#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1afc s PRO 11 N 0.00 3.65 0.00 -1.58 0.02 -1.26 -4.91 135.00 130.93 1afc s PRO 11 Ca 0.00 0.02 0.00 0.00 0.02 0.00 0.00 61.00 61.04 1afc s PRO 11 Cb 0.00 -3.05 0.00 0.00 0.02 0.00 0.00 34.50 31.47 1afc s PRO 11 CO 0.00 0.61 0.00 1.63 -0.33 0.00 0.00 177.00 178.91 1afc n LYS 12 N 1.02 2.22 -3.67 5.54 4.76 -1.20 -4.24 118.16 122.59 1afc n LYS 12 Ca -0.10 0.00 -0.18 0.00 -2.87 0.00 0.00 58.31 55.16 1afc n LYS 12 Cb 0.53 0.00 -0.17 0.00 -1.84 0.00 0.00 35.03 33.55 1afc n LYS 12 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 1afc s LEU 13 N 0.00 0.04 -0.45 -0.35 2.96 -0.19 -2.39 118.68 118.31 1afc s LEU 13 Ca 0.00 0.23 -0.21 0.00 -0.22 0.00 0.00 54.13 53.93 1afc s LEU 13 Cb 0.00 0.11 0.03 0.00 0.50 0.00 0.00 46.19 46.83 1afc s LEU 13 CO 0.00 -0.24 0.67 -0.76 -1.32 0.00 0.00 176.35 174.70 1afc s LEU 14 N 2.20 4.50 -0.16 -0.68 2.01 -1.26 -1.45 118.68 123.84 1afc s LEU 14 Ca 0.03 -0.37 -0.21 0.00 0.01 0.00 0.00 54.13 53.59 1afc s LEU 14 Cb -0.12 -2.73 -0.03 0.00 0.01 0.00 0.00 46.19 43.32 1afc s LEU 14 CO -0.05 -0.82 0.61 -0.47 1.01 0.00 0.00 176.35 176.63 1afc s TYR 15 N 2.90 3.43 -0.21 0.29 5.04 -0.87 -1.86 117.35 126.07 1afc s TYR 15 Ca 0.23 0.97 -0.07 0.00 -2.44 0.00 0.00 57.07 55.75 1afc s TYR 15 Cb -0.14 -2.75 -0.04 0.00 0.35 0.00 0.00 41.96 39.38 1afc s TYR 15 CO 0.19 -0.07 0.06 0.00 -1.34 0.00 0.00 175.55 174.39 1afc h SER 17 N 7.28 0.00 0.00 0.00 0.87 -1.67 -2.30 113.55 117.73 1afc h SER 17 Ca -0.36 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.20 1afc h SER 17 Cb 1.17 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.13 1afc h SER 17 CO 0.65 0.00 0.00 -3.20 -0.53 0.00 0.00 176.83 173.75 1afc n ASN 18 N -3.22 0.00 -1.54 6.23 5.15 -1.18 -4.21 115.26 116.49 1afc n ASN 18 Ca 0.15 0.35 -0.01 0.00 -0.60 0.00 0.00 54.58 54.47 1afc n ASN 18 Cb 1.20 -0.05 0.28 0.00 -0.53 0.00 0.00 39.78 40.67 1afc n ASN 18 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1afc n GLY 19 N 0.63 3.98 2.38 8.20 0.00 -1.26 -4.76 105.19 114.36 1afc n GLY 19 Ca 0.00 -1.05 -0.06 0.00 0.00 0.00 0.00 46.02 44.91 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 -0.42 0.79 3.68 -0.02 0.00 -0.86 -4.99 105.19 103.37 1afc n GLY 20 Ca 0.34 -0.33 -0.30 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.02 0.52 -0.06 1.61 2.02 -1.25 -4.69 117.35 113.48 1afc s TYR 21 Ca 0.00 0.37 0.04 0.00 -0.37 0.00 0.00 57.07 57.11 1afc s TYR 21 Cb 0.00 -3.68 0.00 0.00 -0.40 0.00 0.00 41.96 37.88 1afc s TYR 21 CO 0.00 -3.71 -0.17 -0.06 -1.57 0.00 0.00 175.55 170.04 1afc s PHE 22 N -3.26 1.81 0.53 2.71 0.08 0.13 -1.62 117.98 118.36 1afc s PHE 22 Ca 0.73 -0.61 -0.21 0.00 0.12 0.00 0.00 56.93 56.96 1afc s PHE 22 Cb -0.07 -1.24 -0.07 0.00 -0.57 0.00 0.00 43.02 41.08 1afc s PHE 22 CO 0.55 -0.25 1.06 -0.11 -0.10 0.00 0.00 175.22 176.38 1afc n LEU 23 N 3.40 3.76 -3.73 -0.37 7.94 -0.78 -1.45 117.00 125.77 1afc n LEU 23 Ca -0.20 0.91 -0.12 0.00 -1.11 0.00 0.00 56.01 55.49 1afc n LEU 23 Cb 0.53 -1.42 -0.11 0.00 0.53 0.00 0.00 43.42 42.95 1afc n LEU 23 CO 0.26 -1.46 0.03 -0.60 -1.11 0.00 0.00 177.39 174.51 1afc s ARG 24 N -2.55 0.40 -0.48 1.96 3.52 0.13 -4.64 118.95 117.30 1afc s ARG 24 Ca 0.71 0.61 0.01 0.00 -0.13 0.00 0.00 55.73 56.93 1afc s ARG 24 Cb -0.46 0.11 0.13 0.00 -1.56 0.00 0.00 34.95 33.17 1afc s ARG 24 CO 0.51 -0.09 0.23 0.42 -0.81 0.00 0.00 175.30 175.56 1afc s ILE 25 N 0.66 2.87 0.36 4.11 1.01 -1.22 -0.23 121.20 128.76 1afc s ILE 25 Ca -0.04 -2.77 -0.28 0.00 0.00 0.00 0.00 60.65 57.56 1afc s ILE 25 Cb -0.05 -2.98 -0.11 0.00 0.01 0.00 0.00 42.46 39.33 1afc s ILE 25 CO -0.04 -0.74 1.47 -0.76 0.00 0.00 0.00 174.94 174.87 1afc s LEU 26 N 0.32 4.33 0.52 2.97 1.02 0.20 -4.86 118.68 123.19 1afc s LEU 26 Ca 0.14 2.99 0.46 0.00 0.02 0.00 0.00 54.13 57.74 1afc s LEU 26 Cb -0.22 -3.66 1.67 0.00 0.02 0.00 0.00 46.19 43.99 1afc s LEU 26 CO -0.04 -0.84 1.55 -2.65 0.02 0.00 0.00 176.35 174.40 1afc n PRO 27 N 0.69 -0.01 -0.24 1.29 -0.01 -1.26 0.13 135.00 135.58 1afc n PRO 27 Ca 0.02 1.11 0.02 0.00 -0.01 0.00 0.00 63.50 64.64 1afc n PRO 27 Cb 0.39 -2.48 0.11 0.00 -0.01 0.00 0.00 33.50 31.52 1afc n PRO 27 CO 0.00 0.00 0.00 -0.40 -0.01 0.00 0.00 175.50 175.09 1afc n ASP 28 N -4.09 2.24 -0.31 2.55 5.68 -1.26 -4.86 116.55 116.50 1afc n ASP 28 Ca 0.43 -2.24 -0.04 0.00 -0.50 0.00 0.00 54.79 52.44 1afc n ASP 28 Cb 1.90 -0.54 -0.02 0.00 -1.14 0.00 0.00 41.12 41.33 1afc n ASP 28 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1afc n GLY 29 N 0.19 0.70 3.65 6.12 0.00 0.12 -4.94 105.19 111.03 1afc n GLY 29 Ca 0.07 -0.73 -0.39 0.00 0.00 0.00 0.00 46.02 44.97 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 -2.12 5.09 -0.52 2.61 2.01 -1.06 -1.76 115.64 119.89 1afc s THR 30 Ca 0.00 0.97 -0.07 0.00 0.31 0.00 0.00 61.69 62.90 1afc s THR 30 Cb 0.00 -3.85 0.14 0.00 0.01 0.00 0.00 72.50 68.79 1afc s THR 30 CO 0.00 0.15 0.37 -0.69 -0.69 0.00 0.00 174.62 173.76 1afc s VAL 31 N 1.81 4.05 0.00 3.82 1.01 -1.26 0.58 120.40 130.41 1afc s VAL 31 Ca 0.24 -2.14 0.00 0.00 0.00 0.00 0.00 61.98 60.08 1afc s VAL 31 Cb -0.15 -3.66 0.00 0.00 0.00 0.00 0.00 36.38 32.56 1afc s VAL 31 CO 0.10 -0.80 0.00 -0.90 0.00 0.00 0.00 175.10 173.49 1afc n ASP 32 N 4.47 1.75 -4.11 3.32 5.68 0.68 -4.20 116.55 124.14 1afc n ASP 32 Ca -0.02 -0.75 -0.20 0.00 -0.50 0.00 0.00 54.79 53.32 1afc n ASP 32 Cb 0.41 0.00 -0.14 0.00 -1.14 0.00 0.00 41.12 40.25 1afc n ASP 32 CO 0.00 0.00 0.00 -0.83 -1.33 0.00 0.00 177.20 175.04 1afc s GLY 33 N -0.75 0.68 0.10 6.12 0.00 -0.87 0.20 107.32 112.79 1afc s GLY 33 Ca 0.00 -0.69 0.06 0.00 0.00 0.00 0.00 44.72 44.09 1afc s GLY 33 CO 0.00 -0.65 -0.15 -1.08 0.00 0.00 0.00 173.10 171.22 1afc s THR 34 N -0.65 1.29 -0.39 0.90 -1.32 -0.53 -4.71 115.64 110.22 1afc s THR 34 Ca 0.02 -1.54 0.10 0.00 -1.21 0.00 0.00 61.69 59.06 1afc s THR 34 Cb -0.07 -1.36 0.65 0.00 -1.51 0.00 0.00 72.50 70.22 1afc s THR 34 CO 0.01 -0.31 1.53 0.29 -2.21 0.00 0.00 174.62 173.93 1afc n LYS 35 N 0.87 3.97 -3.53 7.08 5.02 -1.26 0.21 118.16 130.52 1afc n LYS 35 Ca -0.18 -2.53 -0.42 0.00 -2.02 0.00 0.00 58.31 53.16 1afc n LYS 35 Cb 0.56 -2.11 -0.09 0.00 -0.02 0.00 0.00 35.03 33.36 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 -0.64 5.82 0.18 4.39 2.15 -1.26 -4.94 116.67 122.36 1afc s ASP 36 Ca 0.44 -1.40 0.16 0.00 0.43 0.00 0.00 52.55 52.18 1afc s ASP 36 Cb 0.34 -2.06 0.76 0.00 -0.30 0.00 0.00 42.92 41.66 1afc s ASP 36 CO 0.12 -0.56 1.49 -1.14 -0.17 0.00 0.00 175.17 174.92 1afc n ARG 37 N 5.02 0.10 -0.47 4.34 0.63 -1.26 -2.37 116.66 122.64 1afc n ARG 37 Ca -0.11 0.48 0.07 0.00 -0.92 0.00 0.00 57.85 57.37 1afc n ARG 37 Cb 0.43 -1.75 0.27 0.00 0.45 0.00 0.00 32.46 31.86 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 -1.95 3.70 -4.71 6.15 3.41 -1.26 -4.93 113.62 114.02 1afc n SER 38 Ca 0.01 -2.34 -0.42 0.00 -0.26 0.00 0.00 58.87 55.86 1afc n SER 38 Cb 0.10 -0.50 -0.03 0.00 -0.26 0.00 0.00 64.21 63.52 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 -0.79 7.34 0.40 4.04 -1.08 -1.00 -4.87 116.67 120.70 1afc s ASP 39 Ca 0.38 1.62 0.07 0.00 -0.52 0.00 0.00 52.55 54.10 1afc s ASP 39 Cb 0.25 -2.55 0.81 0.00 -1.46 0.00 0.00 42.92 39.96 1afc s ASP 39 CO 0.18 -0.24 2.02 0.06 0.52 0.00 0.00 175.17 177.71 1afc h GLN 40 N 6.77 0.52 -0.17 4.34 -0.00 -1.92 -3.08 115.11 121.57 1afc h GLN 40 Ca -0.41 -0.05 0.00 0.00 -0.00 0.00 0.00 58.65 58.19 1afc h GLN 40 Cb 1.22 -0.11 0.00 0.00 -0.00 0.00 0.00 27.48 28.59 1afc h GLN 40 CO 0.75 0.39 0.00 0.72 -0.00 0.00 0.00 178.83 180.69 1afc n HIS 41 N -4.43 0.15 0.72 0.06 8.25 -1.26 -4.29 115.22 114.41 1afc n HIS 41 Ca 0.03 -0.07 0.08 0.00 -0.26 0.00 0.00 57.72 57.50 1afc n HIS 41 Cb 0.10 -0.01 0.05 0.00 1.12 0.00 0.00 29.99 31.25 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 -0.18 0.00 -3.28 1.59 -5.35 -1.16 -3.44 119.36 107.54 1afc n ILE 42 Ca 0.03 -0.44 -0.41 0.00 -0.27 0.00 0.00 62.75 61.66 1afc n ILE 42 Cb 0.11 1.30 -0.08 0.00 -1.74 0.00 0.00 39.64 39.23 1afc n ILE 42 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1afc s GLN 43 N -1.59 3.69 0.35 6.28 -2.07 -1.26 -4.52 119.66 120.53 1afc s GLN 43 Ca 0.18 -0.14 0.08 0.00 -1.82 0.00 0.00 55.36 53.66 1afc s GLN 43 Cb 0.14 -3.78 -0.05 0.00 -1.09 0.00 0.00 33.01 28.23 1afc s GLN 43 CO 0.28 -0.57 0.11 -0.51 -1.32 0.00 0.00 175.29 173.28 1afc s LEU 44 N 2.30 3.15 -0.10 2.60 2.01 -1.00 -1.61 118.68 126.03 1afc s LEU 44 Ca 0.17 -0.89 0.01 0.00 0.01 0.00 0.00 54.13 53.44 1afc s LEU 44 Cb -0.16 -1.57 0.02 0.00 0.01 0.00 0.00 46.19 44.49 1afc s LEU 44 CO 0.12 -0.32 -0.13 0.00 1.01 0.00 0.00 176.35 177.03 1afc s GLN 45 N -3.82 1.99 -0.71 1.70 -2.07 -0.11 -3.24 119.66 113.41 1afc s GLN 45 Ca 0.37 -0.48 -0.14 0.00 -1.82 0.00 0.00 55.36 53.30 1afc s GLN 45 Cb -0.01 -1.74 0.18 0.00 -1.09 0.00 0.00 33.01 30.36 1afc s GLN 45 CO 0.22 -0.09 0.65 -0.51 -1.32 0.00 0.00 175.29 174.24 1afc s LEU 46 N 1.06 6.47 0.16 2.60 1.43 -1.25 -0.08 118.68 129.06 1afc s LEU 46 Ca -0.06 -2.36 -0.30 0.00 -1.03 0.00 0.00 54.13 50.38 1afc s LEU 46 Cb -0.15 -2.19 -0.08 0.00 0.03 0.00 0.00 46.19 43.81 1afc s LEU 46 CO -0.02 -0.67 1.22 0.00 0.23 0.00 0.00 176.35 177.11 1afc s ALA 47 N 0.69 3.44 -0.68 4.21 0.00 -0.62 -4.70 121.76 124.09 1afc s ALA 47 Ca 0.12 0.95 -0.02 0.00 0.00 0.00 0.00 51.96 53.01 1afc s ALA 47 Cb -0.18 -3.43 0.33 0.00 0.00 0.00 0.00 23.12 19.84 1afc s ALA 47 CO -0.04 -0.41 2.14 0.00 0.00 0.00 0.00 175.76 177.45 1afc n ALA 48 N 2.90 6.33 -0.19 0.00 0.00 -1.26 -0.37 120.51 127.91 1afc n ALA 48 Ca 0.06 -3.52 0.18 0.00 0.00 0.00 0.00 53.44 50.16 1afc n ALA 48 Cb 0.45 -1.89 0.34 0.00 0.00 0.00 0.00 19.45 18.35 1afc n ALA 48 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1afc n GLU 49 N -0.38 -0.04 -1.64 0.00 0.00 -0.93 -4.43 120.64 113.24 1afc n GLU 49 Ca 0.54 0.81 0.00 0.00 0.00 0.00 0.00 57.16 58.51 1afc n GLU 49 Cb 0.45 -1.45 0.00 0.00 0.00 0.00 0.00 31.44 30.44 1afc n GLU 49 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.13 177.56 1afc n SER 50 N -4.34 0.30 -3.85 4.31 7.64 -1.05 -4.95 113.62 111.69 1afc n SER 50 Ca 0.22 -0.82 -0.39 0.00 1.01 0.00 0.00 58.87 58.90 1afc n SER 50 Cb 0.75 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.87 1afc n SER 50 CO 0.00 0.00 0.00 2.30 -3.01 0.00 0.00 175.04 174.33 1afc n ILE 51 N 0.00 1.23 -1.14 0.44 -0.00 -1.26 -3.50 119.36 115.13 1afc n ILE 51 Ca 0.00 -1.14 0.00 0.00 -0.00 0.00 0.00 62.75 61.61 1afc n ILE 51 Cb 0.00 -2.19 0.00 0.00 -0.00 0.00 0.00 39.64 37.45 1afc n ILE 51 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 1afc n GLY 52 N 5.01 0.53 2.72 3.28 0.00 -1.26 -5.09 105.19 110.37 1afc n GLY 52 Ca 0.47 -0.28 -0.24 0.00 0.00 0.00 0.00 46.02 45.98 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 -1.89 0.37 0.30 1.61 2.56 -1.23 -3.25 118.70 117.18 1afc s GLU 53 Ca 0.00 0.05 0.09 0.00 0.00 0.00 0.00 54.97 55.11 1afc s GLU 53 Cb 0.00 -1.20 -0.05 0.00 2.00 0.00 0.00 34.13 34.88 1afc s GLU 53 CO 0.00 -0.43 0.01 0.14 -0.56 0.00 0.00 175.26 174.43 1afc s VAL 54 N 2.02 3.03 0.02 3.70 -7.23 -0.76 -2.18 120.40 119.01 1afc s VAL 54 Ca 0.03 -1.93 0.07 0.00 -1.81 0.00 0.00 61.98 58.34 1afc s VAL 54 Cb -0.14 -2.81 -0.02 0.00 0.56 0.00 0.00 36.38 33.97 1afc s VAL 54 CO -0.06 -0.28 -0.20 -0.31 -0.31 0.00 0.00 175.10 173.94 1afc s TYR 55 N -2.42 1.78 -0.42 2.82 2.02 0.50 -2.59 117.35 119.04 1afc s TYR 55 Ca 0.34 -0.36 0.02 0.00 -0.37 0.00 0.00 57.07 56.70 1afc s TYR 55 Cb -0.04 -1.10 0.13 0.00 -0.40 0.00 0.00 41.96 40.55 1afc s TYR 55 CO 0.20 0.04 0.20 0.42 -1.57 0.00 0.00 175.55 174.84 1afc s ILE 56 N -0.65 1.50 0.27 2.71 1.01 -1.24 -1.60 121.20 123.20 1afc s ILE 56 Ca 0.07 -2.41 -0.29 0.00 0.00 0.00 0.00 60.65 58.02 1afc s ILE 56 Cb -0.08 -2.06 -0.09 0.00 0.01 0.00 0.00 42.46 40.23 1afc s ILE 56 CO 0.01 -0.82 0.98 -0.54 0.00 0.00 0.00 174.94 174.56 1afc s LYS 57 N 0.55 4.73 -0.33 2.79 1.02 0.88 -1.60 119.74 127.78 1afc s LYS 57 Ca 0.16 1.54 -0.27 0.00 0.02 0.00 0.00 55.97 57.41 1afc s LYS 57 Cb -0.23 -3.15 0.01 0.00 -0.52 0.00 0.00 37.83 33.95 1afc s LYS 57 CO -0.05 0.38 0.98 0.45 -0.92 0.00 0.00 175.35 176.19 1afc s SER 58 N -1.20 6.80 0.61 2.83 0.15 -0.08 -0.93 113.70 121.88 1afc s SER 58 Ca 0.44 0.84 0.27 0.00 0.70 0.00 0.00 55.95 58.20 1afc s SER 58 Cb -0.26 -2.49 1.28 0.00 -1.71 0.00 0.00 66.02 62.84 1afc s SER 58 CO 0.33 -0.82 1.70 0.74 1.20 0.00 0.00 173.24 176.38 1afc h THR 59 N 5.73 0.20 0.00 6.45 2.02 -1.59 -1.05 112.91 124.67 1afc h THR 59 Ca -0.22 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.96 1afc h THR 59 Cb 1.07 0.43 0.00 0.00 -1.74 0.00 0.00 68.15 67.92 1afc h THR 59 CO 0.99 0.00 0.00 -0.62 0.37 0.00 0.00 175.52 176.26 1afc n GLU 60 N -3.41 0.00 0.00 6.66 4.71 -1.26 -4.43 120.64 122.91 1afc n GLU 60 Ca 0.10 0.15 0.08 0.00 -0.01 0.00 0.00 57.16 57.48 1afc n GLU 60 Cb 0.87 -0.60 0.34 0.00 -1.01 0.00 0.00 31.44 31.04 1afc n GLU 60 CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 1afc n THR 61 N -2.19 0.91 -1.64 2.62 -2.24 -1.26 -4.94 114.28 105.54 1afc n THR 61 Ca 0.00 0.23 -0.19 0.00 -2.27 0.00 0.00 64.05 61.81 1afc n THR 61 Cb 0.00 -0.96 -0.08 0.00 -2.10 0.00 0.00 70.33 67.19 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 0.13 1.65 3.93 3.38 0.00 -0.40 -4.92 105.19 108.97 1afc n GLY 62 Ca 0.04 -0.08 -0.26 0.00 0.00 0.00 0.00 46.02 45.72 1afc n GLY 62 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1afc s GLN 63 N -3.77 2.80 -0.15 1.61 -0.21 -1.26 -4.69 119.66 113.98 1afc s GLN 63 Ca 0.00 -0.15 -0.02 0.00 0.02 0.00 0.00 55.36 55.22 1afc s GLN 63 Cb 0.00 -2.30 -0.02 0.00 1.00 0.00 0.00 33.01 31.69 1afc s GLN 63 CO 0.00 -0.74 -0.10 -0.06 -2.12 0.00 0.00 175.29 172.27 1afc s PHE 64 N -2.97 2.88 -0.04 0.91 0.08 0.90 -0.90 117.98 118.84 1afc s PHE 64 Ca 0.54 -0.62 -0.30 0.00 0.12 0.00 0.00 56.93 56.68 1afc s PHE 64 Cb -0.10 -1.91 -0.06 0.00 -0.57 0.00 0.00 43.02 40.37 1afc s PHE 64 CO 0.44 -0.23 1.73 -1.17 -0.10 0.00 0.00 175.22 175.89 1afc s LEU 65 N 0.53 4.32 0.31 -0.37 0.20 -0.63 -1.05 118.68 121.99 1afc s LEU 65 Ca -0.07 2.31 0.03 0.00 0.69 0.00 0.00 54.13 57.09 1afc s LEU 65 Cb -0.15 -3.53 -0.06 0.00 -0.43 0.00 0.00 46.19 42.01 1afc s LEU 65 CO 0.03 -0.98 0.06 0.00 -0.29 0.00 0.00 176.35 175.18 1afc s ALA 66 N 4.23 2.23 -0.29 5.97 0.00 -0.02 -4.43 121.76 129.45 1afc s ALA 66 Ca 0.77 -2.02 0.00 0.00 0.00 0.00 0.00 51.96 50.72 1afc s ALA 66 Cb -0.35 0.73 0.09 0.00 0.00 0.00 0.00 23.12 23.58 1afc s ALA 66 CO 0.32 -0.33 0.05 1.41 0.00 0.00 0.00 175.76 177.21 1afc s MET 67 N -3.92 1.03 0.95 0.00 1.75 -1.04 -1.60 119.30 116.48 1afc s MET 67 Ca 0.37 -1.13 -0.15 0.00 -1.25 0.00 0.00 55.69 53.52 1afc s MET 67 Cb 0.08 -2.35 0.24 0.00 2.84 0.00 0.00 34.83 35.64 1afc s MET 67 CO 0.15 -0.86 0.54 -0.40 -0.65 0.00 0.00 175.02 173.80 1afc n ASP 68 N 4.72 -3.31 0.21 1.11 5.68 -0.29 -4.79 116.55 119.88 1afc n ASP 68 Ca -0.04 -0.54 0.08 0.00 -0.50 0.00 0.00 54.79 53.79 1afc n ASP 68 Cb 0.43 -0.65 0.42 0.00 -1.14 0.00 0.00 41.12 40.18 1afc n ASP 68 CO 0.00 0.00 0.00 0.74 -1.33 0.00 0.00 177.20 176.61 1afc h THR 69 N -3.00 0.70 -0.01 2.12 2.02 -2.02 -1.39 112.91 111.33 1afc h THR 69 Ca -0.24 -1.25 0.00 0.00 0.77 0.00 0.00 66.41 65.69 1afc h THR 69 Cb 0.82 1.81 0.00 0.00 -1.74 0.00 0.00 68.15 69.04 1afc h THR 69 CO 0.15 0.28 0.00 0.47 0.37 0.00 0.00 175.52 176.78 1afc n ASP 70 N -3.48 0.10 -0.57 4.18 8.00 -1.26 -4.91 116.55 118.62 1afc n ASP 70 Ca -0.00 -1.28 0.00 0.00 0.71 0.00 0.00 54.79 54.22 1afc n ASP 70 Cb 0.45 -0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.55 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 0.89 0.87 3.14 0.44 0.00 -0.52 -4.30 105.19 105.71 1afc n GLY 71 Ca 0.18 -0.62 -0.31 0.00 0.00 0.00 0.00 46.02 45.26 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 -1.14 2.00 0.44 0.99 2.96 -1.25 0.27 118.68 122.94 1afc s LEU 72 Ca 0.00 -0.55 -0.24 0.00 -0.22 0.00 0.00 54.13 53.12 1afc s LEU 72 Cb 0.00 -1.34 -0.08 0.00 0.50 0.00 0.00 46.19 45.27 1afc s LEU 72 CO 0.00 0.07 1.19 -0.76 -1.32 0.00 0.00 176.35 175.53 1afc s LEU 73 N 0.84 4.09 0.05 -0.68 1.02 -1.26 -1.14 118.68 121.60 1afc s LEU 73 Ca -0.08 2.39 -0.27 0.00 0.02 0.00 0.00 54.13 56.20 1afc s LEU 73 Cb -0.15 -4.12 0.08 0.00 0.02 0.00 0.00 46.19 42.01 1afc s LEU 73 CO -0.01 -0.86 0.67 -0.72 0.02 0.00 0.00 176.35 175.46 1afc s TYR 74 N -1.45 -0.56 -0.52 0.29 -0.85 -0.62 -4.36 117.35 109.28 1afc s TYR 74 Ca 0.61 0.62 -0.26 0.00 -0.52 0.00 0.00 57.07 57.52 1afc s TYR 74 Cb -0.31 0.50 0.03 0.00 0.38 0.00 0.00 41.96 42.56 1afc s TYR 74 CO 0.39 -0.71 1.00 0.20 -1.52 0.00 0.00 175.55 174.91 1afc s GLY 75 N -2.09 1.36 -0.19 5.49 0.00 -0.72 -0.84 107.32 110.33 1afc s GLY 75 Ca -0.03 -0.95 -0.14 0.00 0.00 0.00 0.00 44.72 43.60 1afc s GLY 75 CO -0.04 2.17 0.30 -0.45 0.00 0.00 0.00 173.10 175.08 1afc s SER 76 N 2.65 6.37 -0.86 1.64 0.15 -0.21 -4.65 113.70 118.78 1afc s SER 76 Ca 0.37 0.43 -0.04 0.00 0.70 0.00 0.00 55.95 57.41 1afc s SER 76 Cb -0.10 -2.18 0.16 0.00 -1.71 0.00 0.00 66.02 62.19 1afc s SER 76 CO 0.24 0.03 2.40 0.00 1.20 0.00 0.00 173.24 177.11 1afc n GLN 77 N 4.02 3.57 0.00 5.44 10.64 -1.26 0.31 117.38 140.09 1afc n GLN 77 Ca -0.11 -3.21 0.00 0.00 -1.83 0.00 0.00 57.00 51.84 1afc n GLN 77 Cb 0.52 -2.36 0.00 0.00 -0.86 0.00 0.00 30.24 27.54 1afc n GLN 77 CO 0.00 0.00 0.00 2.41 -1.83 0.00 0.00 177.06 177.64 1afc n THR 78 N 0.76 0.00 -3.28 -0.39 -1.04 -1.26 -4.98 114.28 104.08 1afc n THR 78 Ca 0.54 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 62.12 1afc n THR 78 Cb 0.36 0.00 -0.08 0.00 -1.82 0.00 0.00 70.33 68.79 1afc n THR 78 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1afc s PRO 79 N -0.79 3.33 0.34 -2.82 0.04 -1.26 -4.88 135.00 128.96 1afc s PRO 79 Ca 0.00 -0.49 0.10 0.00 0.04 0.00 0.00 61.00 60.64 1afc s PRO 79 Cb 0.00 -3.90 -0.06 0.00 0.04 0.00 0.00 34.50 30.58 1afc s PRO 79 CO 0.00 -0.77 -0.10 0.54 0.04 0.00 0.00 177.00 176.71 1afc s ASN 80 N 1.82 3.74 0.59 6.66 4.22 -1.26 -5.02 114.94 125.69 1afc s ASN 80 Ca 0.15 -1.18 0.03 0.00 -2.14 0.00 0.00 52.86 49.72 1afc s ASN 80 Cb -0.16 -0.35 0.15 0.00 1.28 0.00 0.00 41.25 42.17 1afc s ASN 80 CO 0.14 -0.19 1.04 1.05 -2.04 0.00 0.00 177.10 177.10 1afc h GLU 81 N 2.03 0.00 -0.59 3.55 9.09 -2.01 -1.17 114.58 125.49 1afc h GLU 81 Ca -0.42 0.00 0.00 0.00 0.05 0.00 0.00 59.36 58.99 1afc h GLU 81 Cb 1.25 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.35 1afc h GLU 81 CO 0.70 0.00 0.00 0.39 0.05 0.00 0.00 179.01 180.15 1afc n GLU 82 N -2.38 2.16 0.00 1.06 1.02 -1.26 -3.95 120.64 117.29 1afc n GLU 82 Ca -0.00 -1.18 0.06 0.00 -0.02 0.00 0.00 57.16 56.02 1afc n GLU 82 Cb 0.89 -1.54 -0.01 0.00 -0.02 0.00 0.00 31.44 30.75 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 -1.89 4.10 -0.16 0.00 2.01 -1.25 -4.46 118.68 117.03 1afc s LEU 84 Ca 0.09 0.15 -0.01 0.00 0.01 0.00 0.00 54.13 54.37 1afc s LEU 84 Cb 0.10 -2.17 -0.01 0.00 0.01 0.00 0.00 46.19 44.11 1afc s LEU 84 CO 0.33 0.02 -0.11 -0.36 1.01 0.00 0.00 176.35 177.24 1afc s PHE 85 N 1.23 2.85 0.07 0.29 0.40 -1.07 -0.96 117.98 120.80 1afc s PHE 85 Ca 0.09 -0.80 -0.29 0.00 -0.60 0.00 0.00 56.93 55.33 1afc s PHE 85 Cb -0.14 -1.92 -0.05 0.00 0.51 0.00 0.00 43.02 41.42 1afc s PHE 85 CO 0.06 -0.35 0.93 -0.51 0.70 0.00 0.00 175.22 176.06 1afc s LEU 86 N 0.73 4.45 0.09 -0.37 1.43 0.23 -1.82 118.68 123.41 1afc s LEU 86 Ca -0.05 1.69 0.04 0.00 -1.03 0.00 0.00 54.13 54.78 1afc s LEU 86 Cb -0.15 -3.52 -0.04 0.00 0.03 0.00 0.00 46.19 42.51 1afc s LEU 86 CO 0.02 -0.11 0.04 -1.83 0.23 0.00 0.00 176.35 174.70 1afc s GLU 87 N 0.29 2.73 -0.09 1.70 4.04 -1.20 -2.13 118.70 124.04 1afc s GLU 87 Ca 0.47 -0.76 -0.01 0.00 0.04 0.00 0.00 54.97 54.71 1afc s GLU 87 Cb -0.22 -2.64 0.03 0.00 0.02 0.00 0.00 34.13 31.32 1afc s GLU 87 CO 0.28 0.55 -0.01 1.03 -1.84 0.00 0.00 175.26 175.27 1afc s ARG 88 N -2.36 0.83 0.89 -4.83 3.00 -0.96 -4.93 118.95 110.59 1afc s ARG 88 Ca 0.28 -0.03 -0.11 0.00 0.00 0.00 0.00 55.73 55.87 1afc s ARG 88 Cb -0.12 -1.22 0.12 0.00 0.00 0.00 0.00 34.95 33.73 1afc s ARG 88 CO 0.20 -0.33 1.09 -1.17 0.00 0.00 0.00 175.30 175.10 1afc s LEU 89 N 1.90 2.34 0.00 2.53 1.98 -1.26 -2.95 118.68 123.22 1afc s LEU 89 Ca 0.04 1.56 0.00 0.00 -2.89 0.00 0.00 54.13 52.85 1afc s LEU 89 Cb -0.13 -4.00 0.00 0.00 0.66 0.00 0.00 46.19 42.72 1afc s LEU 89 CO -0.06 -2.63 0.00 -0.62 -1.89 0.00 0.00 176.35 171.15 1afc n GLU 90 N -3.88 0.00 0.27 1.98 1.02 -1.06 -4.86 120.64 114.10 1afc n GLU 90 Ca 0.07 0.00 -0.15 0.00 -0.02 0.00 0.00 57.16 57.06 1afc n GLU 90 Cb 0.55 0.00 -0.08 0.00 -0.02 0.00 0.00 31.44 31.89 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 -0.84 0.00 3.49 4.11 -1.95 -1.67 114.58 117.72 1afc h GLU 91 Ca 0.00 0.06 0.00 0.00 0.07 0.00 0.00 59.36 59.49 1afc h GLU 91 Cb 0.00 0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.44 1afc h GLU 91 CO 0.00 -0.56 0.00 0.27 0.07 0.00 0.00 179.01 178.79 1afc n ASN 92 N -4.97 0.00 -0.25 3.06 0.23 -1.26 -4.75 115.26 107.31 1afc n ASN 92 Ca -0.10 -0.21 -0.02 0.00 -0.53 0.00 0.00 54.58 53.71 1afc n ASN 92 Cb 0.39 -0.11 -0.00 0.00 -2.08 0.00 0.00 39.78 37.97 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 -1.11 -0.10 -4.27 -2.53 8.25 -0.63 -4.97 115.22 109.86 1afc n HIS 93 Ca 0.08 0.00 -0.25 0.00 -0.26 0.00 0.00 57.72 57.29 1afc n HIS 93 Cb 0.07 -1.30 -0.08 0.00 1.12 0.00 0.00 29.99 29.80 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 -2.11 2.71 0.59 4.41 1.51 -1.26 -4.75 117.35 118.44 1afc s TYR 94 Ca 0.00 -0.20 0.08 0.00 -1.01 0.00 0.00 57.07 55.94 1afc s TYR 94 Cb 0.00 -1.28 0.10 0.00 -0.11 0.00 0.00 41.96 40.67 1afc s TYR 94 CO 0.00 0.55 0.81 0.09 -1.11 0.00 0.00 175.55 175.89 1afc n ASN 95 N -0.35 1.92 -3.63 2.29 3.02 -0.88 -2.55 115.26 115.07 1afc n ASN 95 Ca -0.09 -2.42 -0.15 0.00 -0.03 0.00 0.00 54.58 51.89 1afc n ASN 95 Cb 0.57 -0.45 -0.07 0.00 -0.61 0.00 0.00 39.78 39.22 1afc n ASN 95 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 1afc s THR 96 N -2.56 0.01 -0.07 3.41 -1.32 -1.15 -2.39 115.64 111.57 1afc s THR 96 Ca 0.60 -0.10 0.01 0.00 -1.21 0.00 0.00 61.69 60.98 1afc s THR 96 Cb -0.04 -0.86 0.02 0.00 -1.51 0.00 0.00 72.50 70.11 1afc s THR 96 CO 0.38 -0.05 -0.06 -0.31 -2.21 0.00 0.00 174.62 172.36 1afc s TYR 97 N -0.66 1.09 -0.07 9.09 1.51 -1.26 -2.26 117.35 124.79 1afc s TYR 97 Ca -0.07 -0.41 0.02 0.00 -1.01 0.00 0.00 57.07 55.60 1afc s TYR 97 Cb -0.03 -0.92 -0.03 0.00 -0.11 0.00 0.00 41.96 40.87 1afc s TYR 97 CO 0.05 -0.31 -0.12 0.42 -1.11 0.00 0.00 175.55 174.48 1afc s ILE 98 N 1.22 3.23 0.01 2.71 1.09 -0.91 -2.24 121.20 126.32 1afc s ILE 98 Ca -0.05 -0.65 -0.30 0.00 -1.10 0.00 0.00 60.65 58.55 1afc s ILE 98 Cb -0.14 -2.30 -0.08 0.00 -1.06 0.00 0.00 42.46 38.89 1afc s ILE 98 CO -0.02 0.58 1.81 -0.55 -0.10 0.00 0.00 174.94 176.66 1afc s SER 99 N -0.56 6.54 0.26 3.58 0.15 -1.06 0.75 113.70 123.36 1afc s SER 99 Ca 0.08 2.50 -0.05 0.00 0.70 0.00 0.00 55.95 59.18 1afc s SER 99 Cb -0.12 -2.54 0.51 0.00 -1.71 0.00 0.00 66.02 62.17 1afc s SER 99 CO 0.02 -0.98 1.61 0.50 1.20 0.00 0.00 173.24 175.58 1afc h LYS 100 N 9.81 0.07 0.10 5.44 3.64 -1.37 -2.45 116.57 131.82 1afc h LYS 100 Ca -0.45 -0.00 0.01 0.00 -1.27 0.00 0.00 60.65 58.94 1afc h LYS 100 Cb 1.21 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 33.00 1afc h LYS 100 CO 0.94 0.04 -0.13 0.87 -2.27 0.00 0.00 179.45 178.91 1afc h LYS 101 N 0.07 -0.26 -1.84 1.90 1.57 -1.79 -2.89 116.57 113.32 1afc h LYS 101 Ca 0.46 0.02 -0.69 0.00 -1.87 0.00 0.00 60.65 58.57 1afc h LYS 101 Cb 0.84 0.06 -0.34 0.00 0.08 0.00 0.00 32.23 32.87 1afc h LYS 101 CO -0.77 -0.17 0.24 0.72 -0.57 0.00 0.00 179.45 178.90 1afc n HIS 102 N -5.25 3.21 0.04 -1.35 8.25 -1.22 -4.77 115.22 114.13 1afc n HIS 102 Ca -0.07 -2.76 -0.12 0.00 -0.26 0.00 0.00 57.72 54.51 1afc n HIS 102 Cb 0.17 -0.70 -0.08 0.00 1.12 0.00 0.00 29.99 30.49 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 2.92 -0.18 0.00 -1.41 0.00 -1.21 0.61 119.26 119.98 1afc h ALA 103 Ca 0.43 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1afc h ALA 103 Cb 0.43 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1afc h ALA 103 CO 1.15 -0.31 0.00 -0.85 0.00 0.00 0.00 179.25 179.24 1afc n GLU 104 N -4.92 0.26 -0.00 0.00 0.00 -1.26 -2.07 120.64 112.65 1afc n GLU 104 Ca -0.08 0.02 0.10 0.00 0.00 0.00 0.00 57.16 57.20 1afc n GLU 104 Cb 0.27 -1.50 -0.13 0.00 0.00 0.00 0.00 31.44 30.08 1afc n GLU 104 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1afc n LYS 105 N -1.03 0.31 -3.59 3.44 4.01 0.20 -5.01 118.16 116.49 1afc n LYS 105 Ca 0.06 -0.07 -0.20 0.00 -0.51 0.00 0.00 58.31 57.60 1afc n LYS 105 Cb 0.04 -1.49 0.06 0.00 -0.51 0.00 0.00 35.03 33.12 1afc n LYS 105 CO 0.00 0.00 0.00 0.72 -1.11 0.00 0.00 177.40 177.01 1afc n HIS 106 N -1.75 -2.05 -3.19 2.13 8.25 -0.22 -4.96 115.22 113.43 1afc n HIS 106 Ca 0.01 0.89 -0.46 0.00 -0.26 0.00 0.00 57.72 57.90 1afc n HIS 106 Cb 0.41 -4.69 -0.02 0.00 1.12 0.00 0.00 29.99 26.80 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 -3.53 3.54 0.69 4.41 0.52 -1.21 -4.75 118.94 118.62 1afc s TRP 107 Ca 0.02 -1.79 -0.11 0.00 0.02 0.00 0.00 56.10 54.24 1afc s TRP 107 Cb -0.01 -3.99 0.00 0.00 -1.15 0.00 0.00 33.47 28.33 1afc s TRP 107 CO 0.78 -1.17 1.07 -0.06 0.02 0.00 0.00 176.95 177.59 1afc s PHE 108 N 1.04 3.34 -0.19 -1.98 0.08 -1.26 -2.56 117.98 116.46 1afc s PHE 108 Ca 0.23 1.16 -0.16 0.00 0.12 0.00 0.00 56.93 58.28 1afc s PHE 108 Cb -0.08 -2.96 -0.04 0.00 -0.57 0.00 0.00 43.02 39.37 1afc s PHE 108 CO -0.09 -1.11 0.41 0.08 -0.10 0.00 0.00 175.22 174.42 1afc s VAL 109 N -3.26 5.20 0.30 -0.44 1.01 -0.95 -4.55 120.40 117.71 1afc s VAL 109 Ca 0.57 0.76 -0.13 0.00 0.00 0.00 0.00 61.98 63.19 1afc s VAL 109 Cb -0.12 -3.75 0.01 0.00 0.00 0.00 0.00 36.38 32.53 1afc s VAL 109 CO 0.53 0.27 0.59 -0.83 0.00 0.00 0.00 175.10 175.66 1afc s GLY 110 N 0.94 0.58 0.03 4.51 0.00 -1.26 -4.49 107.32 107.63 1afc s GLY 110 Ca 0.20 -0.88 0.02 0.00 0.00 0.00 0.00 44.72 44.07 1afc s GLY 110 CO 0.08 -0.53 -0.07 1.08 0.00 0.00 0.00 173.10 173.66 1afc s LEU 111 N -3.06 2.17 0.33 0.66 1.43 -0.99 0.56 118.68 119.78 1afc s LEU 111 Ca 0.20 -0.38 -0.12 0.00 -1.03 0.00 0.00 54.13 52.80 1afc s LEU 111 Cb -0.03 -0.19 -0.07 0.00 0.03 0.00 0.00 46.19 45.93 1afc s LEU 111 CO 0.11 -0.11 0.70 -0.54 0.23 0.00 0.00 176.35 176.75 1afc s LYS 112 N -1.05 3.86 0.48 1.70 1.02 0.23 -4.47 119.74 121.51 1afc s LYS 112 Ca -0.06 0.48 0.15 0.00 0.02 0.00 0.00 55.97 56.56 1afc s LYS 112 Cb -0.07 -2.47 0.82 0.00 -0.52 0.00 0.00 37.83 35.59 1afc s LYS 112 CO 0.00 0.12 1.39 1.57 -0.92 0.00 0.00 175.35 177.51 1afc h LYS 113 N 1.90 0.00 -0.24 1.68 5.09 -1.88 0.24 116.57 123.35 1afc h LYS 113 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.27 1afc h LYS 113 Cb 1.18 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.51 1afc h LYS 113 CO 0.65 0.00 0.00 0.27 -2.09 0.00 0.00 179.45 178.28 1afc n ASN 114 N -2.35 2.84 0.00 7.07 6.94 -1.26 -4.68 115.26 123.83 1afc n ASN 114 Ca -0.01 -1.90 0.00 0.00 -0.02 0.00 0.00 54.58 52.65 1afc n ASN 114 Cb 0.49 -0.15 0.00 0.00 -2.36 0.00 0.00 39.78 37.76 1afc n ASN 114 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1afc n GLY 115 N 1.37 3.01 3.76 4.83 0.00 0.84 -5.05 105.19 113.95 1afc n GLY 115 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 1afc n GLY 115 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1afc s ARG 116 N -0.55 4.48 0.79 1.61 0.52 -1.26 -2.06 118.95 122.49 1afc s ARG 116 Ca 0.00 2.01 -0.12 0.00 -0.52 0.00 0.00 55.73 57.11 1afc s ARG 116 Cb 0.00 -3.12 0.07 0.00 0.52 0.00 0.00 34.95 32.43 1afc s ARG 116 CO 0.00 -0.00 1.14 -1.54 0.02 0.00 0.00 175.30 174.91 1afc s SER 117 N -0.69 4.02 0.24 0.23 1.04 -1.26 0.76 113.70 118.04 1afc s SER 117 Ca 0.47 2.08 -0.02 0.00 0.48 0.00 0.00 55.95 58.95 1afc s SER 117 Cb -0.36 -2.55 -0.05 0.00 0.10 0.00 0.00 66.02 63.16 1afc s SER 117 CO 0.47 -2.37 0.45 -0.54 0.98 0.00 0.00 173.24 172.24 1afc s LYS 118 N -4.50 3.56 0.44 4.02 1.02 0.19 -4.56 119.74 119.91 1afc s LYS 118 Ca 0.66 -0.21 -0.21 0.00 0.02 0.00 0.00 55.97 56.23 1afc s LYS 118 Cb -0.22 -2.76 -0.10 0.00 -0.52 0.00 0.00 37.83 34.23 1afc s LYS 118 CO 0.52 0.33 0.99 -0.51 -0.92 0.00 0.00 175.35 175.76 1afc s LEU 119 N -3.41 3.95 0.26 3.17 1.43 -1.26 -4.46 118.68 118.35 1afc s LEU 119 Ca 0.40 1.81 -0.04 0.00 -1.03 0.00 0.00 54.13 55.28 1afc s LEU 119 Cb -0.11 -4.48 0.37 0.00 0.03 0.00 0.00 46.19 42.00 1afc s LEU 119 CO 0.29 -0.49 1.88 1.23 0.23 0.00 0.00 176.35 179.49 1afc h GLY 120 N 1.93 1.44 2.00 -3.19 0.00 0.36 -2.43 103.07 103.18 1afc h GLY 120 Ca -0.49 -0.45 0.00 0.00 0.00 0.00 0.00 47.33 46.39 1afc h GLY 120 CO 0.61 0.34 0.00 -2.55 0.00 0.00 0.00 176.54 174.93 1afc h PRO 121 N 1.14 0.00 -0.42 4.80 0.11 -1.82 -1.91 132.00 133.90 1afc h PRO 121 Ca 0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.52 1afc h PRO 121 Cb 0.13 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.24 1afc h PRO 121 CO -0.16 0.00 0.00 0.54 -0.21 0.00 0.00 178.00 178.17 1afc n ARG 122 N -2.47 3.52 -3.85 1.05 1.74 -0.92 -4.96 116.66 110.78 1afc n ARG 122 Ca -0.00 -2.82 -0.36 0.00 -0.77 0.00 0.00 57.85 53.90 1afc n ARG 122 Cb 0.13 -1.87 -0.13 0.00 -1.02 0.00 0.00 32.46 29.57 1afc n ARG 122 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 1afc s THR 123 N -2.37 4.08 0.03 0.55 -4.23 -0.72 -5.00 115.64 107.98 1afc s THR 123 Ca 0.44 -0.25 0.02 0.00 -1.18 0.00 0.00 61.69 60.71 1afc s THR 123 Cb 0.33 -2.89 -0.02 0.00 1.34 0.00 0.00 72.50 71.26 1afc s THR 123 CO 0.14 0.37 -0.06 -1.38 -0.54 0.00 0.00 174.62 173.16 1afc s HIS 124 N 1.44 0.54 0.31 3.99 -3.43 -1.26 -4.59 115.29 112.29 1afc s HIS 124 Ca 0.05 -0.37 -0.28 0.00 -0.80 0.00 0.00 55.06 53.66 1afc s HIS 124 Cb -0.15 -0.33 -0.14 0.00 -1.43 0.00 0.00 32.58 30.53 1afc s HIS 124 CO 0.02 -0.07 1.05 0.34 -2.00 0.00 0.00 174.74 174.08 1afc n PHE 125 N 1.94 1.42 0.00 0.38 7.35 -1.26 -2.74 117.46 124.55 1afc n PHE 125 Ca -0.20 0.67 0.00 0.00 -0.76 0.00 0.00 57.45 57.16 1afc n PHE 125 Cb 0.56 -2.27 0.00 0.00 0.35 0.00 0.00 39.48 38.12 1afc n PHE 125 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1afc n GLY 126 N 1.15 0.56 3.92 7.13 0.00 -1.26 -5.06 105.19 111.63 1afc n GLY 126 Ca 0.09 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.73 3.55 0.09 1.61 -0.21 -1.11 -4.99 119.66 117.88 1afc s GLN 127 Ca 0.00 -0.20 0.26 0.00 0.02 0.00 0.00 55.36 55.43 1afc s GLN 127 Cb 0.00 -2.70 0.63 0.00 1.00 0.00 0.00 33.01 31.94 1afc s GLN 127 CO 0.00 0.24 1.54 1.63 -2.12 0.00 0.00 175.29 176.57 1afc n LYS 128 N -1.17 0.18 0.10 2.91 5.02 -1.26 -2.27 118.16 121.67 1afc n LYS 128 Ca -0.04 0.08 0.12 0.00 -2.02 0.00 0.00 58.31 56.46 1afc n LYS 128 Cb 0.55 -1.64 0.45 0.00 -0.02 0.00 0.00 35.03 34.37 1afc n LYS 128 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1afc n ALA 129 N -1.70 1.95 0.34 7.82 0.00 -1.26 -3.11 120.51 124.55 1afc n ALA 129 Ca 0.05 0.02 0.11 0.00 0.00 0.00 0.00 53.44 53.62 1afc n ALA 129 Cb 0.40 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.44 1afc n ALA 129 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01 1afc n ILE 130 N -2.13 0.31 -4.55 0.00 3.06 -0.96 -2.35 119.36 112.73 1afc n ILE 130 Ca 0.04 -0.38 -0.22 0.00 -2.50 0.00 0.00 62.75 59.69 1afc n ILE 130 Cb 0.31 -0.03 -0.15 0.00 0.54 0.00 0.00 39.64 40.31 1afc n ILE 130 CO 0.00 0.00 0.00 -1.48 -2.50 0.00 0.00 176.55 172.57 1afc s LEU 131 N -4.49 1.93 0.37 9.51 -0.00 -1.21 -4.42 118.68 120.37 1afc s LEU 131 Ca 0.01 -0.23 0.08 0.00 -0.00 0.00 0.00 54.13 53.98 1afc s LEU 131 Cb 0.13 -0.67 -0.04 0.00 -0.00 0.00 0.00 46.19 45.60 1afc s LEU 131 CO 0.81 0.13 0.17 -0.36 -0.00 0.00 0.00 176.35 177.09 1afc s PHE 132 N -0.08 2.67 -0.04 3.48 0.40 -1.00 -2.68 117.98 120.73 1afc s PHE 132 Ca 0.01 -0.46 0.02 0.00 -0.60 0.00 0.00 56.93 55.90 1afc s PHE 132 Cb -0.07 -1.79 0.01 0.00 0.51 0.00 0.00 43.02 41.68 1afc s PHE 132 CO 0.00 0.25 -0.08 -1.17 0.70 0.00 0.00 175.22 174.92 1afc s LEU 133 N -3.89 1.65 -0.12 -0.37 2.96 -0.25 -2.08 118.68 116.58 1afc s LEU 133 Ca 0.40 -0.19 -0.18 0.00 -0.22 0.00 0.00 54.13 53.94 1afc s LEU 133 Cb -0.00 -0.57 -0.04 0.00 0.50 0.00 0.00 46.19 46.08 1afc s LEU 133 CO 0.23 0.03 0.47 -2.84 -1.32 0.00 0.00 176.35 172.92 1afc s PRO 134 N 0.45 4.33 0.26 0.98 0.02 -1.26 -2.05 135.00 137.72 1afc s PRO 134 Ca -0.07 0.43 0.00 0.00 0.02 0.00 0.00 61.00 61.38 1afc s PRO 134 Cb -0.11 -3.44 0.00 0.00 0.02 0.00 0.00 34.50 30.97 1afc s PRO 134 CO 0.01 0.15 0.02 1.28 -0.33 0.00 0.00 177.00 178.13 1afc n LEU 135 N 3.72 0.00 0.00 -5.54 4.77 -0.53 -4.78 117.00 114.65 1afc n LEU 135 Ca -0.07 -1.59 0.00 0.00 -0.03 0.00 0.00 56.01 54.31 1afc n LEU 135 Cb 0.52 0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.77 1afc n LEU 135 CO 0.43 -0.25 0.11 -0.81 -1.33 0.00 0.00 177.39 175.54