#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fnt s PHE -8 N 0.00 3.19 -0.44 3.69 5.36 -1.26 -5.07 117.98 123.45 1fnt s PHE -8 Ca 0.00 -0.07 -0.13 0.00 -0.96 0.00 0.00 56.93 55.77 1fnt s PHE -8 Cb 0.00 -2.10 0.07 0.00 -0.34 0.00 0.00 43.02 40.64 1fnt s PHE -8 CO 0.00 0.02 0.33 1.21 -1.46 0.00 0.00 175.22 175.32 1fnt s ASN -7 N 0.65 5.97 0.00 6.13 3.04 -1.26 -4.97 114.94 124.51 1fnt s ASN -7 Ca 0.03 -1.31 0.18 0.00 0.04 0.00 0.00 52.86 51.80 1fnt s ASN -7 Cb -0.13 -2.11 1.10 0.00 -1.54 0.00 0.00 41.25 38.56 1fnt s ASN -7 CO 0.02 -0.58 1.58 -0.81 -3.04 0.00 0.00 177.10 174.27 1fnt n PRO -6 N 5.10 0.81 -4.47 0.43 -0.04 -1.26 -4.88 135.00 130.69 1fnt n PRO -6 Ca -0.12 0.00 -0.23 0.00 -0.04 0.00 0.00 63.50 63.12 1fnt n PRO -6 Cb 0.44 -1.36 -0.10 0.00 -0.04 0.00 0.00 33.50 32.44 1fnt n PRO -6 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1fnt s TYR -5 N -2.00 2.09 -0.00 0.54 2.02 -1.26 -5.11 117.35 113.62 1fnt s TYR -5 Ca 0.28 -0.66 -0.28 0.00 -0.37 0.00 0.00 57.07 56.03 1fnt s TYR -5 Cb 0.13 -1.22 0.10 0.00 -0.40 0.00 0.00 41.96 40.57 1fnt s TYR -5 CO 0.21 0.35 0.83 0.20 -1.57 0.00 0.00 175.55 175.57 1fnt s GLY -4 N -3.50 -0.47 -0.13 0.71 0.00 -1.26 -5.16 107.32 97.50 1fnt s GLY -4 Ca 0.31 1.10 0.01 0.00 0.00 0.00 0.00 44.72 46.14 1fnt s GLY -4 CO 0.13 0.47 -0.16 -0.35 0.00 0.00 0.00 173.10 173.19 1fnt s ASP -3 N -2.19 3.66 -0.32 1.64 2.15 -1.26 -4.16 116.67 116.19 1fnt s ASP -3 Ca 0.02 -0.44 0.08 0.00 0.43 0.00 0.00 52.55 52.63 1fnt s ASP -3 Cb -0.01 -1.55 0.49 0.00 -0.30 0.00 0.00 42.92 41.56 1fnt s ASP -3 CO -0.06 0.13 1.46 0.59 -0.17 0.00 0.00 175.17 177.12 1fnt n ASN -2 N 3.76 3.18 0.00 -0.34 4.13 -0.92 -4.58 115.26 120.48 1fnt n ASN -2 Ca -0.19 -3.80 0.00 0.00 1.68 0.00 0.00 54.58 52.27 1fnt n ASN -2 Cb 0.52 -0.62 0.00 0.00 -1.54 0.00 0.00 39.78 38.15 1fnt n ASN -2 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1fnt n GLY -1 N -1.05 3.48 0.37 7.41 0.00 -1.26 -3.54 105.19 110.60 1fnt n GLY -1 Ca 0.37 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.33 1fnt n GLY -1 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fnt n GLY 1 N 0.00 -3.08 3.21 -0.02 0.00 -1.26 -4.32 105.19 99.73 1fnt n GLY 1 Ca 0.00 -1.20 -0.11 0.00 0.00 0.00 0.00 46.02 44.71 1fnt n GLY 1 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1fnt s THR 2 N -4.27 -0.03 0.42 2.61 2.01 -1.26 -1.58 115.64 113.54 1fnt s THR 2 Ca 0.00 0.10 0.05 0.00 0.31 0.00 0.00 61.69 62.15 1fnt s THR 2 Cb 0.00 -0.54 -0.06 0.00 0.01 0.00 0.00 72.50 71.91 1fnt s THR 2 CO 0.00 0.04 0.02 0.27 -0.69 0.00 0.00 174.62 174.27 1fnt s ILE 3 N 1.32 1.57 -0.26 1.82 -5.25 -0.37 -2.99 121.20 117.04 1fnt s ILE 3 Ca -0.09 -2.00 -0.22 0.00 -0.99 0.00 0.00 60.65 57.35 1fnt s ILE 3 Cb -0.09 -2.73 0.07 0.00 2.95 0.00 0.00 42.46 42.66 1fnt s ILE 3 CO -0.11 0.00 0.69 -0.22 -1.79 0.00 0.00 174.94 173.51 1fnt s LEU 4 N -3.70 -0.70 -0.05 0.37 2.96 0.33 -2.63 118.68 115.26 1fnt s LEU 4 Ca 0.28 1.41 0.01 0.00 -0.22 0.00 0.00 54.13 55.61 1fnt s LEU 4 Cb 0.07 2.36 0.02 0.00 0.50 0.00 0.00 46.19 49.15 1fnt s LEU 4 CO 0.14 -0.24 -0.04 -0.83 -1.32 0.00 0.00 176.35 174.06 1fnt s GLY 5 N 0.65 0.48 -0.04 7.98 0.00 -0.33 -0.71 107.32 115.35 1fnt s GLY 5 Ca -0.02 -0.10 0.04 0.00 0.00 0.00 0.00 44.72 44.64 1fnt s GLY 5 CO -0.04 0.54 -0.16 -0.42 0.00 0.00 0.00 173.10 173.02 1fnt s ILE 6 N 1.08 1.37 -0.69 0.90 1.09 -1.06 -0.01 121.20 123.88 1fnt s ILE 6 Ca -0.08 -0.68 -0.15 0.00 -1.10 0.00 0.00 60.65 58.63 1fnt s ILE 6 Cb -0.14 -1.18 0.17 0.00 -1.06 0.00 0.00 42.46 40.25 1fnt s ILE 6 CO -0.01 0.40 0.66 0.00 -0.10 0.00 0.00 174.94 175.89 1fnt s ALA 7 N 0.05 3.82 0.57 9.38 0.00 0.78 -1.62 121.76 134.74 1fnt s ALA 7 Ca -0.04 -2.88 -0.17 0.00 0.00 0.00 0.00 51.96 48.87 1fnt s ALA 7 Cb -0.11 -3.43 -0.05 0.00 0.00 0.00 0.00 23.12 19.53 1fnt s ALA 7 CO 0.02 -2.20 1.06 0.20 0.00 0.00 0.00 175.76 174.84 1fnt s GLY 8 N 2.95 2.25 0.20 0.00 0.00 -1.05 -4.90 107.32 106.76 1fnt s GLY 8 Ca 0.12 0.48 -0.09 0.00 0.00 0.00 0.00 44.72 45.23 1fnt s GLY 8 CO -0.03 0.81 1.19 -2.21 0.00 0.00 0.00 173.10 172.85 1fnt n GLU 9 N -1.75 -0.11 -1.07 2.90 0.00 -1.26 -2.35 120.64 116.99 1fnt n GLU 9 Ca 0.09 1.18 0.04 0.00 0.00 0.00 0.00 57.16 58.47 1fnt n GLU 9 Cb 0.53 -1.76 0.05 0.00 0.00 0.00 0.00 31.44 30.26 1fnt n GLU 9 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.13 176.73 1fnt n ASP 10 N -5.20 0.98 -0.78 4.31 3.85 -1.26 -2.51 116.55 115.93 1fnt n ASP 10 Ca 0.11 -2.35 0.00 0.00 -0.71 0.00 0.00 54.79 51.83 1fnt n ASP 10 Cb 0.35 -0.32 0.00 0.00 -1.35 0.00 0.00 41.12 39.80 1fnt n ASP 10 CO 0.00 0.00 0.00 2.22 -1.01 0.00 0.00 177.20 178.41 1fnt n PHE 11 N 0.04 -0.40 -3.63 2.11 -1.74 -0.99 -4.66 117.46 108.19 1fnt n PHE 11 Ca 0.07 0.00 -0.09 0.00 -0.56 0.00 0.00 57.45 56.88 1fnt n PHE 11 Cb 0.96 0.00 -0.07 0.00 1.52 0.00 0.00 39.48 41.89 1fnt n PHE 11 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1fnt s ALA 12 N -1.48 -2.00 0.03 1.98 0.00 -0.83 -2.54 121.76 116.92 1fnt s ALA 12 Ca 0.00 1.79 0.06 0.00 0.00 0.00 0.00 51.96 53.81 1fnt s ALA 12 Cb 0.00 -1.33 -0.02 0.00 0.00 0.00 0.00 23.12 21.76 1fnt s ALA 12 CO 0.00 -0.23 -0.18 0.14 0.00 0.00 0.00 175.76 175.48 1fnt s VAL 13 N -0.10 1.45 -0.30 0.00 -7.23 -0.64 -0.58 120.40 113.00 1fnt s VAL 13 Ca 0.03 -1.06 -0.02 0.00 -1.81 0.00 0.00 61.98 59.12 1fnt s VAL 13 Cb -0.04 -1.27 0.10 0.00 0.56 0.00 0.00 36.38 35.73 1fnt s VAL 13 CO -0.06 0.18 0.10 -0.22 -0.31 0.00 0.00 175.10 174.79 1fnt s LEU 14 N -1.03 1.77 0.21 1.32 0.20 -0.49 -2.55 118.68 118.10 1fnt s LEU 14 Ca 0.06 -1.52 0.08 0.00 0.69 0.00 0.00 54.13 53.44 1fnt s LEU 14 Cb -0.08 -0.72 -0.04 0.00 -0.43 0.00 0.00 46.19 44.91 1fnt s LEU 14 CO 0.01 -0.42 -0.00 0.00 -0.29 0.00 0.00 176.35 175.65 1fnt s ALA 15 N 1.75 3.18 -0.30 5.97 0.00 0.11 -1.78 121.76 130.69 1fnt s ALA 15 Ca 0.09 -1.48 -0.16 0.00 0.00 0.00 0.00 51.96 50.41 1fnt s ALA 15 Cb -0.17 -0.91 0.21 0.00 0.00 0.00 0.00 23.12 22.25 1fnt s ALA 15 CO -0.28 0.40 1.27 0.20 0.00 0.00 0.00 175.76 177.35 1fnt s GLY 16 N -3.22 0.62 1.19 0.00 0.00 -1.14 0.12 107.32 104.89 1fnt s GLY 16 Ca 0.29 3.83 -0.17 0.00 0.00 0.00 0.00 44.72 48.66 1fnt s GLY 16 CO 0.19 2.73 0.47 2.09 0.00 0.00 0.00 173.10 178.57 1fnt n ASP 17 N 3.01 -2.69 -0.68 1.64 5.75 -1.16 -3.32 116.55 119.10 1fnt n ASP 17 Ca -0.17 -0.33 0.06 0.00 -0.01 0.00 0.00 54.79 54.34 1fnt n ASP 17 Cb 0.56 -1.00 0.18 0.00 -1.03 0.00 0.00 41.12 39.83 1fnt n ASP 17 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 1fnt n THR 18 N -4.85 1.39 -2.29 2.12 -2.24 -0.87 -4.55 114.28 102.98 1fnt n THR 18 Ca 0.04 -1.27 -0.30 0.00 -2.27 0.00 0.00 64.05 60.24 1fnt n THR 18 Cb 0.55 0.27 -0.01 0.00 -2.10 0.00 0.00 70.33 69.04 1fnt n THR 18 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1fnt s ARG 19 N -1.56 3.70 -0.10 -0.78 3.52 -1.26 -1.70 118.95 120.78 1fnt s ARG 19 Ca 0.28 0.65 -0.04 0.00 -0.13 0.00 0.00 55.73 56.49 1fnt s ARG 19 Cb 0.18 -2.20 0.05 0.00 -1.56 0.00 0.00 34.95 31.42 1fnt s ARG 19 CO 0.13 -0.35 0.20 1.21 -0.81 0.00 0.00 175.30 175.68 1fnt s ASN 20 N -3.74 0.19 0.31 -2.12 3.84 -1.21 -4.65 114.94 107.56 1fnt s ASN 20 Ca 0.54 0.43 0.05 0.00 0.21 0.00 0.00 52.86 54.09 1fnt s ASN 20 Cb -0.10 0.39 -0.06 0.00 -0.55 0.00 0.00 41.25 40.92 1fnt s ASN 20 CO 0.43 -0.20 0.02 0.27 -2.79 0.00 0.00 177.10 174.83 1fnt s ILE 21 N 1.79 1.31 -0.24 -5.21 -5.25 -1.23 -1.46 121.20 110.90 1fnt s ILE 21 Ca -0.03 -2.03 -0.08 0.00 -0.99 0.00 0.00 60.65 57.52 1fnt s ILE 21 Cb -0.11 -2.67 0.11 0.00 2.95 0.00 0.00 42.46 42.74 1fnt s ILE 21 CO -0.07 -0.11 0.52 -0.89 -1.79 0.00 0.00 174.94 172.59 1fnt s THR 22 N -3.22 -0.80 0.00 8.37 2.01 -1.19 -4.26 115.64 116.55 1fnt s THR 22 Ca 0.34 0.09 0.00 0.00 0.31 0.00 0.00 61.69 62.42 1fnt s THR 22 Cb 0.07 -0.82 0.00 0.00 0.01 0.00 0.00 72.50 71.76 1fnt s THR 22 CO 0.14 0.03 0.00 0.47 -0.69 0.00 0.00 174.62 174.57 1fnt n ASP 23 N 5.42 0.00 -0.71 3.53 9.92 -1.26 -0.34 116.55 133.10 1fnt n ASP 23 Ca -0.09 0.00 0.07 0.00 -0.53 0.00 0.00 54.79 54.23 1fnt n ASP 23 Cb 0.49 0.00 0.15 0.00 -0.64 0.00 0.00 41.12 41.12 1fnt n ASP 23 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 1fnt n TYR 24 N 12.28 0.40 -2.92 1.24 4.01 -1.26 -5.02 117.16 125.90 1fnt n TYR 24 Ca 0.00 -0.36 -0.19 0.00 -0.16 0.00 0.00 57.90 57.19 1fnt n TYR 24 Cb 0.00 -0.02 0.05 0.00 -0.31 0.00 0.00 39.34 39.06 1fnt n TYR 24 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 1fnt s SER 25 N -1.04 5.23 0.14 7.72 0.01 0.54 -5.13 113.70 121.16 1fnt s SER 25 Ca 0.25 -0.53 0.06 0.00 1.31 0.00 0.00 55.95 57.05 1fnt s SER 25 Cb 0.14 -0.23 -0.04 0.00 0.21 0.00 0.00 66.02 66.09 1fnt s SER 25 CO 0.19 -1.18 -0.01 -0.63 0.41 0.00 0.00 173.24 172.02 1fnt s ILE 26 N -2.63 3.80 -0.01 1.44 -1.09 -1.26 -3.16 121.20 118.28 1fnt s ILE 26 Ca 0.59 -1.26 -0.00 0.00 -2.23 0.00 0.00 60.65 57.75 1fnt s ILE 26 Cb -0.08 -2.86 -0.01 0.00 -1.58 0.00 0.00 42.46 37.93 1fnt s ILE 26 CO 0.37 -0.01 -0.02 0.59 -1.23 0.00 0.00 174.94 174.65 1fnt n ASN 27 N 0.18 1.19 -3.65 3.58 3.02 -0.53 -4.90 115.26 114.14 1fnt n ASN 27 Ca -0.10 0.01 -0.10 0.00 -0.03 0.00 0.00 54.58 54.36 1fnt n ASN 27 Cb 0.54 -0.03 -0.08 0.00 -0.61 0.00 0.00 39.78 39.59 1fnt n ASN 27 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1fnt s SER 28 N -4.84 -0.79 0.28 6.41 0.15 -1.25 -5.03 113.70 108.64 1fnt s SER 28 Ca -0.02 1.34 -0.01 0.00 0.70 0.00 0.00 55.95 57.96 1fnt s SER 28 Cb 0.01 1.25 0.39 0.00 -1.71 0.00 0.00 66.02 65.96 1fnt s SER 28 CO 0.03 -0.23 1.81 0.03 1.20 0.00 0.00 173.24 176.08 1fnt h ARG 29 N 6.49 0.80 -4.72 5.44 2.47 -1.91 -3.20 114.38 119.73 1fnt h ARG 29 Ca -0.31 -0.18 -0.62 0.00 -1.26 0.00 0.00 59.98 57.61 1fnt h ARG 29 Cb 1.20 -0.11 -0.36 0.00 -1.65 0.00 0.00 29.97 29.05 1fnt h ARG 29 CO 0.17 0.75 -0.83 -0.47 0.56 0.00 0.00 179.97 180.15 1fnt s TYR 30 N -5.12 2.40 -0.29 3.04 5.04 -1.25 -4.18 117.35 116.99 1fnt s TYR 30 Ca -0.09 -1.45 0.04 0.00 -2.44 0.00 0.00 57.07 53.12 1fnt s TYR 30 Cb 0.15 -1.68 0.18 0.00 0.35 0.00 0.00 41.96 40.96 1fnt s TYR 30 CO 0.80 -0.73 0.52 -2.00 -1.34 0.00 0.00 175.55 172.80 1fnt s GLU 31 N 1.41 0.50 0.18 4.97 2.56 -0.69 -5.04 118.70 122.59 1fnt s GLU 31 Ca 0.03 0.44 -0.31 0.00 0.00 0.00 0.00 54.97 55.12 1fnt s GLU 31 Cb -0.14 0.05 -0.10 0.00 2.00 0.00 0.00 34.13 35.93 1fnt s GLU 31 CO -0.10 -0.99 1.57 -1.25 -0.56 0.00 0.00 175.26 173.93 1fnt s PRO 32 N 2.72 4.21 -0.00 4.30 0.04 -1.26 -4.57 135.00 140.43 1fnt s PRO 32 Ca 0.11 2.38 0.11 0.00 0.04 0.00 0.00 61.00 63.64 1fnt s PRO 32 Cb -0.12 -3.14 -0.13 0.00 0.04 0.00 0.00 34.50 31.15 1fnt s PRO 32 CO -0.27 -0.61 0.40 1.63 0.04 0.00 0.00 177.00 178.20 1fnt n LYS 33 N 3.84 2.65 -3.99 4.56 5.02 -1.26 -5.00 118.16 123.98 1fnt n LYS 33 Ca 0.13 -0.03 -0.35 0.00 -2.02 0.00 0.00 58.31 56.05 1fnt n LYS 33 Cb 0.38 -1.07 -0.09 0.00 -0.02 0.00 0.00 35.03 34.23 1fnt n LYS 33 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1fnt s VAL 34 N -2.21 4.84 0.09 -0.18 1.01 -1.26 -4.15 120.40 118.55 1fnt s VAL 34 Ca 0.02 -0.02 0.02 0.00 0.00 0.00 0.00 61.98 62.00 1fnt s VAL 34 Cb 0.08 -3.18 -0.04 0.00 0.00 0.00 0.00 36.38 33.24 1fnt s VAL 34 CO 0.45 0.47 -0.07 -0.36 0.00 0.00 0.00 175.10 175.58 1fnt s PHE 35 N 0.31 0.90 0.06 5.22 0.08 0.34 -4.96 117.98 119.93 1fnt s PHE 35 Ca 0.04 -0.84 -0.12 0.00 0.12 0.00 0.00 56.93 56.13 1fnt s PHE 35 Cb -0.12 -0.51 -0.06 0.00 -0.57 0.00 0.00 43.02 41.76 1fnt s PHE 35 CO 0.00 -0.12 0.43 0.34 -0.10 0.00 0.00 175.22 175.77 1fnt s ASP 36 N -2.83 6.73 -0.04 1.36 -1.08 -1.26 -0.66 116.67 118.89 1fnt s ASP 36 Ca 0.09 0.90 0.07 0.00 -0.52 0.00 0.00 52.55 53.08 1fnt s ASP 36 Cb 0.03 -2.22 0.10 0.00 -1.46 0.00 0.00 42.92 39.37 1fnt s ASP 36 CO -0.03 0.21 0.98 0.00 0.52 0.00 0.00 175.17 176.85 1fnt n GLY 38 N -0.68 -2.65 3.34 0.00 0.00 -1.26 -4.94 105.19 99.01 1fnt n GLY 38 Ca 0.06 -1.78 -0.19 0.00 0.00 0.00 0.00 46.02 44.11 1fnt n GLY 38 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1fnt n ASP 39 N -0.04 -1.74 -3.70 1.61 9.92 -1.26 -1.49 116.55 119.86 1fnt n ASP 39 Ca 0.00 -0.25 -0.30 0.00 -0.53 0.00 0.00 54.79 53.71 1fnt n ASP 39 Cb 0.00 -1.55 0.03 0.00 -0.64 0.00 0.00 41.12 38.96 1fnt n ASP 39 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 1fnt n ASN 40 N -1.95 -5.33 -3.67 -2.24 4.05 -1.26 -4.88 115.26 99.97 1fnt n ASN 40 Ca 0.04 -0.96 -0.13 0.00 0.45 0.00 0.00 54.58 53.98 1fnt n ASN 40 Cb 0.49 -3.04 -0.13 0.00 1.23 0.00 0.00 39.78 38.34 1fnt n ASN 40 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 1fnt s ILE 41 N -3.35 -0.36 0.03 -1.44 1.01 -0.55 -4.55 121.20 111.98 1fnt s ILE 41 Ca 0.36 0.24 0.00 0.00 0.00 0.00 0.00 60.65 61.25 1fnt s ILE 41 Cb -0.14 -0.47 -0.04 0.00 0.01 0.00 0.00 42.46 41.82 1fnt s ILE 41 CO 0.87 0.10 0.11 0.68 0.00 0.00 0.00 174.94 176.70 1fnt s VAL 42 N 2.20 4.84 0.16 2.92 -7.23 -0.91 -1.71 120.40 120.67 1fnt s VAL 42 Ca -0.01 -0.49 0.01 0.00 -1.81 0.00 0.00 61.98 59.67 1fnt s VAL 42 Cb -0.12 -3.28 -0.04 0.00 0.56 0.00 0.00 36.38 33.50 1fnt s VAL 42 CO -0.09 0.25 0.02 -0.32 -0.31 0.00 0.00 175.10 174.65 1fnt s MET 43 N -2.08 1.05 -0.29 4.82 1.75 0.17 -2.29 119.30 122.43 1fnt s MET 43 Ca 0.27 -1.50 -0.22 0.00 -1.25 0.00 0.00 55.69 52.99 1fnt s MET 43 Cb -0.12 -0.07 0.14 0.00 2.84 0.00 0.00 34.83 37.62 1fnt s MET 43 CO 0.19 -0.18 1.09 0.45 -0.65 0.00 0.00 175.02 175.91 1fnt s SER 44 N -3.13 -0.39 -0.15 1.11 0.15 -0.88 -0.50 113.70 109.91 1fnt s SER 44 Ca 0.24 0.70 -0.02 0.00 0.70 0.00 0.00 55.95 57.57 1fnt s SER 44 Cb 0.07 0.88 0.05 0.00 -1.71 0.00 0.00 66.02 65.30 1fnt s SER 44 CO 0.03 -0.12 0.01 0.00 1.20 0.00 0.00 173.24 174.36 1fnt s ALA 45 N 0.60 1.02 -0.08 5.45 0.00 -1.26 -0.79 121.76 126.71 1fnt s ALA 45 Ca -0.01 -0.57 -0.00 0.00 0.00 0.00 0.00 51.96 51.38 1fnt s ALA 45 Cb -0.04 -1.05 -0.03 0.00 0.00 0.00 0.00 23.12 22.00 1fnt s ALA 45 CO -0.11 -0.89 -0.04 1.21 0.00 0.00 0.00 175.76 175.93 1fnt s ASN 46 N 1.84 4.92 0.00 0.00 3.84 0.20 -4.72 114.94 121.02 1fnt s ASN 46 Ca 0.01 0.05 0.00 0.00 0.21 0.00 0.00 52.86 53.13 1fnt s ASN 46 Cb -0.15 -1.31 0.00 0.00 -0.55 0.00 0.00 41.25 39.23 1fnt s ASN 46 CO -0.07 0.37 0.00 0.61 -2.79 0.00 0.00 177.10 175.22 1fnt n GLY 47 N 2.20 -0.21 2.97 1.21 0.00 -1.26 -0.63 105.19 109.47 1fnt n GLY 47 Ca -0.18 0.14 -0.31 0.00 0.00 0.00 0.00 46.02 45.67 1fnt n GLY 47 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1fnt s PHE 48 N 0.00 2.67 0.00 1.61 5.36 -1.00 -2.17 117.98 124.45 1fnt s PHE 48 Ca 0.00 -1.96 0.00 0.00 -0.96 0.00 0.00 56.93 54.01 1fnt s PHE 48 Cb 0.00 -1.73 0.00 0.00 -0.34 0.00 0.00 43.02 40.95 1fnt s PHE 48 CO 0.00 -0.81 0.72 0.00 -1.46 0.00 0.00 175.22 173.66 1fnt n ALA 49 N 4.59 0.00 -0.34 11.12 0.00 -1.26 -1.08 120.51 133.54 1fnt n ALA 49 Ca -0.12 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.32 1fnt n ALA 49 Cb 0.43 0.36 0.04 0.00 0.00 0.00 0.00 19.45 20.29 1fnt n ALA 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1fnt n ALA 50 N -2.23 -0.08 -0.11 0.00 0.00 -1.26 0.83 120.51 117.66 1fnt n ALA 50 Ca 0.00 0.89 -0.09 0.00 0.00 0.00 0.00 53.44 54.24 1fnt n ALA 50 Cb 0.00 -0.41 -0.02 0.00 0.00 0.00 0.00 19.45 19.02 1fnt n ALA 50 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1fnt h ASP 51 N 0.00 0.44 0.00 0.00 3.32 -1.89 -2.33 116.42 115.96 1fnt h ASP 51 Ca 0.32 -0.12 0.00 0.00 0.02 0.00 0.00 57.03 57.25 1fnt h ASP 51 Cb 0.54 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.98 1fnt h ASP 51 CO -0.88 0.44 0.00 0.61 -1.72 0.00 0.00 179.24 177.68 1fnt n GLY 52 N -0.88 -3.29 0.50 2.75 0.00 0.24 -1.38 105.19 103.13 1fnt n GLY 52 Ca -0.01 0.36 0.30 0.00 0.00 0.00 0.00 46.02 46.67 1fnt n GLY 52 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1fnt h ASP 53 N 0.00 0.00 -0.31 1.61 -0.00 -0.90 0.52 116.42 117.34 1fnt h ASP 53 Ca 0.00 0.00 -0.16 0.00 -0.00 0.00 0.00 57.03 56.87 1fnt h ASP 53 Cb 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 39.33 39.33 1fnt h ASP 53 CO 0.00 0.00 -0.42 0.00 -0.00 0.00 0.00 179.24 178.82 1fnt h ALA 54 N 1.19 0.47 0.24 4.15 0.00 -1.12 -0.70 119.26 123.50 1fnt h ALA 54 Ca 0.45 -0.46 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1fnt h ALA 54 Cb 2.15 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.85 1fnt h ALA 54 CO -0.00 0.59 -0.12 1.25 0.00 0.00 0.00 179.25 180.97 1fnt h LEU 55 N 0.61 -0.28 -0.34 0.00 5.85 0.13 0.24 115.31 121.52 1fnt h LEU 55 Ca 0.04 -0.06 0.07 0.00 0.84 0.00 0.00 57.88 58.76 1fnt h LEU 55 Cb 1.01 0.07 -0.07 0.00 0.37 0.00 0.00 40.66 42.05 1fnt h LEU 55 CO 0.10 -0.11 -0.10 0.58 -0.34 0.00 0.00 178.44 178.56 1fnt h VAL 56 N -0.43 0.62 0.05 1.05 2.07 -1.39 0.63 116.25 118.87 1fnt h VAL 56 Ca -0.03 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.50 1fnt h VAL 56 Cb 0.32 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 30.69 1fnt h VAL 56 CO 0.05 0.00 -0.12 0.50 0.02 0.00 0.00 177.57 178.02 1fnt h LYS 57 N -0.03 -0.22 -0.30 1.57 3.64 -0.99 0.79 116.57 121.04 1fnt h LYS 57 Ca 0.17 0.02 0.05 0.00 -1.27 0.00 0.00 60.65 59.61 1fnt h LYS 57 Cb 0.28 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.13 1fnt h LYS 57 CO -0.37 -0.15 0.20 -0.09 -2.27 0.00 0.00 179.45 176.78 1fnt h ARG 58 N -0.23 0.18 0.03 1.90 2.43 0.20 -2.13 114.38 116.75 1fnt h ARG 58 Ca 0.03 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.18 1fnt h ARG 58 Cb 0.26 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.77 1fnt h ARG 58 CO -0.08 0.12 -0.01 0.35 -1.51 0.00 0.00 179.97 178.83 1fnt h PHE 59 N 0.19 -0.03 -1.08 2.20 3.57 0.18 -2.84 116.94 119.13 1fnt h PHE 59 Ca 0.13 -0.00 0.31 0.00 3.53 0.00 0.00 57.97 61.95 1fnt h PHE 59 Cb 0.29 0.01 -0.04 0.00 2.79 0.00 0.00 35.95 39.00 1fnt h PHE 59 CO -0.00 0.15 1.03 0.87 -2.23 0.00 0.00 178.31 178.13 1fnt h LYS 60 N -1.00 0.00 0.12 1.11 1.57 0.77 1.58 116.57 120.72 1fnt h LYS 60 Ca -0.00 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.61 1fnt h LYS 60 Cb 0.20 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.53 1fnt h LYS 60 CO 0.01 0.00 -0.73 -0.97 -0.57 0.00 0.00 179.45 177.18 1fnt h ASN 61 N 0.00 0.44 0.11 0.86 -0.73 -1.45 -3.05 115.58 111.75 1fnt h ASN 61 Ca 0.52 -0.94 0.00 0.00 1.87 0.00 0.00 56.30 57.74 1fnt h ASN 61 Cb 2.57 -0.14 0.00 0.00 0.27 0.00 0.00 38.32 41.02 1fnt h ASN 61 CO -0.01 1.35 0.00 -1.54 -0.37 0.00 0.00 177.43 176.86 1fnt n SER 62 N -4.17 0.00 -0.09 1.15 3.41 0.53 -1.14 113.62 113.32 1fnt n SER 62 Ca -0.13 0.43 -0.20 0.00 -0.26 0.00 0.00 58.87 58.71 1fnt n SER 62 Cb 0.78 -0.44 -0.12 0.00 -0.26 0.00 0.00 64.21 64.17 1fnt n SER 62 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1fnt h VAL 63 N 0.00 1.18 -0.24 -3.33 2.07 -1.23 -3.25 116.25 111.45 1fnt h VAL 63 Ca 0.00 -2.24 0.06 0.00 0.82 0.00 0.00 66.70 65.34 1fnt h VAL 63 Cb 0.05 2.60 -0.07 0.00 -1.52 0.00 0.00 31.29 32.35 1fnt h VAL 63 CO 0.00 0.43 -0.34 0.50 0.02 0.00 0.00 177.57 178.17 1fnt h LYS 64 N -0.95 -0.34 0.00 1.57 3.64 -1.07 -0.47 116.57 118.96 1fnt h LYS 64 Ca -0.24 0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.16 1fnt h LYS 64 Cb 1.25 0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 33.15 1fnt h LYS 64 CO -0.13 -0.23 -0.00 -1.49 -2.27 0.00 0.00 179.45 175.33 1fnt h TRP 65 N -0.36 0.00 -0.26 1.91 4.06 -1.29 -1.05 115.95 118.98 1fnt h TRP 65 Ca 0.12 0.00 -0.16 0.00 2.06 0.00 0.00 58.89 60.91 1fnt h TRP 65 Cb 0.56 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.71 1fnt h TRP 65 CO -0.47 0.00 -0.49 -0.92 -3.56 0.00 0.00 178.44 173.00 1fnt h TYR 66 N 0.00 0.86 -0.49 0.49 3.20 -1.11 -3.00 116.97 116.92 1fnt h TYR 66 Ca -0.00 -0.28 -0.11 0.00 3.14 0.00 0.00 58.73 61.48 1fnt h TYR 66 Cb 0.11 -0.17 -0.02 0.00 1.54 0.00 0.00 36.73 38.19 1fnt h TYR 66 CO 0.00 1.05 -0.12 0.45 -1.64 0.00 0.00 178.16 177.89 1fnt h HIS 67 N 0.55 1.07 -0.76 -3.82 3.86 -0.95 -2.78 115.15 112.33 1fnt h HIS 67 Ca 0.03 -0.23 0.07 0.00 -1.16 0.00 0.00 60.37 59.08 1fnt h HIS 67 Cb 1.05 -0.26 -0.05 0.00 1.06 0.00 0.00 27.41 29.21 1fnt h HIS 67 CO 0.05 1.03 0.50 0.74 0.86 0.00 0.00 177.93 181.11 1fnt h PHE 68 N 0.81 0.80 -0.00 2.45 0.04 -1.38 -0.77 116.94 118.88 1fnt h PHE 68 Ca 0.12 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.91 1fnt h PHE 68 Cb 0.68 -0.26 0.00 0.00 2.20 0.00 0.00 35.95 38.57 1fnt h PHE 68 CO 0.05 0.41 -0.61 -0.25 -0.60 0.00 0.00 178.31 177.31 1fnt n ASP 69 N -4.49 1.05 -0.72 2.17 8.00 -1.15 -4.43 116.55 116.97 1fnt n ASP 69 Ca 0.12 -0.85 0.04 0.00 0.71 0.00 0.00 54.79 54.81 1fnt n ASP 69 Cb 0.25 0.51 0.07 0.00 -0.02 0.00 0.00 41.12 41.93 1fnt n ASP 69 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1fnt n HIS 70 N -1.06 0.00 -3.22 1.24 8.25 -1.05 -5.04 115.22 114.34 1fnt n HIS 70 Ca 0.07 -0.59 -0.06 0.00 -0.26 0.00 0.00 57.72 56.88 1fnt n HIS 70 Cb 0.36 -0.13 0.00 0.00 1.12 0.00 0.00 29.99 31.34 1fnt n HIS 70 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1fnt n ASN 71 N -0.33 -7.16 -3.84 0.41 5.03 -0.87 -3.25 115.26 105.25 1fnt n ASN 71 Ca 0.08 -0.27 -0.30 0.00 0.87 0.00 0.00 54.58 54.95 1fnt n ASN 71 Cb 0.82 -4.54 -0.06 0.00 -1.02 0.00 0.00 39.78 34.97 1fnt n ASN 71 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 1fnt n ASP 72 N -1.98 -0.85 -4.77 6.41 9.92 -0.35 -4.86 116.55 120.08 1fnt n ASP 72 Ca -0.07 -0.96 -0.39 0.00 -0.53 0.00 0.00 54.79 52.84 1fnt n ASP 72 Cb 0.54 -1.22 -0.03 0.00 -0.64 0.00 0.00 41.12 39.78 1fnt n ASP 72 CO 0.00 0.00 0.00 -0.75 0.13 0.00 0.00 177.20 176.58 1fnt s LYS 73 N -5.91 4.31 0.42 -1.24 2.20 -1.20 -4.99 119.74 113.32 1fnt s LYS 73 Ca 0.48 1.87 -0.23 0.00 -0.36 0.00 0.00 55.97 57.72 1fnt s LYS 73 Cb -0.28 -2.90 -0.09 0.00 -1.51 0.00 0.00 37.83 33.05 1fnt s LYS 73 CO 0.78 -0.11 1.04 0.21 -0.36 0.00 0.00 175.35 176.91 1fnt s LYS 74 N -1.95 4.09 -0.50 4.03 2.20 -1.26 -4.72 119.74 121.63 1fnt s LYS 74 Ca 0.52 1.45 -0.24 0.00 -0.36 0.00 0.00 55.97 57.33 1fnt s LYS 74 Cb -0.32 -2.42 0.03 0.00 -1.51 0.00 0.00 37.83 33.61 1fnt s LYS 74 CO 0.41 -0.20 0.91 -1.17 -0.36 0.00 0.00 175.35 174.94 1fnt s LEU 75 N -2.86 4.10 0.25 5.43 2.96 -1.26 -5.02 118.68 122.28 1fnt s LEU 75 Ca 0.60 -0.15 -0.30 0.00 -0.22 0.00 0.00 54.13 54.06 1fnt s LEU 75 Cb -0.20 -2.98 -0.10 0.00 0.50 0.00 0.00 46.19 43.41 1fnt s LEU 75 CO 0.25 -1.11 1.50 -0.94 -1.32 0.00 0.00 176.35 174.73 1fnt s SER 76 N 2.52 6.56 0.29 3.68 1.04 -1.26 -4.82 113.70 121.71 1fnt s SER 76 Ca 0.33 2.74 0.03 0.00 0.48 0.00 0.00 55.95 59.53 1fnt s SER 76 Cb -0.12 -2.62 0.72 0.00 0.10 0.00 0.00 66.02 64.10 1fnt s SER 76 CO 0.22 -0.78 1.66 -0.29 0.98 0.00 0.00 173.24 175.03 1fnt h ILE 77 N 3.56 0.35 -0.57 -1.02 2.10 -1.94 0.53 117.51 120.52 1fnt h ILE 77 Ca -0.46 -0.09 0.11 0.00 1.08 0.00 0.00 64.86 65.51 1fnt h ILE 77 Cb 1.22 0.08 -0.09 0.00 -1.09 0.00 0.00 36.82 36.94 1fnt h ILE 77 CO 0.80 0.05 0.05 -0.55 -1.08 0.00 0.00 178.15 177.42 1fnt h ASN 78 N 0.25 -0.14 -0.39 2.19 -1.07 -1.89 -1.55 115.58 112.99 1fnt h ASN 78 Ca 0.56 0.13 0.05 0.00 0.07 0.00 0.00 56.30 57.11 1fnt h ASN 78 Cb 1.12 0.20 -0.05 0.00 -2.07 0.00 0.00 38.32 37.52 1fnt h ASN 78 CO -0.62 -0.05 0.10 0.28 0.07 0.00 0.00 177.43 177.21 1fnt h SER 79 N 0.17 0.07 -0.59 6.14 0.02 -0.29 -2.17 113.55 116.90 1fnt h SER 79 Ca 0.30 0.06 0.11 0.00 -0.84 0.00 0.00 61.79 61.42 1fnt h SER 79 Cb 0.46 0.06 -0.09 0.00 0.14 0.00 0.00 62.40 62.97 1fnt h SER 79 CO -0.44 0.07 0.10 0.00 -1.14 0.00 0.00 176.83 175.42 1fnt h ALA 80 N 1.27 0.67 0.10 3.77 0.00 -0.85 -0.05 119.26 124.17 1fnt h ALA 80 Ca 0.18 0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.23 1fnt h ALA 80 Cb 0.20 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1fnt h ALA 80 CO -0.22 -0.33 -0.05 0.00 0.00 0.00 0.00 179.25 178.66 1fnt h ALA 81 N 1.49 -0.13 -0.84 0.00 0.00 -1.00 0.21 119.26 118.99 1fnt h ALA 81 Ca 0.31 -0.06 0.13 0.00 0.00 0.00 0.00 54.91 55.29 1fnt h ALA 81 Cb 0.47 0.05 -0.09 0.00 0.00 0.00 0.00 17.79 18.22 1fnt h ALA 81 CO -0.42 -0.54 0.44 -0.09 0.00 0.00 0.00 179.25 178.65 1fnt h ARG 82 N -0.20 0.64 -0.06 0.00 9.65 -1.04 0.52 114.38 123.89 1fnt h ARG 82 Ca -0.01 -0.04 0.01 0.00 -1.10 0.00 0.00 59.98 58.84 1fnt h ARG 82 Cb 0.16 -0.15 -0.01 0.00 -1.39 0.00 0.00 29.97 28.59 1fnt h ARG 82 CO 0.02 0.43 -0.02 -0.97 2.80 0.00 0.00 179.97 182.23 1fnt h ASN 83 N 0.66 -0.07 -0.69 -3.80 -0.00 0.08 -2.75 115.58 109.02 1fnt h ASN 83 Ca 0.45 0.02 0.07 0.00 -0.00 0.00 0.00 56.30 56.84 1fnt h ASN 83 Cb 0.58 0.04 -0.06 0.00 -0.00 0.00 0.00 38.32 38.88 1fnt h ASN 83 CO -0.33 -0.03 0.37 0.40 -0.00 0.00 0.00 177.43 177.84 1fnt h ILE 84 N -0.01 0.92 -0.74 2.57 2.04 0.98 -2.05 117.51 121.23 1fnt h ILE 84 Ca 0.03 -0.23 0.12 0.00 1.00 0.00 0.00 64.86 65.79 1fnt h ILE 84 Cb 0.05 0.21 -0.13 0.00 -0.74 0.00 0.00 36.82 36.21 1fnt h ILE 84 CO -0.07 0.12 -0.36 -0.61 0.00 0.00 0.00 178.15 177.24 1fnt h GLN 85 N 0.66 -0.10 0.42 2.37 4.15 -0.66 0.25 115.11 122.19 1fnt h GLN 85 Ca 0.32 0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.74 1fnt h GLN 85 Cb 0.26 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 27.95 1fnt h GLN 85 CO -0.21 -0.07 -0.32 0.45 -1.93 0.00 0.00 178.83 176.74 1fnt h HIS 86 N -0.10 -0.86 -0.70 3.99 3.86 -1.33 0.38 115.15 120.39 1fnt h HIS 86 Ca 0.27 -0.00 0.12 0.00 -1.16 0.00 0.00 60.37 59.60 1fnt h HIS 86 Cb 0.57 0.32 -0.13 0.00 1.06 0.00 0.00 27.41 29.24 1fnt h HIS 86 CO -0.72 -0.48 -0.36 -0.07 0.86 0.00 0.00 177.93 177.16 1fnt h LEU 87 N -0.74 -1.26 -0.82 2.43 3.38 -0.66 0.96 115.31 118.60 1fnt h LEU 87 Ca -0.04 0.25 0.01 0.00 0.09 0.00 0.00 57.88 58.19 1fnt h LEU 87 Cb 0.63 0.63 -0.04 0.00 0.09 0.00 0.00 40.66 41.98 1fnt h LEU 87 CO -0.00 -0.30 0.54 0.25 0.09 0.00 0.00 178.44 179.01 1fnt h LEU 88 N -0.12 0.94 -0.61 1.67 6.46 0.00 -1.64 115.31 122.01 1fnt h LEU 88 Ca 0.26 -0.03 0.00 0.00 -0.12 0.00 0.00 57.88 57.99 1fnt h LEU 88 Cb 0.56 -0.23 0.00 0.00 -0.73 0.00 0.00 40.66 40.26 1fnt h LEU 88 CO -0.76 0.68 0.00 0.22 -0.62 0.00 0.00 178.44 177.96 1fnt h TYR 89 N 1.11 0.00 -0.37 1.25 5.03 0.27 -3.09 116.97 121.16 1fnt h TYR 89 Ca 0.30 0.00 0.07 0.00 2.58 0.00 0.00 58.73 61.68 1fnt h TYR 89 Cb -0.13 0.00 -0.06 0.00 1.55 0.00 0.00 36.73 38.09 1fnt h TYR 89 CO -0.01 0.00 -0.00 0.78 -1.32 0.00 0.00 178.16 177.60 1fnt h GLY 90 N 3.19 0.37 -5.44 1.82 0.00 0.18 -1.78 103.07 101.41 1fnt h GLY 90 Ca 0.00 0.04 -0.70 0.00 0.00 0.00 0.00 47.33 46.68 1fnt h GLY 90 CO 0.00 -0.09 1.62 0.28 0.00 0.00 0.00 176.54 178.35 1fnt n LYS 91 N -5.19 4.11 -0.02 4.80 5.02 -1.17 -4.70 118.16 121.02 1fnt n LYS 91 Ca 0.02 -3.41 -0.13 0.00 -2.02 0.00 0.00 58.31 52.77 1fnt n LYS 91 Cb 0.19 -2.47 -0.09 0.00 -0.02 0.00 0.00 35.03 32.65 1fnt n LYS 91 CO 0.00 0.00 0.00 -0.09 -0.52 0.00 0.00 177.40 176.79 1fnt h ARG 92 N 4.05 0.08 -1.28 1.97 9.65 -1.47 -2.17 114.38 125.22 1fnt h ARG 92 Ca 0.59 -0.03 -0.36 0.00 -1.10 0.00 0.00 59.98 59.08 1fnt h ARG 92 Cb 0.39 -0.00 -0.17 0.00 -1.39 0.00 0.00 29.97 28.79 1fnt h ARG 92 CO 1.28 0.47 0.46 1.19 2.80 0.00 0.00 179.97 186.17 1fnt n PHE 93 N -4.83 1.81 0.00 2.20 3.72 -1.26 -3.72 117.46 115.38 1fnt n PHE 93 Ca -0.08 -1.85 0.00 0.00 -0.05 0.00 0.00 57.45 55.48 1fnt n PHE 93 Cb 0.24 -0.91 0.00 0.00 -0.94 0.00 0.00 39.48 37.87 1fnt n PHE 93 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1fnt n PHE 94 N -0.08 0.00 -1.15 1.38 -0.00 -1.23 -5.18 117.46 111.21 1fnt n PHE 94 Ca 0.35 0.00 -0.29 0.00 -0.00 0.00 0.00 57.45 57.51 1fnt n PHE 94 Cb 0.80 0.00 0.21 0.00 -0.00 0.00 0.00 39.48 40.49 1fnt n PHE 94 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.76 175.51 1fnt s PRO 95 N 0.00 -0.51 -0.36 -7.13 0.05 -0.82 -4.70 135.00 121.53 1fnt s PRO 95 Ca 0.00 0.15 -0.19 0.00 0.05 0.00 0.00 61.00 61.01 1fnt s PRO 95 Cb 0.00 -1.66 0.00 0.00 0.05 0.00 0.00 34.50 32.89 1fnt s PRO 95 CO 0.00 -3.28 0.57 0.71 0.05 0.00 0.00 177.00 175.05 1fnt s TYR 96 N -3.02 3.16 -0.88 0.56 2.02 -1.25 -4.96 117.35 112.97 1fnt s TYR 96 Ca 0.69 0.21 -0.12 0.00 -0.37 0.00 0.00 57.07 57.48 1fnt s TYR 96 Cb -0.13 -3.05 -0.09 0.00 -0.40 0.00 0.00 41.96 38.29 1fnt s TYR 96 CO 0.57 -0.61 2.05 0.98 -1.57 0.00 0.00 175.55 176.96 1fnt n TYR 97 N 5.91 1.62 -3.67 2.71 9.36 -1.26 -4.74 117.16 127.09 1fnt n TYR 97 Ca -0.03 -1.94 -0.15 0.00 3.32 0.00 0.00 57.90 59.10 1fnt n TYR 97 Cb 0.49 -1.71 -0.08 0.00 -0.63 0.00 0.00 39.34 37.41 1fnt n TYR 97 CO 0.00 0.00 0.00 0.14 0.22 0.00 0.00 176.86 177.22 1fnt s VAL 98 N 3.99 0.03 -0.27 2.97 -7.23 -1.26 -2.38 120.40 116.24 1fnt s VAL 98 Ca 0.46 -0.21 -0.16 0.00 -1.81 0.00 0.00 61.98 60.27 1fnt s VAL 98 Cb 0.12 -0.75 -0.03 0.00 0.56 0.00 0.00 36.38 36.27 1fnt s VAL 98 CO 0.02 -0.12 0.41 -2.28 -0.31 0.00 0.00 175.10 172.82 1fnt s HIS 99 N -0.89 3.25 0.13 2.82 2.46 0.20 -3.99 115.29 119.27 1fnt s HIS 99 Ca -0.09 0.47 0.09 0.00 0.47 0.00 0.00 55.06 55.99 1fnt s HIS 99 Cb -0.03 -2.61 -0.04 0.00 -0.13 0.00 0.00 32.58 29.77 1fnt s HIS 99 CO 0.05 -0.24 -0.17 -0.08 -2.47 0.00 0.00 174.74 171.84 1fnt s THR 100 N 2.12 2.91 -0.01 0.89 -1.32 -1.24 -0.63 115.64 118.35 1fnt s THR 100 Ca 0.17 -1.52 -0.03 0.00 -1.21 0.00 0.00 61.69 59.09 1fnt s THR 100 Cb -0.16 -2.35 -0.00 0.00 -1.51 0.00 0.00 72.50 68.48 1fnt s THR 100 CO 0.10 0.07 0.07 -0.63 -2.21 0.00 0.00 174.62 172.01 1fnt s ILE 101 N -1.23 0.05 0.15 5.08 1.01 0.03 -0.72 121.20 125.58 1fnt s ILE 101 Ca 0.19 -0.44 0.02 0.00 0.00 0.00 0.00 60.65 60.42 1fnt s ILE 101 Cb -0.10 -0.25 -0.04 0.00 0.01 0.00 0.00 42.46 42.07 1fnt s ILE 101 CO 0.11 -0.24 -0.03 0.27 0.00 0.00 0.00 174.94 175.05 1fnt s ILE 102 N -0.77 0.71 0.01 2.92 -4.36 -0.67 -2.07 121.20 116.97 1fnt s ILE 102 Ca -0.09 -1.97 -0.25 0.00 -0.26 0.00 0.00 60.65 58.09 1fnt s ILE 102 Cb -0.05 -1.95 0.06 0.00 1.25 0.00 0.00 42.46 41.76 1fnt s ILE 102 CO 0.00 -0.63 0.56 0.00 0.24 0.00 0.00 174.94 175.11 1fnt s ALA 103 N -3.63 -1.44 0.00 2.27 0.00 -0.97 -0.74 121.76 117.25 1fnt s ALA 103 Ca 0.19 0.83 0.00 0.00 0.00 0.00 0.00 51.96 52.98 1fnt s ALA 103 Cb 0.06 0.23 0.00 0.00 0.00 0.00 0.00 23.12 23.41 1fnt s ALA 103 CO 0.01 -0.44 0.00 0.41 0.00 0.00 0.00 175.76 175.74 1fnt n GLY 104 N 0.65 -0.73 2.93 0.00 0.00 -0.25 -2.13 105.19 105.66 1fnt n GLY 104 Ca -0.19 0.23 -0.12 0.00 0.00 0.00 0.00 46.02 45.94 1fnt n GLY 104 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1fnt s LEU 105 N 0.00 2.08 0.00 0.99 1.43 -1.26 -1.86 118.68 120.05 1fnt s LEU 105 Ca 0.00 -0.18 -0.05 0.00 -1.03 0.00 0.00 54.13 52.87 1fnt s LEU 105 Cb 0.00 -0.05 0.13 0.00 0.03 0.00 0.00 46.19 46.30 1fnt s LEU 105 CO 0.00 -0.07 0.84 -0.90 0.23 0.00 0.00 176.35 176.45 1fnt n ASP 106 N 2.59 0.62 -0.91 2.29 5.68 -0.60 -4.23 116.55 121.98 1fnt n ASP 106 Ca -0.16 -1.64 0.00 0.00 -0.50 0.00 0.00 54.79 52.49 1fnt n ASP 106 Cb 0.58 -0.59 0.00 0.00 -1.14 0.00 0.00 41.12 39.97 1fnt n ASP 106 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1fnt n GLU 107 N -2.65 0.71 0.00 0.11 1.02 -1.26 -2.23 120.64 116.34 1fnt n GLU 107 Ca 0.12 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.26 1fnt n GLU 107 Cb 0.43 -1.18 0.00 0.00 -0.02 0.00 0.00 31.44 30.67 1fnt n GLU 107 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1fnt n ASP 108 N 0.56 0.00 0.00 1.62 8.00 -1.26 -5.02 116.55 120.44 1fnt n ASP 108 Ca 0.00 -0.06 0.00 0.00 0.71 0.00 0.00 54.79 55.44 1fnt n ASP 108 Cb 0.32 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.42 1fnt n ASP 108 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1fnt n GLY 109 N 0.00 0.60 3.79 0.44 0.00 -0.94 -5.07 105.19 104.00 1fnt n GLY 109 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 1fnt n GLY 109 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fnt s LYS 110 N -0.89 4.46 0.75 1.61 -0.14 -1.26 -4.57 119.74 119.70 1fnt s LYS 110 Ca 0.00 1.12 -0.13 0.00 -1.36 0.00 0.00 55.97 55.60 1fnt s LYS 110 Cb 0.00 -2.95 0.05 0.00 -1.68 0.00 0.00 37.83 33.25 1fnt s LYS 110 CO 0.00 0.40 1.13 0.20 -0.76 0.00 0.00 175.35 176.32 1fnt s GLY 111 N -1.51 2.00 -0.25 -3.33 0.00 -1.05 -1.56 107.32 101.63 1fnt s GLY 111 Ca 0.44 0.56 -0.16 0.00 0.00 0.00 0.00 44.72 45.57 1fnt s GLY 111 CO 0.24 0.94 0.61 0.00 0.00 0.00 0.00 173.10 174.89 1fnt s ALA 112 N -2.45 -1.62 0.21 3.20 0.00 -0.78 -4.77 121.76 115.55 1fnt s ALA 112 Ca 0.67 2.08 0.11 0.00 0.00 0.00 0.00 51.96 54.82 1fnt s ALA 112 Cb -0.22 -1.23 -0.04 0.00 0.00 0.00 0.00 23.12 21.63 1fnt s ALA 112 CO 0.49 -0.34 -0.18 0.08 0.00 0.00 0.00 175.76 175.81 1fnt s VAL 113 N 1.30 2.65 -0.06 0.00 1.01 -1.10 -1.09 120.40 123.10 1fnt s VAL 113 Ca -0.08 -2.01 -0.03 0.00 0.00 0.00 0.00 61.98 59.86 1fnt s VAL 113 Cb -0.06 -2.32 0.04 0.00 0.00 0.00 0.00 36.38 34.04 1fnt s VAL 113 CO -0.14 -0.19 0.11 -0.31 0.00 0.00 0.00 175.10 174.57 1fnt s TYR 114 N -1.90 -0.07 -0.12 5.22 4.12 0.08 -1.85 117.35 122.83 1fnt s TYR 114 Ca 0.24 0.44 -0.07 0.00 0.02 0.00 0.00 57.07 57.70 1fnt s TYR 114 Cb -0.07 -0.35 -0.04 0.00 -1.52 0.00 0.00 41.96 39.98 1fnt s TYR 114 CO 0.13 -0.23 0.15 0.45 0.02 0.00 0.00 175.55 176.07 1fnt s SER 115 N 2.16 6.40 0.12 2.29 0.15 -0.91 -1.67 113.70 122.23 1fnt s SER 115 Ca 0.03 0.47 0.11 0.00 0.70 0.00 0.00 55.95 57.26 1fnt s SER 115 Cb -0.12 -2.08 -0.04 0.00 -1.71 0.00 0.00 66.02 62.08 1fnt s SER 115 CO -0.04 0.40 -0.26 -0.36 1.20 0.00 0.00 173.24 174.17 1fnt s PHE 116 N -0.98 2.32 0.77 3.44 0.40 0.11 -2.07 117.98 121.97 1fnt s PHE 116 Ca 0.15 -0.38 -0.12 0.00 -0.60 0.00 0.00 56.93 55.99 1fnt s PHE 116 Cb -0.12 -1.27 0.05 0.00 0.51 0.00 0.00 43.02 42.19 1fnt s PHE 116 CO 0.04 0.32 1.12 0.34 0.70 0.00 0.00 175.22 177.74 1fnt s ASP 117 N -1.96 4.83 0.00 1.36 2.15 -0.39 -3.72 116.67 118.94 1fnt s ASP 117 Ca 0.14 1.07 0.31 0.00 0.43 0.00 0.00 52.55 54.50 1fnt s ASP 117 Cb -0.10 -1.76 1.73 0.00 -0.30 0.00 0.00 42.92 42.49 1fnt s ASP 117 CO 0.06 -1.73 2.14 -0.81 -0.17 0.00 0.00 175.17 174.66 1fnt n PRO 118 N -3.24 0.92 0.00 4.34 -0.04 -1.26 -3.84 135.00 131.88 1fnt n PRO 118 Ca 0.07 -0.09 0.00 0.00 -0.04 0.00 0.00 63.50 63.44 1fnt n PRO 118 Cb 0.58 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.54 1fnt n PRO 118 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 1fnt n VAL 119 N -0.96 0.00 0.00 0.52 0.24 -1.26 -3.83 118.33 113.04 1fnt n VAL 119 Ca 0.21 -0.02 0.00 0.00 -2.04 0.00 0.00 64.34 62.49 1fnt n VAL 119 Cb 0.16 0.33 0.00 0.00 -1.47 0.00 0.00 33.84 32.87 1fnt n VAL 119 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1fnt n GLY 120 N 1.40 0.29 3.67 7.63 0.00 -1.25 -2.48 105.19 114.44 1fnt n GLY 120 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1fnt n GLY 120 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1fnt s SER 121 N 0.00 6.55 0.05 1.61 1.04 -1.26 -4.69 113.70 117.00 1fnt s SER 121 Ca 0.00 2.49 0.06 0.00 0.48 0.00 0.00 55.95 58.98 1fnt s SER 121 Cb 0.00 -2.54 -0.03 0.00 0.10 0.00 0.00 66.02 63.54 1fnt s SER 121 CO 0.00 -0.97 -0.13 -0.72 0.98 0.00 0.00 173.24 172.39 1fnt s TYR 122 N 3.83 2.69 0.05 5.02 1.13 -1.26 -1.26 117.35 127.55 1fnt s TYR 122 Ca 0.80 -0.17 0.03 0.00 -1.41 0.00 0.00 57.07 56.32 1fnt s TYR 122 Cb -0.39 -1.49 -0.02 0.00 -1.10 0.00 0.00 41.96 38.95 1fnt s TYR 122 CO 0.35 0.33 -0.10 -2.00 -2.51 0.00 0.00 175.55 171.62 1fnt s GLU 123 N -1.64 0.64 -0.57 -3.49 2.56 -0.88 -5.00 118.70 110.32 1fnt s GLU 123 Ca 0.17 -0.79 -0.23 0.00 0.00 0.00 0.00 54.97 54.12 1fnt s GLU 123 Cb -0.11 -0.52 0.05 0.00 2.00 0.00 0.00 34.13 35.56 1fnt s GLU 123 CO 0.08 0.11 0.89 0.50 -0.56 0.00 0.00 175.26 176.28 1fnt s ARG 124 N -1.52 3.23 0.20 4.30 6.06 -1.26 -2.14 118.95 127.82 1fnt s ARG 124 Ca -0.06 -0.53 0.06 0.00 -2.50 0.00 0.00 55.73 52.70 1fnt s ARG 124 Cb -0.09 -4.11 -0.04 0.00 0.06 0.00 0.00 34.95 30.77 1fnt s ARG 124 CO 0.01 -1.54 0.16 -1.21 -2.50 0.00 0.00 175.30 170.23 1fnt s GLU 125 N 3.76 2.91 0.00 5.12 0.41 -0.77 -4.99 118.70 125.14 1fnt s GLU 125 Ca 0.25 -0.95 0.09 0.00 -0.41 0.00 0.00 54.97 53.95 1fnt s GLU 125 Cb -0.15 -2.61 0.04 0.00 -1.78 0.00 0.00 34.13 29.63 1fnt s GLU 125 CO 0.15 0.45 0.69 0.94 -0.49 0.00 0.00 175.26 177.00 1fnt n GLN 126 N -0.73 1.26 -3.21 1.61 0.00 -1.26 -2.72 117.38 112.32 1fnt n GLN 126 Ca -0.08 -0.81 0.04 0.00 -0.00 0.00 0.00 57.00 56.15 1fnt n GLN 126 Cb 0.56 -1.11 -0.03 0.00 0.00 0.00 0.00 30.24 29.66 1fnt n GLN 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1fnt s ARG 128 N 2.61 0.34 -0.12 0.00 3.52 0.98 -5.00 118.95 121.28 1fnt s ARG 128 Ca -0.02 0.63 -0.03 0.00 -0.13 0.00 0.00 55.73 56.19 1fnt s ARG 128 Cb -0.07 0.00 -0.03 0.00 -1.56 0.00 0.00 34.95 33.30 1fnt s ARG 128 CO -0.13 -0.13 -0.02 0.00 -0.81 0.00 0.00 175.30 174.21 1fnt s ALA 129 N 1.05 3.14 0.05 6.12 0.00 -1.26 -1.19 121.76 129.68 1fnt s ALA 129 Ca -0.07 -0.82 -0.00 0.00 0.00 0.00 0.00 51.96 51.07 1fnt s ALA 129 Cb -0.07 -1.52 -0.04 0.00 0.00 0.00 0.00 23.12 21.49 1fnt s ALA 129 CO -0.08 0.40 -0.04 0.20 0.00 0.00 0.00 175.76 176.24 1fnt s GLY 130 N -0.27 0.50 0.00 0.00 0.00 -1.08 -4.85 107.32 101.62 1fnt s GLY 130 Ca 0.05 -1.10 0.00 0.00 0.00 0.00 0.00 44.72 43.68 1fnt s GLY 130 CO 0.02 -1.19 0.00 0.61 0.00 0.00 0.00 173.10 172.54 1fnt n GLY 131 N 0.44 0.24 0.41 0.20 0.00 -1.26 -1.24 105.19 103.98 1fnt n GLY 131 Ca -0.16 -2.30 -0.17 0.00 0.00 0.00 0.00 46.02 43.39 1fnt n GLY 131 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fnt h ALA 132 N 0.00 -0.90 0.00 4.61 0.00 -1.56 -2.62 119.26 118.80 1fnt h ALA 132 Ca 0.00 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 1fnt h ALA 132 Cb 0.00 0.50 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 1fnt h ALA 132 CO 0.00 -1.03 -0.02 0.00 0.00 0.00 0.00 179.25 178.20 1fnt h ALA 133 N -0.52 1.10 0.00 0.00 0.00 -1.89 -3.37 119.26 114.58 1fnt h ALA 133 Ca -0.06 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1fnt h ALA 133 Cb 0.73 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1fnt h ALA 133 CO 0.02 0.03 0.00 0.00 0.00 0.00 0.00 179.25 179.30 1fnt n ALA 134 N -2.14 0.00 0.56 0.00 0.00 -0.99 0.22 120.51 118.16 1fnt n ALA 134 Ca -0.02 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.45 1fnt n ALA 134 Cb 0.16 0.00 0.15 0.00 0.00 0.00 0.00 19.45 19.76 1fnt n ALA 134 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1fnt n SER 135 N -1.85 0.00 -0.01 0.00 3.41 -1.26 -1.48 113.62 112.43 1fnt n SER 135 Ca 0.00 -0.40 0.05 0.00 -0.26 0.00 0.00 58.87 58.26 1fnt n SER 135 Cb 0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 63.85 1fnt n SER 135 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1fnt n LEU 136 N -0.78 0.00 -0.10 1.04 4.32 0.58 -4.61 117.00 117.45 1fnt n LEU 136 Ca 0.04 0.00 -0.13 0.00 -0.02 0.00 0.00 56.01 55.89 1fnt n LEU 136 Cb 0.02 0.02 -0.11 0.00 -1.62 0.00 0.00 43.42 41.73 1fnt n LEU 136 CO 0.03 0.02 -1.17 -0.38 -1.22 0.00 0.00 177.39 174.67 1fnt n ILE 137 N -1.98 1.24 -0.32 -0.08 5.41 -0.55 -4.41 119.36 118.67 1fnt n ILE 137 Ca -0.04 -0.55 0.00 0.00 1.00 0.00 0.00 62.75 63.16 1fnt n ILE 137 Cb 0.38 -1.07 0.13 0.00 -0.71 0.00 0.00 39.64 38.37 1fnt n ILE 137 CO 0.00 0.00 0.00 -0.03 0.00 0.00 0.00 176.55 176.52 1fnt h MET 138 N 0.00 1.03 -0.56 0.38 4.05 -1.59 -1.11 114.93 117.13 1fnt h MET 138 Ca -0.48 -0.06 -0.01 0.00 -0.28 0.00 0.00 59.70 58.86 1fnt h MET 138 Cb 1.84 -0.23 -0.03 0.00 -0.80 0.00 0.00 31.60 32.38 1fnt h MET 138 CO -0.05 0.68 0.29 -1.35 0.23 0.00 0.00 176.91 176.72 1fnt h PRO 139 N 1.06 0.77 0.26 0.39 0.11 -1.81 -1.05 132.00 131.72 1fnt h PRO 139 Ca 0.37 -0.08 -0.01 0.00 0.11 0.00 0.00 66.00 66.39 1fnt h PRO 139 Cb 0.09 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.05 1fnt h PRO 139 CO -0.15 0.58 -0.12 0.35 -0.21 0.00 0.00 178.00 178.45 1fnt h PHE 140 N 0.78 -0.32 -0.33 0.65 3.57 -1.58 -2.85 116.94 116.86 1fnt h PHE 140 Ca 0.20 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.68 1fnt h PHE 140 Cb 0.04 0.11 -0.02 0.00 2.79 0.00 0.00 35.95 38.87 1fnt h PHE 140 CO 0.01 0.04 0.14 -0.07 -2.23 0.00 0.00 178.31 176.19 1fnt h LEU 141 N -0.75 0.40 -0.24 0.59 4.07 -1.12 0.62 115.31 118.89 1fnt h LEU 141 Ca -0.04 -0.03 0.04 0.00 0.08 0.00 0.00 57.88 57.93 1fnt h LEU 141 Cb 0.50 -0.10 -0.07 0.00 1.08 0.00 0.00 40.66 42.07 1fnt h LEU 141 CO 0.06 0.37 -0.50 0.44 -1.08 0.00 0.00 178.44 177.72 1fnt h ASP 142 N 0.45 -1.64 0.44 -0.43 5.19 -1.15 0.35 116.42 119.63 1fnt h ASP 142 Ca 0.11 0.20 -0.02 0.00 -0.62 0.00 0.00 57.03 56.71 1fnt h ASP 142 Cb 0.08 0.65 0.00 0.00 0.18 0.00 0.00 39.33 40.25 1fnt h ASP 142 CO -0.01 -0.41 -0.21 -1.13 -3.12 0.00 0.00 179.24 174.36 1fnt h ASN 143 N -0.46 -0.50 -0.33 6.45 -0.00 -0.90 -0.48 115.58 119.38 1fnt h ASN 143 Ca 0.05 0.02 -0.01 0.00 -0.00 0.00 0.00 56.30 56.36 1fnt h ASN 143 Cb 0.59 0.13 -0.02 0.00 -0.00 0.00 0.00 38.32 39.02 1fnt h ASN 143 CO -0.46 -0.31 0.18 1.56 -0.00 0.00 0.00 177.43 178.40 1fnt h GLN 144 N -0.68 0.45 -0.03 6.67 1.08 0.20 0.92 115.11 123.72 1fnt h GLN 144 Ca -0.06 -0.05 -0.25 0.00 -1.45 0.00 0.00 58.65 56.84 1fnt h GLN 144 Cb 0.45 -0.09 0.02 0.00 -0.05 0.00 0.00 27.48 27.81 1fnt h GLN 144 CO 0.10 0.37 -0.98 0.28 -0.95 0.00 0.00 178.83 177.65 1fnt h VAL 145 N 0.41 1.29 -0.19 -0.54 2.07 -0.42 -3.34 116.25 115.54 1fnt h VAL 145 Ca 0.12 -2.20 0.00 0.00 0.82 0.00 0.00 66.70 65.43 1fnt h VAL 145 Cb 0.05 2.30 0.00 0.00 -1.52 0.00 0.00 31.29 32.11 1fnt h VAL 145 CO -0.02 0.68 0.00 0.59 0.02 0.00 0.00 177.57 178.84 1fnt n ASN 146 N -3.86 2.50 -3.78 0.57 3.02 -0.19 -4.93 115.26 108.59 1fnt n ASN 146 Ca -0.10 -1.74 -0.28 0.00 -0.03 0.00 0.00 54.58 52.43 1fnt n ASN 146 Cb 0.85 -0.12 0.02 0.00 -0.61 0.00 0.00 39.78 39.92 1fnt n ASN 146 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1fnt n PHE 147 N 0.68 -1.82 -2.73 3.10 3.72 0.32 -4.90 117.46 115.83 1fnt n PHE 147 Ca 0.10 0.61 -0.41 0.00 -0.05 0.00 0.00 57.45 57.69 1fnt n PHE 147 Cb 0.38 -3.68 -0.04 0.00 -0.94 0.00 0.00 39.48 35.20 1fnt n PHE 147 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1fnt s LYS 148 N -6.17 4.65 -1.02 -1.08 1.02 -1.13 -3.28 119.74 112.72 1fnt s LYS 148 Ca 0.25 1.43 0.00 0.00 0.02 0.00 0.00 55.97 57.67 1fnt s LYS 148 Cb -0.09 -3.40 0.00 0.00 -0.52 0.00 0.00 37.83 33.82 1fnt s LYS 148 CO 0.86 0.14 0.00 0.09 -0.92 0.00 0.00 175.35 175.52 1fnt n ASN 149 N 3.12 -4.15 -4.25 2.83 5.03 -1.26 -4.66 115.26 111.93 1fnt n ASN 149 Ca 0.03 0.23 -0.34 0.00 0.87 0.00 0.00 54.58 55.38 1fnt n ASN 149 Cb 0.50 -2.52 -0.15 0.00 -1.02 0.00 0.00 39.78 36.59 1fnt n ASN 149 CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 1fnt s GLN 150 N -2.86 3.23 0.39 3.52 -0.21 -1.21 -5.10 119.66 117.43 1fnt s GLN 150 Ca 0.00 -0.71 0.08 0.00 0.02 0.00 0.00 55.36 54.75 1fnt s GLN 150 Cb 0.00 -2.80 -0.04 0.00 1.00 0.00 0.00 33.01 31.17 1fnt s GLN 150 CO 0.00 -0.15 0.21 0.71 -2.12 0.00 0.00 175.29 173.94 1fnt s TYR 151 N 1.27 2.65 -0.12 0.91 1.51 -1.26 -1.04 117.35 121.27 1fnt s TYR 151 Ca 0.03 -0.51 -0.30 0.00 -1.01 0.00 0.00 57.07 55.28 1fnt s TYR 151 Cb -0.14 -1.92 -0.01 0.00 -0.11 0.00 0.00 41.96 39.78 1fnt s TYR 151 CO -0.05 0.17 1.06 -1.21 -1.11 0.00 0.00 175.55 174.41 1fnt s GLU 152 N -3.93 4.37 0.72 -0.62 0.41 0.25 -4.58 118.70 115.31 1fnt s GLU 152 Ca 0.42 1.46 -0.16 0.00 -0.41 0.00 0.00 54.97 56.27 1fnt s GLU 152 Cb 0.01 -3.57 0.02 0.00 -1.78 0.00 0.00 34.13 28.81 1fnt s GLU 152 CO 0.24 -0.41 1.15 -2.30 -0.49 0.00 0.00 175.26 173.45 1fnt n PRO 153 N 5.33 0.65 -0.48 0.39 -0.02 -1.26 -2.72 135.00 136.88 1fnt n PRO 153 Ca 0.10 0.28 0.00 0.00 -2.02 0.00 0.00 63.50 61.86 1fnt n PRO 153 Cb 0.48 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.56 1fnt n PRO 153 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1fnt n GLY 154 N 0.89 0.65 0.34 -1.23 0.00 -1.26 -4.73 105.19 99.85 1fnt n GLY 154 Ca 0.14 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.29 1fnt n GLY 154 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1fnt n THR 155 N -2.00 0.00 0.00 2.61 -2.24 -1.10 -4.96 114.28 106.59 1fnt n THR 155 Ca 0.00 -0.18 0.00 0.00 -2.27 0.00 0.00 64.05 61.60 1fnt n THR 155 Cb 0.00 0.55 0.00 0.00 -2.10 0.00 0.00 70.33 68.78 1fnt n THR 155 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1fnt n ASN 156 N -0.36 0.00 0.00 3.42 4.05 -1.26 -2.90 115.26 118.21 1fnt n ASN 156 Ca 0.13 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.16 1fnt n ASN 156 Cb 0.37 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.38 1fnt n ASN 156 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1fnt n GLY 157 N 0.00 0.00 0.01 8.20 0.00 -1.26 -5.02 105.19 107.12 1fnt n GLY 157 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.10 1fnt n GLY 157 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1fnt n LYS 158 N 0.00 0.67 -4.06 1.61 4.76 -1.14 -4.89 118.16 115.11 1fnt n LYS 158 Ca 0.00 -0.13 -0.32 0.00 -2.87 0.00 0.00 58.31 54.99 1fnt n LYS 158 Cb 0.00 -1.37 -0.15 0.00 -1.84 0.00 0.00 35.03 31.66 1fnt n LYS 158 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1fnt s VAL 159 N -3.06 2.07 0.41 -0.18 1.01 -1.26 -5.08 120.40 114.31 1fnt s VAL 159 Ca -0.04 -1.51 -0.23 0.00 0.00 0.00 0.00 61.98 60.20 1fnt s VAL 159 Cb 0.11 -2.17 -0.09 0.00 0.00 0.00 0.00 36.38 34.23 1fnt s VAL 159 CO 0.69 0.03 1.02 -0.75 0.00 0.00 0.00 175.10 176.08 1fnt s LYS 160 N 1.16 4.17 -0.07 2.72 2.20 -1.26 0.85 119.74 129.52 1fnt s LYS 160 Ca -0.07 1.41 -0.30 0.00 -0.36 0.00 0.00 55.97 56.65 1fnt s LYS 160 Cb -0.19 -2.46 -0.05 0.00 -1.51 0.00 0.00 37.83 33.63 1fnt s LYS 160 CO -0.06 -0.11 1.53 0.21 -0.36 0.00 0.00 175.35 176.56 1fnt s LYS 161 N -2.65 4.21 0.42 4.03 2.20 -0.21 -4.61 119.74 123.14 1fnt s LYS 161 Ca 0.59 2.05 -0.26 0.00 -0.36 0.00 0.00 55.97 57.98 1fnt s LYS 161 Cb -0.19 -3.87 -0.09 0.00 -1.51 0.00 0.00 37.83 32.17 1fnt s LYS 161 CO 0.24 -0.78 1.43 -0.35 -0.36 0.00 0.00 175.35 175.53 1fnt n PRO 162 N 6.72 2.33 -2.15 4.03 -0.04 -1.26 -4.92 135.00 139.72 1fnt n PRO 162 Ca 0.16 0.83 -0.32 0.00 -0.04 0.00 0.00 63.50 64.12 1fnt n PRO 162 Cb 0.43 -2.60 -0.00 0.00 -0.04 0.00 0.00 33.50 31.28 1fnt n PRO 162 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1fnt s LEU 163 N -2.34 3.52 -0.09 1.53 1.02 -1.26 -5.05 118.68 116.01 1fnt s LEU 163 Ca 0.59 1.71 -0.11 0.00 0.02 0.00 0.00 54.13 56.34 1fnt s LEU 163 Cb -0.47 -4.52 0.03 0.00 0.02 0.00 0.00 46.19 41.25 1fnt s LEU 163 CO 0.59 -0.97 0.29 -0.75 0.02 0.00 0.00 176.35 175.54 1fnt s LYS 164 N -4.14 0.40 -0.22 1.70 2.36 -1.26 -5.14 119.74 113.45 1fnt s LYS 164 Ca 0.62 0.29 -0.20 0.00 -2.55 0.00 0.00 55.97 54.13 1fnt s LYS 164 Cb -0.14 0.19 -0.03 0.00 -1.05 0.00 0.00 37.83 36.81 1fnt s LYS 164 CO 0.36 -0.06 0.60 0.71 1.55 0.00 0.00 175.35 178.50 1fnt s TYR 165 N -0.12 3.35 0.05 4.03 2.02 -1.26 -5.04 117.35 120.38 1fnt s TYR 165 Ca -0.03 0.85 -0.23 0.00 -0.37 0.00 0.00 57.07 57.30 1fnt s TYR 165 Cb -0.03 -2.78 -0.06 0.00 -0.40 0.00 0.00 41.96 38.70 1fnt s TYR 165 CO 0.01 -0.20 0.69 -0.48 -1.57 0.00 0.00 175.55 174.00 1fnt s LEU 166 N 2.02 4.47 0.94 -1.29 0.05 -1.26 -5.04 118.68 118.57 1fnt s LEU 166 Ca 0.27 1.37 -0.11 0.00 0.05 0.00 0.00 54.13 55.71 1fnt s LEU 166 Cb -0.16 -3.11 0.13 0.00 -2.05 0.00 0.00 46.19 41.01 1fnt s LEU 166 CO 0.10 0.11 0.99 -1.54 -0.55 0.00 0.00 176.35 175.45 1fnt n SER 167 N 2.44 -0.24 -0.26 1.48 3.41 -1.26 -4.70 113.62 114.50 1fnt n SER 167 Ca -0.05 0.37 0.00 0.00 -0.26 0.00 0.00 58.87 58.93 1fnt n SER 167 Cb 0.50 -1.41 0.13 0.00 -0.26 0.00 0.00 64.21 63.16 1fnt n SER 167 CO 0.00 0.00 0.00 1.62 -0.16 0.00 0.00 175.04 176.50 1fnt h VAL 168 N -1.88 0.94 -0.21 -3.33 3.04 -2.00 -1.88 116.25 110.93 1fnt h VAL 168 Ca -0.44 -0.25 0.06 0.00 -1.01 0.00 0.00 66.70 65.06 1fnt h VAL 168 Cb 1.28 0.15 -0.07 0.00 -2.01 0.00 0.00 31.29 30.64 1fnt h VAL 168 CO 0.40 0.13 -0.34 -0.33 -1.01 0.00 0.00 177.57 176.42 1fnt h GLU 169 N 0.72 -0.35 -0.85 4.17 3.07 -2.00 -0.90 114.58 118.44 1fnt h GLU 169 Ca 0.34 0.02 0.16 0.00 -0.50 0.00 0.00 59.36 59.38 1fnt h GLU 169 Cb 0.26 0.08 -0.10 0.00 -0.84 0.00 0.00 28.75 28.15 1fnt h GLU 169 CO -0.21 -0.23 0.43 1.49 -1.40 0.00 0.00 179.01 179.08 1fnt h GLU 170 N -0.37 0.57 0.15 2.33 4.57 -1.70 -1.69 114.58 118.45 1fnt h GLU 170 Ca 0.12 -0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 58.25 1fnt h GLU 170 Cb 0.55 -0.13 0.00 0.00 -0.16 0.00 0.00 28.75 29.02 1fnt h GLU 170 CO -0.42 0.38 -0.07 0.28 -1.18 0.00 0.00 179.01 178.00 1fnt h VAL 171 N 0.59 0.93 -0.16 0.32 2.07 -0.56 -2.86 116.25 116.58 1fnt h VAL 171 Ca 0.47 -0.34 0.05 0.00 0.82 0.00 0.00 66.70 67.70 1fnt h VAL 171 Cb 0.71 1.14 -0.01 0.00 -1.52 0.00 0.00 31.29 31.61 1fnt h VAL 171 CO -0.39 0.08 0.15 0.40 0.02 0.00 0.00 177.57 177.83 1fnt h ILE 172 N -0.37 0.64 0.10 4.57 2.04 -0.39 0.42 117.51 124.53 1fnt h ILE 172 Ca -0.02 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.83 1fnt h ILE 172 Cb 0.29 0.89 0.00 0.00 -0.74 0.00 0.00 36.82 37.26 1fnt h ILE 172 CO 0.03 0.00 -0.05 0.11 0.00 0.00 0.00 178.15 178.25 1fnt h LYS 173 N 0.00 -0.12 -0.04 2.37 1.57 -1.26 -2.14 116.57 116.95 1fnt h LYS 173 Ca 0.08 0.01 0.04 0.00 -1.87 0.00 0.00 60.65 58.90 1fnt h LYS 173 Cb 0.37 0.03 -0.06 0.00 0.08 0.00 0.00 32.23 32.65 1fnt h LYS 173 CO -0.00 0.24 -0.37 -0.07 -0.57 0.00 0.00 179.45 178.68 1fnt h LEU 174 N -0.51 -1.13 -0.57 2.94 3.38 -0.77 -2.31 115.31 116.35 1fnt h LEU 174 Ca -0.01 0.15 0.11 0.00 0.09 0.00 0.00 57.88 58.22 1fnt h LEU 174 Cb 0.42 0.45 -0.11 0.00 0.09 0.00 0.00 40.66 41.52 1fnt h LEU 174 CO 0.02 -0.42 -0.15 0.58 0.09 0.00 0.00 178.44 178.57 1fnt h VAL 175 N -0.50 0.42 -0.08 1.22 2.07 -1.16 -0.27 116.25 117.94 1fnt h VAL 175 Ca 0.06 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.58 1fnt h VAL 175 Cb 0.60 0.42 -0.00 0.00 -1.52 0.00 0.00 31.29 30.79 1fnt h VAL 175 CO -0.32 0.00 0.05 0.03 0.02 0.00 0.00 177.57 177.35 1fnt h ARG 176 N -0.01 0.12 -0.85 1.57 3.08 -0.99 -2.45 114.38 114.85 1fnt h ARG 176 Ca 0.27 -0.01 0.14 0.00 0.07 0.00 0.00 59.98 60.45 1fnt h ARG 176 Cb 0.42 -0.02 -0.09 0.00 0.08 0.00 0.00 29.97 30.36 1fnt h ARG 176 CO -0.59 0.13 0.45 -0.44 -1.07 0.00 0.00 179.97 178.45 1fnt h ASP 177 N 0.07 0.57 -0.33 7.04 3.32 -0.80 -1.58 116.42 124.71 1fnt h ASP 177 Ca 0.03 0.08 0.04 0.00 0.02 0.00 0.00 57.03 57.20 1fnt h ASP 177 Cb 0.04 -0.01 -0.04 0.00 0.22 0.00 0.00 39.33 39.54 1fnt h ASP 177 CO -0.01 0.26 0.10 0.28 -1.72 0.00 0.00 179.24 178.16 1fnt h SER 178 N 0.67 0.09 -0.56 6.45 0.02 -0.68 -2.19 113.55 117.35 1fnt h SER 178 Ca 0.45 0.04 -0.11 0.00 -0.84 0.00 0.00 61.79 61.33 1fnt h SER 178 Cb 0.60 0.04 -0.02 0.00 0.14 0.00 0.00 62.40 63.15 1fnt h SER 178 CO -0.34 0.09 -0.09 -0.26 -1.14 0.00 0.00 176.83 175.09 1fnt h PHE 179 N 0.23 1.17 0.50 3.45 -1.00 -0.89 -1.84 116.94 118.57 1fnt h PHE 179 Ca 0.15 -0.24 -0.02 0.00 2.81 0.00 0.00 57.97 60.67 1fnt h PHE 179 Cb 0.14 -0.29 0.00 0.00 3.61 0.00 0.00 35.95 39.41 1fnt h PHE 179 CO -0.15 1.07 -0.24 1.79 -1.61 0.00 0.00 178.31 179.16 1fnt h THR 180 N 0.94 0.50 -0.60 -1.55 1.35 -1.17 0.16 112.91 112.55 1fnt h THR 180 Ca 0.15 -0.04 0.12 0.00 -0.55 0.00 0.00 66.41 66.10 1fnt h THR 180 Cb 0.66 0.52 -0.10 0.00 -1.73 0.00 0.00 68.15 67.50 1fnt h THR 180 CO 0.05 0.01 -0.02 0.28 -0.25 0.00 0.00 175.52 175.59 1fnt h SER 181 N -0.70 -0.30 -0.70 5.36 0.02 -1.39 0.22 113.55 116.07 1fnt h SER 181 Ca -0.07 0.15 0.01 0.00 -0.84 0.00 0.00 61.79 61.04 1fnt h SER 181 Cb 0.53 0.27 -0.03 0.00 0.14 0.00 0.00 62.40 63.31 1fnt h SER 181 CO 0.11 -0.12 0.46 0.00 -1.14 0.00 0.00 176.83 176.15 1fnt h ALA 182 N 1.55 0.89 -0.33 3.77 0.00 -1.05 -2.39 119.26 121.70 1fnt h ALA 182 Ca 0.31 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.11 1fnt h ALA 182 Cb 0.50 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1fnt h ALA 182 CO -0.52 0.32 -0.02 1.15 0.00 0.00 0.00 179.25 180.17 1fnt h THR 183 N 0.95 1.20 -0.46 0.00 2.02 0.24 0.16 112.91 117.03 1fnt h THR 183 Ca 0.26 -0.83 -0.01 0.00 0.77 0.00 0.00 66.41 66.59 1fnt h THR 183 Cb -0.10 0.98 -0.02 0.00 -1.74 0.00 0.00 68.15 67.26 1fnt h THR 183 CO -0.06 0.28 0.23 -0.33 0.37 0.00 0.00 175.52 176.02 1fnt h GLU 184 N 0.50 0.65 -0.24 6.66 4.39 -0.57 -3.23 114.58 122.74 1fnt h GLU 184 Ca 0.11 -0.09 0.00 0.00 0.34 0.00 0.00 59.36 59.72 1fnt h GLU 184 Cb 0.36 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 28.89 1fnt h GLU 184 CO 0.01 0.53 0.00 0.54 -1.16 0.00 0.00 179.01 178.94 1fnt n ARG 185 N -4.67 2.04 -4.01 2.33 5.12 -1.05 -4.92 116.66 111.50 1fnt n ARG 185 Ca 0.01 -1.92 -0.25 0.00 -1.93 0.00 0.00 57.85 53.76 1fnt n ARG 185 Cb 0.10 -1.39 -0.17 0.00 -1.16 0.00 0.00 32.46 29.84 1fnt n ARG 185 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 1fnt s HIS 186 N -1.32 1.32 0.16 -1.55 2.46 0.54 -5.04 115.29 111.87 1fnt s HIS 186 Ca 0.28 -0.60 -0.10 0.00 0.47 0.00 0.00 55.06 55.11 1fnt s HIS 186 Cb 0.17 -1.11 0.03 0.00 -0.13 0.00 0.00 32.58 31.54 1fnt s HIS 186 CO 0.24 -0.43 1.59 -0.84 -2.47 0.00 0.00 174.74 172.83 1fnt h ILE 187 N 6.16 1.27 0.00 0.89 3.07 -1.86 -2.83 117.51 124.21 1fnt h ILE 187 Ca -0.29 -1.22 0.00 0.00 1.55 0.00 0.00 64.86 64.90 1fnt h ILE 187 Cb 1.14 0.97 0.00 0.00 -0.27 0.00 0.00 36.82 38.66 1fnt h ILE 187 CO 0.40 0.43 0.00 0.00 -1.05 0.00 0.00 178.15 177.93 1fnt n GLN 188 N -4.20 0.33 -4.85 0.16 6.02 -1.26 -4.67 117.38 108.92 1fnt n GLN 188 Ca 0.01 0.08 -0.27 0.00 -0.01 0.00 0.00 57.00 56.81 1fnt n GLN 188 Cb 0.38 -1.50 -0.17 0.00 1.02 0.00 0.00 30.24 29.98 1fnt n GLN 188 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1fnt s VAL 189 N -2.32 1.50 -3.32 5.09 1.01 -1.07 -4.23 120.40 117.05 1fnt s VAL 189 Ca 0.18 -0.71 0.00 0.00 0.00 0.00 0.00 61.98 61.45 1fnt s VAL 189 Cb 0.10 -1.32 0.00 0.00 0.00 0.00 0.00 36.38 35.17 1fnt s VAL 189 CO 0.21 0.43 0.00 0.61 0.00 0.00 0.00 175.10 176.35 1fnt n GLY 190 N 3.52 -0.79 4.81 4.51 0.00 -1.26 -4.44 105.19 111.54 1fnt n GLY 190 Ca -0.20 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 44.83 1fnt n GLY 190 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1fnt n ASP 191 N 0.67 0.00 -3.72 1.61 8.00 0.41 -4.29 116.55 119.23 1fnt n ASP 191 Ca 0.00 0.00 -0.06 0.00 0.71 0.00 0.00 54.79 55.44 1fnt n ASP 191 Cb 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.08 1fnt n ASP 191 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1fnt s GLY 192 N 0.00 -0.26 -0.07 0.44 0.00 -1.26 -1.52 107.32 104.64 1fnt s GLY 192 Ca 0.00 0.13 -0.02 0.00 0.00 0.00 0.00 44.72 44.84 1fnt s GLY 192 CO 0.00 0.03 0.01 -2.27 0.00 0.00 0.00 173.10 170.88 1fnt s LEU 193 N -2.85 0.53 -0.22 0.66 2.96 -0.16 -2.05 118.68 117.55 1fnt s LEU 193 Ca 0.09 -0.08 -0.04 0.00 -0.22 0.00 0.00 54.13 53.88 1fnt s LEU 193 Cb -0.03 -0.39 -0.01 0.00 0.50 0.00 0.00 46.19 46.26 1fnt s LEU 193 CO 0.00 -0.21 -0.03 -0.70 -1.32 0.00 0.00 176.35 174.10 1fnt s GLU 194 N 2.00 3.44 -0.16 1.98 2.12 -1.21 -1.85 118.70 125.03 1fnt s GLU 194 Ca 0.05 -0.60 -0.01 0.00 0.36 0.00 0.00 54.97 54.77 1fnt s GLU 194 Cb -0.12 -3.03 -0.01 0.00 0.26 0.00 0.00 34.13 31.23 1fnt s GLU 194 CO -0.05 -0.15 -0.12 0.42 -0.54 0.00 0.00 175.26 174.83 1fnt s ILE 195 N 1.37 3.02 -0.25 -3.70 1.01 -0.25 -2.91 121.20 119.50 1fnt s ILE 195 Ca 0.04 -0.65 -0.08 0.00 0.00 0.00 0.00 60.65 59.97 1fnt s ILE 195 Cb -0.14 -2.30 -0.03 0.00 0.01 0.00 0.00 42.46 40.00 1fnt s ILE 195 CO -0.01 0.50 0.08 -0.76 0.00 0.00 0.00 174.94 174.75 1fnt s LEU 196 N 0.73 3.54 -0.22 2.97 1.02 -0.73 -2.12 118.68 123.87 1fnt s LEU 196 Ca -0.05 -0.16 -0.05 0.00 0.02 0.00 0.00 54.13 53.89 1fnt s LEU 196 Cb -0.15 -1.95 -0.02 0.00 0.02 0.00 0.00 46.19 44.09 1fnt s LEU 196 CO 0.02 -0.02 -0.01 -0.63 0.02 0.00 0.00 176.35 175.73 1fnt s ILE 197 N 1.51 3.77 -0.16 -0.59 1.01 0.05 -1.40 121.20 125.40 1fnt s ILE 197 Ca 0.06 -0.36 -0.09 0.00 0.00 0.00 0.00 60.65 60.26 1fnt s ILE 197 Cb -0.15 -2.72 -0.05 0.00 0.01 0.00 0.00 42.46 39.55 1fnt s ILE 197 CO 0.04 0.41 0.14 -0.69 0.00 0.00 0.00 174.94 174.84 1fnt s VAL 198 N 1.33 5.45 0.15 2.92 1.01 0.25 -1.58 120.40 129.93 1fnt s VAL 198 Ca 0.04 0.21 -0.10 0.00 0.00 0.00 0.00 61.98 62.13 1fnt s VAL 198 Cb -0.15 -3.44 -0.00 0.00 0.00 0.00 0.00 36.38 32.79 1fnt s VAL 198 CO 0.00 0.52 0.28 0.42 0.00 0.00 0.00 175.10 176.32 1fnt s THR 199 N -0.26 0.08 0.00 3.92 -4.23 -0.99 -1.98 115.64 112.19 1fnt s THR 199 Ca 0.11 -1.27 0.00 0.00 -1.18 0.00 0.00 61.69 59.35 1fnt s THR 199 Cb -0.12 -1.68 0.00 0.00 1.34 0.00 0.00 72.50 72.04 1fnt s THR 199 CO 0.01 -0.37 0.27 2.29 -0.54 0.00 0.00 174.62 176.28 1fnt n LYS 200 N -0.19 0.18 -0.49 3.99 2.85 -1.26 -1.79 118.16 121.44 1fnt n LYS 200 Ca -0.10 0.00 -0.02 0.00 -1.05 0.00 0.00 58.31 57.15 1fnt n LYS 200 Cb 0.63 -1.41 -0.02 0.00 -0.65 0.00 0.00 35.03 33.58 1fnt n LYS 200 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 177.40 176.95 1fnt n ASP 201 N 1.44 -0.23 0.00 -5.58 5.68 -1.26 -5.16 116.55 111.44 1fnt n ASP 201 Ca 0.00 -0.79 0.00 0.00 -0.50 0.00 0.00 54.79 53.50 1fnt n ASP 201 Cb 0.09 0.07 0.00 0.00 -1.14 0.00 0.00 41.12 40.14 1fnt n ASP 201 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1fnt n GLY 202 N 0.00 0.74 3.33 6.12 0.00 -0.74 -5.05 105.19 109.59 1fnt n GLY 202 Ca -0.07 -2.08 -0.33 0.00 0.00 0.00 0.00 46.02 43.55 1fnt n GLY 202 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1fnt s VAL 203 N -1.15 2.82 0.07 1.61 1.01 -1.26 -2.35 120.40 121.16 1fnt s VAL 203 Ca 0.00 -0.74 0.07 0.00 0.00 0.00 0.00 61.98 61.31 1fnt s VAL 203 Cb 0.00 -2.17 -0.04 0.00 0.00 0.00 0.00 36.38 34.17 1fnt s VAL 203 CO 0.00 0.53 -0.14 -0.60 0.00 0.00 0.00 175.10 174.89 1fnt s ARG 204 N 0.40 2.12 -0.06 2.72 3.52 -0.61 -4.94 118.95 122.10 1fnt s ARG 204 Ca -0.12 -0.99 0.03 0.00 -0.13 0.00 0.00 55.73 54.53 1fnt s ARG 204 Cb -0.16 -2.27 0.00 0.00 -1.56 0.00 0.00 34.95 30.97 1fnt s ARG 204 CO 0.06 0.53 -0.17 0.21 -0.81 0.00 0.00 175.30 175.12 1fnt s LYS 205 N -1.81 2.03 0.00 5.12 2.36 -1.26 -0.77 119.74 125.41 1fnt s LYS 205 Ca 0.18 -0.59 0.01 0.00 -2.55 0.00 0.00 55.97 53.02 1fnt s LYS 205 Cb -0.11 -1.66 -0.00 0.00 -1.05 0.00 0.00 37.83 35.01 1fnt s LYS 205 CO 0.09 0.14 -0.03 -1.21 1.55 0.00 0.00 175.35 175.89 1fnt s GLU 206 N 0.35 0.26 0.10 4.03 2.02 -0.90 -5.01 118.70 119.55 1fnt s GLU 206 Ca -0.11 -0.17 0.08 0.00 0.02 0.00 0.00 54.97 54.79 1fnt s GLU 206 Cb -0.15 -0.22 -0.03 0.00 0.10 0.00 0.00 34.13 33.83 1fnt s GLU 206 CO 0.04 0.06 -0.22 0.12 0.02 0.00 0.00 175.26 175.28 1fnt s PHE 207 N -0.21 1.86 -0.09 1.61 5.36 -1.26 -1.09 117.98 124.16 1fnt s PHE 207 Ca -0.00 -0.41 -0.04 0.00 -0.96 0.00 0.00 56.93 55.52 1fnt s PHE 207 Cb -0.02 -1.03 0.04 0.00 -0.34 0.00 0.00 43.02 41.67 1fnt s PHE 207 CO -0.00 0.21 0.19 0.71 -1.46 0.00 0.00 175.22 174.86 1fnt s TYR 208 N -1.10 -0.24 0.18 10.12 2.02 -0.77 -5.01 117.35 122.54 1fnt s TYR 208 Ca 0.07 0.64 -0.30 0.00 -0.37 0.00 0.00 57.07 57.12 1fnt s TYR 208 Cb -0.10 -0.07 -0.08 0.00 -0.40 0.00 0.00 41.96 41.32 1fnt s TYR 208 CO 0.04 -0.22 1.12 -1.21 -1.57 0.00 0.00 175.55 173.71 1fnt s GLU 209 N 1.49 4.57 0.18 -0.62 2.02 -1.26 -0.99 118.70 124.08 1fnt s GLU 209 Ca -0.06 1.75 0.03 0.00 0.02 0.00 0.00 54.97 56.70 1fnt s GLU 209 Cb -0.11 -3.27 0.03 0.00 0.10 0.00 0.00 34.13 30.87 1fnt s GLU 209 CO -0.07 0.03 0.23 1.28 0.02 0.00 0.00 175.26 176.76 1fnt n LEU 210 N 2.43 0.00 -4.78 1.80 4.77 -0.58 -4.89 117.00 115.76 1fnt n LEU 210 Ca 0.03 -0.79 -0.39 0.00 -0.03 0.00 0.00 56.01 54.83 1fnt n LEU 210 Cb 0.46 -0.11 -0.06 0.00 -2.33 0.00 0.00 43.42 41.38 1fnt n LEU 210 CO 0.54 -0.53 0.39 -0.54 -1.33 0.00 0.00 177.39 175.92 1fnt s LYS 211 N -2.80 4.42 -0.39 3.23 1.02 -1.26 -4.35 119.74 119.60 1fnt s LYS 211 Ca 0.17 0.96 -0.03 0.00 0.02 0.00 0.00 55.97 57.10 1fnt s LYS 211 Cb -0.01 -3.29 0.11 0.00 -0.52 0.00 0.00 37.83 34.12 1fnt s LYS 211 CO 0.11 0.50 2.52 0.54 -0.92 0.00 0.00 175.35 178.10 1fnt n ARG 212 N 2.07 2.18 0.00 1.68 1.74 -1.26 -0.45 116.66 122.61 1fnt n ARG 212 Ca -0.06 -2.03 0.00 0.00 -0.77 0.00 0.00 57.85 54.99 1fnt n ARG 212 Cb 0.50 -1.95 0.00 0.00 -1.02 0.00 0.00 32.46 29.99 1fnt n ARG 212 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71