#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fc3 s LYS 3 N 0.00 1.23 0.27 3.23 1.02 -1.26 -5.02 119.74 119.21 3fc3 s LYS 3 Ca 0.00 -1.40 -0.30 0.00 0.02 0.00 0.00 55.97 54.29 3fc3 s LYS 3 Cb 0.00 -1.21 -0.14 0.00 -0.52 0.00 0.00 37.83 35.96 3fc3 s LYS 3 CO 0.00 0.24 1.18 0.09 -0.92 0.00 0.00 175.35 175.94 3fc3 n ASN 4 N 0.23 1.91 0.00 2.83 3.02 -1.26 -1.86 115.26 120.13 3fc3 n ASN 4 Ca -0.13 1.17 0.00 0.00 -0.03 0.00 0.00 54.58 55.59 3fc3 n ASN 4 Cb 0.58 -1.34 0.00 0.00 -0.61 0.00 0.00 39.78 38.40 3fc3 n ASN 4 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3fc3 n ASP 5 N 1.48 0.00 -4.76 6.41 8.00 0.14 -4.98 116.55 122.84 3fc3 n ASP 5 Ca 0.10 0.00 -0.32 0.00 0.71 0.00 0.00 54.79 55.28 3fc3 n ASP 5 Cb 0.31 0.00 0.08 0.00 -0.02 0.00 0.00 41.12 41.49 3fc3 n ASP 5 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 3fc3 s ASP 6 N -3.44 4.64 0.01 -2.24 1.01 -0.78 -4.72 116.67 111.14 3fc3 s ASP 6 Ca 0.00 1.96 0.02 0.00 0.71 0.00 0.00 52.55 55.24 3fc3 s ASP 6 Cb 0.00 -2.54 -0.04 0.00 1.01 0.00 0.00 42.92 41.35 3fc3 s ASP 6 CO 0.00 -1.95 -0.03 -0.36 0.21 0.00 0.00 175.17 173.04 3fc3 s PHE 7 N -2.58 2.98 0.13 4.23 0.08 -1.26 -0.74 117.98 120.82 3fc3 s PHE 7 Ca 0.65 0.02 0.01 0.00 0.12 0.00 0.00 56.93 57.73 3fc3 s PHE 7 Cb -0.20 -1.63 -0.04 0.00 -0.57 0.00 0.00 43.02 40.58 3fc3 s PHE 7 CO 0.49 0.42 -0.01 0.14 -0.10 0.00 0.00 175.22 176.17 3fc3 s VAL 8 N -1.06 0.48 0.13 -0.44 -7.23 0.01 -1.63 120.40 110.66 3fc3 s VAL 8 Ca 0.19 -1.93 0.08 0.00 -1.81 0.00 0.00 61.98 58.51 3fc3 s VAL 8 Cb -0.11 -1.92 -0.04 0.00 0.56 0.00 0.00 36.38 34.87 3fc3 s VAL 8 CO 0.09 -0.64 -0.11 0.27 -0.31 0.00 0.00 175.10 174.40 3fc3 s ILE 9 N -3.78 3.20 0.04 -0.62 -4.36 0.19 -0.51 121.20 115.36 3fc3 s ILE 9 Ca 0.19 -1.45 -0.30 0.00 -0.26 0.00 0.00 60.65 58.82 3fc3 s ILE 9 Cb 0.06 -2.53 -0.06 0.00 1.25 0.00 0.00 42.46 41.18 3fc3 s ILE 9 CO -0.01 0.03 1.44 0.00 0.24 0.00 0.00 174.94 176.64 3fc3 s ALA 10 N -1.38 3.60 0.22 2.27 0.00 -0.69 -1.82 121.76 123.96 3fc3 s ALA 10 Ca 0.22 0.99 0.06 0.00 0.00 0.00 0.00 51.96 53.23 3fc3 s ALA 10 Cb -0.10 -3.60 0.18 0.00 0.00 0.00 0.00 23.12 19.60 3fc3 s ALA 10 CO 0.14 -0.88 1.51 0.87 0.00 0.00 0.00 175.76 177.40 3fc3 h LYS 11 N 7.68 0.14 -4.62 0.00 1.57 -1.42 -0.69 116.57 119.23 3fc3 h LYS 11 Ca -0.40 -0.12 -0.26 0.00 -1.87 0.00 0.00 60.65 58.01 3fc3 h LYS 11 Cb 1.19 0.03 -0.15 0.00 0.08 0.00 0.00 32.23 33.38 3fc3 h LYS 11 CO 0.90 0.79 -0.61 -0.80 -0.57 0.00 0.00 179.45 179.16 3fc3 s ASN 12 N -6.88 0.30 0.12 0.86 0.01 -1.26 -4.80 114.94 103.30 3fc3 s ASN 12 Ca -0.03 -1.43 -0.33 0.00 -0.71 0.00 0.00 52.86 50.37 3fc3 s ASN 12 Cb 0.12 0.40 -0.12 0.00 0.41 0.00 0.00 41.25 42.05 3fc3 s ASN 12 CO 0.80 -0.86 1.74 1.67 -1.51 0.00 0.00 177.10 178.94 3fc3 n GLN 13 N -0.30 2.52 -3.89 -0.60 -0.06 -1.26 -4.14 117.38 109.65 3fc3 n GLN 13 Ca 0.03 0.91 -0.30 0.00 -2.00 0.00 0.00 57.00 55.64 3fc3 n GLN 13 Cb 0.66 -2.75 -0.14 0.00 -4.06 0.00 0.00 30.24 23.94 3fc3 n GLN 13 CO 0.00 0.00 0.00 -0.51 -0.20 0.00 0.00 177.06 176.35 3fc3 s LEU 14 N 2.06 3.87 0.00 1.69 1.43 0.66 -4.99 118.68 123.40 3fc3 s LEU 14 Ca 0.81 -2.75 0.00 0.00 -1.03 0.00 0.00 54.13 51.16 3fc3 s LEU 14 Cb -0.57 -1.45 0.00 0.00 0.03 0.00 0.00 46.19 44.19 3fc3 s LEU 14 CO 0.38 -0.27 0.00 0.61 0.23 0.00 0.00 176.35 177.31 3fc3 n GLY 15 N 3.43 3.76 0.10 -3.19 0.00 -1.26 -0.54 105.19 107.49 3fc3 n GLY 15 Ca 0.05 0.21 0.12 0.00 0.00 0.00 0.00 46.02 46.41 3fc3 n GLY 15 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3fc3 n ASN 16 N 8.99 0.61 -4.59 1.61 3.02 -1.26 -4.81 115.26 118.84 3fc3 n ASN 16 Ca 0.00 0.60 -0.42 0.00 -0.03 0.00 0.00 54.58 54.73 3fc3 n ASN 16 Cb 0.00 -0.75 -0.06 0.00 -0.61 0.00 0.00 39.78 38.36 3fc3 n ASN 16 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3fc3 s ILE 17 N -3.17 4.87 0.62 2.41 -1.09 0.30 -5.05 121.20 120.09 3fc3 s ILE 17 Ca 0.08 0.78 -0.14 0.00 -2.23 0.00 0.00 60.65 59.15 3fc3 s ILE 17 Cb 0.12 -4.08 -0.03 0.00 -1.58 0.00 0.00 42.46 36.89 3fc3 s ILE 17 CO 0.48 -0.27 1.05 0.68 -1.23 0.00 0.00 174.94 175.65 3fc3 s VAL 18 N 2.76 4.03 0.71 2.92 -7.23 -1.26 -0.25 120.40 122.09 3fc3 s VAL 18 Ca 0.27 0.83 -0.16 0.00 -1.81 0.00 0.00 61.98 61.11 3fc3 s VAL 18 Cb -0.14 -3.46 0.01 0.00 0.56 0.00 0.00 36.38 33.35 3fc3 s VAL 18 CO 0.14 -0.70 1.10 -2.65 -0.31 0.00 0.00 175.10 172.68 3fc3 n PRO 19 N -2.42 0.63 -0.93 4.82 -0.02 -1.26 -2.44 135.00 133.38 3fc3 n PRO 19 Ca 0.08 0.27 0.00 0.00 -2.02 0.00 0.00 63.50 61.83 3fc3 n PRO 19 Cb 0.53 -2.34 0.00 0.00 -0.02 0.00 0.00 33.50 31.67 3fc3 n PRO 19 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3fc3 n ASN 20 N -1.99 -2.45 -4.72 2.55 3.02 -0.27 -4.91 115.26 106.50 3fc3 n ASN 20 Ca 0.14 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.27 3fc3 n ASN 20 Cb 0.49 -1.30 -0.03 0.00 -0.61 0.00 0.00 39.78 38.33 3fc3 n ASN 20 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 3fc3 s SER 21 N -2.26 6.78 0.02 6.41 0.01 -1.02 -0.73 113.70 122.92 3fc3 s SER 21 Ca 0.00 2.39 -0.23 0.00 1.31 0.00 0.00 55.95 59.42 3fc3 s SER 21 Cb 0.00 -2.59 -0.05 0.00 0.21 0.00 0.00 66.02 63.59 3fc3 s SER 21 CO 0.00 -0.68 0.71 -0.69 0.41 0.00 0.00 173.24 172.99 3fc3 s VAL 22 N 1.00 4.81 0.09 3.43 1.01 0.22 -1.70 120.40 129.25 3fc3 s VAL 22 Ca 0.65 1.49 0.03 0.00 0.00 0.00 0.00 61.98 64.15 3fc3 s VAL 22 Cb -0.38 -4.05 -0.04 0.00 0.00 0.00 0.00 36.38 31.91 3fc3 s VAL 22 CO 0.31 0.37 -0.08 -0.83 0.00 0.00 0.00 175.10 174.87 3fc3 s GLY 23 N -0.03 0.76 -0.10 4.51 0.00 0.34 -2.36 107.32 110.44 3fc3 s GLY 23 Ca 0.36 -1.18 -0.02 0.00 0.00 0.00 0.00 44.72 43.88 3fc3 s GLY 23 CO 0.21 -1.26 -0.03 0.54 0.00 0.00 0.00 173.10 172.56 3fc3 s VAL 24 N -2.72 4.06 -0.04 1.40 0.11 -0.40 -0.81 120.40 121.99 3fc3 s VAL 24 Ca 0.05 -0.33 -0.30 0.00 -2.93 0.00 0.00 61.98 58.47 3fc3 s VAL 24 Cb -0.01 -2.71 -0.04 0.00 -1.53 0.00 0.00 36.38 32.09 3fc3 s VAL 24 CO -0.02 0.57 1.28 -0.63 -3.33 0.00 0.00 175.10 172.98 3fc3 s ILE 25 N -0.54 4.05 -0.02 7.04 -1.09 0.08 -1.23 121.20 129.49 3fc3 s ILE 25 Ca 0.09 1.39 0.09 0.00 -2.23 0.00 0.00 60.65 59.99 3fc3 s ILE 25 Cb -0.12 -3.90 -0.14 0.00 -1.58 0.00 0.00 42.46 36.72 3fc3 s ILE 25 CO 0.02 -0.01 0.19 0.54 -1.23 0.00 0.00 174.94 174.46 3fc3 n ARG 26 N 5.35 0.46 -3.58 2.79 5.12 0.69 -0.68 116.66 126.81 3fc3 n ARG 26 Ca 0.12 -0.08 -0.14 0.00 -1.93 0.00 0.00 57.85 55.81 3fc3 n ARG 26 Cb 0.45 -1.23 -0.06 0.00 -1.16 0.00 0.00 32.46 30.47 3fc3 n ARG 26 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3fc3 s ALA 27 N -2.63 -1.36 -0.02 7.54 0.00 -1.10 -4.95 121.76 119.24 3fc3 s ALA 27 Ca -0.04 0.69 0.03 0.00 0.00 0.00 0.00 51.96 52.64 3fc3 s ALA 27 Cb 0.06 0.31 0.00 0.00 0.00 0.00 0.00 23.12 23.48 3fc3 s ALA 27 CO 0.39 -0.47 -0.09 0.08 0.00 0.00 0.00 175.76 175.67 3fc3 s VAL 28 N -2.18 0.79 0.00 0.00 1.01 -1.26 -0.69 120.40 118.08 3fc3 s VAL 28 Ca -0.07 -0.38 0.00 0.00 0.00 0.00 0.00 61.98 61.54 3fc3 s VAL 28 Cb -0.01 -0.70 0.00 0.00 0.00 0.00 0.00 36.38 35.67 3fc3 s VAL 28 CO 0.00 0.24 0.00 -0.46 0.00 0.00 0.00 175.10 174.89 3fc3 n ASN 29 N 3.22 1.66 0.27 3.32 6.94 -0.39 -5.02 115.26 125.25 3fc3 n ASN 29 Ca -0.17 -0.77 0.14 0.00 -0.02 0.00 0.00 54.58 53.76 3fc3 n ASN 29 Cb 0.55 0.00 0.73 0.00 -2.36 0.00 0.00 39.78 38.70 3fc3 n ASN 29 CO 0.00 0.00 0.00 1.23 -1.03 0.00 0.00 177.26 177.46 3fc3 h GLY 30 N 0.00 0.00 0.00 4.83 0.00 -2.03 -3.33 103.07 102.54 3fc3 h GLY 30 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3fc3 h GLY 30 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 176.54 177.71 3fc3 n LYS 31 N -3.44 0.47 -4.00 4.80 4.81 -1.26 -5.06 118.16 114.48 3fc3 n LYS 31 Ca -0.01 -0.05 -0.09 0.00 -0.87 0.00 0.00 58.31 57.29 3fc3 n LYS 31 Cb 0.26 -0.36 -0.08 0.00 0.02 0.00 0.00 35.03 34.87 3fc3 n LYS 31 CO 0.00 0.00 0.00 -1.54 1.17 0.00 0.00 177.40 177.03 3fc3 s SER 32 N -0.08 0.16 0.10 3.14 1.04 -1.25 -1.22 113.70 115.59 3fc3 s SER 32 Ca 0.00 -0.92 0.08 0.00 0.48 0.00 0.00 55.95 55.60 3fc3 s SER 32 Cb 0.00 0.36 -0.03 0.00 0.10 0.00 0.00 66.02 66.45 3fc3 s SER 32 CO 0.00 -0.79 -0.21 0.00 0.98 0.00 0.00 173.24 173.21 3fc3 s ALA 33 N -3.96 1.85 -0.23 5.32 0.00 -0.02 -1.27 121.76 123.45 3fc3 s ALA 33 Ca 0.15 -1.26 -0.21 0.00 0.00 0.00 0.00 51.96 50.64 3fc3 s ALA 33 Cb 0.05 -0.26 -0.02 0.00 0.00 0.00 0.00 23.12 22.89 3fc3 s ALA 33 CO -0.03 0.38 0.67 -1.64 0.00 0.00 0.00 175.76 175.14 3fc3 s MET 34 N -1.89 4.15 -0.12 0.00 -1.94 0.14 -0.42 119.30 119.23 3fc3 s MET 34 Ca 0.07 0.65 0.03 0.00 -1.71 0.00 0.00 55.69 54.73 3fc3 s MET 34 Cb -0.10 -3.63 0.00 0.00 2.01 0.00 0.00 34.83 33.12 3fc3 s MET 34 CO 0.04 -0.38 -0.22 0.08 -0.01 0.00 0.00 175.02 174.53 3fc3 s VAL 35 N 2.40 2.18 -0.45 -6.03 1.01 0.42 -0.22 120.40 119.71 3fc3 s VAL 35 Ca 0.29 -0.96 -0.21 0.00 0.00 0.00 0.00 61.98 61.10 3fc3 s VAL 35 Cb -0.16 -1.86 0.03 0.00 0.00 0.00 0.00 36.38 34.39 3fc3 s VAL 35 CO 0.09 0.55 0.65 -0.22 0.00 0.00 0.00 175.10 176.17 3fc3 s LEU 36 N 0.56 4.55 -0.30 3.92 2.96 -0.37 -1.03 118.68 128.98 3fc3 s LEU 36 Ca -0.13 -0.42 -0.28 0.00 -0.22 0.00 0.00 54.13 53.08 3fc3 s LEU 36 Cb -0.17 -2.69 0.01 0.00 0.50 0.00 0.00 46.19 43.85 3fc3 s LEU 36 CO 0.04 -0.81 1.01 -0.36 -1.32 0.00 0.00 176.35 174.91 3fc3 s PHE 37 N 2.84 3.20 0.10 5.38 0.08 -0.51 -1.28 117.98 127.79 3fc3 s PHE 37 Ca 0.22 1.18 -0.13 0.00 0.12 0.00 0.00 56.93 58.32 3fc3 s PHE 37 Cb -0.15 -3.50 -0.15 0.00 -0.57 0.00 0.00 43.02 38.65 3fc3 s PHE 37 CO 0.18 -0.66 1.31 0.82 -0.10 0.00 0.00 175.22 176.77 3fc3 h ILE 38 N 5.64 1.27 -0.06 0.64 2.04 -1.78 -0.30 117.51 124.96 3fc3 h ILE 38 Ca -0.21 -1.96 0.02 0.00 1.00 0.00 0.00 64.86 63.71 3fc3 h ILE 38 Cb 1.07 1.97 -0.02 0.00 -0.74 0.00 0.00 36.82 39.09 3fc3 h ILE 38 CO 0.99 0.62 -0.05 1.23 0.00 0.00 0.00 178.15 180.95 3fc3 h GLY 39 N 0.55 0.01 -0.11 5.37 0.00 -1.78 -2.91 103.07 104.21 3fc3 h GLY 39 Ca -0.05 0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.34 3fc3 h GLY 39 CO 0.16 -0.06 -0.36 1.04 0.00 0.00 0.00 176.54 177.32 3fc3 n LEU 40 N -5.17 1.31 -3.67 3.11 4.77 -1.24 -4.84 117.00 111.28 3fc3 n LEU 40 Ca -0.05 -0.41 -0.24 0.00 -0.03 0.00 0.00 56.01 55.28 3fc3 n LEU 40 Cb 0.10 -0.09 0.06 0.00 -2.33 0.00 0.00 43.42 41.16 3fc3 n LEU 40 CO 0.29 0.25 0.12 -3.20 -1.33 0.00 0.00 177.39 173.52 3fc3 n ASN 41 N -0.52 -4.04 -4.31 -1.43 5.15 -0.17 -4.99 115.26 104.95 3fc3 n ASN 41 Ca 0.11 -0.67 -0.34 0.00 -0.60 0.00 0.00 54.58 53.07 3fc3 n ASN 41 Cb 0.38 -4.57 -0.14 0.00 -0.53 0.00 0.00 39.78 34.92 3fc3 n ASN 41 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 3fc3 s GLU 42 N -6.13 3.35 -0.27 1.20 2.02 -0.90 -4.94 118.70 113.02 3fc3 s GLU 42 Ca 0.37 -0.67 -0.12 0.00 0.02 0.00 0.00 54.97 54.57 3fc3 s GLU 42 Cb -0.17 -2.82 -0.05 0.00 0.10 0.00 0.00 34.13 31.19 3fc3 s GLU 42 CO 0.77 -0.04 0.25 -1.17 0.02 0.00 0.00 175.26 175.09 3fc3 s LEU 43 N 1.02 4.04 0.06 1.80 0.20 -1.26 -1.43 118.68 123.12 3fc3 s LEU 43 Ca -0.00 0.12 0.04 0.00 0.69 0.00 0.00 54.13 54.97 3fc3 s LEU 43 Cb -0.15 -2.23 -0.03 0.00 -0.43 0.00 0.00 46.19 43.36 3fc3 s LEU 43 CO -0.01 -0.08 -0.11 -0.54 -0.29 0.00 0.00 176.35 175.31 3fc3 s LYS 44 N 1.77 0.70 -0.25 1.98 1.02 -0.20 -4.94 119.74 119.82 3fc3 s LYS 44 Ca 0.10 -0.88 -0.24 0.00 0.02 0.00 0.00 55.97 54.96 3fc3 s LYS 44 Cb -0.16 -0.59 -0.00 0.00 -0.52 0.00 0.00 37.83 36.56 3fc3 s LYS 44 CO 0.10 0.12 0.82 0.50 -0.92 0.00 0.00 175.35 175.98 3fc3 s ARG 45 N -1.72 4.15 -0.06 1.68 3.52 -1.26 -0.43 118.95 124.83 3fc3 s ARG 45 Ca -0.05 0.89 0.03 0.00 -0.13 0.00 0.00 55.73 56.47 3fc3 s ARG 45 Cb -0.10 -3.66 0.01 0.00 -1.56 0.00 0.00 34.95 29.65 3fc3 s ARG 45 CO 0.01 -0.54 -0.13 0.08 -0.81 0.00 0.00 175.30 173.91 3fc3 s VAL 46 N 2.86 1.21 0.41 7.11 1.01 0.44 -4.98 120.40 128.47 3fc3 s VAL 46 Ca 0.34 -0.54 -0.27 0.00 0.00 0.00 0.00 61.98 61.52 3fc3 s VAL 46 Cb -0.15 -1.09 -0.09 0.00 0.00 0.00 0.00 36.38 35.05 3fc3 s VAL 46 CO 0.08 0.37 1.42 -0.62 0.00 0.00 0.00 175.10 176.35 3fc3 s ASP 47 N 0.51 6.18 0.42 3.32 2.15 -1.26 -0.84 116.67 127.15 3fc3 s ASP 47 Ca -0.12 2.90 0.15 0.00 0.43 0.00 0.00 52.55 55.91 3fc3 s ASP 47 Cb -0.15 -2.66 1.03 0.00 -0.30 0.00 0.00 42.92 40.84 3fc3 s ASP 47 CO 0.04 -0.97 1.93 -0.26 -0.17 0.00 0.00 175.17 175.74 3fc3 h PHE 48 N 2.70 0.50 0.00 -5.34 0.04 -1.50 0.59 116.94 113.93 3fc3 h PHE 48 Ca -0.50 0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.28 3fc3 h PHE 48 Cb 1.25 -0.16 0.00 0.00 2.20 0.00 0.00 35.95 39.24 3fc3 h PHE 48 CO 0.52 0.20 0.00 -1.13 -0.60 0.00 0.00 178.31 177.30 3fc3 n SER 49 N -4.48 0.26 -0.92 2.17 3.41 -1.26 -1.75 113.62 111.06 3fc3 n SER 49 Ca 0.14 0.59 0.09 0.00 -0.26 0.00 0.00 58.87 59.42 3fc3 n SER 49 Cb 0.50 -0.63 0.20 0.00 -0.26 0.00 0.00 64.21 64.01 3fc3 n SER 49 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3fc3 n GLU 50 N -1.82 2.44 -4.66 4.33 -0.58 0.20 -4.97 120.64 115.59 3fc3 n GLU 50 Ca 0.01 -2.15 -0.27 0.00 -0.42 0.00 0.00 57.16 54.34 3fc3 n GLU 50 Cb 0.12 -1.40 -0.14 0.00 -0.57 0.00 0.00 31.44 29.45 3fc3 n GLU 50 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 3fc3 s LEU 51 N -1.11 2.19 -0.09 -4.62 1.43 -0.72 -1.01 118.68 114.75 3fc3 s LEU 51 Ca 0.32 -0.57 0.01 0.00 -1.03 0.00 0.00 54.13 52.87 3fc3 s LEU 51 Cb 0.18 -1.05 0.02 0.00 0.03 0.00 0.00 46.19 45.36 3fc3 s LEU 51 CO 0.24 0.17 -0.12 -0.70 0.23 0.00 0.00 176.35 176.17 3fc3 s GLU 52 N -1.31 1.79 0.43 1.70 2.12 -0.76 -4.89 118.70 117.78 3fc3 s GLU 52 Ca 0.09 -0.41 -0.26 0.00 0.36 0.00 0.00 54.97 54.74 3fc3 s GLU 52 Cb -0.09 -1.58 -0.09 0.00 0.26 0.00 0.00 34.13 32.63 3fc3 s GLU 52 CO 0.02 -0.07 1.45 0.00 -0.54 0.00 0.00 175.26 176.12 3fc3 s ALA 53 N 1.01 3.35 0.07 6.30 0.00 -1.26 -0.64 121.76 130.58 3fc3 s ALA 53 Ca -0.08 1.50 0.06 0.00 0.00 0.00 0.00 51.96 53.44 3fc3 s ALA 53 Cb -0.15 -3.60 -0.03 0.00 0.00 0.00 0.00 23.12 19.35 3fc3 s ALA 53 CO -0.01 -1.15 -0.15 0.96 0.00 0.00 0.00 175.76 175.41 3fc3 s ILE 54 N -1.18 1.21 -0.58 0.00 -4.36 -0.65 -4.82 121.20 110.82 3fc3 s ILE 54 Ca 0.58 -1.32 -0.19 0.00 -0.26 0.00 0.00 60.65 59.47 3fc3 s ILE 54 Cb -0.45 -1.14 0.09 0.00 1.25 0.00 0.00 42.46 42.21 3fc3 s ILE 54 CO 0.59 -0.18 0.71 -0.62 0.24 0.00 0.00 174.94 175.68 3fc3 s ASP 55 N -1.71 6.19 0.55 4.36 -1.08 -1.26 -4.48 116.67 119.24 3fc3 s ASP 55 Ca -0.00 -1.30 0.29 0.00 -0.52 0.00 0.00 52.55 51.02 3fc3 s ASP 55 Cb -0.10 -2.31 1.63 0.00 -1.46 0.00 0.00 42.92 40.68 3fc3 s ASP 55 CO 0.02 -1.10 2.14 0.16 0.52 0.00 0.00 175.17 176.92 3fc3 h ILE 56 N 5.92 0.50 0.00 4.11 3.07 -1.98 -1.75 117.51 127.38 3fc3 h ILE 56 Ca -0.29 -0.34 0.00 0.00 1.55 0.00 0.00 64.86 65.78 3fc3 h ILE 56 Cb 1.09 1.23 0.00 0.00 -0.27 0.00 0.00 36.82 38.86 3fc3 h ILE 56 CO 1.08 0.07 0.00 -1.22 -1.05 0.00 0.00 178.15 177.04 3fc3 n TYR 57 N -3.64 0.00 -1.89 0.16 4.01 -1.26 -3.18 117.16 111.36 3fc3 n TYR 57 Ca -0.02 0.00 -0.31 0.00 -0.16 0.00 0.00 57.90 57.41 3fc3 n TYR 57 Cb 0.18 -0.26 0.04 0.00 -0.31 0.00 0.00 39.34 38.99 3fc3 n TYR 57 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 3fc3 n ARG 58 N -1.26 3.12 -4.11 -0.72 1.74 -0.66 -4.96 116.66 109.82 3fc3 n ARG 58 Ca 0.15 -3.84 -0.09 0.00 -0.77 0.00 0.00 57.85 53.30 3fc3 n ARG 58 Cb 0.23 -2.27 -0.10 0.00 -1.02 0.00 0.00 32.46 29.29 3fc3 n ARG 58 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 3fc3 s THR 59 N -4.96 0.44 0.00 0.55 -4.23 -1.19 -4.81 115.64 101.44 3fc3 s THR 59 Ca 0.55 -1.65 0.00 0.00 -1.18 0.00 0.00 61.69 59.40 3fc3 s THR 59 Cb 0.44 -1.31 0.00 0.00 1.34 0.00 0.00 72.50 72.97 3fc3 s THR 59 CO -0.12 -0.81 0.00 0.61 -0.54 0.00 0.00 174.62 173.76 3fc3 n GLY 60 N 0.41 0.01 3.69 3.99 0.00 0.49 -4.87 105.19 108.90 3fc3 n GLY 60 Ca -0.16 -1.28 -0.44 0.00 0.00 0.00 0.00 46.02 44.15 3fc3 n GLY 60 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3fc3 n LYS 61 N 2.81 2.56 -0.01 1.61 4.81 -1.26 -1.21 118.16 127.46 3fc3 n LYS 61 Ca 0.00 0.93 0.00 0.00 -0.87 0.00 0.00 58.31 58.37 3fc3 n LYS 61 Cb 0.00 -2.78 0.00 0.00 0.02 0.00 0.00 35.03 32.27 3fc3 n LYS 61 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3fc3 n GLY 62 N 3.99 0.29 3.52 3.14 0.00 -1.26 -5.06 105.19 109.81 3fc3 n GLY 62 Ca 0.18 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.96 3fc3 n GLY 62 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3fc3 s TYR 63 N -2.09 2.20 -2.72 1.61 2.02 -0.35 -5.06 117.35 112.96 3fc3 s TYR 63 Ca 0.00 -0.77 0.25 0.00 -0.37 0.00 0.00 57.07 56.18 3fc3 s TYR 63 Cb 0.00 -1.44 0.41 0.00 -0.40 0.00 0.00 41.96 40.53 3fc3 s TYR 63 CO 0.00 0.27 1.38 -0.25 -1.57 0.00 0.00 175.55 175.37 3fc3 n ASP 64 N -0.78 2.44 -4.20 2.29 8.00 -1.26 -4.73 116.55 118.30 3fc3 n ASP 64 Ca -0.04 -1.78 -0.16 0.00 0.71 0.00 0.00 54.79 53.53 3fc3 n ASP 64 Cb 0.66 0.06 -0.11 0.00 -0.02 0.00 0.00 41.12 41.71 3fc3 n ASP 64 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3fc3 s LYS 65 N -2.07 0.92 -0.06 -1.24 1.02 -1.26 -1.71 119.74 115.33 3fc3 s LYS 65 Ca 0.29 -1.19 -0.08 0.00 0.02 0.00 0.00 55.97 55.01 3fc3 s LYS 65 Cb 0.20 -0.68 0.02 0.00 -0.52 0.00 0.00 37.83 36.85 3fc3 s LYS 65 CO 0.35 0.12 0.21 0.21 -0.92 0.00 0.00 175.35 175.31 3fc3 s LYS 66 N -2.74 0.32 -0.21 1.68 2.20 0.78 -0.38 119.74 121.39 3fc3 s LYS 66 Ca 0.07 0.15 -0.19 0.00 -0.36 0.00 0.00 55.97 55.63 3fc3 s LYS 66 Cb -0.04 0.15 -0.03 0.00 -1.51 0.00 0.00 37.83 36.40 3fc3 s LYS 66 CO 0.01 -0.05 0.56 0.42 -0.36 0.00 0.00 175.35 175.92 3fc3 s ILE 67 N -0.24 5.07 0.31 5.43 1.01 -1.26 -0.94 121.20 130.58 3fc3 s ILE 67 Ca -0.03 1.02 -0.29 0.00 0.00 0.00 0.00 60.65 61.35 3fc3 s ILE 67 Cb -0.03 -3.87 -0.10 0.00 0.01 0.00 0.00 42.46 38.47 3fc3 s ILE 67 CO 0.01 0.14 1.22 0.00 0.00 0.00 0.00 174.94 176.31 3fc3 n ASN 69 N 1.01 0.00 0.00 0.00 6.94 -0.52 -1.12 115.26 121.56 3fc3 n ASN 69 Ca -0.00 -0.10 0.00 0.00 -0.02 0.00 0.00 54.58 54.45 3fc3 n ASN 69 Cb 0.43 -0.29 0.00 0.00 -2.36 0.00 0.00 39.78 37.56 3fc3 n ASN 69 CO 0.00 0.00 0.00 -0.38 -1.03 0.00 0.00 177.26 175.85 3fc3 n ILE 70 N -1.29 0.00 0.45 1.53 2.08 -1.26 -4.72 119.36 116.15 3fc3 n ILE 70 Ca 0.14 0.34 0.13 0.00 0.56 0.00 0.00 62.75 63.91 3fc3 n ILE 70 Cb 0.24 -1.33 0.47 0.00 -0.75 0.00 0.00 39.64 38.28 3fc3 n ILE 70 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 3fc3 n HIS 72 N -2.35 -1.58 -4.58 0.00 8.25 -0.28 -3.71 115.22 110.97 3fc3 n HIS 72 Ca 0.03 0.72 -0.34 0.00 -0.26 0.00 0.00 57.72 57.88 3fc3 n HIS 72 Cb 0.31 -3.51 -0.11 0.00 1.12 0.00 0.00 29.99 27.80 3fc3 n HIS 72 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3fc3 s ILE 73 N -3.99 3.75 -0.24 1.59 1.01 -1.26 -0.61 121.20 121.45 3fc3 s ILE 73 Ca 0.06 -0.45 -0.29 0.00 0.00 0.00 0.00 60.65 59.97 3fc3 s ILE 73 Cb -0.03 -2.56 0.00 0.00 0.01 0.00 0.00 42.46 39.88 3fc3 s ILE 73 CO 0.91 0.58 1.19 -0.22 0.00 0.00 0.00 174.94 177.41 3fc3 s LEU 74 N -0.58 4.04 0.22 2.97 2.96 0.09 -2.55 118.68 125.84 3fc3 s LEU 74 Ca 0.09 1.39 0.06 0.00 -0.22 0.00 0.00 54.13 55.45 3fc3 s LEU 74 Cb -0.12 -3.54 -0.05 0.00 0.50 0.00 0.00 46.19 42.98 3fc3 s LEU 74 CO 0.02 -0.84 -0.09 -0.54 -1.32 0.00 0.00 176.35 173.57 3fc3 s LYS 75 N 3.64 1.34 0.54 1.98 1.02 -0.12 -4.91 119.74 123.23 3fc3 s LYS 75 Ca 0.51 -1.63 -0.21 0.00 0.02 0.00 0.00 55.97 54.66 3fc3 s LYS 75 Cb -0.17 -0.96 -0.06 0.00 -0.52 0.00 0.00 37.83 36.12 3fc3 s LYS 75 CO 0.15 0.09 1.21 0.09 -0.92 0.00 0.00 175.35 175.97 3fc3 n ASN 76 N -0.41 2.01 -0.33 2.83 3.02 -1.26 -0.16 115.26 120.96 3fc3 n ASN 76 Ca -0.07 0.94 0.16 0.00 -0.03 0.00 0.00 54.58 55.58 3fc3 n ASN 76 Cb 0.62 -1.50 0.38 0.00 -0.61 0.00 0.00 39.78 38.67 3fc3 n ASN 76 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 3fc3 h THR 77 N 1.20 0.66 0.00 3.41 2.02 -1.63 -0.06 112.91 118.51 3fc3 h THR 77 Ca -0.49 -0.22 0.00 0.00 0.77 0.00 0.00 66.41 66.47 3fc3 h THR 77 Cb 1.32 -0.04 0.00 0.00 -1.74 0.00 0.00 68.15 67.69 3fc3 h THR 77 CO 0.55 0.12 0.00 -0.90 0.37 0.00 0.00 175.52 175.66 3fc3 n ASP 78 N -4.73 0.00 0.00 4.18 5.68 -1.26 -1.80 116.55 118.62 3fc3 n ASP 78 Ca 0.23 0.07 0.12 0.00 -0.50 0.00 0.00 54.79 54.71 3fc3 n ASP 78 Cb 0.65 -0.30 0.69 0.00 -1.14 0.00 0.00 41.12 41.02 3fc3 n ASP 78 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3fc3 n GLY 79 N 0.16 -0.76 3.16 6.12 0.00 -0.04 -4.76 105.19 109.08 3fc3 n GLY 79 Ca 0.08 -0.14 -0.23 0.00 0.00 0.00 0.00 46.02 45.72 3fc3 n GLY 79 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3fc3 s PHE 80 N -2.00 1.43 0.00 1.61 0.08 -0.75 -1.24 117.98 117.12 3fc3 s PHE 80 Ca 0.35 -0.31 -0.27 0.00 0.12 0.00 0.00 56.93 56.82 3fc3 s PHE 80 Cb 0.16 -0.89 -0.04 0.00 -0.57 0.00 0.00 43.02 41.68 3fc3 s PHE 80 CO 0.27 0.02 0.84 -2.00 -0.10 0.00 0.00 175.22 174.24 3fc3 s GLU 81 N -0.74 4.52 0.25 0.44 2.12 -1.26 -4.83 118.70 119.20 3fc3 s GLU 81 Ca 0.05 1.17 -0.31 0.00 0.36 0.00 0.00 54.97 56.25 3fc3 s GLU 81 Cb -0.07 -3.42 -0.11 0.00 0.26 0.00 0.00 34.13 30.79 3fc3 s GLU 81 CO 0.00 0.10 1.59 0.42 -0.54 0.00 0.00 175.26 176.83 3fc3 s ILE 82 N 0.56 2.25 0.00 -3.70 1.01 -1.26 -0.93 121.20 119.13 3fc3 s ILE 82 Ca 0.44 0.20 0.00 0.00 0.00 0.00 0.00 60.65 61.28 3fc3 s ILE 82 Cb -0.20 -3.13 0.00 0.00 0.01 0.00 0.00 42.46 39.14 3fc3 s ILE 82 CO 0.24 0.03 0.00 -3.20 0.00 0.00 0.00 174.94 172.01 3fc3 n ASN 83 N 2.79 1.51 -2.92 3.58 2.85 0.39 -4.86 115.26 118.60 3fc3 n ASN 83 Ca 0.10 0.00 -0.12 0.00 -0.11 0.00 0.00 54.58 54.45 3fc3 n ASN 83 Cb 0.38 0.20 0.00 0.00 1.24 0.00 0.00 39.78 41.60 3fc3 n ASN 83 CO 0.00 0.00 0.00 -1.10 -2.11 0.00 0.00 177.26 174.05 3fc3 s GLN 84 N -1.08 2.18 -0.01 1.20 -1.52 -0.83 -5.00 119.66 114.59 3fc3 s GLN 84 Ca 0.00 -1.64 0.02 0.00 -1.95 0.00 0.00 55.36 51.79 3fc3 s GLN 84 Cb 0.00 0.56 0.00 0.00 -0.22 0.00 0.00 33.01 33.35 3fc3 s GLN 84 CO 0.00 -0.98 -0.05 0.99 -0.25 0.00 0.00 175.29 175.00 3fc3 s THR 85 N -2.41 0.44 0.71 -0.19 2.01 -1.26 -0.82 115.64 114.11 3fc3 s THR 85 Ca 0.22 -0.20 0.01 0.00 0.31 0.00 0.00 61.69 62.03 3fc3 s THR 85 Cb -0.03 -0.40 0.13 0.00 0.01 0.00 0.00 72.50 72.21 3fc3 s THR 85 CO 0.16 0.14 0.98 1.51 -0.69 0.00 0.00 174.62 176.72 3fc3 s ASP 86 N 0.12 4.40 0.62 3.53 1.47 -0.09 -4.94 116.67 121.78 3fc3 s ASP 86 Ca -0.01 -0.47 0.36 0.00 1.18 0.00 0.00 52.55 53.61 3fc3 s ASP 86 Cb -0.05 0.10 2.06 0.00 -0.34 0.00 0.00 42.92 44.69 3fc3 s ASP 86 CO -0.00 -1.83 2.29 0.00 0.68 0.00 0.00 175.17 176.30 3fc3 h ALA 87 N -0.46 1.26 -0.15 2.11 0.00 -2.02 0.20 119.26 120.20 3fc3 h ALA 87 Ca -0.35 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.55 3fc3 h ALA 87 Cb 1.27 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.06 3fc3 h ALA 87 CO 0.39 0.01 0.00 1.63 0.00 0.00 0.00 179.25 181.28 3fc3 n LYS 88 N -3.47 1.72 -1.00 0.00 4.01 -1.26 -4.93 118.16 113.24 3fc3 n LYS 88 Ca -0.03 -1.08 0.00 0.00 -0.51 0.00 0.00 58.31 56.69 3fc3 n LYS 88 Cb 0.10 -1.41 0.00 0.00 -0.51 0.00 0.00 35.03 33.21 3fc3 n LYS 88 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 3fc3 n GLY 89 N 1.14 0.62 3.81 0.72 0.00 0.06 -5.03 105.19 106.50 3fc3 n GLY 89 Ca 0.16 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 3fc3 n GLY 89 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3fc3 s ARG 90 N -0.02 4.31 0.26 1.61 0.52 -1.26 -4.78 118.95 119.58 3fc3 s ARG 90 Ca 0.00 0.92 -0.24 0.00 -0.52 0.00 0.00 55.73 55.89 3fc3 s ARG 90 Cb 0.00 -2.94 -0.09 0.00 0.52 0.00 0.00 34.95 32.44 3fc3 s ARG 90 CO 0.00 0.42 0.84 0.15 0.02 0.00 0.00 175.30 176.73 3fc3 s LYS 91 N -1.83 4.49 -0.09 3.54 -0.14 -1.26 -0.91 119.74 123.53 3fc3 s LYS 91 Ca 0.42 1.15 0.03 0.00 -1.36 0.00 0.00 55.97 56.21 3fc3 s LYS 91 Cb -0.18 -2.94 -0.01 0.00 -1.68 0.00 0.00 37.83 33.01 3fc3 s LYS 91 CO 0.22 0.39 -0.17 0.99 -0.76 0.00 0.00 175.35 176.01 3fc3 s THR 92 N -1.47 2.73 0.25 2.17 2.01 -0.00 -4.91 115.64 116.41 3fc3 s THR 92 Ca 0.44 -0.81 0.06 0.00 0.31 0.00 0.00 61.69 61.70 3fc3 s THR 92 Cb -0.19 -2.09 -0.03 0.00 0.01 0.00 0.00 72.50 70.20 3fc3 s THR 92 CO 0.24 0.55 0.30 0.42 -0.69 0.00 0.00 174.62 175.44 3fc3 s THR 93 N -0.03 4.85 0.66 -0.82 -4.23 -1.26 -0.46 115.64 114.35 3fc3 s THR 93 Ca -0.05 -1.16 -0.17 0.00 -1.18 0.00 0.00 61.69 59.13 3fc3 s THR 93 Cb -0.14 -3.65 -0.00 0.00 1.34 0.00 0.00 72.50 70.05 3fc3 s THR 93 CO 0.04 -0.33 1.26 -0.13 -0.54 0.00 0.00 174.62 174.93 3fc3 s ARG 94 N -3.93 2.51 0.44 3.99 0.52 -0.10 -4.82 118.95 117.54 3fc3 s ARG 94 Ca 0.34 1.96 0.28 0.00 -0.52 0.00 0.00 55.73 57.79 3fc3 s ARG 94 Cb -0.08 -1.85 0.97 0.00 0.52 0.00 0.00 34.95 34.50 3fc3 s ARG 94 CO 0.27 -1.60 1.82 -1.00 0.02 0.00 0.00 175.30 174.81 3fc3 h PRO 95 N 0.39 0.00 -5.64 3.54 0.13 -1.97 -3.44 132.00 125.01 3fc3 h PRO 95 Ca -0.50 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 63.97 3fc3 h PRO 95 Cb 1.32 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 32.34 3fc3 h PRO 95 CO 0.52 0.00 -0.54 -1.12 -0.23 0.00 0.00 178.00 176.64 3fc3 s SER 96 N -5.48 5.89 0.96 1.44 0.01 -1.26 -1.44 113.70 113.82 3fc3 s SER 96 Ca 0.04 0.28 -0.12 0.00 1.31 0.00 0.00 55.95 57.46 3fc3 s SER 96 Cb 0.08 -1.88 0.17 0.00 0.21 0.00 0.00 66.02 64.60 3fc3 s SER 96 CO 0.56 0.34 1.09 0.00 0.41 0.00 0.00 173.24 175.64 3fc3 h ARG 98 N -1.77 0.55 -0.26 0.00 3.08 -1.55 -0.06 114.38 114.37 3fc3 h ARG 98 Ca -0.53 -0.03 -0.09 0.00 0.07 0.00 0.00 59.98 59.40 3fc3 h ARG 98 Cb 1.31 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 31.23 3fc3 h ARG 98 CO 0.57 0.36 -0.18 0.93 -1.07 0.00 0.00 179.97 180.58 3fc3 h GLU 99 N 0.56 0.57 -0.07 0.04 4.39 -1.91 -2.95 114.58 115.21 3fc3 h GLU 99 Ca 0.16 -0.27 -0.09 0.00 0.34 0.00 0.00 59.36 59.50 3fc3 h GLU 99 Cb -0.05 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.59 3fc3 h GLU 99 CO -0.03 0.85 -0.35 0.00 -1.16 0.00 0.00 179.01 178.31 3fc3 h ARG 101 N 0.13 0.00 -0.64 0.00 2.47 -0.90 -2.86 114.38 112.57 3fc3 h ARG 101 Ca 0.01 0.00 0.05 0.00 -1.26 0.00 0.00 59.98 58.78 3fc3 h ARG 101 Cb 0.69 0.00 -0.05 0.00 -1.65 0.00 0.00 29.97 28.96 3fc3 h ARG 101 CO 0.05 0.13 0.37 0.87 0.56 0.00 0.00 179.97 181.95 3fc3 h LYS 102 N 0.00 0.68 -0.03 0.04 1.57 -1.33 0.13 116.57 117.64 3fc3 h LYS 102 Ca -0.00 -0.04 -0.11 0.00 -1.87 0.00 0.00 60.65 58.63 3fc3 h LYS 102 Cb 0.28 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.42 3fc3 h LYS 102 CO 0.02 0.45 -0.49 -0.91 -0.57 0.00 0.00 179.45 177.95 3fc3 h ASN 103 N 0.70 0.08 -0.05 0.86 2.35 -1.66 -1.97 115.58 115.89 3fc3 h ASN 103 Ca 0.27 -0.04 -0.13 0.00 -0.55 0.00 0.00 56.30 55.86 3fc3 h ASN 103 Cb 0.11 -0.02 0.01 0.00 0.05 0.00 0.00 38.32 38.47 3fc3 h ASN 103 CO -0.15 0.56 -0.46 0.40 -1.65 0.00 0.00 177.43 176.13 3fc3 h ILE 104 N 0.06 1.42 -0.11 2.81 2.04 -1.30 -3.29 117.51 119.14 3fc3 h ILE 104 Ca -0.00 -1.89 -0.12 0.00 1.00 0.00 0.00 64.86 63.85 3fc3 h ILE 104 Cb 0.89 2.42 -0.01 0.00 -0.74 0.00 0.00 36.82 39.38 3fc3 h ILE 104 CO 0.07 0.55 -0.46 0.44 0.00 0.00 0.00 178.15 178.75 3fc3 h ASP 105 N -0.09 0.28 0.00 1.72 3.32 -0.75 -3.48 116.42 117.41 3fc3 h ASP 105 Ca -0.04 -0.13 0.00 0.00 0.02 0.00 0.00 57.03 56.88 3fc3 h ASP 105 Cb 1.14 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.61 3fc3 h ASP 105 CO 0.09 0.70 0.00 0.61 -1.72 0.00 0.00 179.24 178.93 3fc3 n GLY 106 N -0.05 2.30 3.74 2.75 0.00 -0.74 -4.59 105.19 108.58 3fc3 n GLY 106 Ca -0.02 -0.41 -0.39 0.00 0.00 0.00 0.00 46.02 45.20 3fc3 n GLY 106 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fc3 s VAL 107 N 0.00 4.95 0.79 1.61 1.01 0.12 -4.99 120.40 123.89 3fc3 s VAL 107 Ca 0.00 1.40 -0.11 0.00 0.00 0.00 0.00 61.98 63.27 3fc3 s VAL 107 Cb 0.00 -4.01 0.07 0.00 0.00 0.00 0.00 36.38 32.43 3fc3 s VAL 107 CO 0.00 0.33 1.09 -1.59 0.00 0.00 0.00 175.10 174.93 3fc3 s LYS 108 N 0.34 2.13 0.12 2.72 -2.85 -1.26 -4.38 119.74 116.55 3fc3 s LYS 108 Ca 0.35 1.10 -0.31 0.00 -1.00 0.00 0.00 55.97 56.12 3fc3 s LYS 108 Cb -0.18 -1.89 -0.09 0.00 -2.06 0.00 0.00 37.83 33.61 3fc3 s LYS 108 CO 0.18 -1.71 1.62 -1.17 0.10 0.00 0.00 175.35 174.37 3fc3 s LEU 109 N -5.95 4.37 0.64 2.77 2.96 -1.26 -4.38 118.68 117.82 3fc3 s LEU 109 Ca 0.61 2.56 -0.15 0.00 -0.22 0.00 0.00 54.13 56.94 3fc3 s LEU 109 Cb -0.17 -3.58 -0.01 0.00 0.50 0.00 0.00 46.19 42.93 3fc3 s LEU 109 CO 0.56 -0.86 1.07 -0.94 -1.32 0.00 0.00 176.35 174.86 3fc3 s SER 110 N 1.83 5.46 0.20 3.68 1.04 -0.90 -4.84 113.70 120.17 3fc3 s SER 110 Ca 0.72 1.84 -0.10 0.00 0.48 0.00 0.00 55.95 58.90 3fc3 s SER 110 Cb -0.42 -2.53 0.25 0.00 0.10 0.00 0.00 66.02 63.42 3fc3 s SER 110 CO 0.32 -1.39 1.76 0.28 0.98 0.00 0.00 173.24 175.19 3fc3 h SER 111 N 0.07 0.30 -0.04 7.02 0.02 -1.93 0.20 113.55 119.20 3fc3 h SER 111 Ca -0.46 0.06 -0.17 0.00 -0.84 0.00 0.00 61.79 60.38 3fc3 h SER 111 Cb 1.23 0.02 -0.00 0.00 0.14 0.00 0.00 62.40 63.78 3fc3 h SER 111 CO 0.56 0.19 -0.58 0.71 -1.14 0.00 0.00 176.83 176.57 3fc3 h THR 112 N 0.47 1.31 -0.41 -2.27 1.35 -1.98 -0.60 112.91 110.78 3fc3 h THR 112 Ca 0.29 -1.83 -0.11 0.00 -0.55 0.00 0.00 66.41 64.22 3fc3 h THR 112 Cb 0.31 1.78 -0.02 0.00 -1.73 0.00 0.00 68.15 68.50 3fc3 h THR 112 CO -0.26 0.57 -0.18 -0.33 -0.25 0.00 0.00 175.52 175.07 3fc3 h GLU 113 N 0.48 0.78 -0.73 4.72 4.39 -1.84 -2.02 114.58 120.37 3fc3 h GLU 113 Ca 0.00 -0.29 -0.05 0.00 0.34 0.00 0.00 59.36 59.35 3fc3 h GLU 113 Cb 1.15 -0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 29.72 3fc3 h GLU 113 CO 0.11 0.90 0.24 -0.22 -1.16 0.00 0.00 179.01 178.89 3fc3 h LYS 114 N 0.69 1.12 -0.65 2.33 3.64 -0.32 -2.12 116.57 121.26 3fc3 h LYS 114 Ca 0.10 -0.23 -0.08 0.00 -1.27 0.00 0.00 60.65 59.18 3fc3 h LYS 114 Cb 0.68 -0.17 -0.03 0.00 -0.41 0.00 0.00 32.23 32.31 3fc3 h LYS 114 CO 0.05 0.95 0.11 0.87 -2.27 0.00 0.00 179.45 179.16 3fc3 h LYS 115 N 1.07 1.07 -0.86 1.90 1.79 -1.05 -0.17 116.57 120.32 3fc3 h LYS 115 Ca 0.24 -0.28 0.04 0.00 -2.18 0.00 0.00 60.65 58.46 3fc3 h LYS 115 Cb 0.29 -0.13 -0.05 0.00 -1.58 0.00 0.00 32.23 30.76 3fc3 h LYS 115 CO -0.01 0.98 0.55 0.87 -1.08 0.00 0.00 179.45 180.77 3fc3 h LYS 116 N 0.98 1.04 -0.30 3.15 1.57 -1.13 -2.11 116.57 119.77 3fc3 h LYS 116 Ca 0.20 -0.06 -0.17 0.00 -1.87 0.00 0.00 60.65 58.75 3fc3 h LYS 116 Cb 0.43 -0.23 -0.00 0.00 0.08 0.00 0.00 32.23 32.50 3fc3 h LYS 116 CO 0.01 0.69 -0.48 0.52 -0.57 0.00 0.00 179.45 179.62 3fc3 h MET 117 N 1.07 0.81 0.00 3.15 2.86 -1.02 -3.09 114.93 118.71 3fc3 h MET 117 Ca 0.35 -0.47 -0.04 0.00 -2.06 0.00 0.00 59.70 57.47 3fc3 h MET 117 Cb 0.02 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.71 3fc3 h MET 117 CO -0.12 1.10 -0.21 -0.44 1.06 0.00 0.00 176.91 178.31 3fc3 h ASP 118 N 0.64 0.00 0.40 1.22 3.32 -0.72 -1.76 116.42 119.53 3fc3 h ASP 118 Ca 0.03 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.06 3fc3 h ASP 118 Cb 1.06 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.61 3fc3 h ASP 118 CO 0.11 0.21 -0.09 -0.33 -1.72 0.00 0.00 179.24 177.41 3fc3 h GLU 119 N 0.00 0.00 0.00 3.56 5.08 -1.30 -3.04 114.58 118.88 3fc3 h GLU 119 Ca -0.00 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 3fc3 h GLU 119 Cb 0.38 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.62 3fc3 h GLU 119 CO 0.03 0.09 -0.30 0.44 -1.00 0.00 0.00 179.01 178.27 3fc3 n ILE 120 N -3.52 1.99 -2.17 3.13 -5.35 -0.70 -5.06 119.36 107.69 3fc3 n ILE 120 Ca -0.02 -2.74 -0.41 0.00 -0.27 0.00 0.00 62.75 59.31 3fc3 n ILE 120 Cb 0.23 -0.20 -0.03 0.00 -1.74 0.00 0.00 39.64 37.90 3fc3 n ILE 120 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3fc3 s ALA 121 N -2.97 3.56 0.17 -1.28 0.00 -0.97 -4.97 121.76 115.30 3fc3 s ALA 121 Ca 0.35 1.15 -0.32 0.00 0.00 0.00 0.00 51.96 53.15 3fc3 s ALA 121 Cb 0.33 -3.51 -0.11 0.00 0.00 0.00 0.00 23.12 19.83 3fc3 s ALA 121 CO -0.03 -0.59 1.69 -2.14 0.00 0.00 0.00 175.76 174.69 3fc3 s PRO 122 N 0.06 4.16 0.49 0.00 0.02 -1.26 -4.95 135.00 133.51 3fc3 s PRO 122 Ca 0.59 2.51 -0.24 0.00 0.02 0.00 0.00 61.00 63.88 3fc3 s PRO 122 Cb -0.38 -3.23 -0.07 0.00 0.02 0.00 0.00 34.50 30.84 3fc3 s PRO 122 CO 0.38 -0.73 1.37 -2.30 -0.33 0.00 0.00 177.00 175.39 3fc3 n PRO 123 N 4.42 1.97 -1.69 5.54 -0.02 -1.26 -4.93 135.00 139.02 3fc3 n PRO 123 Ca 0.16 0.71 -0.44 0.00 -2.02 0.00 0.00 63.50 61.91 3fc3 n PRO 123 Cb 0.37 -2.57 -0.02 0.00 -0.02 0.00 0.00 33.50 31.27 3fc3 n PRO 123 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 3fc3 n LYS 124 N -0.48 2.18 -0.99 -0.52 4.81 -1.26 -1.87 118.16 120.03 3fc3 n LYS 124 Ca 0.07 0.77 0.00 0.00 -0.87 0.00 0.00 58.31 58.29 3fc3 n LYS 124 Cb 0.42 -2.43 0.00 0.00 0.02 0.00 0.00 35.03 33.04 3fc3 n LYS 124 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3fc3 n GLY 125 N 1.75 0.67 3.92 3.14 0.00 0.11 -4.95 105.19 109.83 3fc3 n GLY 125 Ca 0.09 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.85 3fc3 n GLY 125 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3fc3 s SER 126 N -2.36 5.88 -0.23 1.61 1.04 -0.78 -4.70 113.70 114.16 3fc3 s SER 126 Ca 0.00 0.71 -0.20 0.00 0.48 0.00 0.00 55.95 56.94 3fc3 s SER 126 Cb 0.00 -1.87 -0.02 0.00 0.10 0.00 0.00 66.02 64.23 3fc3 s SER 126 CO 0.00 -0.82 0.60 -0.69 0.98 0.00 0.00 173.24 173.31 3fc3 s VAL 127 N -2.82 5.02 0.08 5.02 1.01 -1.26 -0.60 120.40 126.86 3fc3 s VAL 127 Ca 0.50 1.10 0.08 0.00 0.00 0.00 0.00 61.98 63.67 3fc3 s VAL 127 Cb -0.10 -3.91 -0.03 0.00 0.00 0.00 0.00 36.38 32.33 3fc3 s VAL 127 CO 0.44 0.09 -0.22 0.12 0.00 0.00 0.00 175.10 175.52 3fc3 s PHE 128 N 2.13 1.92 -0.15 5.22 5.36 0.22 -4.96 117.98 127.72 3fc3 s PHE 128 Ca 0.26 -0.40 0.00 0.00 -0.96 0.00 0.00 56.93 55.84 3fc3 s PHE 128 Cb -0.16 -1.09 0.02 0.00 -0.34 0.00 0.00 43.02 41.46 3fc3 s PHE 128 CO 0.09 0.17 -0.14 0.99 -1.46 0.00 0.00 175.22 174.88 3fc3 s THR 129 N -0.98 1.55 0.15 0.12 2.01 -1.26 -0.26 115.64 116.97 3fc3 s THR 129 Ca 0.08 -0.63 -0.31 0.00 0.31 0.00 0.00 61.69 61.14 3fc3 s THR 129 Cb -0.10 -1.47 -0.09 0.00 0.01 0.00 0.00 72.50 70.86 3fc3 s THR 129 CO 0.03 0.44 1.47 0.00 -0.69 0.00 0.00 174.62 175.87 3fc3 n PRO 131 N 3.74 0.13 -0.02 0.00 -0.04 -1.26 -1.67 135.00 135.87 3fc3 n PRO 131 Ca 0.12 0.43 -0.02 0.00 -0.04 0.00 0.00 63.50 64.00 3fc3 n PRO 131 Cb 0.40 -1.78 -0.01 0.00 -0.04 0.00 0.00 33.50 32.08 3fc3 n PRO 131 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 3fc3 n ILE 132 N -2.03 0.28 0.53 0.52 5.41 -1.26 -4.68 119.36 118.12 3fc3 n ILE 132 Ca 0.02 0.44 0.13 0.00 1.00 0.00 0.00 62.75 64.33 3fc3 n ILE 132 Cb 0.16 -1.66 0.42 0.00 -0.71 0.00 0.00 39.64 37.85 3fc3 n ILE 132 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3fc3 n GLU 134 N -2.34 -0.84 -2.84 0.00 1.02 -0.67 -4.99 120.64 109.98 3fc3 n GLU 134 Ca 0.04 0.40 -0.40 0.00 -0.02 0.00 0.00 57.16 57.19 3fc3 n GLU 134 Cb 0.38 -4.15 -0.06 0.00 -0.02 0.00 0.00 31.44 27.60 3fc3 n GLU 134 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 3fc3 s LYS 135 N -1.45 4.71 0.30 3.49 1.02 -1.26 -4.68 119.74 121.86 3fc3 s LYS 135 Ca 0.00 1.34 -0.19 0.00 0.02 0.00 0.00 55.97 57.14 3fc3 s LYS 135 Cb 0.00 -3.30 -0.09 0.00 -0.52 0.00 0.00 37.83 33.92 3fc3 s LYS 135 CO 0.00 0.46 0.78 1.03 -0.92 0.00 0.00 175.35 176.71 3fc3 s ARG 136 N -0.87 4.20 0.25 1.68 0.52 -1.26 -1.61 118.95 121.87 3fc3 s ARG 136 Ca 0.40 0.89 -0.16 0.00 -0.52 0.00 0.00 55.73 56.34 3fc3 s ARG 136 Cb -0.24 -2.62 0.01 0.00 0.52 0.00 0.00 34.95 32.61 3fc3 s ARG 136 CO 0.29 0.24 0.56 -1.54 0.02 0.00 0.00 175.30 174.88 3fc3 s SER 137 N -1.93 -0.17 -0.28 0.23 1.04 0.64 -4.98 113.70 108.25 3fc3 s SER 137 Ca 0.50 -0.75 -0.09 0.00 0.48 0.00 0.00 55.95 56.09 3fc3 s SER 137 Cb -0.14 0.63 -0.02 0.00 0.10 0.00 0.00 66.02 66.59 3fc3 s SER 137 CO 0.19 -1.19 0.12 -0.63 0.98 0.00 0.00 173.24 172.71 3fc3 s ILE 138 N -3.96 4.57 0.03 -1.02 1.01 -1.26 -0.61 121.20 119.96 3fc3 s ILE 138 Ca 0.16 -0.23 -0.31 0.00 0.00 0.00 0.00 60.65 60.27 3fc3 s ILE 138 Cb -0.02 -3.22 -0.10 0.00 0.01 0.00 0.00 42.46 39.12 3fc3 s ILE 138 CO 0.06 0.21 1.91 0.52 0.00 0.00 0.00 174.94 177.65 3fc3 n VAL 139 N 4.97 0.61 -0.99 2.92 0.31 0.23 -1.19 118.33 125.19 3fc3 n VAL 139 Ca -0.15 -0.11 0.00 0.00 -0.01 0.00 0.00 64.34 64.07 3fc3 n VAL 139 Cb 0.51 -2.14 0.00 0.00 -0.91 0.00 0.00 33.84 31.29 3fc3 n VAL 139 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3fc3 n GLY 140 N 4.41 0.80 1.15 2.92 0.00 0.08 -0.71 105.19 113.83 3fc3 n GLY 140 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 3fc3 n GLY 140 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3fc3 n VAL 141 N -2.34 0.49 0.56 1.61 0.31 -0.33 -4.86 118.33 113.76 3fc3 n VAL 141 Ca 0.00 0.16 0.06 0.00 -0.01 0.00 0.00 64.34 64.55 3fc3 n VAL 141 Cb 0.01 -1.40 0.02 0.00 -0.91 0.00 0.00 33.84 31.55 3fc3 n VAL 141 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 3fc3 n THR 142 N -3.19 0.00 -3.59 2.52 -2.24 -0.42 -4.95 114.28 102.41 3fc3 n THR 142 Ca 0.00 -0.41 -0.15 0.00 -2.27 0.00 0.00 64.05 61.22 3fc3 n THR 142 Cb 0.24 1.19 -0.07 0.00 -2.10 0.00 0.00 70.33 69.59 3fc3 n THR 142 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3fc3 s ALA 143 N -1.42 -1.79 -0.10 6.98 0.00 -1.20 -4.79 121.76 119.43 3fc3 s ALA 143 Ca 0.12 1.78 -0.13 0.00 0.00 0.00 0.00 51.96 53.73 3fc3 s ALA 143 Cb 0.10 -0.80 -0.05 0.00 0.00 0.00 0.00 23.12 22.37 3fc3 s ALA 143 CO 0.26 -0.34 0.30 -0.80 0.00 0.00 0.00 175.76 175.19 3fc3 s ASN 144 N -0.17 6.54 0.25 0.00 0.01 -1.26 -0.74 114.94 119.56 3fc3 s ASN 144 Ca -0.03 0.64 0.07 0.00 -0.71 0.00 0.00 52.86 52.83 3fc3 s ASN 144 Cb -0.03 -2.18 -0.04 0.00 0.41 0.00 0.00 41.25 39.41 3fc3 s ASN 144 CO 0.03 0.22 0.20 -0.76 -1.51 0.00 0.00 177.10 175.28 3fc3 s LEU 145 N -0.26 3.82 0.04 0.60 1.43 -1.26 -0.45 118.68 122.59 3fc3 s LEU 145 Ca 0.19 -0.24 -0.02 0.00 -1.03 0.00 0.00 54.13 53.02 3fc3 s LEU 145 Cb -0.14 -2.35 -0.02 0.00 0.03 0.00 0.00 46.19 43.71 3fc3 s LEU 145 CO 0.07 -0.03 0.01 0.68 0.23 0.00 0.00 176.35 177.30 3fc3 s VAL 146 N -2.12 0.16 -0.70 -1.59 -7.23 -0.38 -4.82 120.40 103.71 3fc3 s VAL 146 Ca 0.33 -1.28 -0.27 0.00 -1.81 0.00 0.00 61.98 58.95 3fc3 s VAL 146 Cb -0.08 -0.89 0.01 0.00 0.56 0.00 0.00 36.38 35.99 3fc3 s VAL 146 CO 0.25 -0.70 1.48 -1.00 -0.31 0.00 0.00 175.10 174.81 3fc3 s HIS 147 N -2.66 2.08 0.34 2.82 3.76 -1.26 -2.79 115.29 117.58 3fc3 s HIS 147 Ca -0.05 0.22 -0.24 0.00 -0.15 0.00 0.00 55.06 54.84 3fc3 s HIS 147 Cb -0.01 -4.45 -0.10 0.00 1.11 0.00 0.00 32.58 29.13 3fc3 s HIS 147 CO -0.05 -2.15 0.93 0.34 -0.85 0.00 0.00 174.74 172.96 3fc3 s ASP 148 N 5.20 7.21 0.07 1.40 2.15 -1.13 -5.00 116.67 126.57 3fc3 s ASP 148 Ca 0.46 1.77 -0.08 0.00 0.43 0.00 0.00 52.55 55.13 3fc3 s ASP 148 Cb -0.09 -2.56 -0.01 0.00 -0.30 0.00 0.00 42.92 39.96 3fc3 s ASP 148 CO 0.16 -0.14 0.16 -1.38 -0.17 0.00 0.00 175.17 173.80 3fc3 s HIS 149 N -1.76 0.17 -0.20 -5.34 -3.43 -1.26 -1.15 115.29 102.32 3fc3 s HIS 149 Ca 0.53 -0.54 -0.27 0.00 -0.80 0.00 0.00 55.06 53.97 3fc3 s HIS 149 Cb -0.16 -0.10 -0.00 0.00 -1.43 0.00 0.00 32.58 30.89 3fc3 s HIS 149 CO 0.21 -0.47 0.94 1.21 -2.00 0.00 0.00 174.74 174.63 3fc3 s ASN 150 N -2.57 7.03 0.00 7.38 3.84 0.59 -4.84 114.94 126.36 3fc3 s ASN 150 Ca 0.01 1.28 0.21 0.00 0.21 0.00 0.00 52.86 54.57 3fc3 s ASN 150 Cb 0.03 -2.50 0.73 0.00 -0.55 0.00 0.00 41.25 38.96 3fc3 s ASN 150 CO -0.08 -0.55 1.54 0.00 -2.79 0.00 0.00 177.10 175.22 3fc3 n HIS 151 N 5.84 0.22 0.02 0.43 1.44 -1.26 -0.14 115.22 121.77 3fc3 n HIS 151 Ca 0.08 -0.11 -0.15 0.00 -2.01 0.00 0.00 57.72 55.54 3fc3 n HIS 151 Cb 0.47 0.00 -0.14 0.00 0.12 0.00 0.00 29.99 30.44 3fc3 n HIS 151 CO 0.00 0.00 0.00 -0.44 -2.81 0.00 0.00 176.34 173.09 3fc3 h ASP 152 N 2.33 0.25 0.00 4.39 3.32 -1.92 0.34 116.42 125.13 3fc3 h ASP 152 Ca 0.00 -0.44 -0.20 0.00 0.02 0.00 0.00 57.03 56.41 3fc3 h ASP 152 Cb 0.51 -0.08 -0.04 0.00 0.22 0.00 0.00 39.33 39.94 3fc3 h ASP 152 CO 0.00 1.39 -1.81 0.35 -1.72 0.00 0.00 179.24 177.45 3fc3 n THR 153 N -3.32 0.75 -0.69 0.35 -2.24 -1.21 -4.83 114.28 103.09 3fc3 n THR 153 Ca -0.20 -0.49 0.00 0.00 -2.27 0.00 0.00 64.05 61.09 3fc3 n THR 153 Cb 1.04 -0.59 0.00 0.00 -2.10 0.00 0.00 70.33 68.68 3fc3 n THR 153 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3fc3 n GLY 154 N 2.20 0.69 3.88 3.38 0.00 0.80 -4.98 105.19 111.16 3fc3 n GLY 154 Ca -0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.53 3fc3 n GLY 154 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3fc3 s TRP 155 N -2.25 3.43 0.56 1.61 0.51 -1.22 -2.13 118.94 119.46 3fc3 s TRP 155 Ca 0.00 0.92 -0.18 0.00 -2.12 0.00 0.00 56.10 54.72 3fc3 s TRP 155 Cb 0.00 -2.31 -0.05 0.00 -0.81 0.00 0.00 33.47 30.30 3fc3 s TRP 155 CO 0.00 0.15 1.07 0.20 -0.51 0.00 0.00 176.95 177.86 3fc3 s GLY 156 N -2.66 2.35 0.00 0.98 0.00 -1.26 -0.30 107.32 106.43 3fc3 s GLY 156 Ca 0.49 0.57 0.00 0.00 0.00 0.00 0.00 44.72 45.77 3fc3 s GLY 156 CO 0.24 0.90 0.00 0.54 0.00 0.00 0.00 173.10 174.78 3fc3 n ARG 157 N -1.60 0.00 -4.30 2.90 1.74 -0.30 -4.69 116.66 110.41 3fc3 n ARG 157 Ca 0.10 0.00 -0.16 0.00 -0.77 0.00 0.00 57.85 57.02 3fc3 n ARG 157 Cb 0.52 0.00 -0.10 0.00 -1.02 0.00 0.00 32.46 31.86 3fc3 n ARG 157 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 3fc3 s GLU 158 N 1.86 1.24 -0.06 5.56 2.02 -1.26 -4.96 118.70 123.11 3fc3 s GLU 158 Ca 0.00 -1.61 -0.30 0.00 0.02 0.00 0.00 54.97 53.08 3fc3 s GLU 158 Cb 0.00 -0.53 -0.04 0.00 0.10 0.00 0.00 34.13 33.66 3fc3 s GLU 158 CO 0.00 -0.08 1.42 -1.58 0.02 0.00 0.00 175.26 175.04 3fc3 s TRP 159 N -3.47 2.63 0.16 1.61 0.52 -1.26 -2.84 118.94 116.30 3fc3 s TRP 159 Ca 0.26 0.72 -0.00 0.00 0.02 0.00 0.00 56.10 57.09 3fc3 s TRP 159 Cb 0.05 -3.68 -0.04 0.00 -1.15 0.00 0.00 33.47 28.65 3fc3 s TRP 159 CO 0.06 -2.57 0.07 0.96 0.02 0.00 0.00 176.95 175.49 3fc3 s ILE 160 N 3.12 0.20 0.56 2.03 -4.36 -1.12 -4.60 121.20 117.03 3fc3 s ILE 160 Ca 0.64 -1.95 -0.18 0.00 -0.26 0.00 0.00 60.65 58.90 3fc3 s ILE 160 Cb -0.29 -2.19 -0.05 0.00 1.25 0.00 0.00 42.46 41.18 3fc3 s ILE 160 CO 0.24 -0.34 1.07 0.00 0.24 0.00 0.00 174.94 176.15 3fc3 h ASP 162 N 0.88 0.59 0.16 0.00 3.58 -1.08 -1.40 116.42 119.14 3fc3 h ASP 162 Ca -0.48 -0.01 0.00 0.00 0.42 0.00 0.00 57.03 56.95 3fc3 h ASP 162 Cb 1.23 -0.15 -0.01 0.00 1.72 0.00 0.00 39.33 42.13 3fc3 h ASP 162 CO 0.57 0.42 -0.13 -1.28 -2.88 0.00 0.00 179.24 175.95 3fc3 h SER 163 N 0.69 -0.33 -0.39 2.28 0.87 -1.92 -0.79 113.55 113.97 3fc3 h SER 163 Ca 0.19 0.03 -0.01 0.00 -1.23 0.00 0.00 61.79 60.78 3fc3 h SER 163 Cb -0.05 0.11 -0.02 0.00 -0.44 0.00 0.00 62.40 62.00 3fc3 h SER 163 CO -0.04 -0.20 0.22 0.00 -0.53 0.00 0.00 176.83 176.28 3fc3 h ASN 165 N 0.51 0.57 1.58 0.00 -1.24 -1.08 0.16 115.58 116.08 3fc3 h ASN 165 Ca 0.14 0.04 -0.01 0.00 0.71 0.00 0.00 56.30 57.18 3fc3 h ASN 165 Cb 0.03 -0.07 -0.00 0.00 0.73 0.00 0.00 38.32 39.01 3fc3 h ASN 165 CO -0.02 0.35 -0.05 0.71 -1.29 0.00 0.00 177.43 177.13 3fc3 h THR 166 N 0.70 0.09 -0.11 -3.57 1.35 -0.99 -2.77 112.91 107.62 3fc3 h THR 166 Ca 0.33 -0.93 -0.05 0.00 -0.55 0.00 0.00 66.41 65.21 3fc3 h THR 166 Cb 0.25 1.85 -0.00 0.00 -1.73 0.00 0.00 68.15 68.53 3fc3 h THR 166 CO -0.21 0.05 -0.13 1.23 -0.25 0.00 0.00 175.52 176.20 3fc3 h GLY 167 N 3.20 0.31 0.06 5.82 0.00 -0.31 -3.12 103.07 109.04 3fc3 h GLY 167 Ca -0.00 -0.33 0.15 0.00 0.00 0.00 0.00 47.33 47.15 3fc3 h GLY 167 CO 0.01 0.30 0.23 1.41 0.00 0.00 0.00 176.54 178.48 3fc3 h LEU 168 N -0.13 0.14 -1.18 3.11 3.38 -0.79 -2.21 115.31 117.63 3fc3 h LEU 168 Ca 0.01 0.12 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 3fc3 h LEU 168 Cb 0.67 0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.54 3fc3 h LEU 168 CO 0.03 0.03 0.19 1.23 0.09 0.00 0.00 178.44 180.01 3fc3 h GLY 169 N 0.35 0.82 1.87 0.83 0.00 -1.56 -0.70 103.07 104.68 3fc3 h GLY 169 Ca 0.40 -0.42 0.02 0.00 0.00 0.00 0.00 47.33 47.33 3fc3 h GLY 169 CO -0.45 0.40 0.05 3.21 0.00 0.00 0.00 176.54 179.75 3fc3 h ARG 170 N 0.75 0.00 -0.41 4.80 3.08 -1.33 -1.54 114.38 119.73 3fc3 h ARG 170 Ca 0.18 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 60.09 3fc3 h ARG 170 Cb 0.18 0.00 -0.08 0.00 0.08 0.00 0.00 29.97 30.15 3fc3 h ARG 170 CO -0.01 0.00 0.05 1.19 -1.07 0.00 0.00 179.97 180.13 3fc3 n PHE 171 N -4.22 1.35 -1.97 3.04 3.72 -0.69 -4.96 117.46 113.72 3fc3 n PHE 171 Ca -0.02 -1.27 -0.21 0.00 -0.05 0.00 0.00 57.45 55.90 3fc3 n PHE 171 Cb 0.15 -0.48 -0.05 0.00 -0.94 0.00 0.00 39.48 38.16 3fc3 n PHE 171 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 3fc3 n LYS 172 N -0.75 -1.56 -2.90 -1.08 5.02 -0.58 -1.83 118.16 114.48 3fc3 n LYS 172 Ca 0.31 1.13 -0.17 0.00 -2.02 0.00 0.00 58.31 57.56 3fc3 n LYS 172 Cb 1.07 -5.65 -0.00 0.00 -0.02 0.00 0.00 35.03 30.43 3fc3 n LYS 172 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3fc3 n ASP 173 N -1.67 -3.85 -4.05 4.39 9.92 -0.35 -4.95 116.55 116.00 3fc3 n ASP 173 Ca -0.23 -0.09 -0.31 0.00 -0.53 0.00 0.00 54.79 53.63 3fc3 n ASP 173 Cb 0.69 -3.22 -0.16 0.00 -0.64 0.00 0.00 41.12 37.79 3fc3 n ASP 173 CO 0.00 0.00 0.00 0.21 0.13 0.00 0.00 177.20 177.54 3fc3 s ASN 174 N -2.38 3.37 0.59 -2.24 3.84 -0.76 -5.01 114.94 112.35 3fc3 s ASN 174 Ca 0.20 -0.83 0.29 0.00 0.21 0.00 0.00 52.86 52.72 3fc3 s ASN 174 Cb -0.10 -1.34 1.55 0.00 -0.55 0.00 0.00 41.25 40.80 3fc3 s ASN 174 CO 0.25 -0.10 1.97 -0.65 -2.79 0.00 0.00 177.10 175.78 3fc3 h PRO 175 N 7.95 0.00 -0.28 0.43 0.11 -1.92 -1.80 132.00 136.49 3fc3 h PRO 175 Ca -0.33 0.00 0.05 0.00 0.11 0.00 0.00 66.00 65.83 3fc3 h PRO 175 Cb 1.11 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.17 3fc3 h PRO 175 CO 0.53 0.00 -0.05 -0.22 -0.21 0.00 0.00 178.00 178.05 3fc3 h LYS 176 N 0.00 0.03 -0.00 1.05 3.64 -1.95 0.45 116.57 119.79 3fc3 h LYS 176 Ca 0.16 -0.00 -0.17 0.00 -1.27 0.00 0.00 60.65 59.37 3fc3 h LYS 176 Cb 0.90 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.70 3fc3 h LYS 176 CO -0.00 0.02 -0.80 0.74 -2.27 0.00 0.00 179.45 177.13 3fc3 h PHE 177 N 0.03 0.04 -0.60 1.91 0.04 -1.59 -2.17 116.94 114.60 3fc3 h PHE 177 Ca 0.13 -0.02 -0.07 0.00 2.80 0.00 0.00 57.97 60.81 3fc3 h PHE 177 Cb 0.19 -0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.31 3fc3 h PHE 177 CO -0.25 0.81 0.09 -0.07 -0.60 0.00 0.00 178.31 178.30 3fc3 h LEU 178 N 0.01 0.92 -0.86 1.54 3.38 -1.27 -1.05 115.31 117.99 3fc3 h LEU 178 Ca -0.01 -0.21 -0.08 0.00 0.09 0.00 0.00 57.88 57.67 3fc3 h LEU 178 Cb 1.41 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.90 3fc3 h LEU 178 CO 0.11 0.93 -0.02 -0.33 0.09 0.00 0.00 178.44 179.21 3fc3 h GLU 179 N 0.92 0.83 -0.92 1.13 4.39 -0.75 -1.58 114.58 118.59 3fc3 h GLU 179 Ca 0.19 -0.24 -0.00 0.00 0.34 0.00 0.00 59.36 59.65 3fc3 h GLU 179 Cb 0.40 -0.09 -0.04 0.00 -0.10 0.00 0.00 28.75 28.92 3fc3 h GLU 179 CO 0.01 0.84 0.57 0.87 -1.16 0.00 0.00 179.01 180.15 3fc3 h LYS 180 N 0.76 1.24 -0.44 2.33 1.57 -1.04 -1.62 116.57 119.38 3fc3 h LYS 180 Ca 0.14 -0.10 -0.00 0.00 -1.87 0.00 0.00 60.65 58.82 3fc3 h LYS 180 Cb 0.50 -0.27 -0.02 0.00 0.08 0.00 0.00 32.23 32.52 3fc3 h LYS 180 CO 0.02 0.85 0.26 0.28 -0.57 0.00 0.00 179.45 180.30 3fc3 h VAL 181 N 1.26 1.14 -0.29 0.50 2.07 -0.80 -1.03 116.25 119.10 3fc3 h VAL 181 Ca 0.33 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 67.52 3fc3 h VAL 181 Cb -0.08 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 30.25 3fc3 h VAL 181 CO -0.07 0.14 0.19 0.40 0.02 0.00 0.00 177.57 178.26 3fc3 h ILE 182 N 0.58 1.07 -0.73 4.57 2.04 -0.99 -0.38 117.51 123.67 3fc3 h ILE 182 Ca 0.16 -0.14 -0.05 0.00 1.00 0.00 0.00 64.86 65.83 3fc3 h ILE 182 Cb 0.01 0.64 -0.03 0.00 -0.74 0.00 0.00 36.82 36.70 3fc3 h ILE 182 CO -0.03 0.07 0.25 -0.33 0.00 0.00 0.00 178.15 178.11 3fc3 h GLU 183 N 0.39 1.13 -0.16 2.37 4.39 -1.20 -0.82 114.58 120.68 3fc3 h GLU 183 Ca 0.11 -0.23 0.00 0.00 0.34 0.00 0.00 59.36 59.57 3fc3 h GLU 183 Cb -0.04 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 28.43 3fc3 h GLU 183 CO -0.03 0.95 0.10 -0.92 -1.16 0.00 0.00 179.01 177.96 3fc3 h TYR 184 N 1.08 0.21 -0.48 4.33 3.20 -0.86 -1.45 116.97 123.00 3fc3 h TYR 184 Ca 0.24 0.00 -0.05 0.00 3.14 0.00 0.00 58.73 62.06 3fc3 h TYR 184 Cb 0.28 -0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.46 3fc3 h TYR 184 CO 0.02 0.16 0.10 -0.07 -1.64 0.00 0.00 178.16 176.73 3fc3 h LEU 185 N 0.21 0.75 -1.34 2.82 3.38 -0.91 -3.06 115.31 117.16 3fc3 h LEU 185 Ca 0.06 -0.25 -0.04 0.00 0.09 0.00 0.00 57.88 57.74 3fc3 h LEU 185 Cb 0.00 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 3fc3 h LEU 185 CO -0.01 0.80 0.00 0.11 0.09 0.00 0.00 178.44 179.43 3fc3 h LYS 186 N 0.66 0.44 -0.33 1.13 1.57 -1.07 -1.36 116.57 117.62 3fc3 h LYS 186 Ca 0.15 -0.08 0.05 0.00 -1.87 0.00 0.00 60.65 58.89 3fc3 h LYS 186 Cb 0.36 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.58 3fc3 h LYS 186 CO 0.01 0.47 0.22 -0.22 -0.57 0.00 0.00 179.45 179.36 3fc3 h LYS 187 N 0.43 0.24 -0.21 3.15 3.64 -1.15 -3.00 116.57 119.66 3fc3 h LYS 187 Ca 0.10 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 3fc3 h LYS 187 Cb 0.28 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.04 3fc3 h LYS 187 CO 0.01 0.16 0.00 0.66 -2.27 0.00 0.00 179.45 178.01 3fc3 n TYR 188 N -4.48 0.28 0.00 1.91 4.01 -0.84 -5.12 117.16 112.92 3fc3 n TYR 188 Ca 0.03 -0.48 0.00 0.00 -0.16 0.00 0.00 57.90 57.30 3fc3 n TYR 188 Cb 0.22 -0.03 0.00 0.00 -0.31 0.00 0.00 39.34 39.22 3fc3 n TYR 188 CO 0.00 0.00 0.00 -1.91 -0.46 0.00 0.00 176.86 174.49