#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pla s GLU 2 N 0.00 3.99 -0.22 0.00 2.02 -1.26 -1.21 118.70 122.02 1pla s GLU 2 Ca 0.00 -0.05 -0.06 0.00 0.02 0.00 0.00 54.97 54.88 1pla s GLU 2 Cb 0.00 -3.66 -0.02 0.00 0.10 0.00 0.00 34.13 30.55 1pla s GLU 2 CO 0.00 -0.26 0.02 0.08 0.02 0.00 0.00 175.26 175.12 1pla s VAL 3 N 2.00 3.97 -0.42 2.63 1.01 -0.47 -4.53 120.40 124.59 1pla s VAL 3 Ca 0.13 -0.30 -0.23 0.00 0.00 0.00 0.00 61.98 61.58 1pla s VAL 3 Cb -0.16 -2.82 0.02 0.00 0.00 0.00 0.00 36.38 33.42 1pla s VAL 3 CO 0.10 0.40 0.78 -0.54 0.00 0.00 0.00 175.10 175.84 1pla s LYS 4 N 1.28 3.51 -0.40 2.72 1.02 0.12 0.29 119.74 128.28 1pla s LYS 4 Ca 0.04 0.01 -0.29 0.00 0.02 0.00 0.00 55.97 55.76 1pla s LYS 4 Cb -0.15 -3.90 0.01 0.00 -0.52 0.00 0.00 37.83 33.27 1pla s LYS 4 CO 0.01 -1.02 1.47 -0.51 -0.92 0.00 0.00 175.35 174.38 1pla s LEU 5 N 3.21 3.57 0.00 3.17 1.43 0.77 -2.61 118.68 128.22 1pla s LEU 5 Ca 0.30 0.90 0.00 0.00 -1.03 0.00 0.00 54.13 54.30 1pla s LEU 5 Cb -0.12 -3.54 0.00 0.00 0.03 0.00 0.00 46.19 42.56 1pla s LEU 5 CO 0.21 -1.47 0.00 0.61 0.23 0.00 0.00 176.35 175.92 1pla n GLY 6 N 5.13 1.30 3.82 -3.19 0.00 -1.05 -2.31 105.19 108.90 1pla n GLY 6 Ca 0.17 -1.30 -0.32 0.00 0.00 0.00 0.00 46.02 44.58 1pla n GLY 6 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1pla s SER 7 N -0.04 5.84 0.46 1.61 1.04 -0.49 -4.33 113.70 117.79 1pla s SER 7 Ca 0.00 1.66 0.26 0.00 0.48 0.00 0.00 55.95 58.34 1pla s SER 7 Cb 0.00 -2.51 0.63 0.00 0.10 0.00 0.00 66.02 64.25 1pla s SER 7 CO 0.00 -1.13 1.71 0.44 0.98 0.00 0.00 173.24 175.25 1pla h ASP 8 N 0.02 0.00 0.00 7.02 3.32 -1.94 -3.40 116.42 121.45 1pla h ASP 8 Ca -0.45 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 56.41 1pla h ASP 8 Cb 1.21 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 40.62 1pla h ASP 8 CO 0.58 0.04 -0.37 -0.90 -1.72 0.00 0.00 179.24 176.87 1pla n ASP 9 N -3.12 -2.47 0.00 6.45 5.75 -1.26 -5.03 116.55 116.87 1pla n ASP 9 Ca 0.03 -2.99 0.00 0.00 -0.01 0.00 0.00 54.79 51.82 1pla n ASP 9 Cb 0.48 1.59 0.00 0.00 -1.03 0.00 0.00 41.12 42.16 1pla n ASP 9 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1pla n GLY 10 N 1.46 -1.92 0.00 6.12 0.00 -1.26 -5.18 105.19 104.42 1pla n GLY 10 Ca 0.07 0.52 0.00 0.00 0.00 0.00 0.00 46.02 46.61 1pla n GLY 10 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pla n GLY 11 N -1.49 1.16 3.37 -0.02 0.00 -1.26 -5.04 105.19 101.91 1pla n GLY 11 Ca 0.00 -0.55 -0.44 0.00 0.00 0.00 0.00 46.02 45.02 1pla n GLY 11 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1pla s LEU 12 N 0.00 5.67 0.08 0.99 1.43 -1.26 -1.40 118.68 124.19 1pla s LEU 12 Ca 0.00 -1.41 -0.14 0.00 -1.03 0.00 0.00 54.13 51.56 1pla s LEU 12 Cb 0.00 -2.17 0.02 0.00 0.03 0.00 0.00 46.19 44.07 1pla s LEU 12 CO 0.00 -0.67 0.32 0.68 0.23 0.00 0.00 176.35 176.91 1pla s VAL 13 N 1.62 0.09 -0.36 -1.59 -7.23 -1.26 -4.10 120.40 107.56 1pla s VAL 13 Ca 0.04 -0.74 -0.29 0.00 -1.81 0.00 0.00 61.98 59.18 1pla s VAL 13 Cb -0.25 -1.12 0.01 0.00 0.56 0.00 0.00 36.38 35.59 1pla s VAL 13 CO 0.06 -0.41 1.20 -0.36 -0.31 0.00 0.00 175.10 175.28 1pla s PHE 14 N -3.30 2.83 -0.30 2.82 0.40 -1.26 -2.52 117.98 116.66 1pla s PHE 14 Ca 0.00 0.91 -0.01 0.00 -0.60 0.00 0.00 56.93 57.23 1pla s PHE 14 Cb 0.02 -4.02 0.05 0.00 0.51 0.00 0.00 43.02 39.57 1pla s PHE 14 CO -0.08 -1.33 -0.01 -1.12 0.70 0.00 0.00 175.22 173.37 1pla s SER 15 N 2.47 4.83 1.11 1.36 0.01 -1.07 -0.22 113.70 122.17 1pla s SER 15 Ca 0.51 -1.31 -0.13 0.00 1.31 0.00 0.00 55.95 56.33 1pla s SER 15 Cb -0.12 -1.69 0.25 0.00 0.21 0.00 0.00 66.02 64.67 1pla s SER 15 CO 0.24 -0.25 1.06 -2.16 0.41 0.00 0.00 173.24 172.53 1pla s PRO 16 N 1.23 -0.44 -0.02 12.44 0.05 -1.26 0.10 135.00 147.10 1pla s PRO 16 Ca -0.06 0.57 -0.02 0.00 0.05 0.00 0.00 61.00 61.55 1pla s PRO 16 Cb -0.20 -1.63 -0.01 0.00 0.05 0.00 0.00 34.50 32.71 1pla s PRO 16 CO -0.02 -3.33 -0.04 -1.13 0.05 0.00 0.00 177.00 172.53 1pla n SER 17 N -4.60 0.26 -4.51 6.66 3.41 0.69 -4.85 113.62 110.68 1pla n SER 17 Ca 0.04 0.15 -0.34 0.00 -0.26 0.00 0.00 58.87 58.47 1pla n SER 17 Cb 0.56 -0.54 -0.12 0.00 -0.26 0.00 0.00 64.21 63.85 1pla n SER 17 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1pla s SER 18 N -4.08 4.65 -0.24 4.04 0.01 -1.26 -2.47 113.70 114.34 1pla s SER 18 Ca -0.03 -0.12 -0.26 0.00 1.31 0.00 0.00 55.95 56.85 1pla s SER 18 Cb 0.00 -1.59 0.08 0.00 0.21 0.00 0.00 66.02 64.73 1pla s SER 18 CO 0.05 0.23 0.80 0.72 0.41 0.00 0.00 173.24 175.44 1pla s PHE 19 N 0.01 -0.69 0.53 2.43 -0.71 -0.98 -5.00 117.98 113.56 1pla s PHE 19 Ca -0.00 1.62 -0.07 0.00 -1.04 0.00 0.00 56.93 57.43 1pla s PHE 19 Cb -0.14 0.31 -0.03 0.00 -1.21 0.00 0.00 43.02 41.95 1pla s PHE 19 CO 0.03 -0.37 0.86 0.95 -1.34 0.00 0.00 175.22 175.35 1pla s THR 20 N 0.11 4.78 0.36 -4.49 -4.23 -1.26 -2.31 115.64 108.60 1pla s THR 20 Ca -0.01 0.37 -0.03 0.00 -1.18 0.00 0.00 61.69 60.84 1pla s THR 20 Cb -0.04 -3.84 0.01 0.00 1.34 0.00 0.00 72.50 69.96 1pla s THR 20 CO 0.00 -0.91 0.52 0.68 -0.54 0.00 0.00 174.62 174.37 1pla s VAL 21 N -2.88 0.00 0.10 2.29 -7.23 -0.53 -4.84 120.40 107.32 1pla s VAL 21 Ca 0.50 -1.54 -0.05 0.00 -1.81 0.00 0.00 61.98 59.08 1pla s VAL 21 Cb -0.10 -2.69 -0.05 0.00 0.56 0.00 0.00 36.38 34.09 1pla s VAL 21 CO 0.47 0.00 0.35 0.00 -0.31 0.00 0.00 175.10 175.61 1pla s ALA 22 N -2.90 3.81 -0.67 1.32 0.00 -1.26 -1.35 121.76 120.71 1pla s ALA 22 Ca 0.29 -0.56 -0.24 0.00 0.00 0.00 0.00 51.96 51.46 1pla s ALA 22 Cb -0.01 -2.11 -0.19 0.00 0.00 0.00 0.00 23.12 20.80 1pla s ALA 22 CO 0.20 0.66 1.87 0.00 0.00 0.00 0.00 175.76 178.49 1pla n ALA 23 N 0.41 2.68 0.00 0.00 0.00 -1.26 -1.95 120.51 120.39 1pla n ALA 23 Ca -0.05 -3.16 0.00 0.00 0.00 0.00 0.00 53.44 50.23 1pla n ALA 23 Cb 0.52 -3.64 0.00 0.00 0.00 0.00 0.00 19.45 16.33 1pla n ALA 23 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pla n GLY 24 N 4.76 -0.05 3.87 0.00 0.00 -1.21 -4.83 105.19 107.73 1pla n GLY 24 Ca 0.49 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.24 1pla n GLY 24 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1pla s GLU 25 N 0.00 3.17 -0.01 1.61 2.12 -0.82 -5.05 118.70 119.72 1pla s GLU 25 Ca 0.00 -0.73 -0.11 0.00 0.36 0.00 0.00 54.97 54.48 1pla s GLU 25 Cb 0.00 -2.81 -0.05 0.00 0.26 0.00 0.00 34.13 31.53 1pla s GLU 25 CO 0.00 0.50 0.33 0.15 -0.54 0.00 0.00 175.26 175.71 1pla s LYS 26 N -3.16 3.75 -0.22 4.30 1.02 -1.26 -4.15 119.74 120.01 1pla s LYS 26 Ca 0.33 0.21 0.02 0.00 0.02 0.00 0.00 55.97 56.55 1pla s LYS 26 Cb -0.11 -3.17 0.04 0.00 -0.52 0.00 0.00 37.83 34.08 1pla s LYS 26 CO 0.26 0.69 -0.15 0.42 -0.92 0.00 0.00 175.35 175.65 1pla s ILE 27 N -1.14 2.15 -0.22 2.17 1.01 0.40 0.11 121.20 125.69 1pla s ILE 27 Ca 0.23 -1.29 -0.04 0.00 0.00 0.00 0.00 60.65 59.55 1pla s ILE 27 Cb -0.15 -2.10 -0.01 0.00 0.01 0.00 0.00 42.46 40.21 1pla s ILE 27 CO 0.12 0.24 -0.04 0.42 0.00 0.00 0.00 174.94 175.69 1pla s THR 28 N 1.20 3.46 -0.42 2.92 -4.23 -0.35 -0.52 115.64 117.69 1pla s THR 28 Ca -0.02 -0.47 -0.25 0.00 -1.18 0.00 0.00 61.69 59.77 1pla s THR 28 Cb -0.17 -2.57 0.02 0.00 1.34 0.00 0.00 72.50 71.12 1pla s THR 28 CO -0.09 0.42 0.89 -0.36 -0.54 0.00 0.00 174.62 174.95 1pla s PHE 29 N 1.38 2.99 -0.12 3.99 0.08 -0.35 -1.37 117.98 124.59 1pla s PHE 29 Ca 0.05 0.48 -0.05 0.00 0.12 0.00 0.00 56.93 57.52 1pla s PHE 29 Cb -0.14 -3.78 -0.04 0.00 -0.57 0.00 0.00 43.02 38.49 1pla s PHE 29 CO -0.02 -0.97 0.08 0.21 -0.10 0.00 0.00 175.22 174.42 1pla s LYS 30 N 3.54 3.34 -0.46 0.44 2.20 0.14 -2.27 119.74 126.68 1pla s LYS 30 Ca 0.36 -0.25 -0.29 0.00 -0.36 0.00 0.00 55.97 55.43 1pla s LYS 30 Cb -0.11 -3.05 0.03 0.00 -1.51 0.00 0.00 37.83 33.18 1pla s LYS 30 CO 0.23 0.69 1.11 -0.80 -0.36 0.00 0.00 175.35 176.22 1pla s ASN 31 N -0.81 6.64 -0.18 1.43 0.01 -0.92 -0.17 114.94 120.95 1pla s ASN 31 Ca 0.13 0.47 0.15 0.00 -0.71 0.00 0.00 52.86 52.90 1pla s ASN 31 Cb -0.12 -2.54 -0.24 0.00 0.41 0.00 0.00 41.25 38.76 1pla s ASN 31 CO 0.03 -1.21 0.13 -3.20 -1.51 0.00 0.00 177.10 171.35 1pla n ASN 32 N 7.71 0.38 0.00 -1.22 5.15 -1.02 -3.26 115.26 122.99 1pla n ASN 32 Ca 0.11 0.05 0.00 0.00 -0.60 0.00 0.00 54.58 54.15 1pla n ASN 32 Cb 0.49 0.66 0.00 0.00 -0.53 0.00 0.00 39.78 40.40 1pla n ASN 32 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1pla n ALA 33 N -2.78 0.00 0.00 5.20 0.00 -0.98 -4.98 120.51 116.98 1pla n ALA 33 Ca -0.32 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.12 1pla n ALA 33 Cb 1.12 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.57 1pla n ALA 33 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pla n GLY 34 N 0.00 1.54 3.60 0.00 0.00 -1.26 -4.18 105.19 104.89 1pla n GLY 34 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 1pla n GLY 34 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1pla s PHE 35 N -2.00 1.51 0.39 1.61 -0.71 -1.26 -4.55 117.98 112.97 1pla s PHE 35 Ca 0.00 1.57 -0.24 0.00 -1.04 0.00 0.00 56.93 57.22 1pla s PHE 35 Cb 0.00 -3.25 -0.09 0.00 -1.21 0.00 0.00 43.02 38.47 1pla s PHE 35 CO 0.00 -3.22 1.01 -1.25 -1.34 0.00 0.00 175.22 170.42 1pla s PRO 36 N -4.57 4.25 0.54 1.99 0.04 -1.26 -5.07 135.00 130.92 1pla s PRO 36 Ca 0.67 1.41 0.05 0.00 0.04 0.00 0.00 61.00 63.17 1pla s PRO 36 Cb -0.24 -2.53 0.05 0.00 0.04 0.00 0.00 34.50 31.82 1pla s PRO 36 CO 0.60 -0.04 0.37 0.72 0.04 0.00 0.00 177.00 178.70 1pla n HIS 37 N -0.04 -0.44 -3.67 0.56 8.25 -0.94 -4.91 115.22 114.04 1pla n HIS 37 Ca 0.05 -2.33 -0.14 0.00 -0.26 0.00 0.00 57.72 55.03 1pla n HIS 37 Cb 0.50 -0.44 -0.08 0.00 1.12 0.00 0.00 29.99 31.10 1pla n HIS 37 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 1pla s ASN 38 N -4.18 -0.56 -0.13 0.41 2.47 -1.26 -3.13 114.94 108.57 1pla s ASN 38 Ca 0.28 0.96 0.01 0.00 0.42 0.00 0.00 52.86 54.53 1pla s ASN 38 Cb -0.02 0.97 0.02 0.00 -1.45 0.00 0.00 41.25 40.77 1pla s ASN 38 CO 0.18 -0.29 -0.14 -0.63 -3.72 0.00 0.00 177.10 172.51 1pla s ILE 39 N -0.10 1.50 -0.04 -5.21 1.01 -1.26 -3.94 121.20 113.16 1pla s ILE 39 Ca -0.03 -0.60 -0.07 0.00 0.00 0.00 0.00 60.65 59.95 1pla s ILE 39 Cb -0.03 -1.40 0.01 0.00 0.01 0.00 0.00 42.46 41.04 1pla s ILE 39 CO 0.03 0.44 0.16 -0.69 0.00 0.00 0.00 174.94 174.88 1pla s VAL 40 N 1.34 0.03 -0.10 2.92 1.01 -1.01 -2.27 120.40 122.33 1pla s VAL 40 Ca 0.01 -0.27 -0.12 0.00 0.00 0.00 0.00 61.98 61.60 1pla s VAL 40 Cb -0.13 -0.32 -0.05 0.00 0.00 0.00 0.00 36.38 35.88 1pla s VAL 40 CO -0.08 -0.15 0.29 -0.36 0.00 0.00 0.00 175.10 174.81 1pla s PHE 41 N -0.48 3.59 -0.34 5.22 0.40 -1.26 -2.22 117.98 122.88 1pla s PHE 41 Ca -0.06 0.70 -0.29 0.00 -0.60 0.00 0.00 56.93 56.69 1pla s PHE 41 Cb -0.04 -2.21 -0.01 0.00 0.51 0.00 0.00 43.02 41.27 1pla s PHE 41 CO 0.01 0.51 1.56 0.34 0.70 0.00 0.00 175.22 178.33 1pla s ASP 42 N -0.44 6.23 0.00 1.36 -1.08 -0.70 -4.84 116.67 117.21 1pla s ASP 42 Ca 0.18 1.14 0.00 0.00 -0.52 0.00 0.00 52.55 53.36 1pla s ASP 42 Cb -0.14 -2.53 0.00 0.00 -1.46 0.00 0.00 42.92 38.79 1pla s ASP 42 CO 0.07 -1.46 0.87 -0.62 0.52 0.00 0.00 175.17 174.55 1pla n GLU 43 N 8.05 0.57 -0.00 4.34 1.02 -1.26 -2.86 120.64 130.50 1pla n GLU 43 Ca 0.19 0.00 0.05 0.00 -0.02 0.00 0.00 57.16 57.37 1pla n GLU 43 Cb 0.47 -1.21 -0.06 0.00 -0.02 0.00 0.00 31.44 30.61 1pla n GLU 43 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1pla n ASP 44 N 1.24 1.79 0.00 1.62 8.00 -1.26 -4.78 116.55 123.16 1pla n ASP 44 Ca 0.00 -0.31 0.00 0.00 0.71 0.00 0.00 54.79 55.19 1pla n ASP 44 Cb 0.29 1.24 0.00 0.00 -0.02 0.00 0.00 41.12 42.63 1pla n ASP 44 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1pla n GLU 45 N -1.56 0.00 -1.62 -1.24 -0.58 -1.14 -5.10 120.64 109.41 1pla n GLU 45 Ca -0.00 0.00 -0.42 0.00 -0.42 0.00 0.00 57.16 56.32 1pla n GLU 45 Cb 0.20 -0.16 0.00 0.00 -0.57 0.00 0.00 31.44 30.91 1pla n GLU 45 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1pla n VAL 46 N 0.00 2.26 -1.49 2.62 0.31 -1.23 -4.83 118.33 115.98 1pla n VAL 46 Ca 0.00 -0.50 -0.39 0.00 -0.01 0.00 0.00 64.34 63.44 1pla n VAL 46 Cb 0.12 -1.18 0.03 0.00 -0.91 0.00 0.00 33.84 31.89 1pla n VAL 46 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1pla n PRO 47 N 0.35 0.65 -1.26 5.55 -0.01 -1.26 -4.76 135.00 134.25 1pla n PRO 47 Ca 0.09 0.25 -0.37 0.00 -0.01 0.00 0.00 63.50 63.46 1pla n PRO 47 Cb 0.37 -1.71 -0.02 0.00 -0.01 0.00 0.00 33.50 32.12 1pla n PRO 47 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 175.50 175.49 1pla n ALA 48 N -1.32 5.58 0.00 3.55 0.00 -1.26 -3.03 120.51 124.03 1pla n ALA 48 Ca 0.11 -3.23 0.00 0.00 0.00 0.00 0.00 53.44 50.33 1pla n ALA 48 Cb 0.44 -3.38 0.00 0.00 0.00 0.00 0.00 19.45 16.51 1pla n ALA 48 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pla n GLY 49 N 3.94 0.04 3.41 0.00 0.00 -1.26 -5.07 105.19 106.24 1pla n GLY 49 Ca 0.58 -0.02 -0.44 0.00 0.00 0.00 0.00 46.02 46.14 1pla n GLY 49 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pla s VAL 50 N -0.95 4.72 1.00 1.61 1.01 -1.17 -5.02 120.40 121.59 1pla s VAL 50 Ca 0.00 -1.06 -0.18 0.00 0.00 0.00 0.00 61.98 60.75 1pla s VAL 50 Cb 0.00 -4.61 -0.08 0.00 0.00 0.00 0.00 36.38 31.69 1pla s VAL 50 CO 0.00 -1.30 -0.50 0.59 0.00 0.00 0.00 175.10 173.89 1pla n ASN 51 N 6.59 -4.16 -0.08 3.32 5.03 -1.26 -4.63 115.26 120.06 1pla n ASN 51 Ca 0.01 0.17 -0.07 0.00 0.87 0.00 0.00 54.58 55.56 1pla n ASN 51 Cb 0.45 -0.87 -0.14 0.00 -1.02 0.00 0.00 39.78 38.21 1pla n ASN 51 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1pla n ALA 52 N -3.13 1.68 0.65 5.41 0.00 -1.26 -4.30 120.51 119.56 1pla n ALA 52 Ca 0.01 -1.08 0.13 0.00 0.00 0.00 0.00 53.44 52.50 1pla n ALA 52 Cb 0.59 -0.17 0.44 0.00 0.00 0.00 0.00 19.45 20.31 1pla n ALA 52 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1pla n GLU 53 N -2.59 0.22 0.11 0.00 2.13 -1.26 -1.90 120.64 117.34 1pla n GLU 53 Ca -0.26 0.21 -0.20 0.00 0.66 0.00 0.00 57.16 57.57 1pla n GLU 53 Cb 1.01 -1.77 -0.15 0.00 0.27 0.00 0.00 31.44 30.80 1pla n GLU 53 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 1pla h LYS 54 N 0.00 0.38 0.00 5.31 6.56 -1.96 -3.33 116.57 123.54 1pla h LYS 54 Ca 0.00 -0.65 0.00 0.00 -1.06 0.00 0.00 60.65 58.94 1pla h LYS 54 Cb 0.67 0.24 0.00 0.00 -0.57 0.00 0.00 32.23 32.57 1pla h LYS 54 CO 0.00 1.29 -0.97 0.44 -2.06 0.00 0.00 179.45 178.15 1pla n ILE 55 N -3.59 0.45 -1.43 1.86 -5.35 -1.22 -4.92 119.36 105.16 1pla n ILE 55 Ca -0.16 -0.43 -0.22 0.00 -0.27 0.00 0.00 62.75 61.66 1pla n ILE 55 Cb 1.07 -0.18 0.17 0.00 -1.74 0.00 0.00 39.64 38.95 1pla n ILE 55 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 1pla n SER 56 N -2.41 -0.57 -2.76 7.28 7.64 -0.80 -4.97 113.62 117.03 1pla n SER 56 Ca 0.01 -1.24 -0.05 0.00 1.01 0.00 0.00 58.87 58.60 1pla n SER 56 Cb 0.51 -0.77 0.02 0.00 -1.01 0.00 0.00 64.21 62.95 1pla n SER 56 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1pla n GLN 57 N -3.45 0.57 0.00 1.43 0.00 -0.96 -4.98 117.38 110.00 1pla n GLN 57 Ca 0.12 -2.00 0.00 0.00 0.00 0.00 0.00 57.00 55.13 1pla n GLN 57 Cb 0.44 -1.47 0.02 0.00 0.00 0.00 0.00 30.24 29.24 1pla n GLN 57 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.06 174.76 1pla n PRO 58 N 2.75 0.03 -2.66 2.61 -0.02 -1.26 -4.35 135.00 132.09 1pla n PRO 58 Ca 0.17 0.00 -0.42 0.00 -2.02 0.00 0.00 63.50 61.23 1pla n PRO 58 Cb 0.57 -1.45 -0.03 0.00 -0.02 0.00 0.00 33.50 32.57 1pla n PRO 58 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1pla s GLU 59 N -2.00 3.18 1.01 -0.52 2.12 -1.26 -4.99 118.70 116.23 1pla s GLU 59 Ca 0.01 -0.42 -0.21 0.00 0.36 0.00 0.00 54.97 54.71 1pla s GLU 59 Cb 0.01 -4.19 -0.14 0.00 0.26 0.00 0.00 34.13 30.07 1pla s GLU 59 CO 0.01 -2.00 -0.96 0.66 -0.54 0.00 0.00 175.26 172.43 1pla n TYR 60 N 8.72 -3.05 -3.69 5.30 4.01 -1.26 -4.96 117.16 122.22 1pla n TYR 60 Ca 0.01 0.29 -0.13 0.00 -0.16 0.00 0.00 57.90 57.91 1pla n TYR 60 Cb 0.48 -1.45 -0.13 0.00 -0.31 0.00 0.00 39.34 37.93 1pla n TYR 60 CO 0.00 0.00 0.00 -0.48 -0.46 0.00 0.00 176.86 175.92 1pla s LEU 61 N 6.56 -0.03 -0.22 7.72 0.05 -1.18 -5.02 118.68 126.55 1pla s LEU 61 Ca 0.41 0.61 0.11 0.00 0.05 0.00 0.00 54.13 55.30 1pla s LEU 61 Cb -0.06 0.79 0.43 0.00 -2.05 0.00 0.00 46.19 45.30 1pla s LEU 61 CO 0.74 -0.21 1.21 -0.46 -0.55 0.00 0.00 176.35 177.08 1pla n ASN 62 N 4.86 2.48 -4.61 1.48 0.23 -1.26 -2.21 115.26 116.22 1pla n ASN 62 Ca -0.15 -3.79 -0.39 0.00 -0.53 0.00 0.00 54.58 49.72 1pla n ASN 62 Cb 0.51 -0.48 -0.09 0.00 -2.08 0.00 0.00 39.78 37.64 1pla n ASN 62 CO 0.00 0.00 0.00 -0.83 -0.93 0.00 0.00 177.26 175.50 1pla s GLY 63 N -3.30 1.92 -0.12 4.83 0.00 -1.26 -4.93 107.32 104.46 1pla s GLY 63 Ca 0.41 -0.87 -0.29 0.00 0.00 0.00 0.00 44.72 43.97 1pla s GLY 63 CO -0.05 0.83 1.60 0.00 0.00 0.00 0.00 173.10 175.49 1pla s ALA 64 N 1.84 3.52 0.00 3.20 0.00 -1.26 -1.96 121.76 127.10 1pla s ALA 64 Ca 0.13 0.75 0.00 0.00 0.00 0.00 0.00 51.96 52.83 1pla s ALA 64 Cb -0.16 -3.76 0.00 0.00 0.00 0.00 0.00 23.12 19.20 1pla s ALA 64 CO 0.10 -1.54 0.00 0.41 0.00 0.00 0.00 175.76 174.73 1pla n GLY 65 N 4.23 3.21 3.63 0.00 0.00 -1.20 -5.02 105.19 110.03 1pla n GLY 65 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 1pla n GLY 65 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1pla n GLU 66 N -2.00 0.45 -4.10 1.61 2.13 -0.83 -4.30 120.64 113.60 1pla n GLU 66 Ca 0.00 0.21 -0.11 0.00 0.66 0.00 0.00 57.16 57.93 1pla n GLU 66 Cb 0.00 -2.26 -0.08 0.00 0.27 0.00 0.00 31.44 29.37 1pla n GLU 66 CO 0.00 0.00 0.00 0.95 -0.41 0.00 0.00 177.13 177.67 1pla s THR 67 N -1.87 0.01 -0.01 6.31 -4.23 -1.26 -2.17 115.64 112.43 1pla s THR 67 Ca 0.73 -1.73 0.02 0.00 -1.18 0.00 0.00 61.69 59.53 1pla s THR 67 Cb -0.33 -2.32 -0.00 0.00 1.34 0.00 0.00 72.50 71.19 1pla s THR 67 CO 0.51 -0.05 -0.07 -0.47 -0.54 0.00 0.00 174.62 174.00 1pla s TYR 68 N -4.09 0.62 0.03 3.99 6.14 -0.96 -4.95 117.35 118.14 1pla s TYR 68 Ca 0.30 -0.12 -0.01 0.00 0.64 0.00 0.00 57.07 57.88 1pla s TYR 68 Cb 0.04 -0.42 -0.04 0.00 0.42 0.00 0.00 41.96 41.96 1pla s TYR 68 CO 0.09 -0.03 0.19 -1.21 0.64 0.00 0.00 175.55 175.24 1pla s GLU 69 N -0.06 3.41 -0.09 4.97 8.01 -1.26 -1.21 118.70 132.46 1pla s GLU 69 Ca 0.01 -0.40 -0.05 0.00 0.01 0.00 0.00 54.97 54.54 1pla s GLU 69 Cb -0.04 -3.05 0.04 0.00 -4.31 0.00 0.00 34.13 26.78 1pla s GLU 69 CO -0.00 0.64 0.22 0.08 0.01 0.00 0.00 175.26 176.20 1pla s VAL 70 N -1.42 -0.04 -0.21 2.63 1.01 0.32 -4.97 120.40 117.72 1pla s VAL 70 Ca 0.31 0.14 0.01 0.00 0.00 0.00 0.00 61.98 62.44 1pla s VAL 70 Cb -0.13 -0.34 0.05 0.00 0.00 0.00 0.00 36.38 35.96 1pla s VAL 70 CO 0.23 0.06 -0.11 -0.89 0.00 0.00 0.00 175.10 174.39 1pla s THR 71 N 1.09 1.77 0.25 3.92 2.01 -1.26 -0.45 115.64 122.97 1pla s THR 71 Ca -0.08 -1.15 0.04 0.00 0.31 0.00 0.00 61.69 60.80 1pla s THR 71 Cb -0.09 -1.85 -0.03 0.00 0.01 0.00 0.00 72.50 70.53 1pla s THR 71 CO -0.07 0.13 0.39 -0.76 -0.69 0.00 0.00 174.62 173.62 1pla s LEU 72 N 1.33 4.26 -0.14 4.42 1.43 -1.26 -5.03 118.68 123.69 1pla s LEU 72 Ca -0.03 0.17 0.14 0.00 -1.03 0.00 0.00 54.13 53.39 1pla s LEU 72 Cb -0.17 -2.97 0.31 0.00 0.03 0.00 0.00 46.19 43.39 1pla s LEU 72 CO -0.08 -0.10 1.20 0.35 0.23 0.00 0.00 176.35 177.95 1pla n THR 73 N -1.34 0.26 -3.61 5.49 -2.24 -1.26 -3.33 114.28 108.25 1pla n THR 73 Ca -0.08 -1.08 -0.29 0.00 -2.27 0.00 0.00 64.05 60.33 1pla n THR 73 Cb 0.56 0.91 -0.15 0.00 -2.10 0.00 0.00 70.33 69.55 1pla n THR 73 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1pla s GLU 74 N -0.74 0.32 -0.43 -0.78 0.41 -1.26 -4.92 118.70 111.30 1pla s GLU 74 Ca 0.16 -0.56 -0.42 0.00 -0.41 0.00 0.00 54.97 53.73 1pla s GLU 74 Cb 0.27 -1.51 -0.17 0.00 -1.78 0.00 0.00 34.13 30.94 1pla s GLU 74 CO -0.08 -0.93 1.93 0.36 -0.49 0.00 0.00 175.26 176.05 1pla n LYS 75 N 5.15 0.43 0.00 1.61 2.85 -1.26 -4.66 118.16 122.28 1pla n LYS 75 Ca -0.06 0.14 0.00 0.00 -1.05 0.00 0.00 58.31 57.34 1pla n LYS 75 Cb 0.43 -1.79 0.00 0.00 -0.65 0.00 0.00 35.03 33.02 1pla n LYS 75 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1pla n GLY 76 N 5.77 -0.84 2.85 2.58 0.00 -0.74 -4.92 105.19 109.89 1pla n GLY 76 Ca 0.41 -0.22 -0.15 0.00 0.00 0.00 0.00 46.02 46.06 1pla n GLY 76 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1pla s THR 77 N -4.00 -0.07 -0.03 2.61 -4.23 -1.26 -1.81 115.64 106.85 1pla s THR 77 Ca 0.00 0.22 0.07 0.00 -1.18 0.00 0.00 61.69 60.80 1pla s THR 77 Cb 0.00 -0.18 -0.02 0.00 1.34 0.00 0.00 72.50 73.64 1pla s THR 77 CO 0.00 0.09 -0.24 -0.31 -0.54 0.00 0.00 174.62 173.62 1pla s TYR 78 N 1.26 2.16 -0.16 3.99 1.51 -1.04 -4.20 117.35 120.86 1pla s TYR 78 Ca -0.08 -0.47 -0.03 0.00 -1.01 0.00 0.00 57.07 55.49 1pla s TYR 78 Cb -0.12 -1.40 -0.02 0.00 -0.11 0.00 0.00 41.96 40.31 1pla s TYR 78 CO -0.05 -0.08 -0.07 0.15 -1.11 0.00 0.00 175.55 174.40 1pla s LYS 79 N -0.45 3.52 0.17 -0.62 1.02 -1.26 -1.93 119.74 120.20 1pla s LYS 79 Ca 0.06 -0.59 0.06 0.00 0.02 0.00 0.00 55.97 55.52 1pla s LYS 79 Cb -0.10 -2.85 -0.05 0.00 -0.52 0.00 0.00 37.83 34.31 1pla s LYS 79 CO 0.00 0.14 -0.12 -0.59 -0.92 0.00 0.00 175.35 173.85 1pla s PHE 80 N 0.60 1.49 0.19 3.18 -0.71 0.52 -1.72 117.98 121.54 1pla s PHE 80 Ca -0.04 -0.66 -0.22 0.00 -1.04 0.00 0.00 56.93 54.97 1pla s PHE 80 Cb -0.15 -0.72 0.08 0.00 -1.21 0.00 0.00 43.02 41.02 1pla s PHE 80 CO 0.03 0.22 1.03 1.52 -1.34 0.00 0.00 175.22 176.67 1pla s TYR 81 N -3.11 0.06 -0.16 3.49 1.13 -0.94 0.27 117.35 118.09 1pla s TYR 81 Ca 0.19 -0.47 -0.06 0.00 -1.41 0.00 0.00 57.07 55.32 1pla s TYR 81 Cb 0.01 0.70 -0.04 0.00 -1.10 0.00 0.00 41.96 41.53 1pla s TYR 81 CO 0.04 -0.94 0.05 0.00 -2.51 0.00 0.00 175.55 172.18 1pla h GLU 83 N 6.40 0.33 -0.28 0.00 5.08 -1.91 -1.88 114.58 122.32 1pla h GLU 83 Ca -0.39 -0.22 -0.06 0.00 -1.00 0.00 0.00 59.36 57.70 1pla h GLU 83 Cb 1.18 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.44 1pla h GLU 83 CO 0.67 0.81 -0.04 -1.00 -1.00 0.00 0.00 179.01 178.45 1pla h PRO 84 N -0.10 0.52 -0.80 2.33 0.14 -1.95 -2.92 132.00 129.22 1pla h PRO 84 Ca 0.00 -0.19 -0.10 0.00 0.14 0.00 0.00 66.00 65.86 1pla h PRO 84 Cb 0.80 -0.04 -0.06 0.00 0.14 0.00 0.00 31.00 31.85 1pla h PRO 84 CO 0.05 0.71 0.13 0.72 0.14 0.00 0.00 178.00 179.74 1pla n HIS 85 N -4.54 1.61 0.38 1.56 8.25 -1.25 -4.25 115.22 116.97 1pla n HIS 85 Ca -0.03 -0.75 0.10 0.00 -0.26 0.00 0.00 57.72 56.78 1pla n HIS 85 Cb 0.29 -0.48 0.45 0.00 1.12 0.00 0.00 29.99 31.37 1pla n HIS 85 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1pla n ALA 86 N 0.13 1.57 0.80 -1.41 0.00 -0.71 -1.63 120.51 119.26 1pla n ALA 86 Ca 0.25 0.07 0.12 0.00 0.00 0.00 0.00 53.44 53.88 1pla n ALA 86 Cb 1.01 -1.34 0.28 0.00 0.00 0.00 0.00 19.45 19.40 1pla n ALA 86 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pla n GLY 87 N -0.20 -1.38 0.02 0.00 0.00 -1.26 -3.55 105.19 98.81 1pla n GLY 87 Ca 0.02 -0.25 0.11 0.00 0.00 0.00 0.00 46.02 45.90 1pla n GLY 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pla n ALA 88 N -1.65 3.69 0.00 4.61 0.00 -0.65 -4.93 120.51 121.57 1pla n ALA 88 Ca 0.05 -0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.07 1pla n ALA 88 Cb 0.38 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 18.84 1pla n ALA 88 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pla n GLY 89 N 1.44 1.06 3.56 0.00 0.00 -1.21 -4.93 105.19 105.10 1pla n GLY 89 Ca 0.04 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.67 1pla n GLY 89 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1pla s MET 90 N -0.82 2.59 0.36 1.61 0.00 -1.17 -4.91 119.30 116.95 1pla s MET 90 Ca 0.00 0.97 0.03 0.00 0.00 0.00 0.00 55.69 56.70 1pla s MET 90 Cb 0.00 -4.42 -0.05 0.00 0.00 0.00 0.00 34.83 30.37 1pla s MET 90 CO 0.00 -2.75 0.09 0.15 0.00 0.00 0.00 175.02 172.51 1pla s LYS 91 N 7.17 1.75 0.00 4.11 1.02 -1.26 -2.72 119.74 129.81 1pla s LYS 91 Ca 0.78 -2.01 -0.23 0.00 0.02 0.00 0.00 55.97 54.53 1pla s LYS 91 Cb -0.16 -0.74 0.05 0.00 -0.52 0.00 0.00 37.83 36.46 1pla s LYS 91 CO 0.24 -0.31 0.51 0.20 -0.92 0.00 0.00 175.35 175.07 1pla s GLY 92 N -3.53 -0.39 -0.12 -3.33 0.00 0.77 -3.98 107.32 96.73 1pla s GLY 92 Ca 0.31 0.73 -0.22 0.00 0.00 0.00 0.00 44.72 45.54 1pla s GLY 92 CO 0.15 0.44 0.55 -0.54 0.00 0.00 0.00 173.10 173.70 1pla s GLU 93 N -1.78 0.78 -0.05 2.90 2.02 -1.03 -0.35 118.70 121.18 1pla s GLU 93 Ca -0.09 0.44 -0.01 0.00 0.02 0.00 0.00 54.97 55.33 1pla s GLU 93 Cb -0.02 0.37 0.03 0.00 0.10 0.00 0.00 34.13 34.61 1pla s GLU 93 CO 0.03 -0.17 0.00 0.54 0.02 0.00 0.00 175.26 175.68 1pla s VAL 94 N -0.47 0.29 -0.59 2.63 0.11 -0.81 -2.33 120.40 119.23 1pla s VAL 94 Ca -0.06 0.11 -0.15 0.00 -2.93 0.00 0.00 61.98 58.95 1pla s VAL 94 Cb -0.03 -0.42 0.15 0.00 -1.53 0.00 0.00 36.38 34.54 1pla s VAL 94 CO 0.04 0.21 0.54 -0.89 -3.33 0.00 0.00 175.10 171.67 1pla s THR 95 N 1.55 5.19 0.47 5.04 2.01 -0.98 -2.50 115.64 126.42 1pla s THR 95 Ca -0.02 -1.73 -0.19 0.00 0.31 0.00 0.00 61.69 60.06 1pla s THR 95 Cb -0.13 -4.31 -0.09 0.00 0.01 0.00 0.00 72.50 67.98 1pla s THR 95 CO -0.03 -0.89 0.97 -0.69 -0.69 0.00 0.00 174.62 173.29 1pla s VAL 96 N 1.28 4.39 0.00 3.82 1.01 -0.75 -1.45 120.40 128.70 1pla s VAL 96 Ca 0.06 1.34 0.00 0.00 0.00 0.00 0.00 61.98 63.39 1pla s VAL 96 Cb -0.26 -3.63 0.00 0.00 0.00 0.00 0.00 36.38 32.49 1pla s VAL 96 CO 0.00 -0.47 0.47 0.59 0.00 0.00 0.00 175.10 175.69