#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 3.57 -0.18 0.00 2.02 -1.26 -0.53 118.70 122.32 1pla s GLU 2 Ca 0.00 -0.40 0.01 0.00 0.02 0.00 0.00 54.97 54.59 1pla s GLU 2 Cb 0.00 -3.00 0.03 0.00 0.10 0.00 0.00 34.13 31.26 1pla s GLU 2 CO 0.00 0.42 -0.13 0.08 0.02 0.00 0.00 175.26 175.64 1pla s VAL 3 N -0.07 1.71 -0.36 2.63 1.01 -0.69 -4.41 120.40 120.22 1pla s VAL 3 Ca 0.04 -0.87 -0.20 0.00 0.00 0.00 0.00 61.98 60.95 1pla s VAL 3 Cb -0.13 -1.67 0.00 0.00 0.00 0.00 0.00 36.38 34.59 1pla s VAL 3 CO 0.02 0.34 0.59 -0.54 0.00 0.00 0.00 175.10 175.51 1pla s LYS 4 N 1.40 3.62 -0.35 2.72 1.02 0.21 0.20 119.74 128.57 1pla s LYS 4 Ca 0.02 -0.06 -0.29 0.00 0.02 0.00 0.00 55.97 55.66 1pla s LYS 4 Cb -0.14 -3.82 0.01 0.00 -0.52 0.00 0.00 37.83 33.35 1pla s LYS 4 CO -0.10 -0.73 1.30 -0.51 -0.92 0.00 0.00 175.35 174.39 1pla s LEU 5 N 2.60 3.78 0.00 3.17 1.43 0.79 -2.56 118.68 127.88 1pla s LEU 5 Ca 0.22 1.01 0.00 0.00 -1.03 0.00 0.00 54.13 54.34 1pla s LEU 5 Cb -0.15 -3.54 0.00 0.00 0.03 0.00 0.00 46.19 42.53 1pla s LEU 5 CO 0.15 -1.18 0.00 0.61 0.23 0.00 0.00 176.35 176.16 1pla n GLY 6 N 4.54 1.80 3.62 -3.19 0.00 -1.06 -2.14 105.19 108.76 1pla n GLY 6 Ca 0.15 -1.29 -0.28 0.00 0.00 0.00 0.00 46.02 44.59 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 0.00 2.12 -0.57 1.61 1.04 0.76 -4.53 113.70 114.13 1pla s SER 7 Ca 0.00 1.25 -0.02 0.00 0.48 0.00 0.00 55.95 57.66 1pla s SER 7 Cb 0.00 -1.95 0.30 0.00 0.10 0.00 0.00 66.02 64.47 1pla s SER 7 CO 0.00 -3.46 2.16 0.47 0.98 0.00 0.00 173.24 173.39 1pla n ASP 8 N -4.40 7.13 0.07 7.02 8.00 -1.26 -4.38 116.55 128.73 1pla n ASP 8 Ca 0.04 -3.50 0.00 0.00 0.71 0.00 0.00 54.79 52.04 1pla n ASP 8 Cb 0.57 -1.06 0.00 0.00 -0.02 0.00 0.00 41.12 40.60 1pla n ASP 8 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1pla n ASP 9 N -0.19 -1.22 0.00 -2.24 5.75 -1.26 -5.07 116.55 112.32 1pla n ASP 9 Ca 0.50 0.27 0.00 0.00 -0.01 0.00 0.00 54.79 55.55 1pla n ASP 9 Cb 0.54 1.45 0.00 0.00 -1.03 0.00 0.00 41.12 42.07 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 -1.21 -1.83 3.57 6.12 0.00 -1.26 -5.17 105.19 105.41 1pla n GLY 10 Ca 0.00 0.78 -0.15 0.00 0.00 0.00 0.00 46.02 46.65 1pla n GLY 10 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1pla s GLY 11 N 0.00 -0.49 -0.46 -0.02 0.00 -1.26 -5.00 107.32 100.10 1pla s GLY 11 Ca 0.00 1.74 -0.09 0.00 0.00 0.00 0.00 44.72 46.37 1pla s GLY 11 CO 0.00 1.27 0.32 1.08 0.00 0.00 0.00 173.10 175.77 1pla s LEU 12 N -0.61 5.55 0.07 0.66 1.43 -1.26 -0.17 118.68 124.35 1pla s LEU 12 Ca -0.05 -1.83 -0.14 0.00 -1.03 0.00 0.00 54.13 51.08 1pla s LEU 12 Cb -0.02 -2.00 0.02 0.00 0.03 0.00 0.00 46.19 44.23 1pla s LEU 12 CO 0.05 -0.65 0.33 0.68 0.23 0.00 0.00 176.35 176.99 1pla s VAL 13 N 1.36 0.08 -0.38 -1.59 -7.23 -1.26 -4.45 120.40 106.94 1pla s VAL 13 Ca 0.05 -0.70 -0.29 0.00 -1.81 0.00 0.00 61.98 59.24 1pla s VAL 13 Cb -0.25 -1.07 0.02 0.00 0.56 0.00 0.00 36.38 35.64 1pla s VAL 13 CO -0.00 -0.38 1.21 -0.36 -0.31 0.00 0.00 175.10 175.25 1pla s PHE 14 N -3.09 2.81 -0.30 2.82 0.40 -1.26 -2.57 117.98 116.78 1pla s PHE 14 Ca -0.01 0.88 -0.01 0.00 -0.60 0.00 0.00 56.93 57.18 1pla s PHE 14 Cb 0.01 -4.08 0.06 0.00 0.51 0.00 0.00 43.02 39.52 1pla s PHE 14 CO -0.07 -1.37 0.00 -1.12 0.70 0.00 0.00 175.22 173.37 1pla s SER 15 N 2.56 4.87 1.13 1.36 0.01 -1.06 -0.36 113.70 122.21 1pla s SER 15 Ca 0.52 -1.35 -0.15 0.00 1.31 0.00 0.00 55.95 56.27 1pla s SER 15 Cb -0.12 -1.70 0.26 0.00 0.21 0.00 0.00 66.02 64.66 1pla s SER 15 CO 0.25 -0.27 1.07 -2.16 0.41 0.00 0.00 173.24 172.53 1pla s PRO 16 N 1.22 -0.66 -0.09 12.44 0.05 -1.26 0.67 135.00 147.38 1pla s PRO 16 Ca -0.04 0.39 -0.07 0.00 0.05 0.00 0.00 61.00 61.32 1pla s PRO 16 Cb -0.20 -1.62 -0.02 0.00 0.05 0.00 0.00 34.50 32.70 1pla s PRO 16 CO -0.02 -3.43 -0.14 0.45 0.05 0.00 0.00 177.00 173.91 1pla n SER 17 N -4.65 1.06 -4.45 6.66 2.88 0.51 -4.88 113.62 110.76 1pla n SER 17 Ca 0.07 0.35 -0.33 0.00 -1.33 0.00 0.00 58.87 57.63 1pla n SER 17 Cb 0.57 -0.68 -0.13 0.00 -0.75 0.00 0.00 64.21 63.22 1pla n SER 17 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1pla s SER 18 N -4.90 4.18 -0.27 -3.46 0.15 -1.26 -2.51 113.70 105.63 1pla s SER 18 Ca -0.12 -0.21 -0.23 0.00 0.70 0.00 0.00 55.95 56.09 1pla s SER 18 Cb 0.02 -1.28 0.08 0.00 -1.71 0.00 0.00 66.02 63.13 1pla s SER 18 CO 0.17 0.26 0.75 0.72 1.20 0.00 0.00 173.24 176.35 1pla s PHE 19 N -0.22 -0.81 0.37 3.44 -0.71 -0.93 -5.00 117.98 114.11 1pla s PHE 19 Ca 0.01 1.88 -0.08 0.00 -1.04 0.00 0.00 56.93 57.70 1pla s PHE 19 Cb -0.13 0.35 -0.06 0.00 -1.21 0.00 0.00 43.02 41.97 1pla s PHE 19 CO 0.03 -0.39 0.70 0.95 -1.34 0.00 0.00 175.22 175.17 1pla s THR 20 N 0.62 4.87 0.20 -4.49 -4.23 -1.26 -2.27 115.64 109.09 1pla s THR 20 Ca -0.02 0.41 -0.07 0.00 -1.18 0.00 0.00 61.69 60.83 1pla s THR 20 Cb -0.05 -3.74 -0.02 0.00 1.34 0.00 0.00 72.50 70.03 1pla s THR 20 CO -0.04 -0.47 0.29 0.68 -0.54 0.00 0.00 174.62 174.54 1pla s VAL 21 N -2.29 0.02 0.14 2.29 -7.23 -0.33 -4.86 120.40 108.15 1pla s VAL 21 Ca 0.49 -1.64 -0.11 0.00 -1.81 0.00 0.00 61.98 58.90 1pla s VAL 21 Cb -0.10 -2.22 -0.06 0.00 0.56 0.00 0.00 36.38 34.55 1pla s VAL 21 CO 0.31 -0.09 0.48 0.00 -0.31 0.00 0.00 175.10 175.49 1pla s ALA 22 N -4.06 3.65 -0.77 1.32 0.00 -1.26 -1.33 121.76 119.30 1pla s ALA 22 Ca 0.27 -0.29 -0.27 0.00 0.00 0.00 0.00 51.96 51.67 1pla s ALA 22 Cb 0.03 -2.37 -0.25 0.00 0.00 0.00 0.00 23.12 20.53 1pla s ALA 22 CO 0.08 0.53 1.93 0.00 0.00 0.00 0.00 175.76 178.29 1pla n ALA 23 N 0.56 0.83 0.00 0.00 0.00 -0.94 -1.36 120.51 119.60 1pla n ALA 23 Ca -0.05 -2.55 0.00 0.00 0.00 0.00 0.00 53.44 50.84 1pla n ALA 23 Cb 0.52 -3.50 0.00 0.00 0.00 0.00 0.00 19.45 16.47 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 5.64 -0.15 3.71 0.00 0.00 -1.26 -4.96 105.19 108.18 1pla n GLY 24 Ca 0.44 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 46.11 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 3.82 0.30 1.61 2.56 -0.46 -5.08 118.70 121.46 1pla s GLU 25 Ca 0.00 -0.28 -0.28 0.00 0.00 0.00 0.00 54.97 54.41 1pla s GLU 25 Cb 0.00 -3.22 -0.09 0.00 2.00 0.00 0.00 34.13 32.82 1pla s GLU 25 CO 0.00 0.42 1.05 0.15 -0.56 0.00 0.00 175.26 176.33 1pla s LYS 26 N -0.04 4.57 -0.21 4.30 1.02 -1.26 -4.62 119.74 123.50 1pla s LYS 26 Ca 0.08 1.66 0.01 0.00 0.02 0.00 0.00 55.97 57.74 1pla s LYS 26 Cb -0.12 -3.04 0.05 0.00 -0.52 0.00 0.00 37.83 34.20 1pla s LYS 26 CO 0.01 0.19 -0.07 0.42 -0.92 0.00 0.00 175.35 174.98 1pla s ILE 27 N -1.30 1.51 -0.23 2.17 1.01 -0.85 0.96 121.20 124.48 1pla s ILE 27 Ca 0.47 -1.08 -0.06 0.00 0.00 0.00 0.00 60.65 59.99 1pla s ILE 27 Cb -0.28 -1.70 -0.02 0.00 0.01 0.00 0.00 42.46 40.46 1pla s ILE 27 CO 0.36 0.01 0.02 0.42 0.00 0.00 0.00 174.94 175.75 1pla s THR 28 N 1.43 3.93 -0.22 2.92 -4.23 0.31 -1.64 115.64 118.13 1pla s THR 28 Ca -0.04 -0.31 -0.23 0.00 -1.18 0.00 0.00 61.69 59.94 1pla s THR 28 Cb -0.18 -2.81 -0.01 0.00 1.34 0.00 0.00 72.50 70.84 1pla s THR 28 CO -0.07 0.39 0.76 -0.36 -0.54 0.00 0.00 174.62 174.80 1pla s PHE 29 N 1.39 3.33 -0.02 3.99 0.08 -0.82 -1.70 117.98 124.24 1pla s PHE 29 Ca 0.05 1.07 0.04 0.00 0.12 0.00 0.00 56.93 58.20 1pla s PHE 29 Cb -0.15 -2.97 -0.03 0.00 -0.57 0.00 0.00 43.02 39.31 1pla s PHE 29 CO 0.01 -0.32 -0.11 0.21 -0.10 0.00 0.00 175.22 174.91 1pla s LYS 30 N 2.51 2.49 -0.29 0.44 2.36 0.13 -1.13 119.74 126.25 1pla s LYS 30 Ca 0.33 -0.73 -0.17 0.00 -2.55 0.00 0.00 55.97 52.85 1pla s LYS 30 Cb -0.16 -2.42 -0.02 0.00 -1.05 0.00 0.00 37.83 34.18 1pla s LYS 30 CO 0.09 0.61 0.46 1.21 1.55 0.00 0.00 175.35 179.27 1pla s ASN 31 N -1.12 6.33 -0.19 1.43 3.84 -0.97 -0.15 114.94 124.11 1pla s ASN 31 Ca 0.14 0.26 0.16 0.00 0.21 0.00 0.00 52.86 53.63 1pla s ASN 31 Cb -0.11 -2.25 -0.24 0.00 -0.55 0.00 0.00 41.25 38.10 1pla s ASN 31 CO 0.04 -0.31 0.11 -3.20 -2.79 0.00 0.00 177.10 170.96 1pla n ASN 32 N 5.52 0.24 0.00 -4.21 5.15 -0.91 -3.56 115.26 117.49 1pla n ASN 32 Ca -0.06 0.04 0.00 0.00 -0.60 0.00 0.00 54.58 53.96 1pla n ASN 32 Cb 0.50 0.78 0.00 0.00 -0.53 0.00 0.00 39.78 40.53 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 -2.77 0.00 0.00 5.20 0.00 -1.08 -4.95 120.51 116.92 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 1.14 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.59 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 -0.75 0.91 3.36 0.00 0.00 -1.26 -4.10 105.19 103.35 1pla n GLY 34 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1pla n GLY 34 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1pla n PHE 35 N -0.85 -1.48 -2.69 1.61 1.16 -1.26 -4.62 117.46 109.34 1pla n PHE 35 Ca 0.00 0.19 -0.38 0.00 -1.87 0.00 0.00 57.45 55.39 1pla n PHE 35 Cb 0.00 -1.69 -0.06 0.00 -1.61 0.00 0.00 39.48 36.12 1pla n PHE 35 CO 0.00 0.00 0.00 -1.25 -1.87 0.00 0.00 176.76 173.64 1pla s PRO 36 N -3.55 4.53 0.56 3.97 0.04 -1.26 -5.07 135.00 134.22 1pla s PRO 36 Ca 0.56 1.44 0.06 0.00 0.04 0.00 0.00 61.00 63.11 1pla s PRO 36 Cb -0.17 -2.85 0.05 0.00 0.04 0.00 0.00 34.50 31.57 1pla s PRO 36 CO 0.67 0.21 0.51 -1.01 0.04 0.00 0.00 177.00 177.42 1pla s HIS 37 N -1.52 1.53 -0.14 0.56 3.76 -0.84 -4.90 115.29 113.73 1pla s HIS 37 Ca 0.50 -0.82 -0.25 0.00 -0.15 0.00 0.00 55.06 54.33 1pla s HIS 37 Cb -0.22 -1.98 0.06 0.00 1.11 0.00 0.00 32.58 31.55 1pla s HIS 37 CO 0.28 -0.67 0.63 1.21 -0.85 0.00 0.00 174.74 175.33 1pla s ASN 38 N -4.39 -0.62 -0.13 1.40 3.04 -1.26 -3.23 114.94 109.75 1pla s ASN 38 Ca 0.41 0.95 -0.01 0.00 0.04 0.00 0.00 52.86 54.25 1pla s ASN 38 Cb -0.03 0.91 0.04 0.00 -1.54 0.00 0.00 41.25 40.63 1pla s ASN 38 CO 0.26 -0.40 -0.03 -0.63 -3.04 0.00 0.00 177.10 173.25 1pla s ILE 39 N -0.44 0.78 0.00 -5.21 1.09 -1.26 -3.85 121.20 112.32 1pla s ILE 39 Ca -0.06 -0.31 0.02 0.00 -1.10 0.00 0.00 60.65 59.20 1pla s ILE 39 Cb -0.03 -0.97 -0.01 0.00 -1.06 0.00 0.00 42.46 40.40 1pla s ILE 39 CO 0.05 0.18 -0.06 -0.69 -0.10 0.00 0.00 174.94 174.32 1pla s VAL 40 N 1.79 0.43 -0.09 2.92 1.01 -0.97 0.40 120.40 125.89 1pla s VAL 40 Ca 0.03 -0.37 -0.15 0.00 0.00 0.00 0.00 61.98 61.48 1pla s VAL 40 Cb -0.14 -0.39 -0.05 0.00 0.00 0.00 0.00 36.38 35.80 1pla s VAL 40 CO -0.07 0.03 0.39 -0.36 0.00 0.00 0.00 175.10 175.09 1pla s PHE 41 N -0.35 3.58 -0.64 5.22 0.08 -1.26 -2.23 117.98 122.39 1pla s PHE 41 Ca -0.00 0.84 -0.27 0.00 0.12 0.00 0.00 56.93 57.62 1pla s PHE 41 Cb -0.03 -2.38 0.01 0.00 -0.57 0.00 0.00 43.02 40.04 1pla s PHE 41 CO -0.00 0.38 1.53 0.16 -0.10 0.00 0.00 175.22 177.19 1pla s ASP 42 N -0.10 5.83 0.00 1.36 -4.77 -0.62 -4.80 116.67 113.58 1pla s ASP 42 Ca 0.22 0.05 0.00 0.00 -3.30 0.00 0.00 52.55 49.52 1pla s ASP 42 Cb -0.15 -2.54 0.00 0.00 -1.09 0.00 0.00 42.92 39.13 1pla s ASP 42 CO 0.09 -1.99 0.14 -1.84 0.70 0.00 0.00 175.17 172.27 1pla n GLU 43 N 9.11 0.00 -0.02 2.11 0.00 -1.26 -2.32 120.64 128.27 1pla n GLU 43 Ca 0.12 0.00 -0.00 0.00 0.00 0.00 0.00 57.16 57.28 1pla n GLU 43 Cb 0.50 -1.18 -0.00 0.00 0.00 0.00 0.00 31.44 30.76 1pla n GLU 43 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.13 176.69 1pla h ASP 44 N 0.00 0.00 -0.79 -1.84 5.19 -1.96 -3.39 116.42 113.63 1pla h ASP 44 Ca 0.00 0.00 -0.34 0.00 -0.62 0.00 0.00 57.03 56.07 1pla h ASP 44 Cb 0.00 0.00 -0.20 0.00 0.18 0.00 0.00 39.33 39.31 1pla h ASP 44 CO 0.00 0.15 0.43 -0.62 -3.12 0.00 0.00 179.24 176.09 1pla n GLU 45 N -2.79 2.75 -4.03 3.56 1.02 -0.98 -4.91 120.64 115.27 1pla n GLU 45 Ca -0.01 -2.72 -0.34 0.00 -0.02 0.00 0.00 57.16 54.07 1pla n GLU 45 Cb 0.02 -2.09 -0.06 0.00 -0.02 0.00 0.00 31.44 29.29 1pla n GLU 45 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1pla s VAL 46 N -2.85 5.05 0.29 2.62 1.01 -1.17 -4.51 120.40 120.83 1pla s VAL 46 Ca 0.50 -0.19 -0.27 0.00 0.00 0.00 0.00 61.98 62.02 1pla s VAL 46 Cb 0.41 -3.28 -0.15 0.00 0.00 0.00 0.00 36.38 33.36 1pla s VAL 46 CO 0.11 0.42 0.80 -2.65 0.00 0.00 0.00 175.10 173.78 1pla n PRO 47 N 1.37 0.85 -0.41 2.72 -0.02 -1.26 -4.76 135.00 133.50 1pla n PRO 47 Ca -0.14 0.30 0.00 0.00 -2.02 0.00 0.00 63.50 61.64 1pla n PRO 47 Cb 0.53 -1.55 0.00 0.00 -0.02 0.00 0.00 33.50 32.46 1pla n PRO 47 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1pla n ALA 48 N -0.02 3.60 0.00 3.55 0.00 -1.26 -3.03 120.51 123.35 1pla n ALA 48 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.56 1pla n ALA 48 Cb 0.31 -1.11 0.00 0.00 0.00 0.00 0.00 19.45 18.65 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 1.49 0.03 3.48 0.00 0.00 -1.26 -4.97 105.19 103.96 1pla n GLY 49 Ca 0.00 -0.02 -0.44 0.00 0.00 0.00 0.00 46.02 45.56 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 -1.10 4.73 0.24 1.61 1.01 -1.17 -4.99 120.40 120.73 1pla s VAL 50 Ca 0.00 -2.01 -0.28 0.00 0.00 0.00 0.00 61.98 59.69 1pla s VAL 50 Cb 0.00 -4.91 -0.16 0.00 0.00 0.00 0.00 36.38 31.32 1pla s VAL 50 CO 0.00 -1.65 0.73 0.59 0.00 0.00 0.00 175.10 174.77 1pla n ASN 51 N 6.55 -0.17 -0.31 3.32 3.02 -1.26 -4.75 115.26 121.67 1pla n ASN 51 Ca 0.33 1.15 0.14 0.00 -0.03 0.00 0.00 54.58 56.17 1pla n ASN 51 Cb 0.46 -1.09 0.65 0.00 -0.61 0.00 0.00 39.78 39.19 1pla n ASN 51 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1pla n ALA 52 N 0.11 2.61 0.93 5.41 0.00 -1.26 -3.44 120.51 124.87 1pla n ALA 52 Ca 0.14 -0.36 0.12 0.00 0.00 0.00 0.00 53.44 53.35 1pla n ALA 52 Cb 0.28 -1.28 0.32 0.00 0.00 0.00 0.00 19.45 18.77 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 -0.24 0.04 -0.10 0.00 2.13 -1.26 -2.51 120.64 118.70 1pla n GLU 53 Ca 0.20 0.02 -0.15 0.00 0.66 0.00 0.00 57.16 57.89 1pla n GLU 53 Cb 0.26 -1.53 -0.14 0.00 0.27 0.00 0.00 31.44 30.30 1pla n GLU 53 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1pla n LYS 54 N -1.60 0.67 0.02 5.31 5.02 -1.22 -4.39 118.16 121.97 1pla n LYS 54 Ca 0.06 0.12 0.11 0.00 -2.02 0.00 0.00 58.31 56.57 1pla n LYS 54 Cb 0.35 -1.56 0.08 0.00 -0.02 0.00 0.00 35.03 33.88 1pla n LYS 54 CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32 1pla n ILE 55 N -3.08 0.15 -1.63 -0.18 -5.35 -1.26 -4.93 119.36 103.09 1pla n ILE 55 Ca -0.37 -0.18 -0.29 0.00 -0.27 0.00 0.00 62.75 61.64 1pla n ILE 55 Cb 1.06 0.23 0.13 0.00 -1.74 0.00 0.00 39.64 39.32 1pla n ILE 55 CO 0.00 0.00 0.00 -0.44 -1.76 0.00 0.00 176.55 174.35 1pla s SER 56 N -3.72 3.72 -0.41 7.28 0.01 -1.05 -4.88 113.70 114.66 1pla s SER 56 Ca 0.06 0.89 0.08 0.00 1.31 0.00 0.00 55.95 58.29 1pla s SER 56 Cb 0.15 -1.43 0.25 0.00 0.21 0.00 0.00 66.02 65.20 1pla s SER 56 CO 0.77 -2.41 0.54 0.00 0.41 0.00 0.00 173.24 172.55 1pla n GLN 57 N -3.67 0.86 0.00 12.44 6.02 0.16 -4.93 117.38 128.27 1pla n GLN 57 Ca 0.07 -3.34 0.00 0.00 -0.01 0.00 0.00 57.00 53.72 1pla n GLN 57 Cb 0.60 -1.30 0.01 0.00 1.02 0.00 0.00 30.24 30.56 1pla n GLN 57 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 1pla n PRO 58 N 1.34 0.00 -2.80 -1.09 -0.02 -1.26 -4.13 135.00 127.05 1pla n PRO 58 Ca 0.22 0.49 -0.43 0.00 -2.02 0.00 0.00 63.50 61.76 1pla n PRO 58 Cb 0.52 -1.52 -0.04 0.00 -0.02 0.00 0.00 33.50 32.45 1pla n PRO 58 CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 1pla s GLU 59 N -2.99 3.25 1.03 -0.52 -1.05 -1.26 -5.01 118.70 112.16 1pla s GLU 59 Ca -0.00 -0.41 -0.23 0.00 -0.15 0.00 0.00 54.97 54.17 1pla s GLU 59 Cb 0.00 -4.12 -0.09 0.00 -0.44 0.00 0.00 34.13 29.48 1pla s GLU 59 CO 0.00 -1.68 -0.92 0.66 0.95 0.00 0.00 175.26 174.27 1pla n TYR 60 N 7.81 -1.79 -3.72 4.83 4.01 -1.26 -4.96 117.16 122.08 1pla n TYR 60 Ca 0.00 0.42 -0.14 0.00 -0.16 0.00 0.00 57.90 58.02 1pla n TYR 60 Cb 0.47 -1.46 -0.09 0.00 -0.31 0.00 0.00 39.34 37.95 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 4.83 0.47 0.00 7.72 0.05 -1.20 -5.03 118.68 125.52 1pla s LEU 61 Ca 0.43 0.45 0.00 0.00 0.05 0.00 0.00 54.13 55.06 1pla s LEU 61 Cb -0.01 1.51 0.00 0.00 -2.05 0.00 0.00 46.19 45.64 1pla s LEU 61 CO 0.68 -0.36 0.00 -0.46 -0.55 0.00 0.00 176.35 175.66 1pla n ASN 62 N 1.79 0.00 -4.65 1.48 0.23 -1.26 -1.99 115.26 110.86 1pla n ASN 62 Ca -0.18 -0.29 -0.54 0.00 -0.53 0.00 0.00 54.58 53.03 1pla n ASN 62 Cb 0.56 0.00 -0.06 0.00 -2.08 0.00 0.00 39.78 38.20 1pla n ASN 62 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1pla n GLY 63 N 0.00 0.66 3.61 4.83 0.00 -1.26 -4.82 105.19 108.21 1pla n GLY 63 Ca 0.00 0.81 -0.43 0.00 0.00 0.00 0.00 46.02 46.40 1pla n GLY 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pla s ALA 64 N 1.91 3.08 0.00 4.61 0.00 -1.26 -2.17 121.76 127.93 1pla s ALA 64 Ca 0.91 0.17 0.00 0.00 0.00 0.00 0.00 51.96 53.04 1pla s ALA 64 Cb -1.00 -3.92 0.00 0.00 0.00 0.00 0.00 23.12 18.19 1pla s ALA 64 CO 0.55 -2.29 0.00 0.41 0.00 0.00 0.00 175.76 174.43 1pla n GLY 65 N 5.01 1.47 3.61 0.00 0.00 -1.23 -5.04 105.19 109.01 1pla n GLY 65 Ca 0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 1pla n GLY 65 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1pla n GLU 66 N -2.00 -0.33 -4.14 1.61 4.71 -0.92 -4.42 120.64 115.15 1pla n GLU 66 Ca 0.00 -0.03 -0.13 0.00 -0.01 0.00 0.00 57.16 56.99 1pla n GLU 66 Cb 0.00 -2.25 -0.07 0.00 -1.01 0.00 0.00 31.44 28.11 1pla n GLU 66 CO 0.00 0.00 0.00 0.95 0.09 0.00 0.00 177.13 178.17 1pla s THR 67 N -2.50 0.00 0.37 2.62 -4.23 -1.26 -2.30 115.64 108.34 1pla s THR 67 Ca 0.65 -1.77 0.05 0.00 -1.18 0.00 0.00 61.69 59.45 1pla s THR 67 Cb -0.24 -2.45 -0.03 0.00 1.34 0.00 0.00 72.50 71.13 1pla s THR 67 CO 0.59 0.00 0.21 -0.47 -0.54 0.00 0.00 174.62 174.41 1pla s TYR 68 N -3.84 1.75 0.02 3.99 5.04 -0.28 -4.95 117.35 119.08 1pla s TYR 68 Ca 0.33 -1.49 -0.09 0.00 -2.44 0.00 0.00 57.07 53.39 1pla s TYR 68 Cb 0.03 -0.92 0.00 0.00 0.35 0.00 0.00 41.96 41.43 1pla s TYR 68 CO 0.15 -0.60 0.18 -1.21 -1.34 0.00 0.00 175.55 172.72 1pla s GLU 69 N -3.59 0.59 -0.27 4.97 2.02 -1.26 -1.94 118.70 119.23 1pla s GLU 69 Ca 0.32 -0.48 -0.25 0.00 0.02 0.00 0.00 54.97 54.58 1pla s GLU 69 Cb 0.02 0.25 0.09 0.00 0.10 0.00 0.00 34.13 34.59 1pla s GLU 69 CO 0.21 -0.16 0.81 0.54 0.02 0.00 0.00 175.26 176.69 1pla s VAL 70 N -1.88 0.00 -0.34 2.63 0.11 -0.65 -5.00 120.40 115.26 1pla s VAL 70 Ca -0.11 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 58.95 1pla s VAL 70 Cb -0.05 -1.00 0.11 0.00 -1.53 0.00 0.00 36.38 33.91 1pla s VAL 70 CO -0.00 0.00 0.12 -0.89 -3.33 0.00 0.00 175.10 171.00 1pla s THR 71 N 0.27 1.18 0.61 5.04 2.01 -1.26 -2.00 115.64 121.49 1pla s THR 71 Ca 0.01 -1.77 -0.12 0.00 0.31 0.00 0.00 61.69 60.12 1pla s THR 71 Cb -0.05 -1.87 -0.04 0.00 0.01 0.00 0.00 72.50 70.54 1pla s THR 71 CO -0.01 -0.71 1.03 -0.76 -0.69 0.00 0.00 174.62 173.48 1pla s LEU 72 N 1.26 3.28 -0.37 4.42 1.43 -1.26 -4.99 118.68 122.44 1pla s LEU 72 Ca 0.12 1.45 0.13 0.00 -1.03 0.00 0.00 54.13 54.79 1pla s LEU 72 Cb -0.19 -4.48 0.41 0.00 0.03 0.00 0.00 46.19 41.96 1pla s LEU 72 CO -0.17 -0.86 1.13 0.35 0.23 0.00 0.00 176.35 177.02 1pla n THR 73 N -2.62 0.40 -3.48 5.49 -2.24 -1.26 -4.08 114.28 106.48 1pla n THR 73 Ca 0.06 -2.35 -0.24 0.00 -2.27 0.00 0.00 64.05 59.25 1pla n THR 73 Cb 0.54 0.82 -0.13 0.00 -2.10 0.00 0.00 70.33 69.46 1pla n THR 73 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1pla s GLU 74 N -1.34 0.25 -0.77 -0.78 2.12 -1.26 -5.03 118.70 111.88 1pla s GLU 74 Ca 0.25 -0.39 -0.34 0.00 0.36 0.00 0.00 54.97 54.85 1pla s GLU 74 Cb 0.41 -0.95 -0.19 0.00 0.26 0.00 0.00 34.13 33.66 1pla s GLU 74 CO -0.03 -1.03 2.49 1.63 -0.54 0.00 0.00 175.26 177.78 1pla n LYS 75 N 5.25 0.18 0.00 4.30 5.02 -1.26 -4.55 118.16 127.10 1pla n LYS 75 Ca -0.04 0.02 0.00 0.00 -2.02 0.00 0.00 58.31 56.27 1pla n LYS 75 Cb 0.44 -1.75 0.00 0.00 -0.02 0.00 0.00 35.03 33.70 1pla n LYS 75 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1pla n GLY 76 N 6.72 -0.97 3.01 0.72 0.00 -0.69 -4.93 105.19 109.04 1pla n GLY 76 Ca 0.59 -0.04 -0.13 0.00 0.00 0.00 0.00 46.02 46.44 1pla n GLY 76 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1pla s THR 77 N -4.00 -0.03 -0.19 2.61 2.01 -1.26 -1.72 115.64 113.06 1pla s THR 77 Ca 0.00 0.11 0.01 0.00 0.31 0.00 0.00 61.69 62.12 1pla s THR 77 Cb 0.00 -0.29 0.03 0.00 0.01 0.00 0.00 72.50 72.25 1pla s THR 77 CO 0.00 0.04 -0.15 -0.31 -0.69 0.00 0.00 174.62 173.52 1pla s TYR 78 N 0.84 2.63 -0.34 4.92 1.51 -1.06 -4.45 117.35 121.40 1pla s TYR 78 Ca -0.06 -1.65 -0.16 0.00 -1.01 0.00 0.00 57.07 54.19 1pla s TYR 78 Cb -0.08 -1.77 -0.01 0.00 -0.11 0.00 0.00 41.96 39.99 1pla s TYR 78 CO -0.05 -0.77 0.41 0.15 -1.11 0.00 0.00 175.55 174.18 1pla s LYS 79 N 1.33 3.63 0.41 -0.62 3.01 -1.26 -2.47 119.74 123.77 1pla s LYS 79 Ca 0.01 -0.28 0.07 0.00 -1.01 0.00 0.00 55.97 54.76 1pla s LYS 79 Cb -0.15 -3.79 -0.08 0.00 -1.01 0.00 0.00 37.83 32.80 1pla s LYS 79 CO -0.10 -0.54 0.02 -0.59 0.51 0.00 0.00 175.35 174.66 1pla s PHE 80 N 2.14 2.52 0.14 3.18 -0.71 0.12 -1.58 117.98 123.79 1pla s PHE 80 Ca 0.14 -0.67 -0.23 0.00 -1.04 0.00 0.00 56.93 55.13 1pla s PHE 80 Cb -0.16 -1.79 0.08 0.00 -1.21 0.00 0.00 43.02 39.94 1pla s PHE 80 CO 0.12 0.43 1.10 1.52 -1.34 0.00 0.00 175.22 177.05 1pla s TYR 81 N -2.70 0.07 -0.20 3.49 1.13 -0.95 0.21 117.35 118.41 1pla s TYR 81 Ca 0.35 -0.41 -0.08 0.00 -1.41 0.00 0.00 57.07 55.52 1pla s TYR 81 Cb 0.09 0.67 -0.04 0.00 -1.10 0.00 0.00 41.96 41.58 1pla s TYR 81 CO 0.18 -0.78 0.09 0.00 -2.51 0.00 0.00 175.55 172.53 1pla h GLU 83 N 6.96 0.36 0.08 0.00 5.08 -1.90 -2.35 114.58 122.80 1pla h GLU 83 Ca -0.38 -0.29 -0.00 0.00 -1.00 0.00 0.00 59.36 57.69 1pla h GLU 83 Cb 1.17 0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.48 1pla h GLU 83 CO 0.69 0.93 -0.04 -1.35 -1.00 0.00 0.00 179.01 178.24 1pla h PRO 84 N -0.13 -0.10 -0.45 2.33 0.11 -1.94 -2.77 132.00 129.06 1pla h PRO 84 Ca -0.02 0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.09 1pla h PRO 84 Cb 0.99 0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.13 1pla h PRO 84 CO 0.07 0.20 0.00 0.72 -0.21 0.00 0.00 178.00 178.78 1pla n HIS 85 N -5.00 0.25 0.00 0.65 8.25 -1.26 -4.06 115.22 114.06 1pla n HIS 85 Ca -0.08 -0.10 0.00 0.00 -0.26 0.00 0.00 57.72 57.27 1pla n HIS 85 Cb 0.19 -0.07 0.00 0.00 1.12 0.00 0.00 29.99 31.23 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 -0.03 1.12 0.11 -1.41 0.00 -0.88 -0.64 120.51 118.77 1pla n ALA 86 Ca 0.05 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.48 1pla n ALA 86 Cb 0.23 -0.91 -0.03 0.00 0.00 0.00 0.00 19.45 18.74 1pla n ALA 86 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1pla h GLY 87 N 0.00 0.00 1.00 0.00 0.00 -1.83 -3.22 103.07 99.02 1pla h GLY 87 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1pla h GLY 87 CO 0.00 0.00 -0.68 0.00 0.00 0.00 0.00 176.54 175.86 1pla n ALA 88 N -2.28 3.17 0.00 3.60 0.00 0.18 -4.92 120.51 120.26 1pla n ALA 88 Ca 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.14 1pla n ALA 88 Cb 0.81 -1.12 0.00 0.00 0.00 0.00 0.00 19.45 19.14 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 1.38 0.89 3.40 0.00 0.00 -1.21 -5.01 105.19 104.65 1pla n GLY 89 Ca 0.04 0.00 -0.53 0.00 0.00 0.00 0.00 46.02 45.53 1pla n GLY 89 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1pla n MET 90 N -1.86 0.80 -4.31 1.61 0.00 -1.24 -4.90 117.12 107.23 1pla n MET 90 Ca 0.00 0.21 -0.17 0.00 0.00 0.00 0.00 57.70 57.75 1pla n MET 90 Cb 0.00 -2.23 -0.10 0.00 0.00 0.00 0.00 33.22 30.89 1pla n MET 90 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 175.97 174.38 1pla s LYS 91 N 6.24 1.43 -0.03 2.12 -2.85 -1.26 -2.58 119.74 122.81 1pla s LYS 91 Ca 1.12 -1.78 -0.18 0.00 -1.00 0.00 0.00 55.97 54.13 1pla s LYS 91 Cb -1.01 -0.21 0.03 0.00 -2.06 0.00 0.00 37.83 34.59 1pla s LYS 91 CO 0.53 -0.33 0.39 0.20 0.10 0.00 0.00 175.35 176.23 1pla s GLY 92 N -3.32 -0.24 -0.17 0.59 0.00 0.57 -4.20 107.32 100.55 1pla s GLY 92 Ca 0.37 0.56 -0.16 0.00 0.00 0.00 0.00 44.72 45.50 1pla s GLY 92 CO 0.14 0.33 0.46 1.85 0.00 0.00 0.00 173.10 175.89 1pla s GLU 93 N -1.20 0.53 -0.08 2.90 2.12 -1.04 0.12 118.70 122.04 1pla s GLU 93 Ca -0.12 0.66 -0.01 0.00 0.36 0.00 0.00 54.97 55.86 1pla s GLU 93 Cb -0.04 0.25 0.03 0.00 0.26 0.00 0.00 34.13 34.62 1pla s GLU 93 CO 0.05 -0.07 -0.04 0.54 -0.54 0.00 0.00 175.26 175.20 1pla s VAL 94 N 0.33 0.68 -0.54 3.70 0.11 -1.03 -2.20 120.40 121.44 1pla s VAL 94 Ca -0.01 -0.09 -0.17 0.00 -2.93 0.00 0.00 61.98 58.79 1pla s VAL 94 Cb -0.04 -0.76 0.12 0.00 -1.53 0.00 0.00 36.38 34.17 1pla s VAL 94 CO -0.00 0.30 0.54 -0.89 -3.33 0.00 0.00 175.10 171.72 1pla s THR 95 N 1.70 5.11 0.40 5.04 2.01 -0.96 -2.57 115.64 126.37 1pla s THR 95 Ca 0.02 -1.31 -0.17 0.00 0.31 0.00 0.00 61.69 60.55 1pla s THR 95 Cb -0.13 -4.35 -0.09 0.00 0.01 0.00 0.00 72.50 67.94 1pla s THR 95 CO -0.05 -0.89 0.86 -0.69 -0.69 0.00 0.00 174.62 173.15 1pla s VAL 96 N 1.88 4.55 0.00 3.82 1.01 -0.70 -1.18 120.40 129.78 1pla s VAL 96 Ca 0.05 1.17 0.00 0.00 0.00 0.00 0.00 61.98 63.21 1pla s VAL 96 Cb -0.28 -3.63 0.00 0.00 0.00 0.00 0.00 36.38 32.47 1pla s VAL 96 CO 0.04 -0.34 0.15 0.59 0.00 0.00 0.00 175.10 175.55