#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bsq s SER 3 N 0.00 1.80 -0.08 0.00 1.04 -1.26 -5.16 113.70 110.05 2bsq s SER 3 Ca 0.00 -0.65 -0.12 0.00 0.48 0.00 0.00 55.95 55.66 2bsq s SER 3 Cb 0.00 -0.06 0.03 0.00 0.10 0.00 0.00 66.02 66.09 2bsq s SER 3 CO 0.00 -0.07 0.31 0.54 0.98 0.00 0.00 173.24 175.00 2bsq s VAL 4 N -1.36 0.02 0.17 5.02 0.11 -1.26 -5.17 120.40 117.94 2bsq s VAL 4 Ca 0.00 -0.18 0.04 0.00 -2.93 0.00 0.00 61.98 58.91 2bsq s VAL 4 Cb -0.09 -0.50 -0.04 0.00 -1.53 0.00 0.00 36.38 34.22 2bsq s VAL 4 CO 0.03 -0.10 0.24 -0.69 -3.33 0.00 0.00 175.10 171.24 2bsq s VAL 5 N -0.37 5.00 -0.27 2.04 1.01 -1.26 -5.09 120.40 121.45 2bsq s VAL 5 Ca -0.05 -0.88 -0.02 0.00 0.00 0.00 0.00 61.98 61.03 2bsq s VAL 5 Cb -0.03 -3.59 0.09 0.00 0.00 0.00 0.00 36.38 32.84 2bsq s VAL 5 CO 0.02 -0.14 0.08 -0.63 0.00 0.00 0.00 175.10 174.44 2bsq s ILE 6 N -1.79 0.63 0.42 2.22 1.09 -1.26 -5.13 121.20 117.38 2bsq s ILE 6 Ca 0.33 -1.06 0.05 0.00 -1.10 0.00 0.00 60.65 58.87 2bsq s ILE 6 Cb -0.10 -1.38 0.01 0.00 -1.06 0.00 0.00 42.46 39.92 2bsq s ILE 6 CO 0.27 -0.55 0.59 -0.13 -0.10 0.00 0.00 174.94 175.02 2bsq s ARG 7 N 1.76 2.91 -1.23 2.79 3.00 -1.26 -4.55 118.95 122.37 2bsq s ARG 7 Ca 0.06 -0.94 -0.12 0.00 0.00 0.00 0.00 55.73 54.74 2bsq s ARG 7 Cb -0.17 -2.69 -0.01 0.00 0.00 0.00 0.00 34.95 32.08 2bsq s ARG 7 CO -0.22 -0.24 0.69 0.09 0.00 0.00 0.00 175.30 175.61 2bsq n ASN 8 N -1.91 -3.41 -4.59 0.23 3.02 -1.26 -4.94 115.26 102.39 2bsq n ASN 8 Ca 0.04 -0.97 -0.37 0.00 -0.03 0.00 0.00 54.58 53.25 2bsq n ASN 8 Cb 0.59 -3.50 -0.11 0.00 -0.61 0.00 0.00 39.78 36.15 2bsq n ASN 8 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2bsq s LEU 9 N -6.58 3.95 0.03 3.41 2.96 -1.26 -5.02 118.68 116.16 2bsq s LEU 9 Ca 0.28 0.00 -0.35 0.00 -0.22 0.00 0.00 54.13 53.84 2bsq s LEU 9 Cb -0.09 -2.07 -0.18 0.00 0.50 0.00 0.00 46.19 44.34 2bsq s LEU 9 CO 0.85 0.00 0.89 -0.24 -1.32 0.00 0.00 176.35 176.54 2bsq n SER 10 N 4.69 -0.21 0.25 3.68 2.88 -1.26 -4.75 113.62 118.90 2bsq n SER 10 Ca -0.15 1.06 0.10 0.00 -1.33 0.00 0.00 58.87 58.55 2bsq n SER 10 Cb 0.52 -0.85 0.64 0.00 -0.75 0.00 0.00 64.21 63.77 2bsq n SER 10 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 2bsq h GLU 11 N 2.43 0.00 -0.12 -1.46 4.57 -2.00 -1.20 114.58 116.80 2bsq h GLU 11 Ca -0.43 0.00 -0.18 0.00 -1.18 0.00 0.00 59.36 57.57 2bsq h GLU 11 Cb 1.31 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 29.91 2bsq h GLU 11 CO 0.58 0.15 -0.61 0.00 -1.18 0.00 0.00 179.01 177.95 2bsq h ALA 12 N 1.85 0.23 -0.56 2.92 0.00 -2.00 -2.82 119.26 118.88 2bsq h ALA 12 Ca -0.00 -0.54 -0.01 0.00 0.00 0.00 0.00 54.91 54.36 2bsq h ALA 12 Cb 0.34 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 2bsq h ALA 12 CO 0.02 0.49 0.32 1.15 0.00 0.00 0.00 179.25 181.23 2bsq h THR 13 N 0.27 1.18 0.21 0.00 2.02 -1.76 -1.10 112.91 113.74 2bsq h THR 13 Ca -0.04 -0.43 0.01 0.00 0.77 0.00 0.00 66.41 66.72 2bsq h THR 13 Cb 1.25 0.45 -0.04 0.00 -1.74 0.00 0.00 68.15 68.08 2bsq h THR 13 CO 0.13 0.19 -0.40 -0.74 0.37 0.00 0.00 175.52 175.06 2bsq h HIS 14 N 0.75 -1.11 -0.62 3.16 6.17 -1.21 -0.71 115.15 121.58 2bsq h HIS 14 Ca 0.20 0.02 0.07 0.00 0.71 0.00 0.00 60.37 61.37 2bsq h HIS 14 Cb 0.02 0.46 -0.06 0.00 2.52 0.00 0.00 27.41 30.35 2bsq h HIS 14 CO -0.02 -0.52 0.30 -0.91 0.71 0.00 0.00 177.93 177.49 2bsq h ASN 15 N -0.70 0.39 -0.79 3.26 -0.26 -1.29 0.28 115.58 116.48 2bsq h ASN 15 Ca 0.00 0.05 0.13 0.00 -0.56 0.00 0.00 56.30 55.92 2bsq h ASN 15 Cb 0.68 -0.01 -0.09 0.00 -1.06 0.00 0.00 38.32 37.84 2bsq h ASN 15 CO -0.18 0.24 0.39 0.00 -1.06 0.00 0.00 177.43 176.82 2bsq h ALA 16 N 1.37 1.14 -0.16 -0.83 0.00 -0.57 0.60 119.26 120.81 2bsq h ALA 16 Ca 0.29 0.08 -0.21 0.00 0.00 0.00 0.00 54.91 55.07 2bsq h ALA 16 Cb 0.27 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.06 2bsq h ALA 16 CO -0.23 -0.09 -0.73 0.82 0.00 0.00 0.00 179.25 179.02 2bsq h ILE 17 N 0.59 1.28 -0.67 0.00 1.08 0.31 -0.96 117.51 119.15 2bsq h ILE 17 Ca 0.42 -1.93 0.02 0.00 -0.39 0.00 0.00 64.86 62.98 2bsq h ILE 17 Cb 0.55 1.96 -0.04 0.00 -3.07 0.00 0.00 36.82 36.23 2bsq h ILE 17 CO -0.34 0.61 0.42 0.50 -0.69 0.00 0.00 178.15 178.66 2bsq h LYS 18 N 0.52 0.82 0.71 2.37 3.64 0.38 -1.29 116.57 123.71 2bsq h LYS 18 Ca -0.04 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 59.25 2bsq h LYS 18 Cb 1.36 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 33.00 2bsq h LYS 18 CO 0.15 0.54 -0.36 0.35 -2.27 0.00 0.00 179.45 177.86 2bsq h PHE 19 N 0.84 -0.94 -0.95 1.91 3.57 0.38 -1.53 116.94 120.23 2bsq h PHE 19 Ca 0.26 -0.02 0.20 0.00 3.53 0.00 0.00 57.97 61.94 2bsq h PHE 19 Cb -0.02 0.32 -0.08 0.00 2.79 0.00 0.00 35.95 38.95 2bsq h PHE 19 CO -0.04 -0.57 0.61 -0.09 -2.23 0.00 0.00 178.31 175.99 2bsq h ARG 20 N -0.98 0.51 -0.18 1.11 2.43 -0.95 0.16 114.38 116.47 2bsq h ARG 20 Ca -0.09 -0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 58.97 2bsq h ARG 20 Cb 0.76 -0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 30.19 2bsq h ARG 20 CO 0.14 0.34 -0.17 0.00 -1.51 0.00 0.00 179.97 178.77 2bsq h ALA 21 N 1.62 0.27 -0.52 2.80 0.00 -0.96 -2.13 119.26 120.33 2bsq h ALA 21 Ca 0.51 -0.34 -0.06 0.00 0.00 0.00 0.00 54.91 55.02 2bsq h ALA 21 Cb 1.10 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 2bsq h ALA 21 CO -0.24 0.17 0.09 -0.09 0.00 0.00 0.00 179.25 179.18 2bsq h ARG 22 N 0.10 0.82 -0.36 0.00 2.43 -0.11 -2.32 114.38 114.94 2bsq h ARG 22 Ca 0.03 -0.18 0.02 0.00 -0.81 0.00 0.00 59.98 59.03 2bsq h ARG 22 Cb 0.71 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 30.12 2bsq h ARG 22 CO 0.04 0.77 0.21 0.00 -1.51 0.00 0.00 179.97 179.48 2bsq h ALA 23 N 1.31 0.45 -2.09 2.80 0.00 -0.65 -3.40 119.26 117.69 2bsq h ALA 23 Ca 0.17 -0.01 -0.46 0.00 0.00 0.00 0.00 54.91 54.61 2bsq h ALA 23 Cb 0.34 -0.10 0.10 0.00 0.00 0.00 0.00 17.79 18.14 2bsq h ALA 23 CO 0.00 -0.14 0.28 0.00 0.00 0.00 0.00 179.25 179.39 2bsq s ALA 24 N -6.16 2.96 -0.59 0.00 0.00 -0.81 -4.96 121.76 112.20 2bsq s ALA 24 Ca -0.13 -1.11 -0.02 0.00 0.00 0.00 0.00 51.96 50.69 2bsq s ALA 24 Cb 0.11 -2.58 0.26 0.00 0.00 0.00 0.00 23.12 20.91 2bsq s ALA 24 CO 0.72 -1.67 2.25 0.41 0.00 0.00 0.00 175.76 177.47 2bsq n GLY 25 N -3.17 4.99 3.63 0.00 0.00 -1.25 -4.78 105.19 104.62 2bsq n GLY 25 Ca 0.11 -2.01 -0.28 0.00 0.00 0.00 0.00 46.02 43.84 2bsq n GLY 25 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2bsq s ARG 26 N -2.90 1.99 0.56 1.61 0.52 -0.91 -5.06 118.95 114.75 2bsq s ARG 26 Ca 0.53 -2.13 -0.06 0.00 -0.52 0.00 0.00 55.73 53.55 2bsq s ARG 26 Cb 0.40 -1.64 -0.01 0.00 0.52 0.00 0.00 34.95 34.23 2bsq s ARG 26 CO -0.19 -0.08 0.87 -1.54 0.02 0.00 0.00 175.30 174.38 2bsq s SER 27 N -3.73 5.85 0.20 0.23 1.04 -1.26 -4.10 113.70 111.93 2bsq s SER 27 Ca 0.33 0.82 -0.11 0.00 0.48 0.00 0.00 55.95 57.47 2bsq s SER 27 Cb 0.09 -1.92 0.13 0.00 0.10 0.00 0.00 66.02 64.41 2bsq s SER 27 CO 0.17 -0.89 1.83 0.74 0.98 0.00 0.00 173.24 176.06 2bsq h THR 28 N -0.05 1.21 -0.50 2.02 2.02 -1.91 -0.85 112.91 114.85 2bsq h THR 28 Ca -0.46 -0.48 -0.00 0.00 0.77 0.00 0.00 66.41 66.24 2bsq h THR 28 Cb 1.24 0.27 -0.02 0.00 -1.74 0.00 0.00 68.15 67.89 2bsq h THR 28 CO 0.61 0.22 0.30 -0.08 0.37 0.00 0.00 175.52 176.94 2bsq h GLU 29 N 0.95 0.68 -0.87 6.66 4.81 -1.98 -1.33 114.58 123.51 2bsq h GLU 29 Ca 0.25 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.42 2bsq h GLU 29 Cb -0.00 -0.14 -0.04 0.00 0.63 0.00 0.00 28.75 29.19 2bsq h GLU 29 CO -0.04 0.50 0.55 0.00 -0.73 0.00 0.00 179.01 179.29 2bsq h ALA 30 N 1.14 1.34 -0.46 2.92 0.00 -1.82 -0.47 119.26 121.91 2bsq h ALA 30 Ca 0.18 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 54.91 2bsq h ALA 30 Cb -0.00 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.42 2bsq h ALA 30 CO -0.03 0.59 -0.11 1.49 0.00 0.00 0.00 179.25 181.19 2bsq h GLU 31 N 1.19 0.83 0.19 0.00 4.57 -0.54 -1.20 114.58 119.62 2bsq h GLU 31 Ca 0.32 -0.28 -0.01 0.00 -1.18 0.00 0.00 59.36 58.20 2bsq h GLU 31 Cb -0.10 -0.07 0.00 0.00 -0.16 0.00 0.00 28.75 28.43 2bsq h GLU 31 CO -0.06 0.90 -0.09 0.82 -1.18 0.00 0.00 179.01 179.40 2bsq h ILE 32 N 0.75 0.90 -0.76 2.32 1.08 -0.66 0.14 117.51 121.28 2bsq h ILE 32 Ca 0.13 -0.47 0.18 0.00 -0.39 0.00 0.00 64.86 64.30 2bsq h ILE 32 Cb 0.60 1.19 -0.12 0.00 -3.07 0.00 0.00 36.82 35.42 2bsq h ILE 32 CO 0.04 0.11 0.12 0.03 -0.69 0.00 0.00 178.15 177.76 2bsq h ARG 33 N -0.48 0.19 -0.09 2.37 3.08 -0.93 0.61 114.38 119.13 2bsq h ARG 33 Ca -0.03 -0.01 -0.24 0.00 0.07 0.00 0.00 59.98 59.78 2bsq h ARG 33 Cb 0.37 -0.04 0.01 0.00 0.08 0.00 0.00 29.97 30.39 2bsq h ARG 33 CO 0.04 0.13 -0.87 1.25 -1.07 0.00 0.00 179.97 179.44 2bsq h LEU 34 N 0.20 0.90 -1.48 3.04 5.85 -1.01 0.29 115.31 123.10 2bsq h LEU 34 Ca 0.44 -0.64 -0.03 0.00 0.84 0.00 0.00 57.88 58.49 2bsq h LEU 34 Cb 0.78 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 41.54 2bsq h LEU 34 CO -0.59 1.43 -0.13 0.16 -0.34 0.00 0.00 178.44 178.98 2bsq h ILE 35 N 0.47 0.37 0.00 4.05 3.07 -0.31 -0.46 117.51 124.70 2bsq h ILE 35 Ca -0.08 -0.76 -0.00 0.00 1.55 0.00 0.00 64.86 65.57 2bsq h ILE 35 Cb 1.51 1.56 -0.00 0.00 -0.27 0.00 0.00 36.82 39.62 2bsq h ILE 35 CO 0.17 0.12 -0.01 0.25 -1.05 0.00 0.00 178.15 177.64 2bsq h LEU 36 N 0.00 0.00 -1.35 0.16 5.85 -0.77 -3.23 115.31 115.97 2bsq h LEU 36 Ca -0.00 -0.02 0.27 0.00 0.84 0.00 0.00 57.88 58.96 2bsq h LEU 36 Cb 0.55 0.00 -0.10 0.00 0.37 0.00 0.00 40.66 41.49 2bsq h LEU 36 CO 0.02 0.51 0.67 0.44 -0.34 0.00 0.00 178.44 179.74 2bsq h ASP 37 N -1.00 0.45 -0.26 1.25 3.32 -0.35 -1.39 116.42 118.43 2bsq h ASP 37 Ca -0.00 0.09 -0.02 0.00 0.02 0.00 0.00 57.03 57.12 2bsq h ASP 37 Cb 0.03 0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 2bsq h ASP 37 CO -0.00 0.08 0.10 0.78 -1.72 0.00 0.00 179.24 178.48 2bsq h ASN 38 N 0.39 0.37 0.50 6.45 -0.26 -1.18 -1.63 115.58 120.22 2bsq h ASN 38 Ca 0.60 -0.18 -0.13 0.00 -0.56 0.00 0.00 56.30 56.04 2bsq h ASN 38 Cb 1.52 -0.10 -0.02 0.00 -1.06 0.00 0.00 38.32 38.67 2bsq h ASN 38 CO -0.31 0.45 -0.57 0.16 -1.06 0.00 0.00 177.43 176.10 2bsq h ILE 39 N 0.27 1.40 -0.16 2.81 3.07 -1.32 -2.84 117.51 120.73 2bsq h ILE 39 Ca 0.09 -1.94 0.00 0.00 1.55 0.00 0.00 64.86 64.56 2bsq h ILE 39 Cb 0.20 2.02 -0.01 0.00 -0.27 0.00 0.00 36.82 38.76 2bsq h ILE 39 CO -0.01 0.56 0.11 0.00 -1.05 0.00 0.00 178.15 177.76 2bsq h ALA 40 N 1.36 0.21 0.00 0.16 0.00 -1.03 -0.23 119.26 119.72 2bsq h ALA 40 Ca -0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2bsq h ALA 40 Cb 1.03 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.75 2bsq h ALA 40 CO 0.08 -0.31 -0.02 -0.22 0.00 0.00 0.00 179.25 178.78 2bsq h LYS 41 N 0.21 0.00 -0.09 0.00 3.64 -1.18 -0.23 116.57 118.93 2bsq h LYS 41 Ca 0.06 0.00 -0.16 0.00 -1.27 0.00 0.00 60.65 59.28 2bsq h LYS 41 Cb -0.02 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 31.81 2bsq h LYS 41 CO -0.01 0.02 -0.59 0.00 -2.27 0.00 0.00 179.45 176.60 2bsq h ALA 42 N 1.98 0.19 0.00 5.00 0.00 -0.86 -3.08 119.26 122.48 2bsq h ALA 42 Ca -0.00 -0.54 -0.03 0.00 0.00 0.00 0.00 54.91 54.34 2bsq h ALA 42 Cb 0.08 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 2bsq h ALA 42 CO 0.00 0.44 -0.13 1.96 0.00 0.00 0.00 179.25 181.52 2bsq h GLN 43 N 0.16 0.00 -5.39 0.00 1.08 0.35 -3.37 115.11 107.94 2bsq h GLN 43 Ca -0.05 0.00 -0.25 0.00 -1.45 0.00 0.00 58.65 56.90 2bsq h GLN 43 Cb 1.24 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 28.64 2bsq h GLN 43 CO 0.12 0.13 0.80 -1.14 -0.95 0.00 0.00 178.83 177.79 2bsq s GLN 44 N -4.57 2.17 0.14 1.46 2.00 -0.76 -4.68 119.66 115.42 2bsq s GLN 44 Ca -0.04 -0.93 -0.07 0.00 -2.00 0.00 0.00 55.36 52.31 2bsq s GLN 44 Cb 0.15 -5.17 -0.03 0.00 0.80 0.00 0.00 33.01 28.76 2bsq s GLN 44 CO 0.65 -4.34 1.39 1.15 -0.50 0.00 0.00 175.29 173.64 2bsq h THR 45 N 6.37 1.31 -3.09 -0.34 2.02 -1.85 -3.46 112.91 113.87 2bsq h THR 45 Ca 0.16 -1.95 -0.12 0.00 0.77 0.00 0.00 66.41 65.26 2bsq h THR 45 Cb 0.96 1.93 -0.21 0.00 -1.74 0.00 0.00 68.15 69.09 2bsq h THR 45 CO 1.17 0.61 -0.31 0.68 0.37 0.00 0.00 175.52 178.04 2bsq s VAL 46 N -3.81 0.05 -0.58 3.16 -7.23 -1.26 -5.11 120.40 105.63 2bsq s VAL 46 Ca -0.08 -0.45 -0.10 0.00 -1.81 0.00 0.00 61.98 59.53 2bsq s VAL 46 Cb 0.10 -0.57 0.15 0.00 0.56 0.00 0.00 36.38 36.61 2bsq s VAL 46 CO 0.87 -0.25 0.46 -0.13 -0.31 0.00 0.00 175.10 175.75 2bsq s ARG 47 N -1.18 2.78 0.21 4.82 0.52 -1.26 -4.96 118.95 119.87 2bsq s ARG 47 Ca -0.12 -2.02 -0.12 0.00 -0.52 0.00 0.00 55.73 52.94 2bsq s ARG 47 Cb -0.05 -4.04 0.27 0.00 0.52 0.00 0.00 34.95 31.64 2bsq s ARG 47 CO 0.03 -1.23 1.65 1.25 0.02 0.00 0.00 175.30 177.02 2bsq h LEU 48 N 8.14 -0.40 0.00 2.53 5.85 -1.99 -1.10 115.31 128.34 2bsq h LEU 48 Ca -0.13 0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.76 2bsq h LEU 48 Cb 1.05 0.32 0.00 0.00 0.37 0.00 0.00 40.66 42.40 2bsq h LEU 48 CO 0.84 -0.16 0.00 0.61 -0.34 0.00 0.00 178.44 179.39 2bsq n GLY 49 N -1.39 -2.78 0.42 3.75 0.00 -1.26 -1.22 105.19 102.72 2bsq n GLY 49 Ca 0.08 0.27 0.24 0.00 0.00 0.00 0.00 46.02 46.61 2bsq n GLY 49 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2bsq h SER 50 N 0.00 0.05 0.62 1.61 0.02 -1.97 -0.80 113.55 113.08 2bsq h SER 50 Ca 0.00 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.92 2bsq h SER 50 Cb 0.00 -0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.54 2bsq h SER 50 CO 0.00 0.02 -0.30 -0.03 -1.14 0.00 0.00 176.83 175.38 2bsq h MET 51 N 0.05 -0.80 -0.44 3.45 -1.53 -0.62 -1.76 114.93 113.28 2bsq h MET 51 Ca 0.36 0.05 -0.03 0.00 -3.44 0.00 0.00 59.70 56.64 2bsq h MET 51 Cb 1.35 0.18 -0.02 0.00 -0.55 0.00 0.00 31.60 32.56 2bsq h MET 51 CO -0.02 -0.49 0.16 -0.07 0.14 0.00 0.00 176.91 176.63 2bsq h LEU 52 N -0.98 0.58 -0.17 3.39 3.38 -0.42 -2.58 115.31 118.51 2bsq h LEU 52 Ca -0.08 -0.07 0.02 0.00 0.09 0.00 0.00 57.88 57.84 2bsq h LEU 52 Cb 0.68 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 2bsq h LEU 52 CO 0.14 0.54 0.04 0.00 0.09 0.00 0.00 178.44 179.24 2bsq h ALA 53 N 1.55 0.17 -0.02 1.53 0.00 -1.02 -0.10 119.26 121.36 2bsq h ALA 53 Ca 0.15 0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.12 2bsq h ALA 53 Cb 0.15 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 17.92 2bsq h ALA 53 CO -0.01 -0.40 -0.43 0.77 0.00 0.00 0.00 179.25 179.17 2bsq h SER 54 N 0.11 -1.33 -1.07 0.00 0.02 -0.92 0.54 113.55 110.90 2bsq h SER 54 Ca 0.07 0.16 0.30 0.00 -0.84 0.00 0.00 61.79 61.49 2bsq h SER 54 Cb 0.06 0.52 -0.12 0.00 0.14 0.00 0.00 62.40 63.01 2bsq h SER 54 CO -0.10 -0.46 0.66 0.40 -1.14 0.00 0.00 176.83 176.20 2bsq h ILE 55 N -0.58 0.41 0.14 3.27 1.08 -1.26 0.51 117.51 121.08 2bsq h ILE 55 Ca 0.05 -0.13 -0.01 0.00 -0.39 0.00 0.00 64.86 64.38 2bsq h ILE 55 Cb 0.66 0.01 0.00 0.00 -3.07 0.00 0.00 36.82 34.43 2bsq h ILE 55 CO -0.34 0.07 -0.07 1.23 -0.69 0.00 0.00 178.15 178.35 2bsq h GLY 56 N 0.37 -0.20 1.53 5.37 0.00 0.18 -3.07 103.07 107.25 2bsq h GLY 56 Ca 0.67 0.07 -0.03 0.00 0.00 0.00 0.00 47.33 48.04 2bsq h GLY 56 CO -0.42 -0.07 0.12 0.06 0.00 0.00 0.00 176.54 176.24 2bsq h GLN 57 N -0.47 0.60 -0.76 4.80 3.07 0.33 0.24 115.11 122.92 2bsq h GLN 57 Ca -0.02 -0.09 0.04 0.00 0.09 0.00 0.00 58.65 58.67 2bsq h GLN 57 Cb 0.37 -0.11 -0.04 0.00 0.08 0.00 0.00 27.48 27.78 2bsq h GLN 57 CO 0.03 0.53 0.50 1.49 0.09 0.00 0.00 178.83 181.47 2bsq h GLU 58 N 0.59 0.87 -0.53 0.06 4.81 -0.19 -2.53 114.58 117.66 2bsq h GLU 58 Ca 0.14 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 2bsq h GLU 58 Cb 0.19 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.37 2bsq h GLU 58 CO -0.01 0.57 0.00 0.44 -0.73 0.00 0.00 179.01 179.29 2bsq n ILE 59 N -4.46 0.76 -1.08 2.32 -5.35 -0.88 -4.93 119.36 105.75 2bsq n ILE 59 Ca 0.10 -0.88 -0.03 0.00 -0.27 0.00 0.00 62.75 61.67 2bsq n ILE 59 Cb 0.15 0.72 -0.01 0.00 -1.74 0.00 0.00 39.64 38.76 2bsq n ILE 59 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2bsq n GLY 60 N 1.43 0.57 0.00 3.28 0.00 -0.69 -4.76 105.19 105.01 2bsq n GLY 60 Ca 0.20 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.89 2bsq n GLY 60 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bsq n GLY 61 N -2.00 -2.76 3.62 -0.02 0.00 0.76 -4.97 105.19 99.81 2bsq n GLY 61 Ca -0.03 -1.19 -0.28 0.00 0.00 0.00 0.00 46.02 44.52 2bsq n GLY 61 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2bsq s VAL 62 N -2.04 1.82 -0.37 1.61 -7.23 -1.26 -5.09 120.40 107.84 2bsq s VAL 62 Ca 0.00 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.19 2bsq s VAL 62 Cb 0.00 -2.88 0.15 0.00 0.56 0.00 0.00 36.38 34.21 2bsq s VAL 62 CO 0.00 0.00 0.30 -1.61 -0.31 0.00 0.00 175.10 173.48 2bsq s GLU 63 N -3.74 0.64 0.59 4.82 0.41 -1.26 -5.13 118.70 115.02 2bsq s GLU 63 Ca 0.32 -1.26 -0.19 0.00 -0.41 0.00 0.00 54.97 53.43 2bsq s GLU 63 Cb 0.09 -1.08 -0.04 0.00 -1.78 0.00 0.00 34.13 31.32 2bsq s GLU 63 CO 0.16 -1.23 1.19 -0.51 -0.49 0.00 0.00 175.26 174.38 2bsq s LEU 64 N 1.06 3.66 0.85 1.80 1.43 -1.26 -4.98 118.68 121.23 2bsq s LEU 64 Ca 0.20 2.33 -0.11 0.00 -1.03 0.00 0.00 54.13 55.52 2bsq s LEU 64 Cb -0.17 -4.59 0.10 0.00 0.03 0.00 0.00 46.19 41.57 2bsq s LEU 64 CO -0.03 -1.55 1.11 -0.70 0.23 0.00 0.00 176.35 175.41 2bsq s GLU 65 N -3.38 1.59 0.00 1.70 2.12 -1.26 -4.98 118.70 114.49 2bsq s GLU 65 Ca 0.76 1.23 -0.03 0.00 0.36 0.00 0.00 54.97 57.29 2bsq s GLU 65 Cb -0.29 -1.82 -0.02 0.00 0.26 0.00 0.00 34.13 32.27 2bsq s GLU 65 CO 0.33 -2.13 0.67 0.22 -0.54 0.00 0.00 175.26 173.81 2bsq h ASP 66 N -1.49 -0.09 -5.27 -1.70 1.82 -2.08 -3.49 116.42 104.12 2bsq h ASP 66 Ca -0.45 0.00 -0.01 0.00 -0.39 0.00 0.00 57.03 56.18 2bsq h ASP 66 Cb 1.25 0.02 0.00 0.00 0.68 0.00 0.00 39.33 41.29 2bsq h ASP 66 CO 0.49 -0.04 -0.71 0.52 -1.61 0.00 0.00 179.24 177.88 2bsq n VAL 67 N -2.43-11.22 0.00 2.25 0.31 -1.26 -5.05 118.33 100.93 2bsq n VAL 67 Ca -0.01 1.24 0.00 0.00 -0.01 0.00 0.00 64.34 65.56 2bsq n VAL 67 Cb 0.04 -7.04 0.00 0.00 -0.91 0.00 0.00 33.84 25.94 2bsq n VAL 67 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 2bsq n ARG 68 N 0.11 0.00 0.28 5.55 0.63 -1.26 -5.07 116.66 116.89 2bsq n ARG 68 Ca 0.07 0.00 -0.17 0.00 -0.92 0.00 0.00 57.85 56.83 2bsq n ARG 68 Cb 0.29 0.00 -0.08 0.00 0.45 0.00 0.00 32.46 33.12 2bsq n ARG 68 CO 0.00 0.00 0.00 0.78 -2.51 0.00 0.00 177.63 175.90 2bsq h GLY 69 N 0.00 -0.95 0.00 5.14 0.00 -2.07 -3.57 103.07 101.63 2bsq h GLY 69 Ca 0.00 0.43 0.00 0.00 0.00 0.00 0.00 47.33 47.76 2bsq h GLY 69 CO 0.00 -0.33 0.00 0.54 0.00 0.00 0.00 176.54 176.75