#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3lfs h GLU 2 N 0.00 0.94 0.00 2.12 3.07 -2.05 -3.13 114.58 115.53 3lfs h GLU 2 Ca 0.00 -0.36 0.00 0.00 -0.50 0.00 0.00 59.36 58.50 3lfs h GLU 2 Cb 0.00 -0.06 0.00 0.00 -0.84 0.00 0.00 28.75 27.85 3lfs h GLU 2 CO 0.00 1.02 0.00 0.09 -1.40 0.00 0.00 179.01 178.72 3lfs n ASN 3 N -4.22 0.00 -4.42 1.42 3.02 -1.26 -4.78 115.26 105.03 3lfs n ASN 3 Ca 0.00 0.03 -0.31 0.00 -0.03 0.00 0.00 54.58 54.28 3lfs n ASN 3 Cb 0.39 -0.30 -0.13 0.00 -0.61 0.00 0.00 39.78 39.13 3lfs n ASN 3 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3lfs s PHE 4 N -2.59 2.48 -0.26 3.10 0.40 -1.18 0.45 117.98 120.38 3lfs s PHE 4 Ca 0.18 -0.31 -0.03 0.00 -0.60 0.00 0.00 56.93 56.18 3lfs s PHE 4 Cb 0.13 -1.46 0.02 0.00 0.51 0.00 0.00 43.02 42.23 3lfs s PHE 4 CO 0.30 0.19 -0.03 1.14 0.70 0.00 0.00 175.22 177.53 3lfs s GLN 5 N -1.28 2.90 0.33 0.44 -2.07 0.46 -4.78 119.66 115.66 3lfs s GLN 5 Ca 0.13 -0.94 -0.28 0.00 -1.82 0.00 0.00 55.36 52.44 3lfs s GLN 5 Cb -0.10 -3.06 -0.10 0.00 -1.09 0.00 0.00 33.01 28.65 3lfs s GLN 5 CO 0.04 -0.40 1.26 0.15 -1.32 0.00 0.00 175.29 175.01 3lfs s LYS 6 N 1.36 4.37 -0.21 9.60 1.02 -1.26 -0.72 119.74 133.91 3lfs s LYS 6 Ca 0.01 2.12 -0.00 0.00 0.02 0.00 0.00 55.97 58.11 3lfs s LYS 6 Cb -0.17 -3.05 -0.13 0.00 -0.52 0.00 0.00 37.83 33.97 3lfs s LYS 6 CO -0.03 -0.14 -0.20 1.33 -0.92 0.00 0.00 175.35 175.39 3lfs n VAL 7 N 0.79 1.17 -3.57 3.17 0.24 0.10 -4.92 118.33 115.31 3lfs n VAL 7 Ca 0.00 -0.42 -0.06 0.00 -2.04 0.00 0.00 64.34 61.82 3lfs n VAL 7 Cb 0.43 -1.31 -0.02 0.00 -1.47 0.00 0.00 33.84 31.46 3lfs n VAL 7 CO 0.00 0.00 0.00 -1.83 -2.14 0.00 0.00 176.83 172.86 3lfs s GLU 8 N -2.40 0.46 -0.33 7.34 -1.05 -1.22 -5.02 118.70 116.48 3lfs s GLU 8 Ca -0.28 -0.13 -0.29 0.00 -0.15 0.00 0.00 54.97 54.12 3lfs s GLU 8 Cb 0.08 0.21 0.01 0.00 -0.44 0.00 0.00 34.13 33.99 3lfs s GLU 8 CO 0.45 -0.19 1.18 0.21 0.95 0.00 0.00 175.26 177.86 3lfs s LYS 9 N -2.40 3.96 0.00 -4.83 2.20 -1.26 -1.50 119.74 115.91 3lfs s LYS 9 Ca 0.07 1.09 0.24 0.00 -0.36 0.00 0.00 55.97 57.00 3lfs s LYS 9 Cb -0.01 -3.82 0.33 0.00 -1.51 0.00 0.00 37.83 32.82 3lfs s LYS 9 CO -0.05 -1.06 1.34 0.44 -0.36 0.00 0.00 175.35 175.66 3lfs n ILE 10 N 6.14 0.25 0.00 5.43 -5.35 -0.13 -4.95 119.36 120.75 3lfs n ILE 10 Ca 0.13 -0.61 0.00 0.00 -0.27 0.00 0.00 62.75 62.00 3lfs n ILE 10 Cb 0.47 1.22 0.00 0.00 -1.74 0.00 0.00 39.64 39.59 3lfs n ILE 10 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3lfs n GLY 11 N 1.42 0.72 3.10 3.28 0.00 -1.12 -4.99 105.19 107.61 3lfs n GLY 11 Ca 0.17 -1.30 -0.32 0.00 0.00 0.00 0.00 46.02 44.56 3lfs n GLY 11 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3lfs s GLU 12 N -1.93 2.81 0.15 1.61 0.41 -1.26 -1.85 118.70 118.64 3lfs s GLU 12 Ca 0.00 -0.84 -0.01 0.00 -0.41 0.00 0.00 54.97 53.72 3lfs s GLU 12 Cb 0.00 -2.53 0.03 0.00 -1.78 0.00 0.00 34.13 29.85 3lfs s GLU 12 CO 0.00 -0.25 0.21 0.41 -0.49 0.00 0.00 175.26 175.14 3lfs n GLY 13 N 4.63 0.44 0.19 -1.39 0.00 -0.75 -4.98 105.19 103.33 3lfs n GLY 13 Ca -0.20 -1.92 -0.17 0.00 0.00 0.00 0.00 46.02 43.73 3lfs n GLY 13 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3lfs h THR 14 N -0.54 1.33 0.01 2.61 2.02 -1.99 -3.39 112.91 112.96 3lfs h THR 14 Ca -0.07 -1.94 -0.36 0.00 0.77 0.00 0.00 66.41 64.80 3lfs h THR 14 Cb 0.24 2.18 -0.06 0.00 -1.74 0.00 0.00 68.15 68.77 3lfs h THR 14 CO 0.07 0.60 -2.30 -1.22 0.37 0.00 0.00 175.52 173.04 3lfs n TYR 15 N -4.09 0.21 -3.83 3.16 4.01 -1.26 -2.57 117.16 112.78 3lfs n TYR 15 Ca -0.08 0.06 -0.02 0.00 -0.16 0.00 0.00 57.90 57.70 3lfs n TYR 15 Cb 0.69 -1.03 0.01 0.00 -0.31 0.00 0.00 39.34 38.69 3lfs n TYR 15 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 3lfs s GLY 16 N -5.69 -0.08 0.33 2.72 0.00 -1.26 -4.07 107.32 99.27 3lfs s GLY 16 Ca -0.16 -0.02 -0.29 0.00 0.00 0.00 0.00 44.72 44.25 3lfs s GLY 16 CO 0.77 1.99 1.46 0.14 0.00 0.00 0.00 173.10 177.46 3lfs s VAL 17 N -2.43 2.31 -0.20 1.40 1.01 -1.16 -1.81 120.40 119.52 3lfs s VAL 17 Ca 0.20 0.29 -0.03 0.00 0.00 0.00 0.00 61.98 62.43 3lfs s VAL 17 Cb -0.01 -3.18 -0.01 0.00 0.00 0.00 0.00 36.38 33.18 3lfs s VAL 17 CO 0.02 0.06 -0.06 -0.69 0.00 0.00 0.00 175.10 174.43 3lfs s VAL 18 N -0.70 3.31 0.16 2.92 1.01 -0.77 -1.55 120.40 124.78 3lfs s VAL 18 Ca 0.55 -0.53 0.10 0.00 0.00 0.00 0.00 61.98 62.10 3lfs s VAL 18 Cb -0.44 -2.48 -0.04 0.00 0.00 0.00 0.00 36.38 33.41 3lfs s VAL 18 CO 0.54 0.45 -0.19 -0.31 0.00 0.00 0.00 175.10 175.60 3lfs s TYR 19 N 1.17 2.46 -0.27 5.22 2.02 0.32 -0.96 117.35 127.31 3lfs s TYR 19 Ca 0.02 -0.30 -0.16 0.00 -0.37 0.00 0.00 57.07 56.26 3lfs s TYR 19 Cb -0.14 -1.25 -0.03 0.00 -0.40 0.00 0.00 41.96 40.13 3lfs s TYR 19 CO -0.02 0.45 0.42 0.21 -1.57 0.00 0.00 175.55 175.04 3lfs s LYS 20 N -2.49 4.01 0.23 -0.62 2.20 -0.56 0.62 119.74 123.14 3lfs s LYS 20 Ca 0.20 0.11 0.04 0.00 -0.36 0.00 0.00 55.97 55.96 3lfs s LYS 20 Cb -0.09 -3.66 -0.05 0.00 -1.51 0.00 0.00 37.83 32.52 3lfs s LYS 20 CO 0.11 -0.31 -0.03 0.00 -0.36 0.00 0.00 175.35 174.76 3lfs s ALA 21 N 2.15 1.88 -0.07 3.13 0.00 -0.07 0.03 121.76 128.81 3lfs s ALA 21 Ca 0.17 -1.76 0.04 0.00 0.00 0.00 0.00 51.96 50.41 3lfs s ALA 21 Cb -0.16 0.37 0.00 0.00 0.00 0.00 0.00 23.12 23.34 3lfs s ALA 21 CO 0.10 -0.19 -0.19 0.50 0.00 0.00 0.00 175.76 175.98 3lfs s ARG 22 N -3.82 2.22 0.09 0.00 3.52 0.10 -0.19 118.95 120.86 3lfs s ARG 22 Ca 0.27 -0.67 -0.31 0.00 -0.13 0.00 0.00 55.73 54.90 3lfs s ARG 22 Cb 0.05 -1.80 -0.06 0.00 -1.56 0.00 0.00 34.95 31.58 3lfs s ARG 22 CO 0.08 0.18 1.21 1.21 -0.81 0.00 0.00 175.30 177.18 3lfs s ASN 23 N 0.27 7.06 0.34 -2.12 3.84 -0.78 -0.40 114.94 123.14 3lfs s ASN 23 Ca -0.11 2.08 0.16 0.00 0.21 0.00 0.00 52.86 55.19 3lfs s ASN 23 Cb -0.15 -2.58 0.55 0.00 -0.55 0.00 0.00 41.25 38.52 3lfs s ASN 23 CO 0.05 -0.46 1.68 0.11 -2.79 0.00 0.00 177.10 175.69 3lfs h LYS 24 N 6.53 0.00 0.03 0.43 1.57 -0.36 -1.60 116.57 123.17 3lfs h LYS 24 Ca -0.42 0.00 -0.22 0.00 -1.87 0.00 0.00 60.65 58.14 3lfs h LYS 24 Cb 1.21 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.50 3lfs h LYS 24 CO 0.80 0.46 -1.20 1.37 -0.57 0.00 0.00 179.45 180.32 3lfs h LEU 25 N 0.00 0.09 0.00 2.94 -0.00 -1.93 -3.41 115.31 112.99 3lfs h LEU 25 Ca -0.00 -0.65 -0.19 0.00 -0.00 0.00 0.00 57.88 57.03 3lfs h LEU 25 Cb 0.98 -0.03 -0.03 0.00 -0.00 0.00 0.00 40.66 41.58 3lfs h LEU 25 CO 0.06 1.48 -1.21 0.71 -0.00 0.00 0.00 178.44 179.48 3lfs h THR 26 N -0.81 0.86 0.00 0.15 1.35 -1.95 -3.48 112.91 109.03 3lfs h THR 26 Ca -0.31 -2.45 0.00 0.00 -0.55 0.00 0.00 66.41 63.11 3lfs h THR 26 Cb 1.39 2.34 0.00 0.00 -1.73 0.00 0.00 68.15 70.16 3lfs h THR 26 CO -0.12 0.49 0.00 0.61 -0.25 0.00 0.00 175.52 176.25 3lfs n GLY 27 N 1.39 0.84 3.71 5.82 0.00 -0.60 -5.03 105.19 111.31 3lfs n GLY 27 Ca -0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.53 3lfs n GLY 27 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3lfs s GLU 28 N -0.10 4.54 0.07 1.61 2.56 -1.26 -4.70 118.70 121.42 3lfs s GLU 28 Ca 0.00 1.54 -0.30 0.00 0.00 0.00 0.00 54.97 56.21 3lfs s GLU 28 Cb 0.00 -3.41 -0.05 0.00 2.00 0.00 0.00 34.13 32.67 3lfs s GLU 28 CO 0.00 -0.08 1.11 0.14 -0.56 0.00 0.00 175.26 175.86 3lfs s VAL 29 N 0.86 4.26 0.20 3.70 -7.23 -1.26 -1.87 120.40 119.06 3lfs s VAL 29 Ca 0.53 1.69 0.01 0.00 -1.81 0.00 0.00 61.98 62.40 3lfs s VAL 29 Cb -0.24 -4.08 -0.05 0.00 0.56 0.00 0.00 36.38 32.57 3lfs s VAL 29 CO 0.29 0.17 0.06 0.54 -0.31 0.00 0.00 175.10 175.84 3lfs s VAL 30 N 0.74 0.47 -0.26 1.32 0.11 0.73 -4.33 120.40 119.18 3lfs s VAL 30 Ca 0.54 -1.98 -0.07 0.00 -2.93 0.00 0.00 61.98 57.54 3lfs s VAL 30 Cb -0.27 -2.32 -0.02 0.00 -1.53 0.00 0.00 36.38 32.25 3lfs s VAL 30 CO 0.30 -0.27 0.07 0.00 -3.33 0.00 0.00 175.10 171.88 3lfs s ALA 31 N -3.81 3.13 -0.32 1.54 0.00 -0.45 -0.89 121.76 120.97 3lfs s ALA 31 Ca 0.30 -1.22 -0.08 0.00 0.00 0.00 0.00 51.96 50.96 3lfs s ALA 31 Cb 0.07 -2.10 0.01 0.00 0.00 0.00 0.00 23.12 21.11 3lfs s ALA 31 CO 0.08 -0.60 0.13 -1.17 0.00 0.00 0.00 175.76 174.19 3lfs s LEU 32 N 1.58 4.18 -0.20 0.00 1.98 0.20 -0.92 118.68 125.51 3lfs s LEU 32 Ca 0.05 -0.80 -0.09 0.00 -2.89 0.00 0.00 54.13 50.41 3lfs s LEU 32 Cb -0.16 -1.94 -0.04 0.00 0.66 0.00 0.00 46.19 44.71 3lfs s LEU 32 CO 0.03 -0.26 0.10 -0.75 -1.89 0.00 0.00 176.35 173.58 3lfs s LYS 33 N 1.52 4.06 -0.24 1.98 2.47 0.24 -0.52 119.74 129.25 3lfs s LYS 33 Ca 0.02 -0.29 0.02 0.00 -1.56 0.00 0.00 55.97 54.16 3lfs s LYS 33 Cb -0.18 -3.33 0.05 0.00 -1.46 0.00 0.00 37.83 32.92 3lfs s LYS 33 CO 0.04 0.25 -0.11 -1.59 0.16 0.00 0.00 175.35 174.10 3lfs s LYS 34 N 0.47 2.17 -0.16 4.03 0.00 -0.59 0.20 119.74 125.86 3lfs s LYS 34 Ca 0.05 -1.17 -0.18 0.00 0.00 0.00 0.00 55.97 54.68 3lfs s LYS 34 Cb -0.12 -2.74 -0.04 0.00 0.00 0.00 0.00 37.83 34.93 3lfs s LYS 34 CO -0.00 -0.52 0.48 0.42 0.00 0.00 0.00 175.35 175.73 3lfs s ILE 35 N 1.21 5.16 0.00 3.79 1.01 0.17 -2.97 121.20 129.57 3lfs s ILE 35 Ca -0.06 0.91 0.00 0.00 0.00 0.00 0.00 60.65 61.50 3lfs s ILE 35 Cb -0.19 -3.81 0.00 0.00 0.01 0.00 0.00 42.46 38.47 3lfs s ILE 35 CO -0.06 0.26 0.00 -2.11 0.00 0.00 0.00 174.94 173.02 3lfs n ARG 36 N 4.23 0.00 -0.61 2.79 1.85 -1.26 -2.02 116.66 121.65 3lfs n ARG 36 Ca -0.06 0.00 -0.22 0.00 -1.00 0.00 0.00 57.85 56.56 3lfs n ARG 36 Cb 0.51 0.00 0.02 0.00 -1.05 0.00 0.00 32.46 31.94 3lfs n ARG 36 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 177.63 177.27 3lfs n PRO 45 N 0.00 0.00 0.07 2.89 -0.04 -1.26 -5.04 135.00 131.62 3lfs n PRO 45 Ca 0.00 0.00 -0.06 0.00 -0.04 0.00 0.00 63.50 63.40 3lfs n PRO 45 Cb 0.00 -0.61 0.11 0.00 -0.04 0.00 0.00 33.50 32.96 3lfs n PRO 45 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3lfs h SER 46 N -0.61 0.33 -0.54 3.54 4.64 -2.03 -3.26 113.55 115.63 3lfs h SER 46 Ca -0.26 -0.19 -0.05 0.00 -0.47 0.00 0.00 61.79 60.82 3lfs h SER 46 Cb 0.80 -0.10 -0.03 0.00 -0.31 0.00 0.00 62.40 62.77 3lfs h SER 46 CO 0.14 0.84 0.15 0.71 -0.87 0.00 0.00 176.83 177.80 3lfs h THR 47 N 0.22 1.23 -0.41 2.95 1.35 -2.00 -2.33 112.91 113.93 3lfs h THR 47 Ca -0.00 -0.84 -0.08 0.00 -0.55 0.00 0.00 66.41 64.94 3lfs h THR 47 Cb 1.09 0.63 -0.02 0.00 -1.73 0.00 0.00 68.15 68.12 3lfs h THR 47 CO 0.09 0.32 -0.06 0.00 -0.25 0.00 0.00 175.52 175.62 3lfs h ALA 48 N 1.30 1.14 -0.05 6.62 0.00 -1.84 -2.18 119.26 124.25 3lfs h ALA 48 Ca 0.19 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 3lfs h ALA 48 Cb 0.30 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 3lfs h ALA 48 CO -0.00 0.55 0.01 0.82 0.00 0.00 0.00 179.25 180.63 3lfs h ILE 49 N 0.64 1.19 -0.09 0.00 1.08 -1.53 -2.64 117.51 116.16 3lfs h ILE 49 Ca 0.12 -0.56 0.02 0.00 -0.39 0.00 0.00 64.86 64.05 3lfs h ILE 49 Cb 0.48 1.47 -0.03 0.00 -3.07 0.00 0.00 36.82 35.68 3lfs h ILE 49 CO 0.03 0.15 -0.07 0.03 -0.69 0.00 0.00 178.15 177.60 3lfs h ARG 50 N -0.13 -0.08 -0.70 2.37 -0.00 -1.30 -1.82 114.38 112.72 3lfs h ARG 50 Ca 0.02 0.01 0.11 0.00 -0.50 0.00 0.00 59.98 59.61 3lfs h ARG 50 Cb 0.24 0.02 -0.08 0.00 0.00 0.00 0.00 29.97 30.14 3lfs h ARG 50 CO 0.00 -0.05 0.30 0.93 0.00 0.00 0.00 179.97 181.15 3lfs h GLU 51 N -0.08 0.48 0.01 0.04 4.39 -1.37 -2.02 114.58 116.03 3lfs h GLU 51 Ca 0.06 -0.03 -0.22 0.00 0.34 0.00 0.00 59.36 59.51 3lfs h GLU 51 Cb 0.16 -0.11 -0.00 0.00 -0.10 0.00 0.00 28.75 28.70 3lfs h GLU 51 CO -0.13 0.32 -0.94 0.82 -1.16 0.00 0.00 179.01 177.91 3lfs h ILE 52 N 0.49 1.44 0.00 3.13 2.04 -1.37 -3.25 117.51 120.00 3lfs h ILE 52 Ca 0.36 -2.56 -0.04 0.00 1.00 0.00 0.00 64.86 63.63 3lfs h ILE 52 Cb 0.46 2.48 -0.01 0.00 -0.74 0.00 0.00 36.82 39.01 3lfs h ILE 52 CO -0.33 0.76 -0.17 0.28 0.00 0.00 0.00 178.15 178.69 3lfs h SER 53 N 0.17 0.00 0.62 1.72 0.02 -0.72 -1.92 113.55 113.45 3lfs h SER 53 Ca -0.07 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.76 3lfs h SER 53 Cb 1.58 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 64.11 3lfs h SER 53 CO 0.16 0.17 -0.55 -0.07 -1.14 0.00 0.00 176.83 175.39 3lfs h LEU 54 N 0.00 0.00 -1.19 5.07 3.38 -1.42 -3.18 115.31 117.98 3lfs h LEU 54 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3lfs h LEU 54 Cb 0.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.07 3lfs h LEU 54 CO 0.02 0.55 0.00 -0.07 0.09 0.00 0.00 178.44 179.03 3lfs h LEU 55 N 0.00 0.00 -1.10 1.67 3.38 -1.42 -2.80 115.31 115.04 3lfs h LEU 55 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3lfs h LEU 55 Cb 1.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.76 3lfs h LEU 55 CO 0.07 0.00 0.00 0.11 0.09 0.00 0.00 178.44 178.71 3lfs h LYS 56 N 0.00 0.00 -0.01 1.13 1.57 -1.63 -2.65 116.57 114.99 3lfs h LYS 56 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3lfs h LYS 56 Cb 0.37 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.68 3lfs h LYS 56 CO 0.00 0.00 -0.17 0.39 -0.57 0.00 0.00 179.45 179.10 3lfs n GLU 57 N -2.37 1.50 -2.36 3.15 4.71 -1.05 -4.77 120.64 119.44 3lfs n GLU 57 Ca 0.01 -0.98 -0.42 0.00 -0.01 0.00 0.00 57.16 55.76 3lfs n GLU 57 Cb 0.17 -1.22 0.00 0.00 -1.01 0.00 0.00 31.44 29.38 3lfs n GLU 57 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 3lfs n LEU 58 N 0.22 6.80 -4.73 -4.62 4.77 -1.00 -5.00 117.00 113.44 3lfs n LEU 58 Ca 0.07 -4.73 -0.36 0.00 -0.03 0.00 0.00 56.01 50.96 3lfs n LEU 58 Cb 0.31 -1.44 -0.08 0.00 -2.33 0.00 0.00 43.42 39.88 3lfs n LEU 58 CO 0.14 1.49 -0.11 0.20 -1.33 0.00 0.00 177.39 177.78 3lfs s ASN 59 N 0.51 6.30 -0.18 -1.43 0.02 -1.26 -4.95 114.94 113.95 3lfs s ASN 59 Ca 0.40 0.35 -0.28 0.00 -1.02 0.00 0.00 52.86 52.31 3lfs s ASN 59 Cb 0.10 -2.13 0.07 0.00 0.02 0.00 0.00 41.25 39.31 3lfs s ASN 59 CO 0.00 0.14 0.72 -2.28 0.02 0.00 0.00 177.10 175.70 3lfs s HIS 60 N 0.43 -0.72 0.61 2.20 2.46 -1.26 -5.07 115.29 113.93 3lfs s HIS 60 Ca 0.12 1.57 0.28 0.00 0.47 0.00 0.00 55.06 57.49 3lfs s HIS 60 Cb -0.12 0.33 1.48 0.00 -0.13 0.00 0.00 32.58 34.14 3lfs s HIS 60 CO 0.01 -0.47 1.87 -1.35 -2.47 0.00 0.00 174.74 172.33 3lfs h PRO 61 N 4.13 0.00 -0.52 2.88 0.11 -1.99 -2.03 132.00 134.58 3lfs h PRO 61 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 3lfs h PRO 61 Cb 1.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 3lfs h PRO 61 CO 0.19 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 178.07 3lfs n ASN 62 N -3.44 4.77 -4.09 -2.05 4.13 -1.26 -4.86 115.26 108.46 3lfs n ASN 62 Ca 0.05 -2.70 -0.28 0.00 1.68 0.00 0.00 54.58 53.34 3lfs n ASN 62 Cb 0.60 -0.58 -0.17 0.00 -1.54 0.00 0.00 39.78 38.10 3lfs n ASN 62 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 3lfs s ILE 63 N -2.29 1.49 0.08 2.41 1.09 -0.76 -1.79 121.20 121.42 3lfs s ILE 63 Ca 0.48 -0.67 -0.31 0.00 -1.10 0.00 0.00 60.65 59.06 3lfs s ILE 63 Cb 0.35 -1.33 -0.09 0.00 -1.06 0.00 0.00 42.46 40.32 3lfs s ILE 63 CO 0.18 0.44 1.83 -0.69 -0.10 0.00 0.00 174.94 176.59 3lfs s VAL 64 N 0.67 2.81 0.09 2.92 1.01 -0.49 -4.62 120.40 122.79 3lfs s VAL 64 Ca -0.13 0.15 -0.31 0.00 0.00 0.00 0.00 61.98 61.69 3lfs s VAL 64 Cb -0.16 -3.10 -0.08 0.00 0.00 0.00 0.00 36.38 33.05 3lfs s VAL 64 CO 0.04 -0.00 1.47 -0.75 0.00 0.00 0.00 175.10 175.85 3lfs s LYS 65 N 3.30 4.27 -0.75 2.72 2.20 -1.26 -4.93 119.74 125.29 3lfs s LYS 65 Ca 0.82 2.14 -0.21 0.00 -0.36 0.00 0.00 55.97 58.36 3lfs s LYS 65 Cb -0.43 -3.38 0.10 0.00 -1.51 0.00 0.00 37.83 32.61 3lfs s LYS 65 CO 0.37 -0.55 0.99 -1.17 -0.36 0.00 0.00 175.35 174.62 3lfs s LEU 66 N 1.71 4.76 0.10 5.43 2.96 -1.26 -2.27 118.68 130.11 3lfs s LEU 66 Ca 0.67 -1.43 -0.15 0.00 -0.22 0.00 0.00 54.13 53.00 3lfs s LEU 66 Cb -0.37 -2.40 -0.09 0.00 0.50 0.00 0.00 46.19 43.84 3lfs s LEU 66 CO 0.30 -1.26 1.43 -0.07 -1.32 0.00 0.00 176.35 175.42 3lfs h LEU 67 N 10.83 0.71 -7.08 -0.68 4.07 -1.21 -3.43 115.31 118.52 3lfs h LEU 67 Ca -0.13 -0.46 -0.03 0.00 0.08 0.00 0.00 57.88 57.34 3lfs h LEU 67 Cb 1.06 -0.20 -0.13 0.00 1.08 0.00 0.00 40.66 42.47 3lfs h LEU 67 CO 1.14 1.02 0.15 -1.81 -1.08 0.00 0.00 178.44 177.86 3lfs s ASP 68 N -6.48 -0.50 -0.19 -0.43 1.01 -1.09 -5.00 116.67 103.98 3lfs s ASP 68 Ca -0.13 -0.02 -0.01 0.00 0.71 0.00 0.00 52.55 53.10 3lfs s ASP 68 Cb 0.08 0.57 0.05 0.00 1.01 0.00 0.00 42.92 44.64 3lfs s ASP 68 CO 0.82 -0.92 -0.01 -0.69 0.21 0.00 0.00 175.17 174.57 3lfs s VAL 69 N -3.60 0.94 -0.19 -1.27 1.01 -1.26 -1.61 120.40 114.42 3lfs s VAL 69 Ca 0.01 -0.71 -0.01 0.00 0.00 0.00 0.00 61.98 61.27 3lfs s VAL 69 Cb -0.00 -1.27 0.01 0.00 0.00 0.00 0.00 36.38 35.11 3lfs s VAL 69 CO -0.11 -0.06 -0.14 -0.63 0.00 0.00 0.00 175.10 174.15 3lfs s ILE 70 N 1.68 2.57 -0.37 2.22 1.01 -0.48 -5.01 121.20 122.82 3lfs s ILE 70 Ca -0.01 -0.77 -0.03 0.00 0.00 0.00 0.00 60.65 59.84 3lfs s ILE 70 Cb -0.17 -2.11 0.09 0.00 0.01 0.00 0.00 42.46 40.28 3lfs s ILE 70 CO -0.07 0.50 0.14 -2.28 0.00 0.00 0.00 174.94 173.23 3lfs s HIS 71 N 1.27 3.48 0.06 3.97 2.46 -1.26 -0.90 115.29 124.37 3lfs s HIS 71 Ca 0.04 -2.20 0.03 0.00 0.47 0.00 0.00 55.06 53.39 3lfs s HIS 71 Cb -0.14 -2.85 -0.03 0.00 -0.13 0.00 0.00 32.58 29.43 3lfs s HIS 71 CO -0.08 -0.91 -0.09 0.99 -2.47 0.00 0.00 174.74 172.19 3lfs s THR 72 N 1.19 0.69 -1.36 0.89 2.01 -1.11 -4.88 115.64 113.07 3lfs s THR 72 Ca 0.04 -1.33 -0.17 0.00 0.31 0.00 0.00 61.69 60.54 3lfs s THR 72 Cb -0.22 -0.95 0.17 0.00 0.01 0.00 0.00 72.50 71.52 3lfs s THR 72 CO -0.03 -0.47 0.43 -0.62 -0.69 0.00 0.00 174.62 173.24 3lfs n GLU 73 N 1.06 -0.98 -3.55 4.92 4.71 -1.26 -0.31 120.64 125.23 3lfs n GLU 73 Ca -0.20 0.10 -0.20 0.00 -0.01 0.00 0.00 57.16 56.86 3lfs n GLU 73 Cb 0.56 -3.81 0.07 0.00 -1.01 0.00 0.00 31.44 27.25 3lfs n GLU 73 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 3lfs n ASN 74 N -1.77 -2.20 -3.76 1.62 4.13 -1.26 -5.05 115.26 106.96 3lfs n ASN 74 Ca 0.09 -0.69 -0.13 0.00 1.68 0.00 0.00 54.58 55.53 3lfs n ASN 74 Cb 0.37 -4.72 -0.11 0.00 -1.54 0.00 0.00 39.78 33.79 3lfs n ASN 74 CO 0.00 0.00 0.00 -1.59 0.28 0.00 0.00 177.26 175.95 3lfs s LYS 75 N -5.69 0.42 -0.20 3.52 -2.85 0.57 -5.03 119.74 110.48 3lfs s LYS 75 Ca 0.07 0.36 -0.16 0.00 -1.00 0.00 0.00 55.97 55.25 3lfs s LYS 75 Cb -0.03 0.20 -0.04 0.00 -2.06 0.00 0.00 37.83 35.90 3lfs s LYS 75 CO 0.76 -0.06 0.39 -0.51 0.10 0.00 0.00 175.35 176.02 3lfs s LEU 76 N -0.04 4.16 -0.14 2.77 1.43 -0.86 -2.75 118.68 123.26 3lfs s LEU 76 Ca -0.02 0.51 -0.01 0.00 -1.03 0.00 0.00 54.13 53.58 3lfs s LEU 76 Cb -0.03 -2.50 -0.02 0.00 0.03 0.00 0.00 46.19 43.68 3lfs s LEU 76 CO 0.01 -0.06 -0.11 -0.31 0.23 0.00 0.00 176.35 176.12 3lfs s TYR 77 N 1.21 2.86 -0.16 0.29 2.02 -0.08 0.44 117.35 123.94 3lfs s TYR 77 Ca 0.19 -0.62 0.01 0.00 -0.37 0.00 0.00 57.07 56.27 3lfs s TYR 77 Cb -0.15 -1.89 0.02 0.00 -0.40 0.00 0.00 41.96 39.55 3lfs s TYR 77 CO 0.08 -0.22 -0.18 -0.51 -1.57 0.00 0.00 175.55 173.15 3lfs s LEU 78 N 0.46 1.97 -0.32 -1.29 1.43 0.13 -1.38 118.68 119.68 3lfs s LEU 78 Ca -0.08 -0.58 -0.13 0.00 -1.03 0.00 0.00 54.13 52.31 3lfs s LEU 78 Cb -0.15 -1.36 -0.03 0.00 0.03 0.00 0.00 46.19 44.68 3lfs s LEU 78 CO 0.04 -0.01 0.27 -0.69 0.23 0.00 0.00 176.35 176.20 3lfs s VAL 79 N 1.27 5.25 0.29 -1.59 1.01 -0.63 -0.60 120.40 125.40 3lfs s VAL 79 Ca 0.03 0.00 0.11 0.00 0.00 0.00 0.00 61.98 62.12 3lfs s VAL 79 Cb -0.13 -3.70 -0.05 0.00 0.00 0.00 0.00 36.38 32.50 3lfs s VAL 79 CO -0.10 0.04 -0.16 -0.36 0.00 0.00 0.00 175.10 174.52 3lfs s PHE 80 N 1.83 2.35 0.31 5.22 0.08 -0.10 -0.62 117.98 127.05 3lfs s PHE 80 Ca 0.08 -0.35 -0.29 0.00 0.12 0.00 0.00 56.93 56.50 3lfs s PHE 80 Cb -0.17 -1.07 -0.10 0.00 -0.57 0.00 0.00 43.02 41.11 3lfs s PHE 80 CO 0.11 0.69 1.18 -1.83 -0.10 0.00 0.00 175.22 175.27 3lfs s GLU 81 N -3.54 4.47 0.03 0.44 -1.05 -0.96 -1.34 118.70 116.74 3lfs s GLU 81 Ca 0.31 1.95 -0.22 0.00 -0.15 0.00 0.00 54.97 56.86 3lfs s GLU 81 Cb -0.04 -3.08 -0.06 0.00 -0.44 0.00 0.00 34.13 30.51 3lfs s GLU 81 CO 0.16 0.00 0.65 0.12 0.95 0.00 0.00 175.26 177.14 3lfs s PHE 82 N -1.19 3.72 -0.03 4.83 5.36 -1.26 -4.55 117.98 124.87 3lfs s PHE 82 Ca 0.48 1.30 0.02 0.00 -0.96 0.00 0.00 56.93 57.77 3lfs s PHE 82 Cb -0.34 -2.66 0.01 0.00 -0.34 0.00 0.00 43.02 39.68 3lfs s PHE 82 CO 0.45 0.37 -0.09 -0.51 -1.46 0.00 0.00 175.22 173.98 3lfs s LEU 83 N -0.32 1.74 0.45 6.12 1.02 -1.26 -5.03 118.68 121.40 3lfs s LEU 83 Ca 0.33 -0.19 0.18 0.00 0.02 0.00 0.00 54.13 54.47 3lfs s LEU 83 Cb -0.19 -0.56 1.06 0.00 0.02 0.00 0.00 46.19 46.51 3lfs s LEU 83 CO 0.19 0.05 1.96 0.45 0.02 0.00 0.00 176.35 179.03 3lfs h HIS 84 N 6.49 0.00 -3.81 0.29 3.86 -1.99 -3.47 115.15 116.52 3lfs h HIS 84 Ca -0.33 0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 58.79 3lfs h HIS 84 Cb 1.17 0.00 -0.14 0.00 1.06 0.00 0.00 27.41 29.51 3lfs h HIS 84 CO 0.45 0.22 -0.34 -1.14 0.86 0.00 0.00 177.93 177.98 3lfs s GLN 85 N -4.33 0.94 0.29 2.45 0.74 -1.22 -5.07 119.66 113.45 3lfs s GLN 85 Ca -0.03 -1.00 0.09 0.00 0.05 0.00 0.00 55.36 54.46 3lfs s GLN 85 Cb 0.14 0.36 -0.04 0.00 1.10 0.00 0.00 33.01 34.57 3lfs s GLN 85 CO 0.67 -0.32 0.08 0.16 -0.55 0.00 0.00 175.29 175.33 3lfs s ASP 86 N -2.89 4.77 0.30 6.67 1.47 -1.26 -1.10 116.67 124.63 3lfs s ASP 86 Ca 0.08 -0.61 0.01 0.00 1.18 0.00 0.00 52.55 53.21 3lfs s ASP 86 Cb 0.04 -0.91 0.49 0.00 -0.34 0.00 0.00 42.92 42.20 3lfs s ASP 86 CO -0.08 -0.10 1.86 0.25 0.68 0.00 0.00 175.17 177.78 3lfs h LEU 87 N 1.71 0.68 -0.27 2.11 5.85 -0.88 -2.77 115.31 121.74 3lfs h LEU 87 Ca -0.45 -0.11 0.05 0.00 0.84 0.00 0.00 57.88 58.21 3lfs h LEU 87 Cb 1.25 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 42.05 3lfs h LEU 87 CO 0.61 0.67 -0.04 0.50 -0.34 0.00 0.00 178.44 179.84 3lfs h LYS 88 N 0.70 0.03 -0.68 1.25 1.63 -1.81 -0.21 116.57 117.48 3lfs h LYS 88 Ca 0.16 -0.00 -0.07 0.00 -0.85 0.00 0.00 60.65 59.89 3lfs h LYS 88 Cb 0.27 -0.01 -0.03 0.00 -0.60 0.00 0.00 32.23 31.87 3lfs h LYS 88 CO -0.00 0.02 0.15 0.87 -3.45 0.00 0.00 179.45 177.04 3lfs h LYS 89 N 0.03 1.09 -0.50 1.90 1.57 -1.88 -2.64 116.57 116.14 3lfs h LYS 89 Ca 0.13 -0.27 -0.03 0.00 -1.87 0.00 0.00 60.65 58.62 3lfs h LYS 89 Cb 0.19 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.34 3lfs h LYS 89 CO -0.26 0.98 0.21 0.35 -0.57 0.00 0.00 179.45 180.15 3lfs h PHE 90 N 1.02 0.75 -0.45 -1.35 3.57 -1.17 -2.17 116.94 117.15 3lfs h PHE 90 Ca 0.21 -0.05 -0.02 0.00 3.53 0.00 0.00 57.97 61.63 3lfs h PHE 90 Cb 0.38 -0.23 -0.02 0.00 2.79 0.00 0.00 35.95 38.87 3lfs h PHE 90 CO 0.03 0.62 0.18 0.52 -2.23 0.00 0.00 178.31 177.43 3lfs h MET 91 N 0.67 0.64 -0.09 1.11 2.86 -0.90 -1.08 114.93 118.14 3lfs h MET 91 Ca 0.17 -0.09 -0.18 0.00 -2.06 0.00 0.00 59.70 57.54 3lfs h MET 91 Cb 0.18 -0.12 0.01 0.00 0.06 0.00 0.00 31.60 31.73 3lfs h MET 91 CO -0.02 0.53 -0.65 -0.44 1.06 0.00 0.00 176.91 177.40 3lfs h ASP 92 N 0.64 0.73 -0.22 1.22 3.32 -1.34 -2.30 116.42 118.47 3lfs h ASP 92 Ca 0.16 -0.67 -0.08 0.00 0.02 0.00 0.00 57.03 56.46 3lfs h ASP 92 Cb 0.13 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.44 3lfs h ASP 92 CO -0.02 1.28 -0.12 0.00 -1.72 0.00 0.00 179.24 178.66 3lfs h ALA 93 N 0.46 1.12 -0.52 3.45 0.00 -1.19 -2.95 119.26 119.64 3lfs h ALA 93 Ca -0.06 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.56 3lfs h ALA 93 Cb 1.30 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.94 3lfs h ALA 93 CO 0.13 0.55 0.00 0.43 0.00 0.00 0.00 179.25 180.36 3lfs n SER 94 N -4.18 3.07 -0.09 0.00 7.64 -0.43 -4.62 113.62 115.02 3lfs n SER 94 Ca 0.01 -2.09 0.01 0.00 1.01 0.00 0.00 58.87 57.81 3lfs n SER 94 Cb 0.35 -0.40 0.31 0.00 -1.01 0.00 0.00 64.21 63.46 3lfs n SER 94 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3lfs h ALA 95 N 3.90 1.50 0.00 -0.43 0.00 -1.23 0.42 119.26 123.43 3lfs h ALA 95 Ca 0.00 -0.09 -0.12 0.00 0.00 0.00 0.00 54.91 54.71 3lfs h ALA 95 Cb 0.83 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 3lfs h ALA 95 CO 0.05 0.41 -0.65 -0.07 0.00 0.00 0.00 179.25 179.00 3lfs h LEU 96 N 0.74 0.00 0.00 0.00 4.07 -1.84 -3.37 115.31 114.91 3lfs h LEU 96 Ca 0.19 0.00 -0.25 0.00 0.08 0.00 0.00 57.88 57.90 3lfs h LEU 96 Cb 0.03 0.00 -0.05 0.00 1.08 0.00 0.00 40.66 41.72 3lfs h LEU 96 CO -0.03 0.52 -1.96 0.35 -1.08 0.00 0.00 178.44 176.24 3lfs n THR 97 N -3.18 0.96 0.00 0.22 -2.24 -1.18 -5.14 114.28 103.73 3lfs n THR 97 Ca 0.00 -0.52 0.00 0.00 -2.27 0.00 0.00 64.05 61.27 3lfs n THR 97 Cb 0.75 -0.79 0.00 0.00 -2.10 0.00 0.00 70.33 68.19 3lfs n THR 97 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3lfs n GLY 98 N 2.32 -0.04 3.70 3.38 0.00 0.15 -4.93 105.19 109.76 3lfs n GLY 98 Ca -0.25 -1.62 -0.42 0.00 0.00 0.00 0.00 46.02 43.73 3lfs n GLY 98 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3lfs s ILE 99 N -2.96 4.85 0.37 -0.61 1.01 -1.26 -4.94 121.20 117.66 3lfs s ILE 99 Ca 0.00 1.99 -0.28 0.00 0.00 0.00 0.00 60.65 62.36 3lfs s ILE 99 Cb 0.00 -4.29 -0.11 0.00 0.01 0.00 0.00 42.46 38.07 3lfs s ILE 99 CO 0.00 0.10 1.39 -2.65 0.00 0.00 0.00 174.94 173.78 3lfs n PRO 100 N 4.39 2.40 -0.27 2.79 -0.02 -1.26 -4.76 135.00 138.27 3lfs n PRO 100 Ca 0.06 0.84 0.07 0.00 -2.02 0.00 0.00 63.50 62.46 3lfs n PRO 100 Cb 0.50 -2.51 0.19 0.00 -0.02 0.00 0.00 33.50 31.66 3lfs n PRO 100 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3lfs h LEU 101 N 2.72 -0.26 -1.53 2.45 5.85 -1.99 -1.27 115.31 121.27 3lfs h LEU 101 Ca -0.49 0.20 0.10 0.00 0.84 0.00 0.00 57.88 58.53 3lfs h LEU 101 Cb 1.26 0.33 -0.04 0.00 0.37 0.00 0.00 40.66 42.58 3lfs h LEU 101 CO 0.63 -0.17 0.45 -0.65 -0.34 0.00 0.00 178.44 178.36 3lfs h PRO 102 N 0.13 0.51 -0.11 5.25 0.11 -1.98 -0.92 132.00 134.98 3lfs h PRO 102 Ca 0.45 -0.03 -0.13 0.00 0.11 0.00 0.00 66.00 66.40 3lfs h PRO 102 Cb 0.83 -0.12 0.01 0.00 0.11 0.00 0.00 31.00 31.83 3lfs h PRO 102 CO -0.67 0.34 -0.45 1.25 -0.21 0.00 0.00 178.00 178.26 3lfs h LEU 103 N 0.53 0.59 -0.40 2.35 5.85 -1.61 -2.48 115.31 120.13 3lfs h LEU 103 Ca 0.31 -0.63 0.04 0.00 0.84 0.00 0.00 57.88 58.45 3lfs h LEU 103 Cb 0.52 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.34 3lfs h LEU 103 CO -0.10 1.12 0.18 0.40 -0.34 0.00 0.00 178.44 179.69 3lfs h ILE 104 N 0.10 0.93 -0.09 4.05 2.04 -1.01 -1.65 117.51 121.88 3lfs h ILE 104 Ca -0.02 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 65.71 3lfs h ILE 104 Cb 1.09 0.54 -0.00 0.00 -0.74 0.00 0.00 36.82 37.70 3lfs h ILE 104 CO 0.09 0.07 0.06 0.50 0.00 0.00 0.00 178.15 178.87 3lfs h LYS 105 N 0.36 0.11 -0.54 2.37 3.64 -1.21 -2.04 116.57 119.27 3lfs h LYS 105 Ca 0.18 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.54 3lfs h LYS 105 Cb 0.12 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 31.89 3lfs h LYS 105 CO -0.15 0.08 0.29 1.03 -2.27 0.00 0.00 179.45 178.43 3lfs h SER 106 N 0.12 0.67 -0.28 4.20 0.87 -1.31 -0.55 113.55 117.27 3lfs h SER 106 Ca 0.03 -0.09 -0.01 0.00 -1.23 0.00 0.00 61.79 60.49 3lfs h SER 106 Cb -0.01 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 61.76 3lfs h SER 106 CO -0.01 0.57 0.14 1.88 -0.53 0.00 0.00 176.83 178.88 3lfs h TYR 107 N 0.72 0.39 -0.49 2.24 0.05 -1.26 -1.28 116.97 117.33 3lfs h TYR 107 Ca 0.19 -0.01 -0.02 0.00 0.05 0.00 0.00 58.73 58.94 3lfs h TYR 107 Cb 0.05 -0.12 -0.02 0.00 1.01 0.00 0.00 36.73 37.64 3lfs h TYR 107 CO -0.02 0.34 0.24 1.25 -1.05 0.00 0.00 178.16 178.92 3lfs h LEU 108 N 0.32 0.64 -0.42 3.88 5.85 -1.22 0.29 115.31 124.66 3lfs h LEU 108 Ca 0.10 -0.12 0.05 0.00 0.84 0.00 0.00 57.88 58.74 3lfs h LEU 108 Cb 0.09 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 40.90 3lfs h LEU 108 CO -0.01 0.59 0.15 0.15 -0.34 0.00 0.00 178.44 178.97 3lfs h PHE 109 N 0.65 0.26 -0.29 1.25 3.57 -0.95 0.34 116.94 121.79 3lfs h PHE 109 Ca 0.17 0.02 -0.17 0.00 3.53 0.00 0.00 57.97 61.52 3lfs h PHE 109 Cb 0.11 -0.06 -0.00 0.00 2.79 0.00 0.00 35.95 38.79 3lfs h PHE 109 CO -0.01 0.10 -0.51 1.96 -2.23 0.00 0.00 178.31 177.62 3lfs h GLN 110 N 0.31 0.82 -0.40 1.11 4.20 -1.05 -2.44 115.11 117.66 3lfs h GLN 110 Ca 0.19 -0.50 -0.03 0.00 0.06 0.00 0.00 58.65 58.37 3lfs h GLN 110 Cb 0.18 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.99 3lfs h GLN 110 CO -0.20 1.13 0.12 -0.07 -0.67 0.00 0.00 178.83 179.14 3lfs h LEU 111 N 0.64 0.58 -1.78 1.46 4.07 -0.64 -2.22 115.31 117.42 3lfs h LEU 111 Ca 0.02 -0.21 -0.01 0.00 0.08 0.00 0.00 57.88 57.76 3lfs h LEU 111 Cb 1.10 -0.15 -0.01 0.00 1.08 0.00 0.00 40.66 42.68 3lfs h LEU 111 CO 0.11 0.64 0.03 -0.07 -1.08 0.00 0.00 178.44 178.08 3lfs h LEU 112 N 0.50 0.15 -0.22 1.67 4.07 -0.89 -1.21 115.31 119.37 3lfs h LEU 112 Ca 0.13 -0.01 -0.19 0.00 0.08 0.00 0.00 57.88 57.89 3lfs h LEU 112 Cb 0.27 -0.04 0.00 0.00 1.08 0.00 0.00 40.66 41.97 3lfs h LEU 112 CO -0.00 0.16 -0.59 1.56 -1.08 0.00 0.00 178.44 178.48 3lfs h GLN 113 N 0.18 0.80 0.03 1.13 4.20 -1.21 -1.61 115.11 118.62 3lfs h GLN 113 Ca 0.04 -0.56 -0.00 0.00 0.06 0.00 0.00 58.65 58.19 3lfs h GLN 113 Cb 0.07 0.09 0.00 0.00 0.30 0.00 0.00 27.48 27.93 3lfs h GLN 113 CO -0.00 1.18 -0.01 0.78 -0.67 0.00 0.00 178.83 180.11 3lfs h GLY 114 N 0.55 -0.04 0.85 3.46 0.00 -0.77 -2.78 103.07 104.34 3lfs h GLY 114 Ca -0.01 0.01 0.01 0.00 0.00 0.00 0.00 47.33 47.34 3lfs h GLY 114 CO 0.13 -0.01 -0.06 1.41 0.00 0.00 0.00 176.54 178.00 3lfs h LEU 115 N -0.21 -0.18 -0.87 3.11 4.07 -1.31 -2.74 115.31 117.19 3lfs h LEU 115 Ca -0.00 0.03 0.15 0.00 0.08 0.00 0.00 57.88 58.13 3lfs h LEU 115 Cb 0.19 0.08 -0.09 0.00 1.08 0.00 0.00 40.66 41.91 3lfs h LEU 115 CO 0.01 -0.10 0.46 0.00 -1.08 0.00 0.00 178.44 177.73 3lfs h ALA 116 N 0.86 1.32 0.10 1.53 0.00 -1.31 0.82 119.26 122.59 3lfs h ALA 116 Ca 0.02 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 3lfs h ALA 116 Cb 0.14 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.90 3lfs h ALA 116 CO -0.06 -0.07 -0.05 0.35 0.00 0.00 0.00 179.25 179.42 3lfs h PHE 117 N 0.65 -0.13 -0.12 0.00 3.57 -1.35 -2.69 116.94 116.88 3lfs h PHE 117 Ca 0.47 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.96 3lfs h PHE 117 Cb 0.66 0.04 -0.00 0.00 2.79 0.00 0.00 35.95 39.44 3lfs h PHE 117 CO -0.08 0.09 0.04 0.00 -2.23 0.00 0.00 178.31 176.13 3lfs h HIS 119 N 0.01 0.00 0.00 0.00 3.86 -0.77 -0.64 115.15 117.61 3lfs h HIS 119 Ca 0.04 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.19 3lfs h HIS 119 Cb 0.21 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.67 3lfs h HIS 119 CO -0.00 0.01 -0.27 0.66 0.86 0.00 0.00 177.93 179.18 3lfs h SER 120 N 0.00 0.00 -0.47 2.45 4.64 -1.27 -3.09 113.55 115.81 3lfs h SER 120 Ca -0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 3lfs h SER 120 Cb 0.04 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.12 3lfs h SER 120 CO 0.00 0.27 0.03 1.41 -0.87 0.00 0.00 176.83 177.67 3lfs n HIS 121 N -3.23 1.69 -3.22 4.77 8.25 -0.34 -4.94 115.22 118.20 3lfs n HIS 121 Ca 0.02 -0.87 -0.23 0.00 -0.26 0.00 0.00 57.72 56.38 3lfs n HIS 121 Cb 0.57 -0.46 0.03 0.00 1.12 0.00 0.00 29.99 31.25 3lfs n HIS 121 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 3lfs n ARG 122 N 0.06 -4.80 -4.74 -0.41 1.74 -1.14 -5.01 116.66 102.37 3lfs n ARG 122 Ca 0.27 0.77 -0.33 0.00 -0.77 0.00 0.00 57.85 57.79 3lfs n ARG 122 Cb 1.11 -5.61 -0.14 0.00 -1.02 0.00 0.00 32.46 26.80 3lfs n ARG 122 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3lfs s VAL 123 N -3.13 3.03 0.17 1.55 1.01 -0.64 -5.00 120.40 117.39 3lfs s VAL 123 Ca 0.38 -0.66 0.11 0.00 0.00 0.00 0.00 61.98 61.80 3lfs s VAL 123 Cb -0.18 -2.28 -0.04 0.00 0.00 0.00 0.00 36.38 33.88 3lfs s VAL 123 CO 0.46 0.52 -0.24 -1.48 0.00 0.00 0.00 175.10 174.37 3lfs s LEU 124 N 0.41 2.40 -0.11 3.92 2.34 -1.26 -3.05 118.68 123.33 3lfs s LEU 124 Ca -0.10 -0.82 -0.07 0.00 0.06 0.00 0.00 54.13 53.19 3lfs s LEU 124 Cb -0.16 -1.11 -0.06 0.00 -0.56 0.00 0.00 46.19 44.31 3lfs s LEU 124 CO 0.05 0.11 0.15 -0.74 -1.06 0.00 0.00 176.35 174.86 3lfs h HIS 125 N 3.44 0.00 0.00 3.48 -0.00 -1.95 -3.32 115.15 116.79 3lfs h HIS 125 Ca -0.47 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 59.90 3lfs h HIS 125 Cb 1.20 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.61 3lfs h HIS 125 CO 0.66 0.23 0.00 -2.13 -0.00 0.00 0.00 177.93 176.69 3lfs n ARG 126 N -4.73 0.00 -3.00 5.26 0.00 -1.26 -4.31 116.66 108.62 3lfs n ARG 126 Ca -0.03 0.00 -0.15 0.00 -0.00 0.00 0.00 57.85 57.67 3lfs n ARG 126 Cb 0.13 -1.03 -0.01 0.00 0.00 0.00 0.00 32.46 31.55 3lfs n ARG 126 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.63 174.16 3lfs n ASP 127 N 0.00 0.88 -4.73 6.15 2.03 -1.26 -4.99 116.55 114.63 3lfs n ASP 127 Ca 0.00 -2.93 -0.41 0.00 0.52 0.00 0.00 54.79 51.97 3lfs n ASP 127 Cb 0.00 -0.49 -0.04 0.00 -0.72 0.00 0.00 41.12 39.87 3lfs n ASP 127 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3lfs s LEU 128 N -2.65 4.47 0.02 -2.67 1.43 -1.26 -4.96 118.68 113.06 3lfs s LEU 128 Ca 0.35 2.03 -0.22 0.00 -1.03 0.00 0.00 54.13 55.26 3lfs s LEU 128 Cb 0.38 -3.60 0.05 0.00 0.03 0.00 0.00 46.19 43.05 3lfs s LEU 128 CO -0.04 -0.23 0.50 -1.59 0.23 0.00 0.00 176.35 175.22 3lfs s LYS 129 N -0.11 0.97 0.58 1.70 -2.85 -1.26 -4.77 119.74 114.00 3lfs s LYS 129 Ca 0.50 -0.17 0.29 0.00 -1.00 0.00 0.00 55.97 55.59 3lfs s LYS 129 Cb -0.28 0.44 1.50 0.00 -2.06 0.00 0.00 37.83 37.43 3lfs s LYS 129 CO 0.33 -0.33 1.93 -1.35 0.10 0.00 0.00 175.35 176.03 3lfs h PRO 130 N 3.01 0.00 -0.68 1.78 0.11 -1.96 -2.14 132.00 132.12 3lfs h PRO 130 Ca -0.30 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.81 3lfs h PRO 130 Cb 1.19 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.27 3lfs h PRO 130 CO 0.41 0.00 0.42 0.37 -0.21 0.00 0.00 178.00 178.99 3lfs h GLN 131 N 0.00 0.92 -0.78 1.05 4.15 -1.96 -2.86 115.11 115.63 3lfs h GLN 131 Ca 0.21 -0.08 -0.09 0.00 0.77 0.00 0.00 58.65 59.45 3lfs h GLN 131 Cb 1.09 -0.20 -0.06 0.00 0.21 0.00 0.00 27.48 28.53 3lfs h GLN 131 CO -0.00 0.65 0.12 0.27 -1.93 0.00 0.00 178.83 177.93 3lfs n ASN 132 N -4.57 4.12 -4.16 -0.69 0.23 -0.80 -4.78 115.26 104.60 3lfs n ASN 132 Ca 0.06 -2.78 -0.34 0.00 -0.53 0.00 0.00 54.58 50.99 3lfs n ASN 132 Cb 0.05 -0.66 -0.14 0.00 -2.08 0.00 0.00 39.78 36.95 3lfs n ASN 132 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 3lfs s LEU 133 N -2.03 3.47 -0.10 -4.53 1.02 -1.10 -0.61 118.68 114.81 3lfs s LEU 133 Ca 0.39 -1.12 -0.02 0.00 0.02 0.00 0.00 54.13 53.40 3lfs s LEU 133 Cb 0.30 -1.65 -0.03 0.00 0.02 0.00 0.00 46.19 44.83 3lfs s LEU 133 CO 0.10 -0.19 -0.01 -0.76 0.02 0.00 0.00 176.35 175.51 3lfs s LEU 134 N 1.25 3.47 0.21 1.79 1.43 -0.07 -0.99 118.68 125.77 3lfs s LEU 134 Ca -0.04 0.06 0.11 0.00 -1.03 0.00 0.00 54.13 53.24 3lfs s LEU 134 Cb -0.18 -1.80 -0.05 0.00 0.03 0.00 0.00 46.19 44.19 3lfs s LEU 134 CO -0.04 0.32 -0.22 0.27 0.23 0.00 0.00 176.35 176.91 3lfs s ILE 135 N -0.55 2.32 0.34 -0.59 -4.36 -0.26 -0.53 121.20 117.56 3lfs s ILE 135 Ca 0.09 -2.11 0.03 0.00 -0.26 0.00 0.00 60.65 58.41 3lfs s ILE 135 Cb -0.12 -2.13 -0.05 0.00 1.25 0.00 0.00 42.46 41.41 3lfs s ILE 135 CO 0.02 -0.20 0.08 0.54 0.24 0.00 0.00 174.94 175.62 3lfs s ASN 136 N -2.86 2.30 0.57 4.36 2.20 -1.08 -3.46 114.94 116.97 3lfs s ASN 136 Ca 0.22 -1.46 0.35 0.00 -0.94 0.00 0.00 52.86 51.03 3lfs s ASN 136 Cb -0.07 0.12 1.53 0.00 -2.00 0.00 0.00 41.25 40.82 3lfs s ASN 136 CO 0.11 -0.72 2.04 0.71 -2.94 0.00 0.00 177.10 176.30 3lfs h THR 137 N 2.07 0.02 -0.21 0.54 1.35 -1.92 -3.09 112.91 111.66 3lfs h THR 137 Ca -0.39 -0.45 0.00 0.00 -0.55 0.00 0.00 66.41 65.02 3lfs h THR 137 Cb 1.25 1.44 0.00 0.00 -1.73 0.00 0.00 68.15 69.11 3lfs h THR 137 CO 0.65 0.01 0.00 -0.62 -0.25 0.00 0.00 175.52 175.31 3lfs n GLU 138 N -3.10 1.56 -0.93 4.72 1.02 -1.26 -4.50 120.64 118.14 3lfs n GLU 138 Ca -0.00 -0.86 0.00 0.00 -0.02 0.00 0.00 57.16 56.28 3lfs n GLU 138 Cb 0.27 -1.25 0.00 0.00 -0.02 0.00 0.00 31.44 30.44 3lfs n GLU 138 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3lfs n GLY 139 N 0.94 0.50 3.89 0.62 0.00 -1.17 -4.85 105.19 105.13 3lfs n GLY 139 Ca 0.11 -0.30 -0.30 0.00 0.00 0.00 0.00 46.02 45.53 3lfs n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3lfs s ALA 140 N -2.00 3.54 -0.01 4.61 0.00 -1.26 -4.88 121.76 121.76 3lfs s ALA 140 Ca 0.00 -0.40 0.02 0.00 0.00 0.00 0.00 51.96 51.58 3lfs s ALA 140 Cb 0.00 -2.43 -0.00 0.00 0.00 0.00 0.00 23.12 20.69 3lfs s ALA 140 CO 0.00 0.25 -0.06 -1.50 0.00 0.00 0.00 175.76 174.45 3lfs s ILE 141 N -2.08 0.50 0.05 0.00 2.07 -1.26 -2.62 121.20 117.86 3lfs s ILE 141 Ca 0.47 -0.25 0.03 0.00 -1.41 0.00 0.00 60.65 59.48 3lfs s ILE 141 Cb -0.11 -0.43 -0.03 0.00 0.13 0.00 0.00 42.46 42.03 3lfs s ILE 141 CO 0.28 0.15 -0.09 -0.54 -1.91 0.00 0.00 174.94 172.83 3lfs s LYS 142 N -0.05 0.59 -0.20 3.50 1.02 0.31 -4.68 119.74 120.23 3lfs s LYS 142 Ca 0.01 -0.81 -0.19 0.00 0.02 0.00 0.00 55.97 55.00 3lfs s LYS 142 Cb -0.04 -0.38 -0.03 0.00 -0.52 0.00 0.00 37.83 36.86 3lfs s LYS 142 CO -0.00 0.07 0.55 -0.51 -0.92 0.00 0.00 175.35 174.54 3lfs s LEU 143 N -1.66 4.14 0.25 3.17 1.43 -0.74 -0.89 118.68 124.38 3lfs s LEU 143 Ca -0.08 0.71 0.06 0.00 -1.03 0.00 0.00 54.13 53.79 3lfs s LEU 143 Cb -0.09 -2.76 -0.03 0.00 0.03 0.00 0.00 46.19 43.34 3lfs s LEU 143 CO 0.01 -0.21 0.35 0.00 0.23 0.00 0.00 176.35 176.72 3lfs s ALA 144 N 1.75 3.91 -2.17 4.21 0.00 0.22 -1.40 121.76 128.29 3lfs s ALA 144 Ca 0.25 -1.29 0.00 0.00 0.00 0.00 0.00 51.96 50.92 3lfs s ALA 144 Cb -0.16 -1.65 0.00 0.00 0.00 0.00 0.00 23.12 21.31 3lfs s ALA 144 CO 0.10 0.21 0.00 -0.25 0.00 0.00 0.00 175.76 175.82 3lfs n ASP 145 N -1.40 -5.56 -4.65 0.00 8.00 -1.26 -4.88 116.55 106.80 3lfs n ASP 145 Ca -0.08 0.46 -0.42 0.00 0.71 0.00 0.00 54.79 55.46 3lfs n ASP 145 Cb 0.57 -4.86 -0.03 0.00 -0.02 0.00 0.00 41.12 36.79 3lfs n ASP 145 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 3lfs s PHE 146 N -2.80 1.94 0.00 1.24 2.19 -1.26 -3.00 117.98 116.28 3lfs s PHE 146 Ca 0.00 0.21 0.00 0.00 0.33 0.00 0.00 56.93 57.47 3lfs s PHE 146 Cb 0.00 -3.94 0.00 0.00 -1.31 0.00 0.00 43.02 37.77 3lfs s PHE 146 CO 0.00 -3.83 0.00 0.41 1.83 0.00 0.00 175.22 173.63 3lfs n GLY 147 N 4.25 1.45 0.28 13.12 0.00 -1.25 -4.96 105.19 118.08 3lfs n GLY 147 Ca 0.18 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.35 3lfs n GLY 147 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3lfs h LEU 148 N 0.00 0.00 -0.77 0.99 4.07 -1.83 -2.88 115.31 114.88 3lfs h LEU 148 Ca 0.00 0.00 -0.12 0.00 0.08 0.00 0.00 57.88 57.84 3lfs h LEU 148 Cb 0.00 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 41.72 3lfs h LEU 148 CO 0.00 0.09 -0.58 0.00 -1.08 0.00 0.00 178.44 176.87 3lfs h ALA 149 N 1.91 0.96 -0.25 1.53 0.00 -1.75 -2.10 119.26 119.57 3lfs h ALA 149 Ca -0.00 -0.52 -0.16 0.00 0.00 0.00 0.00 54.91 54.23 3lfs h ALA 149 Cb 0.33 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3lfs h ALA 149 CO 0.01 0.72 -0.47 -0.09 0.00 0.00 0.00 179.25 179.43 3lfs h ARG 150 N 0.00 0.76 -0.29 0.00 2.43 -1.80 -3.02 114.38 112.45 3lfs h ARG 150 Ca -0.01 -0.48 -0.01 0.00 -0.81 0.00 0.00 59.98 58.68 3lfs h ARG 150 Cb 1.07 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.67 3lfs h ARG 150 CO 0.07 1.11 0.15 0.00 -1.51 0.00 0.00 179.97 179.79 3lfs h ALA 151 N 0.64 0.37 -3.26 2.80 0.00 -1.56 -3.42 119.26 114.84 3lfs h ALA 151 Ca 0.01 -0.08 -0.36 0.00 0.00 0.00 0.00 54.91 54.48 3lfs h ALA 151 Cb 1.07 -0.12 -0.39 0.00 0.00 0.00 0.00 17.79 18.36 3lfs h ALA 151 CO 0.10 -0.09 -0.73 -0.06 0.00 0.00 0.00 179.25 178.48 3lfs s PHE 152 N -5.82 0.03 0.70 0.00 0.08 -0.80 -4.70 117.98 107.48 3lfs s PHE 152 Ca -0.13 0.28 -0.16 0.00 0.12 0.00 0.00 56.93 57.03 3lfs s PHE 152 Cb 0.09 -0.46 -0.02 0.00 -0.57 0.00 0.00 43.02 42.06 3lfs s PHE 152 CO 0.72 -0.22 0.82 0.41 -0.10 0.00 0.00 175.22 176.84 3lfs n GLY 153 N 5.30 -0.80 3.62 4.36 0.00 -1.14 -4.07 105.19 112.46 3lfs n GLY 153 Ca -0.03 -0.32 -0.43 0.00 0.00 0.00 0.00 46.02 45.23 3lfs n GLY 153 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3lfs s VAL 154 N -1.81 3.43 0.76 1.61 0.11 -1.26 -5.01 120.40 118.24 3lfs s VAL 154 Ca 0.71 0.48 -0.12 0.00 -2.93 0.00 0.00 61.98 60.12 3lfs s VAL 154 Cb -0.36 -3.47 0.05 0.00 -1.53 0.00 0.00 36.38 31.07 3lfs s VAL 154 CO 0.52 -0.22 1.12 -2.16 -3.33 0.00 0.00 175.10 171.04 3lfs s PRO 155 N 5.14 2.37 0.09 1.54 0.04 -1.26 -4.99 135.00 137.92 3lfs s PRO 155 Ca 0.81 0.39 -0.17 0.00 0.04 0.00 0.00 61.00 62.07 3lfs s PRO 155 Cb -0.28 -1.97 -0.08 0.00 0.04 0.00 0.00 34.50 32.20 3lfs s PRO 155 CO 0.33 -1.37 1.45 0.28 0.04 0.00 0.00 177.00 177.73 3lfs h VAL 156 N -0.90 1.30 -3.24 -0.36 2.07 -1.95 -3.43 116.25 109.74 3lfs h VAL 156 Ca -0.46 -1.24 -0.62 0.00 0.82 0.00 0.00 66.70 65.20 3lfs h VAL 156 Cb 1.28 1.53 -0.19 0.00 -1.52 0.00 0.00 31.29 32.39 3lfs h VAL 156 CO 0.63 0.39 -0.81 -0.13 0.02 0.00 0.00 177.57 177.67 3lfs s ARG 157 N -4.57 1.45 0.70 1.57 1.81 -1.26 -1.80 118.95 116.85 3lfs s ARG 157 Ca -0.13 -1.49 -0.11 0.00 -1.72 0.00 0.00 55.73 52.28 3lfs s ARG 157 Cb 0.08 -1.71 0.16 0.00 -0.45 0.00 0.00 34.95 33.03 3lfs s ARG 157 CO 0.79 0.37 0.96 0.25 -0.68 0.00 0.00 175.30 176.99 3lfs n THR 158 N 0.30 0.00 0.26 0.02 -2.24 0.99 -4.87 114.28 108.74 3lfs n THR 158 Ca -0.13 -0.78 0.11 0.00 -2.27 0.00 0.00 64.05 60.97 3lfs n THR 158 Cb 0.56 -1.56 0.70 0.00 -2.10 0.00 0.00 70.33 67.94 3lfs n THR 158 CO 0.00 0.00 0.00 0.10 -0.57 0.00 0.00 175.07 174.60 3lfs h TYR 159 N -1.45 0.00 -0.08 4.78 -0.00 -1.73 -0.74 116.97 117.75 3lfs h TYR 159 Ca -0.31 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.42 3lfs h TYR 159 Cb 0.88 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.61 3lfs h TYR 159 CO 0.00 0.09 0.00 0.25 -0.00 0.00 0.00 178.16 178.50 3lfs n THR 160 N -4.00 0.10 -1.12 -0.90 -2.24 -1.26 -4.92 114.28 99.94 3lfs n THR 160 Ca -0.02 -0.25 -0.04 0.00 -2.27 0.00 0.00 64.05 61.46 3lfs n THR 160 Cb 0.18 0.29 -0.02 0.00 -2.10 0.00 0.00 70.33 68.68 3lfs n THR 160 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 3lfs n HIS 161 N 0.06 0.00 -2.40 4.78 8.25 -0.28 -5.03 115.22 120.60 3lfs n HIS 161 Ca 0.18 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.24 3lfs n HIS 161 Cb 0.30 -1.18 -0.04 0.00 1.12 0.00 0.00 29.99 30.19 3lfs n HIS 161 CO 0.00 0.00 0.00 -2.00 0.64 0.00 0.00 176.34 174.98 3lfs s GLU 162 N -1.75 4.49 -0.05 -0.41 2.12 -1.26 -4.62 118.70 117.23 3lfs s GLU 162 Ca 0.00 1.85 -0.30 0.00 0.36 0.00 0.00 54.97 56.88 3lfs s GLU 162 Cb 0.00 -3.06 -0.04 0.00 0.26 0.00 0.00 34.13 31.29 3lfs s GLU 162 CO 0.00 0.06 1.39 0.08 -0.54 0.00 0.00 175.26 176.25 3lfs s VAL 163 N -1.23 3.87 -0.06 3.70 1.01 -1.26 -0.01 120.40 126.42 3lfs s VAL 163 Ca 0.48 1.18 -0.30 0.00 0.00 0.00 0.00 61.98 63.34 3lfs s VAL 163 Cb -0.32 -3.76 -0.04 0.00 0.00 0.00 0.00 36.38 32.25 3lfs s VAL 163 CO 0.42 -0.04 1.40 -0.69 0.00 0.00 0.00 175.10 176.19 3lfs s VAL 164 N 2.85 3.87 0.26 2.92 1.01 -0.75 -4.92 120.40 125.64 3lfs s VAL 164 Ca 0.63 1.17 -0.31 0.00 0.00 0.00 0.00 61.98 63.47 3lfs s VAL 164 Cb -0.29 -3.75 -0.13 0.00 0.00 0.00 0.00 36.38 32.20 3lfs s VAL 164 CO 0.24 -0.05 1.38 1.07 0.00 0.00 0.00 175.10 177.74 3lfs n THR 165 N 5.00 1.13 0.26 3.92 5.66 -1.26 -4.95 114.28 124.04 3lfs n THR 165 Ca 0.14 -0.28 0.10 0.00 -3.05 0.00 0.00 64.05 60.96 3lfs n THR 165 Cb 0.44 -1.47 -0.15 0.00 -1.55 0.00 0.00 70.33 67.60 3lfs n THR 165 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 3lfs n LEU 166 N 1.93 0.26 -0.39 1.09 4.32 -1.26 -4.69 117.00 118.26 3lfs n LEU 166 Ca 0.11 -0.14 0.30 0.00 -0.02 0.00 0.00 56.01 56.26 3lfs n LEU 166 Cb 0.32 0.00 0.58 0.00 -1.62 0.00 0.00 43.42 42.70 3lfs n LEU 166 CO 0.62 0.07 1.21 -0.50 -1.22 0.00 0.00 177.39 177.57 3lfs h TRP 167 N 0.00 0.62 -0.42 -1.77 4.06 -1.81 -1.57 115.95 115.06 3lfs h TRP 167 Ca 0.00 0.03 0.00 0.00 2.06 0.00 0.00 58.89 60.98 3lfs h TRP 167 Cb 0.81 -0.16 0.00 0.00 -1.00 0.00 0.00 29.16 28.81 3lfs h TRP 167 CO 0.00 -0.12 0.00 0.66 -3.56 0.00 0.00 178.44 175.42 3lfs n TYR 168 N -4.73 0.55 -2.40 0.49 4.01 -1.26 -4.55 117.16 109.27 3lfs n TYR 168 Ca 0.32 -0.34 -0.42 0.00 -0.16 0.00 0.00 57.90 57.31 3lfs n TYR 168 Cb 1.18 -0.01 -0.03 0.00 -0.31 0.00 0.00 39.34 40.18 3lfs n TYR 168 CO 0.00 0.00 0.00 0.50 -0.46 0.00 0.00 176.86 176.90 3lfs s ARG 169 N -1.20 4.44 0.59 -0.72 3.52 -0.59 -3.89 118.95 121.09 3lfs s ARG 169 Ca 0.35 1.80 -0.19 0.00 -0.13 0.00 0.00 55.73 57.56 3lfs s ARG 169 Cb 0.20 -3.32 -0.03 0.00 -1.56 0.00 0.00 34.95 30.23 3lfs s ARG 169 CO 0.27 -0.24 1.25 0.00 -0.81 0.00 0.00 175.30 175.77 3lfs s ALA 170 N 0.87 2.58 0.24 6.12 0.00 -1.26 -4.95 121.76 125.37 3lfs s ALA 170 Ca 0.58 1.11 0.28 0.00 0.00 0.00 0.00 51.96 53.94 3lfs s ALA 170 Cb -0.30 -3.49 1.26 0.00 0.00 0.00 0.00 23.12 20.59 3lfs s ALA 170 CO 0.30 -1.27 1.97 -1.00 0.00 0.00 0.00 175.76 175.76 3lfs h PRO 171 N 0.99 0.00 -0.34 0.00 0.13 -1.96 -3.00 132.00 127.82 3lfs h PRO 171 Ca -0.51 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.49 3lfs h PRO 171 Cb 1.30 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.42 3lfs h PRO 171 CO 0.55 0.13 -0.31 1.05 -0.23 0.00 0.00 178.00 179.20 3lfs h GLU 172 N 0.00 0.74 -0.23 0.86 9.09 -1.93 -1.85 114.58 121.27 3lfs h GLU 172 Ca -0.00 -0.34 -0.03 0.00 0.05 0.00 0.00 59.36 59.04 3lfs h GLU 172 Cb 0.53 -0.01 -0.01 0.00 -1.65 0.00 0.00 28.75 27.61 3lfs h GLU 172 CO 0.02 0.95 0.02 0.82 0.05 0.00 0.00 179.01 180.88 3lfs h ILE 173 N 0.63 1.24 0.00 -1.06 2.04 -1.80 -0.99 117.51 117.57 3lfs h ILE 173 Ca 0.07 -0.80 -0.03 0.00 1.00 0.00 0.00 64.86 65.10 3lfs h ILE 173 Cb 0.83 1.32 -0.00 0.00 -0.74 0.00 0.00 36.82 38.23 3lfs h ILE 173 CO 0.07 0.25 -0.13 -0.07 0.00 0.00 0.00 178.15 178.27 3lfs h LEU 174 N 0.18 0.00 -1.11 1.44 3.38 -1.48 -2.55 115.31 115.16 3lfs h LEU 174 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 3lfs h LEU 174 Cb 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 3lfs h LEU 174 CO 0.01 0.13 0.00 0.18 0.09 0.00 0.00 178.44 178.85 3lfs n LEU 175 N -3.63 1.69 0.00 1.67 4.77 -0.70 -4.88 117.00 115.92 3lfs n LEU 175 Ca -0.02 -0.65 0.00 0.00 -0.03 0.00 0.00 56.01 55.31 3lfs n LEU 175 Cb 0.26 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 3lfs n LEU 175 CO 0.30 0.33 0.00 0.61 -1.33 0.00 0.00 177.39 177.30 3lfs n GLY 176 N 1.17 0.75 3.68 -0.72 0.00 -0.96 -0.04 105.19 109.06 3lfs n GLY 176 Ca 0.17 -0.59 -0.42 0.00 0.00 0.00 0.00 46.02 45.18 3lfs n GLY 176 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3lfs h LYS 178 N 8.57 0.24 -3.70 0.00 -0.00 -1.95 -3.43 116.57 116.30 3lfs h LYS 178 Ca -0.38 -0.41 -0.75 0.00 -0.00 0.00 0.00 60.65 59.11 3lfs h LYS 178 Cb 1.17 0.15 -0.30 0.00 -0.00 0.00 0.00 32.23 33.25 3lfs h LYS 178 CO 0.93 1.19 -0.09 0.71 -0.00 0.00 0.00 179.45 182.19 3lfs s TYR 179 N -2.68 3.62 0.23 0.07 2.02 -1.26 -5.07 117.35 114.28 3lfs s TYR 179 Ca -0.03 -2.33 -0.30 0.00 -0.37 0.00 0.00 57.07 54.04 3lfs s TYR 179 Cb 0.07 -3.55 -0.09 0.00 -0.40 0.00 0.00 41.96 38.00 3lfs s TYR 179 CO 0.88 -0.92 1.10 0.71 -1.57 0.00 0.00 175.55 175.74 3lfs s TYR 180 N 0.00 3.60 0.55 2.71 2.02 -1.26 -5.07 117.35 119.90 3lfs s TYR 180 Ca 0.18 1.66 0.08 0.00 -0.37 0.00 0.00 57.07 58.61 3lfs s TYR 180 Cb -0.14 -3.27 0.06 0.00 -0.40 0.00 0.00 41.96 38.20 3lfs s TYR 180 CO -0.07 -0.55 0.60 -1.54 -1.57 0.00 0.00 175.55 172.42 3lfs s SER 181 N -0.53 4.91 0.43 2.29 1.04 -1.26 -5.01 113.70 115.57 3lfs s SER 181 Ca 0.47 -1.01 0.30 0.00 0.48 0.00 0.00 55.95 56.19 3lfs s SER 181 Cb -0.31 0.29 1.40 0.00 0.10 0.00 0.00 66.02 67.50 3lfs s SER 181 CO 0.38 -1.19 1.90 0.71 0.98 0.00 0.00 173.24 176.01 3lfs h THR 182 N 0.48 0.00 -0.00 2.02 1.35 -1.97 -2.94 112.91 111.85 3lfs h THR 182 Ca -0.34 -0.21 0.00 0.00 -0.55 0.00 0.00 66.41 65.31 3lfs h THR 182 Cb 1.29 1.01 -0.00 0.00 -1.73 0.00 0.00 68.15 68.73 3lfs h THR 182 CO 0.49 0.00 0.02 0.00 -0.25 0.00 0.00 175.52 175.77 3lfs h ALA 183 N 2.09 1.11 -0.87 6.62 0.00 -1.94 -2.40 119.26 123.87 3lfs h ALA 183 Ca 0.00 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 3lfs h ALA 183 Cb 0.26 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 3lfs h ALA 183 CO 0.00 -0.02 0.47 -0.39 0.00 0.00 0.00 179.25 179.31 3lfs h VAL 184 N 0.00 1.26 -0.14 0.00 -1.51 -1.92 -2.38 116.25 111.56 3lfs h VAL 184 Ca 0.00 -0.65 -0.14 0.00 -1.23 0.00 0.00 66.70 64.68 3lfs h VAL 184 Cb 0.03 0.09 -0.01 0.00 -2.13 0.00 0.00 31.29 29.27 3lfs h VAL 184 CO -0.00 0.29 -0.52 0.44 -1.23 0.00 0.00 177.57 176.55 3lfs h ASP 185 N 1.22 0.44 -0.63 4.19 3.32 -1.69 -2.85 116.42 120.43 3lfs h ASP 185 Ca 0.31 -0.23 -0.08 0.00 0.02 0.00 0.00 57.03 57.05 3lfs h ASP 185 Cb 0.04 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.44 3lfs h ASP 185 CO -0.05 0.88 0.10 0.40 -1.72 0.00 0.00 179.24 178.85 3lfs h ILE 186 N 0.31 1.26 0.75 0.35 1.08 -1.56 -2.03 117.51 117.68 3lfs h ILE 186 Ca 0.01 -1.02 -0.03 0.00 -0.39 0.00 0.00 64.86 63.43 3lfs h ILE 186 Cb 1.03 0.70 -0.00 0.00 -3.07 0.00 0.00 36.82 35.47 3lfs h ILE 186 CO 0.09 0.38 -0.47 -0.25 -0.69 0.00 0.00 178.15 177.21 3lfs h TRP 187 N 0.95 -1.26 -0.65 1.37 2.91 -1.33 -1.23 115.95 116.71 3lfs h TRP 187 Ca 0.19 -0.01 0.13 0.00 1.13 0.00 0.00 58.89 60.33 3lfs h TRP 187 Cb 0.44 0.45 -0.09 0.00 -0.51 0.00 0.00 29.16 29.45 3lfs h TRP 187 CO 0.03 -0.71 0.16 0.77 -1.03 0.00 0.00 178.44 177.67 3lfs h SER 188 N -1.15 0.04 -0.70 2.65 0.02 -1.48 -0.97 113.55 111.96 3lfs h SER 188 Ca -0.10 0.12 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 3lfs h SER 188 Cb 0.93 0.15 -0.03 0.00 0.14 0.00 0.00 62.40 63.59 3lfs h SER 188 CO 0.09 0.01 0.44 0.25 -1.14 0.00 0.00 176.83 176.49 3lfs h LEU 189 N 0.29 0.82 -0.68 5.07 5.85 -1.27 -1.51 115.31 123.89 3lfs h LEU 189 Ca 0.35 -0.04 0.04 0.00 0.84 0.00 0.00 57.88 59.07 3lfs h LEU 189 Cb 0.54 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 41.31 3lfs h LEU 189 CO -0.43 0.62 0.40 1.23 -0.34 0.00 0.00 178.44 179.93 3lfs h GLY 190 N 0.95 0.98 1.04 3.75 0.00 0.04 0.11 103.07 109.94 3lfs h GLY 190 Ca 0.25 -0.29 -0.03 0.00 0.00 0.00 0.00 47.33 47.26 3lfs h GLY 190 CO -0.05 0.21 0.39 0.00 0.00 0.00 0.00 176.54 177.10 3lfs h ILE 192 N 1.18 1.27 -0.06 0.00 2.04 -0.63 -2.61 117.51 118.70 3lfs h ILE 192 Ca 0.28 -1.56 0.03 0.00 1.00 0.00 0.00 64.86 64.61 3lfs h ILE 192 Cb 0.13 1.40 -0.03 0.00 -0.74 0.00 0.00 36.82 37.57 3lfs h ILE 192 CO -0.03 0.52 -0.12 0.15 0.00 0.00 0.00 178.15 178.66 3lfs h PHE 193 N 0.73 -0.31 -0.51 1.37 3.57 -0.60 -1.09 116.94 120.10 3lfs h PHE 193 Ca 0.06 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.59 3lfs h PHE 193 Cb 0.97 0.15 -0.03 0.00 2.79 0.00 0.00 35.95 39.83 3lfs h PHE 193 CO 0.06 -0.18 0.32 0.00 -2.23 0.00 0.00 178.31 176.27 3lfs h ALA 194 N 0.83 0.65 -0.96 2.41 0.00 -1.40 -2.71 119.26 118.08 3lfs h ALA 194 Ca 0.06 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.98 3lfs h ALA 194 Cb 0.27 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 17.83 3lfs h ALA 194 CO -0.16 0.04 0.63 1.49 0.00 0.00 0.00 179.25 181.24 3lfs h GLU 195 N 0.64 1.20 -0.28 0.00 4.81 -1.16 -0.21 114.58 119.57 3lfs h GLU 195 Ca 0.20 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 59.34 3lfs h GLU 195 Cb -0.02 -0.27 -0.01 0.00 0.63 0.00 0.00 28.75 29.08 3lfs h GLU 195 CO -0.07 0.79 0.13 0.52 -0.73 0.00 0.00 179.01 179.65 3lfs h MET 196 N 1.23 0.42 -0.06 1.92 2.86 -0.91 -0.33 114.93 120.06 3lfs h MET 196 Ca 0.38 -0.07 -0.01 0.00 -2.06 0.00 0.00 59.70 57.94 3lfs h MET 196 Cb -0.03 -0.07 -0.00 0.00 0.06 0.00 0.00 31.60 31.55 3lfs h MET 196 CO -0.11 0.42 -0.00 0.28 1.06 0.00 0.00 176.91 178.55 3lfs h VAL 197 N 0.32 1.26 0.04 -2.22 2.07 -1.27 -3.35 116.25 113.09 3lfs h VAL 197 Ca 0.10 -0.80 -0.22 0.00 0.82 0.00 0.00 66.70 66.59 3lfs h VAL 197 Cb 0.15 1.67 -0.01 0.00 -1.52 0.00 0.00 31.29 31.58 3lfs h VAL 197 CO -0.01 0.22 -1.00 0.74 0.02 0.00 0.00 177.57 177.55 3lfs h THR 198 N -0.18 1.51 -0.63 2.57 2.02 -1.05 -3.47 112.91 113.68 3lfs h THR 198 Ca 0.02 -2.82 -0.14 0.00 0.77 0.00 0.00 66.41 64.24 3lfs h THR 198 Cb 0.35 2.63 -0.03 0.00 -1.74 0.00 0.00 68.15 69.36 3lfs h THR 198 CO 0.00 0.82 -0.15 0.54 0.37 0.00 0.00 175.52 177.10 3lfs n ARG 199 N -3.60 -0.52 -3.71 6.66 1.74 -0.14 -5.02 116.66 112.07 3lfs n ARG 199 Ca -0.05 0.57 -0.14 0.00 -0.77 0.00 0.00 57.85 57.46 3lfs n ARG 199 Cb 0.88 -4.41 -0.09 0.00 -1.02 0.00 0.00 32.46 27.83 3lfs n ARG 199 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 3lfs s ARG 200 N -3.38 0.59 0.48 5.56 3.52 -1.23 -5.08 118.95 119.40 3lfs s ARG 200 Ca 0.00 0.48 -0.24 0.00 -0.13 0.00 0.00 55.73 55.84 3lfs s ARG 200 Cb 0.00 0.28 -0.08 0.00 -1.56 0.00 0.00 34.95 33.60 3lfs s ARG 200 CO 0.00 -0.10 1.33 0.00 -0.81 0.00 0.00 175.30 175.71 3lfs n ALA 201 N 2.45 1.53 0.16 6.12 0.00 -1.26 -4.16 120.51 125.35 3lfs n ALA 201 Ca -0.15 0.20 -0.07 0.00 0.00 0.00 0.00 53.44 53.42 3lfs n ALA 201 Cb 0.57 -2.32 -0.03 0.00 0.00 0.00 0.00 19.45 17.66 3lfs n ALA 201 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 3lfs h LEU 202 N 1.85 -0.40 -6.94 0.00 6.46 -1.93 -3.42 115.31 110.94 3lfs h LEU 202 Ca -0.50 0.01 -0.62 0.00 -0.12 0.00 0.00 57.88 56.66 3lfs h LEU 202 Cb 1.29 0.10 -0.42 0.00 -0.73 0.00 0.00 40.66 40.91 3lfs h LEU 202 CO 0.59 -0.08 -0.58 0.49 -0.62 0.00 0.00 178.44 178.24 3lfs n PHE 203 N -4.40 3.25 -1.48 1.25 3.72 -1.26 -5.04 117.46 113.51 3lfs n PHE 203 Ca -0.06 -4.28 -0.39 0.00 -0.05 0.00 0.00 57.45 52.67 3lfs n PHE 203 Cb 0.19 -0.60 -0.02 0.00 -0.94 0.00 0.00 39.48 38.10 3lfs n PHE 203 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 3lfs n PRO 204 N 1.80 3.79 -2.11 -1.08 -0.04 -1.26 -4.36 135.00 131.73 3lfs n PRO 204 Ca 0.22 -2.47 -0.36 0.00 -0.04 0.00 0.00 63.50 60.85 3lfs n PRO 204 Cb 0.36 -2.81 0.02 0.00 -0.04 0.00 0.00 33.50 31.02 3lfs n PRO 204 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 3lfs s GLY 205 N 1.93 2.73 -0.08 0.55 0.00 -1.26 -4.99 107.32 106.20 3lfs s GLY 205 Ca 0.65 0.97 0.12 0.00 0.00 0.00 0.00 44.72 46.45 3lfs s GLY 205 CO -0.07 1.37 1.17 2.09 0.00 0.00 0.00 173.10 177.66 3lfs n ASP 206 N -1.25 2.59 -3.55 1.64 5.75 -1.26 -4.58 116.55 115.88 3lfs n ASP 206 Ca 0.12 -2.60 -0.08 0.00 -0.01 0.00 0.00 54.79 52.22 3lfs n ASP 206 Cb 0.49 -0.29 -0.02 0.00 -1.03 0.00 0.00 41.12 40.27 3lfs n ASP 206 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 3lfs s SER 207 N -1.89 -0.35 0.16 -1.12 1.04 -1.26 -5.00 113.70 105.28 3lfs s SER 207 Ca 0.23 -0.08 -0.15 0.00 0.48 0.00 0.00 55.95 56.42 3lfs s SER 207 Cb 0.18 0.43 0.04 0.00 0.10 0.00 0.00 66.02 66.77 3lfs s SER 207 CO 0.05 -0.72 1.80 -0.33 0.98 0.00 0.00 173.24 175.02 3lfs h GLU 208 N 2.00 0.62 -0.51 4.02 5.08 -1.99 -1.31 114.58 122.49 3lfs h GLU 208 Ca -0.24 -0.05 -0.09 0.00 -1.00 0.00 0.00 59.36 57.98 3lfs h GLU 208 Cb 1.25 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 30.34 3lfs h GLU 208 CO 0.30 0.44 -0.06 0.97 -1.00 0.00 0.00 179.01 179.67 3lfs h ILE 209 N 0.62 1.26 -0.69 3.13 6.09 -1.97 -1.76 117.51 124.19 3lfs h ILE 209 Ca 0.17 -1.15 -0.06 0.00 -1.37 0.00 0.00 64.86 62.44 3lfs h ILE 209 Cb -0.03 0.92 -0.03 0.00 0.47 0.00 0.00 36.82 38.16 3lfs h ILE 209 CO -0.03 0.40 0.18 -0.78 -3.07 0.00 0.00 178.15 174.85 3lfs h ASP 210 N 0.82 1.03 -0.18 2.19 3.58 -1.89 -0.34 116.42 121.64 3lfs h ASP 210 Ca 0.14 -0.23 -0.01 0.00 0.42 0.00 0.00 57.03 57.36 3lfs h ASP 210 Cb 0.57 -0.27 -0.01 0.00 1.72 0.00 0.00 39.33 41.34 3lfs h ASP 210 CO 0.03 0.99 0.09 -0.61 -2.88 0.00 0.00 179.24 176.86 3lfs h GLN 211 N 1.03 0.26 -0.52 0.28 5.75 -1.10 -1.55 115.11 119.27 3lfs h GLN 211 Ca 0.22 -0.04 -0.03 0.00 -0.15 0.00 0.00 58.65 58.65 3lfs h GLN 211 Cb 0.35 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 28.83 3lfs h GLN 211 CO -0.00 0.30 0.21 1.25 -2.65 0.00 0.00 178.83 177.94 3lfs h LEU 212 N 0.16 0.71 -0.92 -2.39 5.85 -1.19 -2.39 115.31 115.15 3lfs h LEU 212 Ca 0.06 -0.17 -0.08 0.00 0.84 0.00 0.00 57.88 58.54 3lfs h LEU 212 Cb 0.13 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 40.96 3lfs h LEU 212 CO -0.01 0.68 -0.38 -0.26 -0.34 0.00 0.00 178.44 178.14 3lfs h PHE 213 N 0.70 0.00 -0.24 1.25 0.04 -1.00 -2.75 116.94 114.94 3lfs h PHE 213 Ca 0.17 0.00 -0.20 0.00 2.80 0.00 0.00 57.97 60.74 3lfs h PHE 213 Cb 0.19 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.34 3lfs h PHE 213 CO 0.00 0.38 -0.63 0.00 -0.60 0.00 0.00 178.31 177.46 3lfs h ARG 214 N 0.00 0.85 -0.23 1.51 3.08 -1.10 -0.97 114.38 117.52 3lfs h ARG 214 Ca -0.00 -0.60 0.00 0.00 0.07 0.00 0.00 59.98 59.45 3lfs h ARG 214 Cb 0.91 0.09 -0.01 0.00 0.08 0.00 0.00 29.97 31.04 3lfs h ARG 214 CO 0.05 1.22 0.14 0.82 -1.07 0.00 0.00 179.97 181.13 3lfs h ILE 215 N 0.62 1.07 -0.70 2.04 2.04 -1.33 -3.09 117.51 118.17 3lfs h ILE 215 Ca -0.01 -0.16 -0.04 0.00 1.00 0.00 0.00 64.86 65.65 3lfs h ILE 215 Cb 1.25 0.77 -0.03 0.00 -0.74 0.00 0.00 36.82 38.07 3lfs h ILE 215 CO 0.14 0.07 0.28 -0.26 0.00 0.00 0.00 178.15 178.38 3lfs h PHE 216 N 0.30 1.06 -0.15 1.37 -1.00 -1.48 0.12 116.94 117.15 3lfs h PHE 216 Ca 0.08 -0.08 -0.02 0.00 2.81 0.00 0.00 57.97 60.77 3lfs h PHE 216 Cb -0.01 -0.32 -0.01 0.00 3.61 0.00 0.00 35.95 39.23 3lfs h PHE 216 CO -0.05 0.82 0.02 0.00 -1.61 0.00 0.00 178.31 177.48 3lfs h ARG 217 N 0.99 0.22 0.00 1.51 3.08 -1.10 -0.78 114.38 118.29 3lfs h ARG 217 Ca 0.23 -0.03 -0.05 0.00 0.07 0.00 0.00 59.98 60.21 3lfs h ARG 217 Cb 0.21 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.21 3lfs h ARG 217 CO -0.02 0.22 -0.74 2.41 -1.07 0.00 0.00 179.97 180.78 3lfs n THR 218 N -4.42 1.45 1.37 2.04 -1.04 -1.11 -4.52 114.28 108.05 3lfs n THR 218 Ca -0.01 0.16 0.14 0.00 -2.04 0.00 0.00 64.05 62.30 3lfs n THR 218 Cb 0.15 -2.32 0.58 0.00 -1.82 0.00 0.00 70.33 66.91 3lfs n THR 218 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 3lfs n LEU 219 N -4.56 0.52 0.00 -4.42 7.99 0.39 -0.16 117.00 116.77 3lfs n LEU 219 Ca -0.13 -0.01 0.00 0.00 -0.01 0.00 0.00 56.01 55.86 3lfs n LEU 219 Cb 0.37 -0.19 0.00 0.00 -0.11 0.00 0.00 43.42 43.50 3lfs n LEU 219 CO 0.13 0.10 0.00 0.61 -1.51 0.00 0.00 177.39 176.72 3lfs n GLY 220 N 1.30 -0.06 3.70 -0.72 0.00 -0.30 -4.52 105.19 104.58 3lfs n GLY 220 Ca 0.14 -1.57 -0.42 0.00 0.00 0.00 0.00 46.02 44.17 3lfs n GLY 220 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3lfs s THR 221 N -2.93 4.04 0.53 2.61 2.01 -0.77 -4.49 115.64 116.64 3lfs s THR 221 Ca 0.00 1.42 -0.19 0.00 0.31 0.00 0.00 61.69 63.23 3lfs s THR 221 Cb 0.00 -3.91 -0.06 0.00 0.01 0.00 0.00 72.50 68.54 3lfs s THR 221 CO 0.00 0.04 1.07 -2.16 -0.69 0.00 0.00 174.62 172.88 3lfs s PRO 222 N 1.83 3.51 0.11 4.92 0.04 -1.26 -4.92 135.00 139.23 3lfs s PRO 222 Ca 0.59 1.40 0.02 0.00 0.04 0.00 0.00 61.00 63.05 3lfs s PRO 222 Cb -0.28 -2.05 -0.01 0.00 0.04 0.00 0.00 34.50 32.20 3lfs s PRO 222 CO 0.26 -0.68 0.07 -0.40 0.04 0.00 0.00 177.00 176.29 3lfs n ASP 223 N -1.36 0.29 0.28 6.66 5.68 -1.26 -4.98 116.55 121.86 3lfs n ASP 223 Ca 0.10 -1.65 0.18 0.00 -0.50 0.00 0.00 54.79 52.92 3lfs n ASP 223 Cb 0.52 0.42 0.79 0.00 -1.14 0.00 0.00 41.12 41.71 3lfs n ASP 223 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 3lfs h GLU 224 N 0.00 0.00 0.31 0.11 4.39 -1.99 -0.51 114.58 116.90 3lfs h GLU 224 Ca -0.08 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.61 3lfs h GLU 224 Cb 0.36 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.01 3lfs h GLU 224 CO 0.12 0.00 -0.15 0.28 -1.16 0.00 0.00 179.01 178.10 3lfs h VAL 225 N 0.00 0.00 -0.34 3.13 2.07 -2.00 -3.24 116.25 115.87 3lfs h VAL 225 Ca 0.00 -0.18 -0.17 0.00 0.82 0.00 0.00 66.70 67.17 3lfs h VAL 225 Cb 0.39 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.16 3lfs h VAL 225 CO 0.00 0.00 -0.46 -0.37 0.02 0.00 0.00 177.57 176.76 3lfs h VAL 226 N -0.60 1.27 -3.17 2.57 -1.51 -1.97 -3.40 116.25 109.44 3lfs h VAL 226 Ca -0.04 -1.64 -0.62 0.00 -1.23 0.00 0.00 66.70 63.17 3lfs h VAL 226 Cb 0.32 1.49 -0.40 0.00 -2.13 0.00 0.00 31.29 30.57 3lfs h VAL 226 CO 0.07 0.54 -0.71 0.86 -1.23 0.00 0.00 177.57 177.10 3lfs s TRP 227 N -4.27 2.40 -0.10 5.19 -0.11 -0.20 -4.45 118.94 117.39 3lfs s TRP 227 Ca -0.11 -2.57 -0.29 0.00 1.22 0.00 0.00 56.10 54.35 3lfs s TRP 227 Cb 0.11 -2.19 -0.05 0.00 -1.50 0.00 0.00 33.47 29.84 3lfs s TRP 227 CO 0.89 -0.80 1.63 -1.25 -4.62 0.00 0.00 176.95 172.79 3lfs s PRO 228 N 0.41 4.08 0.00 5.86 0.04 -1.22 -2.42 135.00 141.75 3lfs s PRO 228 Ca 0.16 2.03 0.00 0.00 0.04 0.00 0.00 61.00 63.23 3lfs s PRO 228 Cb -0.23 -3.99 0.00 0.00 0.04 0.00 0.00 34.50 30.32 3lfs s PRO 228 CO -0.04 -0.96 0.00 0.41 0.04 0.00 0.00 177.00 176.46 3lfs n GLY 229 N 4.24 0.67 0.28 0.56 0.00 -1.26 -5.01 105.19 104.67 3lfs n GLY 229 Ca 0.18 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.19 3lfs n GLY 229 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 3lfs h VAL 230 N 0.00 0.98 0.00 1.61 3.04 -1.78 -2.61 116.25 117.50 3lfs h VAL 230 Ca 0.00 -0.26 -0.01 0.00 -1.01 0.00 0.00 66.70 65.41 3lfs h VAL 230 Cb 0.00 0.14 -0.00 0.00 -2.01 0.00 0.00 31.29 29.42 3lfs h VAL 230 CO 0.00 0.14 -0.06 0.71 -1.01 0.00 0.00 177.57 177.35 3lfs h THR 231 N 0.77 0.23 -0.01 3.17 1.35 -1.91 -2.66 112.91 113.86 3lfs h THR 231 Ca 0.33 -0.45 0.00 0.00 -0.55 0.00 0.00 66.41 65.74 3lfs h THR 231 Cb 0.20 1.36 0.00 0.00 -1.73 0.00 0.00 68.15 67.98 3lfs h THR 231 CO -0.19 0.06 -0.35 -1.20 -0.25 0.00 0.00 175.52 173.59 3lfs n SER 232 N -3.29 0.93 -4.75 5.36 7.64 -0.99 -4.91 113.62 113.61 3lfs n SER 232 Ca -0.01 -0.75 -0.37 0.00 1.01 0.00 0.00 58.87 58.75 3lfs n SER 232 Cb 0.24 0.21 0.04 0.00 -1.01 0.00 0.00 64.21 63.68 3lfs n SER 232 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 3lfs s MET 233 N -2.65 3.01 0.18 1.43 -1.94 -1.00 -4.98 119.30 113.35 3lfs s MET 233 Ca 0.20 1.95 -0.16 0.00 -1.71 0.00 0.00 55.69 55.98 3lfs s MET 233 Cb 0.19 -2.03 0.14 0.00 2.01 0.00 0.00 34.83 35.14 3lfs s MET 233 CO 0.58 -1.21 1.66 -1.35 -0.01 0.00 0.00 175.02 174.70 3lfs h PRO 234 N 1.07 0.03 -0.68 2.03 0.11 -1.80 -3.05 132.00 129.71 3lfs h PRO 234 Ca -0.51 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3lfs h PRO 234 Cb 1.30 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.40 3lfs h PRO 234 CO 0.56 0.02 0.00 -0.25 -0.21 0.00 0.00 178.00 178.11 3lfs n ASP 235 N -5.31 3.98 -4.74 -2.05 8.00 0.94 -4.97 116.55 112.41 3lfs n ASP 235 Ca 0.04 -2.14 -0.41 0.00 0.71 0.00 0.00 54.79 52.99 3lfs n ASP 235 Cb 0.25 -0.50 -0.04 0.00 -0.02 0.00 0.00 41.12 40.81 3lfs n ASP 235 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 3lfs s TYR 236 N -1.33 3.64 -0.12 1.24 5.04 -1.15 -4.94 117.35 119.72 3lfs s TYR 236 Ca 0.47 1.64 0.02 0.00 -2.44 0.00 0.00 57.07 56.76 3lfs s TYR 236 Cb 0.26 -3.23 0.01 0.00 0.35 0.00 0.00 41.96 39.36 3lfs s TYR 236 CO 0.29 -0.45 -0.16 0.15 -1.34 0.00 0.00 175.55 174.03 3lfs s LYS 237 N -0.37 2.35 0.06 4.97 -0.14 -1.26 -4.95 119.74 120.41 3lfs s LYS 237 Ca 0.49 -0.61 0.05 0.00 -1.36 0.00 0.00 55.97 54.54 3lfs s LYS 237 Cb -0.28 -1.99 0.25 0.00 -1.68 0.00 0.00 37.83 34.12 3lfs s LYS 237 CO 0.34 -0.07 1.15 -2.30 -0.76 0.00 0.00 175.35 173.71 3lfs n PRO 238 N 4.22 0.03 -0.05 -1.68 -0.02 -1.26 -1.63 135.00 134.61 3lfs n PRO 238 Ca -0.19 0.51 0.06 0.00 -2.02 0.00 0.00 63.50 61.86 3lfs n PRO 238 Cb 0.51 -1.59 0.26 0.00 -0.02 0.00 0.00 33.50 32.66 3lfs n PRO 238 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3lfs n SER 239 N -1.65 0.63 -4.73 2.55 3.41 -1.26 -4.92 113.62 107.66 3lfs n SER 239 Ca -0.00 -1.78 -0.42 0.00 -0.26 0.00 0.00 58.87 56.42 3lfs n SER 239 Cb 0.02 -0.06 -0.03 0.00 -0.26 0.00 0.00 64.21 63.88 3lfs n SER 239 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 3lfs s PHE 240 N -1.88 3.15 0.51 7.33 0.08 -0.65 -4.99 117.98 121.54 3lfs s PHE 240 Ca 0.18 0.98 -0.23 0.00 0.12 0.00 0.00 56.93 57.98 3lfs s PHE 240 Cb 0.09 -3.74 -0.06 0.00 -0.57 0.00 0.00 43.02 38.74 3lfs s PHE 240 CO 0.14 -2.52 1.38 -2.14 -0.10 0.00 0.00 175.22 171.98 3lfs s PRO 241 N 0.40 3.35 -0.72 0.24 0.02 -1.26 -4.96 135.00 132.07 3lfs s PRO 241 Ca 0.62 2.29 -0.13 0.00 0.02 0.00 0.00 61.00 63.81 3lfs s PRO 241 Cb -0.39 -2.40 0.19 0.00 0.02 0.00 0.00 34.50 31.91 3lfs s PRO 241 CO 0.36 -1.04 0.64 0.15 -0.33 0.00 0.00 177.00 176.78 3lfs s LYS 242 N -2.74 3.27 0.16 5.54 1.02 -1.26 -4.85 119.74 120.88 3lfs s LYS 242 Ca 0.68 -2.29 -0.13 0.00 0.02 0.00 0.00 55.97 54.25 3lfs s LYS 242 Cb -0.41 -4.28 -0.07 0.00 -0.52 0.00 0.00 37.83 32.55 3lfs s LYS 242 CO 0.51 -1.27 0.54 -1.58 -0.92 0.00 0.00 175.35 172.62 3lfs s TRP 243 N 0.48 3.57 0.34 3.18 0.51 -1.26 -4.97 118.94 120.79 3lfs s TRP 243 Ca 0.14 1.01 -0.10 0.00 -2.12 0.00 0.00 56.10 55.03 3lfs s TRP 243 Cb -0.16 -2.34 -0.07 0.00 -0.81 0.00 0.00 33.47 30.10 3lfs s TRP 243 CO -0.05 0.41 0.68 0.00 -0.51 0.00 0.00 176.95 177.47 3lfs s ALA 244 N -1.52 3.44 0.16 0.98 0.00 -1.26 -1.85 121.76 121.71 3lfs s ALA 244 Ca 0.39 -0.26 -0.30 0.00 0.00 0.00 0.00 51.96 51.78 3lfs s ALA 244 Cb -0.14 -2.58 -0.08 0.00 0.00 0.00 0.00 23.12 20.32 3lfs s ALA 244 CO 0.19 0.17 1.30 0.50 0.00 0.00 0.00 175.76 177.93 3lfs s ARG 245 N -3.51 4.39 0.40 0.00 3.52 -1.26 -4.20 118.95 118.30 3lfs s ARG 245 Ca 0.49 2.00 -0.15 0.00 -0.13 0.00 0.00 55.73 57.94 3lfs s ARG 245 Cb -0.10 -3.23 -0.08 0.00 -1.56 0.00 0.00 34.95 29.97 3lfs s ARG 245 CO 0.27 -0.27 0.83 -0.65 -0.81 0.00 0.00 175.30 174.67 3lfs s GLN 246 N 0.27 3.97 0.00 5.12 -1.52 0.78 -4.90 119.66 123.38 3lfs s GLN 246 Ca 0.58 0.75 0.00 0.00 -1.95 0.00 0.00 55.36 54.74 3lfs s GLN 246 Cb -0.35 -2.32 0.00 0.00 -0.22 0.00 0.00 33.01 30.12 3lfs s GLN 246 CO 0.35 -0.01 0.00 -3.47 -0.25 0.00 0.00 175.29 171.91 3lfs n ASP 247 N -0.89 0.00 0.00 5.90 -0.08 -1.26 -4.84 116.55 115.38 3lfs n ASP 247 Ca 0.04 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.32 3lfs n ASP 247 Cb 0.54 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.00 3lfs n ASP 247 CO 0.00 0.00 0.00 0.33 0.12 0.00 0.00 177.20 177.65 3lfs n PHE 248 N 0.00 0.00 0.22 -0.67 7.35 -1.26 -4.93 117.46 118.18 3lfs n PHE 248 Ca 0.00 0.00 0.09 0.00 -0.76 0.00 0.00 57.45 56.78 3lfs n PHE 248 Cb 0.00 0.00 0.47 0.00 0.35 0.00 0.00 39.48 40.30 3lfs n PHE 248 CO 0.00 0.00 0.00 0.66 -0.76 0.00 0.00 176.76 176.66 3lfs h SER 249 N 0.55 0.00 0.76 -2.13 4.64 -1.94 -2.11 113.55 113.33 3lfs h SER 249 Ca 0.00 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.09 3lfs h SER 249 Cb 0.00 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.05 3lfs h SER 249 CO 0.00 0.24 -1.35 0.50 -0.87 0.00 0.00 176.83 175.36 3lfs h LYS 250 N 0.00 0.00 0.14 4.77 3.64 -1.97 -3.25 116.57 119.90 3lfs h LYS 250 Ca -0.00 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 3lfs h LYS 250 Cb 0.71 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.53 3lfs h LYS 250 CO 0.03 0.61 -0.07 0.28 -2.27 0.00 0.00 179.45 178.04 3lfs h VAL 251 N 0.00 1.00 -1.81 2.00 2.07 -1.82 -3.40 116.25 114.28 3lfs h VAL 251 Ca -0.16 -1.05 -0.52 0.00 0.82 0.00 0.00 66.70 65.79 3lfs h VAL 251 Cb 1.82 1.60 -0.41 0.00 -1.52 0.00 0.00 31.29 32.78 3lfs h VAL 251 CO 0.09 0.23 -0.89 1.33 0.02 0.00 0.00 177.57 178.34 3lfs n VAL 252 N -4.94 1.76 -2.68 2.57 0.24 -0.83 -5.01 118.33 109.44 3lfs n VAL 252 Ca -0.08 -4.75 -0.34 0.00 -2.04 0.00 0.00 64.34 57.12 3lfs n VAL 252 Cb 0.27 -0.73 -0.05 0.00 -1.47 0.00 0.00 33.84 31.85 3lfs n VAL 252 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 3lfs s PRO 253 N -3.18 4.13 -0.40 7.34 0.04 -1.23 -1.82 135.00 139.88 3lfs s PRO 253 Ca 0.43 1.30 0.06 0.00 0.04 0.00 0.00 61.00 62.82 3lfs s PRO 253 Cb 0.36 -2.30 0.69 0.00 0.04 0.00 0.00 34.50 33.29 3lfs s PRO 253 CO -0.11 -0.14 1.87 -0.35 0.04 0.00 0.00 177.00 178.32 3lfs n PRO 254 N -0.48 2.74 -1.66 0.56 -0.04 -1.26 -4.80 135.00 130.06 3lfs n PRO 254 Ca 0.07 -2.99 -0.46 0.00 -0.04 0.00 0.00 63.50 60.07 3lfs n PRO 254 Cb 0.52 -2.18 -0.04 0.00 -0.04 0.00 0.00 33.50 31.76 3lfs n PRO 254 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 3lfs n LEU 255 N -0.79 3.02 -4.42 1.53 7.94 -0.75 -5.00 117.00 118.53 3lfs n LEU 255 Ca 0.53 1.10 -0.29 0.00 -1.11 0.00 0.00 56.01 56.23 3lfs n LEU 255 Cb 1.57 -1.41 0.27 0.00 0.53 0.00 0.00 43.42 44.37 3lfs n LEU 255 CO 0.55 -0.37 0.48 1.51 -1.11 0.00 0.00 177.39 178.44 3lfs s ASP 256 N 0.76 0.11 0.25 1.96 1.47 -1.26 -4.71 116.67 115.25 3lfs s ASP 256 Ca 0.77 1.15 -0.02 0.00 1.18 0.00 0.00 52.55 55.62 3lfs s ASP 256 Cb -0.69 -1.73 0.31 0.00 -0.34 0.00 0.00 42.92 40.47 3lfs s ASP 256 CO 0.41 -4.69 1.74 -0.08 0.68 0.00 0.00 175.17 173.23 3lfs h GLU 257 N -2.96 0.80 -0.75 2.11 4.57 -1.98 -1.23 114.58 115.14 3lfs h GLU 257 Ca -0.53 -0.23 -0.06 0.00 -1.18 0.00 0.00 59.36 57.36 3lfs h GLU 257 Cb 1.34 -0.09 -0.03 0.00 -0.16 0.00 0.00 28.75 29.81 3lfs h GLU 257 CO 0.41 0.82 0.24 -0.44 -1.18 0.00 0.00 179.01 178.86 3lfs h ASP 258 N 0.74 1.08 -0.34 1.04 3.32 -1.98 0.28 116.42 120.57 3lfs h ASP 258 Ca 0.14 -0.20 -0.13 0.00 0.02 0.00 0.00 57.03 56.86 3lfs h ASP 258 Cb 0.48 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.75 3lfs h ASP 258 CO 0.02 0.99 -0.31 1.23 -1.72 0.00 0.00 179.24 179.46 3lfs h GLY 259 N 1.12 0.87 1.26 2.75 0.00 -1.88 -2.31 103.07 104.88 3lfs h GLY 259 Ca 0.24 -0.88 -0.08 0.00 0.00 0.00 0.00 47.33 46.61 3lfs h GLY 259 CO -0.01 0.79 -0.00 3.21 0.00 0.00 0.00 176.54 180.53 3lfs h ARG 260 N 0.58 0.90 0.02 4.80 3.08 -1.02 -1.91 114.38 120.83 3lfs h ARG 260 Ca 0.06 -0.26 -0.00 0.00 0.07 0.00 0.00 59.98 59.85 3lfs h ARG 260 Cb 0.88 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.84 3lfs h ARG 260 CO 0.08 0.89 -0.01 1.03 -1.07 0.00 0.00 179.97 180.89 3lfs h SER 261 N 0.83 -0.03 -0.22 7.04 0.87 -0.93 -2.33 113.55 118.78 3lfs h SER 261 Ca 0.16 -0.24 -0.00 0.00 -1.23 0.00 0.00 61.79 60.47 3lfs h SER 261 Cb 0.49 0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.45 3lfs h SER 261 CO 0.02 0.23 0.12 0.25 -0.53 0.00 0.00 176.83 176.93 3lfs h LEU 262 N -0.28 0.27 -0.70 2.23 5.85 -1.39 -2.62 115.31 118.67 3lfs h LEU 262 Ca -0.00 -0.07 0.05 0.00 0.84 0.00 0.00 57.88 58.69 3lfs h LEU 262 Cb 0.27 -0.07 -0.05 0.00 0.37 0.00 0.00 40.66 41.18 3lfs h LEU 262 CO 0.01 0.26 0.41 0.25 -0.34 0.00 0.00 178.44 179.03 3lfs h LEU 263 N 0.25 0.64 -0.92 2.25 5.85 -1.40 -2.18 115.31 119.81 3lfs h LEU 263 Ca 0.08 0.02 0.06 0.00 0.84 0.00 0.00 57.88 58.87 3lfs h LEU 263 Cb 0.05 -0.11 -0.06 0.00 0.37 0.00 0.00 40.66 40.90 3lfs h LEU 263 CO -0.01 0.42 0.58 -1.28 -0.34 0.00 0.00 178.44 177.81 3lfs h SER 264 N 0.78 0.94 1.10 1.25 0.87 -1.25 0.19 113.55 117.43 3lfs h SER 264 Ca 0.30 0.01 -0.07 0.00 -1.23 0.00 0.00 61.79 60.80 3lfs h SER 264 Cb 0.13 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 61.89 3lfs h SER 264 CO -0.16 0.61 -0.33 1.56 -0.53 0.00 0.00 176.83 177.98 3lfs h GLN 265 N 1.08 0.00 0.00 2.24 4.20 -1.07 -3.01 115.11 118.55 3lfs h GLN 265 Ca 0.39 0.00 -0.16 0.00 0.06 0.00 0.00 58.65 58.94 3lfs h GLN 265 Cb 0.13 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.89 3lfs h GLN 265 CO -0.16 0.33 -0.94 0.52 -0.67 0.00 0.00 178.83 177.91 3lfs h MET 266 N 0.00 0.00 -0.61 1.46 2.86 -0.76 -1.27 114.93 116.61 3lfs h MET 266 Ca -0.00 0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 57.50 3lfs h MET 266 Cb 0.97 0.00 -0.08 0.00 0.06 0.00 0.00 31.60 32.55 3lfs h MET 266 CO 0.04 0.59 0.15 1.28 1.06 0.00 0.00 176.91 180.04 3lfs n LEU 267 N -3.17 5.62 -4.77 1.22 4.77 -0.01 -4.01 117.00 116.64 3lfs n LEU 267 Ca -0.03 -3.16 -0.40 0.00 -0.03 0.00 0.00 56.01 52.39 3lfs n LEU 267 Cb 0.84 -0.70 -0.03 0.00 -2.33 0.00 0.00 43.42 41.21 3lfs n LEU 267 CO 0.43 0.77 0.92 -1.00 -1.33 0.00 0.00 177.39 177.18 3lfs s HIS 268 N -2.94 3.17 0.05 -1.77 3.76 -1.15 -4.97 115.29 111.44 3lfs s HIS 268 Ca 0.53 1.50 -0.27 0.00 -0.15 0.00 0.00 55.06 56.66 3lfs s HIS 268 Cb 0.42 -3.56 -0.17 0.00 1.11 0.00 0.00 32.58 30.38 3lfs s HIS 268 CO 0.13 -1.50 1.50 1.88 -0.85 0.00 0.00 174.74 175.89 3lfs h TYR 269 N 3.39 -0.43 -2.71 1.40 0.05 -1.93 -3.43 116.97 113.32 3lfs h TYR 269 Ca -0.48 -0.01 -0.56 0.00 0.05 0.00 0.00 58.73 57.73 3lfs h TYR 269 Cb 1.22 0.14 -0.02 0.00 1.01 0.00 0.00 36.73 39.08 3lfs h TYR 269 CO 0.56 -0.18 1.10 0.34 -1.05 0.00 0.00 178.16 178.94 3lfs s ASP 270 N -4.90 6.50 0.43 3.88 -1.08 -1.26 -4.87 116.67 115.37 3lfs s ASP 270 Ca -0.15 1.84 0.16 0.00 -0.52 0.00 0.00 52.55 53.88 3lfs s ASP 270 Cb 0.04 -2.53 1.07 0.00 -1.46 0.00 0.00 42.92 40.03 3lfs s ASP 270 CO 0.61 -1.12 1.91 -0.65 0.52 0.00 0.00 175.17 176.44 3lfs h PRO 271 N 10.22 0.39 0.00 4.34 0.11 -1.96 -2.02 132.00 143.08 3lfs h PRO 271 Ca -0.35 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.69 3lfs h PRO 271 Cb 1.16 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 3lfs h PRO 271 CO 0.98 0.26 -0.20 -0.91 -0.21 0.00 0.00 178.00 177.91 3lfs h ASN 272 N 0.40 0.00 0.20 -2.05 -0.26 -1.96 -3.04 115.58 108.87 3lfs h ASN 272 Ca 0.38 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.12 3lfs h ASN 272 Cb 0.90 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.16 3lfs h ASN 272 CO -0.12 0.20 -1.38 2.29 -1.06 0.00 0.00 177.43 177.36 3lfs n LYS 273 N -4.10 0.38 -1.89 0.81 0.00 -0.80 -4.94 118.16 107.61 3lfs n LYS 273 Ca -0.02 -0.07 -0.42 0.00 -0.00 0.00 0.00 58.31 57.80 3lfs n LYS 273 Cb 0.28 -1.56 -0.03 0.00 -0.00 0.00 0.00 35.03 33.72 3lfs n LYS 273 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.40 177.90 3lfs s ARG 274 N -3.28 4.19 0.33 -1.58 3.52 -0.96 -4.94 118.95 116.23 3lfs s ARG 274 Ca 0.00 2.39 -0.27 0.00 -0.13 0.00 0.00 55.73 57.72 3lfs s ARG 274 Cb 0.14 -3.35 -0.13 0.00 -1.56 0.00 0.00 34.95 30.05 3lfs s ARG 274 CO 0.86 -0.69 1.05 1.51 -0.81 0.00 0.00 175.30 177.22 3lfs n ILE 275 N 4.32 2.09 -2.07 4.11 3.06 -0.48 -5.01 119.36 125.38 3lfs n ILE 275 Ca 0.15 -0.50 -0.29 0.00 -2.50 0.00 0.00 62.75 59.61 3lfs n ILE 275 Cb 0.39 -1.13 0.04 0.00 0.54 0.00 0.00 39.64 39.48 3lfs n ILE 275 CO 0.00 0.00 0.00 -0.94 -2.50 0.00 0.00 176.55 173.11 3lfs s SER 276 N -0.57 5.55 0.28 9.51 1.04 -1.26 -4.89 113.70 123.36 3lfs s SER 276 Ca 0.59 1.00 -0.00 0.00 0.48 0.00 0.00 55.95 58.02 3lfs s SER 276 Cb -0.64 -1.89 0.40 0.00 0.10 0.00 0.00 66.02 63.99 3lfs s SER 276 CO 0.60 -1.21 1.78 0.00 0.98 0.00 0.00 173.24 175.39 3lfs h ALA 277 N -0.46 1.16 -0.28 5.32 0.00 -1.95 -1.70 119.26 121.35 3lfs h ALA 277 Ca -0.45 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.17 3lfs h ALA 277 Cb 1.25 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 3lfs h ALA 277 CO 0.63 0.54 0.05 -0.22 0.00 0.00 0.00 179.25 180.25 3lfs h LYS 278 N 0.66 0.47 -0.28 0.00 3.64 -1.92 -3.06 116.57 116.09 3lfs h LYS 278 Ca 0.13 -0.12 -0.15 0.00 -1.27 0.00 0.00 60.65 59.24 3lfs h LYS 278 Cb 0.44 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.20 3lfs h LYS 278 CO 0.02 0.57 -0.43 0.00 -2.27 0.00 0.00 179.45 177.35 3lfs h ALA 279 N 0.88 0.72 -0.94 5.00 0.00 -1.93 -3.15 119.26 119.84 3lfs h ALA 279 Ca 0.09 -0.46 0.06 0.00 0.00 0.00 0.00 54.91 54.59 3lfs h ALA 279 Cb 0.33 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 17.95 3lfs h ALA 279 CO 0.00 0.66 0.61 0.00 0.00 0.00 0.00 179.25 180.53 3lfs h ALA 280 N 0.95 1.45 0.00 0.00 0.00 -1.31 -1.80 119.26 118.56 3lfs h ALA 280 Ca 0.04 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 3lfs h ALA 280 Cb 0.97 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 3lfs h ALA 280 CO 0.09 0.43 -0.01 -0.07 0.00 0.00 0.00 179.25 179.69 3lfs h LEU 281 N 1.12 0.00 -0.79 0.00 3.38 -1.48 -1.80 115.31 115.73 3lfs h LEU 281 Ca 0.40 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.37 3lfs h LEU 281 Cb 0.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.88 3lfs h LEU 281 CO -0.14 0.01 -0.19 0.00 0.09 0.00 0.00 178.44 178.20 3lfs n ALA 282 N -2.10 2.95 -1.80 1.53 0.00 -0.68 -4.91 120.51 115.50 3lfs n ALA 282 Ca -0.02 -0.47 -0.41 0.00 0.00 0.00 0.00 53.44 52.55 3lfs n ALA 282 Cb 0.15 -1.08 -0.02 0.00 0.00 0.00 0.00 19.45 18.50 3lfs n ALA 282 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 3lfs s HIS 283 N -2.32 2.94 -0.74 0.00 5.04 -0.68 -4.90 115.29 114.64 3lfs s HIS 283 Ca 0.28 1.24 0.07 0.00 -1.54 0.00 0.00 55.06 55.10 3lfs s HIS 283 Cb 0.20 -3.80 0.36 0.00 0.04 0.00 0.00 32.58 29.38 3lfs s HIS 283 CO 0.46 -2.35 1.20 -0.35 -2.34 0.00 0.00 174.74 171.35 3lfs n PRO 284 N 1.22 0.04 0.09 2.88 -0.04 -1.26 -1.70 135.00 136.23 3lfs n PRO 284 Ca 0.02 0.54 0.05 0.00 -0.04 0.00 0.00 63.50 64.07 3lfs n PRO 284 Cb 0.41 -1.65 0.49 0.00 -0.04 0.00 0.00 33.50 32.70 3lfs n PRO 284 CO 0.00 0.00 0.00 0.35 -0.04 0.00 0.00 175.50 175.81 3lfs h PHE 285 N 0.00 0.33 -0.35 0.54 3.57 -1.91 -1.78 116.94 117.34 3lfs h PHE 285 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 3lfs h PHE 285 Cb 0.02 -0.11 0.00 0.00 2.79 0.00 0.00 35.95 38.65 3lfs h PHE 285 CO 0.00 0.23 0.00 1.19 -2.23 0.00 0.00 178.31 177.50 3lfs n PHE 286 N -4.48 1.07 -0.09 0.41 3.72 -0.69 -4.43 117.46 112.98 3lfs n PHE 286 Ca 0.01 -0.39 -0.08 0.00 -0.05 0.00 0.00 57.45 56.94 3lfs n PHE 286 Cb 0.09 -0.27 -0.00 0.00 -0.94 0.00 0.00 39.48 38.36 3lfs n PHE 286 CO 0.00 0.00 0.00 0.37 -0.05 0.00 0.00 176.76 177.08 3lfs h GLN 287 N 2.33 0.30 -0.91 -1.08 5.75 -1.49 -3.17 115.11 116.84 3lfs h GLN 287 Ca 0.00 -0.02 -0.63 0.00 -0.15 0.00 0.00 58.65 57.85 3lfs h GLN 287 Cb 1.19 -0.07 -0.34 0.00 1.07 0.00 0.00 27.48 29.34 3lfs h GLN 287 CO 0.23 0.20 0.26 -0.40 -2.65 0.00 0.00 178.83 176.46 3lfs n ASP 288 N -4.97 6.65 -4.77 -0.69 5.75 -1.26 -5.04 116.55 112.22 3lfs n ASP 288 Ca -0.00 -3.77 -0.39 0.00 -0.01 0.00 0.00 54.79 50.62 3lfs n ASP 288 Cb 0.08 -0.75 -0.01 0.00 -1.03 0.00 0.00 41.12 39.41 3lfs n ASP 288 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 3lfs s VAL 289 N -4.73 2.94 0.34 2.12 1.01 -1.20 -5.04 120.40 115.84 3lfs s VAL 289 Ca 0.60 0.81 0.04 0.00 0.00 0.00 0.00 61.98 63.43 3lfs s VAL 289 Cb 0.47 -3.47 -0.03 0.00 0.00 0.00 0.00 36.38 33.35 3lfs s VAL 289 CO 0.01 0.09 0.16 0.42 0.00 0.00 0.00 175.10 175.78 3lfs s THR 290 N -1.34 0.41 -0.64 3.92 -4.23 -1.26 -5.10 115.64 107.39 3lfs s THR 290 Ca 0.57 -2.00 0.05 0.00 -1.18 0.00 0.00 61.69 59.12 3lfs s THR 290 Cb -0.34 -2.48 0.16 0.00 1.34 0.00 0.00 72.50 71.19 3lfs s THR 290 CO 0.43 0.00 0.43 -0.75 -0.54 0.00 0.00 174.62 174.18 3lfs s LYS 291 N -3.75 2.23 0.64 3.99 2.20 -1.26 -4.50 119.74 119.30 3lfs s LYS 291 Ca 0.33 -3.08 -0.11 0.00 -0.36 0.00 0.00 55.97 52.75 3lfs s LYS 291 Cb 0.04 -3.25 -0.03 0.00 -1.51 0.00 0.00 37.83 33.08 3lfs s LYS 291 CO 0.18 -1.25 1.04 -1.25 -0.36 0.00 0.00 175.35 173.71 3lfs s PRO 292 N -1.06 3.41 -0.17 4.03 0.05 -1.26 -4.98 135.00 135.02 3lfs s PRO 292 Ca 0.23 0.79 -0.06 0.00 0.05 0.00 0.00 61.00 62.02 3lfs s PRO 292 Cb -0.09 -2.06 -0.04 0.00 0.05 0.00 0.00 34.50 32.36 3lfs s PRO 292 CO -0.13 -0.72 0.03 0.14 0.05 0.00 0.00 177.00 176.38 3lfs s VAL 293 N -3.15 4.51 0.63 -0.36 -7.23 -1.26 -4.38 120.40 109.16 3lfs s VAL 293 Ca 0.56 -0.14 -0.10 0.00 -1.81 0.00 0.00 61.98 60.49 3lfs s VAL 293 Cb -0.12 -3.01 -0.01 0.00 0.56 0.00 0.00 36.38 33.79 3lfs s VAL 293 CO 0.54 0.48 1.01 -2.16 -0.31 0.00 0.00 175.10 174.66 3lfs s PRO 294 N 0.31 3.25 -1.33 4.82 0.05 -1.26 -4.98 135.00 135.85 3lfs s PRO 294 Ca 0.01 0.50 -0.10 0.00 0.05 0.00 0.00 61.00 61.46 3lfs s PRO 294 Cb -0.13 -2.11 0.13 0.00 0.05 0.00 0.00 34.50 32.44 3lfs s PRO 294 CO 0.01 -0.72 2.00 -2.39 0.05 0.00 0.00 177.00 175.95 3lfs n HIS 295 N -2.77 3.04 -2.40 0.56 1.44 -1.26 -4.95 115.22 108.87 3lfs n HIS 295 Ca 0.06 -2.83 -0.41 0.00 -2.01 0.00 0.00 57.72 52.52 3lfs n HIS 295 Cb 0.56 -2.09 -0.03 0.00 0.12 0.00 0.00 29.99 28.55 3lfs n HIS 295 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 3lfs s LEU 296 N 0.30 4.43 -0.23 2.39 1.02 -1.26 -5.04 118.68 120.30 3lfs s LEU 296 Ca 0.42 2.17 -0.05 0.00 0.02 0.00 0.00 54.13 56.69 3lfs s LEU 296 Cb 0.11 -3.60 -0.02 0.00 0.02 0.00 0.00 46.19 42.71 3lfs s LEU 296 CO -0.02 -0.38 0.00 -0.60 0.02 0.00 0.00 176.35 175.37 3lfs s ARG 297 N 0.10 3.49 0.00 1.70 3.00 -1.26 -5.10 118.95 120.88 3lfs s ARG 297 Ca 0.54 -0.56 0.04 0.00 -1.00 0.00 0.00 55.73 54.74 3lfs s ARG 297 Cb -0.32 -3.13 0.03 0.00 0.00 0.00 0.00 34.95 31.53 3lfs s ARG 297 CO 0.34 -0.18 0.62 1.28 0.00 0.00 0.00 175.30 177.36