#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fy2 s GLU 2 N 0.00 1.96 0.05 0.03 0.41 -1.26 -3.79 118.70 116.10 1fy2 s GLU 2 Ca 0.00 -1.23 0.04 0.00 -0.41 0.00 0.00 54.97 53.37 1fy2 s GLU 2 Cb 0.00 -2.78 -0.02 0.00 -1.78 0.00 0.00 34.13 29.55 1fy2 s GLU 2 CO 0.00 -0.60 -0.12 -0.51 -0.49 0.00 0.00 175.26 173.54 1fy2 s LEU 3 N 1.21 2.23 -0.16 1.80 1.43 -0.24 -1.50 118.68 123.45 1fy2 s LEU 3 Ca -0.07 -0.52 -0.02 0.00 -1.03 0.00 0.00 54.13 52.49 1fy2 s LEU 3 Cb -0.19 -0.43 0.05 0.00 0.03 0.00 0.00 46.19 45.64 1fy2 s LEU 3 CO -0.06 -0.07 -0.00 -0.22 0.23 0.00 0.00 176.35 176.23 1fy2 s LEU 4 N -1.43 1.25 -0.33 1.79 2.96 0.35 -0.25 118.68 123.02 1fy2 s LEU 4 Ca -0.03 -0.64 -0.00 0.00 -0.22 0.00 0.00 54.13 53.24 1fy2 s LEU 4 Cb -0.09 -0.68 0.07 0.00 0.50 0.00 0.00 46.19 45.99 1fy2 s LEU 4 CO 0.01 -0.24 0.04 -0.76 -1.32 0.00 0.00 176.35 174.08 1fy2 s LEU 5 N 1.79 4.29 -0.09 -0.68 1.43 -0.01 -1.37 118.68 124.04 1fy2 s LEU 5 Ca 0.01 -1.61 -0.08 0.00 -1.03 0.00 0.00 54.13 51.42 1fy2 s LEU 5 Cb -0.16 -1.70 -0.04 0.00 0.03 0.00 0.00 46.19 44.32 1fy2 s LEU 5 CO -0.07 -0.34 0.19 -0.76 0.23 0.00 0.00 176.35 175.60 1fy2 s LEU 6 N 1.15 4.40 0.34 1.79 1.43 0.23 -0.55 118.68 127.48 1fy2 s LEU 6 Ca -0.00 0.56 0.05 0.00 -1.03 0.00 0.00 54.13 53.71 1fy2 s LEU 6 Cb -0.20 -2.18 0.63 0.00 0.03 0.00 0.00 46.19 44.47 1fy2 s LEU 6 CO -0.03 0.39 1.88 -1.28 0.23 0.00 0.00 176.35 177.54 1fy2 h SER 7 N 4.89 0.45 -5.00 2.29 0.87 -1.54 -0.96 113.55 114.55 1fy2 h SER 7 Ca -0.54 -0.08 0.03 0.00 -1.23 0.00 0.00 61.79 59.96 1fy2 h SER 7 Cb 1.23 -0.12 -0.09 0.00 -0.44 0.00 0.00 62.40 62.98 1fy2 h SER 7 CO 0.59 0.53 0.25 0.54 -0.53 0.00 0.00 176.83 178.21 1fy2 s ASN 8 N -6.76 -0.42 0.08 6.23 4.22 -1.26 -2.75 114.94 114.28 1fy2 s ASN 8 Ca -0.07 -0.25 0.11 0.00 -2.14 0.00 0.00 52.86 50.50 1fy2 s ASN 8 Cb 0.15 0.63 -0.17 0.00 1.28 0.00 0.00 41.25 43.14 1fy2 s ASN 8 CO 0.76 -1.09 1.05 0.77 -2.04 0.00 0.00 177.10 176.54 1fy2 h SER 9 N 2.00 0.00 -3.34 3.54 4.64 -1.93 -3.46 113.55 115.00 1fy2 h SER 9 Ca -0.27 0.00 -0.39 0.00 -0.47 0.00 0.00 61.79 60.66 1fy2 h SER 9 Cb 1.28 0.00 -0.37 0.00 -0.31 0.00 0.00 62.40 63.00 1fy2 h SER 9 CO 0.31 0.89 -0.75 -0.89 -0.87 0.00 0.00 176.83 175.52 1fy2 s THR 10 N -2.73 0.13 0.53 2.95 2.01 -1.26 0.12 115.64 117.39 1fy2 s THR 10 Ca -0.01 0.23 -0.17 0.00 0.31 0.00 0.00 61.69 62.05 1fy2 s THR 10 Cb 0.09 -0.31 -0.07 0.00 0.01 0.00 0.00 72.50 72.22 1fy2 s THR 10 CO 0.81 0.20 1.01 -0.76 -0.69 0.00 0.00 174.62 175.19 1fy2 s LEU 11 N 1.79 3.64 0.28 4.42 1.43 -1.26 -4.96 118.68 124.02 1fy2 s LEU 11 Ca 0.01 1.71 -0.30 0.00 -1.03 0.00 0.00 54.13 54.52 1fy2 s LEU 11 Cb -0.12 -4.53 -0.12 0.00 0.03 0.00 0.00 46.19 41.45 1fy2 s LEU 11 CO -0.03 -0.80 1.53 -0.81 0.23 0.00 0.00 176.35 176.46 1fy2 n PRO 12 N -1.58 2.48 -0.85 1.29 -0.04 -1.26 -1.39 135.00 133.66 1fy2 n PRO 12 Ca 0.08 0.88 0.00 0.00 -0.04 0.00 0.00 63.50 64.42 1fy2 n PRO 12 Cb 0.53 -2.62 0.00 0.00 -0.04 0.00 0.00 33.50 31.37 1fy2 n PRO 12 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1fy2 n GLY 13 N 2.05 0.63 3.84 0.55 0.00 -1.26 -4.98 105.19 106.01 1fy2 n GLY 13 Ca 0.09 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.86 1fy2 n GLY 13 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fy2 s LYS 14 N -0.37 2.31 0.27 1.61 -0.14 -0.49 -5.11 119.74 117.82 1fy2 s LYS 14 Ca 0.00 -1.88 -0.23 0.00 -1.36 0.00 0.00 55.97 52.51 1fy2 s LYS 14 Cb 0.00 -2.10 -0.09 0.00 -1.68 0.00 0.00 37.83 33.96 1fy2 s LYS 14 CO 0.00 -0.35 0.83 0.00 -0.76 0.00 0.00 175.35 175.07 1fy2 s ALA 15 N -2.66 3.31 -0.07 5.17 0.00 -1.26 -4.68 121.76 121.57 1fy2 s ALA 15 Ca 0.38 0.34 -0.38 0.00 0.00 0.00 0.00 51.96 52.30 1fy2 s ALA 15 Cb -0.00 -3.00 -0.16 0.00 0.00 0.00 0.00 23.12 19.96 1fy2 s ALA 15 CO 0.22 0.25 1.54 1.87 0.00 0.00 0.00 175.76 179.65 1fy2 n TRP 16 N 0.63 1.80 -0.87 0.00 -0.00 -1.26 -0.75 117.44 117.00 1fy2 n TRP 16 Ca -0.00 0.55 0.00 0.00 -0.00 0.00 0.00 57.50 58.05 1fy2 n TRP 16 Cb 0.51 -2.41 0.00 0.00 -0.00 0.00 0.00 31.31 29.41 1fy2 n TRP 16 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 177.69 178.97 1fy2 n LEU 17 N 3.93 0.52 -0.26 5.87 4.77 0.32 -4.94 117.00 127.21 1fy2 n LEU 17 Ca 0.22 0.00 -0.00 0.00 -0.03 0.00 0.00 56.01 56.19 1fy2 n LEU 17 Cb 0.17 -1.15 0.12 0.00 -2.33 0.00 0.00 43.42 40.23 1fy2 n LEU 17 CO 0.71 -0.39 1.13 -0.08 -1.33 0.00 0.00 177.39 177.43 1fy2 h GLU 18 N 0.98 0.76 0.00 3.23 4.81 -1.13 -1.05 114.58 122.18 1fy2 h GLU 18 Ca 0.00 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 1fy2 h GLU 18 Cb 0.25 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.46 1fy2 h GLU 18 CO 0.00 0.50 0.00 1.12 -0.73 0.00 0.00 179.01 179.90 1fy2 h HIS 19 N 0.78 0.00 0.00 0.92 2.07 -1.87 -2.95 115.15 114.10 1fy2 h HIS 19 Ca 0.33 0.00 -0.08 0.00 -2.85 0.00 0.00 60.37 57.77 1fy2 h HIS 19 Cb 0.20 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.17 1fy2 h HIS 19 CO -0.06 0.00 -0.65 0.00 -3.07 0.00 0.00 177.93 174.14 1fy2 h ALA 20 N 2.02 0.72 -0.33 6.11 0.00 -1.54 -3.39 119.26 122.84 1fy2 h ALA 20 Ca 0.00 -0.36 0.07 0.00 0.00 0.00 0.00 54.91 54.61 1fy2 h ALA 20 Cb 0.52 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.27 1fy2 h ALA 20 CO 0.00 0.45 -0.09 -0.07 0.00 0.00 0.00 179.25 179.54 1fy2 h LEU 21 N 0.00 -0.33 -1.23 0.00 3.38 -1.30 -0.09 115.31 115.74 1fy2 h LEU 21 Ca -0.04 0.10 -0.04 0.00 0.09 0.00 0.00 57.88 58.00 1fy2 h LEU 21 Cb 1.28 0.21 -0.02 0.00 0.09 0.00 0.00 40.66 42.22 1fy2 h LEU 21 CO 0.04 -0.12 0.10 1.55 0.09 0.00 0.00 178.44 180.10 1fy2 h PRO 22 N -0.01 0.63 -0.42 1.13 0.13 -1.78 0.51 132.00 132.19 1fy2 h PRO 22 Ca 0.16 -0.11 -0.02 0.00 -0.87 0.00 0.00 66.00 65.16 1fy2 h PRO 22 Cb 0.25 -0.10 -0.02 0.00 0.13 0.00 0.00 31.00 31.26 1fy2 h PRO 22 CO -0.34 0.58 0.19 -0.07 -0.23 0.00 0.00 178.00 178.13 1fy2 h LEU 23 N 0.62 0.56 -0.17 1.56 3.38 -1.47 -1.00 115.31 118.80 1fy2 h LEU 23 Ca 0.14 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1fy2 h LEU 23 Cb 0.24 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1fy2 h LEU 23 CO -0.00 0.55 0.02 0.40 0.09 0.00 0.00 178.44 179.50 1fy2 h ILE 24 N 0.54 1.23 -0.84 1.22 2.04 -0.67 -2.33 117.51 118.70 1fy2 h ILE 24 Ca 0.14 -0.74 0.07 0.00 1.00 0.00 0.00 64.86 65.32 1fy2 h ILE 24 Cb 0.15 1.40 -0.05 0.00 -0.74 0.00 0.00 36.82 37.58 1fy2 h ILE 24 CO -0.02 0.22 0.55 0.00 0.00 0.00 0.00 178.15 178.91 1fy2 h ALA 25 N 0.81 1.59 0.00 1.87 0.00 -0.78 0.82 119.26 123.57 1fy2 h ALA 25 Ca 0.05 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 1fy2 h ALA 25 Cb 0.32 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1fy2 h ALA 25 CO 0.00 0.28 -0.31 -0.91 0.00 0.00 0.00 179.25 178.31 1fy2 h ASN 26 N 0.92 0.00 0.00 0.00 2.35 -0.95 -3.28 115.58 114.62 1fy2 h ASN 26 Ca 0.36 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.11 1fy2 h ASN 26 Cb 0.23 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.60 1fy2 h ASN 26 CO -0.13 0.31 -1.64 1.67 -1.65 0.00 0.00 177.43 175.99 1fy2 n GLN 27 N -3.95 0.52 -0.26 0.81 7.27 -0.16 -4.58 117.38 117.04 1fy2 n GLN 27 Ca -0.02 -0.13 0.01 0.00 0.07 0.00 0.00 57.00 56.93 1fy2 n GLN 27 Cb 0.38 -1.49 0.13 0.00 2.41 0.00 0.00 30.24 31.68 1fy2 n GLN 27 CO 0.00 0.00 0.00 -0.07 0.07 0.00 0.00 177.06 177.06 1fy2 h LEU 28 N 0.00 0.59 -1.08 1.69 3.38 -0.98 -3.46 115.31 115.44 1fy2 h LEU 28 Ca 0.00 0.04 -0.47 0.00 0.09 0.00 0.00 57.88 57.55 1fy2 h LEU 28 Cb 0.81 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.47 1fy2 h LEU 28 CO 0.00 0.36 -0.77 -3.20 0.09 0.00 0.00 178.44 174.92 1fy2 n ASN 29 N -4.78 -4.39 0.00 -0.43 4.05 -1.26 -1.83 115.26 106.62 1fy2 n ASN 29 Ca 0.11 -0.78 0.00 0.00 0.45 0.00 0.00 54.58 54.36 1fy2 n ASN 29 Cb 0.23 -3.93 0.00 0.00 1.23 0.00 0.00 39.78 37.31 1fy2 n ASN 29 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1fy2 n GLY 30 N -1.69 1.20 3.76 8.20 0.00 -1.26 -5.04 105.19 110.36 1fy2 n GLY 30 Ca -0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 1fy2 n GLY 30 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1fy2 s ARG 31 N -0.56 3.77 0.00 1.61 0.52 -0.76 -4.96 118.95 118.58 1fy2 s ARG 31 Ca 0.00 2.19 0.00 0.00 -0.52 0.00 0.00 55.73 57.40 1fy2 s ARG 31 Cb 0.00 -2.63 0.00 0.00 0.52 0.00 0.00 34.95 32.84 1fy2 s ARG 31 CO 0.00 -0.66 0.00 -2.13 0.02 0.00 0.00 175.30 172.53 1fy2 n ARG 32 N -0.16 0.00 -2.63 3.54 0.63 -1.26 -4.67 116.66 112.11 1fy2 n ARG 32 Ca 0.05 0.00 -0.43 0.00 -0.92 0.00 0.00 57.85 56.55 1fy2 n ARG 32 Cb 0.44 -0.53 -0.02 0.00 0.45 0.00 0.00 32.46 32.79 1fy2 n ARG 32 CO 0.00 0.00 0.00 -1.54 -2.51 0.00 0.00 177.63 173.58 1fy2 s SER 33 N -4.50 7.11 0.02 6.15 1.04 -1.26 -0.25 113.70 122.00 1fy2 s SER 33 Ca 0.00 1.46 0.06 0.00 0.48 0.00 0.00 55.95 57.95 1fy2 s SER 33 Cb 0.00 -2.54 -0.02 0.00 0.10 0.00 0.00 66.02 63.56 1fy2 s SER 33 CO 0.00 -0.63 -0.18 0.00 0.98 0.00 0.00 173.24 173.41 1fy2 s ALA 34 N 2.95 1.51 -0.10 5.32 0.00 -0.04 -0.59 121.76 130.81 1fy2 s ALA 34 Ca 0.47 -0.88 0.00 0.00 0.00 0.00 0.00 51.96 51.55 1fy2 s ALA 34 Cb -0.17 -0.32 -0.02 0.00 0.00 0.00 0.00 23.12 22.60 1fy2 s ALA 34 CO 0.10 0.34 -0.09 0.14 0.00 0.00 0.00 175.76 176.25 1fy2 s VAL 35 N -0.64 3.46 -0.18 0.00 -7.23 -0.58 -1.30 120.40 113.94 1fy2 s VAL 35 Ca 0.06 -0.55 -0.08 0.00 -1.81 0.00 0.00 61.98 59.61 1fy2 s VAL 35 Cb -0.08 -2.43 -0.04 0.00 0.56 0.00 0.00 36.38 34.39 1fy2 s VAL 35 CO 0.01 0.56 0.08 0.12 -0.31 0.00 0.00 175.10 175.55 1fy2 s PHE 36 N -0.30 3.30 -0.42 2.82 2.19 0.16 -0.97 117.98 124.76 1fy2 s PHE 36 Ca 0.04 0.16 -0.12 0.00 0.33 0.00 0.00 56.93 57.33 1fy2 s PHE 36 Cb -0.13 -2.07 0.06 0.00 -1.31 0.00 0.00 43.02 39.57 1fy2 s PHE 36 CO 0.03 0.24 0.30 0.42 1.83 0.00 0.00 175.22 178.03 1fy2 s ILE 37 N 0.22 4.77 -2.73 3.12 -1.09 0.59 -1.01 121.20 125.07 1fy2 s ILE 37 Ca 0.05 -1.06 0.26 0.00 -2.23 0.00 0.00 60.65 57.67 1fy2 s ILE 37 Cb -0.12 -3.80 0.36 0.00 -1.58 0.00 0.00 42.46 37.32 1fy2 s ILE 37 CO -0.00 -0.44 1.49 -0.81 -1.23 0.00 0.00 174.94 173.95 1fy2 n PRO 38 N 5.06 1.97 0.32 2.79 -0.04 -1.26 -2.50 135.00 141.34 1fy2 n PRO 38 Ca -0.11 -1.44 0.19 0.00 -0.04 0.00 0.00 63.50 62.10 1fy2 n PRO 38 Cb 0.44 -1.47 1.04 0.00 -0.04 0.00 0.00 33.50 33.47 1fy2 n PRO 38 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 1fy2 h PHE 39 N 3.51 0.00 0.00 0.54 0.05 -1.92 -0.00 116.94 119.12 1fy2 h PHE 39 Ca 0.00 0.00 -0.07 0.00 3.82 0.00 0.00 57.97 61.72 1fy2 h PHE 39 Cb 0.75 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 38.69 1fy2 h PHE 39 CO 0.00 0.00 -0.33 0.00 -0.18 0.00 0.00 178.31 177.80 1fy2 h ALA 40 N 1.77 1.09 -2.72 2.45 0.00 -1.80 -3.30 119.26 116.75 1fy2 h ALA 40 Ca 0.00 -0.30 -0.53 0.00 0.00 0.00 0.00 54.91 54.09 1fy2 h ALA 40 Cb 0.23 -0.05 0.06 0.00 0.00 0.00 0.00 17.79 18.02 1fy2 h ALA 40 CO 0.00 0.41 0.80 0.20 0.00 0.00 0.00 179.25 180.66 1fy2 s GLY 41 N -4.32 2.13 0.05 0.00 0.00 -0.02 -0.24 107.32 104.92 1fy2 s GLY 41 Ca -0.01 1.36 -0.00 0.00 0.00 0.00 0.00 44.72 46.07 1fy2 s GLY 41 CO 0.67 2.39 -0.01 -0.62 0.00 0.00 0.00 173.10 175.53 1fy2 n VAL 42 N 2.71 0.73 0.59 1.40 0.31 -1.26 -4.85 118.33 117.97 1fy2 n VAL 42 Ca 0.09 0.23 0.13 0.00 -0.01 0.00 0.00 64.34 64.77 1fy2 n VAL 42 Cb 0.40 -1.57 0.34 0.00 -0.91 0.00 0.00 33.84 32.10 1fy2 n VAL 42 CO 0.00 0.00 0.00 0.74 -1.32 0.00 0.00 176.83 176.25 1fy2 h THR 43 N -0.03 0.00 -3.59 2.52 2.02 -2.02 -3.45 112.91 108.36 1fy2 h THR 43 Ca -0.01 -0.51 -0.67 0.00 0.77 0.00 0.00 66.41 65.99 1fy2 h THR 43 Cb 0.45 1.42 -0.18 0.00 -1.74 0.00 0.00 68.15 68.10 1fy2 h THR 43 CO -0.00 0.00 -0.79 -1.58 0.37 0.00 0.00 175.52 173.52 1fy2 s GLN 44 N -3.12 1.83 0.55 6.66 0.74 -1.26 -5.11 119.66 119.95 1fy2 s GLN 44 Ca 0.09 -1.19 -0.18 0.00 0.05 0.00 0.00 55.36 54.13 1fy2 s GLN 44 Cb 0.12 -2.12 -0.05 0.00 1.10 0.00 0.00 33.01 32.05 1fy2 s GLN 44 CO 0.63 0.47 1.07 0.95 -0.55 0.00 0.00 175.29 177.86 1fy2 s THR 45 N -1.24 3.59 0.30 -0.34 -4.23 -1.26 -4.90 115.64 107.56 1fy2 s THR 45 Ca 0.19 0.89 0.04 0.00 -1.18 0.00 0.00 61.69 61.63 1fy2 s THR 45 Cb -0.10 -3.35 0.08 0.00 1.34 0.00 0.00 72.50 70.46 1fy2 s THR 45 CO 0.11 -0.32 1.75 -0.50 -0.54 0.00 0.00 174.62 175.12 1fy2 h TRP 46 N 0.96 0.46 0.01 3.99 6.55 -1.90 -0.77 115.95 125.24 1fy2 h TRP 46 Ca -0.48 -0.09 0.02 0.00 0.95 0.00 0.00 58.89 59.28 1fy2 h TRP 46 Cb 1.23 -0.11 -0.03 0.00 -0.86 0.00 0.00 29.16 29.39 1fy2 h TRP 46 CO 0.56 0.63 -0.13 -0.44 -1.05 0.00 0.00 178.44 178.01 1fy2 h ASP 47 N 0.36 -0.38 0.06 -3.49 5.19 -1.98 -1.23 116.42 114.96 1fy2 h ASP 47 Ca 0.06 0.05 -0.09 0.00 -0.62 0.00 0.00 57.03 56.43 1fy2 h ASP 47 Cb 0.64 0.16 -0.01 0.00 0.18 0.00 0.00 39.33 40.30 1fy2 h ASP 47 CO 0.05 -0.19 -0.27 -0.08 -3.12 0.00 0.00 179.24 175.63 1fy2 h GLU 48 N -0.23 0.33 -0.96 3.56 4.81 -1.88 -2.87 114.58 117.35 1fy2 h GLU 48 Ca 0.04 -0.12 0.00 0.00 -0.13 0.00 0.00 59.36 59.15 1fy2 h GLU 48 Cb 0.28 -0.02 -0.05 0.00 0.63 0.00 0.00 28.75 29.59 1fy2 h GLU 48 CO -0.12 0.58 0.60 -0.92 -0.73 0.00 0.00 179.01 178.42 1fy2 h TYR 49 N 0.30 1.24 -0.20 0.92 -0.00 -0.49 -2.63 116.97 116.11 1fy2 h TYR 49 Ca 0.04 0.01 0.03 0.00 -0.00 0.00 0.00 58.73 58.82 1fy2 h TYR 49 Cb 0.64 -0.41 -0.01 0.00 -0.00 0.00 0.00 36.73 36.94 1fy2 h TYR 49 CO 0.01 0.81 0.13 1.15 -0.00 0.00 0.00 178.16 180.26 1fy2 h THR 50 N 1.31 0.97 -0.30 1.81 2.02 -1.00 -3.30 112.91 114.43 1fy2 h THR 50 Ca 0.35 -0.04 -0.16 0.00 0.77 0.00 0.00 66.41 67.33 1fy2 h THR 50 Cb -0.10 0.83 -0.00 0.00 -1.74 0.00 0.00 68.15 67.14 1fy2 h THR 50 CO -0.07 0.02 -0.42 0.44 0.37 0.00 0.00 175.52 175.86 1fy2 h ASP 51 N 0.13 0.89 -0.81 4.18 3.32 -1.55 -2.74 116.42 119.83 1fy2 h ASP 51 Ca 0.08 -0.50 0.04 0.00 0.02 0.00 0.00 57.03 56.67 1fy2 h ASP 51 Cb 0.18 -0.25 -0.05 0.00 0.22 0.00 0.00 39.33 39.42 1fy2 h ASP 51 CO -0.01 1.22 0.52 0.11 -1.72 0.00 0.00 179.24 179.35 1fy2 h LYS 52 N 0.59 0.97 0.08 3.56 1.57 -1.68 0.88 116.57 122.54 1fy2 h LYS 52 Ca 0.03 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1fy2 h LYS 52 Cb 1.02 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 33.11 1fy2 h LYS 52 CO 0.10 0.64 -0.04 1.15 -0.57 0.00 0.00 179.45 180.73 1fy2 h THR 53 N 1.00 0.96 -1.00 -0.16 2.02 -1.70 -2.41 112.91 111.62 1fy2 h THR 53 Ca 0.33 -0.14 0.01 0.00 0.77 0.00 0.00 66.41 67.38 1fy2 h THR 53 Cb 0.03 1.06 -0.05 0.00 -1.74 0.00 0.00 68.15 67.44 1fy2 h THR 53 CO -0.12 0.04 0.67 0.00 0.37 0.00 0.00 175.52 176.47 1fy2 h ALA 54 N 0.75 1.29 -0.08 6.16 0.00 -1.18 -0.35 119.26 125.84 1fy2 h ALA 54 Ca -0.01 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 54.86 1fy2 h ALA 54 Cb 0.14 -0.41 -0.04 0.00 0.00 0.00 0.00 17.79 17.49 1fy2 h ALA 54 CO 0.02 0.66 -0.13 0.93 0.00 0.00 0.00 179.25 180.73 1fy2 h GLU 55 N 1.36 -0.18 0.00 0.00 5.08 -0.66 0.66 114.58 120.84 1fy2 h GLU 55 Ca 0.37 0.01 -0.12 0.00 -1.00 0.00 0.00 59.36 58.62 1fy2 h GLU 55 Cb -0.15 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.12 1fy2 h GLU 55 CO -0.08 -0.12 -0.78 -0.24 -1.00 0.00 0.00 179.01 176.79 1fy2 h VAL 56 N -0.18 0.77 0.00 3.13 3.04 -1.28 -3.35 116.25 118.38 1fy2 h VAL 56 Ca 0.07 -2.17 -0.14 0.00 -1.01 0.00 0.00 66.70 63.45 1fy2 h VAL 56 Cb 0.29 2.31 -0.02 0.00 -2.01 0.00 0.00 31.29 31.85 1fy2 h VAL 56 CO -0.19 0.44 -1.45 0.18 -1.01 0.00 0.00 177.57 175.54 1fy2 n LEU 57 N -3.13 0.75 -0.22 3.16 4.77 -0.15 -4.31 117.00 117.86 1fy2 n LEU 57 Ca -0.01 0.32 0.01 0.00 -0.03 0.00 0.00 56.01 56.30 1fy2 n LEU 57 Cb 0.77 0.07 0.13 0.00 -2.33 0.00 0.00 43.42 42.06 1fy2 n LEU 57 CO 0.41 0.10 0.99 0.00 -1.33 0.00 0.00 177.39 177.57 1fy2 h ALA 58 N 1.53 0.85 0.00 -1.18 0.00 0.28 -0.04 119.26 120.70 1fy2 h ALA 58 Ca -0.15 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1fy2 h ALA 58 Cb 1.49 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 19.35 1fy2 h ALA 58 CO 0.03 -0.19 -0.04 -1.35 0.00 0.00 0.00 179.25 177.70 1fy2 h PRO 59 N 0.42 0.00 -0.00 0.00 0.11 -1.78 0.09 132.00 130.84 1fy2 h PRO 59 Ca 0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.45 1fy2 h PRO 59 Cb 0.44 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.55 1fy2 h PRO 59 CO -0.34 0.04 -0.00 1.28 -0.21 0.00 0.00 178.00 178.77 1fy2 n LEU 60 N -3.59 0.10 0.00 2.35 4.32 -0.05 -4.87 117.00 115.25 1fy2 n LEU 60 Ca -0.02 -0.03 0.00 0.00 -0.02 0.00 0.00 56.01 55.93 1fy2 n LEU 60 Cb 0.14 -0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.94 1fy2 n LEU 60 CO 0.27 0.02 0.00 0.61 -1.22 0.00 0.00 177.39 177.06 1fy2 n GLY 61 N 1.01 0.72 3.59 -0.72 0.00 0.02 -5.01 105.19 104.80 1fy2 n GLY 61 Ca 0.24 -0.37 -0.35 0.00 0.00 0.00 0.00 46.02 45.53 1fy2 n GLY 61 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1fy2 s VAL 62 N -2.00 4.74 -0.41 1.61 1.01 -1.06 -4.31 120.40 119.97 1fy2 s VAL 62 Ca 0.00 -0.04 -0.14 0.00 0.00 0.00 0.00 61.98 61.80 1fy2 s VAL 62 Cb 0.00 -3.16 0.03 0.00 0.00 0.00 0.00 36.38 33.25 1fy2 s VAL 62 CO 0.00 0.41 0.28 0.21 0.00 0.00 0.00 175.10 176.00 1fy2 s ASN 63 N 0.79 5.98 -0.22 3.32 2.47 0.65 -3.56 114.94 124.37 1fy2 s ASN 63 Ca 0.04 -1.01 -0.12 0.00 0.42 0.00 0.00 52.86 52.19 1fy2 s ASN 63 Cb -0.13 -2.11 -0.05 0.00 -1.45 0.00 0.00 41.25 37.51 1fy2 s ASN 63 CO 0.02 -0.46 0.22 -0.69 -3.72 0.00 0.00 177.10 172.48 1fy2 s VAL 64 N 1.62 5.32 -0.07 -5.21 1.01 -1.26 -0.86 120.40 120.96 1fy2 s VAL 64 Ca 0.04 0.33 0.05 0.00 0.00 0.00 0.00 61.98 62.40 1fy2 s VAL 64 Cb -0.20 -3.56 -0.00 0.00 0.00 0.00 0.00 36.38 32.62 1fy2 s VAL 64 CO 0.08 0.33 -0.22 -0.89 0.00 0.00 0.00 175.10 174.41 1fy2 s THR 65 N 1.02 1.82 0.11 3.92 2.01 -0.42 -4.91 115.64 119.20 1fy2 s THR 65 Ca 0.11 -0.92 -0.31 0.00 0.31 0.00 0.00 61.69 60.89 1fy2 s THR 65 Cb -0.14 -1.56 -0.07 0.00 0.01 0.00 0.00 72.50 70.74 1fy2 s THR 65 CO 0.05 0.51 1.25 -0.83 -0.69 0.00 0.00 174.62 174.91 1fy2 s GLY 66 N 0.09 2.36 0.24 4.40 0.00 -1.26 -0.66 107.32 112.49 1fy2 s GLY 66 Ca -0.09 0.96 0.20 0.00 0.00 0.00 0.00 44.72 45.80 1fy2 s GLY 66 CO 0.05 2.07 1.62 4.51 0.00 0.00 0.00 173.10 181.35 1fy2 n ILE 67 N 3.50 1.00 1.33 0.90 0.13 -0.18 -0.24 119.36 125.80 1fy2 n ILE 67 Ca 0.08 0.43 0.13 0.00 -1.10 0.00 0.00 62.75 62.30 1fy2 n ILE 67 Cb 0.45 -1.38 0.40 0.00 -0.84 0.00 0.00 39.64 38.27 1fy2 n ILE 67 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 1fy2 n HIS 68 N -2.13 0.00 -0.47 9.51 1.44 -1.26 -4.01 115.22 118.30 1fy2 n HIS 68 Ca 0.01 0.00 0.06 0.00 -2.01 0.00 0.00 57.72 55.78 1fy2 n HIS 68 Cb 0.14 -0.05 0.16 0.00 0.12 0.00 0.00 29.99 30.35 1fy2 n HIS 68 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 1fy2 n ARG 69 N -0.13 2.75 -4.57 -1.40 1.74 0.66 -5.01 116.66 110.70 1fy2 n ARG 69 Ca 0.15 -2.23 -0.30 0.00 -0.77 0.00 0.00 57.85 54.70 1fy2 n ARG 69 Cb 0.37 -1.41 -0.13 0.00 -1.02 0.00 0.00 32.46 30.27 1fy2 n ARG 69 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1fy2 s VAL 70 N -1.71 2.36 0.27 1.55 -7.23 -1.23 -4.95 120.40 109.45 1fy2 s VAL 70 Ca 0.25 -1.55 0.02 0.00 -1.81 0.00 0.00 61.98 58.89 1fy2 s VAL 70 Cb 0.18 -2.00 0.06 0.00 0.56 0.00 0.00 36.38 35.17 1fy2 s VAL 70 CO 0.10 0.21 1.71 0.00 -0.31 0.00 0.00 175.10 176.80 1fy2 h ALA 71 N 4.22 1.06 -3.04 1.32 0.00 -1.95 -3.36 119.26 117.51 1fy2 h ALA 71 Ca -0.49 -0.35 -0.61 0.00 0.00 0.00 0.00 54.91 53.45 1fy2 h ALA 71 Cb 1.16 -0.12 -0.40 0.00 0.00 0.00 0.00 17.79 18.42 1fy2 h ALA 71 CO 0.42 0.57 -0.72 0.34 0.00 0.00 0.00 179.25 179.86 1fy2 s ASP 72 N -6.81 3.74 0.37 0.00 -1.08 -1.26 -4.97 116.67 106.66 1fy2 s ASP 72 Ca -0.07 -2.69 0.05 0.00 -0.52 0.00 0.00 52.55 49.32 1fy2 s ASP 72 Cb 0.14 -1.12 0.72 0.00 -1.46 0.00 0.00 42.92 41.19 1fy2 s ASP 72 CO 0.80 -0.26 2.00 1.55 0.52 0.00 0.00 175.17 179.77 1fy2 h PRO 73 N 6.69 0.65 -0.10 4.34 0.13 -1.84 0.15 132.00 142.01 1fy2 h PRO 73 Ca -0.02 -0.06 -0.01 0.00 -0.87 0.00 0.00 66.00 65.05 1fy2 h PRO 73 Cb 0.92 -0.13 -0.00 0.00 0.13 0.00 0.00 31.00 31.91 1fy2 h PRO 73 CO 0.51 0.48 0.04 1.25 -0.23 0.00 0.00 178.00 180.05 1fy2 h LEU 74 N 0.66 0.14 -1.07 1.56 5.85 -1.93 -1.19 115.31 119.33 1fy2 h LEU 74 Ca 0.17 -0.18 -0.07 0.00 0.84 0.00 0.00 57.88 58.64 1fy2 h LEU 74 Cb 0.02 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 1fy2 h LEU 74 CO -0.03 0.28 -0.09 0.00 -0.34 0.00 0.00 178.44 178.26 1fy2 h ALA 75 N 0.87 1.23 -0.63 1.25 0.00 -1.88 -1.00 119.26 119.09 1fy2 h ALA 75 Ca 0.03 -0.26 0.01 0.00 0.00 0.00 0.00 54.91 54.69 1fy2 h ALA 75 Cb 0.18 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1fy2 h ALA 75 CO -0.00 0.50 0.42 0.00 0.00 0.00 0.00 179.25 180.17 1fy2 h ALA 76 N 1.39 0.80 -0.39 0.00 0.00 -0.65 -1.17 119.26 119.24 1fy2 h ALA 76 Ca 0.10 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 1fy2 h ALA 76 Cb 0.47 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1fy2 h ALA 76 CO 0.03 0.22 0.00 0.82 0.00 0.00 0.00 179.25 180.32 1fy2 h ILE 77 N 0.85 1.26 -0.07 0.00 2.04 -0.84 -1.15 117.51 119.61 1fy2 h ILE 77 Ca 0.23 -1.00 0.01 0.00 1.00 0.00 0.00 64.86 65.10 1fy2 h ILE 77 Cb -0.09 1.13 -0.00 0.00 -0.74 0.00 0.00 36.82 37.12 1fy2 h ILE 77 CO -0.06 0.34 0.04 -0.33 0.00 0.00 0.00 178.15 178.15 1fy2 h GLU 78 N 0.52 0.06 0.00 2.37 5.08 -0.69 -2.43 114.58 119.49 1fy2 h GLU 78 Ca 0.11 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1fy2 h GLU 78 Cb 0.47 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.70 1fy2 h GLU 78 CO 0.02 0.04 -1.08 1.63 -1.00 0.00 0.00 179.01 178.62 1fy2 n LYS 79 N -4.53 0.24 -2.12 2.33 4.76 -0.49 -4.98 118.16 113.37 1fy2 n LYS 79 Ca -0.02 -0.02 -0.39 0.00 -2.87 0.00 0.00 58.31 55.01 1fy2 n LYS 79 Cb 0.10 -1.56 -0.01 0.00 -1.84 0.00 0.00 35.03 31.73 1fy2 n LYS 79 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1fy2 s ALA 80 N -3.17 3.21 -0.37 7.82 0.00 -0.45 -4.94 121.76 123.86 1fy2 s ALA 80 Ca 0.04 1.15 0.23 0.00 0.00 0.00 0.00 51.96 53.38 1fy2 s ALA 80 Cb 0.15 -3.46 0.02 0.00 0.00 0.00 0.00 23.12 19.83 1fy2 s ALA 80 CO 0.82 -0.75 1.00 0.39 0.00 0.00 0.00 175.76 177.22 1fy2 n GLU 81 N 0.07 0.48 -3.81 0.00 1.02 0.24 -4.79 120.64 113.85 1fy2 n GLU 81 Ca 0.04 0.04 -0.13 0.00 -0.02 0.00 0.00 57.16 57.09 1fy2 n GLU 81 Cb 0.45 -1.70 -0.14 0.00 -0.02 0.00 0.00 31.44 30.03 1fy2 n GLU 81 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1fy2 s ILE 82 N -3.31 -0.02 -0.17 -3.67 1.01 -0.25 -1.37 121.20 113.43 1fy2 s ILE 82 Ca 0.01 0.07 0.01 0.00 0.00 0.00 0.00 60.65 60.73 1fy2 s ILE 82 Cb 0.12 -0.17 0.01 0.00 0.01 0.00 0.00 42.46 42.44 1fy2 s ILE 82 CO 0.80 0.03 -0.18 -0.63 0.00 0.00 0.00 174.94 174.95 1fy2 s ILE 83 N 0.45 2.26 -0.15 2.92 1.01 0.21 -1.53 121.20 126.38 1fy2 s ILE 83 Ca -0.03 -0.89 0.01 0.00 0.00 0.00 0.00 60.65 59.74 1fy2 s ILE 83 Cb -0.05 -1.95 -0.00 0.00 0.01 0.00 0.00 42.46 40.47 1fy2 s ILE 83 CO -0.02 0.53 -0.16 -0.63 0.00 0.00 0.00 174.94 174.65 1fy2 s ILE 84 N 1.13 2.57 -0.21 2.92 1.01 -0.15 -0.86 121.20 127.62 1fy2 s ILE 84 Ca 0.01 -0.81 0.01 0.00 0.00 0.00 0.00 60.65 59.86 1fy2 s ILE 84 Cb -0.14 -2.07 0.04 0.00 0.01 0.00 0.00 42.46 40.30 1fy2 s ILE 84 CO -0.08 0.52 -0.11 -0.69 0.00 0.00 0.00 174.94 174.58 1fy2 s VAL 85 N 0.76 1.78 0.79 2.92 1.01 0.42 -0.30 120.40 127.78 1fy2 s VAL 85 Ca -0.07 -1.12 -0.12 0.00 0.00 0.00 0.00 61.98 60.68 1fy2 s VAL 85 Cb -0.16 -1.84 0.07 0.00 0.00 0.00 0.00 36.38 34.45 1fy2 s VAL 85 CO 0.01 0.17 1.16 -0.83 0.00 0.00 0.00 175.10 175.61 1fy2 s GLY 86 N 1.33 1.60 0.86 4.51 0.00 -1.04 -2.49 107.32 112.09 1fy2 s GLY 86 Ca -0.02 -0.59 -0.13 0.00 0.00 0.00 0.00 44.72 43.98 1fy2 s GLY 86 CO -0.08 -0.13 1.23 -0.32 0.00 0.00 0.00 173.10 173.79 1fy2 s GLY 87 N -4.53 1.68 0.00 0.20 0.00 -1.20 -3.47 107.32 99.99 1fy2 s GLY 87 Ca 0.61 -0.92 0.00 0.00 0.00 0.00 0.00 44.72 44.42 1fy2 s GLY 87 CO 0.49 -0.31 0.00 0.61 0.00 0.00 0.00 173.10 173.89 1fy2 n GLY 88 N -3.47 0.57 3.65 0.20 0.00 -1.26 -3.74 105.19 101.13 1fy2 n GLY 88 Ca 0.11 -1.42 -0.41 0.00 0.00 0.00 0.00 46.02 44.30 1fy2 n GLY 88 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1fy2 s ASN 89 N -4.00 6.75 0.26 1.61 3.84 0.66 -4.43 114.94 119.64 1fy2 s ASN 89 Ca 0.00 0.92 -0.03 0.00 0.21 0.00 0.00 52.86 53.96 1fy2 s ASN 89 Cb 0.00 -2.39 0.34 0.00 -0.55 0.00 0.00 41.25 38.65 1fy2 s ASN 89 CO 0.00 -0.39 1.82 0.74 -2.79 0.00 0.00 177.10 176.48 1fy2 h THR 90 N 5.31 1.23 -0.40 -5.21 2.02 -1.91 -1.05 112.91 112.90 1fy2 h THR 90 Ca -0.27 -0.81 -0.07 0.00 0.77 0.00 0.00 66.41 66.03 1fy2 h THR 90 Cb 1.12 0.58 -0.01 0.00 -1.74 0.00 0.00 68.15 68.09 1fy2 h THR 90 CO 0.81 0.31 -0.01 -0.26 0.37 0.00 0.00 175.52 176.74 1fy2 h PHE 91 N 0.89 0.77 -0.42 3.16 -1.00 -1.88 -1.30 116.94 117.17 1fy2 h PHE 91 Ca 0.20 -0.14 -0.10 0.00 2.81 0.00 0.00 57.97 60.74 1fy2 h PHE 91 Cb 0.27 -0.20 -0.02 0.00 3.61 0.00 0.00 35.95 39.61 1fy2 h PHE 91 CO 0.02 0.79 -0.15 0.37 -1.61 0.00 0.00 178.31 177.73 1fy2 h GLN 92 N 0.53 0.77 -0.16 1.51 4.15 -1.76 0.13 115.11 120.29 1fy2 h GLN 92 Ca 0.11 -0.27 0.01 0.00 0.77 0.00 0.00 58.65 59.27 1fy2 h GLN 92 Cb 0.49 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 28.11 1fy2 h GLN 92 CO 0.02 0.88 0.07 1.25 -1.93 0.00 0.00 178.83 179.12 1fy2 h LEU 93 N 0.69 0.10 -0.38 -2.39 5.85 -0.99 -0.83 115.31 117.37 1fy2 h LEU 93 Ca 0.11 0.01 -0.08 0.00 0.84 0.00 0.00 57.88 58.76 1fy2 h LEU 93 Cb 0.64 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.65 1fy2 h LEU 93 CO 0.04 0.08 -0.08 0.25 -0.34 0.00 0.00 178.44 178.39 1fy2 h LEU 94 N 0.16 0.73 0.07 2.25 5.85 -1.06 -1.43 115.31 121.88 1fy2 h LEU 94 Ca 0.06 -0.36 0.02 0.00 0.84 0.00 0.00 57.88 58.45 1fy2 h LEU 94 Cb 0.02 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 40.82 1fy2 h LEU 94 CO -0.05 0.92 -0.18 0.50 -0.34 0.00 0.00 178.44 179.29 1fy2 h LYS 95 N 0.54 -0.32 -0.62 1.25 3.64 -0.82 0.06 116.57 120.30 1fy2 h LYS 95 Ca 0.10 0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.46 1fy2 h LYS 95 Cb 0.59 0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.46 1fy2 h LYS 95 CO 0.04 -0.21 0.23 0.93 -2.27 0.00 0.00 179.45 178.16 1fy2 h GLU 96 N -0.33 0.95 -0.58 1.90 4.39 -1.14 0.09 114.58 119.87 1fy2 h GLU 96 Ca 0.03 -0.19 -0.02 0.00 0.34 0.00 0.00 59.36 59.53 1fy2 h GLU 96 Cb 0.37 -0.15 -0.03 0.00 -0.10 0.00 0.00 28.75 28.84 1fy2 h GLU 96 CO -0.12 0.82 0.30 0.77 -1.16 0.00 0.00 179.01 179.61 1fy2 h SER 97 N 0.88 0.74 -0.03 1.42 0.02 -1.00 -0.69 113.55 114.89 1fy2 h SER 97 Ca 0.21 -0.11 -0.01 0.00 -0.84 0.00 0.00 61.79 61.03 1fy2 h SER 97 Cb 0.24 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 62.59 1fy2 h SER 97 CO -0.01 0.64 -0.02 -0.09 -1.14 0.00 0.00 176.83 176.21 1fy2 h ARG 98 N 0.78 0.07 -0.85 3.45 2.43 -0.86 0.06 114.38 119.46 1fy2 h ARG 98 Ca 0.20 -0.03 0.03 0.00 -0.81 0.00 0.00 59.98 59.37 1fy2 h ARG 98 Cb 0.08 -0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 29.58 1fy2 h ARG 98 CO -0.03 0.47 0.56 0.93 -1.51 0.00 0.00 179.97 180.39 1fy2 h GLU 99 N -0.34 1.04 0.00 0.20 5.08 -0.86 -0.55 114.58 119.16 1fy2 h GLU 99 Ca 0.01 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1fy2 h GLU 99 Cb 0.45 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.46 1fy2 h GLU 99 CO 0.00 0.69 0.00 0.54 -1.00 0.00 0.00 179.01 179.25 1fy2 n ARG 100 N -4.44 0.86 -2.11 2.33 1.74 -0.28 -4.90 116.66 109.86 1fy2 n ARG 100 Ca 0.11 0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 57.08 1fy2 n ARG 100 Cb 0.09 -1.50 -0.01 0.00 -1.02 0.00 0.00 32.46 30.02 1fy2 n ARG 100 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1fy2 n GLY 101 N 0.94 0.06 0.00 -0.13 0.00 -0.21 -4.93 105.19 100.92 1fy2 n GLY 101 Ca 0.21 -0.46 0.07 0.00 0.00 0.00 0.00 46.02 45.85 1fy2 n GLY 101 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1fy2 n LEU 102 N -1.48 0.70 0.44 0.99 4.77 -0.01 -4.51 117.00 117.90 1fy2 n LEU 102 Ca -0.12 -0.47 -0.18 0.00 -0.03 0.00 0.00 56.01 55.20 1fy2 n LEU 102 Cb 0.57 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.57 1fy2 n LEU 102 CO 0.15 0.17 0.50 0.25 -1.33 0.00 0.00 177.39 177.14 1fy2 h LEU 103 N 0.00 -0.94 -0.67 2.23 5.85 -1.83 -0.92 115.31 119.03 1fy2 h LEU 103 Ca 0.00 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.72 1fy2 h LEU 103 Cb 0.39 0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.63 1fy2 h LEU 103 CO 0.00 -0.61 0.34 0.00 -0.34 0.00 0.00 178.44 177.83 1fy2 h ALA 104 N -1.15 0.86 -0.93 1.25 0.00 -1.91 -2.29 119.26 115.09 1fy2 h ALA 104 Ca -0.11 -0.12 0.05 0.00 0.00 0.00 0.00 54.91 54.72 1fy2 h ALA 104 Cb 0.86 -0.26 -0.06 0.00 0.00 0.00 0.00 17.79 18.33 1fy2 h ALA 104 CO 0.19 0.39 0.61 -1.35 0.00 0.00 0.00 179.25 179.09 1fy2 h PRO 105 N 0.92 1.09 -0.30 0.00 0.11 -1.77 0.17 132.00 132.22 1fy2 h PRO 105 Ca 0.23 -0.07 -0.03 0.00 0.11 0.00 0.00 66.00 66.25 1fy2 h PRO 105 Cb 0.08 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 30.93 1fy2 h PRO 105 CO -0.03 0.72 0.08 0.52 -0.21 0.00 0.00 178.00 179.08 1fy2 h MET 106 N 1.12 0.47 -0.66 1.05 2.86 -0.87 -0.53 114.93 118.37 1fy2 h MET 106 Ca 0.38 -0.11 -0.02 0.00 -2.06 0.00 0.00 59.70 57.89 1fy2 h MET 106 Cb 0.10 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 31.66 1fy2 h MET 106 CO -0.13 0.53 0.32 0.00 1.06 0.00 0.00 176.91 178.69 1fy2 h ALA 107 N 0.92 0.85 -0.65 6.32 0.00 -0.87 -1.88 119.26 123.94 1fy2 h ALA 107 Ca 0.09 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 54.88 1fy2 h ALA 107 Cb 0.27 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 1fy2 h ALA 107 CO -0.00 0.41 0.42 -0.44 0.00 0.00 0.00 179.25 179.64 1fy2 h ASP 108 N 0.91 0.71 -0.40 0.00 3.32 -0.48 -0.32 116.42 120.16 1fy2 h ASP 108 Ca 0.23 -0.01 -0.12 0.00 0.02 0.00 0.00 57.03 57.14 1fy2 h ASP 108 Cb 0.11 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.48 1fy2 h ASP 108 CO -0.03 0.51 -0.21 -0.09 -1.72 0.00 0.00 179.24 177.70 1fy2 h ARG 109 N 0.84 0.89 -0.45 3.56 9.65 -0.78 -0.38 114.38 127.72 1fy2 h ARG 109 Ca 0.25 -0.37 -0.12 0.00 -1.10 0.00 0.00 59.98 58.64 1fy2 h ARG 109 Cb -0.05 -0.04 -0.01 0.00 -1.39 0.00 0.00 29.97 28.48 1fy2 h ARG 109 CO -0.08 1.02 -0.21 0.28 2.80 0.00 0.00 179.97 183.78 1fy2 h VAL 110 N 0.78 1.27 -0.37 0.20 2.07 -1.11 -2.07 116.25 117.02 1fy2 h VAL 110 Ca 0.11 -1.36 0.02 0.00 0.82 0.00 0.00 66.70 66.28 1fy2 h VAL 110 Cb 0.75 1.19 -0.02 0.00 -1.52 0.00 0.00 31.29 31.70 1fy2 h VAL 110 CO 0.06 0.46 0.25 0.11 0.02 0.00 0.00 177.57 178.47 1fy2 h LYS 111 N 0.77 0.42 -0.15 1.57 1.57 -0.63 -0.89 116.57 119.23 1fy2 h LYS 111 Ca 0.10 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 1fy2 h LYS 111 Cb 0.78 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.99 1fy2 h LYS 111 CO 0.06 0.28 0.00 0.54 -0.57 0.00 0.00 179.45 179.76 1fy2 n ARG 112 N -4.48 1.34 0.00 3.15 1.74 -0.19 -4.88 116.66 113.33 1fy2 n ARG 112 Ca 0.03 -0.52 0.00 0.00 -0.77 0.00 0.00 57.85 56.59 1fy2 n ARG 112 Cb 0.12 -1.11 0.00 0.00 -1.02 0.00 0.00 32.46 30.44 1fy2 n ARG 112 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1fy2 n GLY 113 N 0.73 1.57 3.77 -0.13 0.00 -0.34 -5.04 105.19 105.75 1fy2 n GLY 113 Ca 0.05 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.72 1fy2 n GLY 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fy2 s ALA 114 N -2.01 2.69 -0.04 4.61 0.00 -0.82 -4.86 121.76 121.33 1fy2 s ALA 114 Ca 0.00 0.83 -0.28 0.00 0.00 0.00 0.00 51.96 52.51 1fy2 s ALA 114 Cb 0.00 -3.36 -0.03 0.00 0.00 0.00 0.00 23.12 19.73 1fy2 s ALA 114 CO 0.00 -0.78 0.93 -1.17 0.00 0.00 0.00 175.76 174.74 1fy2 s LEU 115 N -3.80 4.33 -0.20 0.00 2.96 -0.47 -4.50 118.68 117.00 1fy2 s LEU 115 Ca 0.73 1.53 -0.07 0.00 -0.22 0.00 0.00 54.13 56.09 1fy2 s LEU 115 Cb -0.24 -3.46 -0.04 0.00 0.50 0.00 0.00 46.19 42.95 1fy2 s LEU 115 CO 0.27 -0.27 0.07 -0.47 -1.32 0.00 0.00 176.35 174.62 1fy2 s TYR 116 N 1.20 3.20 -0.15 5.38 5.04 -0.56 -0.62 117.35 130.85 1fy2 s TYR 116 Ca 0.48 -0.04 0.01 0.00 -2.44 0.00 0.00 57.07 55.08 1fy2 s TYR 116 Cb -0.20 -2.12 0.02 0.00 0.35 0.00 0.00 41.96 40.01 1fy2 s TYR 116 CO 0.24 0.02 -0.18 0.42 -1.34 0.00 0.00 175.55 174.71 1fy2 s ILE 117 N 0.70 1.80 -0.02 3.14 1.01 -0.04 -0.49 121.20 127.30 1fy2 s ILE 117 Ca 0.03 -0.80 -0.03 0.00 0.00 0.00 0.00 60.65 59.85 1fy2 s ILE 117 Cb -0.13 -1.63 0.00 0.00 0.01 0.00 0.00 42.46 40.71 1fy2 s ILE 117 CO 0.02 0.50 0.08 -0.83 0.00 0.00 0.00 174.94 174.71 1fy2 s GLY 118 N 1.17 -0.01 0.08 6.18 0.00 -0.47 -0.44 107.32 113.84 1fy2 s GLY 118 Ca -0.00 0.07 0.07 0.00 0.00 0.00 0.00 44.72 44.86 1fy2 s GLY 118 CO -0.07 0.02 -0.19 0.66 0.00 0.00 0.00 173.10 173.52 1fy2 s TRP 119 N -0.39 1.61 0.00 1.90 -2.14 -1.04 -0.60 118.94 118.28 1fy2 s TRP 119 Ca -0.05 -0.42 0.00 0.00 2.66 0.00 0.00 56.10 58.30 1fy2 s TRP 119 Cb -0.03 -0.90 0.00 0.00 -3.10 0.00 0.00 33.47 29.44 1fy2 s TRP 119 CO 0.00 0.14 0.00 0.45 -2.66 0.00 0.00 176.95 174.88 1fy2 n SER 120 N 1.30 0.00 -0.29 -2.66 2.88 -0.37 -0.62 113.62 113.86 1fy2 n SER 120 Ca -0.19 0.00 0.17 0.00 -1.33 0.00 0.00 58.87 57.52 1fy2 n SER 120 Cb 0.54 0.00 0.44 0.00 -0.75 0.00 0.00 64.21 64.44 1fy2 n SER 120 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1fy2 h ALA 121 N -0.75 2.02 0.00 -1.46 0.00 -1.80 0.20 119.26 117.48 1fy2 h ALA 121 Ca 0.00 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 1fy2 h ALA 121 Cb 0.00 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1fy2 h ALA 121 CO 0.00 -0.34 -0.22 0.78 0.00 0.00 0.00 179.25 179.47 1fy2 h GLY 122 N 0.54 0.00 1.11 0.00 0.00 -0.89 -0.98 103.07 102.85 1fy2 h GLY 122 Ca 0.52 0.00 -0.23 0.00 0.00 0.00 0.00 47.33 47.61 1fy2 h GLY 122 CO -0.25 0.00 -0.89 0.00 0.00 0.00 0.00 176.54 175.40 1fy2 h ALA 123 N 1.78 0.15 -0.75 3.60 0.00 -0.70 -3.24 119.26 120.10 1fy2 h ALA 123 Ca -0.00 -0.65 0.07 0.00 0.00 0.00 0.00 54.91 54.34 1fy2 h ALA 123 Cb 0.51 0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.28 1fy2 h ALA 123 CO 0.03 0.61 0.42 -0.91 0.00 0.00 0.00 179.25 179.40 1fy2 h ASN 124 N 0.32 0.62 0.09 0.00 -0.26 -0.79 -2.57 115.58 113.00 1fy2 h ASN 124 Ca -0.10 0.04 -0.01 0.00 -0.56 0.00 0.00 56.30 55.67 1fy2 h ASN 124 Cb 1.55 -0.08 -0.00 0.00 -1.06 0.00 0.00 38.32 38.72 1fy2 h ASN 124 CO 0.18 0.38 -0.03 0.25 -1.06 0.00 0.00 177.43 177.15 1fy2 h LEU 125 N 0.75 0.00 -0.74 1.61 5.85 -1.23 -1.76 115.31 119.79 1fy2 h LEU 125 Ca 0.35 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.07 1fy2 h LEU 125 Cb 0.26 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.29 1fy2 h LEU 125 CO -0.21 0.03 0.00 0.00 -0.34 0.00 0.00 178.44 177.92 1fy2 h ALA 126 N 1.97 1.00 -2.05 1.25 0.00 -1.51 -0.02 119.26 119.91 1fy2 h ALA 126 Ca -0.00 0.00 -0.45 0.00 0.00 0.00 0.00 54.91 54.46 1fy2 h ALA 126 Cb 0.08 0.00 0.16 0.00 0.00 0.00 0.00 17.79 18.03 1fy2 h ALA 126 CO 0.00 0.00 0.42 0.00 0.00 0.00 0.00 179.25 179.67 1fy2 h PRO 128 N -1.65 0.61 -4.13 0.00 0.11 -1.79 -0.11 132.00 125.05 1fy2 h PRO 128 Ca -0.44 -0.14 -0.20 0.00 0.11 0.00 0.00 66.00 65.33 1fy2 h PRO 128 Cb 1.24 -0.08 -0.11 0.00 0.11 0.00 0.00 31.00 32.16 1fy2 h PRO 128 CO 0.39 0.63 -0.30 0.95 -0.21 0.00 0.00 178.00 179.45 1fy2 s THR 129 N -4.99 0.00 -0.34 -1.15 -4.23 -1.26 -0.86 115.64 102.81 1fy2 s THR 129 Ca -0.08 -1.67 0.09 0.00 -1.18 0.00 0.00 61.69 58.86 1fy2 s THR 129 Cb 0.15 -2.43 0.74 0.00 1.34 0.00 0.00 72.50 72.30 1fy2 s THR 129 CO 0.78 0.00 1.82 2.30 -0.54 0.00 0.00 174.62 178.98 1fy2 n ILE 130 N -0.42 2.97 0.27 2.99 -5.35 -0.24 -4.62 119.36 114.96 1fy2 n ILE 130 Ca 0.01 -1.69 0.08 0.00 -0.27 0.00 0.00 62.75 60.88 1fy2 n ILE 130 Cb 0.63 -0.37 0.38 0.00 -1.74 0.00 0.00 39.64 38.54 1fy2 n ILE 130 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1fy2 n ARG 131 N -0.27 0.10 -0.50 6.28 1.74 -1.26 -2.17 116.66 120.58 1fy2 n ARG 131 Ca 0.43 0.47 0.08 0.00 -0.77 0.00 0.00 57.85 58.05 1fy2 n ARG 131 Cb 1.42 -1.75 0.28 0.00 -1.02 0.00 0.00 32.46 31.39 1fy2 n ARG 131 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1fy2 n THR 132 N -1.95 2.20 -2.37 0.55 -2.24 -1.26 -5.00 114.28 104.21 1fy2 n THR 132 Ca 0.01 -1.67 -0.34 0.00 -2.27 0.00 0.00 64.05 59.79 1fy2 n THR 132 Cb 0.12 -0.15 -0.02 0.00 -2.10 0.00 0.00 70.33 68.18 1fy2 n THR 132 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1fy2 s THR 133 N -2.56 3.69 -2.36 4.28 -1.32 -0.92 -4.41 115.64 112.04 1fy2 s THR 133 Ca 0.43 0.99 0.25 0.00 -1.21 0.00 0.00 61.69 62.15 1fy2 s THR 133 Cb 0.33 -3.40 0.25 0.00 -1.51 0.00 0.00 72.50 68.16 1fy2 s THR 133 CO 0.12 -0.29 1.41 0.59 -2.21 0.00 0.00 174.62 174.23 1fy2 n ASN 134 N -1.30 1.95 -4.79 8.08 3.02 -1.26 -4.99 115.26 115.97 1fy2 n ASN 134 Ca 0.09 -1.51 -0.32 0.00 -0.03 0.00 0.00 54.58 52.82 1fy2 n ASN 134 Cb 0.52 0.15 0.05 0.00 -0.61 0.00 0.00 39.78 39.89 1fy2 n ASN 134 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1fy2 s ASP 135 N -2.23 5.21 0.29 6.41 1.01 -1.26 -5.03 116.67 121.07 1fy2 s ASP 135 Ca 0.27 1.79 -0.24 0.00 0.71 0.00 0.00 52.55 55.07 1fy2 s ASP 135 Cb 0.20 -2.52 -0.09 0.00 1.01 0.00 0.00 42.92 41.51 1fy2 s ASP 135 CO 0.43 -1.56 0.88 -0.32 0.21 0.00 0.00 175.17 174.81 1fy2 s MET 136 N -4.60 4.51 -1.36 8.23 1.75 -1.26 -4.95 119.30 121.61 1fy2 s MET 136 Ca 0.62 1.20 -0.15 0.00 -1.25 0.00 0.00 55.69 56.11 1fy2 s MET 136 Cb -0.16 -2.86 0.01 0.00 2.84 0.00 0.00 34.83 34.66 1fy2 s MET 136 CO 0.48 0.33 2.18 -0.35 -0.65 0.00 0.00 175.02 177.01 1fy2 n PRO 137 N 0.69 2.67 0.25 4.11 -0.04 -1.26 -4.73 135.00 136.69 1fy2 n PRO 137 Ca 0.00 -2.51 0.15 0.00 -0.04 0.00 0.00 63.50 61.09 1fy2 n PRO 137 Cb 0.50 -3.25 0.49 0.00 -0.04 0.00 0.00 33.50 31.21 1fy2 n PRO 137 CO 0.00 0.00 0.00 -0.84 -0.04 0.00 0.00 175.50 174.62 1fy2 h ILE 138 N 4.11 0.09 -3.41 0.52 3.07 -1.97 -3.43 117.51 116.48 1fy2 h ILE 138 Ca 0.55 -0.77 -0.13 0.00 1.55 0.00 0.00 64.86 66.05 1fy2 h ILE 138 Cb 0.65 1.71 -0.20 0.00 -0.27 0.00 0.00 36.82 38.71 1fy2 h ILE 138 CO 1.89 0.04 -0.43 0.68 -1.05 0.00 0.00 178.15 179.28 1fy2 s VAL 139 N -3.51 0.08 -0.29 0.16 -7.23 -1.26 -5.07 120.40 103.28 1fy2 s VAL 139 Ca 0.03 -0.67 -0.23 0.00 -1.81 0.00 0.00 61.98 59.30 1fy2 s VAL 139 Cb 0.08 -0.53 -0.00 0.00 0.56 0.00 0.00 36.38 36.48 1fy2 s VAL 139 CO 0.60 -0.37 0.76 -0.62 -0.31 0.00 0.00 175.10 175.15 1fy2 s ASP 140 N -1.47 6.67 0.00 4.85 3.68 -1.26 -4.67 116.67 124.47 1fy2 s ASP 140 Ca -0.13 0.72 0.31 0.00 2.13 0.00 0.00 52.55 55.58 1fy2 s ASP 140 Cb -0.06 -2.39 1.67 0.00 -1.45 0.00 0.00 42.92 40.68 1fy2 s ASP 140 CO 0.02 -0.54 2.11 -0.81 0.13 0.00 0.00 175.17 176.07 1fy2 n PRO 141 N 6.06 0.82 -3.17 4.34 -0.04 -1.26 -4.85 135.00 136.89 1fy2 n PRO 141 Ca 0.03 -0.08 -0.14 0.00 -0.04 0.00 0.00 63.50 63.27 1fy2 n PRO 141 Cb 0.48 -1.50 0.07 0.00 -0.04 0.00 0.00 33.50 32.52 1fy2 n PRO 141 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1fy2 n ASN 142 N -1.03 -3.55 0.00 3.54 3.02 -1.26 -4.44 115.26 111.54 1fy2 n ASN 142 Ca 0.20 -0.57 0.00 0.00 -0.03 0.00 0.00 54.58 54.17 1fy2 n ASN 142 Cb 0.18 -4.59 0.00 0.00 -0.61 0.00 0.00 39.78 34.77 1fy2 n ASN 142 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1fy2 n GLY 143 N -1.17 3.72 0.47 7.41 0.00 -1.26 -4.96 105.19 109.41 1fy2 n GLY 143 Ca -0.18 -1.47 0.12 0.00 0.00 0.00 0.00 46.02 44.49 1fy2 n GLY 143 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1fy2 n PHE 144 N -0.32 0.00 -2.07 1.61 0.99 -1.26 -4.94 117.46 111.47 1fy2 n PHE 144 Ca 0.00 0.00 -0.40 0.00 -0.00 0.00 0.00 57.45 57.05 1fy2 n PHE 144 Cb 0.00 -0.03 -0.01 0.00 -1.00 0.00 0.00 39.48 38.43 1fy2 n PHE 144 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 1fy2 s ASP 145 N -2.40 6.60 0.00 4.37 1.01 -1.26 -1.08 116.67 123.90 1fy2 s ASP 145 Ca 0.22 2.72 0.00 0.00 0.71 0.00 0.00 52.55 56.20 1fy2 s ASP 145 Cb 0.19 -2.65 0.00 0.00 1.01 0.00 0.00 42.92 41.47 1fy2 s ASP 145 CO 0.51 -0.66 0.00 0.00 0.21 0.00 0.00 175.17 175.23 1fy2 n ALA 146 N 0.57 0.00 0.19 5.23 0.00 -0.04 -4.85 120.51 121.61 1fy2 n ALA 146 Ca 0.01 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.51 1fy2 n ALA 146 Cb 0.42 0.00 0.36 0.00 0.00 0.00 0.00 19.45 20.23 1fy2 n ALA 146 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1fy2 h LEU 147 N 0.00 0.00 1.12 0.00 3.38 -0.94 -3.47 115.31 115.40 1fy2 h LEU 147 Ca 0.00 0.00 -0.40 0.00 0.09 0.00 0.00 57.88 57.57 1fy2 h LEU 147 Cb 0.00 0.00 0.05 0.00 0.09 0.00 0.00 40.66 40.80 1fy2 h LEU 147 CO 0.00 0.37 -0.59 -0.67 0.09 0.00 0.00 178.44 177.64 1fy2 n ASP 148 N -3.60 -6.05 -0.01 -0.43 4.64 -0.06 -4.85 116.55 106.19 1fy2 n ASP 148 Ca -0.01 -0.26 -0.15 0.00 -1.38 0.00 0.00 54.79 52.99 1fy2 n ASP 148 Cb 0.48 -4.87 -0.14 0.00 -1.04 0.00 0.00 41.12 35.55 1fy2 n ASP 148 CO 0.00 0.00 0.00 0.18 -0.82 0.00 0.00 177.20 176.56 1fy2 n LEU 149 N -3.87 1.76 -4.46 -2.67 4.77 0.28 -4.80 117.00 108.00 1fy2 n LEU 149 Ca -0.12 0.29 -0.34 0.00 -0.03 0.00 0.00 56.01 55.81 1fy2 n LEU 149 Cb 0.62 -0.47 -0.13 0.00 -2.33 0.00 0.00 43.42 41.11 1fy2 n LEU 149 CO 0.45 0.63 -0.36 0.12 -1.33 0.00 0.00 177.39 176.90 1fy2 s PHE 150 N -2.57 2.99 -0.57 -1.77 2.19 -0.35 -5.03 117.98 112.86 1fy2 s PHE 150 Ca -0.14 -0.42 0.25 0.00 0.33 0.00 0.00 56.93 56.94 1fy2 s PHE 150 Cb 0.07 -1.98 0.92 0.00 -1.31 0.00 0.00 43.02 40.73 1fy2 s PHE 150 CO 0.79 -0.14 1.74 -0.35 1.83 0.00 0.00 175.22 179.09 1fy2 n PRO 151 N 3.76 0.22 -3.95 10.12 -0.04 -1.26 -3.57 135.00 140.28 1fy2 n PRO 151 Ca -0.17 0.35 -0.21 0.00 -0.04 0.00 0.00 63.50 63.42 1fy2 n PRO 151 Cb 0.52 -1.85 -0.02 0.00 -0.04 0.00 0.00 33.50 32.11 1fy2 n PRO 151 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1fy2 s LEU 152 N -4.50 4.29 -0.14 1.53 1.43 -1.26 -4.74 118.68 115.30 1fy2 s LEU 152 Ca 0.07 0.05 -0.18 0.00 -1.03 0.00 0.00 54.13 53.03 1fy2 s LEU 152 Cb 0.10 -2.85 -0.04 0.00 0.03 0.00 0.00 46.19 43.44 1fy2 s LEU 152 CO 0.47 -0.09 0.50 -1.10 0.23 0.00 0.00 176.35 176.36 1fy2 s GLN 153 N -3.99 4.30 -0.17 1.70 -1.52 -0.40 -4.50 119.66 115.08 1fy2 s GLN 153 Ca 0.35 0.45 -0.07 0.00 -1.95 0.00 0.00 55.36 54.14 1fy2 s GLN 153 Cb -0.09 -3.48 -0.04 0.00 -0.22 0.00 0.00 33.01 29.18 1fy2 s GLN 153 CO 0.29 0.06 0.07 0.42 -0.25 0.00 0.00 175.29 175.87 1fy2 s ILE 154 N 0.95 4.84 -0.49 1.08 1.01 -1.26 0.04 121.20 127.37 1fy2 s ILE 154 Ca 0.26 -0.02 -0.07 0.00 0.00 0.00 0.00 60.65 60.82 1fy2 s ILE 154 Cb -0.15 -3.16 0.13 0.00 0.01 0.00 0.00 42.46 39.28 1fy2 s ILE 154 CO 0.10 0.49 0.34 0.21 0.00 0.00 0.00 174.94 176.08 1fy2 s ASN 155 N 0.15 5.58 0.98 3.58 3.84 0.89 -4.64 114.94 125.31 1fy2 s ASN 155 Ca 0.05 -2.11 -0.15 0.00 0.21 0.00 0.00 52.86 50.86 1fy2 s ASN 155 Cb -0.12 -1.95 0.18 0.00 -0.55 0.00 0.00 41.25 38.81 1fy2 s ASN 155 CO 0.00 -0.61 1.18 -2.16 -2.79 0.00 0.00 177.10 172.73 1fy2 s PRO 156 N 1.05 0.59 -1.39 0.43 0.04 -1.26 -1.21 135.00 133.25 1fy2 s PRO 156 Ca 0.09 0.04 -0.08 0.00 0.04 0.00 0.00 61.00 61.09 1fy2 s PRO 156 Cb -0.24 -1.80 0.05 0.00 0.04 0.00 0.00 34.50 32.56 1fy2 s PRO 156 CO -0.02 -2.52 0.57 0.72 0.04 0.00 0.00 177.00 175.79 1fy2 n HIS 157 N -3.94 -1.90 -2.15 0.56 8.25 -0.88 -4.82 115.22 110.34 1fy2 n HIS 157 Ca 0.10 0.53 -0.42 0.00 -0.26 0.00 0.00 57.72 57.67 1fy2 n HIS 157 Cb 0.59 -3.52 -0.03 0.00 1.12 0.00 0.00 29.99 28.15 1fy2 n HIS 157 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 1fy2 s PHE 158 N -3.04 3.20 -0.22 4.41 5.36 -0.64 -4.78 117.98 122.27 1fy2 s PHE 158 Ca 0.40 1.07 -0.27 0.00 -0.96 0.00 0.00 56.93 57.16 1fy2 s PHE 158 Cb -0.20 -3.69 0.08 0.00 -0.34 0.00 0.00 43.02 38.88 1fy2 s PHE 158 CO 0.49 -2.27 0.78 -0.08 -1.46 0.00 0.00 175.22 172.68 1fy2 s THR 159 N 0.46 0.00 0.08 0.12 -1.32 -1.26 -4.31 115.64 109.42 1fy2 s THR 159 Ca 0.60 0.00 0.05 0.00 -1.21 0.00 0.00 61.69 61.13 1fy2 s THR 159 Cb -0.38 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 69.57 1fy2 s THR 159 CO 0.36 0.00 -0.03 0.21 -2.21 0.00 0.00 174.62 172.96 1fy2 s ASN 160 N -0.10 4.87 -0.07 8.08 2.47 -1.26 -4.55 114.94 124.38 1fy2 s ASN 160 Ca -0.02 -0.21 -0.32 0.00 0.42 0.00 0.00 52.86 52.73 1fy2 s ASN 160 Cb -0.04 -1.12 0.12 0.00 -1.45 0.00 0.00 41.25 38.77 1fy2 s ASN 160 CO 0.02 0.19 1.20 0.28 -3.72 0.00 0.00 177.10 175.07 1fy2 s THR 170 N -1.26 0.00 0.16 -5.21 -1.32 -1.26 -4.91 115.64 101.84 1fy2 s THR 170 Ca 0.24 -0.16 -0.15 0.00 -1.21 0.00 0.00 61.69 60.42 1fy2 s THR 170 Cb -0.12 -1.53 0.04 0.00 -1.51 0.00 0.00 72.50 69.39 1fy2 s THR 170 CO 0.16 0.00 1.79 -0.09 -2.21 0.00 0.00 174.62 174.27 1fy2 h ARG 171 N 2.00 0.67 -0.73 7.08 9.65 -2.00 -1.14 114.38 129.91 1fy2 h ARG 171 Ca -0.21 -0.06 -0.02 0.00 -1.10 0.00 0.00 59.98 58.59 1fy2 h ARG 171 Cb 1.19 -0.14 -0.03 0.00 -1.39 0.00 0.00 29.97 29.60 1fy2 h ARG 171 CO 0.26 0.49 0.38 1.49 2.80 0.00 0.00 179.97 185.39 1fy2 h GLU 172 N 0.66 1.03 -0.75 0.20 4.81 -1.91 -1.03 114.58 117.59 1fy2 h GLU 172 Ca 0.18 -0.13 -0.04 0.00 -0.13 0.00 0.00 59.36 59.24 1fy2 h GLU 172 Cb -0.00 -0.20 -0.03 0.00 0.63 0.00 0.00 28.75 29.15 1fy2 h GLU 172 CO -0.03 0.77 0.29 1.96 -0.73 0.00 0.00 179.01 181.27 1fy2 h GLN 173 N 1.03 1.11 -0.57 1.92 4.20 -1.81 0.23 115.11 121.22 1fy2 h GLN 173 Ca 0.26 -0.20 -0.06 0.00 0.06 0.00 0.00 58.65 58.71 1fy2 h GLN 173 Cb 0.06 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 27.64 1fy2 h GLN 173 CO -0.04 0.90 0.11 0.00 -0.67 0.00 0.00 178.83 179.14 1fy2 h ARG 174 N 1.08 0.93 -0.65 1.46 3.08 -0.54 -1.85 114.38 117.89 1fy2 h ARG 174 Ca 0.25 -0.24 -0.06 0.00 0.07 0.00 0.00 59.98 60.01 1fy2 h ARG 174 Cb 0.21 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 30.12 1fy2 h ARG 174 CO -0.02 0.88 0.18 0.82 -1.07 0.00 0.00 179.97 180.76 1fy2 h ILE 175 N 0.82 1.25 -0.27 2.04 2.04 -0.66 -2.43 117.51 120.29 1fy2 h ILE 175 Ca 0.17 -0.87 -0.04 0.00 1.00 0.00 0.00 64.86 65.12 1fy2 h ILE 175 Cb 0.39 0.56 -0.02 0.00 -0.74 0.00 0.00 36.82 37.01 1fy2 h ILE 175 CO 0.01 0.34 -0.01 0.03 0.00 0.00 0.00 178.15 178.52 1fy2 h ARG 176 N 0.96 0.41 -0.52 2.37 2.47 -0.12 -0.96 114.38 118.99 1fy2 h ARG 176 Ca 0.21 -0.08 -0.08 0.00 -1.26 0.00 0.00 59.98 58.77 1fy2 h ARG 176 Cb 0.31 -0.07 -0.02 0.00 -1.65 0.00 0.00 29.97 28.54 1fy2 h ARG 176 CO -0.00 0.45 0.01 0.93 0.56 0.00 0.00 179.97 181.91 1fy2 h GLU 177 N 0.40 0.90 -0.90 0.04 5.08 -0.89 -2.12 114.58 117.10 1fy2 h GLU 177 Ca 0.09 -0.28 0.05 0.00 -1.00 0.00 0.00 59.36 58.21 1fy2 h GLU 177 Cb 0.28 -0.08 -0.06 0.00 0.50 0.00 0.00 28.75 29.38 1fy2 h GLU 177 CO 0.01 0.92 0.58 1.25 -1.00 0.00 0.00 179.01 180.77 1fy2 h LEU 178 N 0.77 0.94 -1.37 1.33 5.85 -0.96 -1.94 115.31 119.93 1fy2 h LEU 178 Ca 0.15 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.87 1fy2 h LEU 178 Cb 0.51 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.34 1fy2 h LEU 178 CO 0.02 0.63 0.00 -0.07 -0.34 0.00 0.00 178.44 178.68 1fy2 h LEU 179 N 1.09 0.00 0.00 2.25 3.38 -0.64 0.14 115.31 121.53 1fy2 h LEU 179 Ca 0.37 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.24 1fy2 h LEU 179 Cb 0.08 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.83 1fy2 h LEU 179 CO -0.14 0.00 -0.40 0.58 0.09 0.00 0.00 178.44 178.57 1fy2 h VAL 180 N 0.00 1.50 0.00 1.22 2.07 -0.72 -2.79 116.25 117.53 1fy2 h VAL 180 Ca 0.00 -2.02 -0.05 0.00 0.82 0.00 0.00 66.70 65.45 1fy2 h VAL 180 Cb 0.33 2.72 -0.01 0.00 -1.52 0.00 0.00 31.29 32.81 1fy2 h VAL 180 CO 0.00 0.57 -0.23 -0.37 0.02 0.00 0.00 177.57 177.55 1fy2 h VAL 181 N -0.35 0.40 -2.16 2.57 -1.51 -1.16 -3.37 116.25 110.67 1fy2 h VAL 181 Ca -0.05 -1.57 -0.58 0.00 -1.23 0.00 0.00 66.70 63.28 1fy2 h VAL 181 Cb 1.14 2.20 -0.39 0.00 -2.13 0.00 0.00 31.29 32.11 1fy2 h VAL 181 CO 0.08 0.23 -0.98 0.00 -1.23 0.00 0.00 177.57 175.67 1fy2 n ALA 182 N -2.16 2.82 0.18 5.19 0.00 0.43 -4.98 120.51 121.99 1fy2 n ALA 182 Ca 0.03 -3.60 0.10 0.00 0.00 0.00 0.00 53.44 49.96 1fy2 n ALA 182 Cb 0.63 -0.82 0.49 0.00 0.00 0.00 0.00 19.45 19.74 1fy2 n ALA 182 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1fy2 n PRO 183 N 1.65 0.13 0.00 0.00 -0.04 -1.05 -2.42 135.00 133.26 1fy2 n PRO 183 Ca 0.24 0.58 0.13 0.00 -0.04 0.00 0.00 63.50 64.42 1fy2 n PRO 183 Cb 0.49 -1.88 0.42 0.00 -0.04 0.00 0.00 33.50 32.49 1fy2 n PRO 183 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 1fy2 n GLU 184 N -2.14 0.54 -2.73 0.54 0.00 -1.26 -4.36 120.64 111.23 1fy2 n GLU 184 Ca -0.01 -0.27 -0.33 0.00 0.00 0.00 0.00 57.16 56.55 1fy2 n GLU 184 Cb 0.06 -1.49 -0.06 0.00 0.00 0.00 0.00 31.44 29.94 1fy2 n GLU 184 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 1fy2 s LEU 185 N -2.65 3.87 -0.19 -1.84 1.43 -1.01 -5.03 118.68 113.26 1fy2 s LEU 185 Ca 0.21 1.64 -0.02 0.00 -1.03 0.00 0.00 54.13 54.94 1fy2 s LEU 185 Cb 0.19 -4.51 -0.01 0.00 0.03 0.00 0.00 46.19 41.89 1fy2 s LEU 185 CO 0.56 -0.41 -0.09 -0.89 0.23 0.00 0.00 176.35 175.75 1fy2 s THR 186 N -2.28 3.11 -0.15 5.49 2.01 -1.26 -4.36 115.64 118.20 1fy2 s THR 186 Ca 0.61 -0.60 -0.01 0.00 0.31 0.00 0.00 61.69 61.99 1fy2 s THR 186 Cb -0.09 -2.37 -0.02 0.00 0.01 0.00 0.00 72.50 70.03 1fy2 s THR 186 CO 0.17 0.47 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.79 1fy2 s VAL 187 N 1.07 3.29 -0.29 3.82 1.01 -0.43 -1.27 120.40 127.60 1fy2 s VAL 187 Ca 0.00 -0.57 -0.09 0.00 0.00 0.00 0.00 61.98 61.33 1fy2 s VAL 187 Cb -0.15 -2.41 -0.01 0.00 0.00 0.00 0.00 36.38 33.81 1fy2 s VAL 187 CO -0.02 0.50 0.13 -0.63 0.00 0.00 0.00 175.10 175.08 1fy2 s ILE 188 N 0.50 4.47 -0.76 2.22 1.01 0.11 -0.44 121.20 128.30 1fy2 s ILE 188 Ca -0.07 -0.39 -0.24 0.00 0.00 0.00 0.00 60.65 59.96 1fy2 s ILE 188 Cb -0.15 -3.24 0.06 0.00 0.01 0.00 0.00 42.46 39.14 1fy2 s ILE 188 CO 0.04 0.13 1.14 -0.83 0.00 0.00 0.00 174.94 175.42 1fy2 s GLY 189 N 1.60 1.26 -0.44 6.18 0.00 0.10 -0.07 107.32 115.96 1fy2 s GLY 189 Ca 0.05 -1.85 -0.18 0.00 0.00 0.00 0.00 44.72 42.74 1fy2 s GLY 189 CO 0.05 2.32 0.48 -2.27 0.00 0.00 0.00 173.10 173.68 1fy2 s LEU 190 N 4.55 4.93 0.73 0.66 2.96 -0.35 -1.90 118.68 130.27 1fy2 s LEU 190 Ca 0.30 -0.75 -0.11 0.00 -0.22 0.00 0.00 54.13 53.35 1fy2 s LEU 190 Cb -0.11 -2.40 0.03 0.00 0.50 0.00 0.00 46.19 44.21 1fy2 s LEU 190 CO 0.07 -0.66 1.08 -2.16 -1.32 0.00 0.00 176.35 173.36 1fy2 s PRO 191 N 2.22 2.58 0.49 0.98 0.04 -1.26 -1.63 135.00 138.42 1fy2 s PRO 191 Ca 0.13 1.10 -0.23 0.00 0.04 0.00 0.00 61.00 62.03 1fy2 s PRO 191 Cb -0.18 -1.94 -0.07 0.00 0.04 0.00 0.00 34.50 32.35 1fy2 s PRO 191 CO 0.13 -1.39 1.32 0.39 0.04 0.00 0.00 177.00 177.49 1fy2 n GLU 192 N -3.27 1.84 0.00 4.56 1.02 -1.26 -1.90 120.64 121.63 1fy2 n GLU 192 Ca 0.09 0.66 0.00 0.00 -0.02 0.00 0.00 57.16 57.89 1fy2 n GLU 192 Cb 0.53 -2.51 0.00 0.00 -0.02 0.00 0.00 31.44 29.45 1fy2 n GLU 192 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1fy2 n GLY 193 N 0.77 1.96 3.85 0.62 0.00 -1.26 -4.76 105.19 106.36 1fy2 n GLY 193 Ca 0.08 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.88 1fy2 n GLY 193 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1fy2 s ASN 194 N -1.75 4.88 0.28 1.61 -0.87 -0.80 -4.35 114.94 113.94 1fy2 s ASN 194 Ca 0.00 -0.86 -0.21 0.00 -1.57 0.00 0.00 52.86 50.22 1fy2 s ASN 194 Cb 0.00 -0.47 0.02 0.00 -0.02 0.00 0.00 41.25 40.78 1fy2 s ASN 194 CO 0.00 -0.67 0.73 -1.66 -2.57 0.00 0.00 177.10 172.92 1fy2 s TRP 195 N -2.53 -0.19 -0.11 2.20 -2.14 -0.33 -1.48 118.94 114.37 1fy2 s TRP 195 Ca 0.46 -0.27 0.00 0.00 2.66 0.00 0.00 56.10 58.95 1fy2 s TRP 195 Cb -0.02 0.71 0.02 0.00 -3.10 0.00 0.00 33.47 31.09 1fy2 s TRP 195 CO 0.26 -1.23 -0.09 0.42 -2.66 0.00 0.00 176.95 173.65 1fy2 s ILE 196 N -3.91 1.10 -0.23 0.66 1.01 0.29 -1.04 121.20 119.08 1fy2 s ILE 196 Ca 0.11 -0.36 -0.04 0.00 0.00 0.00 0.00 60.65 60.36 1fy2 s ILE 196 Cb -0.06 -1.08 -0.01 0.00 0.01 0.00 0.00 42.46 41.32 1fy2 s ILE 196 CO 0.07 0.37 -0.03 -1.58 0.00 0.00 0.00 174.94 173.77 1fy2 s GLN 197 N 1.47 3.34 -0.28 2.79 0.74 0.10 -0.83 119.66 127.00 1fy2 s GLN 197 Ca 0.01 -0.65 -0.08 0.00 0.05 0.00 0.00 55.36 54.68 1fy2 s GLN 197 Cb -0.13 -3.04 -0.02 0.00 1.10 0.00 0.00 33.01 30.92 1fy2 s GLN 197 CO -0.06 -0.22 0.10 0.08 -0.55 0.00 0.00 175.29 174.64 1fy2 s VAL 198 N 1.48 4.39 -0.15 1.34 1.01 0.65 -0.84 120.40 128.28 1fy2 s VAL 198 Ca 0.05 -0.32 -0.21 0.00 0.00 0.00 0.00 61.98 61.51 1fy2 s VAL 198 Cb -0.15 -3.14 0.05 0.00 0.00 0.00 0.00 36.38 33.14 1fy2 s VAL 198 CO -0.03 0.21 0.54 -0.55 0.00 0.00 0.00 175.10 175.27 1fy2 s SER 199 N 1.60 -0.53 -1.55 3.32 0.15 -0.04 -1.08 113.70 115.58 1fy2 s SER 199 Ca 0.05 0.87 -0.08 0.00 0.70 0.00 0.00 55.95 57.49 1fy2 s SER 199 Cb -0.16 0.89 0.07 0.00 -1.71 0.00 0.00 66.02 65.10 1fy2 s SER 199 CO 0.05 -0.31 0.55 -3.20 1.20 0.00 0.00 173.24 171.52 1fy2 n ASN 200 N 2.20 -1.53 -2.61 5.45 5.15 -1.26 -1.79 115.26 120.86 1fy2 n ASN 200 Ca -0.16 -1.03 -0.11 0.00 -0.60 0.00 0.00 54.58 52.68 1fy2 n ASN 200 Cb 0.56 -2.81 0.06 0.00 -0.53 0.00 0.00 39.78 37.06 1fy2 n ASN 200 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1fy2 n GLY 201 N -1.78 -0.14 3.51 8.20 0.00 -1.26 -5.04 105.19 108.67 1fy2 n GLY 201 Ca -0.14 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.84 1fy2 n GLY 201 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1fy2 s GLN 202 N -4.75 0.41 -0.34 1.61 2.00 -0.74 -5.12 119.66 112.72 1fy2 s GLN 202 Ca 0.05 0.99 -0.12 0.00 -2.00 0.00 0.00 55.36 54.28 1fy2 s GLN 202 Cb -0.01 0.55 -0.00 0.00 0.80 0.00 0.00 33.01 34.35 1fy2 s GLN 202 CO 0.48 -0.13 0.22 0.00 -0.50 0.00 0.00 175.29 175.35 1fy2 s ALA 203 N 2.49 3.40 -0.07 1.58 0.00 -1.26 -0.86 121.76 127.04 1fy2 s ALA 203 Ca -0.04 -1.47 0.06 0.00 0.00 0.00 0.00 51.96 50.50 1fy2 s ALA 203 Cb -0.08 -2.60 -0.01 0.00 0.00 0.00 0.00 23.12 20.44 1fy2 s ALA 203 CO -0.18 -1.06 -0.25 0.08 0.00 0.00 0.00 175.76 174.35 1fy2 s VAL 204 N 1.66 2.07 0.22 0.00 1.01 -0.02 -1.10 120.40 124.24 1fy2 s VAL 204 Ca 0.05 -1.05 -0.27 0.00 0.00 0.00 0.00 61.98 60.71 1fy2 s VAL 204 Cb -0.18 -1.75 -0.09 0.00 0.00 0.00 0.00 36.38 34.36 1fy2 s VAL 204 CO 0.09 0.57 0.86 -0.22 0.00 0.00 0.00 175.10 176.40 1fy2 s LEU 205 N -0.04 4.55 0.09 3.92 2.96 -0.12 -0.72 118.68 129.32 1fy2 s LEU 205 Ca -0.07 1.77 -0.04 0.00 -0.22 0.00 0.00 54.13 55.57 1fy2 s LEU 205 Cb -0.15 -3.56 -0.02 0.00 0.50 0.00 0.00 46.19 42.96 1fy2 s LEU 205 CO 0.05 0.13 0.09 -0.83 -1.32 0.00 0.00 176.35 174.47 1fy2 s GLY 206 N -1.28 0.44 0.00 7.98 0.00 -0.20 -0.44 107.32 113.82 1fy2 s GLY 206 Ca 0.41 -1.03 0.00 0.00 0.00 0.00 0.00 44.72 44.10 1fy2 s GLY 206 CO 0.28 -1.10 0.00 0.61 0.00 0.00 0.00 173.10 172.88 1fy2 n GLY 207 N -0.02 3.36 0.06 0.20 0.00 -1.26 -1.18 105.19 106.35 1fy2 n GLY 207 Ca -0.12 -1.92 0.13 0.00 0.00 0.00 0.00 46.02 44.12 1fy2 n GLY 207 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1fy2 n PRO 208 N -1.08 0.29 -3.60 1.61 -0.04 -1.26 -4.60 135.00 126.32 1fy2 n PRO 208 Ca 0.00 -0.12 -0.19 0.00 -0.04 0.00 0.00 63.50 63.14 1fy2 n PRO 208 Cb 0.00 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 31.95 1fy2 n PRO 208 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1fy2 s ASN 209 N -2.80 6.01 -0.02 3.54 0.01 -1.26 -5.06 114.94 115.36 1fy2 s ASN 209 Ca 0.18 -0.15 -0.30 0.00 -0.71 0.00 0.00 52.86 51.89 1fy2 s ASN 209 Cb 0.19 -1.36 -0.03 0.00 0.41 0.00 0.00 41.25 40.46 1fy2 s ASN 209 CO 0.58 -0.35 1.04 -0.89 -1.51 0.00 0.00 177.10 175.97 1fy2 s THR 210 N -2.14 4.66 0.05 1.60 2.01 -1.26 -4.87 115.64 115.70 1fy2 s THR 210 Ca 0.42 1.92 0.01 0.00 0.31 0.00 0.00 61.69 64.35 1fy2 s THR 210 Cb -0.09 -4.23 -0.04 0.00 0.01 0.00 0.00 72.50 68.15 1fy2 s THR 210 CO 0.30 0.10 0.14 -0.89 -0.69 0.00 0.00 174.62 173.58 1fy2 s THR 211 N 1.39 4.98 0.11 -0.82 2.01 -1.22 -4.51 115.64 117.58 1fy2 s THR 211 Ca 0.52 -0.52 0.07 0.00 0.31 0.00 0.00 61.69 62.08 1fy2 s THR 211 Cb -0.22 -3.39 -0.04 0.00 0.01 0.00 0.00 72.50 68.86 1fy2 s THR 211 CO 0.25 0.17 -0.18 0.26 -0.69 0.00 0.00 174.62 174.43 1fy2 s TRP 212 N -1.41 1.64 -0.04 4.92 0.52 -0.80 -0.57 118.94 123.20 1fy2 s TRP 212 Ca 0.31 -0.45 0.05 0.00 0.02 0.00 0.00 56.10 56.03 1fy2 s TRP 212 Cb -0.13 -0.88 -0.01 0.00 -1.15 0.00 0.00 33.47 31.30 1fy2 s TRP 212 CO 0.23 0.19 -0.19 0.08 0.02 0.00 0.00 176.95 177.29 1fy2 s VAL 213 N -1.43 1.53 -0.13 4.03 1.01 -0.24 0.03 120.40 125.20 1fy2 s VAL 213 Ca 0.07 -0.78 0.02 0.00 0.00 0.00 0.00 61.98 61.28 1fy2 s VAL 213 Cb -0.09 -1.30 0.01 0.00 0.00 0.00 0.00 36.38 35.00 1fy2 s VAL 213 CO 0.04 0.44 -0.19 -0.36 0.00 0.00 0.00 175.10 175.03 1fy2 s PHE 214 N -0.08 2.35 0.12 5.22 0.40 0.41 -1.89 117.98 124.52 1fy2 s PHE 214 Ca -0.02 -1.16 0.05 0.00 -0.60 0.00 0.00 56.93 55.21 1fy2 s PHE 214 Cb -0.11 -1.64 -0.04 0.00 0.51 0.00 0.00 43.02 41.74 1fy2 s PHE 214 CO 0.02 -0.55 -0.13 0.15 0.70 0.00 0.00 175.22 175.41 1fy2 s LYS 215 N 0.89 1.01 0.14 0.44 1.02 -1.26 -1.32 119.74 120.67 1fy2 s LYS 215 Ca -0.07 -1.26 -0.32 0.00 0.02 0.00 0.00 55.97 54.34 1fy2 s LYS 215 Cb -0.15 -0.83 -0.12 0.00 -0.52 0.00 0.00 37.83 36.21 1fy2 s LYS 215 CO -0.02 0.15 1.76 0.00 -0.92 0.00 0.00 175.35 176.32 1fy2 n ALA 216 N 0.44 2.15 -0.95 5.17 0.00 -1.26 -1.57 120.51 124.49 1fy2 n ALA 216 Ca -0.15 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.66 1fy2 n ALA 216 Cb 0.58 -2.52 0.00 0.00 0.00 0.00 0.00 19.45 17.51 1fy2 n ALA 216 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1fy2 n GLY 217 N 4.00 0.48 3.37 0.00 0.00 -1.26 -5.00 105.19 106.78 1fy2 n GLY 217 Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 1fy2 n GLY 217 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1fy2 s GLU 218 N -0.47 2.50 0.67 1.61 2.02 -0.61 -5.10 118.70 119.32 1fy2 s GLU 218 Ca 0.00 -0.81 -0.17 0.00 0.02 0.00 0.00 54.97 54.01 1fy2 s GLU 218 Cb 0.00 -2.26 0.00 0.00 0.10 0.00 0.00 34.13 31.97 1fy2 s GLU 218 CO 0.00 0.50 1.27 0.39 0.02 0.00 0.00 175.26 177.44 1fy2 n GLU 219 N 2.63 0.97 -1.79 1.61 -0.58 -1.26 -4.34 120.64 117.87 1fy2 n GLU 219 Ca -0.17 0.39 -0.41 0.00 -0.42 0.00 0.00 57.16 56.55 1fy2 n GLU 219 Cb 0.52 -2.50 -0.01 0.00 -0.57 0.00 0.00 31.44 28.87 1fy2 n GLU 219 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1fy2 s ALA 220 N -1.50 3.70 -0.13 0.62 0.00 -1.26 -4.79 121.76 118.39 1fy2 s ALA 220 Ca 0.81 1.56 0.01 0.00 0.00 0.00 0.00 51.96 54.34 1fy2 s ALA 220 Cb -0.37 -3.63 -0.01 0.00 0.00 0.00 0.00 23.12 19.11 1fy2 s ALA 220 CO 0.42 -0.99 -0.16 0.08 0.00 0.00 0.00 175.76 175.11 1fy2 s VAL 221 N -0.31 2.72 -0.04 0.00 1.01 -0.79 -4.94 120.40 118.05 1fy2 s VAL 221 Ca 0.60 -0.77 -0.25 0.00 0.00 0.00 0.00 61.98 61.57 1fy2 s VAL 221 Cb -0.47 -2.13 -0.04 0.00 0.00 0.00 0.00 36.38 33.74 1fy2 s VAL 221 CO 0.52 0.53 0.75 0.00 0.00 0.00 0.00 175.10 176.90 1fy2 s ALA 222 N 0.54 3.31 -0.06 5.51 0.00 -1.26 -1.08 121.76 128.72 1fy2 s ALA 222 Ca -0.10 0.22 0.00 0.00 0.00 0.00 0.00 51.96 52.08 1fy2 s ALA 222 Cb -0.16 -3.02 -0.03 0.00 0.00 0.00 0.00 23.12 19.91 1fy2 s ALA 222 CO 0.04 -0.10 -0.03 -0.51 0.00 0.00 0.00 175.76 175.16 1fy2 s LEU 223 N 0.72 3.38 0.23 0.00 1.43 0.26 -5.00 118.68 119.71 1fy2 s LEU 223 Ca 0.40 0.04 -0.00 0.00 -1.03 0.00 0.00 54.13 53.54 1fy2 s LEU 223 Cb -0.19 -1.80 -0.04 0.00 0.03 0.00 0.00 46.19 44.20 1fy2 s LEU 223 CO 0.20 0.35 0.42 -1.83 0.23 0.00 0.00 176.35 175.73 1fy2 s GLU 224 N -0.99 3.51 0.31 1.70 1.03 -1.26 -3.41 118.70 119.58 1fy2 s GLU 224 Ca 0.14 -0.36 -0.29 0.00 0.03 0.00 0.00 54.97 54.48 1fy2 s GLU 224 Cb -0.11 -2.80 -0.12 0.00 -0.80 0.00 0.00 34.13 30.29 1fy2 s GLU 224 CO 0.03 0.35 1.39 0.00 -1.33 0.00 0.00 175.26 175.70 1fy2 n ALA 225 N -0.94 1.51 0.00 -0.84 0.00 -1.26 -1.27 120.51 117.71 1fy2 n ALA 225 Ca -0.05 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.77 1fy2 n ALA 225 Cb 0.55 -2.30 0.00 0.00 0.00 0.00 0.00 19.45 17.69 1fy2 n ALA 225 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1fy2 n GLY 226 N 1.37 0.95 3.74 0.00 0.00 0.41 -5.00 105.19 106.67 1fy2 n GLY 226 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 1fy2 n GLY 226 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1fy2 n HIS 227 N -2.00 2.78 -4.15 1.61 -0.00 -0.40 -4.66 115.22 108.40 1fy2 n HIS 227 Ca 0.00 0.34 -0.35 0.00 0.46 0.00 0.00 57.72 58.18 1fy2 n HIS 227 Cb 0.00 -2.55 -0.12 0.00 -0.12 0.00 0.00 29.99 27.20 1fy2 n HIS 227 CO 0.00 0.00 0.00 1.03 0.46 0.00 0.00 176.34 177.83 1fy2 s ARG 228 N -1.01 3.68 0.00 1.57 0.52 -1.26 -0.94 118.95 121.51 1fy2 s ARG 228 Ca 0.61 -0.50 0.31 0.00 -0.52 0.00 0.00 55.73 55.63 1fy2 s ARG 228 Cb -0.51 -3.06 1.84 0.00 0.52 0.00 0.00 34.95 33.74 1fy2 s ARG 228 CO 0.54 0.10 2.16 1.19 0.02 0.00 0.00 175.30 179.31