#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bcn s ALA 2 N 0.00 -2.58 -0.45 4.31 0.00 -1.26 -5.12 121.76 116.66 1bcn s ALA 2 Ca 0.00 1.99 -0.18 0.00 0.00 0.00 0.00 51.96 53.77 1bcn s ALA 2 Cb 0.00 -1.93 0.04 0.00 0.00 0.00 0.00 23.12 21.23 1bcn s ALA 2 CO 0.00 -0.30 0.50 -1.21 0.00 0.00 0.00 175.76 174.75 1bcn s GLU 3 N 1.00 3.10 0.00 0.00 2.02 -1.26 -5.06 118.70 118.50 1bcn s GLU 3 Ca -0.07 -0.84 0.00 0.00 0.02 0.00 0.00 54.97 54.08 1bcn s GLU 3 Cb -0.03 -4.02 0.00 0.00 0.10 0.00 0.00 34.13 30.18 1bcn s GLU 3 CO -0.11 -0.99 0.00 0.00 0.02 0.00 0.00 175.26 174.18 1bcn n ALA 4 N 5.77 0.00 -1.64 5.21 0.00 -1.26 -5.02 120.51 123.57 1bcn n ALA 4 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1bcn n ALA 4 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.91 1bcn n ALA 4 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1bcn n HIS 5 N -2.78 -2.93 -2.82 0.00 -0.00 -1.26 -4.96 115.22 100.47 1bcn n HIS 5 Ca 0.00 0.00 -0.43 0.00 0.46 0.00 0.00 57.72 57.75 1bcn n HIS 5 Cb 0.00 0.00 -0.03 0.00 -0.12 0.00 0.00 29.99 29.84 1bcn n HIS 5 CO 0.00 0.00 0.00 0.15 0.46 0.00 0.00 176.34 176.95 1bcn s LYS 6 N -1.92 3.29 0.21 1.57 -0.14 -1.26 -4.36 119.74 117.13 1bcn s LYS 6 Ca 0.00 -1.05 0.00 0.00 -1.36 0.00 0.00 55.97 53.56 1bcn s LYS 6 Cb 0.00 -4.51 0.00 0.00 -1.68 0.00 0.00 37.83 31.64 1bcn s LYS 6 CO 0.00 -1.87 0.00 0.00 -0.76 0.00 0.00 175.35 172.72 1bcn h ASP 8 N 0.00 0.00 0.00 0.00 3.32 -1.96 -0.96 116.42 116.81 1bcn h ASP 8 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1bcn h ASP 8 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1bcn h ASP 8 CO 0.00 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.52 1bcn n ILE 9 N -2.90 0.00 -0.08 0.35 3.06 -1.26 -3.95 119.36 114.58 1bcn n ILE 9 Ca -0.03 0.34 -0.13 0.00 -2.50 0.00 0.00 62.75 60.43 1bcn n ILE 9 Cb 0.12 -1.18 -0.05 0.00 0.54 0.00 0.00 39.64 39.07 1bcn n ILE 9 CO 0.00 0.00 0.00 0.74 -2.50 0.00 0.00 176.55 174.79 1bcn h THR 10 N 0.00 1.32 -0.15 9.51 2.02 -1.92 -2.18 112.91 121.51 1bcn h THR 10 Ca 0.00 -1.45 -0.03 0.00 0.77 0.00 0.00 66.41 65.70 1bcn h THR 10 Cb 0.00 1.72 -0.00 0.00 -1.74 0.00 0.00 68.15 68.12 1bcn h THR 10 CO 0.00 0.45 -0.03 -0.07 0.37 0.00 0.00 175.52 176.24 1bcn h LEU 11 N 0.29 0.28 -0.97 2.58 -0.00 -1.48 -1.82 115.31 114.20 1bcn h LEU 11 Ca 0.03 -0.35 -0.06 0.00 -0.00 0.00 0.00 57.88 57.50 1bcn h LEU 11 Cb 0.84 -0.08 -0.03 0.00 -0.00 0.00 0.00 40.66 41.39 1bcn h LEU 11 CO 0.07 0.57 0.12 0.06 -0.00 0.00 0.00 178.44 179.26 1bcn h GLN 12 N -0.01 0.87 -0.18 1.13 3.07 -1.49 -1.88 115.11 116.62 1bcn h GLN 12 Ca 0.04 -0.19 -0.06 0.00 0.09 0.00 0.00 58.65 58.53 1bcn h GLN 12 Cb 0.44 -0.13 -0.01 0.00 0.08 0.00 0.00 27.48 27.86 1bcn h GLN 12 CO 0.01 0.79 -0.17 1.49 0.09 0.00 0.00 178.83 181.05 1bcn h GLU 13 N 0.84 0.30 -0.12 0.06 4.81 -1.30 -2.05 114.58 117.11 1bcn h GLU 13 Ca 0.18 -0.08 -0.13 0.00 -0.13 0.00 0.00 59.36 59.20 1bcn h GLU 13 Cb 0.33 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.66 1bcn h GLU 13 CO 0.00 0.47 -0.50 0.82 -0.73 0.00 0.00 179.01 179.07 1bcn h ILE 14 N 0.28 1.34 -0.37 2.32 2.04 -0.56 -2.65 117.51 119.91 1bcn h ILE 14 Ca 0.05 -1.73 -0.14 0.00 1.00 0.00 0.00 64.86 64.05 1bcn h ILE 14 Cb 0.46 1.79 -0.01 0.00 -0.74 0.00 0.00 36.82 38.33 1bcn h ILE 14 CO 0.03 0.52 -0.30 0.40 0.00 0.00 0.00 178.15 178.80 1bcn h ILE 15 N 0.26 1.28 -0.24 -0.67 2.04 -0.76 -2.18 117.51 117.24 1bcn h ILE 15 Ca 0.01 -1.46 -0.01 0.00 1.00 0.00 0.00 64.86 64.40 1bcn h ILE 15 Cb 0.97 1.40 -0.01 0.00 -0.74 0.00 0.00 36.82 38.43 1bcn h ILE 15 CO 0.08 0.49 0.11 0.11 0.00 0.00 0.00 178.15 178.94 1bcn h LYS 16 N 0.65 0.36 -0.77 2.37 1.57 -1.34 -2.13 116.57 117.28 1bcn h LYS 16 Ca 0.07 -0.06 0.05 0.00 -1.87 0.00 0.00 60.65 58.84 1bcn h LYS 16 Cb 0.88 -0.06 -0.05 0.00 0.08 0.00 0.00 32.23 33.08 1bcn h LYS 16 CO 0.08 0.38 0.51 1.15 -0.57 0.00 0.00 179.45 180.99 1bcn h THR 17 N 0.26 1.06 -0.99 -0.16 2.02 -1.43 -0.45 112.91 113.21 1bcn h THR 17 Ca 0.08 -0.30 0.03 0.00 0.77 0.00 0.00 66.41 67.00 1bcn h THR 17 Cb 0.14 0.12 -0.06 0.00 -1.74 0.00 0.00 68.15 66.62 1bcn h THR 17 CO -0.01 0.16 0.65 0.25 0.37 0.00 0.00 175.52 176.94 1bcn h LEU 18 N 0.86 1.10 -1.08 2.58 7.12 -0.74 -0.76 115.31 124.39 1bcn h LEU 18 Ca 0.32 -0.01 -0.09 0.00 0.13 0.00 0.00 57.88 58.23 1bcn h LEU 18 Cb 0.18 -0.26 -0.01 0.00 -0.53 0.00 0.00 40.66 40.04 1bcn h LEU 18 CO -0.11 0.76 -0.42 -1.13 -0.13 0.00 0.00 178.44 177.41 1bcn h ASN 19 N 1.28 0.00 -0.36 1.25 -0.73 -0.70 -3.05 115.58 113.27 1bcn h ASN 19 Ca 0.39 0.00 -0.03 0.00 1.87 0.00 0.00 56.30 58.53 1bcn h ASN 19 Cb -0.03 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 38.55 1bcn h ASN 19 CO -0.11 0.42 0.10 -1.28 -0.37 0.00 0.00 177.43 176.18 1bcn h SER 20 N 0.00 0.53 0.48 1.15 0.87 -0.54 -1.94 113.55 114.10 1bcn h SER 20 Ca -0.00 -0.22 0.00 0.00 -1.23 0.00 0.00 61.79 60.33 1bcn h SER 20 Cb 0.82 -0.14 0.00 0.00 -0.44 0.00 0.00 62.40 62.64 1bcn h SER 20 CO 0.05 0.62 0.00 0.18 -0.53 0.00 0.00 176.83 177.15 1bcn n LEU 21 N -4.62 0.48 -0.97 2.23 4.77 -1.03 -2.03 117.00 115.84 1bcn n LEU 21 Ca -0.01 0.65 0.05 0.00 -0.03 0.00 0.00 56.01 56.66 1bcn n LEU 21 Cb 0.19 -0.61 0.19 0.00 -2.33 0.00 0.00 43.42 40.86 1bcn n LEU 21 CO 0.38 -0.59 0.61 0.41 -1.33 0.00 0.00 177.39 176.87 1bcn n THR 22 N -2.06 0.98 -0.07 -5.08 -1.04 -0.73 -4.20 114.28 102.07 1bcn n THR 22 Ca 0.01 -0.63 -0.13 0.00 -2.04 0.00 0.00 64.05 61.27 1bcn n THR 22 Cb 0.16 -0.05 -0.09 0.00 -1.82 0.00 0.00 70.33 68.52 1bcn n THR 22 CO 0.00 0.00 0.00 -0.08 -0.64 0.00 0.00 175.07 174.35 1bcn h GLU 23 N 2.20 0.00 -1.99 -2.82 4.22 -1.48 -3.35 114.58 111.36 1bcn h GLU 23 Ca 0.00 0.00 -0.76 0.00 0.08 0.00 0.00 59.36 58.68 1bcn h GLU 23 Cb 0.89 0.00 -0.28 0.00 0.50 0.00 0.00 28.75 29.86 1bcn h GLU 23 CO 0.13 0.75 0.96 1.04 -2.18 0.00 0.00 179.01 179.71 1bcn n GLN 24 N -4.60 2.95 -2.55 1.92 6.02 -1.26 -4.82 117.38 115.03 1bcn n GLN 24 Ca -0.13 -3.65 -0.42 0.00 -0.01 0.00 0.00 57.00 52.79 1bcn n GLN 24 Cb 0.42 -2.28 0.01 0.00 1.02 0.00 0.00 30.24 29.41 1bcn n GLN 24 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 177.06 176.41 1bcn n LYS 25 N -0.51 4.39 0.12 -1.09 2.85 -1.26 -3.95 118.16 118.72 1bcn n LYS 25 Ca 0.53 -4.06 0.00 0.00 -1.05 0.00 0.00 58.31 53.73 1bcn n LYS 25 Cb 0.26 -2.66 0.00 0.00 -0.65 0.00 0.00 35.03 31.98 1bcn n LYS 25 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 1bcn n THR 26 N 1.81 0.00 0.00 0.58 -2.24 -1.26 -4.82 114.28 108.34 1bcn n THR 26 Ca 0.40 0.00 -0.21 0.00 -2.27 0.00 0.00 64.05 61.97 1bcn n THR 26 Cb 0.31 -0.08 -0.14 0.00 -2.10 0.00 0.00 70.33 68.32 1bcn n THR 26 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1bcn n LEU 27 N -3.03 2.63 -0.01 3.22 7.99 -1.26 -4.00 117.00 122.54 1bcn n LEU 27 Ca 0.00 0.21 0.14 0.00 -0.01 0.00 0.00 56.01 56.35 1bcn n LEU 27 Cb 0.00 -1.12 0.53 0.00 -0.11 0.00 0.00 43.42 42.72 1bcn n LEU 27 CO 0.00 0.85 0.82 0.00 -1.51 0.00 0.00 177.39 177.55 1bcn n THR 29 N -1.43 0.75 -1.68 0.00 -2.24 -1.26 -4.47 114.28 103.95 1bcn n THR 29 Ca 0.08 -0.57 -0.33 0.00 -2.27 0.00 0.00 64.05 60.96 1bcn n THR 29 Cb 0.33 0.09 -0.04 0.00 -2.10 0.00 0.00 70.33 68.60 1bcn n THR 29 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 1bcn n GLU 30 N 0.54 3.58 -3.47 -0.78 -0.00 -1.21 -2.31 120.64 117.00 1bcn n GLU 30 Ca 0.13 -2.78 -0.27 0.00 -0.00 0.00 0.00 57.16 54.24 1bcn n GLU 30 Cb 0.43 -2.44 -0.12 0.00 -0.00 0.00 0.00 31.44 29.31 1bcn n GLU 30 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 1bcn s LEU 31 N -1.76 0.70 -0.91 -1.84 1.43 -1.26 -4.96 118.68 110.07 1bcn s LEU 31 Ca 0.58 -1.84 -0.16 0.00 -1.03 0.00 0.00 54.13 51.69 1bcn s LEU 31 Cb 0.26 -0.24 -0.26 0.00 0.03 0.00 0.00 46.19 45.99 1bcn s LEU 31 CO -0.13 -0.34 2.24 0.35 0.23 0.00 0.00 176.35 178.71 1bcn n THR 32 N 4.41 0.00 0.00 5.49 -2.24 -1.26 -2.79 114.28 117.89 1bcn n THR 32 Ca 0.07 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.35 1bcn n THR 32 Cb 0.39 -0.79 0.00 0.00 -2.10 0.00 0.00 70.33 67.84 1bcn n THR 32 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 1bcn n VAL 33 N 6.80 0.00 -3.63 2.28 0.24 0.81 -4.20 118.33 120.63 1bcn n VAL 33 Ca 0.59 0.00 -0.12 0.00 -2.04 0.00 0.00 64.34 62.77 1bcn n VAL 33 Cb 0.26 -0.05 -0.07 0.00 -1.47 0.00 0.00 33.84 32.51 1bcn n VAL 33 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 1bcn s THR 34 N 0.19 0.00 -0.39 3.34 2.01 -1.19 -2.87 115.64 116.73 1bcn s THR 34 Ca 0.00 0.00 -0.11 0.00 0.31 0.00 0.00 61.69 61.89 1bcn s THR 34 Cb 0.00 -1.00 0.04 0.00 0.01 0.00 0.00 72.50 71.55 1bcn s THR 34 CO 0.00 0.00 0.23 -1.81 -0.69 0.00 0.00 174.62 172.35 1bcn s ASP 35 N 0.24 5.75 -0.16 3.53 1.11 -1.18 -4.74 116.67 121.21 1bcn s ASP 35 Ca 0.01 -1.11 0.09 0.00 0.18 0.00 0.00 52.55 51.71 1bcn s ASP 35 Cb -0.05 -2.03 0.53 0.00 1.07 0.00 0.00 42.92 42.44 1bcn s ASP 35 CO -0.02 -0.43 1.31 2.30 1.18 0.00 0.00 175.17 179.51 1bcn n ILE 36 N 5.00 1.80 -1.47 0.77 -5.35 -1.26 -4.09 119.36 114.75 1bcn n ILE 36 Ca -0.11 -0.91 -0.04 0.00 -0.27 0.00 0.00 62.75 61.41 1bcn n ILE 36 Cb 0.45 -0.36 0.20 0.00 -1.74 0.00 0.00 39.64 38.19 1bcn n ILE 36 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 1bcn n PHE 37 N 0.39 1.06 -0.04 4.28 3.72 -1.26 -4.65 117.46 120.96 1bcn n PHE 37 Ca 0.18 -1.62 -0.09 0.00 -0.05 0.00 0.00 57.45 55.87 1bcn n PHE 37 Cb 0.87 -0.49 0.06 0.00 -0.94 0.00 0.00 39.48 38.99 1bcn n PHE 37 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1bcn h ALA 38 N 1.00 0.76 -0.80 4.37 0.00 -1.92 -3.41 119.26 119.26 1bcn h ALA 38 Ca 0.22 -0.45 -0.09 0.00 0.00 0.00 0.00 54.91 54.58 1bcn h ALA 38 Cb 1.65 -0.11 -0.16 0.00 0.00 0.00 0.00 17.79 19.17 1bcn h ALA 38 CO 0.38 0.66 -0.39 0.00 0.00 0.00 0.00 179.25 179.90 1bcn s ALA 39 N -4.26 -2.74 -0.45 0.00 0.00 -1.26 -5.10 121.76 107.96 1bcn s ALA 39 Ca -0.08 -0.06 -0.27 0.00 0.00 0.00 0.00 51.96 51.54 1bcn s ALA 39 Cb 0.12 -2.79 -0.03 0.00 0.00 0.00 0.00 23.12 20.42 1bcn s ALA 39 CO 0.84 -2.31 1.93 -1.12 0.00 0.00 0.00 175.76 175.11 1bcn s SER 40 N 1.06 5.43 -0.07 0.00 0.01 -1.26 -4.72 113.70 114.14 1bcn s SER 40 Ca 0.26 0.96 0.05 0.00 1.31 0.00 0.00 55.95 58.53 1bcn s SER 40 Cb 0.02 -2.52 -0.08 0.00 0.21 0.00 0.00 66.02 63.65 1bcn s SER 40 CO -0.07 -2.14 0.01 0.29 0.41 0.00 0.00 173.24 171.74 1bcn n LYS 41 N 8.81 2.45 -0.29 12.44 4.76 -1.26 -4.76 118.16 140.30 1bcn n LYS 41 Ca 0.24 0.01 0.02 0.00 -2.87 0.00 0.00 58.31 55.70 1bcn n LYS 41 Cb 0.50 -1.17 0.02 0.00 -1.84 0.00 0.00 35.03 32.54 1bcn n LYS 41 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1bcn n ASP 42 N -2.33 0.49 -4.42 4.39 8.00 -1.26 -5.01 116.55 116.41 1bcn n ASP 42 Ca -0.12 -1.96 -0.42 0.00 0.71 0.00 0.00 54.79 53.01 1bcn n ASP 42 Cb 0.71 -0.18 -0.11 0.00 -0.02 0.00 0.00 41.12 41.52 1bcn n ASP 42 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1bcn s THR 43 N -0.52 4.90 0.00 -3.53 -4.23 -1.26 -4.93 115.64 106.07 1bcn s THR 43 Ca 0.05 -0.76 0.00 0.00 -1.18 0.00 0.00 61.69 59.80 1bcn s THR 43 Cb 0.04 -3.73 0.00 0.00 1.34 0.00 0.00 72.50 70.15 1bcn s THR 43 CO 0.00 -0.27 0.00 0.41 -0.54 0.00 0.00 174.62 174.22 1bcn n THR 44 N 5.07 0.00 0.00 3.99 -1.04 -1.26 -4.75 114.28 116.30 1bcn n THR 44 Ca -0.11 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.90 1bcn n THR 44 Cb 0.46 -0.22 0.00 0.00 -1.82 0.00 0.00 70.33 68.76 1bcn n THR 44 CO 0.00 0.00 0.00 -1.84 -0.64 0.00 0.00 175.07 172.59 1bcn n GLU 45 N -0.00 0.00 0.20 -2.82 0.28 -1.26 -4.54 120.64 112.50 1bcn n GLU 45 Ca 0.00 0.00 0.09 0.00 -0.16 0.00 0.00 57.16 57.09 1bcn n GLU 45 Cb 0.00 -0.45 0.28 0.00 1.43 0.00 0.00 31.44 32.71 1bcn n GLU 45 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 177.13 178.54 1bcn h LYS 46 N 0.00 0.00 0.09 3.44 2.10 -1.94 -2.48 116.57 117.77 1bcn h LYS 46 Ca 0.00 0.00 -0.22 0.00 -2.00 0.00 0.00 60.65 58.43 1bcn h LYS 46 Cb 0.37 0.00 0.02 0.00 -0.90 0.00 0.00 32.23 31.72 1bcn h LYS 46 CO 0.00 0.22 -0.91 1.49 -2.00 0.00 0.00 179.45 178.25 1bcn h GLU 47 N 0.00 0.47 -0.36 0.07 4.57 -1.90 -2.60 114.58 114.82 1bcn h GLU 47 Ca -0.00 -0.62 -0.07 0.00 -1.18 0.00 0.00 59.36 57.49 1bcn h GLU 47 Cb 0.97 0.20 -0.02 0.00 -0.16 0.00 0.00 28.75 29.75 1bcn h GLU 47 CO 0.03 1.25 -0.07 1.15 -1.18 0.00 0.00 179.01 180.19 1bcn h THR 48 N -0.03 1.23 0.00 0.32 2.02 -1.78 -2.73 112.91 111.94 1bcn h THR 48 Ca -0.14 -0.98 -0.16 0.00 0.77 0.00 0.00 66.41 65.90 1bcn h THR 48 Cb 1.64 1.03 -0.02 0.00 -1.74 0.00 0.00 68.15 69.05 1bcn h THR 48 CO 0.18 0.33 -0.76 -0.26 0.37 0.00 0.00 175.52 175.38 1bcn h PHE 49 N 0.57 0.00 0.72 3.16 0.04 -1.50 -2.31 116.94 117.62 1bcn h PHE 49 Ca 0.11 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.84 1bcn h PHE 49 Cb 0.46 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.62 1bcn h PHE 49 CO 0.02 0.76 -0.35 0.00 -0.60 0.00 0.00 178.31 178.14 1bcn h ARG 51 N -1.18 -0.11 0.00 0.00 3.08 -1.59 -0.92 114.38 113.65 1bcn h ARG 51 Ca -0.10 0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.96 1bcn h ARG 51 Cb 0.76 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.84 1bcn h ARG 51 CO 0.16 -0.07 0.00 0.00 -1.07 0.00 0.00 179.97 178.99 1bcn h ALA 52 N 0.83 1.00 0.02 0.04 0.00 -1.43 -1.32 119.26 118.40 1bcn h ALA 52 Ca -0.00 0.00 -0.22 0.00 0.00 0.00 0.00 54.91 54.69 1bcn h ALA 52 Cb 0.10 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 1bcn h ALA 52 CO -0.00 0.00 -0.95 0.00 0.00 0.00 0.00 179.25 178.29 1bcn h ALA 53 N 2.04 0.39 -0.11 0.00 0.00 0.10 -1.26 119.26 120.43 1bcn h ALA 53 Ca 0.00 -0.74 -0.03 0.00 0.00 0.00 0.00 54.91 54.14 1bcn h ALA 53 Cb 0.12 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1bcn h ALA 53 CO 0.00 0.88 -0.07 1.15 0.00 0.00 0.00 179.25 181.21 1bcn h THR 54 N 0.16 1.33 -0.24 0.00 2.02 -0.94 -1.35 112.91 113.88 1bcn h THR 54 Ca -0.07 -1.12 -0.02 0.00 0.77 0.00 0.00 66.41 65.97 1bcn h THR 54 Cb 1.60 1.83 -0.01 0.00 -1.74 0.00 0.00 68.15 69.82 1bcn h THR 54 CO 0.16 0.32 0.07 0.58 0.37 0.00 0.00 175.52 177.02 1bcn h VAL 55 N -0.12 1.11 -0.15 3.16 2.07 -1.53 -0.48 116.25 120.31 1bcn h VAL 55 Ca 0.02 -0.38 -0.09 0.00 0.82 0.00 0.00 66.70 67.07 1bcn h VAL 55 Cb 0.54 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 31.15 1bcn h VAL 55 CO 0.02 0.14 -0.30 -0.07 0.02 0.00 0.00 177.57 177.38 1bcn h LEU 56 N 0.34 0.29 -0.98 2.57 4.07 -0.86 -2.26 115.31 118.49 1bcn h LEU 56 Ca 0.08 -0.10 -0.06 0.00 0.08 0.00 0.00 57.88 57.88 1bcn h LEU 56 Cb 0.12 -0.08 -0.02 0.00 1.08 0.00 0.00 40.66 41.76 1bcn h LEU 56 CO -0.01 0.59 0.03 0.03 -1.08 0.00 0.00 178.44 178.00 1bcn h ARG 57 N 0.26 0.77 0.00 1.13 3.08 0.05 -1.47 114.38 118.20 1bcn h ARG 57 Ca 0.04 -0.19 -0.06 0.00 0.07 0.00 0.00 59.98 59.83 1bcn h ARG 57 Cb 0.66 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.61 1bcn h ARG 57 CO 0.05 0.76 -0.30 1.96 -1.07 0.00 0.00 179.97 181.37 1bcn h GLN 58 N 0.73 0.00 0.16 0.04 1.08 -1.12 -1.20 115.11 114.80 1bcn h GLN 58 Ca 0.15 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.34 1bcn h GLN 58 Cb 0.40 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.83 1bcn h GLN 58 CO 0.01 0.30 -0.08 0.35 -0.95 0.00 0.00 178.83 178.46 1bcn h PHE 59 N 0.00 -0.20 0.00 2.96 3.04 -0.93 -1.77 116.94 120.04 1bcn h PHE 59 Ca -0.00 -0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.94 1bcn h PHE 59 Cb 0.67 0.07 0.00 0.00 2.56 0.00 0.00 35.95 39.25 1bcn h PHE 59 CO 0.00 -0.12 0.00 0.10 -2.02 0.00 0.00 178.31 176.27 1bcn h TYR 60 N -0.68 0.00 0.00 0.41 -0.00 -1.50 0.29 116.97 115.49 1bcn h TYR 60 Ca -0.02 0.00 -0.03 0.00 -0.00 0.00 0.00 58.73 58.67 1bcn h TYR 60 Cb 0.17 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 36.89 1bcn h TYR 60 CO 0.02 0.00 -0.68 0.45 -0.00 0.00 0.00 178.16 177.95 1bcn n SER 61 N -2.45 1.83 -0.02 0.10 2.88 -0.45 -4.20 113.62 111.31 1bcn n SER 61 Ca 0.01 0.58 -0.19 0.00 -1.33 0.00 0.00 58.87 57.93 1bcn n SER 61 Cb 0.19 -0.87 -0.14 0.00 -0.75 0.00 0.00 64.21 62.65 1bcn n SER 61 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 1bcn n HIS 62 N -4.57 1.01 0.06 0.66 8.25 -0.71 -4.19 115.22 115.74 1bcn n HIS 62 Ca -0.11 0.23 -0.05 0.00 -0.26 0.00 0.00 57.72 57.53 1bcn n HIS 62 Cb 0.35 -1.14 0.13 0.00 1.12 0.00 0.00 29.99 30.45 1bcn n HIS 62 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1bcn n HIS 63 N -3.37 1.19 -0.01 4.41 8.25 0.94 -4.00 115.22 122.63 1bcn n HIS 63 Ca -0.32 -0.77 -0.10 0.00 -0.26 0.00 0.00 57.72 56.27 1bcn n HIS 63 Cb 1.04 -0.44 -0.14 0.00 1.12 0.00 0.00 29.99 31.57 1bcn n HIS 63 CO 0.00 0.00 0.00 1.05 0.64 0.00 0.00 176.34 178.03 1bcn h GLU 64 N 1.04 0.04 -2.18 -0.41 4.11 -1.56 -3.40 114.58 112.22 1bcn h GLU 64 Ca 0.16 -0.07 -0.58 0.00 0.07 0.00 0.00 59.36 58.94 1bcn h GLU 64 Cb 1.55 0.03 -0.41 0.00 0.50 0.00 0.00 28.75 30.41 1bcn h GLU 64 CO 0.38 0.63 -0.71 1.17 0.07 0.00 0.00 179.01 180.55 1bcn n LYS 65 N -3.13 2.40 -3.75 1.06 4.81 -1.26 -4.91 118.16 113.37 1bcn n LYS 65 Ca -0.17 -4.46 -0.37 0.00 -0.87 0.00 0.00 58.31 52.44 1bcn n LYS 65 Cb 1.04 -2.08 -0.06 0.00 0.02 0.00 0.00 35.03 33.95 1bcn n LYS 65 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1bcn s ASP 66 N -2.59 6.53 0.40 3.14 1.11 -1.26 -4.97 116.67 119.02 1bcn s ASP 66 Ca 0.42 0.63 0.18 0.00 0.18 0.00 0.00 52.55 53.96 1bcn s ASP 66 Cb 0.20 -2.13 0.82 0.00 1.07 0.00 0.00 42.92 42.88 1bcn s ASP 66 CO -0.06 0.37 1.82 0.00 1.18 0.00 0.00 175.17 178.48 1bcn h THR 67 N 3.83 0.96 0.00 -1.27 1.03 -1.98 -3.07 112.91 112.41 1bcn h THR 67 Ca -0.54 -1.30 -0.00 0.00 -0.01 0.00 0.00 66.41 64.56 1bcn h THR 67 Cb 1.22 1.76 0.00 0.00 -1.07 0.00 0.00 68.15 70.07 1bcn h THR 67 CO 0.60 0.33 -0.00 0.03 -0.01 0.00 0.00 175.52 176.47 1bcn h ARG 68 N 0.00 -0.00 -0.48 0.00 3.08 -1.97 -2.59 114.38 112.42 1bcn h ARG 68 Ca -0.00 0.00 0.13 0.00 0.07 0.00 0.00 59.98 60.18 1bcn h ARG 68 Cb 0.74 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.77 1bcn h ARG 68 CO 0.04 0.35 0.34 0.00 -1.07 0.00 0.00 179.97 179.63 1bcn n LEU 70 N -4.41 1.19 0.00 0.00 4.77 -1.01 -4.83 117.00 112.71 1bcn n LEU 70 Ca 0.08 0.33 0.00 0.00 -0.03 0.00 0.00 56.01 56.39 1bcn n LEU 70 Cb 0.52 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 1bcn n LEU 70 CO 0.36 -0.05 0.00 0.61 -1.33 0.00 0.00 177.39 176.98 1bcn n GLY 71 N 0.78 -1.38 2.17 -0.72 0.00 -1.03 -4.37 105.19 100.63 1bcn n GLY 71 Ca 0.00 -1.86 -0.28 0.00 0.00 0.00 0.00 46.02 43.88 1bcn n GLY 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bcn n ALA 72 N 0.41 5.84 -2.84 4.61 0.00 -1.26 -4.94 120.51 122.33 1bcn n ALA 72 Ca 0.00 -3.33 -0.14 0.00 0.00 0.00 0.00 53.44 49.97 1bcn n ALA 72 Cb 0.00 -1.45 -0.12 0.00 0.00 0.00 0.00 19.45 17.88 1bcn n ALA 72 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1bcn s THR 73 N -4.26 0.52 0.00 0.00 2.01 -1.26 -5.04 115.64 107.62 1bcn s THR 73 Ca 0.60 -0.90 0.08 0.00 0.31 0.00 0.00 61.69 61.77 1bcn s THR 73 Cb 0.48 -0.56 -0.23 0.00 0.01 0.00 0.00 72.50 72.20 1bcn s THR 73 CO 0.03 -0.27 0.84 0.00 -0.69 0.00 0.00 174.62 174.52 1bcn h ALA 74 N 4.81 0.58 -0.99 7.40 0.00 -1.92 -3.34 119.26 125.80 1bcn h ALA 74 Ca -0.34 -1.27 0.06 0.00 0.00 0.00 0.00 54.91 53.36 1bcn h ALA 74 Cb 1.20 0.30 -0.06 0.00 0.00 0.00 0.00 17.79 19.22 1bcn h ALA 74 CO 0.43 1.43 0.65 1.96 0.00 0.00 0.00 179.25 183.71 1bcn h GLN 75 N 0.01 1.15 -0.75 0.00 4.20 -1.96 -0.99 115.11 116.77 1bcn h GLN 75 Ca -0.21 -0.07 0.05 0.00 0.06 0.00 0.00 58.65 58.48 1bcn h GLN 75 Cb 1.95 -0.26 -0.05 0.00 0.30 0.00 0.00 27.48 29.43 1bcn h GLN 75 CO 0.10 0.76 0.49 0.37 -0.67 0.00 0.00 178.83 179.89 1bcn h GLN 76 N 1.19 0.82 -0.39 1.46 5.75 -1.86 -0.65 115.11 121.43 1bcn h GLN 76 Ca 0.42 -0.05 -0.06 0.00 -0.15 0.00 0.00 58.65 58.81 1bcn h GLN 76 Cb 0.13 -0.19 -0.02 0.00 1.07 0.00 0.00 27.48 28.48 1bcn h GLN 76 CO -0.16 0.54 -0.01 0.35 -2.65 0.00 0.00 178.83 176.91 1bcn h PHE 77 N 0.85 0.66 0.83 3.99 3.04 -1.34 -1.24 116.94 123.73 1bcn h PHE 77 Ca 0.31 -0.08 -0.04 0.00 3.98 0.00 0.00 57.97 62.14 1bcn h PHE 77 Cb 0.16 -0.19 0.01 0.00 2.56 0.00 0.00 35.95 38.49 1bcn h PHE 77 CO -0.00 0.64 -0.40 1.25 -2.02 0.00 0.00 178.31 177.78 1bcn h HIS 78 N 0.60 -1.03 0.00 0.41 2.76 -0.93 -2.42 115.15 114.54 1bcn h HIS 78 Ca 0.12 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.27 1bcn h HIS 78 Cb 0.39 0.34 0.00 0.00 1.55 0.00 0.00 27.41 29.69 1bcn h HIS 78 CO 0.02 -0.64 0.00 -0.09 -1.30 0.00 0.00 177.93 175.92 1bcn h ARG 79 N -1.26 0.00 0.05 5.26 9.65 -1.42 -2.58 114.38 124.08 1bcn h ARG 79 Ca -0.11 0.00 -0.00 0.00 -1.10 0.00 0.00 59.98 58.76 1bcn h ARG 79 Cb 0.86 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.44 1bcn h ARG 79 CO 0.19 0.00 -0.03 1.25 2.80 0.00 0.00 179.97 184.18 1bcn h HIS 80 N 0.00 -0.07 -0.13 2.20 2.76 -0.76 -1.38 115.15 117.77 1bcn h HIS 80 Ca 0.00 -0.00 0.04 0.00 -2.20 0.00 0.00 60.37 58.21 1bcn h HIS 80 Cb 0.04 0.02 -0.01 0.00 1.55 0.00 0.00 27.41 29.01 1bcn h HIS 80 CO 0.00 0.44 0.10 -0.22 -1.30 0.00 0.00 177.93 176.95 1bcn h LYS 81 N -0.61 0.00 0.00 5.26 1.63 -1.04 -0.27 116.57 121.53 1bcn h LYS 81 Ca -0.01 0.00 -0.18 0.00 -0.85 0.00 0.00 60.65 59.61 1bcn h LYS 81 Cb 0.53 0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 32.14 1bcn h LYS 81 CO 0.01 0.00 -0.85 1.96 -3.45 0.00 0.00 179.45 177.12 1bcn h GLN 82 N 0.00 0.00 0.00 1.90 4.20 -1.41 -3.22 115.11 116.58 1bcn h GLN 82 Ca 0.06 0.00 -0.10 0.00 0.06 0.00 0.00 58.65 58.67 1bcn h GLN 82 Cb 0.26 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 1bcn h GLN 82 CO -0.00 0.85 -0.46 1.25 -0.67 0.00 0.00 178.83 179.80 1bcn h LEU 83 N 0.00 0.00 -0.80 1.46 5.85 0.11 -2.54 115.31 119.38 1bcn h LEU 83 Ca -0.01 0.00 -0.12 0.00 0.84 0.00 0.00 57.88 58.59 1bcn h LEU 83 Cb 1.65 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.66 1bcn h LEU 83 CO 0.11 0.46 -0.43 0.40 -0.34 0.00 0.00 178.44 178.64 1bcn h ILE 84 N 0.00 1.32 -0.01 4.05 1.08 -1.47 -2.49 117.51 119.98 1bcn h ILE 84 Ca -0.00 -1.60 -0.19 0.00 -0.39 0.00 0.00 64.86 62.68 1bcn h ILE 84 Cb 0.85 1.68 0.01 0.00 -3.07 0.00 0.00 36.82 36.29 1bcn h ILE 84 CO 0.06 0.49 -0.72 0.03 -0.69 0.00 0.00 178.15 177.32 1bcn h ARG 85 N 0.30 0.51 -0.15 2.37 3.08 -1.58 -2.32 114.38 116.59 1bcn h ARG 85 Ca 0.02 -0.53 0.01 0.00 0.07 0.00 0.00 59.98 59.56 1bcn h ARG 85 Cb 0.89 0.15 -0.02 0.00 0.08 0.00 0.00 29.97 31.07 1bcn h ARG 85 CO 0.07 1.17 0.05 0.35 -1.07 0.00 0.00 179.97 180.54 1bcn h PHE 86 N 0.07 0.09 -0.61 3.04 3.04 -1.43 -2.35 116.94 118.79 1bcn h PHE 86 Ca -0.09 0.01 -0.06 0.00 3.98 0.00 0.00 57.97 61.82 1bcn h PHE 86 Cb 1.41 -0.02 -0.03 0.00 2.56 0.00 0.00 35.95 39.88 1bcn h PHE 86 CO 0.13 0.04 0.16 1.25 -2.02 0.00 0.00 178.31 177.88 1bcn h LEU 87 N 0.12 0.91 -0.97 0.59 5.85 -1.52 -2.48 115.31 117.81 1bcn h LEU 87 Ca 0.07 -0.22 0.11 0.00 0.84 0.00 0.00 57.88 58.67 1bcn h LEU 87 Cb 0.04 -0.24 -0.08 0.00 0.37 0.00 0.00 40.66 40.75 1bcn h LEU 87 CO -0.07 0.90 0.61 0.11 -0.34 0.00 0.00 178.44 179.64 1bcn h LYS 88 N 0.88 0.96 -0.16 1.25 1.57 -1.07 0.19 116.57 120.19 1bcn h LYS 88 Ca 0.19 -0.06 -0.10 0.00 -1.87 0.00 0.00 60.65 58.81 1bcn h LYS 88 Cb 0.33 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 1bcn h LYS 88 CO -0.00 0.63 -0.36 0.07 -0.57 0.00 0.00 179.45 179.22 1bcn h ARG 89 N 0.99 0.34 0.00 3.15 0.11 -1.10 -2.05 114.38 115.81 1bcn h ARG 89 Ca 0.47 -0.15 0.00 0.00 0.10 0.00 0.00 59.98 60.40 1bcn h ARG 89 Cb 0.42 -0.01 0.00 0.00 1.11 0.00 0.00 29.97 31.49 1bcn h ARG 89 CO -0.25 0.66 0.00 -0.11 0.10 0.00 0.00 179.97 180.37 1bcn n LEU 90 N -4.06 0.45 0.09 0.08 7.94 0.44 -2.28 117.00 119.65 1bcn n LEU 90 Ca -0.01 0.57 -0.13 0.00 -1.11 0.00 0.00 56.01 55.33 1bcn n LEU 90 Cb 0.46 -0.46 -0.10 0.00 0.53 0.00 0.00 43.42 43.84 1bcn n LEU 90 CO 0.42 -0.25 0.06 -0.78 -1.11 0.00 0.00 177.39 175.72 1bcn h ASP 91 N 0.00 0.34 0.72 1.96 1.82 -0.19 -2.03 116.42 119.04 1bcn h ASP 91 Ca 0.00 -0.34 -0.15 0.00 -0.39 0.00 0.00 57.03 56.15 1bcn h ASP 91 Cb 0.50 -0.11 -0.03 0.00 0.68 0.00 0.00 39.33 40.37 1bcn h ASP 91 CO 0.00 1.23 -1.38 -1.14 -1.61 0.00 0.00 179.24 176.34 1bcn n ARG 92 N -3.55 0.62 -0.06 0.28 3.00 -1.18 -3.43 116.66 112.33 1bcn n ARG 92 Ca -0.06 0.21 -0.07 0.00 -0.00 0.00 0.00 57.85 57.92 1bcn n ARG 92 Cb 0.95 -1.81 -0.06 0.00 0.00 0.00 0.00 32.46 31.55 1bcn n ARG 92 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.63 176.72 1bcn h ASN 93 N 0.00 0.00 0.36 6.15 4.21 -1.53 0.12 115.58 124.89 1bcn h ASN 93 Ca -0.15 -0.42 -0.01 0.00 1.21 0.00 0.00 56.30 56.94 1bcn h ASN 93 Cb 1.52 0.00 -0.03 0.00 -1.12 0.00 0.00 38.32 38.69 1bcn h ASN 93 CO 0.04 0.78 -0.48 0.25 -1.29 0.00 0.00 177.43 176.73 1bcn h LEU 94 N -1.00 -1.36 -1.46 1.61 5.85 -1.56 -1.01 115.31 116.38 1bcn h LEU 94 Ca -0.02 0.12 -0.06 0.00 0.84 0.00 0.00 57.88 58.76 1bcn h LEU 94 Cb 0.51 0.46 -0.01 0.00 0.37 0.00 0.00 40.66 42.00 1bcn h LEU 94 CO -0.01 -0.59 -0.27 -0.25 -0.34 0.00 0.00 178.44 176.97 1bcn h TRP 95 N -0.87 0.00 -0.87 1.25 7.01 -1.73 -2.74 115.95 117.99 1bcn h TRP 95 Ca -0.04 0.00 0.36 0.00 2.11 0.00 0.00 58.89 61.32 1bcn h TRP 95 Cb 0.78 0.00 -0.15 0.00 -2.10 0.00 0.00 29.16 27.69 1bcn h TRP 95 CO -0.30 0.27 0.47 0.41 -2.79 0.00 0.00 178.44 176.50 1bcn n GLY 96 N -0.72 -0.65 0.11 2.65 0.00 0.40 0.15 105.19 107.13 1bcn n GLY 96 Ca -0.02 0.70 -0.14 0.00 0.00 0.00 0.00 46.02 46.56 1bcn n GLY 96 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1bcn n LEU 97 N -4.94 1.53 0.00 0.99 4.32 -1.05 -4.65 117.00 113.20 1bcn n LEU 97 Ca 0.33 0.21 0.00 0.00 -0.02 0.00 0.00 56.01 56.53 1bcn n LEU 97 Cb 1.12 -0.30 0.00 0.00 -1.62 0.00 0.00 43.42 42.62 1bcn n LEU 97 CO 0.01 0.62 0.23 0.00 -1.22 0.00 0.00 177.39 177.03 1bcn n ALA 98 N -2.81 -0.20 0.00 -1.18 0.00 0.40 -4.83 120.51 111.89 1bcn n ALA 98 Ca -0.28 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.16 1bcn n ALA 98 Cb 1.06 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.51 1bcn n ALA 98 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bcn n GLY 99 N 0.60 0.10 2.19 0.00 0.00 0.38 -4.85 105.19 103.60 1bcn n GLY 99 Ca 0.00 -0.71 -0.18 0.00 0.00 0.00 0.00 46.02 45.13 1bcn n GLY 99 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1bcn n LEU 100 N 0.00 5.80 0.00 0.99 7.94 -1.26 -4.63 117.00 125.84 1bcn n LEU 100 Ca 0.00 -3.54 0.00 0.00 -1.11 0.00 0.00 56.01 51.36 1bcn n LEU 100 Cb 0.00 -1.32 0.00 0.00 0.53 0.00 0.00 43.42 42.63 1bcn n LEU 100 CO 0.00 1.68 0.00 0.59 -1.11 0.00 0.00 177.39 178.55 1bcn n ASN 101 N 1.72 0.00 -4.40 1.96 3.02 -1.26 -4.69 115.26 111.61 1bcn n ASN 101 Ca 0.44 0.00 -0.44 0.00 -0.03 0.00 0.00 54.58 54.54 1bcn n ASN 101 Cb 0.74 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.88 1bcn n ASN 101 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1bcn s SER 102 N -1.00 6.36 -0.43 6.41 0.01 -1.26 -4.89 113.70 118.90 1bcn s SER 102 Ca 0.00 -1.66 0.08 0.00 1.31 0.00 0.00 55.95 55.69 1bcn s SER 102 Cb 0.00 -2.34 0.28 0.00 0.21 0.00 0.00 66.02 64.17 1bcn s SER 102 CO 0.00 -1.10 0.62 0.00 0.41 0.00 0.00 173.24 173.17 1bcn n PRO 104 N 0.99 0.56 -1.52 0.00 -0.01 -1.26 -4.82 135.00 128.94 1bcn n PRO 104 Ca 0.24 -0.84 -0.37 0.00 -0.01 0.00 0.00 63.50 62.52 1bcn n PRO 104 Cb 0.53 -3.68 -0.11 0.00 -0.01 0.00 0.00 33.50 30.23 1bcn n PRO 104 CO 0.00 0.00 0.00 1.55 -0.01 0.00 0.00 175.50 177.04 1bcn n VAL 105 N 8.78 -0.03 0.00 -1.45 3.14 -1.26 -4.82 118.33 122.69 1bcn n VAL 105 Ca 0.47 -0.36 0.00 0.00 -2.96 0.00 0.00 64.34 61.49 1bcn n VAL 105 Cb 0.43 -1.42 0.00 0.00 -1.06 0.00 0.00 33.84 31.79 1bcn n VAL 105 CO 0.00 0.00 0.00 0.29 -6.46 0.00 0.00 176.83 170.66 1bcn n LYS 106 N 8.53 0.00 -1.81 1.45 5.02 -1.26 -4.70 118.16 125.39 1bcn n LYS 106 Ca 0.54 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 56.41 1bcn n LYS 106 Cb 0.25 -0.35 -0.03 0.00 -0.02 0.00 0.00 35.03 34.88 1bcn n LYS 106 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 1bcn s GLU 107 N 0.00 3.15 -0.29 1.97 2.56 -1.26 -4.89 118.70 119.94 1bcn s GLU 107 Ca 0.00 1.64 -0.18 0.00 0.00 0.00 0.00 54.97 56.43 1bcn s GLU 107 Cb 0.00 -4.30 0.17 0.00 2.00 0.00 0.00 34.13 32.00 1bcn s GLU 107 CO 0.00 -2.08 1.13 0.00 -0.56 0.00 0.00 175.26 173.76 1bcn s ALA 108 N 7.87 -2.36 0.07 6.30 0.00 -1.26 -4.57 121.76 127.81 1bcn s ALA 108 Ca 0.89 2.03 -0.03 0.00 0.00 0.00 0.00 51.96 54.85 1bcn s ALA 108 Cb -0.26 -1.78 -0.03 0.00 0.00 0.00 0.00 23.12 21.05 1bcn s ALA 108 CO 0.33 -0.29 0.03 0.34 0.00 0.00 0.00 175.76 176.17 1bcn s ASP 109 N 0.94 0.38 -0.33 0.00 -1.08 -1.26 -4.96 116.67 110.37 1bcn s ASP 109 Ca -0.05 -0.96 -0.37 0.00 -0.52 0.00 0.00 52.55 50.65 1bcn s ASP 109 Cb -0.03 0.24 -0.13 0.00 -1.46 0.00 0.00 42.92 41.54 1bcn s ASP 109 CO -0.12 -0.65 2.08 0.00 0.52 0.00 0.00 175.17 176.99 1bcn n GLN 110 N 0.04 1.05 -4.11 4.34 10.64 -1.26 -3.13 117.38 124.95 1bcn n GLN 110 Ca -0.13 0.32 -0.25 0.00 -1.83 0.00 0.00 57.00 55.11 1bcn n GLN 110 Cb 0.62 -2.30 -0.17 0.00 -0.86 0.00 0.00 30.24 27.52 1bcn n GLN 110 CO 0.00 0.00 0.00 0.45 -1.83 0.00 0.00 177.06 175.68 1bcn s SER 111 N 6.22 1.81 -0.04 2.61 0.15 -1.14 -4.85 113.70 118.47 1bcn s SER 111 Ca 1.07 -0.25 -0.39 0.00 0.70 0.00 0.00 55.95 57.09 1bcn s SER 111 Cb -0.95 -0.73 -0.17 0.00 -1.71 0.00 0.00 66.02 62.46 1bcn s SER 111 CO 0.54 -0.08 1.39 0.35 1.20 0.00 0.00 173.24 176.65 1bcn n THR 112 N 4.52 0.06 0.20 6.45 -2.24 -1.26 -0.13 114.28 121.88 1bcn n THR 112 Ca -0.17 -0.01 0.18 0.00 -2.27 0.00 0.00 64.05 61.78 1bcn n THR 112 Cb 0.51 -0.74 0.76 0.00 -2.10 0.00 0.00 70.33 68.75 1bcn n THR 112 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1bcn h LEU 113 N 4.87 0.00 0.24 3.22 5.85 -1.34 -2.76 115.31 125.39 1bcn h LEU 113 Ca -0.48 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.23 1bcn h LEU 113 Cb 1.35 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.37 1bcn h LEU 113 CO 0.80 0.00 -0.19 -0.08 -0.34 0.00 0.00 178.44 178.63 1bcn h GLU 114 N 0.00 -0.41 -0.00 1.25 4.22 -1.76 -1.74 114.58 116.14 1bcn h GLU 114 Ca 0.11 0.03 0.00 0.00 0.08 0.00 0.00 59.36 59.58 1bcn h GLU 114 Cb 0.93 0.09 -0.00 0.00 0.50 0.00 0.00 28.75 30.28 1bcn h GLU 114 CO -0.00 -0.27 0.04 -0.97 -2.18 0.00 0.00 179.01 175.62 1bcn h ASN 115 N -0.42 0.00 -0.14 1.04 -0.73 -1.84 -1.75 115.58 111.74 1bcn h ASN 115 Ca -0.03 0.00 -0.20 0.00 1.87 0.00 0.00 56.30 57.94 1bcn h ASN 115 Cb 0.35 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.95 1bcn h ASN 115 CO 0.00 0.00 -0.68 0.15 -0.37 0.00 0.00 177.43 176.53 1bcn h PHE 116 N 0.00 1.01 -0.00 0.67 3.57 -1.32 -2.56 116.94 118.31 1bcn h PHE 116 Ca 0.00 -0.41 -0.16 0.00 3.53 0.00 0.00 57.97 60.94 1bcn h PHE 116 Cb 0.08 -0.17 -0.02 0.00 2.79 0.00 0.00 35.95 38.63 1bcn h PHE 116 CO 0.00 1.23 -0.73 -0.07 -2.23 0.00 0.00 178.31 176.51 1bcn h LEU 117 N 0.55 0.04 0.51 0.59 -0.00 -0.48 -1.96 115.31 114.57 1bcn h LEU 117 Ca -0.02 -0.03 -0.02 0.00 -0.00 0.00 0.00 57.88 57.80 1bcn h LEU 117 Cb 1.29 -0.01 0.00 0.00 -0.00 0.00 0.00 40.66 41.95 1bcn h LEU 117 CO 0.14 0.76 -0.24 -0.08 -0.00 0.00 0.00 178.44 179.01 1bcn h GLU 118 N 0.02 -0.65 0.00 1.13 4.57 -1.40 -2.40 114.58 115.85 1bcn h GLU 118 Ca -0.01 0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.21 1bcn h GLU 118 Cb 1.29 0.15 0.00 0.00 -0.16 0.00 0.00 28.75 30.03 1bcn h GLU 118 CO 0.10 -0.35 0.00 0.00 -1.18 0.00 0.00 179.01 177.57 1bcn h ARG 119 N -0.91 0.00 -0.10 1.92 2.47 -1.51 -2.51 114.38 113.74 1bcn h ARG 119 Ca -0.07 0.00 -0.04 0.00 -1.26 0.00 0.00 59.98 58.61 1bcn h ARG 119 Cb 0.60 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.92 1bcn h ARG 119 CO 0.11 0.00 -0.11 1.25 0.56 0.00 0.00 179.97 181.79 1bcn h LEU 120 N 0.00 0.26 0.21 3.04 6.46 -1.01 -2.22 115.31 122.05 1bcn h LEU 120 Ca 0.00 -0.50 -0.01 0.00 -0.12 0.00 0.00 57.88 57.25 1bcn h LEU 120 Cb 0.29 -0.07 0.00 0.00 -0.73 0.00 0.00 40.66 40.15 1bcn h LEU 120 CO 0.00 0.71 -0.10 0.50 -0.62 0.00 0.00 178.44 178.92 1bcn h LYS 121 N -0.18 -0.27 -0.57 1.25 3.11 -1.16 -2.74 116.57 116.01 1bcn h LYS 121 Ca 0.01 0.02 0.12 0.00 -2.81 0.00 0.00 60.65 57.99 1bcn h LYS 121 Cb 0.64 0.06 -0.10 0.00 -1.00 0.00 0.00 32.23 31.83 1bcn h LYS 121 CO 0.03 0.01 -0.03 1.79 -2.81 0.00 0.00 179.45 178.43 1bcn h THR 122 N -0.55 0.51 -0.82 1.00 1.35 -1.53 -0.57 112.91 112.30 1bcn h THR 122 Ca -0.03 -0.03 0.05 0.00 -0.55 0.00 0.00 66.41 65.85 1bcn h THR 122 Cb 0.41 0.41 -0.05 0.00 -1.73 0.00 0.00 68.15 67.19 1bcn h THR 122 CO 0.05 0.02 0.52 0.40 -0.25 0.00 0.00 175.52 176.25 1bcn h ILE 123 N 0.09 1.08 0.73 6.82 1.08 -1.35 -0.45 117.51 125.51 1bcn h ILE 123 Ca 0.29 -0.34 -0.04 0.00 -0.39 0.00 0.00 64.86 64.39 1bcn h ILE 123 Cb 0.46 0.02 0.01 0.00 -3.07 0.00 0.00 36.82 34.24 1bcn h ILE 123 CO -0.51 0.18 -0.35 -0.03 -0.69 0.00 0.00 178.15 176.75 1bcn h MET 124 N 0.98 -0.94 0.00 2.37 4.05 -0.81 -2.45 114.93 118.13 1bcn h MET 124 Ca 0.34 0.06 0.00 0.00 -0.28 0.00 0.00 59.70 59.83 1bcn h MET 124 Cb 0.08 0.21 0.00 0.00 -0.80 0.00 0.00 31.60 31.10 1bcn h MET 124 CO -0.14 -0.61 0.00 -2.13 0.23 0.00 0.00 176.91 174.26 1bcn n ARG 125 N -5.48 0.16 -0.09 0.39 0.63 -0.89 -1.72 116.66 109.65 1bcn n ARG 125 Ca -0.14 0.18 -0.18 0.00 -0.92 0.00 0.00 57.85 56.79 1bcn n ARG 125 Cb 0.40 -1.50 -0.11 0.00 0.45 0.00 0.00 32.46 31.70 1bcn n ARG 125 CO 0.00 0.00 0.00 1.49 -2.51 0.00 0.00 177.63 176.61 1bcn h GLU 126 N 0.00 0.00 0.00 -0.14 4.57 -0.63 -3.36 114.58 115.02 1bcn h GLU 126 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1bcn h GLU 126 Cb 0.16 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.75 1bcn h GLU 126 CO 0.00 0.89 -0.95 1.17 -1.18 0.00 0.00 179.01 178.94 1bcn n LYS 127 N -4.51 0.49 -0.33 1.92 0.00 -1.00 -3.92 118.16 110.81 1bcn n LYS 127 Ca -0.23 0.08 0.05 0.00 0.00 0.00 0.00 58.31 58.21 1bcn n LYS 127 Cb 0.57 -1.75 0.19 0.00 0.00 0.00 0.00 35.03 34.05 1bcn n LYS 127 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1bcn n TYR 128 N -2.43 0.79 0.14 5.64 4.01 -0.70 -3.98 117.16 120.64 1bcn n TYR 128 Ca 0.01 -0.32 0.05 0.00 -0.16 0.00 0.00 57.90 57.48 1bcn n TYR 128 Cb 0.51 -0.14 0.22 0.00 -0.31 0.00 0.00 39.34 39.62 1bcn n TYR 128 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1bcn n SER 129 N 0.51 3.28 -2.09 7.72 2.88 -1.25 -4.09 113.62 120.58 1bcn n SER 129 Ca 0.14 -2.36 -0.02 0.00 -1.33 0.00 0.00 58.87 55.30 1bcn n SER 129 Cb 0.52 -0.50 0.04 0.00 -0.75 0.00 0.00 64.21 63.52 1bcn n SER 129 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1bcn n LYS 130 N 0.50 0.87 -0.01 -1.46 5.02 -1.26 -4.99 118.16 116.84 1bcn n LYS 130 Ca 0.16 -1.89 -0.00 0.00 -2.02 0.00 0.00 58.31 54.55 1bcn n LYS 130 Cb 0.66 -0.15 -0.00 0.00 -0.02 0.00 0.00 35.03 35.51 1bcn n LYS 130 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1bcn s SER 132 N -3.39 4.91 0.00 0.00 0.01 -1.26 -5.12 113.70 108.84 1bcn s SER 132 Ca -0.00 0.02 0.00 0.00 1.31 0.00 0.00 55.95 57.28 1bcn s SER 132 Cb 0.00 -1.28 0.00 0.00 0.21 0.00 0.00 66.02 64.95 1bcn s SER 132 CO 0.00 0.35 0.00 -1.20 0.41 0.00 0.00 173.24 172.80