#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 -0.88 -0.31 -0.43 0.00 -0.77 -4.72 121.76 114.65 1c01 s ALA 2 Ca 0.00 -0.58 -0.02 0.00 0.00 0.00 0.00 51.96 51.36 1c01 s ALA 2 Cb 0.00 0.80 0.11 0.00 0.00 0.00 0.00 23.12 24.03 1c01 s ALA 2 CO 0.00 -1.00 0.15 0.12 0.00 0.00 0.00 175.76 175.03 1c01 s PHE 3 N -3.18 0.79 0.47 0.00 5.36 -0.08 -1.00 117.98 120.34 1c01 s PHE 3 Ca 0.14 -1.30 -0.20 0.00 -0.96 0.00 0.00 56.93 54.61 1c01 s PHE 3 Cb -0.05 -1.13 -0.09 0.00 -0.34 0.00 0.00 43.02 41.40 1c01 s PHE 3 CO 0.10 -0.84 1.00 0.99 -1.46 0.00 0.00 175.22 175.01 1c01 s THR 4 N 1.69 4.08 0.03 0.12 2.01 0.12 -0.67 115.64 123.03 1c01 s THR 4 Ca 0.11 1.26 -0.12 0.00 0.31 0.00 0.00 61.69 63.25 1c01 s THR 4 Cb -0.18 -3.52 0.01 0.00 0.01 0.00 0.00 72.50 68.82 1c01 s THR 4 CO -0.25 -0.31 0.26 0.68 -0.69 0.00 0.00 174.62 174.31 1c01 s VAL 5 N -2.13 0.09 0.01 3.82 -7.23 -0.47 -0.15 120.40 114.33 1c01 s VAL 5 Ca 0.64 -0.72 0.02 0.00 -1.81 0.00 0.00 61.98 60.11 1c01 s VAL 5 Cb -0.13 -0.86 -0.01 0.00 0.56 0.00 0.00 36.38 35.94 1c01 s VAL 5 CO 0.19 -0.40 -0.06 0.26 -0.31 0.00 0.00 175.10 174.77 1c01 s TRP 6 N -2.34 0.57 -2.00 2.82 0.51 0.16 -1.68 118.94 116.98 1c01 s TRP 6 Ca -0.07 -0.22 0.09 0.00 -2.12 0.00 0.00 56.10 53.79 1c01 s TRP 6 Cb -0.02 -0.36 0.54 0.00 -0.81 0.00 0.00 33.47 32.83 1c01 s TRP 6 CO -0.02 -0.03 0.97 -1.13 -0.51 0.00 0.00 176.95 176.23 1c01 n SER 7 N 2.50 0.00 0.00 2.95 3.41 -1.25 -1.78 113.62 119.44 1c01 n SER 7 Ca -0.16 -0.34 0.00 0.00 -0.26 0.00 0.00 58.87 58.12 1c01 n SER 7 Cb 0.57 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.52 1c01 n SER 7 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1c01 n GLY 8 N -0.37 2.45 0.14 5.00 0.00 -1.26 -4.10 105.19 107.05 1c01 n GLY 8 Ca 0.07 -1.84 -0.10 0.00 0.00 0.00 0.00 46.02 44.15 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 -0.23 0.00 1.61 0.13 -1.92 -3.42 132.00 128.17 1c01 h PRO 9 Ca 0.00 0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.15 1c01 h PRO 9 Cb 0.00 0.05 0.00 0.00 0.13 0.00 0.00 31.00 31.18 1c01 h PRO 9 CO 0.00 0.18 0.00 0.41 -0.23 0.00 0.00 178.00 178.36 1c01 n GLY 10 N 0.61 1.21 2.74 1.56 0.00 -1.26 -4.07 105.19 105.98 1c01 n GLY 10 Ca -0.08 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.59 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 1.03 -0.53 0.00 0.00 3.02 -1.26 -5.05 115.26 112.47 1c01 n ASN 12 Ca 0.28 0.33 0.00 0.00 -0.03 0.00 0.00 54.58 55.17 1c01 n ASN 12 Cb 0.36 0.64 0.00 0.00 -0.61 0.00 0.00 39.78 40.17 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 -3.07 0.00 -4.55 6.41 0.23 -1.26 -4.49 115.26 108.53 1c01 n ASN 13 Ca 0.00 0.00 -0.37 0.00 -0.53 0.00 0.00 54.58 53.68 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 2.31 -1.19 -3.83 6.06 -1.26 -4.87 118.95 116.17 1c01 s ARG 14 Ca 0.00 1.24 -0.20 0.00 -2.50 0.00 0.00 55.73 54.27 1c01 s ARG 14 Cb 0.00 -4.52 0.04 0.00 0.06 0.00 0.00 34.95 30.54 1c01 s ARG 14 CO 0.00 -3.05 1.68 0.00 -2.50 0.00 0.00 175.30 171.43 1c01 s ALA 15 N 11.11 2.92 0.27 6.12 0.00 -1.26 -3.85 121.76 137.08 1c01 s ALA 15 Ca 0.90 -2.59 0.06 0.00 0.00 0.00 0.00 51.96 50.33 1c01 s ALA 15 Cb -0.17 -4.61 -0.03 0.00 0.00 0.00 0.00 23.12 18.31 1c01 s ALA 15 CO 0.25 -3.64 0.35 -2.00 0.00 0.00 0.00 175.76 170.72 1c01 s GLU 16 N 4.79 3.21 0.03 0.00 2.56 -0.67 -5.00 118.70 123.61 1c01 s GLU 16 Ca 0.54 -0.92 -0.03 0.00 0.00 0.00 0.00 54.97 54.55 1c01 s GLU 16 Cb 0.02 -2.78 -0.02 0.00 2.00 0.00 0.00 34.13 33.35 1c01 s GLU 16 CO 0.03 0.30 0.04 0.50 -0.56 0.00 0.00 175.26 175.57 1c01 s ARG 17 N -4.01 0.49 -0.45 4.30 3.52 -1.26 -1.37 118.95 120.17 1c01 s ARG 17 Ca 0.37 -0.75 0.03 0.00 -0.13 0.00 0.00 55.73 55.26 1c01 s ARG 17 Cb -0.09 0.19 0.16 0.00 -1.56 0.00 0.00 34.95 33.65 1c01 s ARG 17 CO 0.29 -0.11 0.33 0.71 -0.81 0.00 0.00 175.30 175.71 1c01 s TYR 18 N -2.33 1.51 -0.45 5.12 1.51 0.15 -4.90 117.35 117.95 1c01 s TYR 18 Ca -0.07 -2.37 0.12 0.00 -1.01 0.00 0.00 57.07 53.74 1c01 s TYR 18 Cb -0.03 -1.31 -0.14 0.00 -0.11 0.00 0.00 41.96 40.37 1c01 s TYR 18 CO -0.04 -0.78 0.46 -1.13 -1.11 0.00 0.00 175.55 172.95 1c01 n SER 19 N 3.01 0.89 -4.62 2.29 3.41 -1.26 -0.91 113.62 116.44 1c01 n SER 19 Ca 0.22 -0.62 -0.41 0.00 -0.26 0.00 0.00 58.87 57.80 1c01 n SER 19 Cb 0.42 1.11 0.01 0.00 -0.26 0.00 0.00 64.21 65.50 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 -1.41 1.41 -1.70 4.33 0.00 -1.26 -4.85 118.16 114.68 1c01 n LYS 20 Ca 0.01 0.50 -0.43 0.00 0.00 0.00 0.00 58.31 58.40 1c01 n LYS 20 Cb 0.21 -2.07 -0.03 0.00 0.00 0.00 0.00 35.03 33.14 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 4.10 -1.72 3.64 0.00 0.00 -0.82 -4.90 105.19 105.50 1c01 n GLY 22 Ca 0.17 -1.67 -0.23 0.00 0.00 0.00 0.00 46.02 44.29 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 -3.70 -0.57 0.46 0.00 1.04 -0.97 -4.81 113.70 105.15 1c01 s SER 24 Ca 0.33 0.10 -0.20 0.00 0.48 0.00 0.00 55.95 56.67 1c01 s SER 24 Cb -0.04 0.57 -0.10 0.00 0.10 0.00 0.00 66.02 66.56 1c01 s SER 24 CO 0.20 -0.89 0.97 0.00 0.98 0.00 0.00 173.24 174.49 1c01 s ALA 25 N -3.35 3.03 -0.08 5.32 0.00 -1.26 -1.76 121.76 123.65 1c01 s ALA 25 Ca -0.00 0.36 0.04 0.00 0.00 0.00 0.00 51.96 52.36 1c01 s ALA 25 Cb -0.01 -3.15 -0.00 0.00 0.00 0.00 0.00 23.12 19.96 1c01 s ALA 25 CO -0.10 -0.02 -0.23 0.42 0.00 0.00 0.00 175.76 175.83 1c01 s ILE 26 N -2.28 1.93 -1.56 0.00 1.09 -1.07 -4.92 121.20 114.37 1c01 s ILE 26 Ca 0.62 -0.96 0.21 0.00 -1.10 0.00 0.00 60.65 59.42 1c01 s ILE 26 Cb -0.10 -1.66 -0.08 0.00 -1.06 0.00 0.00 42.46 39.56 1c01 s ILE 26 CO 0.19 0.53 0.97 1.41 -0.10 0.00 0.00 174.94 177.94 1c01 n HIS 27 N 3.40 0.00 -2.40 3.97 8.25 -1.26 -4.58 115.22 122.60 1c01 n HIS 27 Ca -0.19 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 56.86 1c01 n HIS 27 Cb 0.53 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.64 1c01 n HIS 27 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1c01 n GLN 28 N -0.55 4.46 0.00 -0.41 3.00 -1.26 -4.75 117.38 117.86 1c01 n GLN 28 Ca 0.07 -3.91 0.02 0.00 -0.01 0.00 0.00 57.00 53.17 1c01 n GLN 28 Cb 0.39 -2.66 0.10 0.00 0.00 0.00 0.00 30.24 28.07 1c01 n GLN 28 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.06 177.42 1c01 n LYS 29 N 1.93 0.86 0.10 -1.09 -0.00 -1.26 -3.87 118.16 114.83 1c01 n LYS 29 Ca 0.46 0.00 -0.05 0.00 -0.00 0.00 0.00 58.31 58.72 1c01 n LYS 29 Cb 0.30 -1.06 -0.02 0.00 -0.00 0.00 0.00 35.03 34.24 1c01 n LYS 29 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.40 178.18 1c01 h GLY 30 N 5.04 -0.33 -3.06 2.58 0.00 -1.50 -1.34 103.07 104.46 1c01 h GLY 30 Ca 0.00 0.12 -0.09 0.00 0.00 0.00 0.00 47.33 47.36 1c01 h GLY 30 CO 0.00 -0.12 -0.36 -0.32 0.00 0.00 0.00 176.54 175.73 1c01 s GLY 31 N -2.82 0.20 -0.28 4.60 0.00 -0.82 -3.07 107.32 105.13 1c01 s GLY 31 Ca -0.05 -0.70 -0.21 0.00 0.00 0.00 0.00 44.72 43.77 1c01 s GLY 31 CO 0.14 -0.82 0.76 -2.52 0.00 0.00 0.00 173.10 170.66 1c01 s TYR 32 N -3.89 -0.85 0.28 1.90 -0.85 -0.30 -0.67 117.35 112.97 1c01 s TYR 32 Ca 0.08 1.86 0.08 0.00 -0.52 0.00 0.00 57.07 58.58 1c01 s TYR 32 Cb 0.05 0.43 -0.04 0.00 0.38 0.00 0.00 41.96 42.78 1c01 s TYR 32 CO -0.08 -0.42 0.11 0.34 -1.52 0.00 0.00 175.55 173.98 1c01 s ASP 33 N 0.96 4.95 0.12 -0.18 2.15 0.78 -1.31 116.67 124.14 1c01 s ASP 33 Ca -0.04 -0.52 0.04 0.00 0.43 0.00 0.00 52.55 52.45 1c01 s ASP 33 Cb -0.05 -1.02 -0.04 0.00 -0.30 0.00 0.00 42.92 41.51 1c01 s ASP 33 CO -0.10 -0.09 -0.10 0.12 -0.17 0.00 0.00 175.17 174.84 1c01 s PHE 34 N -2.28 1.18 -0.04 -5.34 5.36 0.13 0.14 117.98 117.14 1c01 s PHE 34 Ca 0.34 -0.72 -0.02 0.00 -0.96 0.00 0.00 56.93 55.57 1c01 s PHE 34 Cb -0.06 -0.62 0.03 0.00 -0.34 0.00 0.00 43.02 42.03 1c01 s PHE 34 CO 0.23 0.04 0.07 0.45 -1.46 0.00 0.00 175.22 174.54 1c01 s SER 35 N -2.87 0.89 -0.36 6.13 0.15 -0.17 -1.33 113.70 116.15 1c01 s SER 35 Ca 0.12 0.10 -0.10 0.00 0.70 0.00 0.00 55.95 56.77 1c01 s SER 35 Cb 0.00 -0.08 0.02 0.00 -1.71 0.00 0.00 66.02 64.25 1c01 s SER 35 CO 0.00 -0.23 0.19 -0.47 1.20 0.00 0.00 173.24 173.93 1c01 s TYR 36 N 1.97 3.23 0.00 3.44 5.04 -1.26 -1.85 117.35 127.92 1c01 s TYR 36 Ca 0.02 -0.88 0.00 0.00 -2.44 0.00 0.00 57.07 53.77 1c01 s TYR 36 Cb -0.12 -2.41 0.00 0.00 0.35 0.00 0.00 41.96 39.77 1c01 s TYR 36 CO -0.03 -0.60 0.00 0.25 -1.34 0.00 0.00 175.55 173.83 1c01 n THR 37 N 4.99 0.00 0.00 4.34 -2.24 -1.26 -4.54 114.28 115.56 1c01 n THR 37 Ca -0.12 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.66 1c01 n THR 37 Cb 0.47 -0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.44 1c01 n THR 37 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1c01 n GLY 38 N 0.22 1.39 2.32 3.38 0.00 -1.26 -4.74 105.19 106.50 1c01 n GLY 38 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 1c01 n GLY 38 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1c01 n GLN 39 N -0.67 0.39 -1.61 1.61 1.13 -1.26 -4.82 117.38 112.16 1c01 n GLN 39 Ca 0.00 -2.41 -0.29 0.00 -1.94 0.00 0.00 57.00 52.36 1c01 n GLN 39 Cb 0.00 1.80 0.13 0.00 0.11 0.00 0.00 30.24 32.28 1c01 n GLN 39 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 1c01 s THR 40 N -2.88 1.98 0.24 5.09 2.01 -1.26 -4.70 115.64 116.12 1c01 s THR 40 Ca 0.25 0.00 -0.11 0.00 0.31 0.00 0.00 61.69 62.13 1c01 s THR 40 Cb 0.01 -2.80 -0.01 0.00 0.01 0.00 0.00 72.50 69.72 1c01 s THR 40 CO 0.18 0.00 0.43 0.00 -0.69 0.00 0.00 174.62 174.54 1c01 s ALA 41 N -3.36 -0.10 0.17 7.40 0.00 -1.02 -2.81 121.76 122.04 1c01 s ALA 41 Ca 0.64 -0.95 -0.15 0.00 0.00 0.00 0.00 51.96 51.51 1c01 s ALA 41 Cb -0.13 1.09 0.02 0.00 0.00 0.00 0.00 23.12 24.10 1c01 s ALA 41 CO 0.53 -0.82 0.43 0.00 0.00 0.00 0.00 175.76 175.90 1c01 s ALA 42 N -4.03 -0.67 -0.01 0.00 0.00 -0.76 -1.84 121.76 114.45 1c01 s ALA 42 Ca 0.24 -0.38 0.03 0.00 0.00 0.00 0.00 51.96 51.85 1c01 s ALA 42 Cb 0.00 0.82 -0.03 0.00 0.00 0.00 0.00 23.12 23.91 1c01 s ALA 42 CO 0.09 -0.73 -0.08 -0.51 0.00 0.00 0.00 175.76 174.53 1c01 s LEU 43 N -2.89 3.12 -0.12 0.00 2.01 0.39 -1.01 118.68 120.19 1c01 s LEU 43 Ca 0.10 -0.14 -0.00 0.00 0.01 0.00 0.00 54.13 54.10 1c01 s LEU 43 Cb 0.01 -1.77 0.02 0.00 0.01 0.00 0.00 46.19 44.47 1c01 s LEU 43 CO -0.04 0.30 -0.09 -0.31 1.01 0.00 0.00 176.35 177.22 1c01 s TYR 44 N -0.95 1.59 -1.43 0.29 1.51 -0.49 -0.81 117.35 117.05 1c01 s TYR 44 Ca 0.16 -0.81 0.04 0.00 -1.01 0.00 0.00 57.07 55.45 1c01 s TYR 44 Cb -0.11 -1.28 0.18 0.00 -0.11 0.00 0.00 41.96 40.64 1c01 s TYR 44 CO 0.06 -0.53 0.93 -1.71 -1.11 0.00 0.00 175.55 173.19 1c01 n ASN 45 N 4.89 0.00 -4.02 2.29 5.15 -1.26 -0.97 115.26 121.33 1c01 n ASN 45 Ca -0.13 0.23 -0.28 0.00 -0.60 0.00 0.00 54.58 53.79 1c01 n ASN 45 Cb 0.50 -0.28 -0.17 0.00 -0.53 0.00 0.00 39.78 39.30 1c01 n ASN 45 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1c01 s GLN 46 N -2.57 2.10 0.40 1.20 0.00 -1.26 -4.04 119.66 115.49 1c01 s GLN 46 Ca 0.03 -0.50 -0.18 0.00 -0.00 0.00 0.00 55.36 54.71 1c01 s GLN 46 Cb 0.02 -1.88 -0.14 0.00 0.00 0.00 0.00 33.01 31.02 1c01 s GLN 46 CO 0.05 -0.14 -0.00 0.00 0.00 0.00 0.00 175.29 175.20 1c01 n ALA 47 N 4.47 -2.86 -3.59 2.60 0.00 -1.26 -2.39 120.51 117.48 1c01 n ALA 47 Ca -0.18 0.04 -0.27 0.00 0.00 0.00 0.00 53.44 53.04 1c01 n ALA 47 Cb 0.51 -1.30 0.01 0.00 0.00 0.00 0.00 19.45 18.67 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 2.16 -0.49 3.98 0.00 0.00 -1.26 -2.28 105.19 107.30 1c01 n GLY 48 Ca 0.09 0.14 -0.30 0.00 0.00 0.00 0.00 46.02 45.95 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 -2.08 5.96 0.00 0.00 7.64 -0.96 -4.71 113.62 119.47 1c01 n SER 50 Ca -0.09 -2.79 0.00 0.00 1.01 0.00 0.00 58.87 57.00 1c01 n SER 50 Cb 0.47 -1.13 0.00 0.00 -1.01 0.00 0.00 64.21 62.54 1c01 n SER 50 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1c01 n GLY 51 N 1.00 2.20 3.09 0.23 0.00 -1.26 -4.96 105.19 105.47 1c01 n GLY 51 Ca 0.22 0.26 -0.10 0.00 0.00 0.00 0.00 46.02 46.40 1c01 n GLY 51 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1c01 s VAL 52 N 2.02 0.40 0.93 1.61 0.11 -1.26 -5.13 120.40 119.08 1c01 s VAL 52 Ca 0.00 -1.52 -0.12 0.00 -2.93 0.00 0.00 61.98 57.41 1c01 s VAL 52 Cb 0.00 -1.14 0.15 0.00 -1.53 0.00 0.00 36.38 33.86 1c01 s VAL 52 CO 0.00 -0.74 1.09 0.00 -3.33 0.00 0.00 175.10 172.12 1c01 s ALA 53 N -2.85 1.27 0.16 1.54 0.00 -1.26 -4.40 121.76 116.22 1c01 s ALA 53 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 51.96 51.96 1c01 s ALA 53 Cb 0.00 -3.23 0.00 0.00 0.00 0.00 0.00 23.12 19.90 1c01 s ALA 53 CO -0.05 -2.60 0.00 1.58 0.00 0.00 0.00 175.76 174.70 1c01 n HIS 54 N -4.06 -1.18 -4.51 0.00 -0.00 0.01 -4.96 115.22 100.52 1c01 n HIS 54 Ca 0.07 0.21 -0.33 0.00 -0.00 0.00 0.00 57.72 57.67 1c01 n HIS 54 Cb 0.55 0.35 -0.11 0.00 -0.00 0.00 0.00 29.99 30.79 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 -1.72 3.70 -0.06 3.57 2.01 -1.26 -4.95 115.64 116.94 1c01 s THR 55 Ca 0.00 -0.65 0.01 0.00 0.31 0.00 0.00 61.69 61.35 1c01 s THR 55 Cb 0.00 -2.58 0.02 0.00 0.01 0.00 0.00 72.50 69.96 1c01 s THR 55 CO 0.00 0.47 -0.05 -0.13 -0.69 0.00 0.00 174.62 174.22 1c01 s ARG 56 N -1.20 0.99 -0.11 4.92 0.52 -1.26 -0.46 118.95 122.34 1c01 s ARG 56 Ca 0.15 -0.12 -0.15 0.00 -0.52 0.00 0.00 55.73 55.09 1c01 s ARG 56 Cb -0.11 -1.03 -0.05 0.00 0.52 0.00 0.00 34.95 34.28 1c01 s ARG 56 CO 0.05 -0.13 0.37 -0.06 0.02 0.00 0.00 175.30 175.55 1c01 s PHE 57 N 1.18 3.55 0.00 -0.53 0.08 -0.77 -4.93 117.98 116.55 1c01 s PHE 57 Ca -0.07 0.78 0.00 0.00 0.12 0.00 0.00 56.93 57.76 1c01 s PHE 57 Cb -0.14 -2.37 0.00 0.00 -0.57 0.00 0.00 43.02 39.94 1c01 s PHE 57 CO -0.01 0.34 0.65 0.41 -0.10 0.00 0.00 175.22 176.50 1c01 n GLY 58 N 2.89 -0.11 3.64 4.36 0.00 -1.26 -2.44 105.19 112.27 1c01 n GLY 58 Ca -0.11 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.39 -0.74 -0.45 1.61 1.04 -1.26 -4.90 113.70 108.61 1c01 s SER 59 Ca 0.00 1.31 -0.44 0.00 0.48 0.00 0.00 55.95 57.30 1c01 s SER 59 Cb 0.00 1.32 -0.18 0.00 0.10 0.00 0.00 66.02 67.26 1c01 s SER 59 CO 0.00 -0.22 1.81 -1.54 0.98 0.00 0.00 173.24 174.27 1c01 n SER 60 N 3.17 1.34 -4.05 7.02 3.41 -1.26 -4.62 113.62 118.63 1c01 n SER 60 Ca -0.16 0.98 -0.32 0.00 -0.26 0.00 0.00 58.87 59.12 1c01 n SER 60 Cb 0.57 -0.95 -0.15 0.00 -0.26 0.00 0.00 64.21 63.41 1c01 n SER 60 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1c01 s ALA 61 N 4.20 2.60 -1.31 7.33 0.00 -0.44 -4.89 121.76 129.26 1c01 s ALA 61 Ca 1.08 -1.93 -0.17 0.00 0.00 0.00 0.00 51.96 50.94 1c01 s ALA 61 Cb -1.39 -1.67 0.02 0.00 0.00 0.00 0.00 23.12 20.08 1c01 s ALA 61 CO 0.73 -1.33 2.02 0.54 0.00 0.00 0.00 175.76 177.72 1c01 n ARG 62 N 4.41 2.71 -3.13 0.00 5.12 -1.26 -0.69 116.66 123.81 1c01 n ARG 62 Ca -0.09 -2.71 -0.28 0.00 -1.93 0.00 0.00 57.85 52.84 1c01 n ARG 62 Cb 0.42 -3.34 -0.02 0.00 -1.16 0.00 0.00 32.46 28.36 1c01 n ARG 62 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1c01 s ALA 63 N 4.29 3.54 0.00 7.54 0.00 -0.43 -4.92 121.76 131.78 1c01 s ALA 63 Ca 0.52 -0.53 0.00 0.00 0.00 0.00 0.00 51.96 51.95 1c01 s ALA 63 Cb 0.10 -2.40 0.00 0.00 0.00 0.00 0.00 23.12 20.82 1c01 s ALA 63 CO 0.00 0.06 0.79 0.00 0.00 0.00 0.00 175.76 176.62 1c01 s ASN 65 N -0.63 5.80 0.69 0.00 -0.87 -1.26 -4.29 114.94 114.37 1c01 s ASN 65 Ca 0.00 1.09 -0.17 0.00 -1.57 0.00 0.00 52.86 52.21 1c01 s ASN 65 Cb 0.00 -2.06 -0.02 0.00 -0.02 0.00 0.00 41.25 39.14 1c01 s ASN 65 CO 0.00 -1.05 0.79 -2.65 -2.57 0.00 0.00 177.10 171.62 1c01 n PRO 66 N -2.75 0.51 -1.20 -0.60 -0.02 -1.17 -3.83 135.00 125.94 1c01 n PRO 66 Ca 0.05 0.22 -0.29 0.00 -2.02 0.00 0.00 63.50 61.46 1c01 n PRO 66 Cb 0.56 -2.05 0.15 0.00 -0.02 0.00 0.00 33.50 32.14 1c01 n PRO 66 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1c01 s PHE 67 N -1.79 2.27 0.00 6.00 5.36 -0.50 -4.98 117.98 124.34 1c01 s PHE 67 Ca 0.71 1.19 0.00 0.00 -0.96 0.00 0.00 56.93 57.87 1c01 s PHE 67 Cb -0.37 -3.19 0.00 0.00 -0.34 0.00 0.00 43.02 39.13 1c01 s PHE 67 CO 0.52 -2.52 0.00 0.41 -1.46 0.00 0.00 175.22 172.18 1c01 n GLY 68 N -1.12 1.00 0.00 13.12 0.00 -1.26 -5.10 105.19 111.82 1c01 n GLY 68 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 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 0.00 0.00 1.61 8.01 -1.26 -4.84 117.44 120.96 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 0.23 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.53 1c01 n TRP 69 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.69 177.85 1c01 n LYS 70 N 0.00 1.95 -3.85 -0.99 4.81 -0.15 -4.81 118.16 115.12 1c01 n LYS 70 Ca 0.00 0.00 -0.09 0.00 -0.87 0.00 0.00 58.31 57.35 1c01 n LYS 70 Cb 0.00 -0.34 -0.07 0.00 0.02 0.00 0.00 35.03 34.64 1c01 n LYS 70 CO 0.00 0.00 0.00 -1.54 1.17 0.00 0.00 177.40 177.03 1c01 s SER 71 N -0.52 0.10 -0.13 3.14 1.04 -0.51 -2.60 113.70 114.22 1c01 s SER 71 Ca 0.00 -0.58 0.03 0.00 0.48 0.00 0.00 55.95 55.87 1c01 s SER 71 Cb 0.00 0.33 0.00 0.00 0.10 0.00 0.00 66.02 66.45 1c01 s SER 71 CO 0.00 -0.69 -0.22 -0.51 0.98 0.00 0.00 173.24 172.81 1c01 s ILE 72 N -3.55 2.17 -0.21 -1.02 1.10 -0.72 -1.40 121.20 117.57 1c01 s ILE 72 Ca 0.02 -0.96 -0.08 0.00 -0.51 0.00 0.00 60.65 59.13 1c01 s ILE 72 Cb 0.03 -1.86 -0.04 0.00 0.15 0.00 0.00 42.46 40.75 1c01 s ILE 72 CO -0.09 0.55 0.08 0.12 -2.11 0.00 0.00 174.94 173.48 1c01 s PHE 73 N 0.64 3.19 -0.10 3.50 5.36 -0.18 -2.30 117.98 128.10 1c01 s PHE 73 Ca -0.11 -0.07 0.01 0.00 -0.96 0.00 0.00 56.93 55.80 1c01 s PHE 73 Cb -0.16 -2.16 -0.02 0.00 -0.34 0.00 0.00 43.02 40.34 1c01 s PHE 73 CO 0.02 -0.04 -0.13 0.42 -1.46 0.00 0.00 175.22 174.03 1c01 s ILE 74 N 0.91 3.11 -0.93 3.12 -1.09 -0.36 -1.83 121.20 124.13 1c01 s ILE 74 Ca 0.04 -0.67 -0.25 0.00 -2.23 0.00 0.00 60.65 57.55 1c01 s ILE 74 Cb -0.14 -2.27 -0.08 0.00 -1.58 0.00 0.00 42.46 38.39 1c01 s ILE 74 CO 0.03 0.55 2.06 -1.10 -1.23 0.00 0.00 174.94 175.25 1c01 s GLN 75 N -0.11 2.25 0.00 2.79 -1.52 -1.12 -1.95 119.66 120.00 1c01 s GLN 75 Ca -0.01 -0.24 0.00 0.00 -1.95 0.00 0.00 55.36 53.15 1c01 s GLN 75 Cb -0.14 -5.02 0.00 0.00 -0.22 0.00 0.00 33.01 27.63 1c01 s GLN 75 CO 0.03 -3.83 0.00 0.00 -0.25 0.00 0.00 175.29 171.25