#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2awt s ALA 2 N 0.00 3.44 0.36 3.04 0.00 -1.26 -5.05 121.76 122.29 2awt s ALA 2 Ca 0.00 0.31 -0.06 0.00 0.00 0.00 0.00 51.96 52.21 2awt s ALA 2 Cb 0.00 -2.93 0.02 0.00 0.00 0.00 0.00 23.12 20.21 2awt s ALA 2 CO 0.00 0.24 0.57 -0.25 0.00 0.00 0.00 175.76 176.33 2awt n ASP 3 N 1.93 -1.63 -4.86 0.00 8.00 -1.26 -5.17 116.55 113.57 2awt n ASP 3 Ca -0.05 -2.75 -0.31 0.00 0.71 0.00 0.00 54.79 52.38 2awt n ASP 3 Cb 0.49 2.89 0.02 0.00 -0.02 0.00 0.00 41.12 44.50 2awt n ASP 3 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2awt s GLU 4 N -2.55 3.50 -0.40 -1.24 2.02 -1.26 -5.04 118.70 113.72 2awt s GLU 4 Ca 0.24 0.79 0.08 0.00 0.02 0.00 0.00 54.97 56.10 2awt s GLU 4 Cb -0.02 -2.07 0.26 0.00 0.10 0.00 0.00 34.13 32.40 2awt s GLU 4 CO 0.17 -0.65 0.58 1.63 0.02 0.00 0.00 175.26 177.02 2awt n LYS 5 N -2.79 0.74 -2.08 1.61 5.02 -1.26 -5.10 118.16 114.30 2awt n LYS 5 Ca 0.06 -3.03 -0.42 0.00 -2.02 0.00 0.00 58.31 52.90 2awt n LYS 5 Cb 0.54 -1.27 -0.03 0.00 -0.02 0.00 0.00 35.03 34.25 2awt n LYS 5 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2awt s PRO 6 N -1.00 3.32 -0.73 1.97 0.04 -1.26 -4.91 135.00 132.43 2awt s PRO 6 Ca 0.35 1.23 0.03 0.00 0.04 0.00 0.00 61.00 62.65 2awt s PRO 6 Cb 0.19 -4.18 0.34 0.00 0.04 0.00 0.00 34.50 30.89 2awt s PRO 6 CO -0.13 -1.88 1.26 1.17 0.04 0.00 0.00 177.00 177.46 2awt n LYS 7 N 8.43 3.97 -4.44 4.56 4.81 -1.26 -5.03 118.16 129.20 2awt n LYS 7 Ca 0.21 -4.78 -0.27 0.00 -0.87 0.00 0.00 58.31 52.61 2awt n LYS 7 Cb 0.48 -2.32 -0.10 0.00 0.02 0.00 0.00 35.03 33.11 2awt n LYS 7 CO 0.00 0.00 0.00 -1.83 1.17 0.00 0.00 177.40 176.74 2awt s GLU 8 N -3.77 2.06 -0.22 1.64 -1.05 -1.26 -5.11 118.70 110.98 2awt s GLU 8 Ca 0.46 -2.01 -0.23 0.00 -0.15 0.00 0.00 54.97 53.03 2awt s GLU 8 Cb 0.26 -1.76 -0.01 0.00 -0.44 0.00 0.00 34.13 32.17 2awt s GLU 8 CO -0.14 -0.07 0.74 0.20 0.95 0.00 0.00 175.26 176.93 2awt s GLY 9 N -3.78 1.90 0.13 -3.83 0.00 -1.26 -5.03 107.32 95.45 2awt s GLY 9 Ca 0.37 -0.21 -0.12 0.00 0.00 0.00 0.00 44.72 44.77 2awt s GLY 9 CO 0.20 1.58 0.30 -1.34 0.00 0.00 0.00 173.10 173.84 2awt s VAL 10 N 2.42 0.09 0.25 1.40 -7.23 -1.26 -5.18 120.40 110.90 2awt s VAL 10 Ca 0.32 -1.02 0.06 0.00 -1.81 0.00 0.00 61.98 59.54 2awt s VAL 10 Cb -0.16 -1.43 -0.03 0.00 0.56 0.00 0.00 36.38 35.32 2awt s VAL 10 CO 0.09 -0.42 0.26 -0.54 -0.31 0.00 0.00 175.10 174.18 2awt s LYS 11 N -3.87 3.10 0.30 4.82 -0.14 -1.26 -5.13 119.74 117.56 2awt s LYS 11 Ca 0.08 -0.96 -0.08 0.00 -1.36 0.00 0.00 55.97 53.65 2awt s LYS 11 Cb 0.03 -2.68 0.00 0.00 -1.68 0.00 0.00 37.83 33.51 2awt s LYS 11 CO -0.08 0.40 0.50 0.95 -0.76 0.00 0.00 175.35 176.36 2awt s THR 12 N -2.09 0.00 1.03 2.17 -4.23 -1.26 -5.16 115.64 106.10 2awt s THR 12 Ca 0.34 -1.47 -0.15 0.00 -1.18 0.00 0.00 61.69 59.23 2awt s THR 12 Cb -0.08 -2.48 0.09 0.00 1.34 0.00 0.00 72.50 71.37 2awt s THR 12 CO 0.26 0.00 0.39 1.21 -0.54 0.00 0.00 174.62 175.94 2awt n GLU 13 N -0.47 -0.97 -3.34 3.99 4.07 -1.26 -4.93 120.64 117.72 2awt n GLU 13 Ca -0.01 -0.25 -0.45 0.00 -0.06 0.00 0.00 57.16 56.39 2awt n GLU 13 Cb 0.62 -1.88 -0.06 0.00 -0.06 0.00 0.00 31.44 30.06 2awt n GLU 13 CO 0.00 0.00 0.00 -0.80 -0.06 0.00 0.00 177.13 176.27 2awt s ASN 14 N -2.05 6.14 0.00 4.31 0.02 -1.26 -4.95 114.94 117.15 2awt s ASN 14 Ca 0.58 -1.72 0.00 0.00 -1.02 0.00 0.00 52.86 50.70 2awt s ASN 14 Cb -0.18 -2.19 0.00 0.00 0.02 0.00 0.00 41.25 38.90 2awt s ASN 14 CO 0.66 -0.81 0.00 0.59 0.02 0.00 0.00 177.10 177.56 2awt n ASN 15 N 5.21 0.00 -2.32 -1.22 3.02 -1.26 -5.04 115.26 113.64 2awt n ASN 15 Ca -0.13 0.28 -0.07 0.00 -0.03 0.00 0.00 54.58 54.63 2awt n ASN 15 Cb 0.41 -0.29 -0.02 0.00 -0.61 0.00 0.00 39.78 39.27 2awt n ASN 15 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2awt n ASP 16 N -1.41 1.69 -3.19 6.41 2.03 -1.26 -4.94 116.55 115.89 2awt n ASP 16 Ca 0.00 -1.50 0.02 0.00 0.52 0.00 0.00 54.79 53.83 2awt n ASP 16 Cb 0.00 0.15 -0.01 0.00 -0.72 0.00 0.00 41.12 40.55 2awt n ASP 16 CO 0.00 0.00 0.00 -2.28 -1.92 0.00 0.00 177.20 173.00 2awt s HIS 17 N -1.64 -1.78 0.17 -0.67 5.65 -1.26 -4.22 115.29 111.55 2awt s HIS 17 Ca 0.02 0.62 0.02 0.00 0.25 0.00 0.00 55.06 55.97 2awt s HIS 17 Cb 0.00 0.31 0.02 0.00 -1.18 0.00 0.00 32.58 31.73 2awt s HIS 17 CO 0.02 -1.14 0.18 0.44 -0.65 0.00 0.00 174.74 173.59 2awt n ILE 18 N 4.87 0.00 -4.35 0.89 -5.35 0.93 -4.97 119.36 111.38 2awt n ILE 18 Ca 0.08 -0.64 -0.23 0.00 -0.27 0.00 0.00 62.75 61.70 2awt n ILE 18 Cb 0.56 -0.57 -0.13 0.00 -1.74 0.00 0.00 39.64 37.76 2awt n ILE 18 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 2awt s ASN 19 N -2.05 2.21 0.04 7.28 2.47 -1.26 -3.28 114.94 120.35 2awt s ASN 19 Ca 0.14 -0.60 -0.07 0.00 0.42 0.00 0.00 52.86 52.74 2awt s ASN 19 Cb -0.01 -0.13 -0.00 0.00 -1.45 0.00 0.00 41.25 39.66 2awt s ASN 19 CO 0.09 0.05 0.14 -0.76 -3.72 0.00 0.00 177.10 172.90 2awt s LEU 20 N -1.59 1.60 -0.12 3.21 1.43 -0.75 -3.65 118.68 118.81 2awt s LEU 20 Ca 0.04 -0.47 -0.03 0.00 -1.03 0.00 0.00 54.13 52.64 2awt s LEU 20 Cb -0.09 0.77 0.05 0.00 0.03 0.00 0.00 46.19 46.94 2awt s LEU 20 CO 0.03 -0.54 0.07 -0.54 0.23 0.00 0.00 176.35 175.60 2awt s LYS 21 N -2.64 0.13 -1.12 1.70 1.02 -0.94 -1.77 119.74 116.13 2awt s LYS 21 Ca -0.05 0.05 -0.16 0.00 0.02 0.00 0.00 55.97 55.84 2awt s LYS 21 Cb -0.01 -1.36 0.15 0.00 -0.52 0.00 0.00 37.83 36.10 2awt s LYS 21 CO -0.05 -0.52 1.34 0.08 -0.92 0.00 0.00 175.35 175.29 2awt s VAL 22 N 2.10 4.89 -0.99 3.17 1.01 0.80 -1.08 120.40 130.31 2awt s VAL 22 Ca 0.03 -2.25 -0.23 0.00 0.00 0.00 0.00 61.98 59.53 2awt s VAL 22 Cb -0.14 -4.88 0.05 0.00 0.00 0.00 0.00 36.38 31.40 2awt s VAL 22 CO -0.07 -1.60 1.43 0.00 0.00 0.00 0.00 175.10 174.87 2awt s ALA 23 N 2.06 2.71 -0.60 5.51 0.00 -1.23 -1.86 121.76 128.34 2awt s ALA 23 Ca 0.40 -2.15 -0.21 0.00 0.00 0.00 0.00 51.96 49.99 2awt s ALA 23 Cb -0.03 -4.50 0.07 0.00 0.00 0.00 0.00 23.12 18.66 2awt s ALA 23 CO -0.03 -3.59 0.84 0.20 0.00 0.00 0.00 175.76 173.18 2awt s GLY 24 N 4.85 1.54 0.58 0.00 0.00 -0.96 -2.82 107.32 110.52 2awt s GLY 24 Ca 0.45 -1.84 0.29 0.00 0.00 0.00 0.00 44.72 43.61 2awt s GLY 24 CO -0.07 1.85 2.25 0.06 0.00 0.00 0.00 173.10 177.18 2awt h GLN 25 N 9.35 0.00 -0.65 2.90 3.07 -1.86 0.31 115.11 128.23 2awt h GLN 25 Ca -0.28 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.46 2awt h GLN 25 Cb 1.08 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.64 2awt h GLN 25 CO 1.12 0.00 0.00 -0.25 0.09 0.00 0.00 178.83 179.79 2awt n ASP 26 N -3.91 4.03 0.00 0.06 9.92 -1.26 -4.78 116.55 120.61 2awt n ASP 26 Ca -0.03 -2.48 0.00 0.00 -0.53 0.00 0.00 54.79 51.75 2awt n ASP 26 Cb 0.08 -0.56 0.00 0.00 -0.64 0.00 0.00 41.12 40.01 2awt n ASP 26 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2awt n GLY 27 N 0.74 -1.77 3.65 0.44 0.00 0.33 -4.41 105.19 104.17 2awt n GLY 27 Ca 0.20 0.55 -0.02 0.00 0.00 0.00 0.00 46.02 46.74 2awt n GLY 27 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2awt s SER 28 N 2.00 -0.01 0.12 1.61 0.15 0.82 -4.05 113.70 114.35 2awt s SER 28 Ca 0.00 0.00 -0.24 0.00 0.70 0.00 0.00 55.95 56.41 2awt s SER 28 Cb 0.00 0.01 -0.07 0.00 -1.71 0.00 0.00 66.02 64.25 2awt s SER 28 CO 0.00 -0.01 0.73 0.54 1.20 0.00 0.00 173.24 175.70 2awt s VAL 29 N -2.01 4.53 -0.02 4.45 0.11 -1.26 -2.26 120.40 123.93 2awt s VAL 29 Ca 0.12 1.58 0.00 0.00 -2.93 0.00 0.00 61.98 60.75 2awt s VAL 29 Cb -0.01 -4.08 0.03 0.00 -1.53 0.00 0.00 36.38 30.79 2awt s VAL 29 CO -0.02 0.50 0.02 -0.69 -3.33 0.00 0.00 175.10 171.57 2awt s VAL 30 N -0.90 0.04 0.01 2.04 1.01 -0.78 -4.95 120.40 116.86 2awt s VAL 30 Ca 0.35 0.14 -0.12 0.00 0.00 0.00 0.00 61.98 62.36 2awt s VAL 30 Cb -0.22 -0.15 -0.05 0.00 0.00 0.00 0.00 36.38 35.96 2awt s VAL 30 CO 0.24 0.10 0.36 -1.10 0.00 0.00 0.00 175.10 174.70 2awt s GLN 31 N 0.94 3.78 0.17 2.72 -0.21 -1.26 -0.14 119.66 125.66 2awt s GLN 31 Ca -0.08 0.23 -0.12 0.00 0.02 0.00 0.00 55.36 55.41 2awt s GLN 31 Cb -0.12 -3.14 0.00 0.00 1.00 0.00 0.00 33.01 30.75 2awt s GLN 31 CO -0.02 0.66 0.36 -0.06 -2.12 0.00 0.00 175.29 174.11 2awt s PHE 32 N -1.18 0.23 0.07 0.91 0.40 -0.73 -4.99 117.98 112.69 2awt s PHE 32 Ca 0.25 -0.59 0.09 0.00 -0.60 0.00 0.00 56.93 56.08 2awt s PHE 32 Cb -0.15 0.09 -0.03 0.00 0.51 0.00 0.00 43.02 43.44 2awt s PHE 32 CO 0.14 -0.78 -0.23 -1.59 0.70 0.00 0.00 175.22 173.45 2awt s LYS 33 N -3.94 1.43 0.18 0.44 0.00 -1.26 -1.80 119.74 114.79 2awt s LYS 33 Ca 0.14 -1.11 -0.17 0.00 0.00 0.00 0.00 55.97 54.84 2awt s LYS 33 Cb 0.02 -1.66 0.03 0.00 0.00 0.00 0.00 37.83 36.21 2awt s LYS 33 CO -0.01 0.41 0.49 -1.50 0.00 0.00 0.00 175.35 174.74 2awt s ILE 34 N -0.93 0.03 0.77 3.79 2.07 -1.21 -5.01 121.20 120.72 2awt s ILE 34 Ca 0.09 -0.79 -0.04 0.00 -1.41 0.00 0.00 60.65 58.50 2awt s ILE 34 Cb -0.10 -1.53 0.14 0.00 0.13 0.00 0.00 42.46 41.10 2awt s ILE 34 CO 0.03 -0.16 1.06 -0.54 -1.91 0.00 0.00 174.94 173.43 2awt s LYS 35 N -3.87 1.50 0.01 3.50 1.02 -1.26 -0.05 119.74 120.59 2awt s LYS 35 Ca 0.09 -0.91 -0.22 0.00 0.02 0.00 0.00 55.97 54.94 2awt s LYS 35 Cb -0.00 -2.22 -0.12 0.00 -0.52 0.00 0.00 37.83 34.96 2awt s LYS 35 CO -0.04 -1.63 1.06 -0.09 -0.92 0.00 0.00 175.35 173.73 2awt h ARG 36 N -0.76 -0.78 -4.43 1.68 9.65 -1.92 -3.36 114.38 114.46 2awt h ARG 36 Ca -0.39 0.05 -0.75 0.00 -1.10 0.00 0.00 59.98 57.80 2awt h ARG 36 Cb 1.26 0.18 -0.21 0.00 -1.39 0.00 0.00 29.97 29.81 2awt h ARG 36 CO 0.41 -0.52 0.96 -1.58 2.80 0.00 0.00 179.97 182.04 2awt s HIS 37 N -4.34 3.66 -0.04 2.20 2.46 -1.26 -4.12 115.29 113.85 2awt s HIS 37 Ca -0.12 -2.16 -0.02 0.00 0.47 0.00 0.00 55.06 53.23 2awt s HIS 37 Cb 0.01 -4.15 0.02 0.00 -0.13 0.00 0.00 32.58 28.33 2awt s HIS 37 CO 0.35 -1.27 0.10 0.99 -2.47 0.00 0.00 174.74 172.44 2awt s THR 38 N 0.92 -0.03 -0.37 0.89 2.01 -1.26 -5.05 115.64 112.76 2awt s THR 38 Ca 0.36 0.12 -0.28 0.00 0.31 0.00 0.00 61.69 62.20 2awt s THR 38 Cb -0.05 -0.16 -0.01 0.00 0.01 0.00 0.00 72.50 72.28 2awt s THR 38 CO -0.04 0.05 1.71 -2.16 -0.69 0.00 0.00 174.62 173.49 2awt s PRO 39 N 0.70 3.35 0.58 4.92 0.04 -1.26 -4.86 135.00 138.47 2awt s PRO 39 Ca -0.05 1.27 0.30 0.00 0.04 0.00 0.00 61.00 62.55 2awt s PRO 39 Cb -0.07 -4.17 1.44 0.00 0.04 0.00 0.00 34.50 31.73 2awt s PRO 39 CO -0.03 -1.84 1.84 -0.07 0.04 0.00 0.00 177.00 176.94 2awt h LEU 40 N 13.49 0.00 -0.70 -3.56 3.38 -1.83 -0.71 115.31 125.38 2awt h LEU 40 Ca -0.32 0.00 0.15 0.00 0.09 0.00 0.00 57.88 57.80 2awt h LEU 40 Cb 1.15 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.80 2awt h LEU 40 CO 1.06 0.00 0.16 -1.28 0.09 0.00 0.00 178.44 178.47 2awt h SER 41 N 0.00 0.01 -0.97 -0.43 0.87 -1.89 0.26 113.55 111.41 2awt h SER 41 Ca 0.30 0.14 0.26 0.00 -1.23 0.00 0.00 61.79 61.25 2awt h SER 41 Cb 1.49 0.18 -0.06 0.00 -0.44 0.00 0.00 62.40 63.57 2awt h SER 41 CO -0.00 -0.02 0.67 0.07 -0.53 0.00 0.00 176.83 177.01 2awt h LYS 42 N 0.27 0.19 -0.11 2.24 5.09 -1.52 0.24 116.57 122.97 2awt h LYS 42 Ca 0.39 -0.01 -0.22 0.00 0.09 0.00 0.00 60.65 60.90 2awt h LYS 42 Cb 0.64 -0.04 0.01 0.00 0.10 0.00 0.00 32.23 32.93 2awt h LYS 42 CO -0.48 0.13 -0.81 1.25 -2.09 0.00 0.00 179.45 177.44 2awt h LEU 43 N 0.20 0.81 0.62 7.07 5.85 -0.64 -2.97 115.31 126.25 2awt h LEU 43 Ca 0.49 -0.55 -0.03 0.00 0.84 0.00 0.00 57.88 58.63 2awt h LEU 43 Cb 1.60 -0.24 0.01 0.00 0.37 0.00 0.00 40.66 42.39 2awt h LEU 43 CO -0.12 1.34 -0.30 0.24 -0.34 0.00 0.00 178.44 179.27 2awt h MET 44 N 0.44 -0.80 -0.64 1.25 2.86 -0.25 -1.33 114.93 116.47 2awt h MET 44 Ca -0.06 0.05 0.13 0.00 -2.06 0.00 0.00 59.70 57.76 2awt h MET 44 Cb 1.43 0.18 -0.09 0.00 0.06 0.00 0.00 31.60 33.18 2awt h MET 44 CO 0.16 -0.51 0.13 0.87 1.06 0.00 0.00 176.91 178.62 2awt h LYS 45 N -0.91 0.24 -0.90 1.72 1.79 -1.45 -0.28 116.57 116.80 2awt h LYS 45 Ca -0.08 -0.01 0.01 0.00 -2.18 0.00 0.00 60.65 58.38 2awt h LYS 45 Cb 0.66 -0.05 -0.05 0.00 -1.58 0.00 0.00 32.23 31.21 2awt h LYS 45 CO 0.14 0.16 0.59 0.00 -1.08 0.00 0.00 179.45 179.26 2awt h ALA 46 N 1.52 1.14 -0.01 3.86 0.00 -1.41 -2.91 119.26 121.45 2awt h ALA 46 Ca 0.34 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.22 2awt h ALA 46 Cb 0.53 -0.36 -0.06 0.00 0.00 0.00 0.00 17.79 17.91 2awt h ALA 46 CO -0.44 0.52 -0.48 -0.92 0.00 0.00 0.00 179.25 177.93 2awt h TYR 47 N 1.20 -1.39 -0.77 0.00 5.03 0.15 -1.50 116.97 119.70 2awt h TYR 47 Ca 0.33 0.05 0.15 0.00 2.58 0.00 0.00 58.73 61.84 2awt h TYR 47 Cb -0.12 0.61 -0.10 0.00 1.55 0.00 0.00 36.73 38.67 2awt h TYR 47 CO -0.01 -0.54 0.29 0.00 -1.32 0.00 0.00 178.16 176.58 2awt h GLU 49 N 0.41 0.46 0.00 0.00 4.57 -1.09 0.34 114.58 119.26 2awt h GLU 49 Ca 0.43 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.58 2awt h GLU 49 Cb 0.69 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 29.18 2awt h GLU 49 CO -0.44 0.30 -0.34 -0.09 -1.18 0.00 0.00 179.01 177.26 2awt h ARG 50 N 0.47 0.00 -2.23 1.92 1.12 -0.39 -3.43 114.38 111.84 2awt h ARG 50 Ca 0.54 0.00 -0.60 0.00 -1.11 0.00 0.00 59.98 58.82 2awt h ARG 50 Cb 1.26 0.00 -0.42 0.00 -0.01 0.00 0.00 29.97 30.81 2awt h ARG 50 CO -0.26 0.00 -0.66 1.04 -3.11 0.00 0.00 179.97 176.98 2awt n GLN 51 N -4.17 2.23 -1.44 0.20 6.02 0.68 -5.00 117.38 115.91 2awt n GLN 51 Ca -0.05 -4.46 -0.41 0.00 -0.01 0.00 0.00 57.00 52.07 2awt n GLN 51 Cb 0.18 -2.12 -0.02 0.00 1.02 0.00 0.00 30.24 29.30 2awt n GLN 51 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2awt n GLY 52 N 1.01 3.69 0.01 1.08 0.00 0.12 -4.26 105.19 106.84 2awt n GLY 52 Ca 0.28 -1.43 0.04 0.00 0.00 0.00 0.00 46.02 44.90 2awt n GLY 52 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2awt n LEU 53 N 6.30 0.00 -2.76 0.99 -0.00 -1.26 -4.87 117.00 115.39 2awt n LEU 53 Ca 0.53 0.00 -0.04 0.00 -0.00 0.00 0.00 56.01 56.50 2awt n LEU 53 Cb 0.37 0.05 0.01 0.00 -0.00 0.00 0.00 43.42 43.85 2awt n LEU 53 CO 0.94 0.05 0.12 -1.20 -0.00 0.00 0.00 177.39 177.30 2awt n SER 54 N -1.98 -3.46 0.05 1.45 7.64 -1.26 -4.66 113.62 111.40 2awt n SER 54 Ca -0.05 -2.91 -0.01 0.00 1.01 0.00 0.00 58.87 56.92 2awt n SER 54 Cb 0.39 1.75 -0.07 0.00 -1.01 0.00 0.00 64.21 65.28 2awt n SER 54 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2awt h MET 55 N 4.99 0.00 -0.20 1.43 -0.00 -1.89 -3.31 114.93 115.95 2awt h MET 55 Ca 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.76 2awt h MET 55 Cb 1.11 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.71 2awt h MET 55 CO 0.01 0.39 0.00 -2.13 -0.00 0.00 0.00 176.91 175.18 2awt n ARG 56 N -2.99 2.07 -0.64 -0.10 0.63 -1.26 -4.00 116.66 110.37 2awt n ARG 56 Ca -0.08 -1.60 0.03 0.00 -0.92 0.00 0.00 57.85 55.29 2awt n ARG 56 Cb 0.84 -1.45 0.20 0.00 0.45 0.00 0.00 32.46 32.50 2awt n ARG 56 CO 0.00 0.00 0.00 0.94 -2.51 0.00 0.00 177.63 176.06 2awt n GLN 57 N 0.85 1.67 -4.04 -0.14 7.27 -1.24 -5.01 117.38 116.72 2awt n GLN 57 Ca 0.17 -3.24 -0.35 0.00 0.07 0.00 0.00 57.00 53.66 2awt n GLN 57 Cb 0.46 -1.68 -0.09 0.00 2.41 0.00 0.00 30.24 31.34 2awt n GLN 57 CO 0.00 0.00 0.00 0.42 0.07 0.00 0.00 177.06 177.55 2awt s ILE 58 N -3.22 4.78 -0.28 1.69 -1.09 -1.26 -3.85 121.20 117.97 2awt s ILE 58 Ca 0.40 -0.04 -0.00 0.00 -2.23 0.00 0.00 60.65 58.77 2awt s ILE 58 Cb 0.38 -3.13 0.14 0.00 -1.58 0.00 0.00 42.46 38.27 2awt s ILE 58 CO -0.04 0.49 0.33 -0.13 -1.23 0.00 0.00 174.94 174.36 2awt s ARG 59 N 0.09 0.34 -0.03 2.79 3.00 -1.25 -5.03 118.95 118.86 2awt s ARG 59 Ca 0.05 -0.02 -0.30 0.00 0.00 0.00 0.00 55.73 55.47 2awt s ARG 59 Cb -0.12 -0.58 -0.05 0.00 0.00 0.00 0.00 34.95 34.20 2awt s ARG 59 CO 0.01 -0.99 1.43 -0.06 0.00 0.00 0.00 175.30 175.68 2awt s PHE 60 N 2.42 2.71 -0.01 -0.53 0.08 -1.26 -3.75 117.98 117.64 2awt s PHE 60 Ca 0.10 0.74 -0.01 0.00 0.12 0.00 0.00 56.93 57.88 2awt s PHE 60 Cb -0.14 -3.69 -0.00 0.00 -0.57 0.00 0.00 43.02 38.63 2awt s PHE 60 CO -0.30 -2.59 0.02 1.03 -0.10 0.00 0.00 175.22 173.28 2awt s ARG 61 N 2.79 0.06 0.27 0.44 1.81 0.80 -3.54 118.95 121.59 2awt s ARG 61 Ca 0.64 -0.04 0.10 0.00 -1.72 0.00 0.00 55.73 54.72 2awt s ARG 61 Cb -0.31 0.03 -0.05 0.00 -0.45 0.00 0.00 34.95 34.17 2awt s ARG 61 CO 0.26 -0.01 -0.07 0.12 -0.68 0.00 0.00 175.30 174.91 2awt s PHE 62 N -0.16 2.56 -1.26 -0.53 5.36 -1.20 -0.06 117.98 122.70 2awt s PHE 62 Ca -0.02 -0.26 -0.08 0.00 -0.96 0.00 0.00 56.93 55.61 2awt s PHE 62 Cb -0.01 -1.13 -0.08 0.00 -0.34 0.00 0.00 43.02 41.46 2awt s PHE 62 CO -0.00 0.65 2.64 -0.25 -1.46 0.00 0.00 175.22 176.80 2awt n ASP 63 N -0.78 7.02 0.00 6.13 9.92 -1.26 -3.04 116.55 134.53 2awt n ASP 63 Ca -0.06 -2.46 0.00 0.00 -0.53 0.00 0.00 54.79 51.74 2awt n ASP 63 Cb 0.59 -1.35 0.00 0.00 -0.64 0.00 0.00 41.12 39.72 2awt n ASP 63 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2awt n GLY 64 N 3.59 0.04 3.59 0.44 0.00 -1.26 -5.16 105.19 106.43 2awt n GLY 64 Ca 0.63 -0.02 -0.05 0.00 0.00 0.00 0.00 46.02 46.58 2awt n GLY 64 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2awt s GLN 65 N -0.56 0.35 0.86 1.61 -2.07 -1.17 -5.17 119.66 113.51 2awt s GLN 65 Ca 0.00 -0.09 -0.11 0.00 -1.82 0.00 0.00 55.36 53.33 2awt s GLN 65 Cb 0.00 0.16 0.11 0.00 -1.09 0.00 0.00 33.01 32.19 2awt s GLN 65 CO 0.00 -0.15 1.09 -1.25 -1.32 0.00 0.00 175.29 173.67 2awt s PRO 66 N -2.23 1.53 0.02 9.60 0.04 -1.26 -3.20 135.00 139.50 2awt s PRO 66 Ca 0.08 0.91 0.04 0.00 0.04 0.00 0.00 61.00 62.07 2awt s PRO 66 Cb -0.01 -1.83 -0.02 0.00 0.04 0.00 0.00 34.50 32.68 2awt s PRO 66 CO -0.05 -2.08 -0.12 0.42 0.04 0.00 0.00 177.00 175.22 2awt s ILE 67 N -2.93 0.91 0.41 0.56 1.01 -1.23 -4.90 121.20 115.02 2awt s ILE 67 Ca 0.63 -0.75 0.04 0.00 0.00 0.00 0.00 60.65 60.57 2awt s ILE 67 Cb -0.18 -0.81 0.04 0.00 0.01 0.00 0.00 42.46 41.52 2awt s ILE 67 CO 0.57 0.06 0.30 0.59 0.00 0.00 0.00 174.94 176.46 2awt n ASN 68 N 2.28 2.31 0.11 3.58 4.13 -1.26 -4.76 115.26 121.65 2awt n ASN 68 Ca -0.16 -2.40 0.07 0.00 1.68 0.00 0.00 54.58 53.76 2awt n ASN 68 Cb 0.56 -0.03 0.02 0.00 -1.54 0.00 0.00 39.78 38.79 2awt n ASN 68 CO 0.00 0.00 0.00 1.05 0.28 0.00 0.00 177.26 178.59 2awt h GLU 69 N 0.00 0.00 -1.04 3.52 4.11 -2.01 -3.32 114.58 115.84 2awt h GLU 69 Ca -0.26 0.00 -0.55 0.00 0.07 0.00 0.00 59.36 58.63 2awt h GLU 69 Cb 0.94 0.00 -0.28 0.00 0.50 0.00 0.00 28.75 29.91 2awt h GLU 69 CO 0.41 0.17 0.70 -2.37 0.07 0.00 0.00 179.01 177.98 2awt n THR 70 N -2.92 3.25 -4.34 -1.06 5.66 -1.26 -4.67 114.28 108.94 2awt n THR 70 Ca -0.01 -2.22 -0.25 0.00 -3.05 0.00 0.00 64.05 58.52 2awt n THR 70 Cb 0.66 -0.82 -0.09 0.00 -1.55 0.00 0.00 70.33 68.52 2awt n THR 70 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 2awt s ASP 71 N -1.31 4.17 0.06 1.09 1.11 -1.25 -5.16 116.67 115.38 2awt s ASP 71 Ca 0.56 -1.06 -0.03 0.00 0.18 0.00 0.00 52.55 52.19 2awt s ASP 71 Cb 0.45 -0.50 -0.03 0.00 1.07 0.00 0.00 42.92 43.92 2awt s ASP 71 CO 0.05 -0.32 0.03 0.42 1.18 0.00 0.00 175.17 176.54 2awt s THR 72 N -2.56 0.19 -0.66 -1.27 -4.23 -1.26 -4.61 115.64 101.24 2awt s THR 72 Ca 0.36 -1.57 0.20 0.00 -1.18 0.00 0.00 61.69 59.50 2awt s THR 72 Cb 0.02 -1.39 0.20 0.00 1.34 0.00 0.00 72.50 72.67 2awt s THR 72 CO 0.20 -0.87 1.62 -0.81 -0.54 0.00 0.00 174.62 174.22 2awt n PRO 73 N 0.16 0.13 -0.03 3.99 -0.04 -1.26 -2.52 135.00 135.42 2awt n PRO 73 Ca -0.15 0.37 -0.12 0.00 -0.04 0.00 0.00 63.50 63.55 2awt n PRO 73 Cb 0.61 -1.74 -0.08 0.00 -0.04 0.00 0.00 33.50 32.25 2awt n PRO 73 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2awt h ALA 74 N 2.34 0.13 -0.50 0.55 0.00 -1.94 -2.52 119.26 117.31 2awt h ALA 74 Ca 0.00 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.62 2awt h ALA 74 Cb 0.32 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.04 2awt h ALA 74 CO 0.00 -0.13 0.06 0.94 0.00 0.00 0.00 179.25 180.12 2awt n GLN 75 N -4.76 3.81 -0.01 0.00 0.00 -1.18 -4.28 117.38 110.96 2awt n GLN 75 Ca -0.07 -3.05 -0.00 0.00 -0.00 0.00 0.00 57.00 53.88 2awt n GLN 75 Cb 0.25 -2.10 -0.02 0.00 0.00 0.00 0.00 30.24 28.37 2awt n GLN 75 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.06 176.95 2awt n LEU 76 N -0.04 0.00 -3.21 1.69 7.94 -1.05 -4.96 117.00 117.37 2awt n LEU 76 Ca 0.29 0.00 -0.20 0.00 -1.11 0.00 0.00 56.01 55.00 2awt n LEU 76 Cb 1.14 0.03 0.07 0.00 0.53 0.00 0.00 43.42 45.20 2awt n LEU 76 CO 0.29 0.03 0.19 -0.62 -1.11 0.00 0.00 177.39 176.17 2awt n GLU 77 N -1.86 -6.76 -3.18 1.96 1.02 -0.95 -4.95 120.64 105.91 2awt n GLU 77 Ca -0.02 0.74 -0.33 0.00 -0.02 0.00 0.00 57.16 57.53 2awt n GLU 77 Cb 0.35 -5.49 -0.04 0.00 -0.02 0.00 0.00 31.44 26.23 2awt n GLU 77 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2awt n MET 78 N -4.31 3.42 -1.47 3.49 0.00 -1.25 -5.02 117.12 111.98 2awt n MET 78 Ca -0.06 -4.67 0.00 0.00 0.00 0.00 0.00 57.70 52.98 2awt n MET 78 Cb 0.58 -2.35 0.00 0.00 0.00 0.00 0.00 33.22 31.45 2awt n MET 78 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 175.97 176.36 2awt n GLU 79 N 0.79 1.25 -3.25 3.17 1.02 -1.26 -4.65 120.64 117.71 2awt n GLU 79 Ca 0.30 0.00 -0.16 0.00 -0.02 0.00 0.00 57.16 57.28 2awt n GLU 79 Cb 0.37 0.00 0.07 0.00 -0.02 0.00 0.00 31.44 31.86 2awt n GLU 79 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 2awt n ASP 80 N -1.48 -3.31 -2.88 1.62 2.03 -1.26 -3.09 116.55 108.17 2awt n ASP 80 Ca 0.00 -0.48 -0.15 0.00 0.52 0.00 0.00 54.79 54.68 2awt n ASP 80 Cb 0.00 -4.26 0.07 0.00 -0.72 0.00 0.00 41.12 36.21 2awt n ASP 80 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 2awt n GLU 81 N -3.79 -5.42 -2.79 -0.67 2.13 -1.25 -4.96 120.64 103.89 2awt n GLU 81 Ca -0.15 0.65 -0.42 0.00 0.66 0.00 0.00 57.16 57.90 2awt n GLU 81 Cb 0.61 -5.11 -0.03 0.00 0.27 0.00 0.00 31.44 27.17 2awt n GLU 81 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 2awt s ASP 82 N -3.83 7.00 -0.45 4.31 -1.08 -1.18 -4.84 116.67 116.60 2awt s ASP 82 Ca 0.13 1.24 -0.22 0.00 -0.52 0.00 0.00 52.55 53.18 2awt s ASP 82 Cb -0.06 -2.49 0.03 0.00 -1.46 0.00 0.00 42.92 38.94 2awt s ASP 82 CO 0.56 -0.54 0.71 -0.89 0.52 0.00 0.00 175.17 175.53 2awt s THR 83 N 2.73 4.75 -0.40 1.71 2.01 -1.26 -2.22 115.64 122.97 2awt s THR 83 Ca 0.40 0.23 -0.22 0.00 0.31 0.00 0.00 61.69 62.42 2awt s THR 83 Cb -0.16 -4.26 0.01 0.00 0.01 0.00 0.00 72.50 68.10 2awt s THR 83 CO 0.09 -0.66 0.71 -0.63 -0.69 0.00 0.00 174.62 173.44 2awt s ILE 84 N 3.03 4.78 0.27 1.82 -1.09 -0.24 -4.86 121.20 124.90 2awt s ILE 84 Ca 0.26 0.53 -0.31 0.00 -2.23 0.00 0.00 60.65 58.90 2awt s ILE 84 Cb -0.13 -4.19 -0.12 0.00 -1.58 0.00 0.00 42.46 36.44 2awt s ILE 84 CO 0.20 -0.49 1.61 -0.67 -1.23 0.00 0.00 174.94 174.36 2awt n ASP 85 N 6.34 3.78 -3.89 3.58 2.03 0.91 -3.56 116.55 125.74 2awt n ASP 85 Ca 0.01 1.13 -0.14 0.00 0.52 0.00 0.00 54.79 56.30 2awt n ASP 85 Cb 0.48 -1.57 -0.14 0.00 -0.72 0.00 0.00 41.12 39.17 2awt n ASP 85 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2awt s VAL 86 N 0.26 0.15 0.20 5.18 1.01 -1.13 -0.14 120.40 125.93 2awt s VAL 86 Ca 0.67 -0.05 0.05 0.00 0.00 0.00 0.00 61.98 62.65 2awt s VAL 86 Cb -0.52 -0.15 -0.04 0.00 0.00 0.00 0.00 36.38 35.68 2awt s VAL 86 CO 0.45 0.06 0.20 0.12 0.00 0.00 0.00 175.10 175.92 2awt s PHE 87 N 0.11 3.22 0.18 5.22 2.19 -1.25 -3.25 117.98 124.41 2awt s PHE 87 Ca -0.01 -0.03 0.01 0.00 0.33 0.00 0.00 56.93 57.23 2awt s PHE 87 Cb -0.03 -1.50 -0.00 0.00 -1.31 0.00 0.00 43.02 40.18 2awt s PHE 87 CO -0.00 0.51 0.23 1.04 1.83 0.00 0.00 175.22 178.83 2awt n GLN 88 N -0.75 0.33 -0.38 10.12 6.02 -1.25 -3.89 117.38 127.58 2awt n GLN 88 Ca -0.08 -1.58 -0.28 0.00 -0.01 0.00 0.00 57.00 55.04 2awt n GLN 88 Cb 0.56 1.45 0.26 0.00 1.02 0.00 0.00 30.24 33.52 2awt n GLN 88 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2awt n GLN 89 N -0.32 -3.60 -0.01 -1.09 0.00 -1.26 -4.85 117.38 106.26 2awt n GLN 89 Ca 0.01 -1.05 -0.01 0.00 0.00 0.00 0.00 57.00 55.95 2awt n GLN 89 Cb 0.32 -1.90 -0.01 0.00 0.00 0.00 0.00 30.24 28.65 2awt n GLN 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2awt n GLN 90 N -4.65 3.51 -2.49 2.61 10.64 -1.26 -4.78 117.38 120.97 2awt n GLN 90 Ca 0.08 0.00 -0.21 0.00 -1.83 0.00 0.00 57.00 55.04 2awt n GLN 90 Cb 0.55 -1.04 0.01 0.00 -0.86 0.00 0.00 30.24 28.90 2awt n GLN 90 CO 0.00 0.00 0.00 0.25 -1.83 0.00 0.00 177.06 175.48 2awt n THR 91 N -2.09 2.01 0.00 -0.39 -2.24 -1.26 -4.76 114.28 105.56 2awt n THR 91 Ca -0.02 -4.33 0.00 0.00 -2.27 0.00 0.00 64.05 57.43 2awt n THR 91 Cb 0.55 -0.68 0.00 0.00 -2.10 0.00 0.00 70.33 68.09 2awt n THR 91 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2awt n GLY 92 N -0.41 0.06 0.00 3.38 0.00 -1.26 -5.13 105.19 101.83 2awt n GLY 92 Ca 0.31 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.30 2awt n GLY 92 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2awt n GLY 93 N 0.94 1.80 3.08 -0.02 0.00 -1.26 -4.94 105.19 104.79 2awt n GLY 93 Ca 0.00 -1.75 -0.07 0.00 0.00 0.00 0.00 46.02 44.20 2awt n GLY 93 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2awt s VAL 94 N 3.94 -0.67 -0.41 1.61 -7.23 -1.26 -5.07 120.40 111.30 2awt s VAL 94 Ca 0.00 0.02 0.03 0.00 -1.81 0.00 0.00 61.98 60.23 2awt s VAL 94 Cb 0.00 -0.79 0.03 0.00 0.56 0.00 0.00 36.38 36.18 2awt s VAL 94 CO 0.00 -0.04 0.60 0.00 -0.31 0.00 0.00 175.10 175.36