#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1afc n PRO 11 N 0.00 1.30 -4.05 1.64 -0.05 -1.26 -4.75 135.00 127.84 1afc n PRO 11 Ca 0.00 0.47 -0.25 0.00 -0.05 0.00 0.00 63.50 63.67 1afc n PRO 11 Cb 0.00 -2.04 -0.05 0.00 -0.05 0.00 0.00 33.50 31.35 1afc n PRO 11 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 175.50 177.08 1afc n LYS 12 N 0.06 1.00 -3.95 0.54 4.76 0.55 -4.53 118.16 116.60 1afc n LYS 12 Ca 0.10 -2.84 -0.30 0.00 -2.87 0.00 0.00 58.31 52.40 1afc n LYS 12 Cb 0.40 0.85 -0.16 0.00 -1.84 0.00 0.00 35.03 34.28 1afc n LYS 12 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1afc s LEU 13 N 0.00 2.09 -0.92 -0.35 1.02 0.15 -2.00 118.68 118.67 1afc s LEU 13 Ca 0.02 -0.86 -0.22 0.00 0.02 0.00 0.00 54.13 53.09 1afc s LEU 13 Cb 0.00 -1.11 0.08 0.00 0.02 0.00 0.00 46.19 45.18 1afc s LEU 13 CO 0.01 -0.18 1.27 -0.76 0.02 0.00 0.00 176.35 176.72 1afc s LEU 14 N 1.48 4.08 -0.52 1.79 1.02 -1.26 -0.93 118.68 124.34 1afc s LEU 14 Ca -0.01 -1.48 -0.27 0.00 0.02 0.00 0.00 54.13 52.38 1afc s LEU 14 Cb -0.16 -2.50 -0.01 0.00 0.02 0.00 0.00 46.19 43.54 1afc s LEU 14 CO -0.08 -1.39 1.73 -0.47 0.02 0.00 0.00 176.35 176.16 1afc s TYR 15 N 4.20 1.86 -0.01 0.29 5.04 -0.47 -2.32 117.35 125.94 1afc s TYR 15 Ca 0.38 0.67 -0.23 0.00 -2.44 0.00 0.00 57.07 55.45 1afc s TYR 15 Cb -0.04 -4.17 -0.05 0.00 0.35 0.00 0.00 41.96 38.04 1afc s TYR 15 CO -0.05 -2.39 0.67 0.00 -1.34 0.00 0.00 175.55 172.45 1afc n SER 17 N 3.03 0.47 0.00 0.00 2.88 -0.97 -2.39 113.62 116.64 1afc n SER 17 Ca -0.04 0.68 0.00 0.00 -1.33 0.00 0.00 58.87 58.18 1afc n SER 17 Cb 0.51 -0.76 0.00 0.00 -0.75 0.00 0.00 64.21 63.21 1afc n SER 17 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1afc n ASN 18 N -2.09 0.00 -1.47 -3.46 2.85 -1.21 -4.37 115.26 105.51 1afc n ASN 18 Ca 0.00 0.00 0.09 0.00 -0.11 0.00 0.00 54.58 54.56 1afc n ASN 18 Cb 0.09 0.00 0.34 0.00 1.24 0.00 0.00 39.78 41.45 1afc n ASN 18 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1afc n GLY 19 N 0.00 2.97 1.45 8.20 0.00 -1.25 -4.88 105.19 111.69 1afc n GLY 19 Ca 0.00 -0.85 0.00 0.00 0.00 0.00 0.00 46.02 45.17 1afc n GLY 19 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1afc n GLY 20 N 0.78 0.91 3.98 -0.02 0.00 -1.01 -5.04 105.19 104.79 1afc n GLY 20 Ca 0.24 -0.66 -0.20 0.00 0.00 0.00 0.00 46.02 45.40 1afc n GLY 20 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1afc s TYR 21 N -3.00 3.27 -0.10 1.61 2.02 -1.24 -4.51 117.35 115.41 1afc s TYR 21 Ca 0.00 -0.09 0.04 0.00 -0.37 0.00 0.00 57.07 56.65 1afc s TYR 21 Cb 0.00 -1.84 -0.00 0.00 -0.40 0.00 0.00 41.96 39.71 1afc s TYR 21 CO 0.00 0.15 -0.23 -0.06 -1.57 0.00 0.00 175.55 173.84 1afc s PHE 22 N -2.13 2.58 0.19 2.71 0.08 0.30 -1.47 117.98 120.25 1afc s PHE 22 Ca 0.41 -0.98 -0.33 0.00 0.12 0.00 0.00 56.93 56.15 1afc s PHE 22 Cb -0.09 -1.72 -0.13 0.00 -0.57 0.00 0.00 43.02 40.51 1afc s PHE 22 CO 0.31 -0.38 1.58 -0.11 -0.10 0.00 0.00 175.22 176.51 1afc n LEU 23 N 3.48 3.36 -3.96 -0.37 7.94 -0.98 -1.75 117.00 124.72 1afc n LEU 23 Ca -0.19 1.09 -0.17 0.00 -1.11 0.00 0.00 56.01 55.63 1afc n LEU 23 Cb 0.53 -1.47 -0.15 0.00 0.53 0.00 0.00 43.42 42.86 1afc n LEU 23 CO 0.28 -0.20 -0.41 -0.60 -1.11 0.00 0.00 177.39 175.35 1afc s ARG 24 N 0.61 0.59 -0.18 1.96 3.52 0.15 -4.63 118.95 120.96 1afc s ARG 24 Ca 0.75 -0.19 0.01 0.00 -0.13 0.00 0.00 55.73 56.16 1afc s ARG 24 Cb -0.63 -0.58 0.02 0.00 -1.56 0.00 0.00 34.95 32.20 1afc s ARG 24 CO 0.40 0.08 -0.19 0.42 -0.81 0.00 0.00 175.30 175.20 1afc s ILE 25 N 0.12 2.17 0.66 4.11 1.01 -1.20 -0.61 121.20 127.46 1afc s ILE 25 Ca -0.01 -0.90 -0.01 0.00 0.00 0.00 0.00 60.65 59.73 1afc s ILE 25 Cb -0.06 -1.92 0.09 0.00 0.01 0.00 0.00 42.46 40.58 1afc s ILE 25 CO -0.00 0.53 0.91 -0.76 0.00 0.00 0.00 174.94 175.62 1afc s LEU 26 N 1.30 3.07 0.21 2.97 2.01 0.55 -4.84 118.68 123.96 1afc s LEU 26 Ca 0.05 -0.16 0.03 0.00 0.01 0.00 0.00 54.13 54.05 1afc s LEU 26 Cb -0.13 -2.40 0.17 0.00 0.01 0.00 0.00 46.19 43.84 1afc s LEU 26 CO -0.12 -1.58 1.51 -0.65 1.01 0.00 0.00 176.35 176.52 1afc h PRO 27 N -0.31 0.27 0.00 1.29 0.11 -2.00 1.89 132.00 133.25 1afc h PRO 27 Ca -0.39 -0.21 0.00 0.00 0.11 0.00 0.00 66.00 65.51 1afc h PRO 27 Cb 1.28 0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.43 1afc h PRO 27 CO 0.46 0.84 0.05 -0.40 -0.21 0.00 0.00 178.00 178.74 1afc n ASP 28 N -3.84 0.25 -0.17 -2.05 5.75 -1.26 -4.84 116.55 110.38 1afc n ASP 28 Ca -0.03 0.59 0.00 0.00 -0.01 0.00 0.00 54.79 55.34 1afc n ASP 28 Cb 0.66 -0.61 0.00 0.00 -1.03 0.00 0.00 41.12 40.14 1afc n ASP 28 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1afc n GLY 29 N -1.38 0.92 3.83 6.12 0.00 0.64 -4.90 105.19 110.43 1afc n GLY 29 Ca -0.01 -0.54 -0.37 0.00 0.00 0.00 0.00 46.02 45.10 1afc n GLY 29 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1afc s THR 30 N -2.35 4.86 -0.21 2.61 2.01 -0.94 -1.74 115.64 119.88 1afc s THR 30 Ca 0.00 0.94 0.01 0.00 0.31 0.00 0.00 61.69 62.95 1afc s THR 30 Cb 0.00 -3.78 0.05 0.00 0.01 0.00 0.00 72.50 68.78 1afc s THR 30 CO 0.00 0.40 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.54 1afc s VAL 31 N -1.29 1.64 0.00 3.82 1.01 -1.26 -0.33 120.40 124.00 1afc s VAL 31 Ca 0.33 -1.07 0.00 0.00 0.00 0.00 0.00 61.98 61.24 1afc s VAL 31 Cb -0.17 -1.75 0.00 0.00 0.00 0.00 0.00 36.38 34.46 1afc s VAL 31 CO 0.18 0.11 0.00 -0.90 0.00 0.00 0.00 175.10 174.50 1afc n ASP 32 N 4.67 0.03 -4.14 3.32 5.75 0.22 -4.01 116.55 122.40 1afc n ASP 32 Ca -0.14 0.00 -0.18 0.00 -0.01 0.00 0.00 54.79 54.45 1afc n ASP 32 Cb 0.46 0.00 -0.13 0.00 -1.03 0.00 0.00 41.12 40.42 1afc n ASP 32 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 1afc s GLY 33 N 0.00 0.78 -0.00 6.12 0.00 0.40 0.34 107.32 114.95 1afc s GLY 33 Ca 0.00 -0.88 0.01 0.00 0.00 0.00 0.00 44.72 43.86 1afc s GLY 33 CO 0.00 -0.88 -0.05 -1.08 0.00 0.00 0.00 173.10 171.09 1afc s THR 34 N -1.06 0.38 -2.19 0.90 -1.32 -0.72 -4.81 115.64 106.82 1afc s THR 34 Ca -0.01 -0.20 0.29 0.00 -1.21 0.00 0.00 61.69 60.56 1afc s THR 34 Cb -0.09 -0.33 0.74 0.00 -1.51 0.00 0.00 72.50 71.32 1afc s THR 34 CO 0.02 0.11 2.00 0.29 -2.21 0.00 0.00 174.62 174.83 1afc n LYS 35 N 3.01 1.27 -2.56 7.08 5.02 -1.26 0.11 118.16 130.82 1afc n LYS 35 Ca -0.13 -0.39 -0.43 0.00 -2.02 0.00 0.00 58.31 55.33 1afc n LYS 35 Cb 0.58 -1.48 -0.02 0.00 -0.02 0.00 0.00 35.03 34.09 1afc n LYS 35 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1afc s ASP 36 N -1.96 7.01 0.00 4.39 -1.08 -1.26 -4.94 116.67 118.82 1afc s ASP 36 Ca 0.43 1.46 0.21 0.00 -0.52 0.00 0.00 52.55 54.12 1afc s ASP 36 Cb 0.21 -2.54 1.15 0.00 -1.46 0.00 0.00 42.92 40.28 1afc s ASP 36 CO 0.35 -0.74 1.65 -1.14 0.52 0.00 0.00 175.17 175.81 1afc n ARG 37 N 6.52 0.47 -0.14 4.34 0.63 -1.26 -2.25 116.66 124.96 1afc n ARG 37 Ca 0.13 0.05 0.09 0.00 -0.92 0.00 0.00 57.85 57.20 1afc n ARG 37 Cb 0.46 -1.50 0.13 0.00 0.45 0.00 0.00 32.46 32.00 1afc n ARG 37 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 1afc n SER 38 N -1.15 2.11 -4.62 6.15 3.41 -1.26 -4.94 113.62 113.31 1afc n SER 38 Ca 0.13 -3.03 -0.43 0.00 -0.26 0.00 0.00 58.87 55.28 1afc n SER 38 Cb 0.12 -0.41 -0.03 0.00 -0.26 0.00 0.00 64.21 63.63 1afc n SER 38 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1afc s ASP 39 N -2.73 6.24 -0.64 4.04 -1.08 -0.96 -4.83 116.67 116.72 1afc s ASP 39 Ca 0.30 1.61 -0.13 0.00 -0.52 0.00 0.00 52.55 53.80 1afc s ASP 39 Cb 0.26 -2.53 -0.12 0.00 -1.46 0.00 0.00 42.92 39.08 1afc s ASP 39 CO 0.02 -1.37 1.83 0.00 0.52 0.00 0.00 175.17 176.17 1afc n GLN 40 N 7.86 1.36 0.00 4.34 -0.00 -1.26 -2.65 117.38 127.03 1afc n GLN 40 Ca 0.20 -1.41 0.00 0.00 -0.00 0.00 0.00 57.00 55.79 1afc n GLN 40 Cb 0.45 -2.56 0.00 0.00 -0.00 0.00 0.00 30.24 28.14 1afc n GLN 40 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.06 177.78 1afc n HIS 41 N 5.98 0.00 0.87 2.61 8.25 -1.26 -4.81 115.22 126.86 1afc n HIS 41 Ca 0.40 0.00 0.08 0.00 -0.26 0.00 0.00 57.72 57.95 1afc n HIS 41 Cb 0.24 0.00 0.26 0.00 1.12 0.00 0.00 29.99 31.61 1afc n HIS 41 CO 0.00 0.00 0.00 0.44 0.64 0.00 0.00 176.34 177.42 1afc n ILE 42 N 0.00 0.41 -3.29 1.59 -5.35 -1.09 -3.26 119.36 108.38 1afc n ILE 42 Ca 0.00 -0.48 -0.46 0.00 -0.27 0.00 0.00 62.75 61.53 1afc n ILE 42 Cb 0.00 0.36 -0.03 0.00 -1.74 0.00 0.00 39.64 38.24 1afc n ILE 42 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 1afc s GLN 43 N -1.59 3.48 0.76 6.28 1.11 -1.26 -4.49 119.66 123.95 1afc s GLN 43 Ca 0.30 -2.24 -0.09 0.00 0.01 0.00 0.00 55.36 53.34 1afc s GLN 43 Cb 0.16 -4.44 0.08 0.00 -1.01 0.00 0.00 33.01 27.80 1afc s GLN 43 CO 0.22 -1.34 1.09 -0.51 0.01 0.00 0.00 175.29 174.76 1afc s LEU 44 N 0.69 2.71 -0.29 2.90 2.01 -0.85 -1.27 118.68 124.59 1afc s LEU 44 Ca 0.16 0.52 0.00 0.00 0.01 0.00 0.00 54.13 54.83 1afc s LEU 44 Cb -0.13 -3.07 0.09 0.00 0.01 0.00 0.00 46.19 43.09 1afc s LEU 44 CO -0.06 -1.79 0.05 0.00 1.01 0.00 0.00 176.35 175.56 1afc s GLN 45 N -5.40 1.02 0.81 1.70 -2.07 -0.23 -0.33 119.66 115.16 1afc s GLN 45 Ca 0.62 -1.14 -0.11 0.00 -1.82 0.00 0.00 55.36 52.92 1afc s GLN 45 Cb -0.10 -2.34 0.08 0.00 -1.09 0.00 0.00 33.01 29.56 1afc s GLN 45 CO 0.47 -0.87 1.11 -0.51 -1.32 0.00 0.00 175.29 174.17 1afc s LEU 46 N 1.47 3.00 -0.36 2.60 2.01 -1.26 -1.78 118.68 124.37 1afc s LEU 46 Ca 0.06 1.96 0.01 0.00 0.01 0.00 0.00 54.13 56.17 1afc s LEU 46 Cb -0.18 -4.54 0.19 0.00 0.01 0.00 0.00 46.19 41.67 1afc s LEU 46 CO -0.17 -2.36 0.79 0.00 1.01 0.00 0.00 176.35 175.62 1afc s ALA 47 N -2.77 -3.14 -0.11 4.21 0.00 -0.67 -4.89 121.76 114.38 1afc s ALA 47 Ca 0.64 0.76 -0.34 0.00 0.00 0.00 0.00 51.96 53.02 1afc s ALA 47 Cb -0.19 -2.80 -0.12 0.00 0.00 0.00 0.00 23.12 20.01 1afc s ALA 47 CO 0.56 -2.23 1.90 0.00 0.00 0.00 0.00 175.76 175.99 1afc n ALA 48 N 4.43 0.86 -0.02 0.00 0.00 -1.26 -3.60 120.51 120.92 1afc n ALA 48 Ca 0.08 0.26 -0.19 0.00 0.00 0.00 0.00 53.44 53.60 1afc n ALA 48 Cb 0.58 -2.50 -0.13 0.00 0.00 0.00 0.00 19.45 17.40 1afc n ALA 48 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1afc h GLU 49 N 9.43 0.14 0.00 0.00 4.81 0.35 -3.46 114.58 125.85 1afc h GLU 49 Ca -0.47 -0.24 0.00 0.00 -0.13 0.00 0.00 59.36 58.52 1afc h GLU 49 Cb 1.27 0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.74 1afc h GLU 49 CO 0.95 1.11 0.00 -1.13 -0.73 0.00 0.00 179.01 179.22 1afc n SER 50 N -4.29 0.00 -3.82 1.04 3.41 -1.17 -5.02 113.62 103.77 1afc n SER 50 Ca -0.18 0.00 -0.25 0.00 -0.26 0.00 0.00 58.87 58.18 1afc n SER 50 Cb 0.70 0.00 -0.17 0.00 -0.26 0.00 0.00 64.21 64.48 1afc n SER 50 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 175.04 174.37 1afc s ILE 51 N 2.30 0.64 0.00 -1.33 1.10 -1.26 -4.45 121.20 118.20 1afc s ILE 51 Ca 0.00 -0.10 0.00 0.00 -0.51 0.00 0.00 60.65 60.04 1afc s ILE 51 Cb 0.00 -0.77 0.00 0.00 0.15 0.00 0.00 42.46 41.84 1afc s ILE 51 CO 0.00 0.26 0.00 0.61 -2.11 0.00 0.00 174.94 173.70 1afc n GLY 52 N 5.06 0.63 3.12 1.50 0.00 -1.26 -4.87 105.19 109.37 1afc n GLY 52 Ca -0.09 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.59 1afc n GLY 52 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1afc s GLU 53 N -0.10 2.18 0.17 1.61 2.12 -1.26 -0.81 118.70 122.59 1afc s GLU 53 Ca 0.00 -1.48 0.01 0.00 0.36 0.00 0.00 54.97 53.85 1afc s GLU 53 Cb 0.00 -3.23 -0.00 0.00 0.26 0.00 0.00 34.13 31.16 1afc s GLU 53 CO 0.00 -0.75 0.02 1.33 -0.54 0.00 0.00 175.26 175.32 1afc n VAL 54 N 4.53 0.00 -3.76 3.70 0.24 -0.60 0.27 118.33 122.72 1afc n VAL 54 Ca -0.09 -0.86 -0.14 0.00 -2.04 0.00 0.00 64.34 61.21 1afc n VAL 54 Cb 0.43 0.23 -0.15 0.00 -1.47 0.00 0.00 33.84 32.88 1afc n VAL 54 CO 0.00 0.00 0.00 -0.31 -2.14 0.00 0.00 176.83 174.38 1afc s TYR 55 N -1.85 -0.08 -0.40 6.34 1.51 -1.24 -1.96 117.35 119.67 1afc s TYR 55 Ca 0.03 0.34 -0.11 0.00 -1.01 0.00 0.00 57.07 56.32 1afc s TYR 55 Cb 0.00 -0.15 0.05 0.00 -0.11 0.00 0.00 41.96 41.75 1afc s TYR 55 CO 0.02 -0.14 0.25 0.42 -1.11 0.00 0.00 175.55 175.00 1afc s ILE 56 N 1.15 4.60 0.26 2.71 1.01 -1.26 -1.67 121.20 127.99 1afc s ILE 56 Ca -0.09 -1.04 0.08 0.00 0.00 0.00 0.00 60.65 59.61 1afc s ILE 56 Cb -0.12 -3.66 -0.04 0.00 0.01 0.00 0.00 42.46 38.64 1afc s ILE 56 CO -0.05 -0.37 0.08 -0.75 0.00 0.00 0.00 174.94 173.86 1afc s LYS 57 N 1.53 2.56 -0.46 2.79 2.20 -0.73 -0.13 119.74 127.51 1afc s LYS 57 Ca 0.03 -1.26 -0.26 0.00 -0.36 0.00 0.00 55.97 54.12 1afc s LYS 57 Cb -0.21 -2.34 0.03 0.00 -1.51 0.00 0.00 37.83 33.80 1afc s LYS 57 CO 0.06 0.38 0.95 0.45 -0.36 0.00 0.00 175.35 176.83 1afc s SER 58 N -3.73 6.53 0.30 1.43 0.15 1.23 -1.07 113.70 118.54 1afc s SER 58 Ca 0.32 0.19 0.05 0.00 0.70 0.00 0.00 55.95 57.21 1afc s SER 58 Cb -0.07 -2.46 0.71 0.00 -1.71 0.00 0.00 66.02 62.49 1afc s SER 58 CO 0.22 -1.07 1.78 0.74 1.20 0.00 0.00 173.24 176.11 1afc h THR 59 N 6.09 0.73 0.00 6.45 2.02 -1.46 -1.25 112.91 125.50 1afc h THR 59 Ca -0.24 -0.27 0.00 0.00 0.77 0.00 0.00 66.41 66.67 1afc h THR 59 Cb 1.07 -0.13 0.00 0.00 -1.74 0.00 0.00 68.15 67.35 1afc h THR 59 CO 1.04 0.15 0.00 -0.62 0.37 0.00 0.00 175.52 176.45 1afc n GLU 60 N -4.75 0.00 0.00 6.66 -0.58 -1.26 -3.26 120.64 117.45 1afc n GLU 60 Ca 0.23 0.00 0.05 0.00 -0.42 0.00 0.00 57.16 57.01 1afc n GLU 60 Cb 0.54 -0.59 0.27 0.00 -0.57 0.00 0.00 31.44 31.09 1afc n GLU 60 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 1afc n THR 61 N -0.38 0.16 -1.99 2.62 -2.24 -1.26 -4.84 114.28 106.35 1afc n THR 61 Ca 0.00 0.04 -0.18 0.00 -2.27 0.00 0.00 64.05 61.64 1afc n THR 61 Cb 0.00 -0.89 -0.04 0.00 -2.10 0.00 0.00 70.33 67.30 1afc n THR 61 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1afc n GLY 62 N -0.43 0.50 3.93 3.38 0.00 -0.47 -4.95 105.19 107.15 1afc n GLY 62 Ca 0.07 -0.16 -0.25 0.00 0.00 0.00 0.00 46.02 45.68 1afc n GLY 62 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1afc s GLN 63 N -4.30 3.50 0.20 1.61 0.74 -1.24 -4.69 119.66 115.47 1afc s GLN 63 Ca 0.00 -0.21 0.07 0.00 0.05 0.00 0.00 55.36 55.26 1afc s GLN 63 Cb 0.00 -2.60 -0.04 0.00 1.10 0.00 0.00 33.01 31.47 1afc s GLN 63 CO 0.00 0.08 0.10 -0.06 -0.55 0.00 0.00 175.29 174.85 1afc s PHE 64 N -2.40 3.01 0.10 1.67 0.40 0.65 0.38 117.98 121.79 1afc s PHE 64 Ca 0.42 -0.09 -0.14 0.00 -0.60 0.00 0.00 56.93 56.52 1afc s PHE 64 Cb -0.10 -1.42 -0.06 0.00 0.51 0.00 0.00 43.02 41.95 1afc s PHE 64 CO 0.38 0.53 0.49 -1.17 0.70 0.00 0.00 175.22 176.15 1afc s LEU 65 N -3.28 4.39 0.18 -0.37 1.98 0.81 0.33 118.68 122.72 1afc s LEU 65 Ca 0.30 1.01 -0.16 0.00 -2.89 0.00 0.00 54.13 52.40 1afc s LEU 65 Cb -0.09 -3.03 0.02 0.00 0.66 0.00 0.00 46.19 43.75 1afc s LEU 65 CO 0.22 0.18 0.46 0.00 -1.89 0.00 0.00 176.35 175.33 1afc s ALA 66 N -1.34 -0.79 -0.06 5.97 0.00 -0.17 -4.54 121.76 120.84 1afc s ALA 66 Ca 0.33 -0.29 -0.02 0.00 0.00 0.00 0.00 51.96 51.97 1afc s ALA 66 Cb -0.16 0.83 0.04 0.00 0.00 0.00 0.00 23.12 23.82 1afc s ALA 66 CO 0.18 -0.75 0.08 1.41 0.00 0.00 0.00 175.76 176.68 1afc s MET 67 N -3.88 -0.05 0.14 0.00 0.00 -0.86 -1.73 119.30 112.94 1afc s MET 67 Ca 0.09 0.37 0.00 0.00 0.00 0.00 0.00 55.69 56.16 1afc s MET 67 Cb 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 34.83 34.26 1afc s MET 67 CO -0.04 -0.36 0.00 -0.25 0.00 0.00 0.00 175.02 174.37 1afc n ASP 68 N 5.30 -0.58 0.02 1.11 9.92 -1.16 -4.82 116.55 126.34 1afc n ASP 68 Ca -0.04 0.00 0.11 0.00 -0.53 0.00 0.00 54.79 54.34 1afc n ASP 68 Cb 0.50 -0.14 -0.09 0.00 -0.64 0.00 0.00 41.12 40.74 1afc n ASP 68 CO 0.00 0.00 0.00 0.41 0.13 0.00 0.00 177.20 177.74 1afc n THR 69 N -1.44 0.18 -0.21 -3.53 -1.04 -1.26 -2.90 114.28 104.08 1afc n THR 69 Ca 0.00 -0.43 0.09 0.00 -2.04 0.00 0.00 64.05 61.68 1afc n THR 69 Cb 0.00 0.03 0.30 0.00 -1.82 0.00 0.00 70.33 68.85 1afc n THR 69 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1afc n ASP 70 N -2.25 3.89 0.00 8.00 8.00 -1.26 -4.95 116.55 127.98 1afc n ASP 70 Ca -0.01 -2.21 0.00 0.00 0.71 0.00 0.00 54.79 53.28 1afc n ASP 70 Cb 0.52 -0.49 0.00 0.00 -0.02 0.00 0.00 41.12 41.13 1afc n ASP 70 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1afc n GLY 71 N 1.28 0.40 3.79 0.44 0.00 -1.14 -4.28 105.19 105.68 1afc n GLY 71 Ca 0.22 -1.04 -0.36 0.00 0.00 0.00 0.00 46.02 44.84 1afc n GLY 71 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1afc s LEU 72 N 0.00 4.30 0.19 0.99 2.96 -1.26 0.28 118.68 126.14 1afc s LEU 72 Ca 0.00 0.43 -0.29 0.00 -0.22 0.00 0.00 54.13 54.05 1afc s LEU 72 Cb 0.00 -2.18 -0.08 0.00 0.50 0.00 0.00 46.19 44.43 1afc s LEU 72 CO 0.00 0.25 0.89 -0.76 -1.32 0.00 0.00 176.35 175.42 1afc s LEU 73 N -0.21 4.60 0.30 -0.68 1.02 -1.26 -2.99 118.68 119.46 1afc s LEU 73 Ca 0.13 1.82 -0.13 0.00 0.02 0.00 0.00 54.13 55.98 1afc s LEU 73 Cb -0.12 -3.51 0.01 0.00 0.02 0.00 0.00 46.19 42.59 1afc s LEU 73 CO 0.02 0.12 0.58 -0.72 0.02 0.00 0.00 176.35 176.38 1afc s TYR 74 N -0.90 0.36 -0.40 0.29 1.13 -0.70 -4.19 117.35 112.93 1afc s TYR 74 Ca 0.41 -0.77 -0.14 0.00 -1.41 0.00 0.00 57.07 55.16 1afc s TYR 74 Cb -0.25 0.34 0.03 0.00 -1.10 0.00 0.00 41.96 40.99 1afc s TYR 74 CO 0.30 -1.17 0.28 0.20 -2.51 0.00 0.00 175.55 172.64 1afc s GLY 75 N -3.05 1.99 -0.11 5.49 0.00 -0.71 -1.00 107.32 109.91 1afc s GLY 75 Ca 0.21 -1.76 -0.11 0.00 0.00 0.00 0.00 44.72 43.05 1afc s GLY 75 CO 0.11 0.91 0.25 -0.45 0.00 0.00 0.00 173.10 173.92 1afc s SER 76 N 1.72 6.48 -0.02 1.64 0.15 0.15 -4.71 113.70 119.11 1afc s SER 76 Ca 0.04 0.57 0.01 0.00 0.70 0.00 0.00 55.95 57.26 1afc s SER 76 Cb -0.20 -2.15 0.06 0.00 -1.71 0.00 0.00 66.02 62.02 1afc s SER 76 CO 0.08 0.27 0.74 0.00 1.20 0.00 0.00 173.24 175.54 1afc n GLN 77 N 2.62 1.22 -3.64 5.44 1.13 -1.26 -0.25 117.38 122.64 1afc n GLN 77 Ca -0.16 -0.23 -0.06 0.00 -1.94 0.00 0.00 57.00 54.62 1afc n GLN 77 Cb 0.53 -1.40 -0.07 0.00 0.11 0.00 0.00 30.24 29.41 1afc n GLN 77 CO 0.00 0.00 0.00 -0.08 -1.44 0.00 0.00 177.06 175.54 1afc s THR 78 N -0.84 0.00 0.20 5.09 -1.32 -1.26 -4.83 115.64 112.68 1afc s THR 78 Ca 0.04 0.00 -0.31 0.00 -1.21 0.00 0.00 61.69 60.21 1afc s THR 78 Cb 0.03 -1.00 -0.10 0.00 -1.51 0.00 0.00 72.50 69.92 1afc s THR 78 CO 0.01 0.00 1.49 -2.84 -2.21 0.00 0.00 174.62 171.07 1afc s PRO 79 N 0.94 4.25 0.17 7.08 0.02 -1.26 -4.94 135.00 141.27 1afc s PRO 79 Ca -0.04 2.30 -0.16 0.00 0.02 0.00 0.00 61.00 63.12 1afc s PRO 79 Cb -0.04 -3.14 0.02 0.00 0.02 0.00 0.00 34.50 31.36 1afc s PRO 79 CO -0.12 -0.50 0.44 0.54 -0.33 0.00 0.00 177.00 177.04 1afc s ASN 80 N 0.75 -0.20 0.63 2.53 6.03 -1.26 -4.98 114.94 118.44 1afc s ASN 80 Ca 0.64 -0.50 0.24 0.00 -1.03 0.00 0.00 52.86 52.21 1afc s ASN 80 Cb -0.42 0.52 1.19 0.00 -3.03 0.00 0.00 41.25 39.51 1afc s ASN 80 CO 0.37 -0.96 1.65 1.05 -2.03 0.00 0.00 177.10 177.18 1afc h GLU 81 N 2.31 0.00 -0.48 3.55 4.11 -1.99 0.43 114.58 122.51 1afc h GLU 81 Ca -0.31 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.12 1afc h GLU 81 Cb 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 1afc h GLU 81 CO 0.42 0.00 0.00 0.39 0.07 0.00 0.00 179.01 179.89 1afc n GLU 82 N -3.16 2.13 -1.69 1.06 1.02 -1.26 -4.10 120.64 114.65 1afc n GLU 82 Ca 0.06 -1.40 -0.06 0.00 -0.02 0.00 0.00 57.16 55.74 1afc n GLU 82 Cb 0.77 -1.44 0.08 0.00 -0.02 0.00 0.00 31.44 30.84 1afc n GLU 82 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1afc s LEU 84 N -2.95 1.82 0.28 0.00 2.96 -1.25 -4.64 118.68 114.90 1afc s LEU 84 Ca 0.40 -1.18 0.06 0.00 -0.22 0.00 0.00 54.13 53.18 1afc s LEU 84 Cb 0.38 -0.80 -0.02 0.00 0.50 0.00 0.00 46.19 46.24 1afc s LEU 84 CO -0.04 -0.33 0.37 -0.36 -1.32 0.00 0.00 176.35 174.67 1afc s PHE 85 N 1.69 3.27 0.11 5.38 0.40 -0.83 -1.98 117.98 126.02 1afc s PHE 85 Ca 0.02 -0.11 0.08 0.00 -0.60 0.00 0.00 56.93 56.32 1afc s PHE 85 Cb -0.17 -1.70 -0.04 0.00 0.51 0.00 0.00 43.02 41.62 1afc s PHE 85 CO -0.14 0.29 -0.14 -0.51 0.70 0.00 0.00 175.22 175.42 1afc s LEU 86 N -4.03 2.88 0.53 -0.37 1.43 -1.04 -1.55 118.68 116.52 1afc s LEU 86 Ca 0.38 -0.48 0.06 0.00 -1.03 0.00 0.00 54.13 53.06 1afc s LEU 86 Cb -0.09 -1.69 0.05 0.00 0.03 0.00 0.00 46.19 44.49 1afc s LEU 86 CO 0.29 0.17 0.73 -0.70 0.23 0.00 0.00 176.35 177.07 1afc s GLU 87 N -2.22 2.47 -0.37 1.70 2.12 0.00 -2.70 118.70 119.71 1afc s GLU 87 Ca 0.20 -1.24 0.05 0.00 0.36 0.00 0.00 54.97 54.33 1afc s GLU 87 Cb -0.11 -2.62 0.19 0.00 0.26 0.00 0.00 34.13 31.85 1afc s GLU 87 CO 0.12 -0.68 0.69 -0.98 -0.54 0.00 0.00 175.26 173.87 1afc s ARG 88 N -4.63 0.66 1.05 4.30 1.04 -1.10 -4.92 118.95 115.35 1afc s ARG 88 Ca 0.59 -0.06 -0.22 0.00 -1.04 0.00 0.00 55.73 55.00 1afc s ARG 88 Cb -0.08 0.12 -0.05 0.00 -2.04 0.00 0.00 34.95 32.90 1afc s ARG 88 CO 0.37 -1.00 -0.70 -0.11 -0.04 0.00 0.00 175.30 173.82 1afc n LEU 89 N 4.55 -2.76 0.00 -1.89 7.94 -1.26 -3.41 117.00 120.17 1afc n LEU 89 Ca 0.09 -0.02 0.00 0.00 -1.11 0.00 0.00 56.01 54.97 1afc n LEU 89 Cb 0.57 -0.76 0.00 0.00 0.53 0.00 0.00 43.42 43.76 1afc n LEU 89 CO -0.03 -3.10 0.00 -0.62 -1.11 0.00 0.00 177.39 172.53 1afc n GLU 90 N 0.23 0.00 -0.01 1.96 1.02 -1.20 -4.95 120.64 117.69 1afc n GLU 90 Ca -0.00 0.00 -0.11 0.00 -0.02 0.00 0.00 57.16 57.03 1afc n GLU 90 Cb 0.67 0.00 -0.09 0.00 -0.02 0.00 0.00 31.44 32.00 1afc n GLU 90 CO 0.00 0.00 0.00 1.05 1.18 0.00 0.00 177.13 179.36 1afc h GLU 91 N 0.00 -0.09 -0.06 3.49 4.11 -1.94 -2.26 114.58 117.84 1afc h GLU 91 Ca 0.00 0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.44 1afc h GLU 91 Cb 0.00 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.27 1afc h GLU 91 CO 0.00 0.48 0.00 0.27 0.07 0.00 0.00 179.01 179.83 1afc n ASN 92 N -4.79 0.33 0.00 3.06 0.23 -1.26 -4.89 115.26 107.94 1afc n ASN 92 Ca -0.07 -1.90 0.00 0.00 -0.53 0.00 0.00 54.58 52.07 1afc n ASN 92 Cb 0.30 -0.04 0.00 0.00 -2.08 0.00 0.00 39.78 37.96 1afc n ASN 92 CO 0.00 0.00 0.00 1.41 -0.93 0.00 0.00 177.26 177.74 1afc n HIS 93 N -0.37 0.00 -2.27 -2.53 8.25 -0.85 -4.92 115.22 112.53 1afc n HIS 93 Ca 0.04 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.20 1afc n HIS 93 Cb 0.06 -0.54 -0.01 0.00 1.12 0.00 0.00 29.99 30.62 1afc n HIS 93 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 1afc s TYR 94 N -2.00 3.55 0.00 4.41 1.51 -1.26 -4.66 117.35 118.90 1afc s TYR 94 Ca 0.00 1.23 0.00 0.00 -1.01 0.00 0.00 57.07 57.29 1afc s TYR 94 Cb 0.00 -2.64 0.00 0.00 -0.11 0.00 0.00 41.96 39.21 1afc s TYR 94 CO 0.00 -0.46 0.00 0.09 -1.11 0.00 0.00 175.55 174.07 1afc n ASN 95 N -2.15 0.00 0.00 2.29 5.03 0.13 -3.21 115.26 117.35 1afc n ASN 95 Ca 0.05 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.50 1afc n ASN 95 Cb 0.54 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.30 1afc n ASN 95 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.26 175.84 1afc n THR 96 N 0.00 0.00 -4.61 3.41 -1.04 -1.22 -3.29 114.28 107.54 1afc n THR 96 Ca 0.00 0.00 -0.33 0.00 -2.04 0.00 0.00 64.05 61.68 1afc n THR 96 Cb 0.00 0.00 -0.16 0.00 -1.82 0.00 0.00 70.33 68.35 1afc n THR 96 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 1afc s TYR 97 N 0.00 2.74 -0.15 -1.42 1.51 -1.26 -2.71 117.35 116.06 1afc s TYR 97 Ca 0.00 -1.12 -0.05 0.00 -1.01 0.00 0.00 57.07 54.89 1afc s TYR 97 Cb 0.00 -1.86 -0.03 0.00 -0.11 0.00 0.00 41.96 39.96 1afc s TYR 97 CO 0.00 -0.51 0.02 0.42 -1.11 0.00 0.00 175.55 174.38 1afc s ILE 98 N 0.78 4.43 0.29 2.71 1.01 -1.10 -1.22 121.20 128.11 1afc s ILE 98 Ca -0.06 -0.17 -0.28 0.00 0.00 0.00 0.00 60.65 60.13 1afc s ILE 98 Cb -0.15 -2.94 -0.14 0.00 0.01 0.00 0.00 42.46 39.23 1afc s ILE 98 CO -0.00 0.52 1.05 -0.24 0.00 0.00 0.00 174.94 176.27 1afc n SER 99 N 3.09 1.52 0.01 3.58 2.88 0.73 -2.51 113.62 122.92 1afc n SER 99 Ca -0.17 1.18 -0.00 0.00 -1.33 0.00 0.00 58.87 58.54 1afc n SER 99 Cb 0.53 -1.32 -0.00 0.00 -0.75 0.00 0.00 64.21 62.67 1afc n SER 99 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 1afc h LYS 100 N 2.12 -0.03 -0.76 -1.46 1.63 -1.69 -2.58 116.57 113.80 1afc h LYS 100 Ca -0.41 0.00 0.29 0.00 -0.85 0.00 0.00 60.65 59.69 1afc h LYS 100 Cb 1.33 0.01 -0.10 0.00 -0.60 0.00 0.00 32.23 32.86 1afc h LYS 100 CO 0.61 -0.02 0.46 1.63 -3.45 0.00 0.00 179.45 178.68 1afc n LYS 101 N -2.17 -0.03 -2.59 1.90 4.76 -1.26 0.17 118.16 118.95 1afc n LYS 101 Ca -0.00 0.86 -0.27 0.00 -2.87 0.00 0.00 58.31 56.03 1afc n LYS 101 Cb 0.01 -1.61 -0.01 0.00 -1.84 0.00 0.00 35.03 31.59 1afc n LYS 101 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 1afc n HIS 102 N -4.24 3.52 0.10 2.13 8.25 -1.24 -4.83 115.22 118.90 1afc n HIS 102 Ca 0.25 -3.31 -0.04 0.00 -0.26 0.00 0.00 57.72 54.36 1afc n HIS 102 Cb 0.92 -0.17 0.12 0.00 1.12 0.00 0.00 29.99 31.98 1afc n HIS 102 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1afc h ALA 103 N 2.67 0.85 0.00 -1.41 0.00 0.21 0.39 119.26 121.98 1afc h ALA 103 Ca 0.26 -0.56 -0.09 0.00 0.00 0.00 0.00 54.91 54.51 1afc h ALA 103 Cb 0.83 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1afc h ALA 103 CO 0.84 0.75 -0.45 1.05 0.00 0.00 0.00 179.25 181.44 1afc h GLU 104 N 0.13 0.00 0.00 0.00 9.09 -1.87 -3.18 114.58 118.76 1afc h GLU 104 Ca -0.01 0.00 -0.08 0.00 0.05 0.00 0.00 59.36 59.33 1afc h GLU 104 Cb 1.13 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.22 1afc h GLU 104 CO 0.09 0.45 -0.60 0.87 0.05 0.00 0.00 179.01 179.87 1afc h LYS 105 N 0.00 0.00 -3.42 1.06 1.57 -1.68 -3.48 116.57 110.62 1afc h LYS 105 Ca -0.00 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.58 1afc h LYS 105 Cb 1.33 0.00 0.07 0.00 0.08 0.00 0.00 32.23 33.71 1afc h LYS 105 CO 0.06 0.27 -0.34 0.72 -0.57 0.00 0.00 179.45 179.59 1afc n HIS 106 N -3.06 -1.42 -2.46 -1.35 8.25 0.03 -4.98 115.22 110.23 1afc n HIS 106 Ca 0.00 0.50 -0.43 0.00 -0.26 0.00 0.00 57.72 57.54 1afc n HIS 106 Cb 0.68 -3.03 -0.02 0.00 1.12 0.00 0.00 29.99 28.74 1afc n HIS 106 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 1afc s TRP 107 N -3.16 2.85 0.20 4.41 0.51 -1.23 -4.72 118.94 117.81 1afc s TRP 107 Ca 0.28 1.01 0.01 0.00 -2.12 0.00 0.00 56.10 55.28 1afc s TRP 107 Cb -0.12 -3.65 0.04 0.00 -0.81 0.00 0.00 33.47 28.93 1afc s TRP 107 CO 0.36 -1.52 0.28 1.19 -0.51 0.00 0.00 176.95 176.74 1afc n PHE 108 N 6.99 -3.16 -3.57 -1.98 3.72 -1.26 -0.19 117.46 118.00 1afc n PHE 108 Ca 0.14 -0.53 -0.41 0.00 -0.05 0.00 0.00 57.45 56.60 1afc n PHE 108 Cb 0.46 -0.20 -0.11 0.00 -0.94 0.00 0.00 39.48 38.69 1afc n PHE 108 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 1afc s VAL 109 N -0.58 4.65 0.06 -4.37 1.01 -0.36 -4.67 120.40 116.15 1afc s VAL 109 Ca 0.19 -0.90 -0.01 0.00 0.00 0.00 0.00 61.98 61.26 1afc s VAL 109 Cb -0.01 -3.63 -0.04 0.00 0.00 0.00 0.00 36.38 32.70 1afc s VAL 109 CO 0.12 -0.29 -0.03 -0.83 0.00 0.00 0.00 175.10 174.07 1afc s GLY 110 N 1.65 0.50 -0.02 4.51 0.00 -1.26 -4.33 107.32 108.38 1afc s GLY 110 Ca 0.02 -1.22 0.06 0.00 0.00 0.00 0.00 44.72 43.58 1afc s GLY 110 CO 0.07 -1.33 -0.21 1.08 0.00 0.00 0.00 173.10 172.71 1afc s LEU 111 N -2.93 2.03 0.86 0.66 1.43 -0.71 -0.08 118.68 119.94 1afc s LEU 111 Ca 0.07 -0.38 -0.12 0.00 -1.03 0.00 0.00 54.13 52.68 1afc s LEU 111 Cb 0.08 -1.07 0.11 0.00 0.03 0.00 0.00 46.19 45.34 1afc s LEU 111 CO -0.09 0.25 1.14 -0.54 0.23 0.00 0.00 176.35 177.33 1afc s LYS 112 N -0.44 1.58 0.40 1.70 1.02 0.18 -4.52 119.74 119.65 1afc s LYS 112 Ca 0.07 0.32 0.18 0.00 0.02 0.00 0.00 55.97 56.56 1afc s LYS 112 Cb -0.08 -1.89 0.86 0.00 -0.52 0.00 0.00 37.83 36.20 1afc s LYS 112 CO -0.00 -1.90 1.85 1.57 -0.92 0.00 0.00 175.35 175.94 1afc h LYS 113 N -1.29 0.00 -0.00 1.68 5.09 -1.95 -1.61 116.57 118.49 1afc h LYS 113 Ca -0.49 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.25 1afc h LYS 113 Cb 1.32 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.65 1afc h LYS 113 CO 0.62 0.32 -0.04 0.27 -2.09 0.00 0.00 179.45 178.54 1afc n ASN 114 N -3.81 0.17 0.00 7.07 0.23 -1.26 -4.70 115.26 112.96 1afc n ASN 114 Ca -0.01 -0.42 0.00 0.00 -0.53 0.00 0.00 54.58 53.62 1afc n ASN 114 Cb 0.41 -0.17 0.00 0.00 -2.08 0.00 0.00 39.78 37.93 1afc n ASN 114 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1afc n GLY 115 N 1.24 3.40 3.48 4.83 0.00 -0.61 -5.04 105.19 112.49 1afc n GLY 115 Ca 0.16 -1.03 -0.38 0.00 0.00 0.00 0.00 46.02 44.77 1afc n GLY 115 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1afc n ARG 116 N 0.00 0.51 -2.81 1.61 1.74 -1.26 -0.45 116.66 116.00 1afc n ARG 116 Ca 0.00 0.20 -0.34 0.00 -0.77 0.00 0.00 57.85 56.94 1afc n ARG 116 Cb 0.00 -1.74 -0.07 0.00 -1.02 0.00 0.00 32.46 29.63 1afc n ARG 116 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1afc s SER 117 N -1.21 7.03 0.62 0.55 1.04 -1.26 0.47 113.70 120.94 1afc s SER 117 Ca 0.69 1.73 -0.10 0.00 0.48 0.00 0.00 55.95 58.75 1afc s SER 117 Cb -0.43 -2.55 -0.02 0.00 0.10 0.00 0.00 66.02 63.12 1afc s SER 117 CO 0.54 -0.30 1.00 -0.75 0.98 0.00 0.00 173.24 174.71 1afc s LYS 118 N -2.92 3.36 0.09 4.02 2.20 0.88 -4.50 119.74 122.87 1afc s LYS 118 Ca 0.59 0.53 -0.16 0.00 -0.36 0.00 0.00 55.97 56.58 1afc s LYS 118 Cb -0.11 -2.13 -0.07 0.00 -1.51 0.00 0.00 37.83 34.01 1afc s LYS 118 CO 0.16 -0.64 0.52 -0.51 -0.36 0.00 0.00 175.35 174.52 1afc s LEU 119 N -5.14 4.42 0.05 5.43 1.43 -1.26 -4.50 118.68 119.11 1afc s LEU 119 Ca 0.54 1.10 -0.10 0.00 -1.03 0.00 0.00 54.13 54.64 1afc s LEU 119 Cb -0.11 -3.01 -0.02 0.00 0.03 0.00 0.00 46.19 43.08 1afc s LEU 119 CO 0.51 0.20 0.76 0.61 0.23 0.00 0.00 176.35 178.67 1afc n GLY 120 N 1.28 -1.65 0.24 -3.19 0.00 0.14 -1.69 105.19 100.32 1afc n GLY 120 Ca -0.09 0.54 0.16 0.00 0.00 0.00 0.00 46.02 46.64 1afc n GLY 120 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1afc h PRO 121 N 0.00 0.00 -0.01 1.61 0.11 -1.86 -2.15 132.00 129.71 1afc h PRO 121 Ca 0.05 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.16 1afc h PRO 121 Cb 0.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.25 1afc h PRO 121 CO -0.31 0.00 -0.09 0.54 -0.21 0.00 0.00 178.00 177.93 1afc n ARG 122 N -2.86 1.22 -2.06 1.05 5.12 -0.68 -4.91 116.66 113.54 1afc n ARG 122 Ca 0.01 -0.64 -0.28 0.00 -1.93 0.00 0.00 57.85 55.01 1afc n ARG 122 Cb 0.28 -1.49 0.07 0.00 -1.16 0.00 0.00 32.46 30.16 1afc n ARG 122 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 1afc s THR 123 N -2.22 2.50 -0.30 0.55 -4.23 -0.81 -4.97 115.64 106.17 1afc s THR 123 Ca 0.33 -0.02 -0.21 0.00 -1.18 0.00 0.00 61.69 60.62 1afc s THR 123 Cb 0.20 -3.12 0.19 0.00 1.34 0.00 0.00 72.50 71.11 1afc s THR 123 CO 0.41 -0.15 1.32 -2.28 -0.54 0.00 0.00 174.62 173.39 1afc s HIS 124 N -3.37 -0.11 0.25 3.99 5.04 -1.26 -4.87 115.29 114.96 1afc s HIS 124 Ca 0.60 0.25 -0.30 0.00 -1.54 0.00 0.00 55.06 54.07 1afc s HIS 124 Cb -0.11 0.29 -0.09 0.00 0.04 0.00 0.00 32.58 32.71 1afc s HIS 124 CO 0.47 -0.05 1.11 0.12 -2.34 0.00 0.00 174.74 174.05 1afc s PHE 125 N 0.52 3.58 0.00 3.88 5.36 -1.26 -3.01 117.98 127.04 1afc s PHE 125 Ca 0.00 1.65 0.00 0.00 -0.96 0.00 0.00 56.93 57.62 1afc s PHE 125 Cb -0.04 -3.29 0.00 0.00 -0.34 0.00 0.00 43.02 39.35 1afc s PHE 125 CO -0.13 -0.61 0.00 0.41 -1.46 0.00 0.00 175.22 173.44 1afc n GLY 126 N 1.50 1.58 3.77 13.12 0.00 -1.26 -5.09 105.19 118.80 1afc n GLY 126 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 1afc n GLY 126 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1afc s GLN 127 N -0.12 2.83 0.15 1.61 -0.21 -1.16 -5.02 119.66 117.74 1afc s GLN 127 Ca 0.00 -0.83 -0.12 0.00 0.02 0.00 0.00 55.36 54.43 1afc s GLN 127 Cb 0.00 -2.64 0.02 0.00 1.00 0.00 0.00 33.01 31.39 1afc s GLN 127 CO 0.00 0.51 1.61 0.87 -2.12 0.00 0.00 175.29 176.16 1afc h LYS 128 N 2.80 0.88 -0.86 2.91 1.79 -1.95 -3.18 116.57 118.97 1afc h LYS 128 Ca -0.47 -0.28 0.17 0.00 -2.18 0.00 0.00 60.65 57.89 1afc h LYS 128 Cb 1.19 -0.08 -0.16 0.00 -1.58 0.00 0.00 32.23 31.59 1afc h LYS 128 CO 0.63 0.91 -0.20 0.00 -1.08 0.00 0.00 179.45 179.71 1afc h ALA 129 N 0.94 0.59 0.03 3.86 0.00 -1.92 -3.21 119.26 119.55 1afc h ALA 129 Ca 0.14 0.33 0.03 0.00 0.00 0.00 0.00 54.91 55.41 1afc h ALA 129 Cb 0.51 0.64 -0.04 0.00 0.00 0.00 0.00 17.79 18.89 1afc h ALA 129 CO 0.02 -0.40 -0.28 0.82 0.00 0.00 0.00 179.25 179.41 1afc h ILE 130 N 0.00 0.37 -1.81 0.00 5.03 -1.74 -1.90 117.51 117.46 1afc h ILE 130 Ca 0.42 0.00 -0.62 0.00 -0.12 0.00 0.00 64.86 64.53 1afc h ILE 130 Cb 0.64 0.37 0.01 0.00 -3.03 0.00 0.00 36.82 34.81 1afc h ILE 130 CO -0.88 0.00 1.25 0.18 -0.68 0.00 0.00 178.15 178.02 1afc n LEU 131 N -5.39 3.12 -4.43 1.44 4.32 -1.22 -4.49 117.00 110.34 1afc n LEU 131 Ca -0.05 0.70 -0.23 0.00 -0.02 0.00 0.00 56.01 56.40 1afc n LEU 131 Cb 0.31 -1.38 -0.10 0.00 -1.62 0.00 0.00 43.42 40.62 1afc n LEU 131 CO 0.21 -0.33 -0.48 -0.36 -1.22 0.00 0.00 177.39 175.22 1afc s PHE 132 N 5.64 2.16 -0.13 -1.77 0.40 -1.21 -2.29 117.98 120.78 1afc s PHE 132 Ca 0.98 -0.39 -0.04 0.00 -0.60 0.00 0.00 56.93 56.89 1afc s PHE 132 Cb -0.66 -0.97 0.05 0.00 0.51 0.00 0.00 43.02 41.95 1afc s PHE 132 CO 0.48 0.60 0.07 -1.17 0.70 0.00 0.00 175.22 175.90 1afc s LEU 133 N -3.31 0.36 -0.12 -0.37 2.96 0.24 -0.69 118.68 117.74 1afc s LEU 133 Ca 0.26 -0.41 -0.29 0.00 -0.22 0.00 0.00 54.13 53.47 1afc s LEU 133 Cb -0.05 -0.25 -0.01 0.00 0.50 0.00 0.00 46.19 46.39 1afc s LEU 133 CO 0.12 -0.31 1.01 -2.84 -1.32 0.00 0.00 176.35 173.01 1afc s PRO 134 N 2.12 4.40 0.22 0.98 0.02 -1.25 -1.37 135.00 140.12 1afc s PRO 134 Ca 0.03 1.39 0.11 0.00 0.02 0.00 0.00 61.00 62.54 1afc s PRO 134 Cb -0.15 -3.55 -0.05 0.00 0.02 0.00 0.00 34.50 30.77 1afc s PRO 134 CO -0.07 -0.35 -0.22 -0.51 -0.33 0.00 0.00 177.00 175.52 1afc s LEU 135 N 2.16 2.49 0.00 -5.54 1.43 -0.10 -4.83 118.68 114.28 1afc s LEU 135 Ca 0.48 -0.93 0.19 0.00 -1.03 0.00 0.00 54.13 52.84 1afc s LEU 135 Cb -0.18 -1.09 1.13 0.00 0.03 0.00 0.00 46.19 46.08 1afc s LEU 135 CO 0.16 0.06 1.52 -2.65 0.23 0.00 0.00 176.35 175.68