#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 0.00 -3.85 0.00 2.03 -1.26 -4.70 116.55 108.77 1new n ASP 2 Ca 0.00 0.00 -0.12 0.00 0.52 0.00 0.00 54.79 55.19 1new n ASP 2 Cb 0.00 0.07 -0.10 0.00 -0.72 0.00 0.00 41.12 40.37 1new n ASP 2 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1new s VAL 3 N -1.44 0.08 0.12 5.18 0.11 -1.26 -0.18 120.40 123.00 1new s VAL 3 Ca 0.00 -0.63 -0.06 0.00 -2.93 0.00 0.00 61.98 58.36 1new s VAL 3 Cb 0.00 -0.47 -0.02 0.00 -1.53 0.00 0.00 36.38 34.37 1new s VAL 3 CO 0.00 -0.34 0.17 -0.69 -3.33 0.00 0.00 175.10 170.90 1new s VAL 4 N -1.34 0.12 -0.06 2.04 1.01 0.10 -4.86 120.40 117.41 1new s VAL 4 Ca -0.14 -1.47 -0.24 0.00 0.00 0.00 0.00 61.98 60.13 1new s VAL 4 Cb -0.07 -1.66 0.05 0.00 0.00 0.00 0.00 36.38 34.70 1new s VAL 4 CO 0.02 -0.54 0.54 -0.89 0.00 0.00 0.00 175.10 174.23 1new s THR 5 N -3.94 0.02 0.03 3.92 2.01 -1.26 -0.71 115.64 115.70 1new s THR 5 Ca 0.13 -0.15 -0.03 0.00 0.31 0.00 0.00 61.69 61.94 1new s THR 5 Cb 0.05 -0.84 -0.02 0.00 0.01 0.00 0.00 72.50 71.70 1new s THR 5 CO -0.05 -0.08 0.04 -0.31 -0.69 0.00 0.00 174.62 173.53 1new s TYR 6 N -1.00 0.25 -0.07 4.92 1.51 -0.10 -4.95 117.35 117.92 1new s TYR 6 Ca -0.10 -0.56 0.02 0.00 -1.01 0.00 0.00 57.07 55.42 1new s TYR 6 Cb -0.02 -0.19 -0.03 0.00 -0.11 0.00 0.00 41.96 41.61 1new s TYR 6 CO 0.07 -0.30 -0.10 -1.83 -1.11 0.00 0.00 175.55 172.27 1new s GLU 7 N -2.31 2.71 -0.07 -0.62 4.04 -1.26 -0.78 118.70 120.42 1new s GLU 7 Ca -0.08 -0.61 -0.17 0.00 0.04 0.00 0.00 54.97 54.15 1new s GLU 7 Cb -0.03 -2.52 0.04 0.00 0.02 0.00 0.00 34.13 31.63 1new s GLU 7 CO -0.04 0.61 0.39 -0.80 -1.84 0.00 0.00 175.26 173.59 1new s ASN 8 N -0.68 -0.34 0.35 0.83 0.01 -1.26 -4.92 114.94 108.94 1new s ASN 8 Ca 0.10 0.43 0.14 0.00 -0.71 0.00 0.00 52.86 52.81 1new s ASN 8 Cb -0.11 0.53 0.66 0.00 0.41 0.00 0.00 41.25 42.73 1new s ASN 8 CO 0.01 -0.37 1.77 0.11 -1.51 0.00 0.00 177.10 177.12 1new h LYS 9 N 4.30 0.00 0.00 -0.60 1.57 -2.00 -0.27 116.57 119.57 1new h LYS 9 Ca -0.28 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.50 1new h LYS 9 Cb 1.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.48 1new h LYS 9 CO 0.35 0.42 0.00 1.63 -0.57 0.00 0.00 179.45 181.28 1new n LYS 10 N -3.92 0.15 0.00 3.15 4.76 -1.26 -4.94 118.16 116.10 1new n LYS 10 Ca -0.01 0.12 0.00 0.00 -2.87 0.00 0.00 58.31 55.55 1new n LYS 10 Cb 0.47 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 32.16 1new n LYS 10 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1new n GLY 11 N 0.54 3.97 3.56 0.72 0.00 -0.12 -4.28 105.19 109.59 1new n GLY 11 Ca 0.07 -1.16 -0.31 0.00 0.00 0.00 0.00 46.02 44.63 1new n GLY 11 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1new n ASN 12 N 0.00 -0.67 -3.69 1.61 3.02 -1.18 -4.15 115.26 110.20 1new n ASN 12 Ca 0.00 0.24 -0.17 0.00 -0.03 0.00 0.00 54.58 54.62 1new n ASN 12 Cb 0.00 -1.36 -0.16 0.00 -0.61 0.00 0.00 39.78 37.65 1new n ASN 12 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1new s VAL 13 N -2.53 -0.16 0.27 2.41 0.11 0.04 -2.09 120.40 118.47 1new s VAL 13 Ca 0.65 0.34 -0.22 0.00 -2.93 0.00 0.00 61.98 59.82 1new s VAL 13 Cb -0.23 -0.21 -0.09 0.00 -1.53 0.00 0.00 36.38 34.32 1new s VAL 13 CO 0.62 0.14 0.83 -0.89 -3.33 0.00 0.00 175.10 172.47 1new s THR 14 N 1.97 4.41 -0.14 5.04 2.01 -1.26 -0.92 115.64 126.74 1new s THR 14 Ca 0.01 1.52 0.00 0.00 0.31 0.00 0.00 61.69 63.53 1new s THR 14 Cb -0.12 -3.91 0.02 0.00 0.01 0.00 0.00 72.50 68.50 1new s THR 14 CO -0.04 0.16 -0.12 -0.36 -0.69 0.00 0.00 174.62 173.56 1new s PHE 15 N -1.59 1.97 0.59 4.92 0.40 0.11 -4.95 117.98 119.43 1new s PHE 15 Ca 0.47 -1.10 -0.06 0.00 -0.60 0.00 0.00 56.93 55.63 1new s PHE 15 Cb -0.17 -1.49 0.00 0.00 0.51 0.00 0.00 43.02 41.88 1new s PHE 15 CO 0.22 -0.63 0.90 -0.51 0.70 0.00 0.00 175.22 175.90 1new s ASP 16 N 1.55 5.64 0.02 1.36 1.01 -1.26 0.01 116.67 125.01 1new s ASP 16 Ca 0.04 0.76 -0.04 0.00 0.71 0.00 0.00 52.55 54.02 1new s ASP 16 Cb -0.13 -1.77 -0.02 0.00 1.01 0.00 0.00 42.92 42.02 1new s ASP 16 CO -0.10 -1.04 -0.09 1.41 0.21 0.00 0.00 175.17 175.57 1new n HIS 17 N -2.58 0.00 0.13 4.23 8.25 0.01 -4.63 115.22 120.62 1new n HIS 17 Ca 0.04 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.37 1new n HIS 17 Cb 0.57 -0.14 -0.08 0.00 1.12 0.00 0.00 29.99 31.47 1new n HIS 17 CO 0.00 0.00 0.00 -0.22 0.64 0.00 0.00 176.34 176.76 1new h LYS 18 N -0.25 -0.31 0.00 -0.41 3.64 -0.85 0.10 116.57 118.50 1new h LYS 18 Ca -0.01 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1new h LYS 18 Cb 0.33 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.22 1new h LYS 18 CO -0.01 0.00 0.00 0.00 -2.27 0.00 0.00 179.45 177.17 1new h ALA 19 N 0.01 1.00 0.00 5.00 0.00 -1.90 0.98 119.26 124.36 1new h ALA 19 Ca -0.03 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 1new h ALA 19 Cb 0.46 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1new h ALA 19 CO 0.05 0.00 -0.21 0.45 0.00 0.00 0.00 179.25 179.55 1new h HIS 20 N 0.00 0.00 -1.07 0.00 3.86 -1.81 -3.39 115.15 112.74 1new h HIS 20 Ca 0.00 0.00 0.29 0.00 -1.16 0.00 0.00 60.37 59.50 1new h HIS 20 Cb 0.47 0.00 -0.07 0.00 1.06 0.00 0.00 27.41 28.86 1new h HIS 20 CO 0.00 0.92 0.72 0.00 0.86 0.00 0.00 177.93 180.43 1new h ALA 21 N -0.24 2.57 -1.01 2.45 0.00 0.43 0.27 119.26 123.73 1new h ALA 21 Ca -0.05 0.02 0.29 0.00 0.00 0.00 0.00 54.91 55.17 1new h ALA 21 Cb 0.90 0.05 -0.14 0.00 0.00 0.00 0.00 17.79 18.61 1new h ALA 21 CO -0.03 -0.94 0.59 1.05 0.00 0.00 0.00 179.25 179.92 1new h GLU 22 N 0.23 0.42 0.00 0.00 -0.00 -1.05 0.13 114.58 114.31 1new h GLU 22 Ca 0.57 -0.03 -0.19 0.00 -0.00 0.00 0.00 59.36 59.71 1new h GLU 22 Cb 1.76 -0.09 -0.03 0.00 -0.00 0.00 0.00 28.75 30.39 1new h GLU 22 CO -0.18 0.28 -1.26 1.63 -0.00 0.00 0.00 179.01 179.47 1new n LYS 23 N -4.95 0.54 -0.15 1.06 5.02 -0.08 -4.74 118.16 114.85 1new n LYS 23 Ca 0.30 0.48 -0.11 0.00 -2.02 0.00 0.00 58.31 56.96 1new n LYS 23 Cb 0.89 -1.66 -0.01 0.00 -0.02 0.00 0.00 35.03 34.23 1new n LYS 23 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1new h LEU 24 N -1.00 0.87 -0.90 -0.35 4.07 -0.69 -3.48 115.31 113.83 1new h LEU 24 Ca -0.29 -0.36 -0.18 0.00 0.08 0.00 0.00 57.88 57.13 1new h LEU 24 Cb 1.12 -0.24 0.06 0.00 1.08 0.00 0.00 40.66 42.69 1new h LEU 24 CO -0.18 1.02 -0.31 0.61 -1.08 0.00 0.00 178.44 178.51 1new n GLY 25 N -0.23 0.27 5.00 0.83 0.00 0.42 -3.71 105.19 107.77 1new n GLY 25 Ca -0.00 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.76 1new n GLY 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1new h ASP 27 N 0.00 0.45 0.16 0.00 3.32 -1.83 0.62 116.42 119.15 1new h ASP 27 Ca 0.00 0.06 -0.00 0.00 0.02 0.00 0.00 57.03 57.10 1new h ASP 27 Cb 0.00 -0.02 -0.00 0.00 0.22 0.00 0.00 39.33 39.53 1new h ASP 27 CO 0.00 0.16 -0.00 0.00 -1.72 0.00 0.00 179.24 177.67 1new h ALA 28 N 1.61 1.05 0.00 3.45 0.00 -1.77 -2.80 119.26 120.79 1new h ALA 28 Ca 0.51 -0.00 -0.28 0.00 0.00 0.00 0.00 54.91 55.14 1new h ALA 28 Cb 1.24 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.98 1new h ALA 28 CO -0.22 0.01 -2.00 0.00 0.00 0.00 0.00 179.25 177.03 1new n HIS 30 N -3.29 0.00 0.00 0.00 -0.00 0.02 -5.12 115.22 106.83 1new n HIS 30 Ca -0.33 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.39 1new n HIS 30 Cb 0.80 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.79 1new n HIS 30 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 176.34 174.43 1new n GLU 31 N 0.00 -2.99 -0.33 -0.41 2.13 -1.24 -4.78 120.64 113.01 1new n GLU 31 Ca 0.00 0.00 0.29 0.00 0.66 0.00 0.00 57.16 58.11 1new n GLU 31 Cb 0.00 0.00 0.54 0.00 0.27 0.00 0.00 31.44 32.25 1new n GLU 31 CO 0.00 0.00 0.00 0.78 -0.41 0.00 0.00 177.13 177.50 1new h GLY 32 N 0.00 2.15 -7.55 8.31 0.00 -1.96 -3.17 103.07 100.85 1new h GLY 32 Ca 0.00 -0.19 -0.72 0.00 0.00 0.00 0.00 47.33 46.42 1new h GLY 32 CO 0.00 -0.66 -0.30 -1.59 0.00 0.00 0.00 176.54 174.00 1new s THR 33 N -5.57 4.12 0.75 4.70 2.01 -1.26 -5.09 115.64 115.30 1new s THR 33 Ca -0.09 -2.60 -0.11 0.00 0.31 0.00 0.00 61.69 59.19 1new s THR 33 Cb 0.32 -3.67 0.04 0.00 0.01 0.00 0.00 72.50 69.21 1new s THR 33 CO 0.79 -0.87 1.10 -2.16 -0.69 0.00 0.00 174.62 172.78 1new s PRO 34 N 0.31 2.45 0.23 4.92 0.04 -1.20 -5.07 135.00 136.68 1new s PRO 34 Ca 0.15 0.54 -0.21 0.00 0.04 0.00 0.00 61.00 61.52 1new s PRO 34 Cb -0.19 -1.97 0.07 0.00 0.04 0.00 0.00 34.50 32.45 1new s PRO 34 CO -0.04 -1.34 0.98 0.00 0.04 0.00 0.00 177.00 176.63 1new s ALA 35 N -3.26 -1.41 -0.41 8.56 0.00 -1.26 -5.09 121.76 118.88 1new s ALA 35 Ca 0.60 -0.40 -0.27 0.00 0.00 0.00 0.00 51.96 51.88 1new s ALA 35 Cb -0.13 0.74 -0.03 0.00 0.00 0.00 0.00 23.12 23.70 1new s ALA 35 CO 0.53 -1.05 2.00 -1.59 0.00 0.00 0.00 175.76 175.65 1new s LYS 36 N -2.27 2.89 0.45 0.00 0.00 -1.26 -4.97 119.74 114.57 1new s LYS 36 Ca 0.20 1.31 -0.24 0.00 0.00 0.00 0.00 55.97 57.24 1new s LYS 36 Cb -0.03 -4.35 -0.08 0.00 0.00 0.00 0.00 37.83 33.38 1new s LYS 36 CO 0.06 -2.39 1.25 0.42 0.00 0.00 0.00 175.35 174.69 1new s ILE 37 N 8.69 2.75 -0.52 3.79 1.01 -1.26 -4.98 121.20 130.68 1new s ILE 37 Ca 0.83 0.61 -0.25 0.00 0.00 0.00 0.00 60.65 61.85 1new s ILE 37 Cb -0.21 -3.33 0.04 0.00 0.01 0.00 0.00 42.46 38.97 1new s ILE 37 CO 0.29 0.04 0.94 0.00 0.00 0.00 0.00 174.94 176.21 1new s ALA 38 N -1.38 3.18 0.09 9.38 0.00 -1.26 -5.03 121.76 126.74 1new s ALA 38 Ca 0.62 -1.06 0.06 0.00 0.00 0.00 0.00 51.96 51.58 1new s ALA 38 Cb -0.34 -3.70 -0.04 0.00 0.00 0.00 0.00 23.12 19.03 1new s ALA 38 CO 0.43 -2.26 -0.08 0.42 0.00 0.00 0.00 175.76 174.26 1new s ILE 39 N 3.89 3.52 0.00 0.00 -1.09 -1.26 -4.82 121.20 121.44 1new s ILE 39 Ca 0.33 -1.16 0.00 0.00 -2.23 0.00 0.00 60.65 57.59 1new s ILE 39 Cb -0.11 -2.64 0.00 0.00 -1.58 0.00 0.00 42.46 38.13 1new s ILE 39 CO 0.22 0.14 0.00 -0.67 -1.23 0.00 0.00 174.94 173.40 1new n ASP 40 N 0.77 0.00 -2.94 3.58 2.03 -1.26 -5.08 116.55 113.66 1new n ASP 40 Ca -0.13 0.00 -0.07 0.00 0.52 0.00 0.00 54.79 55.11 1new n ASP 40 Cb 0.52 0.00 0.03 0.00 -0.72 0.00 0.00 41.12 40.95 1new n ASP 40 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 1new n LYS 41 N 0.00 0.95 0.00 -0.67 0.00 -1.26 -4.88 118.16 112.30 1new n LYS 41 Ca 0.00 -1.93 0.00 0.00 0.00 0.00 0.00 58.31 56.38 1new n LYS 41 Cb 0.00 2.46 0.00 0.00 0.00 0.00 0.00 35.03 37.49 1new n LYS 41 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 1new n LYS 42 N -0.59 0.00 -0.01 1.64 4.81 -1.26 -3.45 118.16 119.29 1new n LYS 42 Ca -0.06 0.00 -0.11 0.00 -0.87 0.00 0.00 58.31 57.27 1new n LYS 42 Cb 0.58 0.00 -0.04 0.00 0.02 0.00 0.00 35.03 35.59 1new n LYS 42 CO 0.00 0.00 0.00 0.77 1.17 0.00 0.00 177.40 179.34 1new h SER 43 N 0.00 -1.08 0.00 3.14 0.02 -1.87 0.38 113.55 114.14 1new h SER 43 Ca 0.00 0.16 0.00 0.00 -0.84 0.00 0.00 61.79 61.11 1new h SER 43 Cb 0.00 0.46 0.00 0.00 0.14 0.00 0.00 62.40 63.00 1new h SER 43 CO 0.00 -0.37 0.35 0.00 -1.14 0.00 0.00 176.83 175.67 1new n ALA 44 N -2.88 0.53 0.00 3.77 0.00 -1.22 -1.32 120.51 119.39 1new n ALA 44 Ca -0.03 0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.50 1new n ALA 44 Cb 0.34 -0.65 0.00 0.00 0.00 0.00 0.00 19.45 19.14 1new n ALA 44 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1new n HIS 45 N -1.89 0.00 -3.64 0.00 8.25 -0.10 -3.93 115.22 113.91 1new n HIS 45 Ca -0.01 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.37 1new n HIS 45 Cb 0.36 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.40 1new n HIS 45 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1new s LYS 46 N -1.04 0.63 -1.39 -0.41 1.02 -0.07 -4.38 119.74 114.11 1new s LYS 46 Ca 0.00 0.94 -0.06 0.00 0.02 0.00 0.00 55.97 56.87 1new s LYS 46 Cb 0.00 0.21 0.03 0.00 -0.52 0.00 0.00 37.83 37.56 1new s LYS 46 CO 0.00 -0.11 0.87 -3.47 -0.92 0.00 0.00 175.35 171.72 1new n ASP 47 N 3.40 -3.07 0.00 2.83 2.03 -1.26 -3.77 116.55 116.72 1new n ASP 47 Ca -0.17 -0.77 0.00 0.00 0.52 0.00 0.00 54.79 54.37 1new n ASP 47 Cb 0.57 -4.14 0.00 0.00 -0.72 0.00 0.00 41.12 36.83 1new n ASP 47 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1new n ALA 48 N -4.49 0.00 -0.06 -1.67 0.00 -0.95 -4.79 120.51 108.54 1new n ALA 48 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.30 1new n ALA 48 Cb 0.61 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.06 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 -2.10 1.51 0.04 0.00 5.02 -1.26 -3.08 118.16 118.28 1new n LYS 50 Ca 0.00 -1.58 0.00 0.00 -2.02 0.00 0.00 58.31 54.71 1new n LYS 50 Cb 0.00 -2.68 0.00 0.00 -0.02 0.00 0.00 35.03 32.33 1new n LYS 50 CO 0.00 0.00 0.00 -2.37 -0.52 0.00 0.00 177.40 174.51 1new n THR 51 N 5.40 0.02 -0.10 -0.18 5.66 -1.26 -4.58 114.28 119.24 1new n THR 51 Ca 0.45 0.01 -0.06 0.00 -3.05 0.00 0.00 64.05 61.40 1new n THR 51 Cb 0.29 -0.21 0.02 0.00 -1.55 0.00 0.00 70.33 68.88 1new n THR 51 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1new h HIS 53 N 0.11 0.18 -0.39 0.00 -0.00 -1.88 0.21 115.15 113.39 1new h HIS 53 Ca 0.17 0.01 0.02 0.00 -0.00 0.00 0.00 60.37 60.57 1new h HIS 53 Cb 0.23 -0.05 -0.03 0.00 -0.00 0.00 0.00 27.41 27.56 1new h HIS 53 CO -0.24 0.01 0.21 0.87 -0.00 0.00 0.00 177.93 178.78 1new h LYS 54 N 0.10 0.42 -2.37 2.45 1.57 -1.59 -3.09 116.57 114.05 1new h LYS 54 Ca 0.59 -0.03 -0.43 0.00 -1.87 0.00 0.00 60.65 58.91 1new h LYS 54 Cb 2.12 -0.10 -0.06 0.00 0.08 0.00 0.00 32.23 34.28 1new h LYS 54 CO -0.09 0.28 1.31 0.45 -0.57 0.00 0.00 179.45 180.82 1new n SER 55 N -4.89 6.77 -1.47 0.86 2.88 0.75 -4.83 113.62 113.69 1new n SER 55 Ca 0.01 -2.66 -0.01 0.00 -1.33 0.00 0.00 58.87 54.88 1new n SER 55 Cb 0.07 -1.43 0.00 0.00 -0.75 0.00 0.00 64.21 62.10 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 2.56 -0.38 -4.52 -3.46 2.85 -1.17 -5.05 115.26 106.09 1new n ASN 56 Ca 0.57 -1.21 -0.24 0.00 -0.11 0.00 0.00 54.58 53.59 1new n ASN 56 Cb 0.59 0.61 -0.09 0.00 1.24 0.00 0.00 39.78 42.13 1new n ASN 56 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 1new s ASN 57 N -1.50 3.90 0.66 1.20 4.22 -1.26 -4.96 114.94 117.19 1new s ASN 57 Ca 0.05 -0.86 0.00 0.00 -2.14 0.00 0.00 52.86 49.91 1new s ASN 57 Cb -0.01 -0.49 0.00 0.00 1.28 0.00 0.00 41.25 42.04 1new s ASN 57 CO 0.01 0.05 0.00 0.61 -2.04 0.00 0.00 177.10 175.73 1new n GLY 58 N -0.52 0.61 2.78 0.45 0.00 -1.26 -4.58 105.19 102.66 1new n GLY 58 Ca -0.07 -0.92 -0.39 0.00 0.00 0.00 0.00 46.02 44.64 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 7.93 2.38 -1.12 1.61 -0.04 -1.26 -4.57 135.00 139.94 1new n PRO 59 Ca 0.00 -2.09 -0.12 0.00 -0.04 0.00 0.00 63.50 61.25 1new n PRO 59 Cb 0.00 -2.95 0.15 0.00 -0.04 0.00 0.00 33.50 30.66 1new n PRO 59 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1new n THR 60 N 5.05 2.69 -3.64 0.52 -2.24 -1.26 -4.18 114.28 111.22 1new n THR 60 Ca 0.54 -3.06 -0.07 0.00 -2.27 0.00 0.00 64.05 59.19 1new n THR 60 Cb 0.33 -0.58 0.02 0.00 -2.10 0.00 0.00 70.33 68.00 1new n THR 60 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 1new n LYS 61 N -1.03 0.82 0.38 -0.78 2.85 -1.26 -4.64 118.16 114.51 1new n LYS 61 Ca 0.39 -1.73 -0.15 0.00 -1.05 0.00 0.00 58.31 55.77 1new n LYS 61 Cb 1.00 2.09 -0.07 0.00 -0.65 0.00 0.00 35.03 37.39 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 -1.01 2.83 0.00 0.00 0.00 -1.26 -4.12 105.19 101.62 1new n GLY 63 Ca -0.12 -1.32 0.00 0.00 0.00 0.00 0.00 46.02 44.58 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 4.47 0.43 0.20 -0.02 0.00 -1.06 -4.84 105.19 104.36 1new n GLY 64 Ca 0.50 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.42 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 -3.81 2.04 -1.49 0.00 3.76 -1.26 -4.29 115.29 110.25 1new s HIS 66 Ca -0.07 0.16 -0.13 0.00 -0.15 0.00 0.00 55.06 54.87 1new s HIS 66 Cb 0.11 -4.29 -0.02 0.00 1.11 0.00 0.00 32.58 29.49 1new s HIS 66 CO 0.84 -1.90 2.50 1.51 -0.85 0.00 0.00 174.74 176.84 1new n ILE 67 N 7.39 3.70 -0.77 0.60 3.06 -0.89 -4.72 119.36 127.73 1new n ILE 67 Ca 0.33 -2.75 0.00 0.00 -2.50 0.00 0.00 62.75 57.83 1new n ILE 67 Cb 0.49 -2.59 0.00 0.00 0.54 0.00 0.00 39.64 38.08 1new n ILE 67 CO 0.00 0.00 0.00 1.17 -2.50 0.00 0.00 176.55 175.22