#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1new n ASP 2 N 0.00 -0.37 -3.79 0.00 5.68 -1.26 -4.55 116.55 112.25 1new n ASP 2 Ca 0.00 0.22 -0.13 0.00 -0.50 0.00 0.00 54.79 54.39 1new n ASP 2 Cb 0.00 0.56 -0.11 0.00 -1.14 0.00 0.00 41.12 40.43 1new n ASP 2 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1new s VAL 3 N -1.37 0.01 -0.40 2.12 0.11 -1.26 -0.41 120.40 119.21 1new s VAL 3 Ca 0.00 -0.10 0.07 0.00 -2.93 0.00 0.00 61.98 59.02 1new s VAL 3 Cb 0.00 -0.39 0.23 0.00 -1.53 0.00 0.00 36.38 34.70 1new s VAL 3 CO 0.00 -0.06 0.48 0.52 -3.33 0.00 0.00 175.10 172.71 1new n VAL 4 N 2.66 -0.82 -1.54 2.04 0.31 0.20 -4.87 118.33 116.32 1new n VAL 4 Ca -0.14 -3.84 -0.46 0.00 -0.01 0.00 0.00 64.34 59.89 1new n VAL 4 Cb 0.58 -1.85 -0.02 0.00 -0.91 0.00 0.00 33.84 31.64 1new n VAL 4 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1new n THR 5 N 1.76 1.95 -4.78 2.52 -1.04 -1.25 -3.99 114.28 109.45 1new n THR 5 Ca 0.23 -0.49 -0.25 0.00 -2.04 0.00 0.00 64.05 61.50 1new n THR 5 Cb 0.52 -0.73 -0.16 0.00 -1.82 0.00 0.00 70.33 68.14 1new n THR 5 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 1new s TYR 6 N -1.00 1.62 1.18 -1.42 2.02 0.63 -4.89 117.35 115.48 1new s TYR 6 Ca 0.61 -0.47 -0.19 0.00 -0.37 0.00 0.00 57.07 56.65 1new s TYR 6 Cb -0.77 -1.10 0.27 0.00 -0.40 0.00 0.00 41.96 39.97 1new s TYR 6 CO 0.59 -0.16 1.12 -1.21 -1.57 0.00 0.00 175.55 174.31 1new s GLU 7 N 0.08 -1.01 0.00 -0.62 2.02 -1.26 -0.49 118.70 117.42 1new s GLU 7 Ca -0.04 -0.04 0.00 0.00 0.02 0.00 0.00 54.97 54.90 1new s GLU 7 Cb -0.11 -1.62 0.00 0.00 0.10 0.00 0.00 34.13 32.50 1new s GLU 7 CO 0.02 -3.58 0.00 0.27 0.02 0.00 0.00 175.26 171.99 1new n ASN 8 N -4.67 0.00 -0.03 -0.19 0.23 -1.26 -4.63 115.26 104.71 1new n ASN 8 Ca 0.13 0.00 -0.14 0.00 -0.53 0.00 0.00 54.58 54.03 1new n ASN 8 Cb 0.59 0.00 -0.10 0.00 -2.08 0.00 0.00 39.78 38.19 1new n ASN 8 CO 0.00 0.00 0.00 0.11 -0.93 0.00 0.00 177.26 176.44 1new h LYS 9 N 0.00 0.22 -0.72 -3.83 1.57 -2.01 -3.35 116.57 108.45 1new h LYS 9 Ca 0.00 -0.18 0.01 0.00 -1.87 0.00 0.00 60.65 58.61 1new h LYS 9 Cb 0.00 0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.31 1new h LYS 9 CO 0.00 0.82 0.48 -0.22 -0.57 0.00 0.00 179.45 179.96 1new h LYS 10 N -0.34 0.94 0.00 3.15 1.63 -1.96 -3.45 116.57 116.54 1new h LYS 10 Ca -0.01 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 59.73 1new h LYS 10 Cb 0.86 -0.21 0.00 0.00 -0.60 0.00 0.00 32.23 32.28 1new h LYS 10 CO 0.04 0.62 0.00 0.41 -3.45 0.00 0.00 179.45 177.08 1new n GLY 11 N -1.43 2.41 3.76 5.01 0.00 -1.26 -4.64 105.19 109.05 1new n GLY 11 Ca 0.08 -0.26 -0.41 0.00 0.00 0.00 0.00 46.02 45.42 1new n GLY 11 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1new s ASN 12 N 0.00 6.69 -0.49 1.61 3.84 0.39 -4.08 114.94 122.90 1new s ASN 12 Ca 0.00 2.69 -0.16 0.00 0.21 0.00 0.00 52.86 55.59 1new s ASN 12 Cb 0.00 -2.64 0.08 0.00 -0.55 0.00 0.00 41.25 38.14 1new s ASN 12 CO 0.00 -0.64 0.47 -0.69 -2.79 0.00 0.00 177.10 173.44 1new s VAL 13 N -0.49 5.14 -1.38 -5.21 1.01 0.35 -0.65 120.40 119.17 1new s VAL 13 Ca 0.55 -0.97 -0.16 0.00 0.00 0.00 0.00 61.98 61.40 1new s VAL 13 Cb -0.41 -4.20 0.04 0.00 0.00 0.00 0.00 36.38 31.81 1new s VAL 13 CO 0.48 -0.67 2.07 0.41 0.00 0.00 0.00 175.10 177.38 1new n THR 14 N 5.31 3.52 -2.28 3.92 -1.04 -1.26 -0.27 114.28 122.18 1new n THR 14 Ca -0.11 -3.27 -0.42 0.00 -2.04 0.00 0.00 64.05 58.21 1new n THR 14 Cb 0.44 -2.51 -0.03 0.00 -1.82 0.00 0.00 70.33 66.40 1new n THR 14 CO 0.00 0.00 0.00 0.12 -0.64 0.00 0.00 175.07 174.55 1new s PHE 15 N 3.70 3.33 0.19 -1.42 5.36 -1.26 -4.91 117.98 122.98 1new s PHE 15 Ca 0.50 1.15 0.00 0.00 -0.96 0.00 0.00 56.93 57.62 1new s PHE 15 Cb 0.11 -3.56 -0.04 0.00 -0.34 0.00 0.00 43.02 39.19 1new s PHE 15 CO -0.03 -1.83 0.36 -0.51 -1.46 0.00 0.00 175.22 171.75 1new s ASP 16 N 0.90 6.37 0.01 6.13 1.01 -1.26 -0.63 116.67 129.20 1new s ASP 16 Ca 0.60 0.32 -0.05 0.00 0.71 0.00 0.00 52.55 54.14 1new s ASP 16 Cb -0.34 -1.98 -0.02 0.00 1.01 0.00 0.00 42.92 41.60 1new s ASP 16 CO 0.31 -0.02 -0.10 1.57 0.21 0.00 0.00 175.17 177.14 1new n HIS 17 N -0.68 0.00 0.11 4.23 -0.00 0.46 -4.50 115.22 114.84 1new n HIS 17 Ca -0.05 0.00 -0.12 0.00 0.46 0.00 0.00 57.72 58.01 1new n HIS 17 Cb 0.54 -0.16 -0.08 0.00 -0.12 0.00 0.00 29.99 30.17 1new n HIS 17 CO 0.00 0.00 0.00 0.87 0.46 0.00 0.00 176.34 177.67 1new h LYS 18 N -0.29 -0.31 -0.41 1.57 1.57 -1.14 0.80 116.57 118.36 1new h LYS 18 Ca -0.02 0.02 0.03 0.00 -1.87 0.00 0.00 60.65 58.81 1new h LYS 18 Cb 0.38 0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.74 1new h LYS 18 CO -0.01 0.06 0.27 0.00 -0.57 0.00 0.00 179.45 179.20 1new h ALA 19 N -0.30 1.85 0.64 3.86 0.00 -1.89 0.16 119.26 123.57 1new h ALA 19 Ca -0.03 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1new h ALA 19 Cb 0.51 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.19 1new h ALA 19 CO 0.05 0.10 -0.31 0.45 0.00 0.00 0.00 179.25 179.55 1new h HIS 20 N 0.43 -0.80 -0.97 0.00 3.86 -1.78 -3.31 115.15 112.58 1new h HIS 20 Ca 0.17 -0.02 0.30 0.00 -1.16 0.00 0.00 60.37 59.65 1new h HIS 20 Cb 0.13 0.26 -0.15 0.00 1.06 0.00 0.00 27.41 28.72 1new h HIS 20 CO -0.00 -0.45 0.46 0.00 0.86 0.00 0.00 177.93 178.80 1new h ALA 21 N -0.92 1.75 -0.99 2.45 0.00 0.17 0.24 119.26 121.96 1new h ALA 21 Ca -0.09 0.20 0.16 0.00 0.00 0.00 0.00 54.91 55.19 1new h ALA 21 Cb 0.70 0.21 -0.10 0.00 0.00 0.00 0.00 17.79 18.60 1new h ALA 21 CO 0.14 -0.54 0.60 0.93 0.00 0.00 0.00 179.25 180.38 1new h GLU 22 N 0.28 0.80 0.17 0.00 5.08 -1.04 0.28 114.58 120.16 1new h GLU 22 Ca 0.68 -0.05 -0.32 0.00 -1.00 0.00 0.00 59.36 58.67 1new h GLU 22 Cb 1.51 -0.18 0.01 0.00 0.50 0.00 0.00 28.75 30.59 1new h GLU 22 CO -0.63 0.53 -1.53 0.87 -1.00 0.00 0.00 179.01 177.26 1new h LYS 23 N 0.83 0.36 0.00 2.33 1.79 -0.76 -3.43 116.57 117.68 1new h LYS 23 Ca 0.54 -0.61 -0.04 0.00 -2.18 0.00 0.00 60.65 58.36 1new h LYS 23 Cb 0.75 0.23 -0.01 0.00 -1.58 0.00 0.00 32.23 31.62 1new h LYS 23 CO -0.34 1.26 -0.68 1.28 -1.08 0.00 0.00 179.45 179.88 1new n LEU 24 N -3.56 1.83 -0.82 2.94 4.32 -0.05 -5.07 117.00 116.58 1new n LEU 24 Ca -0.17 0.58 0.00 0.00 -0.02 0.00 0.00 56.01 56.40 1new n LEU 24 Cb 1.06 -0.87 0.00 0.00 -1.62 0.00 0.00 43.42 41.99 1new n LEU 24 CO 0.54 -0.34 0.00 0.61 -1.22 0.00 0.00 177.39 176.97 1new n GLY 25 N 1.57 0.51 5.00 -0.72 0.00 0.91 -4.44 105.19 108.02 1new n GLY 25 Ca -0.12 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.53 1new n GLY 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1new n ASP 27 N 0.37 0.00 0.20 0.00 8.00 -1.26 -0.78 116.55 123.09 1new n ASP 27 Ca 0.00 -0.74 0.13 0.00 0.71 0.00 0.00 54.79 54.89 1new n ASP 27 Cb 0.00 0.00 0.30 0.00 -0.02 0.00 0.00 41.12 41.40 1new n ASP 27 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1new h ALA 28 N 2.81 1.00 0.00 2.24 0.00 -1.78 -3.40 119.26 120.14 1new h ALA 28 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 1new h ALA 28 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1new h ALA 28 CO 0.00 0.00 -0.94 0.00 0.00 0.00 0.00 179.25 178.31 1new n HIS 30 N -3.35 -3.89 -3.25 0.00 -0.00 0.04 -5.10 115.22 99.68 1new n HIS 30 Ca -0.07 -0.75 -0.04 0.00 -0.00 0.00 0.00 57.72 56.86 1new n HIS 30 Cb 0.43 -0.70 -0.03 0.00 -0.00 0.00 0.00 29.99 29.68 1new n HIS 30 CO 0.00 0.00 0.00 -2.00 -0.00 0.00 0.00 176.34 174.34 1new s GLU 31 N -4.86 0.75 -0.16 -0.41 2.12 -1.26 -4.34 118.70 110.54 1new s GLU 31 Ca 0.49 -0.36 -0.00 0.00 0.36 0.00 0.00 54.97 55.46 1new s GLU 31 Cb -0.02 -0.11 0.00 0.00 0.26 0.00 0.00 34.13 34.25 1new s GLU 31 CO 0.35 -1.18 0.00 0.41 -0.54 0.00 0.00 175.26 174.31 1new n GLY 32 N 4.45 -3.63 1.81 -1.50 0.00 -1.26 -4.87 105.19 100.18 1new n GLY 32 Ca 0.10 0.14 -0.01 0.00 0.00 0.00 0.00 46.02 46.26 1new n GLY 32 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1new n THR 33 N 0.38 -5.29 -1.53 2.61 -1.04 -1.26 -5.02 114.28 103.13 1new n THR 33 Ca -0.00 0.65 -0.32 0.00 -2.04 0.00 0.00 64.05 62.34 1new n THR 33 Cb 0.01 -4.55 0.06 0.00 -1.82 0.00 0.00 70.33 64.03 1new n THR 33 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1new s PRO 34 N -0.70 2.61 0.00 -2.82 0.04 -1.26 -4.95 135.00 127.92 1new s PRO 34 Ca -0.04 1.22 0.00 0.00 0.04 0.00 0.00 61.00 62.22 1new s PRO 34 Cb 0.00 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 32.61 1new s PRO 34 CO 0.22 -1.37 0.00 0.00 0.04 0.00 0.00 177.00 175.88 1new n ALA 35 N -2.97 1.66 -3.58 8.56 0.00 -1.26 -5.13 120.51 117.79 1new n ALA 35 Ca 0.09 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.56 1new n ALA 35 Cb 0.53 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.97 1new n ALA 35 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 1new s LYS 36 N -2.00 0.16 0.02 0.00 -2.85 -1.26 -5.19 119.74 108.62 1new s LYS 36 Ca 0.00 -0.09 -0.02 0.00 -1.00 0.00 0.00 55.97 54.86 1new s LYS 36 Cb 0.00 0.06 -0.01 0.00 -2.06 0.00 0.00 37.83 35.81 1new s LYS 36 CO 0.00 -0.07 0.02 0.42 0.10 0.00 0.00 175.35 175.82 1new s ILE 37 N -2.17 0.10 -0.84 3.79 1.01 -1.26 -5.04 121.20 116.79 1new s ILE 37 Ca 0.14 -0.85 -0.19 0.00 0.00 0.00 0.00 60.65 59.74 1new s ILE 37 Cb 0.06 -0.32 0.12 0.00 0.01 0.00 0.00 42.46 42.33 1new s ILE 37 CO -0.05 -0.47 1.04 0.00 0.00 0.00 0.00 174.94 175.45 1new s ALA 38 N -1.46 3.34 -0.08 9.38 0.00 -1.26 -5.03 121.76 126.66 1new s ALA 38 Ca -0.15 -2.54 -0.20 0.00 0.00 0.00 0.00 51.96 49.07 1new s ALA 38 Cb -0.09 -3.94 -0.04 0.00 0.00 0.00 0.00 23.12 19.05 1new s ALA 38 CO -0.00 -2.85 0.56 0.42 0.00 0.00 0.00 175.76 173.89 1new s ILE 39 N 2.88 5.09 -0.05 0.00 -1.09 -1.26 -4.63 121.20 122.14 1new s ILE 39 Ca 0.28 1.15 -0.31 0.00 -2.23 0.00 0.00 60.65 59.54 1new s ILE 39 Cb -0.09 -3.90 0.11 0.00 -1.58 0.00 0.00 42.46 37.00 1new s ILE 39 CO -0.04 0.33 1.07 -0.62 -1.23 0.00 0.00 174.94 174.45 1new s ASP 40 N 0.48 -0.21 0.00 3.58 -1.08 -1.26 -4.98 116.67 113.20 1new s ASP 40 Ca 0.30 -0.08 0.03 0.00 -0.52 0.00 0.00 52.55 52.29 1new s ASP 40 Cb -0.16 0.28 0.21 0.00 -1.46 0.00 0.00 42.92 41.78 1new s ASP 40 CO 0.14 -0.48 0.65 1.17 0.52 0.00 0.00 175.17 177.17 1new n LYS 41 N -0.26 0.45 0.05 4.34 4.81 -1.26 -0.56 118.16 125.73 1new n LYS 41 Ca -0.05 0.00 -0.22 0.00 -0.87 0.00 0.00 58.31 57.17 1new n LYS 41 Cb 0.61 -1.12 -0.14 0.00 0.02 0.00 0.00 35.03 34.39 1new n LYS 41 CO 0.00 0.00 0.00 -0.22 1.17 0.00 0.00 177.40 178.35 1new h LYS 42 N 0.00 0.32 0.00 1.64 1.63 -1.95 -3.39 116.57 114.82 1new h LYS 42 Ca 0.00 -0.55 -0.24 0.00 -0.85 0.00 0.00 60.65 59.01 1new h LYS 42 Cb 0.00 0.21 -0.04 0.00 -0.60 0.00 0.00 32.23 31.80 1new h LYS 42 CO 0.00 1.26 -1.67 0.45 -3.45 0.00 0.00 179.45 176.04 1new n SER 43 N -3.84 1.93 -0.32 4.20 2.88 -0.38 -4.05 113.62 114.03 1new n SER 43 Ca -0.23 0.38 0.23 0.00 -1.33 0.00 0.00 58.87 57.92 1new n SER 43 Cb 0.96 -0.82 0.45 0.00 -0.75 0.00 0.00 64.21 64.05 1new n SER 43 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1new h ALA 44 N -0.94 1.81 -0.67 -1.46 0.00 -1.12 0.20 119.26 117.09 1new h ALA 44 Ca -0.36 0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1new h ALA 44 Cb 1.26 0.26 0.00 0.00 0.00 0.00 0.00 17.79 19.32 1new h ALA 44 CO -0.22 -0.64 0.00 0.72 0.00 0.00 0.00 179.25 179.11 1new n HIS 45 N -5.17 1.36 0.05 0.00 -0.00 -1.26 -0.22 115.22 109.98 1new n HIS 45 Ca 0.30 -0.57 0.00 0.00 -0.00 0.00 0.00 57.72 57.46 1new n HIS 45 Cb 0.98 -0.18 0.00 0.00 -0.00 0.00 0.00 29.99 30.78 1new n HIS 45 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.34 177.51 1new n LYS 46 N 1.26 0.00 -1.69 -0.41 4.81 0.53 -4.93 118.16 117.73 1new n LYS 46 Ca 0.25 0.00 -0.04 0.00 -0.87 0.00 0.00 58.31 57.65 1new n LYS 46 Cb 0.82 -0.30 0.02 0.00 0.02 0.00 0.00 35.03 35.58 1new n LYS 46 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 1new n ASP 47 N -3.21 -1.13 0.01 3.14 -0.08 -0.14 -4.85 116.55 110.28 1new n ASP 47 Ca 0.00 -2.00 0.00 0.00 -1.51 0.00 0.00 54.79 51.28 1new n ASP 47 Cb 0.00 0.44 0.00 0.00 2.34 0.00 0.00 41.12 43.90 1new n ASP 47 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1new n ALA 48 N -0.65 2.32 -0.04 -1.67 0.00 -1.04 -4.94 120.51 114.50 1new n ALA 48 Ca -0.22 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.22 1new n ALA 48 Cb 0.75 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.20 1new n ALA 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1new n LYS 50 N -2.45 1.15 0.00 0.00 4.76 0.38 -3.82 118.16 118.17 1new n LYS 50 Ca 0.00 -1.62 0.00 0.00 -2.87 0.00 0.00 58.31 53.82 1new n LYS 50 Cb 0.00 -2.79 0.00 0.00 -1.84 0.00 0.00 35.03 30.40 1new n LYS 50 CO 0.00 0.00 0.00 2.41 -1.37 0.00 0.00 177.40 178.44 1new n THR 51 N 6.16 0.00 -1.13 -0.18 -1.04 -1.26 -4.71 114.28 112.12 1new n THR 51 Ca 0.48 0.00 -0.30 0.00 -2.04 0.00 0.00 64.05 62.19 1new n THR 51 Cb 0.39 0.00 -0.05 0.00 -1.82 0.00 0.00 70.33 68.85 1new n THR 51 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1new n HIS 53 N 3.48 -0.63 0.61 0.00 -0.00 -1.26 -4.73 115.22 112.69 1new n HIS 53 Ca 0.65 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 58.37 1new n HIS 53 Cb 0.34 0.48 0.00 0.00 -0.00 0.00 0.00 29.99 30.81 1new n HIS 53 CO 0.00 0.00 0.00 0.36 -0.00 0.00 0.00 176.34 176.70 1new n LYS 54 N -2.47 0.61 -0.47 -0.41 2.85 -1.15 -1.52 118.16 115.61 1new n LYS 54 Ca 0.00 0.00 0.07 0.00 -1.05 0.00 0.00 58.31 57.33 1new n LYS 54 Cb 0.00 -1.26 0.14 0.00 -0.65 0.00 0.00 35.03 33.25 1new n LYS 54 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 1new n SER 55 N 0.38 1.68 -2.09 -5.58 2.88 -1.26 -5.06 113.62 104.58 1new n SER 55 Ca 0.00 -3.13 -0.07 0.00 -1.33 0.00 0.00 58.87 54.34 1new n SER 55 Cb 0.21 -0.42 0.00 0.00 -0.75 0.00 0.00 64.21 63.25 1new n SER 55 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1new n ASN 56 N -0.93 -1.10 -3.81 -3.46 2.85 -0.57 -5.09 115.26 103.14 1new n ASN 56 Ca 0.14 -2.00 -0.15 0.00 -0.11 0.00 0.00 54.58 52.46 1new n ASN 56 Cb 0.72 1.91 0.07 0.00 1.24 0.00 0.00 39.78 43.72 1new n ASN 56 CO 0.00 0.00 0.00 -0.46 -2.11 0.00 0.00 177.26 174.69 1new n ASN 57 N -1.53 1.10 0.00 1.20 0.23 -1.26 -4.84 115.26 110.15 1new n ASN 57 Ca -0.03 -1.86 0.00 0.00 -0.53 0.00 0.00 54.58 52.16 1new n ASN 57 Cb 0.34 -0.38 0.00 0.00 -2.08 0.00 0.00 39.78 37.66 1new n ASN 57 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1new n GLY 58 N -0.01 2.23 2.72 4.83 0.00 -1.26 -4.47 105.19 109.23 1new n GLY 58 Ca 0.11 -0.22 -0.38 0.00 0.00 0.00 0.00 46.02 45.53 1new n GLY 58 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1new n PRO 59 N 6.81 2.52 -0.00 1.61 -0.04 -1.26 -4.31 135.00 140.33 1new n PRO 59 Ca 0.00 -2.12 0.06 0.00 -0.04 0.00 0.00 63.50 61.40 1new n PRO 59 Cb 0.00 -2.95 -0.07 0.00 -0.04 0.00 0.00 33.50 30.44 1new n PRO 59 CO 0.00 0.00 0.00 -2.37 -0.04 0.00 0.00 175.50 173.09 1new n THR 60 N 4.89 0.00 0.00 0.52 5.66 -1.26 -4.73 114.28 119.35 1new n THR 60 Ca 0.55 -0.20 0.00 0.00 -3.05 0.00 0.00 64.05 61.35 1new n THR 60 Cb 0.32 0.96 0.00 0.00 -1.55 0.00 0.00 70.33 70.06 1new n THR 60 CO 0.00 0.00 0.00 2.29 -3.05 0.00 0.00 175.07 174.31 1new n LYS 61 N -1.33 0.00 0.13 1.09 2.85 -1.26 -4.71 118.16 114.93 1new n LYS 61 Ca 0.02 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.28 1new n LYS 61 Cb 0.20 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.58 1new n LYS 61 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1new n GLY 63 N 1.34 2.22 0.69 0.00 0.00 -1.26 -4.15 105.19 104.03 1new n GLY 63 Ca 0.00 -1.18 -0.05 0.00 0.00 0.00 0.00 46.02 44.80 1new n GLY 63 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1new n GLY 64 N 4.71 -0.22 0.09 -0.02 0.00 -1.26 -4.85 105.19 103.64 1new n GLY 64 Ca 0.49 -0.11 -0.17 0.00 0.00 0.00 0.00 46.02 46.22 1new n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1new s HIS 66 N -2.32 1.87 -0.25 0.00 3.76 -1.26 -4.17 115.29 112.92 1new s HIS 66 Ca -0.18 0.49 -0.29 0.00 -0.15 0.00 0.00 55.06 54.93 1new s HIS 66 Cb -0.00 -4.25 -0.03 0.00 1.11 0.00 0.00 32.58 29.41 1new s HIS 66 CO 0.73 -2.17 1.82 0.42 -0.85 0.00 0.00 174.74 174.69 1new s ILE 67 N 8.19 3.43 0.00 0.60 -1.09 0.18 -4.69 121.20 127.82 1new s ILE 67 Ca 0.59 0.46 0.00 0.00 -2.23 0.00 0.00 60.65 59.47 1new s ILE 67 Cb -0.10 -3.51 0.00 0.00 -1.58 0.00 0.00 42.46 37.27 1new s ILE 67 CO 0.16 -0.28 0.02 2.29 -1.23 0.00 0.00 174.94 175.90