#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 -1.93 -0.43 -1.46 0.00 -0.97 -4.75 121.76 112.22 1c01 s ALA 2 Ca 0.00 2.19 -0.14 0.00 0.00 0.00 0.00 51.96 54.01 1c01 s ALA 2 Cb 0.00 -1.40 0.05 0.00 0.00 0.00 0.00 23.12 21.78 1c01 s ALA 2 CO 0.00 -0.34 0.32 0.12 0.00 0.00 0.00 175.76 175.86 1c01 s PHE 3 N 1.00 3.26 0.25 0.00 5.36 -0.65 -1.17 117.98 126.04 1c01 s PHE 3 Ca -0.05 -0.95 -0.07 0.00 -0.96 0.00 0.00 56.93 54.90 1c01 s PHE 3 Cb -0.05 -2.88 -0.06 0.00 -0.34 0.00 0.00 43.02 39.69 1c01 s PHE 3 CO -0.11 -0.73 0.54 0.99 -1.46 0.00 0.00 175.22 174.45 1c01 s THR 4 N 1.60 4.99 0.02 0.12 2.01 0.55 -0.74 115.64 124.19 1c01 s THR 4 Ca 0.04 0.25 -0.21 0.00 0.31 0.00 0.00 61.69 62.08 1c01 s THR 4 Cb -0.22 -3.67 0.04 0.00 0.01 0.00 0.00 72.50 68.66 1c01 s THR 4 CO 0.07 -0.19 0.47 0.68 -0.69 0.00 0.00 174.62 174.95 1c01 s VAL 5 N -1.94 0.04 0.16 3.82 -7.23 -0.01 -0.61 120.40 114.62 1c01 s VAL 5 Ca 0.45 -0.33 0.10 0.00 -1.81 0.00 0.00 61.98 60.40 1c01 s VAL 5 Cb -0.11 -0.90 -0.04 0.00 0.56 0.00 0.00 36.38 35.89 1c01 s VAL 5 CO 0.26 -0.18 -0.22 0.26 -0.31 0.00 0.00 175.10 174.91 1c01 s TRP 6 N -2.00 2.05 0.13 2.82 0.51 -0.93 -0.64 118.94 120.87 1c01 s TRP 6 Ca -0.08 -0.41 -0.21 0.00 -2.12 0.00 0.00 56.10 53.28 1c01 s TRP 6 Cb -0.02 -1.05 -0.03 0.00 -0.81 0.00 0.00 33.47 31.57 1c01 s TRP 6 CO 0.01 0.37 1.70 1.03 -0.51 0.00 0.00 176.95 179.55 1c01 h SER 7 N 3.46 -0.26 0.00 2.95 0.87 -1.80 -0.16 113.55 118.61 1c01 h SER 7 Ca -0.45 0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.17 1c01 h SER 7 Cb 1.20 0.14 0.00 0.00 -0.44 0.00 0.00 62.40 63.30 1c01 h SER 7 CO 0.46 -0.10 0.00 0.61 -0.53 0.00 0.00 176.83 177.27 1c01 n GLY 8 N -1.22 2.94 0.06 5.77 0.00 -1.26 -1.61 105.19 109.86 1c01 n GLY 8 Ca -0.03 -0.64 -0.06 0.00 0.00 0.00 0.00 46.02 45.29 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 -3.39 132.00 128.44 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 0.40 0.00 0.41 -0.23 0.00 0.00 178.00 178.58 1c01 n GLY 10 N 1.71 2.26 1.95 1.56 0.00 -1.26 -3.97 105.19 107.44 1c01 n GLY 10 Ca -0.04 -1.08 -0.16 0.00 0.00 0.00 0.00 46.02 44.75 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 0.73 0.00 0.00 0.00 3.02 -1.26 -4.97 115.26 112.77 1c01 n ASN 12 Ca 0.30 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.85 1c01 n ASN 12 Cb 0.58 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.75 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 -4.90 6.41 0.23 -1.26 -4.60 115.26 111.14 1c01 n ASN 13 Ca 0.00 0.00 -0.28 0.00 -0.53 0.00 0.00 54.58 53.77 1c01 n ASN 13 Cb 0.00 0.00 -0.02 0.00 -2.08 0.00 0.00 39.78 37.68 1c01 n ASN 13 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1c01 s ARG 14 N 0.00 3.63 0.44 -3.83 1.70 -1.26 -4.97 118.95 114.67 1c01 s ARG 14 Ca 0.00 0.15 0.07 0.00 -0.47 0.00 0.00 55.73 55.48 1c01 s ARG 14 Cb 0.00 -2.50 -0.01 0.00 -0.57 0.00 0.00 34.95 31.87 1c01 s ARG 14 CO 0.00 0.02 0.40 0.00 -1.08 0.00 0.00 175.30 174.64 1c01 s ALA 15 N -2.37 4.14 -0.30 7.88 0.00 -1.26 -3.03 121.76 126.83 1c01 s ALA 15 Ca 0.46 -1.82 -0.16 0.00 0.00 0.00 0.00 51.96 50.44 1c01 s ALA 15 Cb -0.10 -0.99 0.17 0.00 0.00 0.00 0.00 23.12 22.20 1c01 s ALA 15 CO 0.35 -0.29 1.05 -2.00 0.00 0.00 0.00 175.76 174.87 1c01 s GLU 16 N -4.18 0.27 0.19 0.00 2.12 0.18 -4.93 118.70 112.35 1c01 s GLU 16 Ca 0.47 0.55 0.01 0.00 0.36 0.00 0.00 54.97 56.36 1c01 s GLU 16 Cb -0.03 0.20 -0.04 0.00 0.26 0.00 0.00 34.13 34.52 1c01 s GLU 16 CO 0.27 -0.07 0.35 1.03 -0.54 0.00 0.00 175.26 176.30 1c01 s ARG 17 N 1.77 3.48 -0.33 4.30 0.52 -1.26 -0.83 118.95 126.58 1c01 s ARG 17 Ca -0.06 -0.49 -0.01 0.00 -0.52 0.00 0.00 55.73 54.65 1c01 s ARG 17 Cb -0.04 -2.89 0.12 0.00 0.52 0.00 0.00 34.95 32.66 1c01 s ARG 17 CO -0.15 0.44 0.17 0.71 0.02 0.00 0.00 175.30 176.49 1c01 s TYR 18 N -1.84 0.79 -0.02 -0.53 1.51 0.08 -4.96 117.35 112.38 1c01 s TYR 18 Ca 0.36 -1.43 0.03 0.00 -1.01 0.00 0.00 57.07 55.03 1c01 s TYR 18 Cb -0.11 -1.08 0.05 0.00 -0.11 0.00 0.00 41.96 40.71 1c01 s TYR 18 CO 0.29 -0.83 0.86 -1.13 -1.11 0.00 0.00 175.55 173.63 1c01 n SER 19 N 4.54 1.02 -4.67 2.29 3.41 -1.26 -1.63 113.62 117.32 1c01 n SER 19 Ca 0.03 -1.86 -0.47 0.00 -0.26 0.00 0.00 58.87 56.31 1c01 n SER 19 Cb 0.39 -0.11 -0.04 0.00 -0.26 0.00 0.00 64.21 64.18 1c01 n SER 19 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1c01 n LYS 20 N -0.41 2.07 -2.03 4.33 0.00 -1.26 -4.83 118.16 116.04 1c01 n LYS 20 Ca 0.03 0.75 -0.31 0.00 0.00 0.00 0.00 58.31 58.77 1c01 n LYS 20 Cb 0.49 -2.52 -0.04 0.00 0.00 0.00 0.00 35.03 32.96 1c01 n LYS 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1c01 n GLY 22 N 6.37 0.24 3.61 0.00 0.00 -0.09 -4.99 105.19 110.33 1c01 n GLY 22 Ca 0.32 -0.16 -0.08 0.00 0.00 0.00 0.00 46.02 46.09 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 -2.76 -0.59 -0.07 0.00 1.04 -0.87 -4.96 113.70 105.49 1c01 s SER 24 Ca 0.07 0.72 -0.30 0.00 0.48 0.00 0.00 55.95 56.92 1c01 s SER 24 Cb -0.02 0.64 -0.02 0.00 0.10 0.00 0.00 66.02 66.72 1c01 s SER 24 CO -0.04 -0.52 1.03 0.00 0.98 0.00 0.00 173.24 174.69 1c01 s ALA 25 N -0.95 3.36 0.42 5.32 0.00 -1.26 -1.98 121.76 126.67 1c01 s ALA 25 Ca -0.10 0.46 -0.22 0.00 0.00 0.00 0.00 51.96 52.10 1c01 s ALA 25 Cb -0.02 -3.42 -0.10 0.00 0.00 0.00 0.00 23.12 19.58 1c01 s ALA 25 CO 0.08 -0.53 0.97 0.42 0.00 0.00 0.00 175.76 176.70 1c01 s ILE 26 N 1.77 4.21 0.00 0.00 1.01 0.08 -4.95 121.20 123.32 1c01 s ILE 26 Ca 0.50 1.46 0.00 0.00 0.00 0.00 0.00 60.65 62.61 1c01 s ILE 26 Cb -0.20 -3.64 0.00 0.00 0.01 0.00 0.00 42.46 38.63 1c01 s ILE 26 CO 0.21 -0.22 0.00 1.41 0.00 0.00 0.00 174.94 176.34 1c01 n HIS 27 N -0.48 0.00 -2.13 3.97 8.25 -1.26 -4.84 115.22 118.72 1c01 n HIS 27 Ca 0.07 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.16 1c01 n HIS 27 Cb 0.53 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.60 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 -1.75 2.73 -1.31 -0.41 -1.52 -1.26 -4.87 119.66 111.27 1c01 s GLN 28 Ca 0.00 0.23 -0.06 0.00 -1.95 0.00 0.00 55.36 53.58 1c01 s GLN 28 Cb 0.00 -4.55 0.13 0.00 -0.22 0.00 0.00 33.01 28.37 1c01 s GLN 28 CO 0.00 -2.77 2.31 1.17 -0.25 0.00 0.00 175.29 175.75 1c01 n LYS 29 N 9.13 4.50 0.00 2.91 4.81 -1.23 -4.51 118.16 133.78 1c01 n LYS 29 Ca 0.23 -3.50 0.00 0.00 -0.87 0.00 0.00 58.31 54.16 1c01 n LYS 29 Cb 0.51 -2.66 0.00 0.00 0.02 0.00 0.00 35.03 32.89 1c01 n LYS 29 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1c01 n GLY 30 N 1.81 0.42 3.87 3.14 0.00 -0.17 -4.44 105.19 109.83 1c01 n GLY 30 Ca 0.59 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.37 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 -1.02 1.51 -0.12 -0.02 0.00 0.74 -4.30 107.32 104.11 1c01 s GLY 31 Ca 0.00 -1.24 -0.04 0.00 0.00 0.00 0.00 44.72 43.44 1c01 s GLY 31 CO 0.00 -1.26 0.18 -0.19 0.00 0.00 0.00 173.10 171.83 1c01 s TYR 32 N -1.91 -0.21 0.13 1.90 2.02 -0.74 -2.18 117.35 116.35 1c01 s TYR 32 Ca 0.33 0.53 0.07 0.00 -0.37 0.00 0.00 57.07 57.63 1c01 s TYR 32 Cb -0.09 -0.28 -0.04 0.00 -0.40 0.00 0.00 41.96 41.15 1c01 s TYR 32 CO 0.26 -0.36 -0.17 0.34 -1.57 0.00 0.00 175.55 174.05 1c01 s ASP 33 N 2.31 2.35 0.09 2.29 2.15 0.22 -0.27 116.67 125.81 1c01 s ASP 33 Ca 0.04 -0.78 0.03 0.00 0.43 0.00 0.00 52.55 52.28 1c01 s ASP 33 Cb -0.13 -0.12 -0.04 0.00 -0.30 0.00 0.00 42.92 42.34 1c01 s ASP 33 CO -0.08 -0.04 -0.10 0.12 -0.17 0.00 0.00 175.17 174.90 1c01 s PHE 34 N -1.76 1.03 -0.03 -5.34 5.36 -0.12 -0.33 117.98 116.79 1c01 s PHE 34 Ca 0.09 -0.65 0.01 0.00 -0.96 0.00 0.00 56.93 55.42 1c01 s PHE 34 Cb -0.07 -0.57 0.02 0.00 -0.34 0.00 0.00 43.02 42.07 1c01 s PHE 34 CO 0.04 -0.01 -0.01 -1.54 -1.46 0.00 0.00 175.22 172.24 1c01 s SER 35 N -2.40 0.50 0.07 6.13 1.04 -0.32 -1.16 113.70 117.57 1c01 s SER 35 Ca 0.04 -0.05 0.04 0.00 0.48 0.00 0.00 55.95 56.47 1c01 s SER 35 Cb -0.03 -0.24 -0.04 0.00 0.10 0.00 0.00 66.02 65.81 1c01 s SER 35 CO -0.00 -0.07 -0.03 -0.47 0.98 0.00 0.00 173.24 173.65 1c01 s TYR 36 N 0.84 2.94 -0.39 5.02 5.04 -1.26 -2.30 117.35 127.24 1c01 s TYR 36 Ca -0.09 -0.04 0.06 0.00 -2.44 0.00 0.00 57.07 54.56 1c01 s TYR 36 Cb -0.12 -1.55 0.29 0.00 0.35 0.00 0.00 41.96 40.93 1c01 s TYR 36 CO -0.01 0.45 1.24 -2.37 -1.34 0.00 0.00 175.55 173.52 1c01 n THR 37 N 0.86 0.00 0.00 4.34 5.66 -1.26 -4.70 114.28 119.18 1c01 n THR 37 Ca -0.12 -1.17 0.00 0.00 -3.05 0.00 0.00 64.05 59.70 1c01 n THR 37 Cb 0.52 1.09 0.00 0.00 -1.55 0.00 0.00 70.33 70.39 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 -0.07 2.40 3.66 1.09 0.00 -1.26 -4.71 105.19 106.30 1c01 n GLY 38 Ca -0.05 -0.14 -0.42 0.00 0.00 0.00 0.00 46.02 45.40 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 0.00 4.25 0.56 1.61 1.11 -1.26 -5.04 119.66 120.88 1c01 s GLN 39 Ca 0.00 1.19 -0.00 0.00 0.01 0.00 0.00 55.36 56.56 1c01 s GLN 39 Cb 0.00 -3.63 0.03 0.00 -1.01 0.00 0.00 33.01 28.40 1c01 s GLN 39 CO 0.00 -0.54 0.79 0.99 0.01 0.00 0.00 175.29 176.55 1c01 s THR 40 N 2.89 2.89 -0.08 -0.19 2.01 -1.26 -4.67 115.64 117.23 1c01 s THR 40 Ca 0.41 -0.55 -0.22 0.00 0.31 0.00 0.00 61.69 61.64 1c01 s THR 40 Cb -0.15 -3.11 0.05 0.00 0.01 0.00 0.00 72.50 69.30 1c01 s THR 40 CO 0.08 -0.08 0.51 0.00 -0.69 0.00 0.00 174.62 174.44 1c01 s ALA 41 N -2.80 -1.31 0.10 7.40 0.00 -0.78 -3.10 121.76 121.26 1c01 s ALA 41 Ca 0.56 1.03 0.06 0.00 0.00 0.00 0.00 51.96 53.61 1c01 s ALA 41 Cb -0.10 -0.21 -0.04 0.00 0.00 0.00 0.00 23.12 22.76 1c01 s ALA 41 CO 0.39 -0.30 -0.03 0.00 0.00 0.00 0.00 175.76 175.82 1c01 s ALA 42 N -0.84 3.18 -0.27 0.00 0.00 -0.81 -1.09 121.76 121.92 1c01 s ALA 42 Ca -0.09 -1.17 0.03 0.00 0.00 0.00 0.00 51.96 50.73 1c01 s ALA 42 Cb -0.03 -1.08 0.07 0.00 0.00 0.00 0.00 23.12 22.07 1c01 s ALA 42 CO 0.06 0.67 -0.09 -1.17 0.00 0.00 0.00 175.76 175.23 1c01 s LEU 43 N -2.31 3.61 -0.19 0.00 2.96 0.71 -0.87 118.68 122.58 1c01 s LEU 43 Ca 0.24 -1.50 -0.21 0.00 -0.22 0.00 0.00 54.13 52.45 1c01 s LEU 43 Cb -0.11 -1.55 -0.03 0.00 0.50 0.00 0.00 46.19 45.00 1c01 s LEU 43 CO 0.17 -0.22 0.63 -0.31 -1.32 0.00 0.00 176.35 175.30 1c01 s TYR 44 N 1.08 3.39 0.18 5.38 2.02 -0.38 -1.61 117.35 127.42 1c01 s TYR 44 Ca -0.06 0.95 -0.11 0.00 -0.37 0.00 0.00 57.07 57.48 1c01 s TYR 44 Cb -0.20 -2.79 0.09 0.00 -0.40 0.00 0.00 41.96 38.66 1c01 s TYR 44 CO -0.05 -0.14 1.73 -0.97 -1.57 0.00 0.00 175.55 174.54 1c01 h ASN 45 N 7.40 0.91 -4.28 2.29 -0.73 -1.81 -2.58 115.58 116.77 1c01 h ASN 45 Ca -0.32 -0.19 -0.49 0.00 1.87 0.00 0.00 56.30 57.17 1c01 h ASN 45 Cb 1.15 -0.24 0.05 0.00 0.27 0.00 0.00 38.32 39.55 1c01 h ASN 45 CO 0.77 0.85 0.39 0.00 -0.37 0.00 0.00 177.43 179.07 1c01 s GLN 46 N -5.49 3.63 1.10 6.67 0.00 -1.26 -2.54 119.66 121.77 1c01 s GLN 46 Ca -0.13 0.89 -0.15 0.00 -0.00 0.00 0.00 55.36 55.97 1c01 s GLN 46 Cb 0.13 -2.09 0.24 0.00 0.00 0.00 0.00 33.01 31.30 1c01 s GLN 46 CO 0.81 -0.54 1.09 0.00 0.00 0.00 0.00 175.29 176.65 1c01 s ALA 47 N -2.89 0.65 -1.21 2.60 0.00 -1.26 -3.85 121.76 115.80 1c01 s ALA 47 Ca 0.58 -0.59 -0.09 0.00 0.00 0.00 0.00 51.96 51.86 1c01 s ALA 47 Cb -0.11 -3.03 0.09 0.00 0.00 0.00 0.00 23.12 20.06 1c01 s ALA 47 CO 0.44 -3.25 0.22 0.41 0.00 0.00 0.00 175.76 173.58 1c01 n GLY 48 N -0.86 -0.19 3.90 0.00 0.00 -1.26 -2.01 105.19 104.77 1c01 n GLY 48 Ca 0.08 0.09 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 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 -1.34 0.00 -4.85 0.00 7.64 -0.85 -5.03 113.62 109.18 1c01 n SER 50 Ca -0.10 0.00 -0.31 0.00 1.01 0.00 0.00 58.87 59.47 1c01 n SER 50 Cb 0.42 0.00 0.04 0.00 -1.01 0.00 0.00 64.21 63.66 1c01 n SER 50 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1c01 s GLY 51 N -0.47 1.65 -0.03 0.23 0.00 -1.26 -4.80 107.32 102.63 1c01 s GLY 51 Ca 0.00 -0.15 -0.03 0.00 0.00 0.00 0.00 44.72 44.54 1c01 s GLY 51 CO 0.00 0.19 0.06 -0.62 0.00 0.00 0.00 173.10 172.72 1c01 n VAL 52 N -3.03-12.48 -1.19 1.40 0.31 -1.26 -4.89 118.33 97.19 1c01 n VAL 52 Ca 0.07 2.84 -0.15 0.00 -0.01 0.00 0.00 64.34 67.09 1c01 n VAL 52 Cb 0.55 -5.98 0.11 0.00 -0.91 0.00 0.00 33.84 27.62 1c01 n VAL 52 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1c01 n ALA 53 N 1.66 -1.16 0.00 3.52 0.00 -1.26 -4.56 120.51 118.71 1c01 n ALA 53 Ca -0.10 -0.86 0.00 0.00 0.00 0.00 0.00 53.44 52.49 1c01 n ALA 53 Cb 0.15 -0.05 0.00 0.00 0.00 0.00 0.00 19.45 19.55 1c01 n ALA 53 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1c01 n HIS 54 N -3.24 0.00 -4.13 0.00 -0.00 -0.63 -4.74 115.22 102.47 1c01 n HIS 54 Ca 0.08 0.00 -0.09 0.00 0.46 0.00 0.00 57.72 58.17 1c01 n HIS 54 Cb 0.29 0.42 -0.10 0.00 -0.12 0.00 0.00 29.99 30.48 1c01 n HIS 54 CO 0.00 0.00 0.00 0.99 0.46 0.00 0.00 176.34 177.79 1c01 s THR 55 N -1.99 0.41 -0.11 3.57 2.01 -1.05 -5.03 115.64 113.45 1c01 s THR 55 Ca 0.00 -1.88 -0.05 0.00 0.31 0.00 0.00 61.69 60.07 1c01 s THR 55 Cb 0.00 -1.67 0.05 0.00 0.01 0.00 0.00 72.50 70.89 1c01 s THR 55 CO 0.00 -0.86 0.26 -0.13 -0.69 0.00 0.00 174.62 173.19 1c01 s ARG 56 N -3.90 0.20 -0.00 4.92 0.52 -1.26 -0.21 118.95 119.21 1c01 s ARG 56 Ca 0.12 0.59 -0.02 0.00 -0.52 0.00 0.00 55.73 55.90 1c01 s ARG 56 Cb 0.07 -0.10 -0.04 0.00 0.52 0.00 0.00 34.95 35.40 1c01 s ARG 56 CO -0.06 -0.19 0.14 -0.06 0.02 0.00 0.00 175.30 175.15 1c01 s PHE 57 N 1.54 3.44 0.00 -0.53 0.08 -0.25 -4.97 117.98 117.29 1c01 s PHE 57 Ca -0.07 0.29 0.00 0.00 0.12 0.00 0.00 56.93 57.27 1c01 s PHE 57 Cb -0.11 -1.79 0.00 0.00 -0.57 0.00 0.00 43.02 40.56 1c01 s PHE 57 CO -0.09 0.61 0.55 0.41 -0.10 0.00 0.00 175.22 176.60 1c01 n GLY 58 N 1.01 0.42 3.64 4.36 0.00 -1.26 -1.86 105.19 111.49 1c01 n GLY 58 Ca -0.11 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.86 1c01 n GLY 58 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1c01 s SER 59 N -0.28 -0.68 -0.60 1.61 1.04 -1.26 -4.89 113.70 108.65 1c01 s SER 59 Ca 0.00 1.08 -0.33 0.00 0.48 0.00 0.00 55.95 57.18 1c01 s SER 59 Cb 0.00 1.28 -0.17 0.00 0.10 0.00 0.00 66.02 67.23 1c01 s SER 59 CO 0.00 -0.17 2.01 -1.20 0.98 0.00 0.00 173.24 174.86 1c01 n SER 60 N 3.95 0.48 -4.09 7.02 7.64 -1.26 -4.69 113.62 122.68 1c01 n SER 60 Ca -0.19 0.41 -0.34 0.00 1.01 0.00 0.00 58.87 59.76 1c01 n SER 60 Cb 0.58 -0.77 -0.13 0.00 -1.01 0.00 0.00 64.21 62.88 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 6.14 3.00 -1.31 -0.43 0.00 -0.31 -4.92 121.76 123.93 1c01 s ALA 61 Ca 1.08 -2.42 -0.15 0.00 0.00 0.00 0.00 51.96 50.47 1c01 s ALA 61 Cb -1.19 -2.17 0.10 0.00 0.00 0.00 0.00 23.12 19.85 1c01 s ALA 61 CO 0.50 -1.68 1.80 0.54 0.00 0.00 0.00 175.76 176.92 1c01 n ARG 62 N 4.47 3.21 -2.72 0.00 1.74 -1.26 -0.94 116.66 121.16 1c01 n ARG 62 Ca -0.02 -3.28 -0.24 0.00 -0.77 0.00 0.00 57.85 53.54 1c01 n ARG 62 Cb 0.42 -3.29 0.02 0.00 -1.02 0.00 0.00 32.46 28.59 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 3.00 3.60 -0.21 7.54 0.00 0.63 -4.93 121.76 131.40 1c01 s ALA 63 Ca 0.48 -0.97 0.13 0.00 0.00 0.00 0.00 51.96 51.61 1c01 s ALA 63 Cb 0.05 -2.30 0.33 0.00 0.00 0.00 0.00 23.12 21.21 1c01 s ALA 63 CO 0.02 -0.60 1.29 0.00 0.00 0.00 0.00 175.76 176.47 1c01 n ASN 65 N -0.77 -0.70 -4.77 0.00 3.02 -1.26 -4.46 115.26 106.32 1c01 n ASN 65 Ca -0.13 -0.35 -0.30 0.00 -0.03 0.00 0.00 54.58 53.77 1c01 n ASN 65 Cb 0.85 0.00 0.12 0.00 -0.61 0.00 0.00 39.78 40.13 1c01 n ASN 65 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1c01 s PRO 66 N -2.11 1.62 0.82 3.52 0.05 -1.26 -4.48 135.00 133.15 1c01 s PRO 66 Ca 0.00 0.62 -0.12 0.00 0.05 0.00 0.00 61.00 61.56 1c01 s PRO 66 Cb 0.00 -1.87 0.09 0.00 0.05 0.00 0.00 34.50 32.78 1c01 s PRO 66 CO 0.00 -1.94 1.18 0.12 0.05 0.00 0.00 177.00 176.41 1c01 s PHE 67 N -3.11 2.76 0.00 0.56 5.36 -1.26 -5.01 117.98 117.28 1c01 s PHE 67 Ca 0.62 0.65 0.00 0.00 -0.96 0.00 0.00 56.93 57.24 1c01 s PHE 67 Cb -0.16 -3.54 0.00 0.00 -0.34 0.00 0.00 43.02 38.98 1c01 s PHE 67 CO 0.55 -1.85 0.40 0.41 -1.46 0.00 0.00 175.22 173.27 1c01 n GLY 68 N -3.33 0.98 0.00 13.12 0.00 -1.26 -5.14 105.19 109.56 1c01 n GLY 68 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1c01 n GLY 68 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1c01 n TRP 69 N 0.00 -0.02 0.00 1.61 8.01 -1.26 -4.74 117.44 121.03 1c01 n TRP 69 Ca 0.00 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.19 1c01 n TRP 69 Cb 0.49 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.79 1c01 n TRP 69 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.69 178.31 1c01 n LYS 70 N 0.00 0.00 -3.81 -0.99 4.01 -1.02 -4.94 118.16 111.41 1c01 n LYS 70 Ca 0.00 0.00 -0.10 0.00 -0.51 0.00 0.00 58.31 57.70 1c01 n LYS 70 Cb 0.00 -0.39 -0.06 0.00 -0.51 0.00 0.00 35.03 34.07 1c01 n LYS 70 CO 0.00 0.00 0.00 -1.54 -1.11 0.00 0.00 177.40 174.75 1c01 s SER 71 N -1.03 -0.06 -0.02 4.39 1.04 -1.00 -0.74 113.70 116.28 1c01 s SER 71 Ca 0.00 -0.61 0.01 0.00 0.48 0.00 0.00 55.95 55.83 1c01 s SER 71 Cb 0.00 0.44 0.01 0.00 0.10 0.00 0.00 66.02 66.58 1c01 s SER 71 CO 0.00 -0.87 -0.01 -0.51 0.98 0.00 0.00 173.24 172.83 1c01 s ILE 72 N -3.88 0.19 -0.47 -1.02 2.07 -0.84 -1.24 121.20 116.00 1c01 s ILE 72 Ca 0.09 -0.01 -0.18 0.00 -1.41 0.00 0.00 60.65 59.14 1c01 s ILE 72 Cb 0.03 -0.23 0.05 0.00 0.13 0.00 0.00 42.46 42.44 1c01 s ILE 72 CO -0.06 0.10 0.53 0.12 -1.91 0.00 0.00 174.94 173.72 1c01 s PHE 73 N 0.49 3.12 -0.12 3.50 5.36 -0.05 -2.05 117.98 128.24 1c01 s PHE 73 Ca -0.05 -0.56 -0.06 0.00 -0.96 0.00 0.00 56.93 55.30 1c01 s PHE 73 Cb -0.08 -3.28 -0.04 0.00 -0.34 0.00 0.00 43.02 39.28 1c01 s PHE 73 CO -0.01 -0.89 0.12 0.42 -1.46 0.00 0.00 175.22 173.40 1c01 s ILE 74 N 2.30 5.33 0.29 3.12 -1.09 0.43 -1.93 121.20 129.65 1c01 s ILE 74 Ca 0.12 0.14 0.07 0.00 -2.23 0.00 0.00 60.65 58.75 1c01 s ILE 74 Cb -0.20 -3.32 -0.03 0.00 -1.58 0.00 0.00 42.46 37.34 1c01 s ILE 74 CO 0.11 0.61 0.26 -1.10 -1.23 0.00 0.00 174.94 173.59 1c01 s GLN 75 N -0.91 2.87 0.00 2.79 -0.21 -1.18 -0.91 119.66 122.10 1c01 s GLN 75 Ca 0.14 -1.15 0.00 0.00 0.02 0.00 0.00 55.36 54.37 1c01 s GLN 75 Cb -0.12 -2.55 0.00 0.00 1.00 0.00 0.00 33.01 31.34 1c01 s GLN 75 CO 0.03 0.24 0.00 0.00 -2.12 0.00 0.00 175.29 173.45