#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c01 s ALA 2 N 0.00 3.61 0.63 -1.46 0.00 -0.40 -4.80 121.76 119.35 1c01 s ALA 2 Ca 0.00 -0.03 0.01 0.00 0.00 0.00 0.00 51.96 51.94 1c01 s ALA 2 Cb 0.00 -3.31 0.08 0.00 0.00 0.00 0.00 23.12 19.88 1c01 s ALA 2 CO 0.00 -0.86 0.88 0.12 0.00 0.00 0.00 175.76 175.90 1c01 s PHE 3 N 2.69 2.22 0.01 0.00 5.36 -0.93 -0.68 117.98 126.64 1c01 s PHE 3 Ca 0.37 -0.15 -0.27 0.00 -0.96 0.00 0.00 56.93 55.92 1c01 s PHE 3 Cb -0.16 -2.84 0.06 0.00 -0.34 0.00 0.00 43.02 39.74 1c01 s PHE 3 CO 0.09 -1.27 0.62 0.99 -1.46 0.00 0.00 175.22 174.18 1c01 s THR 4 N -2.94 0.01 0.09 0.12 2.01 0.21 -1.06 115.64 114.08 1c01 s THR 4 Ca 0.62 -0.07 -0.14 0.00 0.31 0.00 0.00 61.69 62.41 1c01 s THR 4 Cb -0.08 -0.98 0.02 0.00 0.01 0.00 0.00 72.50 71.48 1c01 s THR 4 CO 0.41 -0.04 0.32 0.68 -0.69 0.00 0.00 174.62 175.31 1c01 s VAL 5 N -1.93 0.09 0.03 3.82 -7.23 -0.43 -0.83 120.40 113.92 1c01 s VAL 5 Ca -0.08 -0.75 0.04 0.00 -1.81 0.00 0.00 61.98 59.38 1c01 s VAL 5 Cb -0.01 -1.13 -0.02 0.00 0.56 0.00 0.00 36.38 35.78 1c01 s VAL 5 CO 0.03 -0.41 -0.11 0.26 -0.31 0.00 0.00 175.10 174.56 1c01 s TRP 6 N -3.37 0.97 0.26 2.82 0.51 0.10 -1.67 118.94 118.56 1c01 s TRP 6 Ca 0.01 -0.35 -0.02 0.00 -2.12 0.00 0.00 56.10 53.62 1c01 s TRP 6 Cb 0.02 -0.58 0.51 0.00 -0.81 0.00 0.00 33.47 32.61 1c01 s TRP 6 CO -0.09 -0.00 1.76 0.66 -0.51 0.00 0.00 176.95 178.78 1c01 h SER 7 N 5.00 0.52 -2.98 2.95 4.64 -1.71 -1.73 113.55 120.24 1c01 h SER 7 Ca -0.36 0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 1c01 h SER 7 Cb 1.19 0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1c01 h SER 7 CO 0.44 0.23 0.00 0.61 -0.87 0.00 0.00 176.83 177.24 1c01 n GLY 8 N -1.32 4.34 0.05 -0.77 0.00 -1.26 -1.78 105.19 104.44 1c01 n GLY 8 Ca 0.16 -1.12 -0.01 0.00 0.00 0.00 0.00 46.02 45.05 1c01 n GLY 8 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1c01 h PRO 9 N 0.00 0.00 0.00 1.61 0.13 -1.92 -3.41 132.00 128.41 1c01 h PRO 9 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1c01 h PRO 9 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1c01 h PRO 9 CO 0.00 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.18 1c01 n GLY 10 N 1.76 1.58 2.37 1.56 0.00 -1.26 -3.48 105.19 107.72 1c01 n GLY 10 Ca -0.01 -1.64 -0.28 0.00 0.00 0.00 0.00 46.02 44.08 1c01 n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c01 n ASN 12 N 0.04 0.00 0.00 0.00 3.02 -1.26 -4.98 115.26 112.07 1c01 n ASN 12 Ca 0.48 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 55.03 1c01 n ASN 12 Cb 0.52 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.69 1c01 n ASN 12 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 1c01 n ASN 13 N 0.00 0.00 -4.70 6.41 0.23 -1.26 -4.38 115.26 111.55 1c01 n ASN 13 Ca 0.00 0.00 -0.42 0.00 -0.53 0.00 0.00 54.58 53.63 1c01 n ASN 13 Cb 0.00 0.00 -0.03 0.00 -2.08 0.00 0.00 39.78 37.67 1c01 n ASN 13 CO 0.00 0.00 0.00 -0.60 -0.93 0.00 0.00 177.26 175.73 1c01 s ARG 14 N 0.00 4.45 0.24 -3.83 6.06 -1.26 -4.93 118.95 119.68 1c01 s ARG 14 Ca 0.00 1.60 -0.03 0.00 -2.50 0.00 0.00 55.73 54.80 1c01 s ARG 14 Cb 0.00 -3.45 -0.05 0.00 0.06 0.00 0.00 34.95 31.51 1c01 s ARG 14 CO 0.00 -0.25 0.47 0.00 -2.50 0.00 0.00 175.30 173.02 1c01 s ALA 15 N 1.45 3.72 -0.30 6.12 0.00 -1.26 -2.22 121.76 129.26 1c01 s ALA 15 Ca 0.55 -0.66 -0.10 0.00 0.00 0.00 0.00 51.96 51.75 1c01 s ALA 15 Cb -0.25 -2.16 0.14 0.00 0.00 0.00 0.00 23.12 20.86 1c01 s ALA 15 CO 0.26 0.37 0.70 -2.00 0.00 0.00 0.00 175.76 175.09 1c01 s GLU 16 N -3.35 0.53 0.44 0.00 2.12 -0.67 -4.99 118.70 112.78 1c01 s GLU 16 Ca 0.41 1.28 -0.08 0.00 0.36 0.00 0.00 54.97 56.94 1c01 s GLU 16 Cb -0.11 0.76 -0.05 0.00 0.26 0.00 0.00 34.13 34.99 1c01 s GLU 16 CO 0.29 -0.24 0.79 0.50 -0.54 0.00 0.00 175.26 176.05 1c01 s ARG 17 N 2.83 3.67 -0.41 4.30 3.52 -1.26 -1.31 118.95 130.29 1c01 s ARG 17 Ca -0.02 0.37 0.10 0.00 -0.13 0.00 0.00 55.73 56.06 1c01 s ARG 17 Cb -0.12 -2.37 0.33 0.00 -1.56 0.00 0.00 34.95 31.24 1c01 s ARG 17 CO -0.19 -0.13 0.74 0.66 -0.81 0.00 0.00 175.30 175.57 1c01 n TYR 18 N -1.75 0.78 0.63 5.12 4.02 -0.22 -4.89 117.16 120.85 1c01 n TYR 18 Ca 0.02 -3.82 0.10 0.00 -0.01 0.00 0.00 57.90 54.19 1c01 n TYR 18 Cb 0.54 -0.43 0.27 0.00 -0.02 0.00 0.00 39.34 39.71 1c01 n TYR 18 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 1c01 n SER 19 N 0.36 2.63 -4.65 7.72 3.41 -1.26 -2.20 113.62 119.63 1c01 n SER 19 Ca 0.26 -1.90 -0.42 0.00 -0.26 0.00 0.00 58.87 56.54 1c01 n SER 19 Cb 0.60 -0.23 -0.03 0.00 -0.26 0.00 0.00 64.21 64.28 1c01 n SER 19 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1c01 s LYS 20 N -1.53 4.00 -0.39 4.33 1.02 -1.26 -4.84 119.74 121.07 1c01 s LYS 20 Ca 0.35 2.29 -0.27 0.00 0.02 0.00 0.00 55.97 58.37 1c01 s LYS 20 Cb 0.19 -4.11 -0.06 0.00 -0.52 0.00 0.00 37.83 33.33 1c01 s LYS 20 CO 0.27 -1.09 2.35 0.00 -0.92 0.00 0.00 175.35 175.96 1c01 n GLY 22 N 5.92 0.54 3.82 0.00 0.00 -0.02 -4.85 105.19 110.60 1c01 n GLY 22 Ca 0.34 -2.20 -0.33 0.00 0.00 0.00 0.00 46.02 43.83 1c01 n GLY 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c01 s SER 24 N -2.22 -0.90 -0.32 0.00 1.04 -0.57 -4.96 113.70 105.77 1c01 s SER 24 Ca 0.62 1.49 -0.29 0.00 0.48 0.00 0.00 55.95 58.25 1c01 s SER 24 Cb -0.09 1.40 0.01 0.00 0.10 0.00 0.00 66.02 67.44 1c01 s SER 24 CO 0.14 -0.24 1.12 0.00 0.98 0.00 0.00 173.24 175.24 1c01 s ALA 25 N 1.37 3.46 -0.55 5.32 0.00 -1.26 -0.96 121.76 129.13 1c01 s ALA 25 Ca -0.08 -0.04 -0.24 0.00 0.00 0.00 0.00 51.96 51.60 1c01 s ALA 25 Cb -0.05 -3.70 0.04 0.00 0.00 0.00 0.00 23.12 19.41 1c01 s ALA 25 CO -0.15 -1.57 0.95 0.96 0.00 0.00 0.00 175.76 175.95 1c01 s ILE 26 N 3.81 4.37 -0.40 0.00 -4.36 -1.24 -4.88 121.20 118.50 1c01 s ILE 26 Ca 0.48 0.30 0.22 0.00 -0.26 0.00 0.00 60.65 61.39 1c01 s ILE 26 Cb -0.13 -4.55 -0.19 0.00 1.25 0.00 0.00 42.46 38.84 1c01 s ILE 26 CO 0.18 -1.13 0.83 1.41 0.24 0.00 0.00 174.94 176.47 1c01 n HIS 27 N 7.51 0.25 -2.36 1.37 8.25 -1.26 -4.67 115.22 124.30 1c01 n HIS 27 Ca 0.02 0.07 -0.38 0.00 -0.26 0.00 0.00 57.72 57.18 1c01 n HIS 27 Cb 0.47 -0.48 -0.03 0.00 1.12 0.00 0.00 29.99 31.07 1c01 n HIS 27 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 1c01 s GLN 28 N -3.31 3.09 -1.51 -0.41 1.11 -1.26 -4.88 119.66 112.49 1c01 s GLN 28 Ca -0.00 -0.38 -0.08 0.00 0.01 0.00 0.00 55.36 54.91 1c01 s GLN 28 Cb 0.14 -4.77 -0.01 0.00 -1.01 0.00 0.00 33.01 27.36 1c01 s GLN 28 CO 0.84 -2.52 2.73 1.63 0.01 0.00 0.00 175.29 177.98 1c01 n LYS 29 N 9.08 4.03 0.00 2.91 5.02 -1.23 -4.43 118.16 133.54 1c01 n LYS 29 Ca 0.23 -2.69 0.00 0.00 -2.02 0.00 0.00 58.31 53.83 1c01 n LYS 29 Cb 0.50 -2.75 0.00 0.00 -0.02 0.00 0.00 35.03 32.76 1c01 n LYS 29 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1c01 n GLY 30 N 2.89 0.55 3.38 0.72 0.00 -0.70 -4.51 105.19 107.52 1c01 n GLY 30 Ca 0.72 -0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.55 1c01 n GLY 30 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1c01 s GLY 31 N -1.00 1.86 -0.28 -0.02 0.00 -0.67 -2.39 107.32 104.82 1c01 s GLY 31 Ca 0.00 -1.94 -0.21 0.00 0.00 0.00 0.00 44.72 42.57 1c01 s GLY 31 CO 0.00 -1.71 0.77 -2.52 0.00 0.00 0.00 173.10 169.64 1c01 s TYR 32 N -3.48 -0.84 0.26 1.90 1.13 -0.69 -0.72 117.35 114.90 1c01 s TYR 32 Ca 0.35 1.85 0.11 0.00 -1.41 0.00 0.00 57.07 57.98 1c01 s TYR 32 Cb 0.08 0.43 -0.05 0.00 -1.10 0.00 0.00 41.96 41.32 1c01 s TYR 32 CO 0.14 -0.41 -0.14 0.34 -2.51 0.00 0.00 175.55 172.96 1c01 s ASP 33 N 0.92 3.89 0.14 -0.18 2.15 -0.01 -0.99 116.67 122.60 1c01 s ASP 33 Ca -0.04 -0.86 0.05 0.00 0.43 0.00 0.00 52.55 52.13 1c01 s ASP 33 Cb -0.05 -0.48 -0.04 0.00 -0.30 0.00 0.00 42.92 42.05 1c01 s ASP 33 CO -0.09 0.05 -0.12 0.12 -0.17 0.00 0.00 175.17 174.95 1c01 s PHE 34 N -2.28 1.37 -0.29 -5.34 5.36 0.12 0.65 117.98 117.58 1c01 s PHE 34 Ca 0.29 -0.64 -0.01 0.00 -0.96 0.00 0.00 56.93 55.62 1c01 s PHE 34 Cb -0.06 -0.70 0.13 0.00 -0.34 0.00 0.00 43.02 42.06 1c01 s PHE 34 CO 0.16 0.14 0.29 0.45 -1.46 0.00 0.00 175.22 174.80 1c01 s SER 35 N -2.83 1.72 0.39 6.13 0.15 0.14 -1.35 113.70 118.06 1c01 s SER 35 Ca 0.13 -0.75 -0.21 0.00 0.70 0.00 0.00 55.95 55.82 1c01 s SER 35 Cb -0.02 0.48 -0.10 0.00 -1.71 0.00 0.00 66.02 64.67 1c01 s SER 35 CO 0.02 -0.39 0.91 -0.47 1.20 0.00 0.00 173.24 174.51 1c01 s TYR 36 N 2.35 3.38 0.00 3.44 6.14 -1.26 -0.30 117.35 131.11 1c01 s TYR 36 Ca 0.09 1.56 0.00 0.00 0.64 0.00 0.00 57.07 59.36 1c01 s TYR 36 Cb -0.14 -2.80 0.00 0.00 0.42 0.00 0.00 41.96 39.44 1c01 s TYR 36 CO -0.33 -0.02 0.00 -2.37 0.64 0.00 0.00 175.55 173.47 1c01 n THR 37 N -0.40 0.00 0.00 4.34 5.66 -1.26 -4.55 114.28 118.07 1c01 n THR 37 Ca 0.05 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.05 1c01 n THR 37 Cb 0.53 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.31 1c01 n THR 37 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1c01 n GLY 38 N -0.00 -0.01 3.22 1.09 0.00 -1.26 -4.91 105.19 103.32 1c01 n GLY 38 Ca 0.00 -0.04 -0.13 0.00 0.00 0.00 0.00 46.02 45.85 1c01 n GLY 38 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1c01 s GLN 39 N -1.32 1.13 0.39 1.61 -1.52 -1.26 -4.99 119.66 113.70 1c01 s GLN 39 Ca 0.00 -1.57 -0.03 0.00 -1.95 0.00 0.00 55.36 51.81 1c01 s GLN 39 Cb 0.00 -0.01 0.08 0.00 -0.22 0.00 0.00 33.01 32.86 1c01 s GLN 39 CO 0.00 -0.25 0.53 0.25 -0.25 0.00 0.00 175.29 175.57 1c01 n THR 40 N -0.25 0.00 -3.36 -0.19 -2.24 -1.26 -3.95 114.28 103.03 1c01 n THR 40 Ca -0.03 -0.63 -0.00 0.00 -2.27 0.00 0.00 64.05 61.11 1c01 n THR 40 Cb 0.64 -1.39 -0.04 0.00 -2.10 0.00 0.00 70.33 67.45 1c01 n THR 40 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1c01 s ALA 41 N -3.35 -1.94 0.57 6.98 0.00 -0.38 -1.79 121.76 121.84 1c01 s ALA 41 Ca 0.33 1.83 -0.14 0.00 0.00 0.00 0.00 51.96 53.98 1c01 s ALA 41 Cb -0.01 -1.92 -0.06 0.00 0.00 0.00 0.00 23.12 21.13 1c01 s ALA 41 CO 0.22 -1.16 1.01 0.00 0.00 0.00 0.00 175.76 175.83 1c01 s ALA 42 N 2.81 3.06 -0.40 0.00 0.00 -0.95 -0.78 121.76 125.50 1c01 s ALA 42 Ca 0.10 0.07 0.02 0.00 0.00 0.00 0.00 51.96 52.15 1c01 s ALA 42 Cb -0.14 -3.11 0.12 0.00 0.00 0.00 0.00 23.12 19.99 1c01 s ALA 42 CO -0.19 -0.48 0.17 -1.17 0.00 0.00 0.00 175.76 174.08 1c01 s LEU 43 N -4.61 3.33 0.27 0.00 2.96 -1.26 -1.48 118.68 117.88 1c01 s LEU 43 Ca 0.57 -2.35 -0.29 0.00 -0.22 0.00 0.00 54.13 51.85 1c01 s LEU 43 Cb -0.11 -1.23 -0.09 0.00 0.50 0.00 0.00 46.19 45.26 1c01 s LEU 43 CO 0.42 -0.32 0.95 -0.31 -1.32 0.00 0.00 176.35 175.76 1c01 s TYR 44 N 0.67 3.88 -0.28 5.38 1.51 -0.06 -0.28 117.35 128.18 1c01 s TYR 44 Ca 0.14 1.87 0.12 0.00 -1.01 0.00 0.00 57.07 58.19 1c01 s TYR 44 Cb -0.22 -2.97 0.71 0.00 -0.11 0.00 0.00 41.96 39.37 1c01 s TYR 44 CO -0.08 0.36 1.71 -1.71 -1.11 0.00 0.00 175.55 174.71 1c01 n ASN 45 N 1.18 4.67 -4.07 2.29 2.85 -1.24 -1.80 115.26 119.14 1c01 n ASN 45 Ca -0.01 -3.18 -0.19 0.00 -0.11 0.00 0.00 54.58 51.09 1c01 n ASN 45 Cb 0.48 -0.69 -0.14 0.00 1.24 0.00 0.00 39.78 40.66 1c01 n ASN 45 CO 0.00 0.00 0.00 -1.10 -2.11 0.00 0.00 177.26 174.05 1c01 s GLN 46 N -2.95 0.85 0.19 1.20 1.11 -1.26 -4.46 119.66 114.34 1c01 s GLN 46 Ca 0.52 -0.47 -0.33 0.00 0.01 0.00 0.00 55.36 55.09 1c01 s GLN 46 Cb 0.42 -0.82 -0.14 0.00 -1.01 0.00 0.00 33.01 31.45 1c01 s GLN 46 CO 0.12 0.22 1.40 0.00 0.01 0.00 0.00 175.29 177.04 1c01 n ALA 47 N 2.57 0.56 -2.33 6.09 0.00 -1.26 -1.71 120.51 124.43 1c01 n ALA 47 Ca -0.15 0.44 -0.21 0.00 0.00 0.00 0.00 53.44 53.53 1c01 n ALA 47 Cb 0.56 -2.22 -0.02 0.00 0.00 0.00 0.00 19.45 17.77 1c01 n ALA 47 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1c01 n GLY 48 N 2.49 -0.28 2.41 0.00 0.00 -1.26 -2.25 105.19 106.30 1c01 n GLY 48 Ca 0.14 -0.02 -0.15 0.00 0.00 0.00 0.00 46.02 46.00 1c01 n GLY 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c01 n SER 50 N -1.77 6.43 0.00 0.00 3.41 -0.96 -4.74 113.62 115.99 1c01 n SER 50 Ca -0.18 -2.89 0.00 0.00 -0.26 0.00 0.00 58.87 55.54 1c01 n SER 50 Cb 0.62 -1.34 0.00 0.00 -0.26 0.00 0.00 64.21 63.23 1c01 n SER 50 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1c01 n GLY 51 N 1.78 2.32 3.04 5.00 0.00 -1.26 -4.88 105.19 111.19 1c01 n GLY 51 Ca 0.51 0.22 -0.12 0.00 0.00 0.00 0.00 46.02 46.63 1c01 n GLY 51 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1c01 s VAL 52 N 1.84 0.42 1.31 1.61 1.01 -1.26 -5.08 120.40 120.25 1c01 s VAL 52 Ca 0.00 -1.05 -0.21 0.00 0.00 0.00 0.00 61.98 60.72 1c01 s VAL 52 Cb 0.00 -0.53 0.33 0.00 0.00 0.00 0.00 36.38 36.18 1c01 s VAL 52 CO 0.00 -0.42 1.04 0.00 0.00 0.00 0.00 175.10 175.72 1c01 s ALA 53 N -1.44 0.07 0.01 5.51 0.00 -1.26 -3.73 121.76 120.91 1c01 s ALA 53 Ca -0.11 -0.95 0.00 0.00 0.00 0.00 0.00 51.96 50.89 1c01 s ALA 53 Cb -0.10 -2.88 0.00 0.00 0.00 0.00 0.00 23.12 20.14 1c01 s ALA 53 CO -0.00 -4.05 0.00 1.58 0.00 0.00 0.00 175.76 173.29 1c01 n HIS 54 N -5.16 -0.12 -3.86 0.00 -0.00 0.62 -4.84 115.22 101.87 1c01 n HIS 54 Ca 0.14 0.02 -0.30 0.00 -0.00 0.00 0.00 57.72 57.58 1c01 n HIS 54 Cb 0.60 0.49 -0.12 0.00 -0.00 0.00 0.00 29.99 30.96 1c01 n HIS 54 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.34 177.33 1c01 s THR 55 N -1.05 3.10 0.81 3.57 2.01 -1.26 -4.95 115.64 117.87 1c01 s THR 55 Ca 0.00 -3.93 -0.11 0.00 0.31 0.00 0.00 61.69 57.96 1c01 s THR 55 Cb 0.00 -3.03 0.08 0.00 0.01 0.00 0.00 72.50 69.56 1c01 s THR 55 CO 0.00 -0.96 1.09 -0.60 -0.69 0.00 0.00 174.62 173.46 1c01 s ARG 56 N -1.10 1.93 -0.03 4.92 3.00 -1.26 -4.23 118.95 122.19 1c01 s ARG 56 Ca 0.23 0.99 0.03 0.00 -1.00 0.00 0.00 55.73 55.97 1c01 s ARG 56 Cb -0.11 -1.87 0.00 0.00 0.00 0.00 0.00 34.95 32.97 1c01 s ARG 56 CO -0.11 -1.82 -0.10 -0.06 0.00 0.00 0.00 175.30 173.20 1c01 s PHE 57 N -2.94 1.09 0.00 5.12 0.08 0.04 -4.97 117.98 116.39 1c01 s PHE 57 Ca 0.62 -0.28 0.00 0.00 0.12 0.00 0.00 56.93 57.39 1c01 s PHE 57 Cb -0.17 -0.76 0.00 0.00 -0.57 0.00 0.00 43.02 41.52 1c01 s PHE 57 CO 0.56 -0.11 0.15 0.41 -0.10 0.00 0.00 175.22 176.13 1c01 n GLY 58 N 3.26 0.23 3.34 4.36 0.00 -1.26 -1.25 105.19 113.87 1c01 n GLY 58 Ca -0.18 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.72 1c01 n GLY 58 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1c01 s SER 59 N -0.11 -0.50 -0.45 1.61 0.01 -1.26 -4.83 113.70 108.17 1c01 s SER 59 Ca 0.00 0.93 -0.40 0.00 1.31 0.00 0.00 55.95 57.79 1c01 s SER 59 Cb 0.00 0.90 -0.17 0.00 0.21 0.00 0.00 66.02 66.96 1c01 s SER 59 CO 0.00 -0.17 1.82 -1.20 0.41 0.00 0.00 173.24 174.10 1c01 n SER 60 N 3.29 0.77 -3.99 2.44 7.64 -1.26 -4.62 113.62 117.89 1c01 n SER 60 Ca -0.16 0.72 -0.31 0.00 1.01 0.00 0.00 58.87 60.13 1c01 n SER 60 Cb 0.56 -0.81 -0.15 0.00 -1.01 0.00 0.00 64.21 62.80 1c01 n SER 60 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1c01 s ALA 61 N 4.79 2.38 -1.37 -0.43 0.00 -0.45 -4.90 121.76 121.77 1c01 s ALA 61 Ca 1.05 -1.81 -0.16 0.00 0.00 0.00 0.00 51.96 51.04 1c01 s ALA 61 Cb -1.35 -1.63 0.06 0.00 0.00 0.00 0.00 23.12 20.20 1c01 s ALA 61 CO 0.63 -1.35 1.95 0.54 0.00 0.00 0.00 175.76 177.53 1c01 n ARG 62 N 4.50 3.07 -2.73 0.00 1.74 -1.26 -0.70 116.66 121.27 1c01 n ARG 62 Ca -0.08 -3.01 -0.24 0.00 -0.77 0.00 0.00 57.85 53.75 1c01 n ARG 62 Cb 0.43 -3.37 0.02 0.00 -1.02 0.00 0.00 32.46 28.52 1c01 n ARG 62 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1c01 s ALA 63 N 3.53 3.60 0.00 7.54 0.00 -0.16 -4.92 121.76 131.35 1c01 s ALA 63 Ca 0.50 -0.96 0.00 0.00 0.00 0.00 0.00 51.96 51.50 1c01 s ALA 63 Cb 0.08 -2.30 0.00 0.00 0.00 0.00 0.00 23.12 20.90 1c01 s ALA 63 CO -0.00 -0.58 0.12 0.00 0.00 0.00 0.00 175.76 175.30 1c01 s ASN 65 N 0.00 5.34 0.62 0.00 -0.87 -1.26 -3.85 114.94 114.92 1c01 s ASN 65 Ca 0.00 2.12 -0.18 0.00 -1.57 0.00 0.00 52.86 53.23 1c01 s ASN 65 Cb 0.00 -2.57 -0.02 0.00 -0.02 0.00 0.00 41.25 38.64 1c01 s ASN 65 CO 0.00 -1.48 1.25 -2.16 -2.57 0.00 0.00 177.10 172.14 1c01 s PRO 66 N -3.68 2.73 0.10 -0.60 0.04 -1.01 -4.18 135.00 128.41 1c01 s PRO 66 Ca 0.71 1.95 -0.02 0.00 0.04 0.00 0.00 61.00 63.67 1c01 s PRO 66 Cb -0.23 -1.88 0.01 0.00 0.04 0.00 0.00 34.50 32.44 1c01 s PRO 66 CO 0.35 -1.43 0.17 1.97 0.04 0.00 0.00 177.00 178.10 1c01 n PHE 67 N -1.78 -1.05 -2.72 0.56 -1.74 -1.26 -5.01 117.46 104.45 1c01 n PHE 67 Ca 0.15 -0.57 -0.08 0.00 -0.56 0.00 0.00 57.45 56.38 1c01 n PHE 67 Cb 0.49 0.20 0.10 0.00 1.52 0.00 0.00 39.48 41.79 1c01 n PHE 67 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 1c01 n GLY 68 N -0.15 1.05 3.86 4.97 0.00 -1.26 -4.79 105.19 108.87 1c01 n GLY 68 Ca -0.01 -0.11 -0.32 0.00 0.00 0.00 0.00 46.02 45.57 1c01 n GLY 68 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1c01 s TRP 69 N 0.10 3.40 -0.22 1.61 0.51 -1.26 -4.94 118.94 118.15 1c01 s TRP 69 Ca 0.22 1.03 0.19 0.00 -2.12 0.00 0.00 56.10 55.43 1c01 s TRP 69 Cb 0.35 -2.39 0.03 0.00 -0.81 0.00 0.00 33.47 30.66 1c01 s TRP 69 CO -0.07 0.17 1.17 0.87 -0.51 0.00 0.00 176.95 178.58 1c01 h LYS 70 N 2.33 0.00 -1.43 4.98 6.56 -1.57 -3.41 116.57 124.02 1c01 h LYS 70 Ca -0.47 0.00 0.31 0.00 -1.06 0.00 0.00 60.65 59.43 1c01 h LYS 70 Cb 1.17 0.00 -0.14 0.00 -0.57 0.00 0.00 32.23 32.70 1c01 h LYS 70 CO 0.67 0.20 0.83 -1.54 -2.06 0.00 0.00 179.45 177.55 1c01 s SER 71 N -5.88 -0.07 -0.06 0.86 1.04 -0.84 -3.59 113.70 105.16 1c01 s SER 71 Ca 0.01 -0.10 0.02 0.00 0.48 0.00 0.00 55.95 56.36 1c01 s SER 71 Cb 0.08 0.15 0.02 0.00 0.10 0.00 0.00 66.02 66.37 1c01 s SER 71 CO 0.76 -0.27 -0.10 -0.51 0.98 0.00 0.00 173.24 174.10 1c01 s ILE 72 N -2.41 0.93 -0.69 -1.02 2.07 -0.14 -0.88 121.20 119.06 1c01 s ILE 72 Ca 0.13 -0.36 -0.12 0.00 -1.41 0.00 0.00 60.65 58.89 1c01 s ILE 72 Cb 0.04 -0.87 0.18 0.00 0.13 0.00 0.00 42.46 41.94 1c01 s ILE 72 CO -0.04 0.31 0.61 0.12 -1.91 0.00 0.00 174.94 174.03 1c01 s PHE 73 N 0.71 3.57 -0.30 3.50 5.36 -0.55 -1.52 117.98 128.75 1c01 s PHE 73 Ca -0.13 -1.97 -0.29 0.00 -0.96 0.00 0.00 56.93 53.58 1c01 s PHE 73 Cb -0.15 -3.67 -0.01 0.00 -0.34 0.00 0.00 43.02 38.85 1c01 s PHE 73 CO 0.02 -0.97 1.49 0.42 -1.46 0.00 0.00 175.22 174.73 1c01 s ILE 74 N 0.55 3.85 -0.31 3.12 -1.09 -0.17 -2.23 121.20 124.92 1c01 s ILE 74 Ca 0.13 0.94 -0.28 0.00 -2.23 0.00 0.00 60.65 59.21 1c01 s ILE 74 Cb -0.18 -3.95 -0.03 0.00 -1.58 0.00 0.00 42.46 36.72 1c01 s ILE 74 CO -0.05 -0.46 2.01 -1.10 -1.23 0.00 0.00 174.94 174.12 1c01 s GLN 75 N 4.67 3.14 0.00 2.79 -1.52 -0.74 -0.84 119.66 127.16 1c01 s GLN 75 Ca 0.65 1.63 0.00 0.00 -1.95 0.00 0.00 55.36 55.70 1c01 s GLN 75 Cb -0.20 -4.30 0.00 0.00 -0.22 0.00 0.00 33.01 28.29 1c01 s GLN 75 CO 0.28 -2.10 0.33 0.00 -0.25 0.00 0.00 175.29 173.56