#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fj1 s ILE 2 N 0.00 4.04 0.08 0.53 1.01 -1.26 -5.02 121.20 120.58 1fj1 s ILE 2 Ca 0.00 1.55 -0.11 0.00 0.00 0.00 0.00 60.65 62.10 1fj1 s ILE 2 Cb 0.00 -3.99 -0.06 0.00 0.01 0.00 0.00 42.46 38.42 1fj1 s ILE 2 CO 0.00 0.17 0.42 -1.58 0.00 0.00 0.00 174.94 173.95 1fj1 s GLN 3 N 0.57 3.79 -0.26 2.79 0.74 -1.26 -4.78 119.66 121.26 1fj1 s GLN 3 Ca 0.55 0.22 0.02 0.00 0.05 0.00 0.00 55.36 56.20 1fj1 s GLN 3 Cb -0.29 -3.00 0.07 0.00 1.10 0.00 0.00 33.01 30.89 1fj1 s GLN 3 CO 0.31 0.56 -0.05 -1.64 -0.55 0.00 0.00 175.29 173.91 1fj1 s MET 4 N -1.88 1.79 -0.34 1.67 -1.94 -1.26 -1.11 119.30 116.23 1fj1 s MET 4 Ca 0.33 -1.26 -0.11 0.00 -1.71 0.00 0.00 55.69 52.95 1fj1 s MET 4 Cb -0.14 -2.76 0.00 0.00 2.01 0.00 0.00 34.83 33.94 1fj1 s MET 4 CO 0.18 -0.66 0.19 -0.08 -0.01 0.00 0.00 175.02 174.64 1fj1 s THR 5 N 1.22 4.74 -0.06 2.05 -1.32 0.32 -4.13 115.64 118.46 1fj1 s THR 5 Ca -0.04 -0.51 -0.04 0.00 -1.21 0.00 0.00 61.69 59.89 1fj1 s THR 5 Cb -0.19 -3.49 -0.04 0.00 -1.51 0.00 0.00 72.50 67.27 1fj1 s THR 5 CO -0.07 -0.04 0.15 -1.58 -2.21 0.00 0.00 174.62 170.87 1fj1 s GLN 6 N 1.62 3.41 0.03 7.08 0.74 -1.26 -0.83 119.66 130.44 1fj1 s GLN 6 Ca 0.04 -0.25 -0.25 0.00 0.05 0.00 0.00 55.36 54.95 1fj1 s GLN 6 Cb -0.18 -3.11 0.06 0.00 1.10 0.00 0.00 33.01 30.88 1fj1 s GLN 6 CO 0.07 0.72 0.58 -1.54 -0.55 0.00 0.00 175.29 174.57 1fj1 s SER 7 N -1.52 -0.53 1.09 6.67 1.04 0.68 -4.49 113.70 116.63 1fj1 s SER 7 Ca 0.22 0.33 -0.18 0.00 0.48 0.00 0.00 55.95 56.80 1fj1 s SER 7 Cb -0.12 0.52 0.24 0.00 0.10 0.00 0.00 66.02 66.76 1fj1 s SER 7 CO 0.12 -0.72 1.21 -2.16 0.98 0.00 0.00 173.24 172.67 1fj1 s PRO 8 N -2.21 -0.31 0.00 4.02 0.04 -1.26 -0.26 135.00 135.02 1fj1 s PRO 8 Ca -0.06 -0.21 0.26 0.00 0.04 0.00 0.00 61.00 61.03 1fj1 s PRO 8 Cb -0.01 -1.72 0.78 0.00 0.04 0.00 0.00 34.50 33.60 1fj1 s PRO 8 CO 0.01 -3.08 1.59 -1.13 0.04 0.00 0.00 177.00 174.42 1fj1 n SER 9 N -4.28 0.54 -3.61 6.66 3.41 -1.26 -4.56 113.62 110.51 1fj1 n SER 9 Ca 0.14 -0.33 -0.15 0.00 -0.26 0.00 0.00 58.87 58.27 1fj1 n SER 9 Cb 0.59 0.07 -0.07 0.00 -0.26 0.00 0.00 64.21 64.54 1fj1 n SER 9 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1fj1 s SER 10 N -2.81 -0.73 0.04 4.04 0.15 -1.26 -1.71 113.70 111.42 1fj1 s SER 10 Ca 0.17 1.31 0.03 0.00 0.70 0.00 0.00 55.95 58.15 1fj1 s SER 10 Cb 0.18 1.29 -0.02 0.00 -1.71 0.00 0.00 66.02 65.76 1fj1 s SER 10 CO 0.60 -0.31 -0.09 -0.76 1.20 0.00 0.00 173.24 173.89 1fj1 s LEU 11 N 0.10 2.21 -0.27 3.45 1.43 0.13 -4.90 118.68 120.83 1fj1 s LEU 11 Ca -0.02 -0.47 -0.03 0.00 -1.03 0.00 0.00 54.13 52.58 1fj1 s LEU 11 Cb -0.04 -0.26 0.09 0.00 0.03 0.00 0.00 46.19 46.01 1fj1 s LEU 11 CO 0.02 -0.12 0.11 -0.55 0.23 0.00 0.00 176.35 176.04 1fj1 s SER 12 N -1.31 3.48 0.26 2.29 0.15 -1.26 -0.58 113.70 116.73 1fj1 s SER 12 Ca -0.06 -1.26 0.08 0.00 0.70 0.00 0.00 55.95 55.40 1fj1 s SER 12 Cb -0.08 -0.51 -0.05 0.00 -1.71 0.00 0.00 66.02 63.66 1fj1 s SER 12 CO 0.01 -0.41 -0.11 0.00 1.20 0.00 0.00 173.24 173.93 1fj1 s ALA 13 N 1.94 2.33 0.31 5.45 0.00 -0.67 -4.69 121.76 126.43 1fj1 s ALA 13 Ca 0.07 -1.83 -0.10 0.00 0.00 0.00 0.00 51.96 50.10 1fj1 s ALA 13 Cb -0.16 0.02 -0.07 0.00 0.00 0.00 0.00 23.12 22.90 1fj1 s ALA 13 CO -0.28 0.03 0.65 0.95 0.00 0.00 0.00 175.76 177.12 1fj1 s THR 14 N -2.90 4.84 0.48 0.00 -4.23 -1.25 0.13 115.64 112.71 1fj1 s THR 14 Ca 0.27 0.56 -0.23 0.00 -1.18 0.00 0.00 61.69 61.12 1fj1 s THR 14 Cb 0.01 -3.66 -0.08 0.00 1.34 0.00 0.00 72.50 70.10 1fj1 s THR 14 CO 0.11 -0.26 1.09 0.18 -0.54 0.00 0.00 174.62 175.21 1fj1 n LEU 15 N -0.62 3.53 0.00 4.79 4.77 -1.26 -1.82 117.00 126.39 1fj1 n LEU 15 Ca 0.01 0.98 0.00 0.00 -0.03 0.00 0.00 56.01 56.98 1fj1 n LEU 15 Cb 0.53 -1.42 0.00 0.00 -2.33 0.00 0.00 43.42 40.20 1fj1 n LEU 15 CO 0.45 -1.30 0.00 0.61 -1.33 0.00 0.00 177.39 175.82 1fj1 n GLY 16 N 1.08 2.91 3.95 -0.72 0.00 -0.13 -4.87 105.19 107.41 1fj1 n GLY 16 Ca 0.10 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.86 1fj1 n GLY 16 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1fj1 s GLY 17 N -2.00 1.74 -0.11 -0.02 0.00 -0.75 -3.86 107.32 102.32 1fj1 s GLY 17 Ca 0.00 -1.29 -0.02 0.00 0.00 0.00 0.00 44.72 43.41 1fj1 s GLY 17 CO 0.00 -0.74 -0.04 1.25 0.00 0.00 0.00 173.10 173.56 1fj1 s LYS 18 N -5.35 3.24 0.03 2.90 2.20 -1.26 -0.72 119.74 120.78 1fj1 s LYS 18 Ca 0.66 -0.52 0.08 0.00 -0.36 0.00 0.00 55.97 55.84 1fj1 s LYS 18 Cb -0.07 -2.78 -0.03 0.00 -1.51 0.00 0.00 37.83 33.45 1fj1 s LYS 18 CO 0.46 0.46 -0.24 0.14 -0.36 0.00 0.00 175.35 175.81 1fj1 s VAL 19 N -0.24 2.30 -0.06 4.02 -7.23 -0.37 -4.99 120.40 113.82 1fj1 s VAL 19 Ca 0.04 -1.29 0.02 0.00 -1.81 0.00 0.00 61.98 58.95 1fj1 s VAL 19 Cb -0.13 -1.90 0.01 0.00 0.56 0.00 0.00 36.38 34.93 1fj1 s VAL 19 CO 0.02 0.40 -0.13 -0.89 -0.31 0.00 0.00 175.10 174.19 1fj1 s THR 20 N -0.80 1.17 0.01 5.32 2.01 -1.26 -1.83 115.64 120.26 1fj1 s THR 20 Ca 0.12 -0.51 0.05 0.00 0.31 0.00 0.00 61.69 61.67 1fj1 s THR 20 Cb -0.10 -1.06 -0.03 0.00 0.01 0.00 0.00 72.50 71.32 1fj1 s THR 20 CO 0.02 0.36 -0.13 -0.63 -0.69 0.00 0.00 174.62 173.55 1fj1 s ILE 21 N 0.58 3.14 0.25 1.82 1.01 0.40 -4.71 121.20 123.69 1fj1 s ILE 21 Ca -0.13 -0.96 0.11 0.00 0.00 0.00 0.00 60.65 59.67 1fj1 s ILE 21 Cb -0.15 -2.33 -0.05 0.00 0.01 0.00 0.00 42.46 39.94 1fj1 s ILE 21 CO 0.04 0.40 -0.20 0.42 0.00 0.00 0.00 174.94 175.59 1fj1 s THR 22 N -0.92 2.36 -0.02 2.92 -4.23 0.64 -0.90 115.64 115.50 1fj1 s THR 22 Ca 0.15 -2.29 0.00 0.00 -1.18 0.00 0.00 61.69 58.37 1fj1 s THR 22 Cb -0.11 -2.22 0.02 0.00 1.34 0.00 0.00 72.50 71.54 1fj1 s THR 22 CO 0.05 -0.35 0.02 0.00 -0.54 0.00 0.00 174.62 173.80 1fj1 s LYS 24 N 0.84 2.86 0.25 0.00 2.20 -0.01 -0.97 119.74 124.91 1fj1 s LYS 24 Ca -0.07 -0.79 -0.01 0.00 -0.36 0.00 0.00 55.97 54.74 1fj1 s LYS 24 Cb -0.10 -2.38 -0.04 0.00 -1.51 0.00 0.00 37.83 33.79 1fj1 s LYS 24 CO -0.02 -0.09 0.46 0.00 -0.36 0.00 0.00 175.35 175.33 1fj1 s ALA 25 N 1.02 3.76 -2.00 3.13 0.00 0.41 -0.52 121.76 127.56 1fj1 s ALA 25 Ca -0.03 -0.81 0.21 0.00 0.00 0.00 0.00 51.96 51.33 1fj1 s ALA 25 Cb -0.15 -2.07 1.23 0.00 0.00 0.00 0.00 23.12 22.13 1fj1 s ALA 25 CO -0.06 0.28 1.69 -1.13 0.00 0.00 0.00 175.76 176.54 1fj1 n SER 26 N -1.01 0.00 -3.68 0.00 3.41 -0.27 -4.83 113.62 107.25 1fj1 n SER 26 Ca -0.04 -1.00 -0.03 0.00 -0.26 0.00 0.00 58.87 57.53 1fj1 n SER 26 Cb 0.54 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.48 1fj1 n SER 26 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1fj1 s GLN 27 N -2.00 0.93 0.23 4.33 -2.07 -1.26 -4.96 119.66 114.87 1fj1 s GLN 27 Ca 0.31 -0.48 -0.32 0.00 -1.82 0.00 0.00 55.36 53.05 1fj1 s GLN 27 Cb 0.14 0.34 -0.12 0.00 -1.09 0.00 0.00 33.01 32.27 1fj1 s GLN 27 CO 0.24 -0.42 1.60 -0.25 -1.32 0.00 0.00 175.29 175.14 1fj1 n ASP 28 N -0.42 3.57 -0.06 12.60 8.00 -1.26 -4.43 116.55 134.55 1fj1 n ASP 28 Ca -0.07 1.11 0.06 0.00 0.71 0.00 0.00 54.79 56.60 1fj1 n ASP 28 Cb 0.61 -1.53 0.08 0.00 -0.02 0.00 0.00 41.12 40.26 1fj1 n ASP 28 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11 1fj1 n ILE 29 N 2.88 1.45 -4.20 0.53 -5.35 -0.39 -4.96 119.36 109.32 1fj1 n ILE 29 Ca 0.13 -1.67 -0.30 0.00 -0.27 0.00 0.00 62.75 60.64 1fj1 n ILE 29 Cb 0.34 0.09 -0.06 0.00 -1.74 0.00 0.00 39.64 38.26 1fj1 n ILE 29 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1fj1 n ASN 30 N -1.01 0.01 -0.07 7.28 3.02 -1.26 -0.84 115.26 122.41 1fj1 n ASN 30 Ca 0.09 -1.16 -0.01 0.00 -0.03 0.00 0.00 54.58 53.47 1fj1 n ASN 30 Cb 0.49 -2.20 -0.00 0.00 -0.61 0.00 0.00 39.78 37.46 1fj1 n ASN 30 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1fj1 n LYS 31 N -4.47 -1.08 -2.43 3.52 5.02 -1.26 -4.93 118.16 112.52 1fj1 n LYS 31 Ca -0.26 0.32 -0.42 0.00 -2.02 0.00 0.00 58.31 55.93 1fj1 n LYS 31 Cb 0.66 -4.17 0.01 0.00 -0.02 0.00 0.00 35.03 31.51 1fj1 n LYS 31 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1fj1 n TYR 32 N -2.46 2.75 -4.39 2.13 4.01 -0.02 -2.63 117.16 116.55 1fj1 n TYR 32 Ca -0.01 -2.74 -0.28 0.00 -0.16 0.00 0.00 57.90 54.71 1fj1 n TYR 32 Cb 0.28 -1.79 -0.13 0.00 -0.31 0.00 0.00 39.34 37.40 1fj1 n TYR 32 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1fj1 s ILE 33 N -0.44 2.24 0.04 -0.72 1.09 -1.25 -1.49 121.20 120.66 1fj1 s ILE 33 Ca 0.39 -1.83 0.02 0.00 -1.10 0.00 0.00 60.65 58.13 1fj1 s ILE 33 Cb 0.10 -2.00 -0.02 0.00 -1.06 0.00 0.00 42.46 39.47 1fj1 s ILE 33 CO 0.01 0.01 -0.07 0.00 -0.10 0.00 0.00 174.94 174.80 1fj1 s ALA 34 N -1.27 0.48 -0.04 9.38 0.00 0.02 -1.98 121.76 128.35 1fj1 s ALA 34 Ca 0.15 -0.72 0.06 0.00 0.00 0.00 0.00 51.96 51.46 1fj1 s ALA 34 Cb -0.09 0.06 -0.01 0.00 0.00 0.00 0.00 23.12 23.08 1fj1 s ALA 34 CO 0.07 -0.04 -0.21 -1.58 0.00 0.00 0.00 175.76 173.99 1fj1 s TRP 35 N -1.36 2.02 0.17 0.00 0.52 0.15 -0.83 118.94 119.60 1fj1 s TRP 35 Ca -0.11 -0.52 0.11 0.00 0.02 0.00 0.00 56.10 55.60 1fj1 s TRP 35 Cb -0.10 -1.33 -0.04 0.00 -1.15 0.00 0.00 33.47 30.85 1fj1 s TRP 35 CO 0.00 -0.14 -0.25 0.71 0.02 0.00 0.00 176.95 177.30 1fj1 s TYR 36 N -0.21 2.25 -0.15 -1.98 1.51 -0.08 -1.48 117.35 117.20 1fj1 s TYR 36 Ca 0.00 -0.38 -0.03 0.00 -1.01 0.00 0.00 57.07 55.66 1fj1 s TYR 36 Cb -0.11 -1.15 -0.02 0.00 -0.11 0.00 0.00 41.96 40.56 1fj1 s TYR 36 CO 0.02 0.42 -0.06 -1.14 -1.11 0.00 0.00 175.55 173.68 1fj1 s GLN 37 N -2.44 3.60 -0.32 -0.62 0.74 -0.51 -1.57 119.66 118.54 1fj1 s GLN 37 Ca 0.17 -0.56 0.02 0.00 0.05 0.00 0.00 55.36 55.05 1fj1 s GLN 37 Cb -0.09 -2.86 0.09 0.00 1.10 0.00 0.00 33.01 31.26 1fj1 s GLN 37 CO 0.08 0.22 0.05 -1.58 -0.55 0.00 0.00 175.29 173.51 1fj1 s HIS 38 N 0.40 2.93 0.04 1.67 2.46 0.09 -0.79 115.29 122.10 1fj1 s HIS 38 Ca -0.05 -2.44 -0.17 0.00 0.47 0.00 0.00 55.06 52.87 1fj1 s HIS 38 Cb -0.15 -2.36 -0.06 0.00 -0.13 0.00 0.00 32.58 29.89 1fj1 s HIS 38 CO 0.03 -0.91 0.49 0.15 -2.47 0.00 0.00 174.74 172.04 1fj1 s LYS 39 N 1.19 4.06 0.13 2.88 1.02 -1.26 -2.60 119.74 125.17 1fj1 s LYS 39 Ca 0.08 0.57 -0.35 0.00 0.02 0.00 0.00 55.97 56.30 1fj1 s LYS 39 Cb -0.18 -3.23 -0.16 0.00 -0.52 0.00 0.00 37.83 33.74 1fj1 s LYS 39 CO -0.13 0.67 1.31 -0.35 -0.92 0.00 0.00 175.35 175.92 1fj1 n PRO 40 N 1.77 1.31 0.00 -1.68 -0.04 -1.26 -1.83 135.00 133.28 1fj1 n PRO 40 Ca -0.12 0.47 0.00 0.00 -0.04 0.00 0.00 63.50 63.81 1fj1 n PRO 40 Cb 0.52 -2.08 0.00 0.00 -0.04 0.00 0.00 33.50 31.90 1fj1 n PRO 40 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1fj1 n GLY 41 N 2.41 2.84 3.86 0.55 0.00 -1.26 -5.00 105.19 108.60 1fj1 n GLY 41 Ca 0.17 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.96 1fj1 n GLY 41 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fj1 s LYS 42 N -0.06 2.43 0.30 1.61 -0.14 -0.76 -5.13 119.74 118.00 1fj1 s LYS 42 Ca 0.00 -1.66 -0.08 0.00 -1.36 0.00 0.00 55.97 52.87 1fj1 s LYS 42 Cb 0.00 -2.28 -0.06 0.00 -1.68 0.00 0.00 37.83 33.81 1fj1 s LYS 42 CO 0.00 -0.27 0.62 0.20 -0.76 0.00 0.00 175.35 175.14 1fj1 s GLY 43 N -4.14 2.01 0.27 -3.33 0.00 -1.26 -4.70 107.32 96.17 1fj1 s GLY 43 Ca 0.45 -0.36 -0.30 0.00 0.00 0.00 0.00 44.72 44.51 1fj1 s GLY 43 CO 0.26 -0.22 1.28 -1.05 0.00 0.00 0.00 173.10 173.38 1fj1 n PRO 44 N -0.79 1.85 -4.14 2.90 -0.02 -1.26 -4.72 135.00 128.82 1fj1 n PRO 44 Ca 0.00 0.65 -0.34 0.00 -2.02 0.00 0.00 63.50 61.79 1fj1 n PRO 44 Cb 0.53 -2.22 -0.14 0.00 -0.02 0.00 0.00 33.50 31.66 1fj1 n PRO 44 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1fj1 s ARG 45 N -0.99 3.45 0.19 -0.52 3.52 0.03 -4.92 118.95 119.72 1fj1 s ARG 45 Ca 0.64 -0.60 -0.31 0.00 -0.13 0.00 0.00 55.73 55.32 1fj1 s ARG 45 Cb -0.66 -2.95 -0.10 0.00 -1.56 0.00 0.00 34.95 29.69 1fj1 s ARG 45 CO 0.55 -0.04 1.47 -1.17 -0.81 0.00 0.00 175.30 175.30 1fj1 s LEU 46 N 1.08 4.38 -0.03 -0.88 2.96 -1.26 -1.43 118.68 123.50 1fj1 s LEU 46 Ca 0.01 2.57 -0.01 0.00 -0.22 0.00 0.00 54.13 56.48 1fj1 s LEU 46 Cb -0.15 -3.61 -0.01 0.00 0.50 0.00 0.00 46.19 42.93 1fj1 s LEU 46 CO -0.00 -0.73 -0.03 0.18 -1.32 0.00 0.00 176.35 174.45 1fj1 n LEU 47 N 3.23 0.65 -3.92 -0.68 4.32 -0.55 -4.82 117.00 115.23 1fj1 n LEU 47 Ca 0.10 0.03 -0.20 0.00 -0.02 0.00 0.00 56.01 55.92 1fj1 n LEU 47 Cb 0.40 -0.08 -0.16 0.00 -1.62 0.00 0.00 43.42 41.96 1fj1 n LEU 47 CO 0.60 0.14 -0.42 -0.63 -1.22 0.00 0.00 177.39 175.86 1fj1 s ILE 48 N -2.05 0.59 0.26 -0.08 -1.09 -1.15 -1.55 121.20 116.12 1fj1 s ILE 48 Ca -0.04 -0.19 0.05 0.00 -2.23 0.00 0.00 60.65 58.24 1fj1 s ILE 48 Cb 0.01 -0.58 -0.06 0.00 -1.58 0.00 0.00 42.46 40.26 1fj1 s ILE 48 CO 0.05 0.22 -0.03 -1.38 -1.23 0.00 0.00 174.94 172.57 1fj1 s HIS 49 N 0.66 1.78 -1.30 3.97 -3.43 -0.28 -0.68 115.29 116.00 1fj1 s HIS 49 Ca -0.09 -0.80 -0.12 0.00 -0.80 0.00 0.00 55.06 53.25 1fj1 s HIS 49 Cb -0.12 -1.02 0.00 0.00 -1.43 0.00 0.00 32.58 30.01 1fj1 s HIS 49 CO 0.00 0.14 0.54 0.98 -2.00 0.00 0.00 174.74 174.40 1fj1 n TYR 50 N -0.51 -1.66 0.00 0.38 9.36 -1.00 -0.76 117.16 122.97 1fj1 n TYR 50 Ca -0.05 0.54 0.00 0.00 3.32 0.00 0.00 57.90 61.71 1fj1 n TYR 50 Cb 0.64 -3.43 0.00 0.00 -0.63 0.00 0.00 39.34 35.92 1fj1 n TYR 50 CO 0.00 0.00 0.00 -2.37 0.22 0.00 0.00 176.86 174.71 1fj1 n THR 51 N -4.44 0.00 -1.86 2.97 5.66 -0.84 -3.87 114.28 111.90 1fj1 n THR 51 Ca -0.21 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.79 1fj1 n THR 51 Cb 0.64 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.42 1fj1 n THR 51 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 1fj1 n SER 52 N 0.00 0.00 -4.71 1.09 3.41 -1.13 -2.80 113.62 109.48 1fj1 n SER 52 Ca 0.00 -1.26 -0.37 0.00 -0.26 0.00 0.00 58.87 56.98 1fj1 n SER 52 Cb 0.00 -0.05 -0.07 0.00 -0.26 0.00 0.00 64.21 63.83 1fj1 n SER 52 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1fj1 s THR 53 N 0.00 5.25 -0.27 6.66 2.01 0.06 -4.59 115.64 124.77 1fj1 s THR 53 Ca 0.00 0.69 -0.29 0.00 0.31 0.00 0.00 61.69 62.40 1fj1 s THR 53 Cb 0.00 -3.70 0.01 0.00 0.01 0.00 0.00 72.50 68.81 1fj1 s THR 53 CO 0.00 0.34 1.16 -0.22 -0.69 0.00 0.00 174.62 175.21 1fj1 s LEU 54 N 0.71 4.00 0.06 4.42 2.96 -1.26 -1.13 118.68 128.44 1fj1 s LEU 54 Ca 0.20 1.28 -0.31 0.00 -0.22 0.00 0.00 54.13 55.08 1fj1 s LEU 54 Cb -0.14 -3.54 -0.07 0.00 0.50 0.00 0.00 46.19 42.94 1fj1 s LEU 54 CO 0.06 -0.86 1.41 -1.58 -1.32 0.00 0.00 176.35 174.06 1fj1 s GLN 55 N 3.66 4.30 0.34 1.98 2.00 -0.60 -4.94 119.66 126.39 1fj1 s GLN 55 Ca 0.50 2.04 -0.27 0.00 -2.00 0.00 0.00 55.36 55.63 1fj1 s GLN 55 Cb -0.16 -3.43 -0.13 0.00 0.80 0.00 0.00 33.01 30.09 1fj1 s GLN 55 CO 0.15 -0.52 1.02 -2.30 -0.50 0.00 0.00 175.29 173.14 1fj1 n PRO 56 N 4.75 1.41 0.00 1.67 -0.02 -1.26 -2.98 135.00 138.56 1fj1 n PRO 56 Ca 0.13 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 62.10 1fj1 n PRO 56 Cb 0.43 -1.94 0.00 0.00 -0.02 0.00 0.00 33.50 31.97 1fj1 n PRO 56 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1fj1 n GLY 57 N 1.18 0.91 3.05 -1.23 0.00 -1.26 -5.08 105.19 102.77 1fj1 n GLY 57 Ca 0.09 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.92 1fj1 n GLY 57 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1fj1 s ASN 58 N -2.20 1.22 0.55 1.61 0.01 -1.16 -5.13 114.94 109.84 1fj1 s ASN 58 Ca 0.00 -0.24 -0.21 0.00 -0.71 0.00 0.00 52.86 51.71 1fj1 s ASN 58 Cb 0.00 -0.12 -0.05 0.00 0.41 0.00 0.00 41.25 41.50 1fj1 s ASN 58 CO 0.00 0.09 1.26 -2.16 -1.51 0.00 0.00 177.10 174.78 1fj1 s PRO 59 N -0.43 3.16 0.00 -0.60 0.04 -1.26 -4.87 135.00 131.04 1fj1 s PRO 59 Ca 0.03 1.98 0.08 0.00 0.04 0.00 0.00 61.00 63.13 1fj1 s PRO 59 Cb -0.05 -2.14 0.50 0.00 0.04 0.00 0.00 34.50 32.85 1fj1 s PRO 59 CO -0.00 -1.10 0.93 -1.13 0.04 0.00 0.00 177.00 175.74 1fj1 n SER 60 N -1.19 0.00 0.20 6.66 3.41 -1.26 -2.44 113.62 119.01 1fj1 n SER 60 Ca 0.11 -0.66 0.15 0.00 -0.26 0.00 0.00 58.87 58.21 1fj1 n SER 60 Cb 0.47 0.00 0.65 0.00 -0.26 0.00 0.00 64.21 65.08 1fj1 n SER 60 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 1fj1 h ARG 61 N 0.00 0.00 -5.79 4.33 3.08 -1.89 -3.41 114.38 110.70 1fj1 h ARG 61 Ca 0.00 0.00 -0.61 0.00 0.07 0.00 0.00 59.98 59.44 1fj1 h ARG 61 Cb 0.00 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 29.98 1fj1 h ARG 61 CO 0.00 0.00 -0.28 -0.06 -1.07 0.00 0.00 179.97 178.56 1fj1 s PHE 62 N -3.56 3.62 0.22 3.04 0.08 -1.02 -0.75 117.98 119.61 1fj1 s PHE 62 Ca 0.01 0.80 -0.14 0.00 0.12 0.00 0.00 56.93 57.72 1fj1 s PHE 62 Cb 0.09 -2.26 0.01 0.00 -0.57 0.00 0.00 43.02 40.29 1fj1 s PHE 62 CO 0.41 0.52 0.47 -1.54 -0.10 0.00 0.00 175.22 174.98 1fj1 s SER 63 N -0.54 -0.12 0.07 1.36 1.04 -0.49 -4.92 113.70 110.09 1fj1 s SER 63 Ca 0.20 -0.78 -0.10 0.00 0.48 0.00 0.00 55.95 55.76 1fj1 s SER 63 Cb -0.15 0.56 0.01 0.00 0.10 0.00 0.00 66.02 66.54 1fj1 s SER 63 CO 0.09 -1.08 0.23 -0.83 0.98 0.00 0.00 173.24 172.62 1fj1 s GLY 64 N -2.96 0.01 0.27 7.32 0.00 -1.26 0.09 107.32 110.79 1fj1 s GLY 64 Ca 0.17 -0.40 -0.19 0.00 0.00 0.00 0.00 44.72 44.30 1fj1 s GLY 64 CO 0.04 -0.60 0.64 -1.35 0.00 0.00 0.00 173.10 171.83 1fj1 s SER 65 N -2.57 -0.22 0.00 1.64 1.04 -0.18 -4.35 113.70 109.06 1fj1 s SER 65 Ca 0.01 -0.69 0.00 0.00 0.48 0.00 0.00 55.95 55.75 1fj1 s SER 65 Cb 0.02 0.68 0.00 0.00 0.10 0.00 0.00 66.02 66.83 1fj1 s SER 65 CO -0.08 -1.27 0.00 0.61 0.98 0.00 0.00 173.24 173.47 1fj1 n GLY 66 N -0.43 1.27 3.90 7.32 0.00 -1.26 -1.09 105.19 114.90 1fj1 n GLY 66 Ca -0.04 -2.19 -0.02 0.00 0.00 0.00 0.00 46.02 43.77 1fj1 n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1fj1 s SER 67 N 0.00 0.01 1.85 1.61 1.04 -0.93 -4.90 113.70 112.37 1fj1 s SER 67 Ca 0.00 -0.61 0.00 0.00 0.48 0.00 0.00 55.95 55.82 1fj1 s SER 67 Cb 0.00 0.45 0.00 0.00 0.10 0.00 0.00 66.02 66.57 1fj1 s SER 67 CO 0.00 -0.89 0.00 0.61 0.98 0.00 0.00 173.24 173.94 1fj1 n GLY 68 N -0.73 1.81 0.03 7.32 0.00 -1.26 -1.39 105.19 110.96 1fj1 n GLY 68 Ca -0.02 0.38 0.04 0.00 0.00 0.00 0.00 46.02 46.42 1fj1 n GLY 68 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fj1 n ARG 69 N 2.23 4.03 -3.90 1.61 1.74 -1.26 -1.26 116.66 119.84 1fj1 n ARG 69 Ca 0.00 -0.10 -0.35 0.00 -0.77 0.00 0.00 57.85 56.63 1fj1 n ARG 69 Cb 0.00 -0.90 -0.14 0.00 -1.02 0.00 0.00 32.46 30.41 1fj1 n ARG 69 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1fj1 s ASP 70 N -1.64 4.46 0.20 0.55 1.11 -0.49 -0.44 116.67 120.42 1fj1 s ASP 70 Ca 0.04 -0.67 0.04 0.00 0.18 0.00 0.00 52.55 52.14 1fj1 s ASP 70 Cb 0.06 -1.73 -0.05 0.00 1.07 0.00 0.00 42.92 42.27 1fj1 s ASP 70 CO 0.30 -0.10 -0.05 -0.31 1.18 0.00 0.00 175.17 176.19 1fj1 s TYR 71 N 1.41 1.47 0.05 4.23 2.02 -0.14 -2.19 117.35 124.20 1fj1 s TYR 71 Ca 0.03 -0.84 -0.11 0.00 -0.37 0.00 0.00 57.07 55.78 1fj1 s TYR 71 Cb -0.16 -0.81 0.01 0.00 -0.40 0.00 0.00 41.96 40.60 1fj1 s TYR 71 CO -0.03 0.03 0.23 -1.54 -1.57 0.00 0.00 175.55 172.67 1fj1 s SER 72 N -3.26 -0.00 -0.01 2.29 1.04 -0.25 -0.71 113.70 112.80 1fj1 s SER 72 Ca 0.24 -0.35 0.01 0.00 0.48 0.00 0.00 55.95 56.32 1fj1 s SER 72 Cb 0.04 0.32 0.00 0.00 0.10 0.00 0.00 66.02 66.48 1fj1 s SER 72 CO 0.06 -0.60 -0.02 0.12 0.98 0.00 0.00 173.24 173.78 1fj1 s PHE 73 N -2.76 0.20 0.14 5.02 5.36 -0.07 -1.01 117.98 124.85 1fj1 s PHE 73 Ca -0.04 -0.03 0.04 0.00 -0.96 0.00 0.00 56.93 55.95 1fj1 s PHE 73 Cb -0.00 -0.15 -0.04 0.00 -0.34 0.00 0.00 43.02 42.48 1fj1 s PHE 73 CO -0.05 -0.02 -0.10 -1.12 -1.46 0.00 0.00 175.22 172.47 1fj1 s SER 74 N 0.10 1.71 -0.20 6.13 0.01 0.11 -0.45 113.70 121.11 1fj1 s SER 74 Ca -0.01 -1.00 -0.01 0.00 1.31 0.00 0.00 55.95 56.24 1fj1 s SER 74 Cb -0.03 0.00 0.06 0.00 0.21 0.00 0.00 66.02 66.26 1fj1 s SER 74 CO -0.00 -0.34 -0.00 -0.63 0.41 0.00 0.00 173.24 172.67 1fj1 s ILE 75 N -3.29 0.89 0.36 1.44 1.01 -0.76 -1.40 121.20 119.45 1fj1 s ILE 75 Ca 0.15 -0.73 0.07 0.00 0.00 0.00 0.00 60.65 60.15 1fj1 s ILE 75 Cb 0.02 -1.27 -0.01 0.00 0.01 0.00 0.00 42.46 41.22 1fj1 s ILE 75 CO -0.00 -0.11 0.43 -0.94 0.00 0.00 0.00 174.94 174.32 1fj1 s SER 76 N 1.70 5.62 -1.42 3.58 1.04 0.07 -1.23 113.70 123.06 1fj1 s SER 76 Ca -0.02 -0.38 -0.02 0.00 0.48 0.00 0.00 55.95 56.01 1fj1 s SER 76 Cb -0.17 -0.97 0.02 0.00 0.10 0.00 0.00 66.02 64.99 1fj1 s SER 76 CO -0.07 -0.50 0.50 0.59 0.98 0.00 0.00 173.24 174.74 1fj1 n ASN 77 N -1.60 -0.82 -4.67 7.02 4.13 -0.85 -4.70 115.26 113.77 1fj1 n ASN 77 Ca 0.01 -0.98 -0.62 0.00 1.68 0.00 0.00 54.58 54.68 1fj1 n ASN 77 Cb 0.59 -3.19 -0.08 0.00 -1.54 0.00 0.00 39.78 35.56 1fj1 n ASN 77 CO 0.00 0.00 0.00 -0.11 0.28 0.00 0.00 177.26 177.43 1fj1 n LEU 78 N -4.40 1.32 -4.94 3.41 7.94 0.10 -4.47 117.00 115.97 1fj1 n LEU 78 Ca -0.27 1.15 -0.27 0.00 -1.11 0.00 0.00 56.01 55.51 1fj1 n LEU 78 Cb 0.66 -0.99 -0.03 0.00 0.53 0.00 0.00 43.42 43.59 1fj1 n LEU 78 CO 0.75 -0.97 -0.10 -1.61 -1.11 0.00 0.00 177.39 174.35 1fj1 s GLU 79 N 2.25 3.45 0.45 1.96 0.41 -1.26 -0.96 118.70 125.00 1fj1 s GLU 79 Ca 0.98 -0.55 0.22 0.00 -0.41 0.00 0.00 54.97 55.21 1fj1 s GLU 79 Cb -1.28 -2.98 1.20 0.00 -1.78 0.00 0.00 34.13 29.29 1fj1 s GLU 79 CO 0.69 0.53 1.86 0.00 -0.49 0.00 0.00 175.26 177.85 1fj1 h ALA 80 N 2.35 2.39 -0.24 5.21 0.00 -1.91 -1.57 119.26 125.47 1fj1 h ALA 80 Ca -0.48 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1fj1 h ALA 80 Cb 1.19 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1fj1 h ALA 80 CO 0.70 -0.67 0.00 -0.85 0.00 0.00 0.00 179.25 178.43 1fj1 n GLU 81 N -4.46 1.85 0.00 0.00 0.00 -1.21 -4.08 120.64 112.74 1fj1 n GLU 81 Ca 0.20 -1.30 0.13 0.00 0.00 0.00 0.00 57.16 56.19 1fj1 n GLU 81 Cb 0.79 -1.39 0.70 0.00 0.00 0.00 0.00 31.44 31.54 1fj1 n GLU 81 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1fj1 n ASP 82 N 0.52 0.00 -4.76 -1.84 8.00 -0.59 -4.83 116.55 113.05 1fj1 n ASP 82 Ca 0.16 -0.34 -0.41 0.00 0.71 0.00 0.00 54.79 54.91 1fj1 n ASP 82 Cb 0.36 -0.19 -0.01 0.00 -0.02 0.00 0.00 41.12 41.26 1fj1 n ASP 82 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 1fj1 s ILE 83 N -2.38 2.20 -1.78 0.53 -4.36 -1.26 -4.88 121.20 109.28 1fj1 s ILE 83 Ca 0.30 0.18 0.00 0.00 -0.26 0.00 0.00 60.65 60.87 1fj1 s ILE 83 Cb 0.18 -3.11 0.00 0.00 1.25 0.00 0.00 42.46 40.77 1fj1 s ILE 83 CO 0.36 0.03 0.00 0.00 0.24 0.00 0.00 174.94 175.58 1fj1 n ALA 84 N 1.63 0.00 -3.07 2.27 0.00 -1.21 -4.91 120.51 115.22 1fj1 n ALA 84 Ca 0.05 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.16 1fj1 n ALA 84 Cb 0.39 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.71 1fj1 n ALA 84 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1fj1 s ILE 85 N -2.34 3.59 -0.00 0.00 1.01 -1.07 -1.21 121.20 121.17 1fj1 s ILE 85 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 60.65 60.19 1fj1 s ILE 85 Cb 0.00 -2.57 -0.04 0.00 0.01 0.00 0.00 42.46 39.86 1fj1 s ILE 85 CO 0.00 0.49 0.06 -0.31 0.00 0.00 0.00 174.94 175.17 1fj1 s TYR 86 N 0.56 3.22 -0.01 3.97 1.51 0.94 -0.73 117.35 126.81 1fj1 s TYR 86 Ca -0.04 0.17 0.02 0.00 -1.01 0.00 0.00 57.07 56.21 1fj1 s TYR 86 Cb -0.15 -1.72 -0.00 0.00 -0.11 0.00 0.00 41.96 39.98 1fj1 s TYR 86 CO 0.03 0.52 -0.08 0.71 -1.11 0.00 0.00 175.55 175.63 1fj1 s TYR 87 N -1.16 0.69 0.29 2.71 2.02 -0.61 0.16 117.35 121.46 1fj1 s TYR 87 Ca 0.22 -0.13 0.01 0.00 -0.37 0.00 0.00 57.07 56.79 1fj1 s TYR 87 Cb -0.12 -0.46 -0.03 0.00 -0.40 0.00 0.00 41.96 40.95 1fj1 s TYR 87 CO 0.13 -0.02 0.48 0.00 -1.57 0.00 0.00 175.55 174.56 1fj1 s LEU 89 N -4.02 0.39 -0.05 0.00 1.98 -0.01 -1.11 118.68 115.86 1fj1 s LEU 89 Ca 0.38 0.46 -0.03 0.00 -2.89 0.00 0.00 54.13 52.06 1fj1 s LEU 89 Cb -0.10 0.61 -0.04 0.00 0.66 0.00 0.00 46.19 47.33 1fj1 s LEU 89 CO 0.33 -0.17 0.10 0.00 -1.89 0.00 0.00 176.35 174.72 1fj1 s GLN 90 N 1.40 3.23 -0.05 1.98 1.03 -0.33 -0.80 119.66 126.13 1fj1 s GLN 90 Ca -0.08 -0.34 0.25 0.00 0.04 0.00 0.00 55.36 55.23 1fj1 s GLN 90 Cb -0.11 -2.99 0.44 0.00 0.03 0.00 0.00 33.01 30.38 1fj1 s GLN 90 CO -0.08 0.70 1.16 2.48 -2.54 0.00 0.00 175.29 177.02 1fj1 n TYR 91 N 1.54 0.20 0.18 9.60 0.18 -0.56 -2.64 117.16 125.67 1fj1 n TYR 91 Ca -0.16 -0.80 0.04 0.00 1.88 0.00 0.00 57.90 58.87 1fj1 n TYR 91 Cb 0.53 -0.17 0.32 0.00 -0.38 0.00 0.00 39.34 39.65 1fj1 n TYR 91 CO 0.00 0.00 0.00 0.22 -2.08 0.00 0.00 176.86 175.00 1fj1 h ASP 92 N 1.24 0.00 -2.05 9.48 3.58 -1.83 -3.44 116.42 123.40 1fj1 h ASP 92 Ca -0.20 0.00 -0.56 0.00 0.42 0.00 0.00 57.03 56.68 1fj1 h ASP 92 Cb 1.76 0.00 -0.10 0.00 1.72 0.00 0.00 39.33 42.72 1fj1 h ASP 92 CO 0.11 0.41 -0.62 0.21 -2.88 0.00 0.00 179.24 176.48 1fj1 s ASN 93 N -6.55 4.42 0.38 2.28 2.47 -1.26 -5.03 114.94 111.64 1fj1 s ASN 93 Ca -0.01 -0.79 0.17 0.00 0.42 0.00 0.00 52.86 52.65 1fj1 s ASN 93 Cb 0.12 -0.70 0.73 0.00 -1.45 0.00 0.00 41.25 39.94 1fj1 s ASN 93 CO 0.70 -0.13 1.77 -0.07 -3.72 0.00 0.00 177.10 175.65 1fj1 h LEU 94 N 1.81 0.00 -6.13 3.21 -0.00 -1.97 -3.29 115.31 108.94 1fj1 h LEU 94 Ca -0.43 0.00 -0.74 0.00 -0.00 0.00 0.00 57.88 56.70 1fj1 h LEU 94 Cb 1.25 0.00 -0.12 0.00 -0.00 0.00 0.00 40.66 41.79 1fj1 h LEU 94 CO 0.63 0.38 2.35 0.00 -0.00 0.00 0.00 178.44 181.80 1fj1 n GLN 95 N -3.70 3.74 -1.73 1.13 1.13 -1.26 -4.98 117.38 111.72 1fj1 n GLN 95 Ca -0.01 -3.33 -0.42 0.00 -1.94 0.00 0.00 57.00 51.31 1fj1 n GLN 95 Cb 0.47 -2.90 -0.00 0.00 0.11 0.00 0.00 30.24 27.92 1fj1 n GLN 95 CO 0.00 0.00 0.00 2.89 -1.44 0.00 0.00 177.06 178.51 1fj1 n ARG 96 N 3.65 2.31 -4.21 -1.09 1.85 -1.24 -4.71 116.66 113.21 1fj1 n ARG 96 Ca 0.48 0.81 -0.19 0.00 -1.00 0.00 0.00 57.85 57.95 1fj1 n ARG 96 Cb 0.33 -2.46 -0.12 0.00 -1.05 0.00 0.00 32.46 29.16 1fj1 n ARG 96 CO 0.00 0.00 0.00 0.95 -0.01 0.00 0.00 177.63 178.57 1fj1 s THR 97 N -1.12 1.28 0.04 8.89 -4.23 -1.08 -4.97 115.64 114.44 1fj1 s THR 97 Ca 0.55 -1.43 -0.00 0.00 -1.18 0.00 0.00 61.69 59.64 1fj1 s THR 97 Cb -0.53 -1.25 -0.04 0.00 1.34 0.00 0.00 72.50 72.02 1fj1 s THR 97 CO 0.62 -0.22 0.15 -0.36 -0.54 0.00 0.00 174.62 174.27 1fj1 s PHE 98 N -1.40 3.40 0.79 3.99 0.40 -1.26 -1.18 117.98 122.72 1fj1 s PHE 98 Ca 0.02 0.23 -0.12 0.00 -0.60 0.00 0.00 56.93 56.45 1fj1 s PHE 98 Cb -0.09 -1.74 0.06 0.00 0.51 0.00 0.00 43.02 41.76 1fj1 s PHE 98 CO 0.03 0.58 1.14 0.20 0.70 0.00 0.00 175.22 177.86 1fj1 s GLY 99 N -2.19 1.61 0.22 4.36 0.00 -0.26 -4.60 107.32 106.45 1fj1 s GLY 99 Ca 0.29 -0.47 0.19 0.00 0.00 0.00 0.00 44.72 44.74 1fj1 s GLY 99 CO 0.22 -0.02 1.59 0.61 0.00 0.00 0.00 173.10 175.50 1fj1 n GLY 100 N -2.91 -1.02 0.00 0.20 0.00 -1.26 -4.69 105.19 95.51 1fj1 n GLY 100 Ca 0.07 0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1fj1 n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fj1 n GLY 101 N -0.61 1.20 2.77 -0.02 0.00 -1.26 -5.04 105.19 102.23 1fj1 n GLY 101 Ca 0.01 -1.74 -0.22 0.00 0.00 0.00 0.00 46.02 44.07 1fj1 n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1fj1 s THR 102 N -2.74 0.32 -0.21 2.61 2.01 0.12 -4.49 115.64 113.26 1fj1 s THR 102 Ca 0.00 0.15 -0.26 0.00 0.31 0.00 0.00 61.69 61.89 1fj1 s THR 102 Cb 0.00 -0.48 -0.01 0.00 0.01 0.00 0.00 72.50 72.03 1fj1 s THR 102 CO 0.00 0.24 0.88 -0.75 -0.69 0.00 0.00 174.62 174.30 1fj1 s LYS 103 N 1.91 4.25 -0.25 4.92 2.20 -0.69 -0.04 119.74 132.02 1fj1 s LYS 103 Ca 0.04 1.07 -0.08 0.00 -0.36 0.00 0.00 55.97 56.63 1fj1 s LYS 103 Cb -0.12 -3.62 -0.03 0.00 -1.51 0.00 0.00 37.83 32.55 1fj1 s LYS 103 CO -0.05 -0.47 0.10 0.08 -0.36 0.00 0.00 175.35 174.65 1fj1 s VAL 104 N 2.65 4.55 0.20 4.02 1.01 -0.35 0.17 120.40 132.66 1fj1 s VAL 104 Ca 0.38 -0.09 0.11 0.00 0.00 0.00 0.00 61.98 62.38 1fj1 s VAL 104 Cb -0.16 -3.14 -0.04 0.00 0.00 0.00 0.00 36.38 33.04 1fj1 s VAL 104 CO 0.09 0.32 -0.22 -1.61 0.00 0.00 0.00 175.10 173.68 1fj1 s GLU 105 N 1.62 1.50 -0.03 2.72 2.02 0.25 -3.28 118.70 123.50 1fj1 s GLU 105 Ca 0.06 -1.54 -0.19 0.00 0.02 0.00 0.00 54.97 53.32 1fj1 s GLU 105 Cb -0.15 -1.73 -0.05 0.00 0.10 0.00 0.00 34.13 32.30 1fj1 s GLU 105 CO 0.05 0.36 0.53 0.42 0.02 0.00 0.00 175.26 176.64 1fj1 s ILE 106 N -1.89 5.00 -0.30 -1.63 -1.09 -1.26 -1.67 121.20 118.34 1fj1 s ILE 106 Ca 0.21 1.10 -0.10 0.00 -2.23 0.00 0.00 60.65 59.63 1fj1 s ILE 106 Cb -0.07 -3.86 -0.02 0.00 -1.58 0.00 0.00 42.46 36.93 1fj1 s ILE 106 CO 0.10 0.43 0.15 -0.75 -1.23 0.00 0.00 174.94 173.64 1fj1 s LYS 107 N -0.16 3.46 0.40 2.79 2.20 0.35 -4.78 119.74 124.00 1fj1 s LYS 107 Ca 0.28 -0.64 0.05 0.00 -0.36 0.00 0.00 55.97 55.31 1fj1 s LYS 107 Cb -0.17 -3.57 -0.02 0.00 -1.51 0.00 0.00 37.83 32.56 1fj1 s LYS 107 CO 0.15 -0.36 0.19 -0.98 -0.36 0.00 0.00 175.35 173.98 1fj1 s ARG 108 N 1.64 1.94 0.54 4.03 1.04 -1.26 -3.91 118.95 122.98 1fj1 s ARG 108 Ca 0.05 -2.18 -0.20 0.00 -1.04 0.00 0.00 55.73 52.35 1fj1 s ARG 108 Cb -0.17 -0.31 -0.05 0.00 -2.04 0.00 0.00 34.95 32.38 1fj1 s ARG 108 CO 0.07 -0.58 1.21 0.00 -0.04 0.00 0.00 175.30 175.96 1fj1 s ALA 109 N -3.23 2.73 0.64 7.88 0.00 -1.26 -4.94 121.76 123.57 1fj1 s ALA 109 Ca 0.27 1.01 -0.18 0.00 0.00 0.00 0.00 51.96 53.06 1fj1 s ALA 109 Cb 0.01 -3.44 -0.02 0.00 0.00 0.00 0.00 23.12 19.68 1fj1 s ALA 109 CO 0.19 -0.99 1.17 -0.25 0.00 0.00 0.00 175.76 175.88 1fj1 n ASP 110 N -1.15 1.58 -3.75 0.00 8.00 -1.26 -4.79 116.55 115.18 1fj1 n ASP 110 Ca 0.11 0.81 -0.13 0.00 0.71 0.00 0.00 54.79 56.30 1fj1 n ASP 110 Cb 0.49 -1.50 -0.11 0.00 -0.02 0.00 0.00 41.12 39.98 1fj1 n ASP 110 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1fj1 s ALA 111 N -1.44 -0.80 0.21 2.24 0.00 0.92 -4.88 121.76 118.01 1fj1 s ALA 111 Ca 0.81 0.97 -0.19 0.00 0.00 0.00 0.00 51.96 53.55 1fj1 s ALA 111 Cb -0.39 -0.57 -0.08 0.00 0.00 0.00 0.00 23.12 22.08 1fj1 s ALA 111 CO 0.42 -0.16 0.70 0.00 0.00 0.00 0.00 175.76 176.72 1fj1 s ALA 112 N 0.35 3.43 0.58 0.00 0.00 -1.26 -1.57 121.76 123.30 1fj1 s ALA 112 Ca -0.01 0.11 -0.15 0.00 0.00 0.00 0.00 51.96 51.91 1fj1 s ALA 112 Cb -0.03 -2.77 -0.05 0.00 0.00 0.00 0.00 23.12 20.27 1fj1 s ALA 112 CO -0.01 0.35 1.03 -1.25 0.00 0.00 0.00 175.76 175.88 1fj1 s PRO 113 N -2.02 3.50 -0.34 0.00 0.04 -1.26 -4.60 135.00 130.32 1fj1 s PRO 113 Ca 0.43 1.07 -0.10 0.00 0.04 0.00 0.00 61.00 62.44 1fj1 s PRO 113 Cb -0.16 -2.06 0.01 0.00 0.04 0.00 0.00 34.50 32.33 1fj1 s PRO 113 CO 0.21 -0.66 0.17 0.99 0.04 0.00 0.00 177.00 177.75 1fj1 s THR 114 N -2.61 4.51 -0.15 1.26 2.01 -0.83 -4.85 115.64 114.98 1fj1 s THR 114 Ca 0.61 -0.66 -0.07 0.00 0.31 0.00 0.00 61.69 61.89 1fj1 s THR 114 Cb -0.14 -3.40 -0.04 0.00 0.01 0.00 0.00 72.50 68.93 1fj1 s THR 114 CO 0.38 -0.07 0.09 -0.69 -0.69 0.00 0.00 174.62 173.64 1fj1 s VAL 115 N 1.57 5.06 -0.03 3.82 1.01 -1.25 -0.75 120.40 129.82 1fj1 s VAL 115 Ca 0.03 0.05 0.01 0.00 0.00 0.00 0.00 61.98 62.08 1fj1 s VAL 115 Cb -0.18 -3.24 0.01 0.00 0.00 0.00 0.00 36.38 32.98 1fj1 s VAL 115 CO 0.06 0.53 -0.05 -0.44 0.00 0.00 0.00 175.10 175.20 1fj1 s SER 116 N -0.28 0.89 0.18 3.32 0.01 -0.25 -4.97 113.70 112.60 1fj1 s SER 116 Ca 0.09 -0.13 0.06 0.00 1.31 0.00 0.00 55.95 57.28 1fj1 s SER 116 Cb -0.12 -0.34 -0.04 0.00 0.21 0.00 0.00 66.02 65.73 1fj1 s SER 116 CO 0.01 -0.01 0.13 -0.51 0.41 0.00 0.00 173.24 173.27 1fj1 s ILE 117 N 0.58 4.40 -0.09 1.44 2.07 -1.26 -1.12 121.20 127.22 1fj1 s ILE 117 Ca -0.08 -1.16 -0.04 0.00 -1.41 0.00 0.00 60.65 57.97 1fj1 s ILE 117 Cb -0.11 -3.26 0.05 0.00 0.13 0.00 0.00 42.46 39.27 1fj1 s ILE 117 CO 0.00 -0.14 0.20 -0.36 -1.91 0.00 0.00 174.94 172.73 1fj1 s PHE 118 N -1.80 -0.25 0.80 3.50 0.08 -0.06 -4.99 117.98 115.27 1fj1 s PHE 118 Ca 0.31 0.66 -0.12 0.00 0.12 0.00 0.00 56.93 57.90 1fj1 s PHE 118 Cb -0.10 -0.05 0.08 0.00 -0.57 0.00 0.00 43.02 42.38 1fj1 s PHE 118 CO 0.23 -0.22 1.17 -1.25 -0.10 0.00 0.00 175.22 175.04 1fj1 s PRO 119 N 1.49 1.95 0.66 0.24 0.04 -1.26 -2.29 135.00 135.83 1fj1 s PRO 119 Ca -0.07 0.07 -0.17 0.00 0.04 0.00 0.00 61.00 60.87 1fj1 s PRO 119 Cb -0.11 -1.97 0.00 0.00 0.04 0.00 0.00 34.50 32.46 1fj1 s PRO 119 CO -0.07 -1.58 1.25 -2.14 0.04 0.00 0.00 177.00 174.49 1fj1 s PRO 120 N -5.56 2.50 0.63 0.56 0.02 -1.22 -4.84 135.00 127.09 1fj1 s PRO 120 Ca 0.62 1.92 -0.09 0.00 0.02 0.00 0.00 61.00 63.46 1fj1 s PRO 120 Cb -0.11 -1.86 -0.01 0.00 0.02 0.00 0.00 34.50 32.54 1fj1 s PRO 120 CO 0.49 -1.60 1.00 -1.54 -0.33 0.00 0.00 177.00 175.02 1fj1 s SER 121 N -1.64 5.82 0.07 2.53 1.04 -1.26 -4.95 113.70 115.31 1fj1 s SER 121 Ca 0.79 1.11 -0.24 0.00 0.48 0.00 0.00 55.95 58.09 1fj1 s SER 121 Cb -0.33 -2.09 -0.16 0.00 0.10 0.00 0.00 66.02 63.54 1fj1 s SER 121 CO 0.40 -1.04 1.67 0.28 0.98 0.00 0.00 173.24 175.53 1fj1 h SER 122 N -0.34 -0.03 -0.66 7.02 0.02 -2.00 -2.56 113.55 115.00 1fj1 h SER 122 Ca -0.45 -0.06 0.10 0.00 -0.84 0.00 0.00 61.79 60.53 1fj1 h SER 122 Cb 1.23 0.01 -0.07 0.00 0.14 0.00 0.00 62.40 63.70 1fj1 h SER 122 CO 0.62 0.04 0.29 1.05 -1.14 0.00 0.00 176.83 177.69 1fj1 h GLU 123 N -0.09 0.48 -0.38 3.45 9.09 -2.00 -1.45 114.58 123.68 1fj1 h GLU 123 Ca -0.00 -0.03 -0.03 0.00 0.05 0.00 0.00 59.36 59.35 1fj1 h GLU 123 Cb 0.09 -0.11 -0.02 0.00 -1.65 0.00 0.00 28.75 27.06 1fj1 h GLU 123 CO 0.01 0.32 0.11 0.37 0.05 0.00 0.00 179.01 179.86 1fj1 h GLN 124 N 0.49 0.60 -0.86 1.06 4.15 -1.85 -2.51 115.11 116.20 1fj1 h GLN 124 Ca 0.33 -0.13 0.10 0.00 0.77 0.00 0.00 58.65 59.71 1fj1 h GLN 124 Cb 0.39 -0.08 -0.07 0.00 0.21 0.00 0.00 27.48 27.92 1fj1 h GLN 124 CO -0.29 0.61 0.50 -0.07 -1.93 0.00 0.00 178.83 177.65 1fj1 h LEU 125 N 0.47 0.73 -0.80 -2.39 3.38 -1.03 0.51 115.31 116.17 1fj1 h LEU 125 Ca 0.12 0.05 0.13 0.00 0.09 0.00 0.00 57.88 58.27 1fj1 h LEU 125 Cb 0.27 -0.10 -0.09 0.00 0.09 0.00 0.00 40.66 40.83 1fj1 h LEU 125 CO -0.00 0.41 0.40 0.74 0.09 0.00 0.00 178.44 180.08 1fj1 h THR 126 N 0.84 0.75 0.00 0.22 2.02 -0.85 0.98 112.91 116.86 1fj1 h THR 126 Ca 0.41 -0.20 0.00 0.00 0.77 0.00 0.00 66.41 67.39 1fj1 h THR 126 Cb 0.37 0.10 0.00 0.00 -1.74 0.00 0.00 68.15 66.88 1fj1 h THR 126 CO -0.24 0.11 0.00 -1.20 0.37 0.00 0.00 175.52 174.55 1fj1 n SER 127 N -4.89 0.14 0.00 4.18 7.64 0.12 -4.87 113.62 115.95 1fj1 n SER 127 Ca 0.15 0.53 0.00 0.00 1.01 0.00 0.00 58.87 60.56 1fj1 n SER 127 Cb 0.39 -0.56 0.00 0.00 -1.01 0.00 0.00 64.21 63.03 1fj1 n SER 127 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1fj1 n GLY 128 N 0.48 0.74 3.84 0.23 0.00 0.34 -5.08 105.19 105.74 1fj1 n GLY 128 Ca 0.04 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.85 1fj1 n GLY 128 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1fj1 s GLY 129 N -1.54 1.79 -0.23 -0.02 0.00 -0.91 -1.91 107.32 104.50 1fj1 s GLY 129 Ca 0.00 -1.67 -0.07 0.00 0.00 0.00 0.00 44.72 42.98 1fj1 s GLY 129 CO 0.00 -1.60 0.48 0.00 0.00 0.00 0.00 173.10 171.98 1fj1 s ALA 130 N -2.32 -1.42 -0.06 3.20 0.00 -0.59 -3.12 121.76 117.44 1fj1 s ALA 130 Ca 0.40 1.64 0.03 0.00 0.00 0.00 0.00 51.96 54.03 1fj1 s ALA 130 Cb -0.05 -1.52 0.01 0.00 0.00 0.00 0.00 23.12 21.55 1fj1 s ALA 130 CO 0.26 -0.89 -0.13 -1.12 0.00 0.00 0.00 175.76 173.87 1fj1 s SER 131 N 2.69 1.86 -0.14 0.00 0.01 -1.26 -1.01 113.70 115.85 1fj1 s SER 131 Ca 0.01 -0.31 -0.04 0.00 1.31 0.00 0.00 55.95 56.92 1fj1 s SER 131 Cb -0.13 -0.81 -0.03 0.00 0.21 0.00 0.00 66.02 65.26 1fj1 s SER 131 CO -0.15 0.05 -0.01 -0.69 0.41 0.00 0.00 173.24 172.86 1fj1 s VAL 132 N 0.56 4.19 0.04 3.43 1.01 -0.30 -3.40 120.40 125.93 1fj1 s VAL 132 Ca -0.13 -0.26 0.08 0.00 0.00 0.00 0.00 61.98 61.67 1fj1 s VAL 132 Cb -0.15 -2.82 -0.03 0.00 0.00 0.00 0.00 36.38 33.38 1fj1 s VAL 132 CO 0.04 0.52 -0.24 -0.69 0.00 0.00 0.00 175.10 174.73 1fj1 s VAL 133 N -0.04 1.92 -0.05 2.92 1.01 -0.97 -0.51 120.40 124.67 1fj1 s VAL 133 Ca 0.03 -1.29 0.02 0.00 0.00 0.00 0.00 61.98 60.74 1fj1 s VAL 133 Cb -0.13 -1.65 0.02 0.00 0.00 0.00 0.00 36.38 34.62 1fj1 s VAL 133 CO 0.02 0.30 -0.08 0.00 0.00 0.00 0.00 175.10 175.34 1fj1 s PHE 135 N 0.79 3.03 -0.33 0.00 2.99 -0.27 -0.49 117.98 123.70 1fj1 s PHE 135 Ca -0.13 -0.30 0.04 0.00 0.00 0.00 0.00 56.93 56.53 1fj1 s PHE 135 Cb -0.15 -1.97 0.09 0.00 0.00 0.00 0.00 43.02 40.99 1fj1 s PHE 135 CO 0.02 -0.05 0.03 -0.51 -0.00 0.00 0.00 175.22 174.71 1fj1 s LEU 136 N 0.42 4.58 0.03 -0.37 1.02 -0.76 -1.09 118.68 122.51 1fj1 s LEU 136 Ca -0.03 -2.03 0.00 0.00 0.02 0.00 0.00 54.13 52.09 1fj1 s LEU 136 Cb -0.14 -1.63 -0.04 0.00 0.02 0.00 0.00 46.19 44.40 1fj1 s LEU 136 CO 0.03 -0.36 0.11 0.20 0.02 0.00 0.00 176.35 176.36 1fj1 s ASN 137 N 0.97 5.84 -0.85 2.29 0.02 0.07 -1.83 114.94 121.44 1fj1 s ASN 137 Ca 0.08 0.15 -0.04 0.00 -1.02 0.00 0.00 52.86 52.03 1fj1 s ASN 137 Cb -0.19 -1.70 0.00 0.00 0.02 0.00 0.00 41.25 39.38 1fj1 s ASN 137 CO -0.07 0.23 0.65 0.59 0.02 0.00 0.00 177.10 178.51 1fj1 n ASN 138 N 0.82 -5.55 -4.49 -1.22 3.02 -1.08 -1.96 115.26 104.80 1fj1 n ASN 138 Ca -0.10 -0.78 -0.25 0.00 -0.03 0.00 0.00 54.58 53.41 1fj1 n ASN 138 Cb 0.52 -2.67 -0.10 0.00 -0.61 0.00 0.00 39.78 36.92 1fj1 n ASN 138 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 1fj1 s PHE 139 N -3.06 2.09 -0.28 3.10 -0.71 -0.16 -4.55 117.98 114.41 1fj1 s PHE 139 Ca 0.07 -0.92 -0.24 0.00 -1.04 0.00 0.00 56.93 54.80 1fj1 s PHE 139 Cb -0.03 -1.45 0.10 0.00 -1.21 0.00 0.00 43.02 40.43 1fj1 s PHE 139 CO 0.86 0.12 0.90 -0.47 -1.34 0.00 0.00 175.22 175.30 1fj1 s TYR 140 N -3.06 -0.61 1.13 3.49 5.04 -0.61 -1.23 117.35 121.50 1fj1 s TYR 140 Ca 0.31 1.47 -0.19 0.00 -2.44 0.00 0.00 57.07 56.22 1fj1 s TYR 140 Cb 0.07 0.34 0.27 0.00 0.35 0.00 0.00 41.96 42.99 1fj1 s TYR 140 CO 0.15 -0.30 1.22 -1.25 -1.34 0.00 0.00 175.55 174.03 1fj1 s PRO 141 N 0.38 -0.67 0.38 4.97 0.04 -1.26 -0.06 135.00 138.78 1fj1 s PRO 141 Ca 0.01 -0.33 0.07 0.00 0.04 0.00 0.00 61.00 60.79 1fj1 s PRO 141 Cb -0.05 -1.69 0.74 0.00 0.04 0.00 0.00 34.50 33.55 1fj1 s PRO 141 CO -0.04 -3.30 1.95 -0.22 0.04 0.00 0.00 177.00 175.43 1fj1 h LYS 142 N -2.28 0.44 -6.33 4.56 3.64 -1.98 -3.43 116.57 111.20 1fj1 h LYS 142 Ca -0.43 -0.07 -0.54 0.00 -1.27 0.00 0.00 60.65 58.34 1fj1 h LYS 142 Cb 1.25 -0.07 0.01 0.00 -0.41 0.00 0.00 32.23 33.01 1fj1 h LYS 142 CO 0.31 0.43 1.22 -0.51 -2.27 0.00 0.00 179.45 178.63 1fj1 s ASP 143 N -6.77 6.45 0.01 4.20 -0.00 -1.26 -4.96 116.67 114.34 1fj1 s ASP 143 Ca -0.07 2.56 -0.22 0.00 -0.00 0.00 0.00 52.55 54.82 1fj1 s ASP 143 Cb 0.16 -2.53 0.05 0.00 -0.00 0.00 0.00 42.92 40.60 1fj1 s ASP 143 CO 0.74 -1.06 0.49 -0.51 -0.00 0.00 0.00 175.17 174.83 1fj1 s ILE 144 N 4.52 0.03 -0.06 0.77 2.07 -1.26 -4.61 121.20 122.66 1fj1 s ILE 144 Ca 0.86 -0.28 0.02 0.00 -1.41 0.00 0.00 60.65 59.84 1fj1 s ILE 144 Cb -0.41 -0.89 0.01 0.00 0.13 0.00 0.00 42.46 41.31 1fj1 s ILE 144 CO 0.39 -0.15 -0.12 0.21 -1.91 0.00 0.00 174.94 173.35 1fj1 s ASN 145 N -1.62 1.71 -0.08 4.50 3.84 -0.21 -4.99 114.94 118.09 1fj1 s ASN 145 Ca -0.09 -0.28 0.02 0.00 0.21 0.00 0.00 52.86 52.72 1fj1 s ASN 145 Cb -0.02 -0.72 -0.02 0.00 -0.55 0.00 0.00 41.25 39.95 1fj1 s ASN 145 CO 0.03 0.05 -0.16 -0.69 -2.79 0.00 0.00 177.10 173.54 1fj1 s VAL 146 N 0.54 2.88 -0.10 -5.21 1.01 -1.26 0.51 120.40 118.78 1fj1 s VAL 146 Ca -0.12 -0.76 0.01 0.00 0.00 0.00 0.00 61.98 61.12 1fj1 s VAL 146 Cb -0.14 -2.15 0.02 0.00 0.00 0.00 0.00 36.38 34.10 1fj1 s VAL 146 CO 0.03 0.56 -0.13 -0.75 0.00 0.00 0.00 175.10 174.82 1fj1 s LYS 147 N -0.19 1.92 -0.03 2.72 2.20 0.83 -4.94 119.74 122.24 1fj1 s LYS 147 Ca -0.01 -0.45 -0.11 0.00 -0.36 0.00 0.00 55.97 55.04 1fj1 s LYS 147 Cb -0.13 -1.70 -0.05 0.00 -1.51 0.00 0.00 37.83 34.44 1fj1 s LYS 147 CO 0.03 -0.10 0.31 -1.58 -0.36 0.00 0.00 175.35 173.66 1fj1 s TRP 148 N 1.10 3.67 -0.13 4.03 0.52 -1.26 -0.18 118.94 126.69 1fj1 s TRP 148 Ca -0.05 0.80 -0.01 0.00 0.02 0.00 0.00 56.10 56.86 1fj1 s TRP 148 Cb -0.14 -2.15 0.04 0.00 -1.15 0.00 0.00 33.47 30.07 1fj1 s TRP 148 CO -0.02 0.67 -0.01 0.15 0.02 0.00 0.00 176.95 177.76 1fj1 s LYS 149 N -1.15 0.90 -0.31 4.98 1.02 -0.40 -0.65 119.74 124.13 1fj1 s LYS 149 Ca 0.22 -0.21 -0.14 0.00 0.02 0.00 0.00 55.97 55.86 1fj1 s LYS 149 Cb -0.15 -1.58 -0.03 0.00 -0.52 0.00 0.00 37.83 35.56 1fj1 s LYS 149 CO 0.11 -0.42 0.30 0.42 -0.92 0.00 0.00 175.35 174.84 1fj1 s ILE 150 N 1.84 5.23 -1.46 2.17 1.01 0.62 -2.22 121.20 128.39 1fj1 s ILE 150 Ca 0.02 0.12 -0.04 0.00 0.00 0.00 0.00 60.65 60.75 1fj1 s ILE 150 Cb -0.14 -3.71 0.04 0.00 0.01 0.00 0.00 42.46 38.65 1fj1 s ILE 150 CO -0.07 0.05 0.56 0.47 0.00 0.00 0.00 174.94 175.96 1fj1 n ASP 151 N 5.24 -1.32 0.00 3.58 8.00 0.17 -1.06 116.55 131.16 1fj1 n ASP 151 Ca -0.11 -0.96 0.00 0.00 0.71 0.00 0.00 54.79 54.43 1fj1 n ASP 151 Cb 0.50 -3.20 0.00 0.00 -0.02 0.00 0.00 41.12 38.40 1fj1 n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1fj1 n GLY 152 N -1.81 2.79 3.80 0.44 0.00 -1.26 -5.00 105.19 104.15 1fj1 n GLY 152 Ca -0.21 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.44 1fj1 n GLY 152 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1fj1 s SER 153 N -3.65 6.37 0.22 1.61 0.01 -0.22 -4.97 113.70 113.07 1fj1 s SER 153 Ca 0.00 0.43 -0.30 0.00 1.31 0.00 0.00 55.95 57.39 1fj1 s SER 153 Cb 0.00 -2.11 -0.10 0.00 0.21 0.00 0.00 66.02 64.02 1fj1 s SER 153 CO 0.00 0.28 1.45 -0.70 0.41 0.00 0.00 173.24 174.68 1fj1 s GLU 154 N -0.33 4.27 -0.26 12.44 2.12 -1.26 -0.28 118.70 135.40 1fj1 s GLU 154 Ca 0.13 2.28 0.02 0.00 0.36 0.00 0.00 54.97 57.76 1fj1 s GLU 154 Cb -0.12 -3.13 0.05 0.00 0.26 0.00 0.00 34.13 31.19 1fj1 s GLU 154 CO 0.03 -0.44 -0.10 0.50 -0.54 0.00 0.00 175.26 174.71 1fj1 s ARG 155 N 0.02 2.38 -0.02 4.30 6.06 0.18 -4.89 118.95 126.99 1fj1 s ARG 155 Ca 0.61 -1.26 0.22 0.00 -2.50 0.00 0.00 55.73 52.80 1fj1 s ARG 155 Cb -0.41 -2.91 -0.29 0.00 0.06 0.00 0.00 34.95 31.39 1fj1 s ARG 155 CO 0.40 -0.53 0.64 0.00 -2.50 0.00 0.00 175.30 173.31 1fj1 n GLN 156 N 4.50 0.41 -3.74 5.12 10.64 -1.26 -4.32 117.38 128.73 1fj1 n GLN 156 Ca -0.15 -0.12 -0.22 0.00 -1.83 0.00 0.00 57.00 54.68 1fj1 n GLN 156 Cb 0.43 -1.51 -0.02 0.00 -0.86 0.00 0.00 30.24 28.28 1fj1 n GLN 156 CO 0.00 0.00 0.00 -0.80 -1.83 0.00 0.00 177.06 174.43 1fj1 s ASN 157 N -3.96 6.28 -0.99 2.61 0.01 -1.26 -4.46 114.94 113.17 1fj1 s ASN 157 Ca -0.02 0.18 0.00 0.00 -0.71 0.00 0.00 52.86 52.31 1fj1 s ASN 157 Cb 0.15 -1.87 0.00 0.00 0.41 0.00 0.00 41.25 39.94 1fj1 s ASN 157 CO 0.89 -0.17 0.00 0.61 -1.51 0.00 0.00 177.10 176.92 1fj1 n GLY 158 N -1.55 0.35 3.67 0.66 0.00 -1.26 -4.91 105.19 102.14 1fj1 n GLY 158 Ca -0.07 -0.47 -0.35 0.00 0.00 0.00 0.00 46.02 45.13 1fj1 n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1fj1 s VAL 159 N -2.49 4.73 -0.34 1.61 1.01 -1.26 -2.70 120.40 120.96 1fj1 s VAL 159 Ca 0.00 -0.06 -0.03 0.00 0.00 0.00 0.00 61.98 61.88 1fj1 s VAL 159 Cb 0.00 -3.09 0.06 0.00 0.00 0.00 0.00 36.38 33.35 1fj1 s VAL 159 CO 0.00 0.51 0.09 -0.76 0.00 0.00 0.00 175.10 174.94 1fj1 s LEU 160 N -0.08 4.41 -0.21 3.92 1.43 0.36 -4.94 118.68 123.57 1fj1 s LEU 160 Ca 0.06 -1.45 -0.05 0.00 -1.03 0.00 0.00 54.13 51.65 1fj1 s LEU 160 Cb -0.12 -1.79 -0.02 0.00 0.03 0.00 0.00 46.19 44.28 1fj1 s LEU 160 CO 0.01 -0.36 0.01 0.20 0.23 0.00 0.00 176.35 176.44 1fj1 s ASN 161 N 1.48 4.87 -0.07 2.29 0.02 -1.26 -0.31 114.94 121.96 1fj1 s ASN 161 Ca -0.00 -0.21 0.01 0.00 -1.02 0.00 0.00 52.86 51.64 1fj1 s ASN 161 Cb -0.21 -1.84 0.02 0.00 0.02 0.00 0.00 41.25 39.24 1fj1 s ASN 161 CO -0.01 0.04 -0.09 -0.55 0.02 0.00 0.00 177.10 176.51 1fj1 s SER 162 N 1.15 1.70 -0.01 -1.22 0.15 -0.02 -4.97 113.70 110.49 1fj1 s SER 162 Ca 0.03 -0.26 -0.02 0.00 0.70 0.00 0.00 55.95 56.40 1fj1 s SER 162 Cb -0.14 -0.75 -0.04 0.00 -1.71 0.00 0.00 66.02 63.38 1fj1 s SER 162 CO 0.02 -0.02 0.16 0.26 1.20 0.00 0.00 173.24 174.86 1fj1 s TRP 163 N 0.96 3.50 0.86 3.44 0.51 -1.26 -0.30 118.94 126.65 1fj1 s TRP 163 Ca -0.09 0.32 -0.11 0.00 -2.12 0.00 0.00 56.10 54.10 1fj1 s TRP 163 Cb -0.15 -1.81 0.15 0.00 -0.81 0.00 0.00 33.47 30.86 1fj1 s TRP 163 CO 0.00 0.63 1.20 0.95 -0.51 0.00 0.00 176.95 179.22 1fj1 s THR 164 N -1.31 2.06 0.80 2.01 -4.23 0.54 -4.98 115.64 110.53 1fj1 s THR 164 Ca 0.27 -0.16 -0.10 0.00 -1.18 0.00 0.00 61.69 60.52 1fj1 s THR 164 Cb -0.13 -2.91 0.10 0.00 1.34 0.00 0.00 72.50 70.91 1fj1 s THR 164 CO 0.18 0.00 1.14 -1.81 -0.54 0.00 0.00 174.62 173.60 1fj1 s ASP 165 N -4.77 4.32 0.24 3.99 1.01 -1.26 -4.68 116.67 115.51 1fj1 s ASP 165 Ca 0.69 0.51 -0.30 0.00 0.71 0.00 0.00 52.55 54.17 1fj1 s ASP 165 Cb -0.06 -0.96 -0.10 0.00 1.01 0.00 0.00 42.92 42.81 1fj1 s ASP 165 CO 0.50 -1.97 1.42 -1.58 0.21 0.00 0.00 175.17 173.75 1fj1 s GLN 166 N -5.51 4.29 0.35 8.23 0.74 -1.26 -4.70 119.66 121.80 1fj1 s GLN 166 Ca 0.64 2.25 -0.28 0.00 0.05 0.00 0.00 55.36 58.02 1fj1 s GLN 166 Cb -0.09 -3.13 -0.11 0.00 1.10 0.00 0.00 33.01 30.78 1fj1 s GLN 166 CO 0.48 -0.39 1.40 0.34 -0.55 0.00 0.00 175.29 176.57 1fj1 s ASP 167 N 0.38 6.55 0.00 6.67 -1.08 0.61 -4.89 116.67 124.91 1fj1 s ASP 167 Ca 0.59 2.88 0.30 0.00 -0.52 0.00 0.00 52.55 55.79 1fj1 s ASP 167 Cb -0.41 -2.66 1.41 0.00 -1.46 0.00 0.00 42.92 39.81 1fj1 s ASP 167 CO 0.42 -0.71 1.96 -1.54 0.52 0.00 0.00 175.17 175.82 1fj1 n SER 168 N 0.66 0.38 -0.04 -0.34 3.41 -1.26 -2.20 113.62 114.24 1fj1 n SER 168 Ca 0.01 -0.69 -0.07 0.00 -0.26 0.00 0.00 58.87 57.86 1fj1 n SER 168 Cb 0.40 -0.09 -0.02 0.00 -0.26 0.00 0.00 64.21 64.25 1fj1 n SER 168 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1fj1 n LYS 169 N -0.91 0.31 -0.03 4.33 4.76 -1.26 -3.35 118.16 122.00 1fj1 n LYS 169 Ca 0.17 0.12 0.12 0.00 -2.87 0.00 0.00 58.31 55.86 1fj1 n LYS 169 Cb 0.24 -1.04 0.21 0.00 -1.84 0.00 0.00 35.03 32.60 1fj1 n LYS 169 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 1fj1 n ASP 170 N -4.00 2.72 -1.98 4.39 5.75 -1.26 -4.92 116.55 117.25 1fj1 n ASP 170 Ca -0.11 -1.89 -0.20 0.00 -0.01 0.00 0.00 54.79 52.58 1fj1 n ASP 170 Cb 0.36 -0.04 -0.05 0.00 -1.03 0.00 0.00 41.12 40.36 1fj1 n ASP 170 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 1fj1 n SER 171 N 1.10 -5.42 -4.57 -1.12 7.64 -0.93 -4.97 113.62 105.34 1fj1 n SER 171 Ca 0.16 0.26 -0.18 0.00 1.01 0.00 0.00 58.87 60.11 1fj1 n SER 171 Cb 0.54 -4.67 0.07 0.00 -1.01 0.00 0.00 64.21 59.15 1fj1 n SER 171 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1fj1 n THR 172 N -3.10 0.00 -4.28 0.44 -2.24 -1.26 -4.63 114.28 99.21 1fj1 n THR 172 Ca -0.22 -1.67 -0.18 0.00 -2.27 0.00 0.00 64.05 59.72 1fj1 n THR 172 Cb 0.66 -0.65 -0.11 0.00 -2.10 0.00 0.00 70.33 68.14 1fj1 n THR 172 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 1fj1 s TYR 173 N -2.35 1.48 0.03 4.78 2.02 -0.36 -0.29 117.35 122.66 1fj1 s TYR 173 Ca 0.56 -0.60 0.00 0.00 -0.37 0.00 0.00 57.07 56.66 1fj1 s TYR 173 Cb -0.04 -0.74 -0.02 0.00 -0.40 0.00 0.00 41.96 40.75 1fj1 s TYR 173 CO 0.36 0.20 -0.04 -1.12 -1.57 0.00 0.00 175.55 173.38 1fj1 s SER 174 N -2.85 0.39 0.02 2.29 0.01 -1.26 -0.99 113.70 111.30 1fj1 s SER 174 Ca 0.15 -0.61 -0.03 0.00 1.31 0.00 0.00 55.95 56.77 1fj1 s SER 174 Cb -0.02 0.11 -0.01 0.00 0.21 0.00 0.00 66.02 66.30 1fj1 s SER 174 CO 0.04 -0.34 0.04 0.00 0.41 0.00 0.00 173.24 173.38 1fj1 s MET 175 N -1.96 0.42 -0.10 12.44 0.23 -0.76 -0.34 119.30 129.23 1fj1 s MET 175 Ca -0.11 -0.60 0.03 0.00 -1.03 0.00 0.00 55.69 53.98 1fj1 s MET 175 Cb -0.06 0.16 -0.01 0.00 -1.53 0.00 0.00 34.83 33.38 1fj1 s MET 175 CO -0.02 -0.09 -0.18 0.45 -2.03 0.00 0.00 175.02 173.15 1fj1 s SER 176 N -1.61 3.62 -0.20 -1.18 0.15 0.59 -1.83 113.70 113.25 1fj1 s SER 176 Ca -0.13 -0.40 0.01 0.00 0.70 0.00 0.00 55.95 56.14 1fj1 s SER 176 Cb -0.07 -1.32 0.03 0.00 -1.71 0.00 0.00 66.02 62.95 1fj1 s SER 176 CO -0.01 0.20 -0.16 -0.55 1.20 0.00 0.00 173.24 173.92 1fj1 s SER 177 N 0.10 3.42 -0.22 5.45 0.15 0.35 -0.84 113.70 122.12 1fj1 s SER 177 Ca -0.09 -0.84 -0.02 0.00 0.70 0.00 0.00 55.95 55.71 1fj1 s SER 177 Cb -0.15 -1.43 0.01 0.00 -1.71 0.00 0.00 66.02 62.74 1fj1 s SER 177 CO 0.05 -0.07 -0.10 -0.89 1.20 0.00 0.00 173.24 173.44 1fj1 s THR 178 N 1.28 2.78 -0.37 6.45 2.01 0.57 -0.83 115.64 127.54 1fj1 s THR 178 Ca 0.01 -0.82 -0.16 0.00 0.31 0.00 0.00 61.69 61.03 1fj1 s THR 178 Cb -0.15 -2.29 0.00 0.00 0.01 0.00 0.00 72.50 70.07 1fj1 s THR 178 CO -0.10 0.38 0.41 -0.22 -0.69 0.00 0.00 174.62 174.40 1fj1 s LEU 179 N 1.37 4.57 -0.06 4.42 2.96 0.33 -0.49 118.68 131.78 1fj1 s LEU 179 Ca 0.04 -0.35 -0.02 0.00 -0.22 0.00 0.00 54.13 53.58 1fj1 s LEU 179 Cb -0.15 -2.39 -0.04 0.00 0.50 0.00 0.00 46.19 44.12 1fj1 s LEU 179 CO -0.07 -0.44 0.03 -0.89 -1.32 0.00 0.00 176.35 173.66 1fj1 s THR 180 N 2.11 4.48 0.26 3.68 2.01 -1.10 -1.14 115.64 125.95 1fj1 s THR 180 Ca 0.13 -0.28 -0.21 0.00 0.31 0.00 0.00 61.69 61.64 1fj1 s THR 180 Cb -0.17 -2.94 0.05 0.00 0.01 0.00 0.00 72.50 69.46 1fj1 s THR 180 CO 0.13 0.53 0.85 -1.48 -0.69 0.00 0.00 174.62 173.96 1fj1 s LEU 181 N -1.14 -0.13 0.31 4.42 0.05 -0.18 -4.91 118.68 117.10 1fj1 s LEU 181 Ca 0.16 -0.70 -0.27 0.00 0.05 0.00 0.00 54.13 53.37 1fj1 s LEU 181 Cb -0.12 2.51 -0.09 0.00 -2.05 0.00 0.00 46.19 46.45 1fj1 s LEU 181 CO 0.06 -1.26 1.00 0.42 -0.55 0.00 0.00 176.35 176.01 1fj1 s THR 182 N -3.09 3.89 0.30 5.48 -4.23 -1.26 -1.55 115.64 115.18 1fj1 s THR 182 Ca 0.14 1.70 0.05 0.00 -1.18 0.00 0.00 61.69 62.41 1fj1 s THR 182 Cb -0.04 -4.01 0.30 0.00 1.34 0.00 0.00 72.50 70.09 1fj1 s THR 182 CO 0.07 0.26 1.79 0.50 -0.54 0.00 0.00 174.62 176.69 1fj1 h LYS 183 N 3.43 0.78 0.03 3.99 3.64 -1.60 0.22 116.57 127.06 1fj1 h LYS 183 Ca -0.47 -0.05 0.01 0.00 -1.27 0.00 0.00 60.65 58.87 1fj1 h LYS 183 Cb 1.20 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 32.84 1fj1 h LYS 183 CO 0.66 0.51 -0.06 -0.44 -2.27 0.00 0.00 179.45 177.85 1fj1 h ASP 184 N 0.80 -0.16 -0.86 4.20 3.32 -1.92 -0.11 116.42 121.69 1fj1 h ASP 184 Ca 0.57 0.02 -0.02 0.00 0.02 0.00 0.00 57.03 57.62 1fj1 h ASP 184 Cb 0.84 0.07 -0.04 0.00 0.22 0.00 0.00 39.33 40.41 1fj1 h ASP 184 CO -0.36 -0.09 0.45 -0.08 -1.72 0.00 0.00 179.24 177.44 1fj1 h GLU 185 N -0.12 1.21 -0.51 3.56 4.81 -1.23 -1.82 114.58 120.47 1fj1 h GLU 185 Ca 0.02 -0.15 -0.04 0.00 -0.13 0.00 0.00 59.36 59.05 1fj1 h GLU 185 Cb 0.13 -0.23 -0.02 0.00 0.63 0.00 0.00 28.75 29.26 1fj1 h GLU 185 CO -0.04 0.90 0.14 -0.92 -0.73 0.00 0.00 179.01 178.35 1fj1 h TYR 186 N 1.21 0.79 0.00 0.92 3.20 -0.24 -2.57 116.97 120.29 1fj1 h TYR 186 Ca 0.30 -0.06 -0.14 0.00 3.14 0.00 0.00 58.73 61.97 1fj1 h TYR 186 Cb 0.05 -0.24 -0.02 0.00 1.54 0.00 0.00 36.73 38.07 1fj1 h TYR 186 CO 0.01 0.66 -0.68 0.93 -1.64 0.00 0.00 178.16 177.45 1fj1 h GLU 187 N 0.75 0.00 0.00 1.82 3.07 -0.54 -3.01 114.58 116.67 1fj1 h GLU 187 Ca 0.17 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.03 1fj1 h GLU 187 Cb 0.26 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.17 1fj1 h GLU 187 CO -0.00 0.68 0.00 0.54 -1.40 0.00 0.00 179.01 178.82 1fj1 n ARG 188 N -3.71 0.06 -4.34 2.33 1.74 -0.73 -4.76 116.66 107.25 1fj1 n ARG 188 Ca -0.01 0.27 -0.17 0.00 -0.77 0.00 0.00 57.85 57.17 1fj1 n ARG 188 Cb 0.67 -1.50 -0.10 0.00 -1.02 0.00 0.00 32.46 30.51 1fj1 n ARG 188 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1fj1 s HIS 189 N -2.81 1.62 0.00 -1.55 3.76 -1.14 -5.09 115.29 110.07 1fj1 s HIS 189 Ca 0.07 -1.07 0.00 0.00 -0.15 0.00 0.00 55.06 53.91 1fj1 s HIS 189 Cb 0.06 -0.97 0.00 0.00 1.11 0.00 0.00 32.58 32.78 1fj1 s HIS 189 CO 0.16 -0.20 0.00 -1.71 -0.85 0.00 0.00 174.74 172.15 1fj1 n ASN 190 N -0.49 3.72 -4.62 1.40 2.85 -1.26 -4.83 115.26 112.03 1fj1 n ASN 190 Ca -0.02 0.00 -0.37 0.00 -0.11 0.00 0.00 54.58 54.08 1fj1 n ASN 190 Cb 0.66 0.29 -0.10 0.00 1.24 0.00 0.00 39.78 41.87 1fj1 n ASN 190 CO 0.00 0.00 0.00 -0.55 -2.11 0.00 0.00 177.26 174.60 1fj1 s SER 191 N -2.88 6.09 -0.17 1.20 0.15 -1.26 0.24 113.70 117.07 1fj1 s SER 191 Ca 0.00 0.08 0.00 0.00 0.70 0.00 0.00 55.95 56.73 1fj1 s SER 191 Cb 0.00 -2.12 0.03 0.00 -1.71 0.00 0.00 66.02 62.22 1fj1 s SER 191 CO 0.00 -0.01 -0.12 -0.31 1.20 0.00 0.00 173.24 174.00 1fj1 s TYR 192 N 1.47 2.21 0.00 3.44 1.51 -0.69 0.41 117.35 125.71 1fj1 s TYR 192 Ca 0.08 -1.32 0.00 0.00 -1.01 0.00 0.00 57.07 54.82 1fj1 s TYR 192 Cb -0.15 -1.58 -0.00 0.00 -0.11 0.00 0.00 41.96 40.11 1fj1 s TYR 192 CO 0.08 -0.69 -0.02 -0.08 -1.11 0.00 0.00 175.55 173.74 1fj1 s THR 193 N 1.47 0.10 -0.13 -0.71 -1.32 -0.94 -1.33 115.64 112.78 1fj1 s THR 193 Ca 0.03 -0.23 0.03 0.00 -1.21 0.00 0.00 61.69 60.31 1fj1 s THR 193 Cb -0.14 -0.12 0.01 0.00 -1.51 0.00 0.00 72.50 70.73 1fj1 s THR 193 CO -0.10 -0.08 -0.22 0.00 -2.21 0.00 0.00 174.62 172.01 1fj1 s GLU 195 N 0.68 3.58 -0.33 0.00 2.02 0.75 -2.10 118.70 123.30 1fj1 s GLU 195 Ca -0.10 -0.54 -0.10 0.00 0.02 0.00 0.00 54.97 54.25 1fj1 s GLU 195 Cb -0.16 -3.43 0.01 0.00 0.10 0.00 0.00 34.13 30.65 1fj1 s GLU 195 CO 0.01 -0.26 0.16 0.00 0.02 0.00 0.00 175.26 175.19 1fj1 s ALA 196 N 1.63 3.25 -0.25 5.21 0.00 -0.21 -0.12 121.76 131.27 1fj1 s ALA 196 Ca 0.06 -1.53 -0.09 0.00 0.00 0.00 0.00 51.96 50.39 1fj1 s ALA 196 Cb -0.16 -2.43 -0.04 0.00 0.00 0.00 0.00 23.12 20.48 1fj1 s ALA 196 CO 0.05 -1.10 0.13 0.99 0.00 0.00 0.00 175.76 175.83 1fj1 s THR 197 N 1.57 5.00 0.01 0.00 2.01 0.18 -1.75 115.64 122.66 1fj1 s THR 197 Ca 0.03 0.06 -0.01 0.00 0.31 0.00 0.00 61.69 62.08 1fj1 s THR 197 Cb -0.18 -3.34 -0.01 0.00 0.01 0.00 0.00 72.50 68.98 1fj1 s THR 197 CO 0.06 0.33 -0.00 -2.28 -0.69 0.00 0.00 174.62 172.03 1fj1 s HIS 198 N 1.34 0.20 0.43 4.92 2.46 -1.26 -1.05 115.29 122.33 1fj1 s HIS 198 Ca 0.06 -0.41 0.27 0.00 0.47 0.00 0.00 55.06 55.45 1fj1 s HIS 198 Cb -0.15 -0.15 1.33 0.00 -0.13 0.00 0.00 32.58 33.49 1fj1 s HIS 198 CO 0.06 -0.18 1.67 -0.22 -2.47 0.00 0.00 174.74 173.60 1fj1 h LYS 199 N 4.78 0.17 0.00 2.88 3.64 -1.95 -0.44 116.57 125.65 1fj1 h LYS 199 Ca -0.31 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.06 1fj1 h LYS 199 Cb 1.21 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.99 1fj1 h LYS 199 CO 0.42 0.11 0.00 0.25 -2.27 0.00 0.00 179.45 177.96 1fj1 n THR 200 N -4.66 0.57 -3.61 1.00 -2.24 -1.26 -4.73 114.28 99.34 1fj1 n THR 200 Ca 0.33 0.14 -0.16 0.00 -2.27 0.00 0.00 64.05 62.10 1fj1 n THR 200 Cb 1.26 -0.99 -0.07 0.00 -2.10 0.00 0.00 70.33 68.43 1fj1 n THR 200 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1fj1 s SER 201 N -2.40 -0.47 0.10 3.42 0.15 -0.17 -4.99 113.70 109.33 1fj1 s SER 201 Ca 0.10 0.43 0.22 0.00 0.70 0.00 0.00 55.95 57.41 1fj1 s SER 201 Cb 0.06 0.45 -0.13 0.00 -1.71 0.00 0.00 66.02 64.70 1fj1 s SER 201 CO 0.13 -0.57 0.82 0.35 1.20 0.00 0.00 173.24 175.17 1fj1 n THR 202 N 0.97 0.35 -3.87 6.45 -2.24 -1.26 -4.48 114.28 110.20 1fj1 n THR 202 Ca -0.20 -0.51 -0.36 0.00 -2.27 0.00 0.00 64.05 60.72 1fj1 n THR 202 Cb 0.57 -0.17 -0.11 0.00 -2.10 0.00 0.00 70.33 68.52 1fj1 n THR 202 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1fj1 s SER 203 N -4.93 5.38 0.40 3.42 1.04 -1.26 -5.07 113.70 112.68 1fj1 s SER 203 Ca -0.03 -0.08 -0.26 0.00 0.48 0.00 0.00 55.95 56.06 1fj1 s SER 203 Cb 0.12 -1.95 -0.09 0.00 0.10 0.00 0.00 66.02 64.20 1fj1 s SER 203 CO 0.84 0.05 1.24 -2.16 0.98 0.00 0.00 173.24 174.19 1fj1 s PRO 204 N 1.13 4.02 0.05 4.02 0.04 -1.26 -4.94 135.00 138.07 1fj1 s PRO 204 Ca 0.05 2.02 -0.30 0.00 0.04 0.00 0.00 61.00 62.80 1fj1 s PRO 204 Cb -0.14 -2.74 -0.05 0.00 0.04 0.00 0.00 34.50 31.61 1fj1 s PRO 204 CO 0.03 -0.40 1.13 0.42 0.04 0.00 0.00 177.00 178.22 1fj1 s ILE 205 N -1.31 4.26 -0.14 0.56 1.01 -0.72 -4.84 121.20 120.02 1fj1 s ILE 205 Ca 0.56 1.64 0.02 0.00 0.00 0.00 0.00 60.65 62.87 1fj1 s ILE 205 Cb -0.35 -4.05 0.01 0.00 0.01 0.00 0.00 42.46 38.08 1fj1 s ILE 205 CO 0.45 0.14 -0.19 -0.69 0.00 0.00 0.00 174.94 174.64 1fj1 s VAL 206 N 0.95 1.85 -0.04 2.92 1.01 -1.26 -1.04 120.40 124.78 1fj1 s VAL 206 Ca 0.56 -0.84 0.07 0.00 0.00 0.00 0.00 61.98 61.77 1fj1 s VAL 206 Cb -0.27 -1.66 -0.01 0.00 0.00 0.00 0.00 36.38 34.44 1fj1 s VAL 206 CO 0.29 0.51 -0.25 -0.54 0.00 0.00 0.00 175.10 175.11 1fj1 s LYS 207 N 0.98 2.37 0.25 2.72 -0.14 -0.89 -5.00 119.74 120.04 1fj1 s LYS 207 Ca -0.04 -0.91 -0.13 0.00 -1.36 0.00 0.00 55.97 53.52 1fj1 s LYS 207 Cb -0.15 -2.11 -0.00 0.00 -1.68 0.00 0.00 37.83 33.89 1fj1 s LYS 207 CO -0.04 0.45 0.50 0.45 -0.76 0.00 0.00 175.35 175.95 1fj1 s SER 208 N -0.34 -0.08 -0.15 2.83 0.15 -1.26 -0.32 113.70 114.53 1fj1 s SER 208 Ca 0.02 -0.92 -0.29 0.00 0.70 0.00 0.00 55.95 55.46 1fj1 s SER 208 Cb -0.12 0.60 0.09 0.00 -1.71 0.00 0.00 66.02 64.87 1fj1 s SER 208 CO 0.02 -1.16 0.79 0.72 1.20 0.00 0.00 173.24 174.80 1fj1 s PHE 209 N -3.98 -0.62 -0.00 3.44 -0.12 -0.44 -4.99 117.98 111.27 1fj1 s PHE 209 Ca 0.22 1.24 -0.01 0.00 -0.05 0.00 0.00 56.93 58.33 1fj1 s PHE 209 Cb -0.01 0.38 -0.04 0.00 -0.63 0.00 0.00 43.02 42.72 1fj1 s PHE 209 CO 0.09 -0.46 0.13 -0.80 -0.05 0.00 0.00 175.22 174.12 1fj1 s ASN 210 N -0.63 5.98 0.49 1.98 0.01 -1.26 -1.70 114.94 119.80 1fj1 s ASN 210 Ca -0.05 0.23 0.33 0.00 -0.71 0.00 0.00 52.86 52.65 1fj1 s ASN 210 Cb -0.02 -1.79 1.56 0.00 0.41 0.00 0.00 41.25 41.41 1fj1 s ASN 210 CO 0.05 0.26 1.98 -0.09 -1.51 0.00 0.00 177.10 177.79 1fj1 h ARG 211 N 3.93 0.00 0.00 -0.60 2.43 -0.53 -3.32 114.38 116.28 1fj1 h ARG 211 Ca -0.49 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.68 1fj1 h ARG 211 Cb 1.18 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.73 1fj1 h ARG 211 CO 0.65 0.00 0.00 0.09 -1.51 0.00 0.00 179.97 179.20 1fj1 n ASN 212 N -2.77 0.00 0.00 -3.80 3.02 -1.26 -5.12 115.26 105.32 1fj1 n ASN 212 Ca -0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1fj1 n ASN 212 Cb 0.18 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.35 1fj1 n ASN 212 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02