#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2f7i h PRO 11 N 0.00 0.00 -3.27 0.00 0.14 -1.83 -3.42 132.00 123.61 2f7i h PRO 11 Ca 0.00 0.00 -0.34 0.00 0.14 0.00 0.00 66.00 65.80 2f7i h PRO 11 Cb 0.00 0.00 -0.38 0.00 0.14 0.00 0.00 31.00 30.76 2f7i h PRO 11 CO 0.00 0.29 -0.71 -1.17 0.14 0.00 0.00 178.00 176.55 2f7i s LEU 12 N -6.97 0.19 0.29 1.56 2.96 -1.26 -0.15 118.68 115.30 2f7i s LEU 12 Ca 0.00 0.14 0.08 0.00 -0.22 0.00 0.00 54.13 54.13 2f7i s LEU 12 Cb 0.11 -0.02 -0.06 0.00 0.50 0.00 0.00 46.19 46.72 2f7i s LEU 12 CO 0.66 -0.24 -0.08 -0.32 -1.32 0.00 0.00 176.35 175.05 2f7i s MET 13 N 2.08 1.59 0.07 1.98 -2.45 0.21 -4.46 119.30 118.32 2f7i s MET 13 Ca 0.03 -1.80 0.05 0.00 -1.25 0.00 0.00 55.69 52.72 2f7i s MET 13 Cb -0.12 -1.29 -0.03 0.00 1.25 0.00 0.00 34.83 34.64 2f7i s MET 13 CO -0.04 0.09 -0.14 0.08 1.05 0.00 0.00 175.02 176.06 2f7i s VAL 14 N -2.90 1.10 0.02 10.11 1.01 -0.64 -1.60 120.40 127.49 2f7i s VAL 14 Ca 0.30 -1.30 0.01 0.00 0.00 0.00 0.00 61.98 60.98 2f7i s VAL 14 Cb 0.03 -1.06 -0.01 0.00 0.00 0.00 0.00 36.38 35.33 2f7i s VAL 14 CO 0.13 -0.23 -0.05 -0.75 0.00 0.00 0.00 175.10 174.20 2f7i s LYS 15 N -1.74 0.37 -0.02 2.72 2.20 -0.31 -1.16 119.74 121.79 2f7i s LYS 15 Ca -0.02 -0.43 0.00 0.00 -0.36 0.00 0.00 55.97 55.16 2f7i s LYS 15 Cb -0.10 -0.21 0.02 0.00 -1.51 0.00 0.00 37.83 36.04 2f7i s LYS 15 CO 0.02 0.04 0.01 0.08 -0.36 0.00 0.00 175.35 175.14 2f7i s VAL 16 N -0.78 0.09 0.22 4.02 1.01 0.21 -1.46 120.40 123.70 2f7i s VAL 16 Ca -0.06 0.11 0.11 0.00 0.00 0.00 0.00 61.98 62.14 2f7i s VAL 16 Cb -0.06 -0.18 -0.05 0.00 0.00 0.00 0.00 36.38 36.09 2f7i s VAL 16 CO -0.00 0.11 -0.21 -0.76 0.00 0.00 0.00 175.10 174.23 2f7i s LEU 17 N 0.87 2.49 -0.28 3.92 1.43 0.12 -1.08 118.68 126.15 2f7i s LEU 17 Ca -0.08 -0.93 -0.07 0.00 -1.03 0.00 0.00 54.13 52.02 2f7i s LEU 17 Cb -0.11 -1.07 0.00 0.00 0.03 0.00 0.00 46.19 45.03 2f7i s LEU 17 CO -0.02 0.06 0.07 -0.62 0.23 0.00 0.00 176.35 176.06 2f7i s ASP 18 N -2.98 5.04 0.11 2.29 -1.08 0.60 -1.00 116.67 119.66 2f7i s ASP 18 Ca 0.23 -0.58 0.26 0.00 -0.52 0.00 0.00 52.55 51.94 2f7i s ASP 18 Cb -0.06 -1.87 0.74 0.00 -1.46 0.00 0.00 42.92 40.26 2f7i s ASP 18 CO 0.11 -0.14 1.64 0.00 0.52 0.00 0.00 175.17 177.30 2f7i n ALA 19 N 4.87 2.63 -0.03 3.66 0.00 -0.19 -1.26 120.51 130.18 2f7i n ALA 19 Ca -0.15 -0.14 -0.19 0.00 0.00 0.00 0.00 53.44 52.96 2f7i n ALA 19 Cb 0.49 -1.34 -0.13 0.00 0.00 0.00 0.00 19.45 18.46 2f7i n ALA 19 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2f7i h VAL 20 N 0.00 1.39 0.00 0.00 2.07 -1.94 -3.39 116.25 114.38 2f7i h VAL 20 Ca 0.00 -2.37 0.00 0.00 0.82 0.00 0.00 66.70 65.15 2f7i h VAL 20 Cb 0.66 2.97 0.00 0.00 -1.52 0.00 0.00 31.29 33.40 2f7i h VAL 20 CO 0.00 0.59 -0.99 0.54 0.02 0.00 0.00 177.57 177.73 2f7i n ARG 21 N -4.32 0.06 -2.97 1.57 1.74 -1.24 -5.00 116.66 106.50 2f7i n ARG 21 Ca -0.19 -0.01 -0.12 0.00 -0.77 0.00 0.00 57.85 56.76 2f7i n ARG 21 Cb 0.69 -1.51 0.06 0.00 -1.02 0.00 0.00 32.46 30.68 2f7i n ARG 21 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2f7i n GLY 22 N 1.48 -0.21 3.25 -0.13 0.00 -0.39 -5.03 105.19 104.15 2f7i n GLY 22 Ca 0.04 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.97 2f7i n GLY 22 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2f7i s SER 23 N -3.84 0.12 0.70 1.61 1.04 -1.09 -5.00 113.70 107.23 2f7i s SER 23 Ca 0.06 -0.78 -0.16 0.00 0.48 0.00 0.00 55.95 55.55 2f7i s SER 23 Cb -0.01 0.37 0.02 0.00 0.10 0.00 0.00 66.02 66.50 2f7i s SER 23 CO 0.52 -0.78 1.26 -2.16 0.98 0.00 0.00 173.24 173.05 2f7i s PRO 24 N -3.91 2.26 -0.45 4.02 0.04 -1.26 -0.29 135.00 135.40 2f7i s PRO 24 Ca 0.11 1.93 -0.17 0.00 0.04 0.00 0.00 61.00 62.90 2f7i s PRO 24 Cb 0.05 -1.83 0.04 0.00 0.04 0.00 0.00 34.50 32.80 2f7i s PRO 24 CO -0.06 -1.79 0.48 0.00 0.04 0.00 0.00 177.00 175.67 2f7i s ALA 25 N -1.69 3.44 0.07 8.56 0.00 -0.24 -4.54 121.76 127.36 2f7i s ALA 25 Ca 0.79 -1.67 -0.05 0.00 0.00 0.00 0.00 51.96 51.02 2f7i s ALA 25 Cb -0.34 -3.13 -0.05 0.00 0.00 0.00 0.00 23.12 19.60 2f7i s ALA 25 CO 0.43 -1.72 0.31 0.96 0.00 0.00 0.00 175.76 175.74 2f7i s ILE 26 N 2.17 5.25 -1.43 0.00 -4.36 -1.26 -4.34 121.20 117.23 2f7i s ILE 26 Ca 0.11 0.05 0.00 0.00 -0.26 0.00 0.00 60.65 60.55 2f7i s ILE 26 Cb -0.19 -3.60 0.00 0.00 1.25 0.00 0.00 42.46 39.92 2f7i s ILE 26 CO 0.12 0.20 0.00 -3.20 0.24 0.00 0.00 174.94 172.30 2f7i n ASN 27 N 0.59 -4.93 -4.67 4.36 5.15 -0.49 -4.93 115.26 110.34 2f7i n ASN 27 Ca -0.07 -0.01 -0.40 0.00 -0.60 0.00 0.00 54.58 53.50 2f7i n ASN 27 Cb 0.52 -4.03 -0.05 0.00 -0.53 0.00 0.00 39.78 35.69 2f7i n ASN 27 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2f7i s VAL 28 N -2.83 5.01 0.21 3.44 1.01 -1.26 -4.74 120.40 121.25 2f7i s VAL 28 Ca 0.00 1.29 -0.30 0.00 0.00 0.00 0.00 61.98 62.97 2f7i s VAL 28 Cb 0.00 -3.99 -0.08 0.00 0.00 0.00 0.00 36.38 32.31 2f7i s VAL 28 CO 0.00 0.13 1.16 0.00 0.00 0.00 0.00 175.10 176.39 2f7i s ALA 29 N 1.70 3.42 -0.05 5.51 0.00 -1.26 -1.08 121.76 130.00 2f7i s ALA 29 Ca 0.32 0.92 0.01 0.00 0.00 0.00 0.00 51.96 53.21 2f7i s ALA 29 Cb -0.16 -3.38 0.02 0.00 0.00 0.00 0.00 23.12 19.60 2f7i s ALA 29 CO 0.12 -0.29 -0.07 0.08 0.00 0.00 0.00 175.76 175.59 2f7i s VAL 30 N -0.43 0.76 -0.06 0.00 1.01 0.13 -0.96 120.40 120.84 2f7i s VAL 30 Ca 0.50 -0.25 0.05 0.00 0.00 0.00 0.00 61.98 62.28 2f7i s VAL 30 Cb -0.32 -0.75 -0.01 0.00 0.00 0.00 0.00 36.38 35.30 2f7i s VAL 30 CO 0.38 0.28 -0.24 -1.00 0.00 0.00 0.00 175.10 174.52 2f7i s HIS 31 N 0.88 2.35 -0.03 5.22 3.76 -0.27 -1.30 115.29 125.90 2f7i s HIS 31 Ca -0.11 -0.75 0.02 0.00 -0.15 0.00 0.00 55.06 54.06 2f7i s HIS 31 Cb -0.15 -1.55 -0.03 0.00 1.11 0.00 0.00 32.58 31.96 2f7i s HIS 31 CO 0.01 -0.25 -0.05 0.08 -0.85 0.00 0.00 174.74 173.68 2f7i s VAL 32 N -0.03 3.79 0.09 -0.90 1.01 0.22 0.08 120.40 124.67 2f7i s VAL 32 Ca -0.07 -0.60 0.04 0.00 0.00 0.00 0.00 61.98 61.36 2f7i s VAL 32 Cb -0.14 -2.61 -0.03 0.00 0.00 0.00 0.00 36.38 33.59 2f7i s VAL 32 CO 0.05 0.49 -0.12 -0.36 0.00 0.00 0.00 175.10 175.15 2f7i s PHE 33 N -0.93 1.14 -0.02 5.22 0.08 0.63 -0.86 117.98 123.24 2f7i s PHE 33 Ca 0.15 -0.56 0.07 0.00 0.12 0.00 0.00 56.93 56.71 2f7i s PHE 33 Cb -0.11 -0.63 -0.02 0.00 -0.57 0.00 0.00 43.02 41.69 2f7i s PHE 33 CO 0.05 0.04 -0.22 0.50 -0.10 0.00 0.00 175.22 175.50 2f7i s ARG 34 N -2.33 2.21 -0.05 0.44 6.06 -0.22 -0.82 118.95 124.25 2f7i s ARG 34 Ca 0.02 -0.87 -0.30 0.00 -2.50 0.00 0.00 55.73 52.09 2f7i s ARG 34 Cb -0.06 -2.16 -0.03 0.00 0.06 0.00 0.00 34.95 32.76 2f7i s ARG 34 CO 0.01 0.58 1.20 0.21 -2.50 0.00 0.00 175.30 174.80 2f7i s LYS 35 N -0.76 4.36 0.60 5.12 2.20 -0.09 -0.50 119.74 130.66 2f7i s LYS 35 Ca 0.11 1.68 -0.03 0.00 -0.36 0.00 0.00 55.97 57.38 2f7i s LYS 35 Cb -0.10 -3.55 0.03 0.00 -1.51 0.00 0.00 37.83 32.70 2f7i s LYS 35 CO 0.00 -0.44 0.86 0.00 -0.36 0.00 0.00 175.35 175.41 2f7i s ALA 36 N 2.16 3.54 0.34 3.13 0.00 -0.06 -4.74 121.76 126.13 2f7i s ALA 36 Ca 0.56 -1.06 0.10 0.00 0.00 0.00 0.00 51.96 51.56 2f7i s ALA 36 Cb -0.25 -2.34 0.88 0.00 0.00 0.00 0.00 23.12 21.41 2f7i s ALA 36 CO 0.22 -0.90 1.78 0.00 0.00 0.00 0.00 175.76 176.87 2f7i h ALA 37 N -0.15 1.87 -0.01 0.00 0.00 -1.96 0.36 119.26 119.37 2f7i h ALA 37 Ca -0.44 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.54 2f7i h ALA 37 Cb 1.29 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2f7i h ALA 37 CO 0.57 -0.25 0.00 -0.40 0.00 0.00 0.00 179.25 179.16 2f7i n ASP 38 N -4.71 0.07 -0.38 0.00 5.75 -1.26 -4.87 116.55 111.14 2f7i n ASP 38 Ca 0.24 -1.90 -0.05 0.00 -0.01 0.00 0.00 54.79 53.07 2f7i n ASP 38 Cb 0.67 -0.01 -0.02 0.00 -1.03 0.00 0.00 41.12 40.73 2f7i n ASP 38 CO 0.00 0.00 0.00 -0.67 -0.11 0.00 0.00 177.20 176.42 2f7i n ASP 39 N -0.51 -3.48 -4.86 -1.12 2.03 0.12 -5.03 116.55 103.70 2f7i n ASP 39 Ca 0.03 0.11 -0.21 0.00 0.52 0.00 0.00 54.79 55.24 2f7i n ASP 39 Cb 0.02 -1.51 -0.03 0.00 -0.72 0.00 0.00 41.12 38.88 2f7i n ASP 39 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 2f7i s THR 40 N -2.18 3.40 -0.21 5.18 -4.23 -1.26 -4.90 115.64 111.44 2f7i s THR 40 Ca 0.00 -1.36 -0.14 0.00 -1.18 0.00 0.00 61.69 59.01 2f7i s THR 40 Cb 0.00 -3.16 -0.04 0.00 1.34 0.00 0.00 72.50 70.64 2f7i s THR 40 CO 0.00 -0.15 0.33 0.26 -0.54 0.00 0.00 174.62 174.52 2f7i s TRP 41 N -2.33 3.37 -0.17 3.99 0.52 -1.26 -0.89 118.94 122.17 2f7i s TRP 41 Ca 0.42 0.52 -0.08 0.00 0.02 0.00 0.00 56.10 56.98 2f7i s TRP 41 Cb -0.05 -2.44 -0.04 0.00 -1.15 0.00 0.00 33.47 29.78 2f7i s TRP 41 CO 0.27 0.04 0.09 -1.21 0.02 0.00 0.00 176.95 176.15 2f7i s GLU 42 N 1.15 3.87 0.22 4.98 2.02 0.35 -4.93 118.70 126.36 2f7i s GLU 42 Ca 0.16 -0.28 -0.31 0.00 0.02 0.00 0.00 54.97 54.55 2f7i s GLU 42 Cb -0.14 -3.23 -0.15 0.00 0.10 0.00 0.00 34.13 30.71 2f7i s GLU 42 CO 0.07 0.39 1.21 -2.30 0.02 0.00 0.00 175.26 174.65 2f7i n PRO 43 N 3.18 1.48 0.00 0.39 -0.02 -1.26 -1.06 135.00 137.71 2f7i n PRO 43 Ca -0.17 0.52 0.00 0.00 -2.02 0.00 0.00 63.50 61.83 2f7i n PRO 43 Cb 0.53 -2.04 0.00 0.00 -0.02 0.00 0.00 33.50 31.96 2f7i n PRO 43 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2f7i n PHE 44 N 1.33 0.00 -3.57 6.00 7.35 -0.03 -4.76 117.46 123.78 2f7i n PHE 44 Ca 0.13 0.00 -0.08 0.00 -0.76 0.00 0.00 57.45 56.74 2f7i n PHE 44 Cb 0.28 0.04 -0.03 0.00 0.35 0.00 0.00 39.48 40.12 2f7i n PHE 44 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2f7i s ALA 45 N -1.80 -1.95 0.22 3.13 0.00 -1.05 -4.99 121.76 115.31 2f7i s ALA 45 Ca 0.00 1.46 -0.18 0.00 0.00 0.00 0.00 51.96 53.23 2f7i s ALA 45 Cb 0.00 -0.34 0.03 0.00 0.00 0.00 0.00 23.12 22.81 2f7i s ALA 45 CO 0.00 -0.47 0.57 -1.54 0.00 0.00 0.00 175.76 174.32 2f7i s SER 46 N -1.72 -0.27 -0.05 0.00 1.04 -1.26 0.70 113.70 112.14 2f7i s SER 46 Ca 0.03 -0.51 -0.18 0.00 0.48 0.00 0.00 55.95 55.77 2f7i s SER 46 Cb -0.01 0.62 0.06 0.00 0.10 0.00 0.00 66.02 66.79 2f7i s SER 46 CO -0.04 -1.12 0.82 0.61 0.98 0.00 0.00 173.24 174.49 2f7i n GLY 47 N -0.38 0.24 3.33 7.32 0.00 -0.42 -4.98 105.19 110.31 2f7i n GLY 47 Ca -0.08 -0.94 -0.31 0.00 0.00 0.00 0.00 46.02 44.69 2f7i n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2f7i s LYS 48 N -2.00 2.09 0.62 1.61 1.02 -1.26 -0.69 119.74 121.12 2f7i s LYS 48 Ca 0.20 -0.94 -0.19 0.00 0.02 0.00 0.00 55.97 55.06 2f7i s LYS 48 Cb -0.00 -2.06 -0.02 0.00 -0.52 0.00 0.00 37.83 35.23 2f7i s LYS 48 CO -0.02 0.56 1.27 0.95 -0.92 0.00 0.00 175.35 177.19 2f7i s THR 49 N -0.65 2.26 0.41 2.17 -4.23 -0.24 -4.78 115.64 110.58 2f7i s THR 49 Ca 0.10 0.16 -0.06 0.00 -1.18 0.00 0.00 61.69 60.72 2f7i s THR 49 Cb -0.10 -3.07 0.09 0.00 1.34 0.00 0.00 72.50 70.76 2f7i s THR 49 CO -0.00 -0.03 0.56 -1.54 -0.54 0.00 0.00 174.62 173.06 2f7i n SER 50 N -1.71 0.11 0.32 3.99 3.41 0.87 -1.39 113.62 119.22 2f7i n SER 50 Ca 0.15 -1.25 0.19 0.00 -0.26 0.00 0.00 58.87 57.70 2f7i n SER 50 Cb 0.48 -0.42 1.05 0.00 -0.26 0.00 0.00 64.21 65.06 2f7i n SER 50 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2f7i h GLU 51 N 0.00 0.00 -0.40 4.33 4.39 -1.94 -0.42 114.58 120.54 2f7i h GLU 51 Ca -0.18 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.52 2f7i h GLU 51 Cb 0.52 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.17 2f7i h GLU 51 CO 0.13 0.01 0.00 -1.13 -1.16 0.00 0.00 179.01 176.86 2f7i n SER 52 N -3.43 2.62 -0.30 1.42 3.41 -1.26 -4.81 113.62 111.27 2f7i n SER 52 Ca -0.03 -1.93 -0.04 0.00 -0.26 0.00 0.00 58.87 56.62 2f7i n SER 52 Cb 0.09 -0.26 -0.02 0.00 -0.26 0.00 0.00 64.21 63.76 2f7i n SER 52 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2f7i n GLY 53 N 1.31 0.67 3.59 5.00 0.00 -0.17 -4.81 105.19 110.79 2f7i n GLY 53 Ca 0.17 -0.46 -0.28 0.00 0.00 0.00 0.00 46.02 45.45 2f7i n GLY 53 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2f7i s GLU 54 N -1.78 2.16 -0.23 1.61 2.02 -1.26 -0.62 118.70 120.60 2f7i s GLU 54 Ca 0.00 -1.12 -0.01 0.00 0.02 0.00 0.00 54.97 53.86 2f7i s GLU 54 Cb 0.00 -2.27 0.07 0.00 0.10 0.00 0.00 34.13 32.03 2f7i s GLU 54 CO 0.00 0.47 0.01 -1.17 0.02 0.00 0.00 175.26 174.60 2f7i s LEU 55 N -2.56 1.94 0.39 1.80 2.96 -0.31 -0.09 118.68 122.81 2f7i s LEU 55 Ca 0.24 -1.11 0.08 0.00 -0.22 0.00 0.00 54.13 53.11 2f7i s LEU 55 Cb -0.10 -0.88 -0.03 0.00 0.50 0.00 0.00 46.19 45.69 2f7i s LEU 55 CO 0.15 -0.30 0.31 -1.00 -1.32 0.00 0.00 176.35 174.20 2f7i s HIS 56 N 1.63 2.74 -0.89 5.38 3.76 -1.26 -1.63 115.29 125.03 2f7i s HIS 56 Ca -0.01 -0.45 -0.00 0.00 -0.15 0.00 0.00 55.06 54.45 2f7i s HIS 56 Cb -0.18 -2.01 0.00 0.00 1.11 0.00 0.00 32.58 31.50 2f7i s HIS 56 CO -0.10 0.03 0.03 0.41 -0.85 0.00 0.00 174.74 174.25 2f7i n GLY 57 N -1.44 -0.05 0.23 -2.22 0.00 -1.26 -4.93 105.19 95.52 2f7i n GLY 57 Ca 0.01 -0.43 -0.16 0.00 0.00 0.00 0.00 46.02 45.44 2f7i n GLY 57 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2f7i h LEU 58 N -0.06 0.95 -8.40 0.99 3.38 -1.86 -3.48 115.31 106.82 2f7i h LEU 58 Ca -0.25 -0.58 -0.21 0.00 0.09 0.00 0.00 57.88 56.93 2f7i h LEU 58 Cb 1.18 -0.28 -0.06 0.00 0.09 0.00 0.00 40.66 41.59 2f7i h LEU 58 CO 0.29 1.38 -0.09 0.28 0.09 0.00 0.00 178.44 180.39 2f7i s THR 59 N -3.90 0.00 0.30 0.22 -1.32 -1.26 -4.80 115.64 104.87 2f7i s THR 59 Ca -0.10 -1.47 0.10 0.00 -1.21 0.00 0.00 61.69 59.02 2f7i s THR 59 Cb 0.09 -2.67 -0.05 0.00 -1.51 0.00 0.00 72.50 68.36 2f7i s THR 59 CO 0.90 0.00 -0.09 0.42 -2.21 0.00 0.00 174.62 173.64 2f7i s THR 60 N -2.93 2.73 0.38 5.08 -4.23 -1.26 -4.63 115.64 110.78 2f7i s THR 60 Ca 0.27 -2.17 0.18 0.00 -1.18 0.00 0.00 61.69 58.79 2f7i s THR 60 Cb -0.01 -2.58 0.17 0.00 1.34 0.00 0.00 72.50 71.41 2f7i s THR 60 CO 0.18 -0.33 1.92 1.05 -0.54 0.00 0.00 174.62 176.90 2f7i h GLU 61 N 2.04 0.00 -0.21 3.99 4.11 -1.98 -1.48 114.58 121.05 2f7i h GLU 61 Ca -0.42 0.00 0.01 0.00 0.07 0.00 0.00 59.36 59.02 2f7i h GLU 61 Cb 1.25 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.49 2f7i h GLU 61 CO 0.63 0.26 0.12 1.49 0.07 0.00 0.00 179.01 181.58 2f7i h GLU 62 N 0.00 0.25 0.00 1.06 4.22 -2.04 -3.22 114.58 114.85 2f7i h GLU 62 Ca -0.00 -0.02 -0.03 0.00 0.08 0.00 0.00 59.36 59.40 2f7i h GLU 62 Cb 0.52 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.71 2f7i h GLU 62 CO 0.03 0.17 -0.47 1.49 -2.18 0.00 0.00 179.01 178.05 2f7i h GLU 63 N 0.26 0.00 -3.41 1.92 4.81 -1.87 -3.39 114.58 112.90 2f7i h GLU 63 Ca 0.08 0.00 -0.76 0.00 -0.13 0.00 0.00 59.36 58.55 2f7i h GLU 63 Cb -0.01 0.00 -0.16 0.00 0.63 0.00 0.00 28.75 29.21 2f7i h GLU 63 CO -0.04 0.09 1.99 0.34 -0.73 0.00 0.00 179.01 180.66 2f7i n PHE 64 N -2.98 2.86 -2.11 0.92 7.35 -0.59 -4.97 117.46 117.94 2f7i n PHE 64 Ca 0.02 -2.77 -0.27 0.00 -0.76 0.00 0.00 57.45 53.66 2f7i n PHE 64 Cb 0.59 -1.90 0.07 0.00 0.35 0.00 0.00 39.48 38.58 2f7i n PHE 64 CO 0.00 0.00 0.00 0.14 -0.76 0.00 0.00 176.76 176.14 2f7i s VAL 65 N 0.12 2.52 0.41 -2.13 -7.23 -1.26 -4.94 120.40 107.88 2f7i s VAL 65 Ca 0.40 -0.08 -0.25 0.00 -1.81 0.00 0.00 61.98 60.24 2f7i s VAL 65 Cb 0.10 -3.11 -0.10 0.00 0.56 0.00 0.00 36.38 33.82 2f7i s VAL 65 CO 0.01 -0.13 1.19 -0.62 -0.31 0.00 0.00 175.10 175.23 2f7i n GLU 66 N -2.99 1.75 0.00 4.82 1.02 -1.26 -4.88 120.64 119.09 2f7i n GLU 66 Ca 0.07 0.62 0.00 0.00 -0.02 0.00 0.00 57.16 57.84 2f7i n GLU 66 Cb 0.60 -2.26 0.00 0.00 -0.02 0.00 0.00 31.44 29.76 2f7i n GLU 66 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2f7i n GLY 67 N 0.93 0.14 3.68 0.62 0.00 -0.98 -4.98 105.19 104.61 2f7i n GLY 67 Ca 0.07 -1.20 -0.37 0.00 0.00 0.00 0.00 46.02 44.53 2f7i n GLY 67 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2f7i s ILE 68 N -2.00 5.30 0.10 -0.61 1.01 -1.26 -0.71 121.20 123.03 2f7i s ILE 68 Ca 0.00 0.42 0.10 0.00 0.00 0.00 0.00 60.65 61.17 2f7i s ILE 68 Cb 0.00 -3.60 -0.04 0.00 0.01 0.00 0.00 42.46 38.84 2f7i s ILE 68 CO 0.00 0.33 -0.25 -0.31 0.00 0.00 0.00 174.94 174.70 2f7i s TYR 69 N 0.99 2.19 -0.08 3.97 1.51 0.28 -0.91 117.35 125.30 2f7i s TYR 69 Ca 0.13 -0.39 0.03 0.00 -1.01 0.00 0.00 57.07 55.83 2f7i s TYR 69 Cb -0.14 -1.22 0.01 0.00 -0.11 0.00 0.00 41.96 40.50 2f7i s TYR 69 CO 0.05 0.26 -0.19 0.21 -1.11 0.00 0.00 175.55 174.77 2f7i s LYS 70 N -1.83 2.44 -0.25 -0.62 2.20 0.00 -1.37 119.74 120.31 2f7i s LYS 70 Ca 0.12 -0.67 -0.03 0.00 -0.36 0.00 0.00 55.97 55.03 2f7i s LYS 70 Cb -0.10 -1.90 0.02 0.00 -1.51 0.00 0.00 37.83 34.34 2f7i s LYS 70 CO 0.05 0.12 -0.04 0.08 -0.36 0.00 0.00 175.35 175.20 2f7i s VAL 71 N 0.47 3.14 -0.20 4.02 1.01 1.00 -0.27 120.40 129.56 2f7i s VAL 71 Ca -0.17 -0.87 -0.05 0.00 0.00 0.00 0.00 61.98 60.89 2f7i s VAL 71 Cb -0.17 -2.56 -0.02 0.00 0.00 0.00 0.00 36.38 33.62 2f7i s VAL 71 CO 0.07 0.23 0.01 -0.70 0.00 0.00 0.00 175.10 174.70 2f7i s GLU 72 N 1.38 3.63 -0.21 2.72 2.12 0.11 -0.43 118.70 128.02 2f7i s GLU 72 Ca 0.02 -0.51 -0.04 0.00 0.36 0.00 0.00 54.97 54.79 2f7i s GLU 72 Cb -0.16 -3.10 -0.01 0.00 0.26 0.00 0.00 34.13 31.11 2f7i s GLU 72 CO -0.03 0.00 -0.03 0.42 -0.54 0.00 0.00 175.26 175.08 2f7i s ILE 73 N 1.03 3.54 -1.36 -3.70 1.01 0.11 -1.11 121.20 120.71 2f7i s ILE 73 Ca 0.02 -0.44 -0.16 0.00 0.00 0.00 0.00 60.65 60.07 2f7i s ILE 73 Cb -0.14 -2.60 0.04 0.00 0.01 0.00 0.00 42.46 39.76 2f7i s ILE 73 CO 0.02 0.43 2.03 -0.67 0.00 0.00 0.00 174.94 176.74 2f7i n ASP 74 N 4.59 4.17 0.16 3.58 2.03 -0.14 -1.47 116.55 129.47 2f7i n ASP 74 Ca -0.18 -2.86 0.01 0.00 0.52 0.00 0.00 54.79 52.28 2f7i n ASP 74 Cb 0.51 -1.67 0.28 0.00 -0.72 0.00 0.00 41.12 39.52 2f7i n ASP 74 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 2f7i h THR 75 N 4.66 1.33 -0.43 5.18 1.35 -1.87 -3.22 112.91 119.91 2f7i h THR 75 Ca 0.51 -1.59 -0.04 0.00 -0.55 0.00 0.00 66.41 64.74 2f7i h THR 75 Cb 0.73 1.84 -0.02 0.00 -1.73 0.00 0.00 68.15 68.98 2f7i h THR 75 CO 1.72 0.46 0.11 0.50 -0.25 0.00 0.00 175.52 178.05 2f7i h LYS 76 N 0.03 0.68 -0.70 4.72 3.64 -1.76 -2.23 116.57 120.95 2f7i h LYS 76 Ca -0.00 -0.16 -0.04 0.00 -1.27 0.00 0.00 60.65 59.18 2f7i h LYS 76 Cb 0.82 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 32.52 2f7i h LYS 76 CO 0.06 0.69 0.27 0.77 -2.27 0.00 0.00 179.45 178.97 2f7i h SER 77 N 0.55 0.95 -0.16 4.20 0.02 -1.87 -1.16 113.55 116.08 2f7i h SER 77 Ca 0.14 -0.14 0.03 0.00 -0.84 0.00 0.00 61.79 60.97 2f7i h SER 77 Cb 0.31 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 62.57 2f7i h SER 77 CO 0.00 0.85 -0.00 0.22 -1.14 0.00 0.00 176.83 176.76 2f7i h TYR 78 N 1.01 -0.02 -0.28 3.45 3.20 -1.48 -1.42 116.97 121.44 2f7i h TYR 78 Ca 0.23 0.01 -0.17 0.00 3.14 0.00 0.00 58.73 61.95 2f7i h TYR 78 Cb 0.20 0.03 -0.00 0.00 1.54 0.00 0.00 36.73 38.50 2f7i h TYR 78 CO 0.02 -0.03 -0.51 -1.49 -1.64 0.00 0.00 178.16 174.51 2f7i h TRP 79 N 0.05 0.96 -0.62 -3.82 4.06 -1.27 -3.14 115.95 112.17 2f7i h TRP 79 Ca 0.08 -0.33 -0.01 0.00 2.06 0.00 0.00 58.89 60.69 2f7i h TRP 79 Cb 0.09 -0.19 -0.03 0.00 -1.00 0.00 0.00 29.16 28.04 2f7i h TRP 79 CO -0.16 1.12 0.35 0.87 -3.56 0.00 0.00 178.44 177.06 2f7i h LYS 80 N 0.61 0.84 0.00 0.49 1.57 -1.00 -0.16 116.57 118.91 2f7i h LYS 80 Ca 0.02 -0.08 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 2f7i h LYS 80 Cb 1.09 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 33.22 2f7i h LYS 80 CO 0.11 0.60 -0.10 0.00 -0.57 0.00 0.00 179.45 179.50 2f7i h ALA 81 N 1.54 1.13 -0.22 3.86 0.00 -1.21 -2.16 119.26 122.19 2f7i h ALA 81 Ca 0.22 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2f7i h ALA 81 Cb -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2f7i h ALA 81 CO -0.04 0.12 0.00 1.28 0.00 0.00 0.00 179.25 180.61 2f7i n LEU 82 N -3.39 2.26 -0.25 0.00 4.77 -0.14 -4.94 117.00 115.32 2f7i n LEU 82 Ca -0.01 -0.94 -0.03 0.00 -0.03 0.00 0.00 56.01 55.00 2f7i n LEU 82 Cb 0.27 -0.14 -0.01 0.00 -2.33 0.00 0.00 43.42 41.21 2f7i n LEU 82 CO 0.29 0.47 -0.03 0.61 -1.33 0.00 0.00 177.39 177.40 2f7i n GLY 83 N 1.25 0.49 3.32 -0.72 0.00 -0.81 -5.03 105.19 103.69 2f7i n GLY 83 Ca 0.17 -0.90 -0.32 0.00 0.00 0.00 0.00 46.02 44.97 2f7i n GLY 83 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2f7i s ILE 84 N -2.11 2.67 -0.53 -0.61 1.01 -0.79 -5.03 121.20 115.80 2f7i s ILE 84 Ca 0.00 -0.81 -0.23 0.00 0.00 0.00 0.00 60.65 59.61 2f7i s ILE 84 Cb 0.00 -2.08 0.04 0.00 0.01 0.00 0.00 42.46 40.44 2f7i s ILE 84 CO 0.00 0.54 0.85 -0.55 0.00 0.00 0.00 174.94 175.79 2f7i s SER 85 N 0.22 6.32 0.53 3.58 0.15 -1.26 -3.36 113.70 119.88 2f7i s SER 85 Ca -0.11 -0.44 -0.01 0.00 0.70 0.00 0.00 55.95 56.09 2f7i s SER 85 Cb -0.16 -2.40 0.02 0.00 -1.71 0.00 0.00 66.02 61.77 2f7i s SER 85 CO 0.06 -1.12 0.78 -2.16 1.20 0.00 0.00 173.24 172.00 2f7i s PRO 86 N 3.58 2.75 -0.13 5.44 0.04 -1.26 -4.95 135.00 140.47 2f7i s PRO 86 Ca 0.27 -0.53 -0.27 0.00 0.04 0.00 0.00 61.00 60.52 2f7i s PRO 86 Cb -0.14 -2.46 -0.26 0.00 0.04 0.00 0.00 34.50 31.68 2f7i s PRO 86 CO 0.18 -0.60 0.74 0.35 0.04 0.00 0.00 177.00 177.71 2f7i h PHE 87 N 0.10 0.11 -3.82 0.56 3.57 -1.43 -3.48 116.94 112.55 2f7i h PHE 87 Ca -0.44 -0.08 -0.48 0.00 3.53 0.00 0.00 57.97 60.50 2f7i h PHE 87 Cb 1.28 -0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.99 2f7i h PHE 87 CO 0.41 1.11 0.16 -1.01 -2.23 0.00 0.00 178.31 176.75 2f7i s HIS 88 N -2.28 3.36 0.15 0.41 3.76 -1.26 -4.98 115.29 114.47 2f7i s HIS 88 Ca -0.19 1.31 -0.04 0.00 -0.15 0.00 0.00 55.06 55.99 2f7i s HIS 88 Cb -0.01 -2.61 -0.01 0.00 1.11 0.00 0.00 32.58 31.06 2f7i s HIS 88 CO 0.71 0.02 1.38 0.93 -0.85 0.00 0.00 174.74 176.94 2f7i h GLU 89 N 2.08 0.47 -2.46 1.40 4.39 -1.98 -3.39 114.58 115.09 2f7i h GLU 89 Ca -0.48 -0.41 0.17 0.00 0.34 0.00 0.00 59.36 58.98 2f7i h GLU 89 Cb 1.18 0.09 -0.05 0.00 -0.10 0.00 0.00 28.75 29.87 2f7i h GLU 89 CO 0.64 1.05 0.57 -3.38 -1.16 0.00 0.00 179.01 176.73 2f7i s HIS 90 N -3.56 0.03 -0.13 4.33 -3.43 -1.26 -3.85 115.29 107.41 2f7i s HIS 90 Ca -0.06 -0.40 -0.00 0.00 -0.80 0.00 0.00 55.06 53.79 2f7i s HIS 90 Cb 0.10 0.68 -0.01 0.00 -1.43 0.00 0.00 32.58 31.92 2f7i s HIS 90 CO 0.86 -0.89 -0.13 0.00 -2.00 0.00 0.00 174.74 172.58 2f7i s ALA 91 N -2.40 2.63 -0.03 -1.38 0.00 -0.54 -4.89 121.76 115.15 2f7i s ALA 91 Ca 0.20 -0.90 0.06 0.00 0.00 0.00 0.00 51.96 51.32 2f7i s ALA 91 Cb -0.02 -1.23 -0.02 0.00 0.00 0.00 0.00 23.12 21.84 2f7i s ALA 91 CO 0.04 0.23 -0.21 -1.21 0.00 0.00 0.00 175.76 174.61 2f7i s GLU 92 N 0.39 2.25 -0.16 0.00 8.01 -1.26 0.05 118.70 127.98 2f7i s GLU 92 Ca -0.10 -0.84 0.00 0.00 0.01 0.00 0.00 54.97 54.03 2f7i s GLU 92 Cb -0.16 -2.17 0.03 0.00 -4.31 0.00 0.00 34.13 27.52 2f7i s GLU 92 CO 0.05 0.58 -0.09 0.08 0.01 0.00 0.00 175.26 175.89 2f7i s VAL 93 N -0.67 1.37 -0.11 2.63 1.01 0.43 -4.96 120.40 120.09 2f7i s VAL 93 Ca 0.11 -0.68 0.03 0.00 0.00 0.00 0.00 61.98 61.45 2f7i s VAL 93 Cb -0.10 -1.42 0.00 0.00 0.00 0.00 0.00 36.38 34.87 2f7i s VAL 93 CO -0.00 0.27 -0.23 -0.69 0.00 0.00 0.00 175.10 174.45 2f7i s VAL 94 N 1.54 2.02 0.09 2.92 1.01 -1.26 -0.00 120.40 126.72 2f7i s VAL 94 Ca 0.02 -0.99 -0.20 0.00 0.00 0.00 0.00 61.98 60.81 2f7i s VAL 94 Cb -0.14 -1.76 0.05 0.00 0.00 0.00 0.00 36.38 34.52 2f7i s VAL 94 CO -0.09 0.55 0.48 0.72 0.00 0.00 0.00 175.10 176.77 2f7i s PHE 95 N 0.50 -0.36 -0.12 5.22 -0.71 -0.47 -5.00 117.98 117.04 2f7i s PHE 95 Ca -0.15 0.25 -0.16 0.00 -1.04 0.00 0.00 56.93 55.82 2f7i s PHE 95 Cb -0.17 0.34 -0.05 0.00 -1.21 0.00 0.00 43.02 41.93 2f7i s PHE 95 CO 0.06 -0.68 0.40 0.99 -1.34 0.00 0.00 175.22 174.64 2f7i s THR 96 N -3.05 5.21 -0.23 -4.49 2.01 -1.26 -0.55 115.64 113.27 2f7i s THR 96 Ca -0.02 0.80 -0.15 0.00 0.31 0.00 0.00 61.69 62.62 2f7i s THR 96 Cb 0.00 -3.74 -0.04 0.00 0.01 0.00 0.00 72.50 68.73 2f7i s THR 96 CO -0.07 0.38 0.39 0.00 -0.69 0.00 0.00 174.62 174.63 2f7i s ALA 97 N 0.34 3.57 -0.31 7.40 0.00 0.11 -4.97 121.76 127.89 2f7i s ALA 97 Ca 0.22 -0.65 -0.02 0.00 0.00 0.00 0.00 51.96 51.52 2f7i s ALA 97 Cb -0.15 -2.66 0.12 0.00 0.00 0.00 0.00 23.12 20.43 2f7i s ALA 97 CO 0.08 -0.45 0.20 -0.80 0.00 0.00 0.00 175.76 174.79 2f7i s ASN 98 N 1.28 2.89 0.35 0.00 -0.87 -1.26 -2.31 114.94 115.02 2f7i s ASN 98 Ca 0.17 -1.38 -0.28 0.00 -1.57 0.00 0.00 52.86 49.80 2f7i s ASN 98 Cb -0.15 -0.12 -0.11 0.00 -0.02 0.00 0.00 41.25 40.85 2f7i s ASN 98 CO 0.08 -0.39 1.41 1.51 -2.57 0.00 0.00 177.10 177.14 2f7i s ASP 99 N 1.90 6.54 0.05 -1.22 1.47 -1.26 -5.12 116.67 119.03 2f7i s ASP 99 Ca 0.11 2.88 0.00 0.00 1.18 0.00 0.00 52.55 56.73 2f7i s ASP 99 Cb -0.17 -2.66 0.00 0.00 -0.34 0.00 0.00 42.92 39.75 2f7i s ASP 99 CO -0.26 -0.72 0.00 -2.11 0.68 0.00 0.00 175.17 172.75 2f7i n ARG 103 N 0.67 0.00 -4.54 2.11 1.85 -1.26 -5.14 116.66 110.35 2f7i n ARG 103 Ca 0.01 0.00 -0.34 0.00 -1.00 0.00 0.00 57.85 56.52 2f7i n ARG 103 Cb 0.40 -0.32 -0.12 0.00 -1.05 0.00 0.00 32.46 31.37 2f7i n ARG 103 CO 0.00 0.00 0.00 1.03 -0.01 0.00 0.00 177.63 178.65 2f7i s ARG 104 N -2.00 3.21 -0.17 2.89 0.52 -1.26 -4.68 118.95 117.46 2f7i s ARG 104 Ca 0.00 -0.55 0.01 0.00 -0.52 0.00 0.00 55.73 54.67 2f7i s ARG 104 Cb 0.00 -2.74 0.01 0.00 0.52 0.00 0.00 34.95 32.74 2f7i s ARG 104 CO 0.00 0.44 -0.18 0.71 0.02 0.00 0.00 175.30 176.30 2f7i s TYR 105 N -0.20 2.78 -0.21 -0.53 1.51 0.79 -1.25 117.35 120.24 2f7i s TYR 105 Ca 0.03 -1.37 -0.05 0.00 -1.01 0.00 0.00 57.07 54.68 2f7i s TYR 105 Cb -0.13 -1.91 -0.02 0.00 -0.11 0.00 0.00 41.96 39.79 2f7i s TYR 105 CO 0.03 -0.66 -0.02 0.99 -1.11 0.00 0.00 175.55 174.78 2f7i s THR 106 N 1.11 3.72 -0.32 -0.71 2.01 -0.06 -0.62 115.64 120.77 2f7i s THR 106 Ca 0.00 -0.39 -0.10 0.00 0.31 0.00 0.00 61.69 61.52 2f7i s THR 106 Cb -0.14 -2.69 -0.00 0.00 0.01 0.00 0.00 72.50 69.68 2f7i s THR 106 CO -0.07 0.42 0.15 -0.63 -0.69 0.00 0.00 174.62 173.81 2f7i s ILE 107 N 1.24 4.56 -0.00 1.82 -1.09 -0.63 -0.83 121.20 126.26 2f7i s ILE 107 Ca 0.03 -0.48 0.04 0.00 -2.23 0.00 0.00 60.65 58.01 2f7i s ILE 107 Cb -0.15 -3.35 -0.03 0.00 -1.58 0.00 0.00 42.46 37.35 2f7i s ILE 107 CO 0.00 0.04 -0.09 0.00 -1.23 0.00 0.00 174.94 173.66 2f7i s ALA 108 N 1.60 2.93 -0.02 9.38 0.00 -0.37 -1.16 121.76 134.13 2f7i s ALA 108 Ca 0.04 -1.03 0.02 0.00 0.00 0.00 0.00 51.96 51.00 2f7i s ALA 108 Cb -0.17 -1.08 0.00 0.00 0.00 0.00 0.00 23.12 21.87 2f7i s ALA 108 CO 0.06 0.60 -0.07 0.00 0.00 0.00 0.00 175.76 176.35 2f7i s ALA 109 N -0.95 0.69 -0.19 0.00 0.00 -0.54 -1.62 121.76 119.15 2f7i s ALA 109 Ca 0.16 -0.27 -0.01 0.00 0.00 0.00 0.00 51.96 51.84 2f7i s ALA 109 Cb -0.11 -0.24 0.00 0.00 0.00 0.00 0.00 23.12 22.77 2f7i s ALA 109 CO 0.06 0.12 -0.13 -1.17 0.00 0.00 0.00 175.76 174.64 2f7i s LEU 110 N 0.11 2.49 -0.11 0.00 2.96 -0.21 -0.70 118.68 123.23 2f7i s LEU 110 Ca -0.01 -0.51 -0.01 0.00 -0.22 0.00 0.00 54.13 53.38 2f7i s LEU 110 Cb -0.06 -1.59 -0.03 0.00 0.50 0.00 0.00 46.19 45.01 2f7i s LEU 110 CO -0.00 0.02 -0.06 -0.76 -1.32 0.00 0.00 176.35 174.23 2f7i s LEU 111 N 1.22 3.19 0.16 -0.68 1.43 -0.17 -1.48 118.68 122.35 2f7i s LEU 111 Ca 0.02 -0.08 0.04 0.00 -1.03 0.00 0.00 54.13 53.09 2f7i s LEU 111 Cb -0.14 -1.72 -0.05 0.00 0.03 0.00 0.00 46.19 44.31 2f7i s LEU 111 CO -0.06 0.28 -0.07 -0.44 0.23 0.00 0.00 176.35 176.29 2f7i s SER 112 N -0.29 1.65 0.30 2.29 0.01 0.41 -1.02 113.70 117.05 2f7i s SER 112 Ca 0.04 -1.07 0.04 0.00 1.31 0.00 0.00 55.95 56.28 2f7i s SER 112 Cb -0.13 0.02 0.67 0.00 0.21 0.00 0.00 66.02 66.79 2f7i s SER 112 CO 0.02 -0.41 1.82 -0.65 0.41 0.00 0.00 173.24 174.43 2f7i h PRO 113 N 2.73 0.84 -0.24 12.44 0.11 -2.00 -2.85 132.00 143.04 2f7i h PRO 113 Ca -0.37 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.69 2f7i h PRO 113 Cb 1.20 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.12 2f7i h PRO 113 CO 0.64 0.56 0.00 0.66 -0.21 0.00 0.00 178.00 179.64 2f7i n TYR 114 N -4.67 0.55 -3.62 0.65 4.02 -1.26 -1.02 117.16 111.82 2f7i n TYR 114 Ca 0.21 -0.69 -0.16 0.00 -0.01 0.00 0.00 57.90 57.25 2f7i n TYR 114 Cb 0.46 -0.15 -0.07 0.00 -0.02 0.00 0.00 39.34 39.56 2f7i n TYR 114 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 2f7i s SER 115 N -1.53 -0.52 0.07 7.72 0.15 -1.07 -4.96 113.70 113.55 2f7i s SER 115 Ca 0.29 0.65 -0.09 0.00 0.70 0.00 0.00 55.95 57.49 2f7i s SER 115 Cb 0.21 0.62 0.00 0.00 -1.71 0.00 0.00 66.02 65.14 2f7i s SER 115 CO 0.10 -0.48 0.20 -0.72 1.20 0.00 0.00 173.24 173.54 2f7i s TYR 116 N -0.91 0.10 0.05 3.44 -0.85 -1.26 -0.45 117.35 117.47 2f7i s TYR 116 Ca -0.09 -0.42 0.06 0.00 -0.52 0.00 0.00 57.07 56.09 2f7i s TYR 116 Cb -0.02 -0.04 -0.02 0.00 0.38 0.00 0.00 41.96 42.25 2f7i s TYR 116 CO 0.06 -0.49 -0.16 -1.12 -1.52 0.00 0.00 175.55 172.32 2f7i s SER 117 N -2.49 1.95 -0.01 -0.18 0.01 -0.55 -4.98 113.70 107.46 2f7i s SER 117 Ca 0.00 -0.50 -0.02 0.00 1.31 0.00 0.00 55.95 56.73 2f7i s SER 117 Cb 0.02 -0.13 -0.00 0.00 0.21 0.00 0.00 66.02 66.12 2f7i s SER 117 CO -0.08 0.06 0.05 0.28 0.41 0.00 0.00 173.24 173.96 2f7i s THR 118 N -0.89 0.04 0.06 1.44 -1.32 -1.26 -1.04 115.64 112.67 2f7i s THR 118 Ca 0.03 -0.35 0.00 0.00 -1.21 0.00 0.00 61.69 60.17 2f7i s THR 118 Cb -0.08 -0.19 -0.04 0.00 -1.51 0.00 0.00 72.50 70.68 2f7i s THR 118 CO 0.02 -0.19 -0.04 0.28 -2.21 0.00 0.00 174.62 172.47 2f7i s THR 119 N -0.58 0.38 -0.12 5.08 -1.32 -0.64 -5.00 115.64 113.43 2f7i s THR 119 Ca -0.06 -1.80 0.00 0.00 -1.21 0.00 0.00 61.69 58.62 2f7i s THR 119 Cb -0.04 -1.50 -0.02 0.00 -1.51 0.00 0.00 72.50 69.43 2f7i s THR 119 CO 0.00 -0.92 -0.14 0.00 -2.21 0.00 0.00 174.62 171.35 2f7i s ALA 120 N -3.66 2.60 -0.25 11.08 0.00 -1.26 -1.23 121.76 129.04 2f7i s ALA 120 Ca 0.07 -0.90 -0.03 0.00 0.00 0.00 0.00 51.96 51.11 2f7i s ALA 120 Cb 0.06 -1.17 0.02 0.00 0.00 0.00 0.00 23.12 22.03 2f7i s ALA 120 CO -0.08 0.28 -0.04 0.08 0.00 0.00 0.00 175.76 176.00 2f7i s VAL 121 N 0.24 3.09 -0.26 0.00 1.01 -0.01 -4.98 120.40 119.49 2f7i s VAL 121 Ca -0.09 -0.90 0.01 0.00 0.00 0.00 0.00 61.98 61.00 2f7i s VAL 121 Cb -0.16 -2.54 0.05 0.00 0.00 0.00 0.00 36.38 33.73 2f7i s VAL 121 CO 0.05 0.22 -0.09 -0.69 0.00 0.00 0.00 175.10 174.59 2f7i s VAL 122 N 1.37 2.43 0.00 2.92 1.01 -1.26 -0.88 120.40 125.99 2f7i s VAL 122 Ca 0.01 -1.40 0.00 0.00 0.00 0.00 0.00 61.98 60.59 2f7i s VAL 122 Cb -0.16 -2.34 0.00 0.00 0.00 0.00 0.00 36.38 33.88 2f7i s VAL 122 CO -0.03 0.07 0.12 0.35 0.00 0.00 0.00 175.10 175.61