#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3m7w s THR 3 N 0.00 1.32 -0.16 3.15 -4.23 -1.26 -3.80 115.64 110.65 3m7w s THR 3 Ca 0.00 -2.00 -0.01 0.00 -1.18 0.00 0.00 61.69 58.50 3m7w s THR 3 Cb 0.00 -2.73 0.04 0.00 1.34 0.00 0.00 72.50 71.15 3m7w s THR 3 CO 0.00 0.00 -0.03 -0.69 -0.54 0.00 0.00 174.62 173.36 3m7w s VAL 4 N -3.10 0.89 -0.25 2.29 1.01 -0.57 -4.91 120.40 115.76 3m7w s VAL 4 Ca 0.32 -0.52 -0.12 0.00 0.00 0.00 0.00 61.98 61.66 3m7w s VAL 4 Cb 0.08 -1.14 -0.05 0.00 0.00 0.00 0.00 36.38 35.27 3m7w s VAL 4 CO 0.15 0.07 0.22 -0.89 0.00 0.00 0.00 175.10 174.64 3m7w s THR 5 N 1.72 5.31 -0.11 3.92 2.01 -1.26 -0.52 115.64 126.71 3m7w s THR 5 Ca 0.01 0.27 0.02 0.00 0.31 0.00 0.00 61.69 62.30 3m7w s THR 5 Cb -0.15 -3.55 0.01 0.00 0.01 0.00 0.00 72.50 68.82 3m7w s THR 5 CO -0.07 0.29 -0.16 0.68 -0.69 0.00 0.00 174.62 174.66 3m7w s VAL 6 N 1.42 1.58 0.00 3.82 -7.23 -0.25 -4.94 120.40 114.80 3m7w s VAL 6 Ca 0.09 -0.69 0.00 0.00 -1.81 0.00 0.00 61.98 59.57 3m7w s VAL 6 Cb -0.15 -1.43 0.00 0.00 0.56 0.00 0.00 36.38 35.36 3m7w s VAL 6 CO 0.08 0.46 0.00 0.54 -0.31 0.00 0.00 175.10 175.86 3m7w n ARG 7 N 4.15 0.00 -0.58 4.82 5.12 -1.26 -0.13 116.66 128.78 3m7w n ARG 7 Ca -0.19 0.00 0.09 0.00 -1.93 0.00 0.00 57.85 55.81 3m7w n ARG 7 Cb 0.51 0.00 0.33 0.00 -1.16 0.00 0.00 32.46 32.14 3m7w n ARG 7 CO 0.00 0.00 0.00 -3.47 -1.93 0.00 0.00 177.63 172.23 3m7w n ASP 8 N 4.40 4.59 -4.67 0.55 2.03 -1.26 -4.94 116.55 117.25 3m7w n ASP 8 Ca 0.00 -2.56 -0.37 0.00 0.52 0.00 0.00 54.79 52.38 3m7w n ASP 8 Cb 0.00 -0.55 -0.08 0.00 -0.72 0.00 0.00 41.12 39.76 3m7w n ASP 8 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 3m7w s LEU 9 N -2.04 4.14 -0.50 -2.67 2.96 0.81 -5.05 118.68 116.33 3m7w s LEU 9 Ca 0.47 0.35 -0.17 0.00 -0.22 0.00 0.00 54.13 54.56 3m7w s LEU 9 Cb 0.32 -2.34 0.08 0.00 0.50 0.00 0.00 46.19 44.75 3m7w s LEU 9 CO 0.20 -0.02 0.50 -0.69 -1.32 0.00 0.00 176.35 175.03 3m7w s VAL 10 N 1.21 5.09 -0.05 1.68 1.01 -1.26 -1.09 120.40 126.99 3m7w s VAL 10 Ca 0.14 -0.94 -0.26 0.00 0.00 0.00 0.00 61.98 60.93 3m7w s VAL 10 Cb -0.14 -4.24 -0.03 0.00 0.00 0.00 0.00 36.38 31.97 3m7w s VAL 10 CO 0.06 -0.73 0.81 -0.69 0.00 0.00 0.00 175.10 174.55 3m7w s VAL 11 N 2.03 4.97 0.00 2.92 1.01 0.32 -3.48 120.40 128.17 3m7w s VAL 11 Ca 0.08 1.67 0.00 0.00 0.00 0.00 0.00 61.98 63.73 3m7w s VAL 11 Cb -0.23 -4.15 0.00 0.00 0.00 0.00 0.00 36.38 32.00 3m7w s VAL 11 CO 0.08 0.20 0.00 0.61 0.00 0.00 0.00 175.10 175.99 3m7w n GLY 12 N 3.07 0.66 3.32 4.51 0.00 -1.26 -1.50 105.19 113.98 3m7w n GLY 12 Ca 0.02 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.79 3m7w n GLY 12 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3m7w s GLU 13 N -0.62 1.21 4.21 1.61 2.02 -1.23 -4.94 118.70 120.96 3m7w s GLU 13 Ca 0.00 -1.22 0.00 0.00 0.02 0.00 0.00 54.97 53.77 3m7w s GLU 13 Cb 0.00 -1.53 0.00 0.00 0.10 0.00 0.00 34.13 32.70 3m7w s GLU 13 CO 0.00 0.36 0.00 0.41 0.02 0.00 0.00 175.26 176.05 3m7w n GLY 14 N 1.01 1.12 3.80 -1.39 0.00 -1.26 -4.78 105.19 103.69 3m7w n GLY 14 Ca -0.19 -0.67 -0.34 0.00 0.00 0.00 0.00 46.02 44.83 3m7w n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m7w s ALA 15 N -1.82 2.80 0.53 4.61 0.00 -1.26 -4.90 121.76 121.72 3m7w s ALA 15 Ca 0.00 0.53 -0.22 0.00 0.00 0.00 0.00 51.96 52.28 3m7w s ALA 15 Cb 0.00 -3.25 -0.06 0.00 0.00 0.00 0.00 23.12 19.81 3m7w s ALA 15 CO 0.00 -0.56 1.27 -2.30 0.00 0.00 0.00 175.76 174.17 3m7w n PRO 16 N -1.45 1.59 -3.15 0.00 -0.02 -1.26 -4.93 135.00 125.77 3m7w n PRO 16 Ca 0.09 0.58 -0.39 0.00 -2.02 0.00 0.00 63.50 61.77 3m7w n PRO 16 Cb 0.52 -2.47 -0.06 0.00 -0.02 0.00 0.00 33.50 31.48 3m7w n PRO 16 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 3m7w s LYS 17 N -2.74 4.35 -0.12 -0.52 -0.14 -0.60 -4.85 119.74 115.13 3m7w s LYS 17 Ca 0.71 0.90 -0.24 0.00 -1.36 0.00 0.00 55.97 55.97 3m7w s LYS 17 Cb -0.44 -3.27 -0.03 0.00 -1.68 0.00 0.00 37.83 32.42 3m7w s LYS 17 CO 0.50 0.57 0.74 0.42 -0.76 0.00 0.00 175.35 176.82 3m7w s ILE 18 N -0.96 4.98 -0.05 2.17 1.01 -1.26 -1.03 121.20 126.07 3m7w s ILE 18 Ca 0.32 1.49 0.04 0.00 0.00 0.00 0.00 60.65 62.50 3m7w s ILE 18 Cb -0.21 -4.07 -0.03 0.00 0.01 0.00 0.00 42.46 38.17 3m7w s ILE 18 CO 0.21 0.15 -0.15 -0.63 0.00 0.00 0.00 174.94 174.53 3m7w s ILE 19 N 1.42 3.02 0.12 2.92 1.01 -0.01 -0.28 121.20 129.40 3m7w s ILE 19 Ca 0.37 -0.74 0.09 0.00 0.00 0.00 0.00 60.65 60.37 3m7w s ILE 19 Cb -0.17 -2.18 -0.04 0.00 0.01 0.00 0.00 42.46 40.08 3m7w s ILE 19 CO 0.15 0.59 -0.22 0.68 0.00 0.00 0.00 174.94 176.15 3m7w s VAL 20 N -0.70 1.83 -0.19 2.92 -7.23 -0.92 -1.00 120.40 115.12 3m7w s VAL 20 Ca 0.11 -1.64 -0.07 0.00 -1.81 0.00 0.00 61.98 58.57 3m7w s VAL 20 Cb -0.11 -1.68 -0.04 0.00 0.56 0.00 0.00 36.38 35.12 3m7w s VAL 20 CO 0.01 -0.07 0.04 -0.44 -0.31 0.00 0.00 175.10 174.33 3m7w s SER 21 N -2.05 5.34 -0.14 4.85 0.01 -1.26 -0.39 113.70 120.06 3m7w s SER 21 Ca 0.09 -0.02 -0.15 0.00 1.31 0.00 0.00 55.95 57.17 3m7w s SER 21 Cb -0.09 -1.91 -0.04 0.00 0.21 0.00 0.00 66.02 64.18 3m7w s SER 21 CO 0.05 0.13 0.37 -0.22 0.41 0.00 0.00 173.24 173.98 3m7w s LEU 22 N 0.61 4.27 -0.18 2.44 0.20 0.39 -4.92 118.68 121.48 3m7w s LEU 22 Ca 0.02 0.64 -0.01 0.00 0.69 0.00 0.00 54.13 55.47 3m7w s LEU 22 Cb -0.13 -2.50 0.05 0.00 -0.43 0.00 0.00 46.19 43.17 3m7w s LEU 22 CO 0.02 0.07 -0.02 -0.04 -0.29 0.00 0.00 176.35 176.08 3m7w s MET 23 N 0.45 1.21 -0.04 1.98 -1.94 -1.26 -1.43 119.30 118.28 3m7w s MET 23 Ca 0.20 -0.56 -0.03 0.00 -1.71 0.00 0.00 55.69 53.59 3m7w s MET 23 Cb -0.14 -2.11 0.01 0.00 2.01 0.00 0.00 34.83 34.60 3m7w s MET 23 CO 0.07 -0.52 0.09 0.20 -0.01 0.00 0.00 175.02 174.85 3m7w s GLY 24 N 1.66 -0.06 -0.03 -0.03 0.00 -1.26 -4.89 107.32 102.72 3m7w s GLY 24 Ca -0.01 0.29 -0.20 0.00 0.00 0.00 0.00 44.72 44.80 3m7w s GLY 24 CO -0.07 0.30 0.90 0.50 0.00 0.00 0.00 173.10 174.73 3m7w h LYS 25 N 6.15 0.37 -5.35 2.90 6.56 -1.91 -3.04 116.57 122.25 3m7w h LYS 25 Ca -0.27 -0.63 -0.56 0.00 -1.06 0.00 0.00 60.65 58.13 3m7w h LYS 25 Cb 1.20 0.23 -0.13 0.00 -0.57 0.00 0.00 32.23 32.96 3m7w h LYS 25 CO 0.45 1.30 -0.58 0.95 -2.06 0.00 0.00 179.45 179.51 3m7w s THR 26 N -2.48 1.39 0.27 -0.16 -4.23 -1.26 -0.93 115.64 108.23 3m7w s THR 26 Ca -0.13 -2.00 -0.02 0.00 -1.18 0.00 0.00 61.69 58.37 3m7w s THR 26 Cb 0.02 -2.74 0.27 0.00 1.34 0.00 0.00 72.50 71.38 3m7w s THR 26 CO 0.86 0.00 1.86 -0.29 -0.54 0.00 0.00 174.62 176.51 3m7w h ILE 27 N 1.88 1.01 -0.22 2.99 6.09 -1.94 -0.62 117.51 126.70 3m7w h ILE 27 Ca -0.42 -0.37 0.01 0.00 -1.37 0.00 0.00 64.86 62.72 3m7w h ILE 27 Cb 1.25 -0.15 -0.02 0.00 0.47 0.00 0.00 36.82 38.38 3m7w h ILE 27 CO 0.72 0.19 0.11 0.74 -3.07 0.00 0.00 178.15 176.85 3m7w h THR 28 N 1.07 1.01 -0.31 2.19 2.02 -1.99 -0.44 112.91 116.45 3m7w h THR 28 Ca 0.45 -0.08 0.05 0.00 0.77 0.00 0.00 66.41 67.60 3m7w h THR 28 Cb 0.30 0.74 -0.05 0.00 -1.74 0.00 0.00 68.15 67.40 3m7w h THR 28 CO -0.21 0.04 0.03 0.44 0.37 0.00 0.00 175.52 176.19 3m7w h ASP 29 N 0.24 -0.07 -0.33 4.18 5.19 -1.82 -1.72 116.42 122.10 3m7w h ASP 29 Ca 0.09 0.06 0.02 0.00 -0.62 0.00 0.00 57.03 56.57 3m7w h ASP 29 Cb 0.01 0.10 -0.02 0.00 0.18 0.00 0.00 39.33 39.60 3m7w h ASP 29 CO -0.05 0.00 0.19 0.58 -3.12 0.00 0.00 179.24 176.83 3m7w h VAL 30 N 0.12 1.02 -0.45 -1.35 2.07 -0.76 -1.05 116.25 115.86 3m7w h VAL 30 Ca 0.15 -0.13 -0.01 0.00 0.82 0.00 0.00 66.70 67.53 3m7w h VAL 30 Cb 0.19 0.61 -0.02 0.00 -1.52 0.00 0.00 31.29 30.54 3m7w h VAL 30 CO -0.23 0.07 0.26 0.11 0.02 0.00 0.00 177.57 177.80 3m7w h LYS 31 N 0.38 0.62 -0.47 1.57 1.57 -0.89 -0.96 116.57 118.38 3m7w h LYS 31 Ca 0.13 -0.06 -0.09 0.00 -1.87 0.00 0.00 60.65 58.76 3m7w h LYS 31 Cb 0.01 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.18 3m7w h LYS 31 CO -0.07 0.47 -0.06 0.66 -0.57 0.00 0.00 179.45 179.88 3m7w h SER 32 N 0.59 0.87 -0.70 0.86 4.64 -1.14 -2.28 113.55 116.39 3m7w h SER 32 Ca 0.16 -0.34 -0.07 0.00 -0.47 0.00 0.00 61.79 61.07 3m7w h SER 32 Cb 0.03 -0.24 -0.03 0.00 -0.31 0.00 0.00 62.40 61.85 3m7w h SER 32 CO -0.03 1.00 0.16 -0.33 -0.87 0.00 0.00 176.83 176.76 3m7w h GLU 33 N 0.72 1.13 -0.55 4.77 4.39 -1.10 -2.05 114.58 121.89 3m7w h GLU 33 Ca 0.13 -0.28 -0.00 0.00 0.34 0.00 0.00 59.36 59.54 3m7w h GLU 33 Cb 0.59 -0.15 -0.03 0.00 -0.10 0.00 0.00 28.75 29.07 3m7w h GLU 33 CO 0.04 1.01 0.33 0.00 -1.16 0.00 0.00 179.01 179.22 3m7w h ALA 34 N 1.08 0.71 -0.72 3.43 0.00 -1.01 -0.28 119.26 122.47 3m7w h ALA 34 Ca 0.22 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 3m7w h ALA 34 Cb 0.39 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 3m7w h ALA 34 CO 0.00 0.20 0.44 -0.07 0.00 0.00 0.00 179.25 179.82 3m7w h LEU 35 N 0.74 0.86 -1.10 0.00 3.38 -1.26 -2.52 115.31 115.41 3m7w h LEU 35 Ca 0.20 -0.06 -0.08 0.00 0.09 0.00 0.00 57.88 58.03 3m7w h LEU 35 Cb 0.00 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 3m7w h LEU 35 CO -0.04 0.66 -0.19 0.00 0.09 0.00 0.00 178.44 178.97 3m7w h ALA 36 N 1.23 1.25 0.00 1.53 0.00 -0.89 -2.75 119.26 119.63 3m7w h ALA 36 Ca 0.26 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3m7w h ALA 36 Cb -0.04 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.63 3m7w h ALA 36 CO -0.05 0.49 0.00 1.88 0.00 0.00 0.00 179.25 181.57 3m7w h TYR 37 N 0.38 0.00 0.00 0.00 -1.99 -0.64 -3.20 116.97 111.52 3m7w h TYR 37 Ca 0.07 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.79 3m7w h TYR 37 Cb 0.55 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.28 3m7w h TYR 37 CO 0.02 0.00 -0.00 0.00 -0.00 0.00 0.00 178.16 178.17 3m7w h ARG 38 N 0.00 0.00 0.00 4.88 3.08 -1.16 -1.43 114.38 119.75 3m7w h ARG 38 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3m7w h ARG 38 Cb 0.59 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.64 3m7w h ARG 38 CO 0.00 0.00 -0.06 0.93 -1.07 0.00 0.00 179.97 179.77 3m7w h GLU 39 N 0.00 0.00 -6.74 0.04 4.39 -1.74 -3.47 114.58 107.07 3m7w h GLU 39 Ca -0.00 0.00 -0.50 0.00 0.34 0.00 0.00 59.36 59.20 3m7w h GLU 39 Cb 0.01 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.64 3m7w h GLU 39 CO 0.00 0.00 0.08 0.00 -1.16 0.00 0.00 179.01 177.93 3m7w s ALA 40 N -3.13 3.35 -1.08 3.43 0.00 -0.54 -5.02 121.76 118.77 3m7w s ALA 40 Ca 0.10 -0.07 -0.11 0.00 0.00 0.00 0.00 51.96 51.88 3m7w s ALA 40 Cb 0.11 -2.72 0.25 0.00 0.00 0.00 0.00 23.12 20.77 3m7w s ALA 40 CO 0.62 0.24 1.10 0.34 0.00 0.00 0.00 175.76 178.06 3m7w s ASP 41 N -2.57 7.19 0.25 0.00 2.15 -1.26 -5.00 116.67 117.43 3m7w s ASP 41 Ca 0.53 -3.33 0.07 0.00 0.43 0.00 0.00 52.55 50.24 3m7w s ASP 41 Cb -0.10 -2.24 -0.05 0.00 -0.30 0.00 0.00 42.92 40.22 3m7w s ASP 41 CO 0.22 -0.41 -0.09 0.72 -0.17 0.00 0.00 175.17 175.44 3m7w s PHE 42 N -0.55 1.87 -0.22 -5.34 -0.12 -1.26 -4.91 117.98 107.45 3m7w s PHE 42 Ca 0.30 -0.65 0.08 0.00 -0.05 0.00 0.00 56.93 56.62 3m7w s PHE 42 Cb -0.09 -0.99 -0.19 0.00 -0.63 0.00 0.00 43.02 41.12 3m7w s PHE 42 CO -0.07 0.32 -0.10 -0.25 -0.05 0.00 0.00 175.22 175.06 3m7w n ASP 43 N -0.51 1.39 -4.08 1.98 8.00 0.62 -4.97 116.55 118.97 3m7w n ASP 43 Ca -0.06 -0.08 -0.22 0.00 0.71 0.00 0.00 54.79 55.14 3m7w n ASP 43 Cb 0.62 0.16 -0.15 0.00 -0.02 0.00 0.00 41.12 41.73 3m7w n ASP 43 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3m7w s ILE 44 N -2.47 1.06 -0.29 0.53 1.01 -0.20 -4.17 121.20 116.66 3m7w s ILE 44 Ca -0.23 -0.55 -0.09 0.00 0.00 0.00 0.00 60.65 59.78 3m7w s ILE 44 Cb 0.07 -0.90 -0.02 0.00 0.01 0.00 0.00 42.46 41.63 3m7w s ILE 44 CO 0.65 0.30 0.14 -0.22 0.00 0.00 0.00 174.94 175.81 3m7w s LEU 45 N -0.15 3.94 -0.21 2.97 2.96 -0.62 -2.16 118.68 125.41 3m7w s LEU 45 Ca 0.02 -0.35 -0.14 0.00 -0.22 0.00 0.00 54.13 53.44 3m7w s LEU 45 Cb -0.07 -2.01 -0.04 0.00 0.50 0.00 0.00 46.19 44.57 3m7w s LEU 45 CO 0.00 -0.13 0.32 -0.70 -1.32 0.00 0.00 176.35 174.52 3m7w s GLU 46 N 1.64 4.16 -0.29 1.98 2.12 0.47 -0.62 118.70 128.17 3m7w s GLU 46 Ca 0.06 0.05 -0.17 0.00 0.36 0.00 0.00 54.97 55.27 3m7w s GLU 46 Cb -0.16 -3.52 -0.02 0.00 0.26 0.00 0.00 34.13 30.68 3m7w s GLU 46 CO 0.07 0.03 0.46 -0.46 -0.54 0.00 0.00 175.26 174.82 3m7w s TRP 47 N 1.11 3.23 -0.99 5.30 -0.00 0.12 -0.46 118.94 127.25 3m7w s TRP 47 Ca 0.15 0.42 -0.19 0.00 -0.00 0.00 0.00 56.10 56.48 3m7w s TRP 47 Cb -0.14 -2.72 0.11 0.00 -0.00 0.00 0.00 33.47 30.72 3m7w s TRP 47 CO 0.06 -0.34 1.25 1.03 -0.00 0.00 0.00 176.95 178.96 3m7w s ARG 48 N 2.24 3.66 0.47 5.86 1.81 -0.52 -1.66 118.95 130.81 3m7w s ARG 48 Ca 0.18 -1.71 0.12 0.00 -1.72 0.00 0.00 55.73 52.61 3m7w s ARG 48 Cb -0.16 -5.06 1.07 0.00 -0.45 0.00 0.00 34.95 30.36 3m7w s ARG 48 CO 0.11 -1.89 2.08 0.28 -0.68 0.00 0.00 175.30 175.20 3m7w h VAL 49 N 5.93 1.06 0.00 3.52 2.07 -1.08 -2.11 116.25 125.64 3m7w h VAL 49 Ca 0.19 -0.20 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 3m7w h VAL 49 Cb 1.00 0.90 -0.00 0.00 -1.52 0.00 0.00 31.29 31.67 3m7w h VAL 49 CO 1.21 0.07 -0.03 -2.24 0.02 0.00 0.00 177.57 176.61 3m7w h ASP 50 N 0.19 0.00 1.18 0.57 2.03 -1.84 0.17 116.42 118.72 3m7w h ASP 50 Ca 0.05 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.35 3m7w h ASP 50 Cb 0.05 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.55 3m7w h ASP 50 CO -0.01 0.03 0.00 0.45 -1.03 0.00 0.00 179.24 178.68 3m7w h HIS 51 N 0.00 0.00 -3.19 4.15 3.86 -1.66 -3.38 115.15 114.92 3m7w h HIS 51 Ca -0.00 0.00 -0.54 0.00 -1.16 0.00 0.00 60.37 58.67 3m7w h HIS 51 Cb 0.08 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.53 3m7w h HIS 51 CO 0.00 0.00 0.59 0.12 0.86 0.00 0.00 177.93 179.50 3m7w s PHE 52 N -3.38 3.38 0.29 2.45 5.36 0.59 -3.84 117.98 122.82 3m7w s PHE 52 Ca 0.05 1.35 0.04 0.00 -0.96 0.00 0.00 56.93 57.41 3m7w s PHE 52 Cb 0.09 -3.35 0.43 0.00 -0.34 0.00 0.00 43.02 39.85 3m7w s PHE 52 CO 0.53 -1.00 1.71 0.00 -1.46 0.00 0.00 175.22 175.00 3m7w h ALA 53 N 7.10 1.10 -1.34 11.12 0.00 -1.27 -3.33 119.26 132.63 3m7w h ALA 53 Ca -0.38 -0.37 -0.69 0.00 0.00 0.00 0.00 54.91 53.47 3m7w h ALA 53 Cb 1.19 -0.10 -0.34 0.00 0.00 0.00 0.00 17.79 18.53 3m7w h ALA 53 CO 0.83 0.57 0.25 0.09 0.00 0.00 0.00 179.25 180.99 3m7w n ASN 54 N -4.08 6.20 0.25 0.00 3.02 -1.26 -4.81 115.26 114.59 3m7w n ASN 54 Ca -0.01 -3.76 0.09 0.00 -0.03 0.00 0.00 54.58 50.87 3m7w n ASN 54 Cb 0.44 -0.81 0.65 0.00 -0.61 0.00 0.00 39.78 39.45 3m7w n ASN 54 CO 0.00 0.00 0.00 -0.37 -2.62 0.00 0.00 177.26 174.27 3m7w h VAL 55 N 2.33 0.87 -0.04 2.41 -1.51 -1.90 -2.46 116.25 115.95 3m7w h VAL 55 Ca 0.43 -0.39 0.00 0.00 -1.23 0.00 0.00 66.70 65.50 3m7w h VAL 55 Cb 0.43 1.22 0.00 0.00 -2.13 0.00 0.00 31.29 30.81 3m7w h VAL 55 CO 1.14 0.10 0.00 0.35 -1.23 0.00 0.00 177.57 177.93 3m7w n THR 56 N -4.12 0.05 -3.49 7.19 -2.24 -1.26 -4.53 114.28 105.88 3m7w n THR 56 Ca -0.02 -0.18 -0.42 0.00 -2.27 0.00 0.00 64.05 61.15 3m7w n THR 56 Cb 0.19 0.14 -0.08 0.00 -2.10 0.00 0.00 70.33 68.48 3m7w n THR 56 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3m7w s THR 57 N -1.95 4.52 0.38 4.28 2.01 -0.93 -4.96 115.64 118.98 3m7w s THR 57 Ca 0.38 -1.60 0.10 0.00 0.31 0.00 0.00 61.69 60.87 3m7w s THR 57 Cb 0.19 -3.90 0.32 0.00 0.01 0.00 0.00 72.50 69.13 3m7w s THR 57 CO 0.31 -0.74 1.90 0.00 -0.69 0.00 0.00 174.62 175.41 3m7w h ALA 58 N 8.57 1.87 -0.47 7.40 0.00 -1.84 -1.12 119.26 133.68 3m7w h ALA 58 Ca -0.24 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.61 3m7w h ALA 58 Cb 1.08 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 3m7w h ALA 58 CO 0.89 -0.07 0.04 1.49 0.00 0.00 0.00 179.25 181.60 3m7w h GLU 59 N 0.64 0.74 -0.14 0.00 4.81 -1.94 -1.86 114.58 116.83 3m7w h GLU 59 Ca 0.39 -0.17 -0.06 0.00 -0.13 0.00 0.00 59.36 59.39 3m7w h GLU 59 Cb 0.63 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 29.91 3m7w h GLU 59 CO -0.16 0.73 -0.14 0.77 -0.73 0.00 0.00 179.01 179.48 3m7w h SER 60 N 0.70 0.36 -0.17 1.04 0.02 -1.51 -2.17 113.55 111.82 3m7w h SER 60 Ca 0.15 -0.48 0.02 0.00 -0.84 0.00 0.00 61.79 60.64 3m7w h SER 60 Cb 0.37 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 62.79 3m7w h SER 60 CO 0.01 0.77 0.03 0.58 -1.14 0.00 0.00 176.83 177.08 3m7w h VAL 61 N -0.05 0.93 -0.80 2.27 2.07 -1.34 -1.67 116.25 117.66 3m7w h VAL 61 Ca 0.02 -0.03 0.03 0.00 0.82 0.00 0.00 66.70 67.54 3m7w h VAL 61 Cb 0.67 0.82 -0.05 0.00 -1.52 0.00 0.00 31.29 31.21 3m7w h VAL 61 CO 0.03 0.02 0.51 0.25 0.02 0.00 0.00 177.57 178.40 3m7w h LEU 62 N 0.10 0.85 -0.34 2.57 5.85 -1.37 0.59 115.31 123.55 3m7w h LEU 62 Ca 0.07 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 3m7w h LEU 62 Cb 0.07 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 40.89 3m7w h LEU 62 CO -0.10 0.59 0.18 -0.08 -0.34 0.00 0.00 178.44 178.69 3m7w h GLU 63 N 1.00 0.48 -0.12 1.25 4.81 -1.07 -0.14 114.58 120.78 3m7w h GLU 63 Ca 0.32 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.48 3m7w h GLU 63 Cb 0.00 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.28 3m7w h GLU 63 CO -0.11 0.40 0.04 0.00 -0.73 0.00 0.00 179.01 178.62 3m7w h ALA 64 N 1.05 0.16 -0.98 2.92 0.00 -0.92 -0.94 119.26 120.55 3m7w h ALA 64 Ca 0.12 -0.11 0.04 0.00 0.00 0.00 0.00 54.91 54.96 3m7w h ALA 64 Cb 0.07 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 17.75 3m7w h ALA 64 CO -0.02 -0.24 0.64 0.00 0.00 0.00 0.00 179.25 179.63 3m7w h ALA 65 N 0.87 1.37 -0.72 0.00 0.00 -0.80 -1.28 119.26 118.69 3m7w h ALA 65 Ca 0.04 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 3m7w h ALA 65 Cb 0.20 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 3m7w h ALA 65 CO -0.00 0.53 0.20 0.78 0.00 0.00 0.00 179.25 180.76 3m7w h GLY 66 N 1.23 1.21 1.01 0.00 0.00 -0.78 -2.09 103.07 103.65 3m7w h GLY 66 Ca 0.39 -0.73 -0.05 0.00 0.00 0.00 0.00 47.33 46.95 3m7w h GLY 66 CO -0.12 0.68 0.20 0.00 0.00 0.00 0.00 176.54 177.29 3m7w h ALA 67 N 1.14 0.81 -0.14 3.60 0.00 -0.46 -1.24 119.26 122.98 3m7w h ALA 67 Ca 0.23 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 3m7w h ALA 67 Cb 0.33 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 3m7w h ALA 67 CO -0.00 0.47 0.08 0.82 0.00 0.00 0.00 179.25 180.62 3m7w h ILE 68 N 0.88 1.08 -0.01 0.00 2.04 -1.04 -2.27 117.51 118.19 3m7w h ILE 68 Ca 0.20 -0.22 -0.04 0.00 1.00 0.00 0.00 64.86 65.80 3m7w h ILE 68 Cb 0.28 0.99 -0.01 0.00 -0.74 0.00 0.00 36.82 37.34 3m7w h ILE 68 CO -0.01 0.08 -0.16 0.03 0.00 0.00 0.00 178.15 178.08 3m7w h ARG 69 N 0.13 0.02 -0.04 2.37 2.47 -1.21 0.15 114.38 118.27 3m7w h ARG 69 Ca 0.05 -0.00 -0.16 0.00 -1.26 0.00 0.00 59.98 58.61 3m7w h ARG 69 Cb 0.05 -0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.36 3m7w h ARG 69 CO -0.01 0.18 -0.68 1.49 0.56 0.00 0.00 179.97 181.51 3m7w h GLU 70 N 0.02 0.18 0.17 0.04 4.81 -1.03 -3.34 114.58 115.43 3m7w h GLU 70 Ca 0.00 -0.14 -0.36 0.00 -0.13 0.00 0.00 59.36 58.73 3m7w h GLU 70 Cb 0.30 0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.71 3m7w h GLU 70 CO 0.02 0.79 -1.84 0.82 -0.73 0.00 0.00 179.01 178.08 3m7w h ILE 71 N 0.13 0.83 -3.58 2.32 2.04 -0.83 -3.42 117.51 115.00 3m7w h ILE 71 Ca -0.02 -2.45 -0.67 0.00 1.00 0.00 0.00 64.86 62.72 3m7w h ILE 71 Cb 1.22 2.68 -0.38 0.00 -0.74 0.00 0.00 36.82 39.60 3m7w h ILE 71 CO 0.10 0.88 -0.63 -0.63 0.00 0.00 0.00 178.15 177.87 3m7w s ILE 72 N -2.57 2.74 -1.09 -0.67 1.01 0.47 -4.94 121.20 116.15 3m7w s ILE 72 Ca -0.18 -2.43 0.21 0.00 0.00 0.00 0.00 60.65 58.24 3m7w s ILE 72 Cb 0.06 -2.93 -0.20 0.00 0.01 0.00 0.00 42.46 39.39 3m7w s ILE 72 CO 0.83 -0.68 0.90 0.35 0.00 0.00 0.00 174.94 176.34 3m7w n THR 73 N 4.15 0.00 -0.10 2.92 -2.24 -1.25 -4.45 114.28 113.31 3m7w n THR 73 Ca 0.03 -0.04 -0.23 0.00 -2.27 0.00 0.00 64.05 61.53 3m7w n THR 73 Cb 0.40 1.03 -0.12 0.00 -2.10 0.00 0.00 70.33 69.54 3m7w n THR 73 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3m7w n ASP 74 N -1.33 1.91 -4.84 3.42 3.85 -1.26 -4.99 116.55 113.32 3m7w n ASP 74 Ca 0.04 0.37 -0.32 0.00 -0.71 0.00 0.00 54.79 54.17 3m7w n ASP 74 Cb 0.34 -0.92 -0.03 0.00 -1.35 0.00 0.00 41.12 39.16 3m7w n ASP 74 CO 0.00 0.00 0.00 -0.54 -1.01 0.00 0.00 177.20 175.65 3m7w s LYS 75 N -2.42 3.88 0.52 0.11 -0.14 -1.26 -4.85 119.74 115.58 3m7w s LYS 75 Ca -0.30 1.00 -0.21 0.00 -1.36 0.00 0.00 55.97 55.09 3m7w s LYS 75 Cb 0.08 -2.12 -0.06 0.00 -1.68 0.00 0.00 37.83 34.04 3m7w s LYS 75 CO 0.60 -0.33 1.21 -2.14 -0.76 0.00 0.00 175.35 173.93 3m7w s PRO 76 N -4.03 3.41 -0.18 -1.68 0.02 -1.26 -4.87 135.00 126.41 3m7w s PRO 76 Ca 0.60 1.86 -0.01 0.00 0.02 0.00 0.00 61.00 63.47 3m7w s PRO 76 Cb -0.11 -2.22 0.00 0.00 0.02 0.00 0.00 34.50 32.19 3m7w s PRO 76 CO 0.31 -0.86 -0.12 -1.17 -0.33 0.00 0.00 177.00 174.83 3m7w s LEU 77 N -3.45 2.55 -0.21 -5.54 2.96 -1.26 -1.59 118.68 112.13 3m7w s LEU 77 Ca 0.69 -0.48 -0.07 0.00 -0.22 0.00 0.00 54.13 54.05 3m7w s LEU 77 Cb -0.31 -1.61 -0.03 0.00 0.50 0.00 0.00 46.19 44.74 3m7w s LEU 77 CO 0.36 0.03 0.06 -0.22 -1.32 0.00 0.00 176.35 175.26 3m7w s LEU 78 N 1.16 3.59 -0.37 -0.68 2.96 0.21 -1.35 118.68 124.20 3m7w s LEU 78 Ca 0.01 -0.08 -0.16 0.00 -0.22 0.00 0.00 54.13 53.68 3m7w s LEU 78 Cb -0.14 -1.93 -0.00 0.00 0.50 0.00 0.00 46.19 44.61 3m7w s LEU 78 CO -0.04 0.07 0.41 0.12 -1.32 0.00 0.00 176.35 175.58 3m7w s PHE 79 N 1.01 3.19 -0.21 5.38 5.36 -0.29 0.12 117.98 132.54 3m7w s PHE 79 Ca 0.04 -0.10 -0.01 0.00 -0.96 0.00 0.00 56.93 55.90 3m7w s PHE 79 Cb -0.14 -2.78 0.06 0.00 -0.34 0.00 0.00 43.02 39.82 3m7w s PHE 79 CO 0.03 -0.53 -0.01 0.99 -1.46 0.00 0.00 175.22 174.23 3m7w s THR 80 N 2.12 1.05 -0.47 0.12 2.01 -0.66 -0.89 115.64 118.91 3m7w s THR 80 Ca 0.13 -0.88 -0.17 0.00 0.31 0.00 0.00 61.69 61.08 3m7w s THR 80 Cb -0.16 -1.42 0.06 0.00 0.01 0.00 0.00 72.50 70.98 3m7w s THR 80 CO 0.13 -0.13 0.48 0.12 -0.69 0.00 0.00 174.62 174.52 3m7w s PHE 81 N 1.62 3.16 -0.38 4.92 5.36 -1.26 -0.50 117.98 130.91 3m7w s PHE 81 Ca -0.03 -0.69 -0.21 0.00 -0.96 0.00 0.00 56.93 55.04 3m7w s PHE 81 Cb -0.18 -3.22 0.01 0.00 -0.34 0.00 0.00 43.02 39.29 3m7w s PHE 81 CO -0.07 -0.85 0.67 0.50 -1.46 0.00 0.00 175.22 174.01 3m7w s ARG 82 N 2.07 3.60 0.57 10.12 6.06 -1.26 -4.90 118.95 135.21 3m7w s ARG 82 Ca 0.09 0.01 -0.19 0.00 -2.50 0.00 0.00 55.73 53.13 3m7w s ARG 82 Cb -0.21 -3.84 -0.04 0.00 0.06 0.00 0.00 34.95 30.91 3m7w s ARG 82 CO 0.10 -0.83 1.20 -1.12 -2.50 0.00 0.00 175.30 172.15 3m7w s SER 83 N 1.86 5.39 0.28 -2.12 0.01 -1.26 -3.46 113.70 114.39 3m7w s SER 83 Ca 0.25 2.37 0.01 0.00 1.31 0.00 0.00 55.95 59.89 3m7w s SER 83 Cb -0.14 -2.60 0.55 0.00 0.21 0.00 0.00 66.02 64.05 3m7w s SER 83 CO 0.16 -1.46 1.82 0.00 0.41 0.00 0.00 173.24 174.18 3m7w h ALA 84 N 1.09 1.49 0.00 1.44 0.00 -1.04 0.16 119.26 122.40 3m7w h ALA 84 Ca -0.50 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.44 3m7w h ALA 84 Cb 1.29 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.89 3m7w h ALA 84 CO 0.56 0.18 0.00 0.36 0.00 0.00 0.00 179.25 180.35 3m7w n LYS 85 N -4.65 0.07 -0.44 0.00 2.85 -1.26 -0.84 118.16 113.88 3m7w n LYS 85 Ca 0.19 0.41 0.06 0.00 -1.05 0.00 0.00 58.31 57.92 3m7w n LYS 85 Cb 0.37 -1.67 0.22 0.00 -0.65 0.00 0.00 35.03 33.30 3m7w n LYS 85 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 3m7w n GLU 86 N -1.81 2.28 -0.65 -1.58 -0.58 0.01 -4.94 120.64 113.37 3m7w n GLU 86 Ca 0.02 -2.87 0.00 0.00 -0.42 0.00 0.00 57.16 53.88 3m7w n GLU 86 Cb 0.12 -1.76 0.00 0.00 -0.57 0.00 0.00 31.44 29.24 3m7w n GLU 86 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3m7w n GLY 87 N -0.87 0.71 1.68 0.62 0.00 -0.02 -4.79 105.19 102.51 3m7w n GLY 87 Ca 0.23 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.12 3m7w n GLY 87 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3m7w n GLY 88 N -2.50 -1.20 0.04 -0.02 0.00 0.35 -4.93 105.19 96.94 3m7w n GLY 88 Ca 0.00 -1.70 0.13 0.00 0.00 0.00 0.00 46.02 44.44 3m7w n GLY 88 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3m7w n GLU 89 N -2.20 0.14 -3.48 1.61 -0.58 -1.22 -4.17 120.64 110.74 3m7w n GLU 89 Ca 0.07 -0.07 -0.10 0.00 -0.42 0.00 0.00 57.16 56.64 3m7w n GLU 89 Cb 0.25 -1.50 -0.02 0.00 -0.57 0.00 0.00 31.44 29.60 3m7w n GLU 89 CO 0.00 0.00 0.00 1.14 -0.48 0.00 0.00 177.13 177.79 3m7w s GLN 90 N -2.91 1.03 -0.00 3.49 -2.07 -1.26 -4.93 119.66 113.01 3m7w s GLN 90 Ca 0.14 -0.39 -0.01 0.00 -1.82 0.00 0.00 55.36 53.28 3m7w s GLN 90 Cb 0.18 0.47 -0.04 0.00 -1.09 0.00 0.00 33.01 32.53 3m7w s GLN 90 CO 0.64 -0.45 0.12 0.00 -1.32 0.00 0.00 175.29 174.27 3m7w s ALA 91 N -3.40 3.71 0.07 2.60 0.00 -1.26 -0.65 121.76 122.84 3m7w s ALA 91 Ca 0.04 -0.84 0.01 0.00 0.00 0.00 0.00 51.96 51.16 3m7w s ALA 91 Cb -0.01 -1.68 -0.04 0.00 0.00 0.00 0.00 23.12 21.40 3m7w s ALA 91 CO -0.10 0.71 -0.05 -0.51 0.00 0.00 0.00 175.76 175.81 3m7w s LEU 92 N -1.84 2.45 0.79 0.00 1.43 -1.26 -4.99 118.68 115.25 3m7w s LEU 92 Ca 0.25 -0.91 -0.11 0.00 -1.03 0.00 0.00 54.13 52.33 3m7w s LEU 92 Cb -0.12 0.02 0.06 0.00 0.03 0.00 0.00 46.19 46.18 3m7w s LEU 92 CO 0.16 -0.46 1.09 0.42 0.23 0.00 0.00 176.35 177.79 3m7w s THR 93 N -3.26 3.21 0.20 5.49 -4.23 -1.26 -4.84 115.64 110.95 3m7w s THR 93 Ca 0.05 0.39 -0.10 0.00 -1.18 0.00 0.00 61.69 60.85 3m7w s THR 93 Cb 0.03 -3.12 0.12 0.00 1.34 0.00 0.00 72.50 70.88 3m7w s THR 93 CO -0.05 -0.51 1.78 0.74 -0.54 0.00 0.00 174.62 176.03 3m7w h THR 94 N -1.05 0.90 -0.32 3.99 2.02 -1.99 -1.24 112.91 115.22 3m7w h THR 94 Ca -0.47 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 66.53 3m7w h THR 94 Cb 1.26 0.31 -0.02 0.00 -1.74 0.00 0.00 68.15 67.97 3m7w h THR 94 CO 0.58 0.10 0.20 1.23 0.37 0.00 0.00 175.52 178.00 3m7w h GLY 95 N 0.54 0.45 1.03 2.16 0.00 -1.99 -0.67 103.07 104.58 3m7w h GLY 95 Ca 0.28 -0.18 -0.01 0.00 0.00 0.00 0.00 47.33 47.42 3m7w h GLY 95 CO -0.21 0.17 0.51 1.46 0.00 0.00 0.00 176.54 178.47 3m7w h GLN 96 N 0.42 1.25 -0.28 4.80 4.20 -1.85 -0.57 115.11 123.08 3m7w h GLN 96 Ca 0.11 -0.14 -0.07 0.00 0.06 0.00 0.00 58.65 58.62 3m7w h GLN 96 Cb -0.02 -0.25 -0.01 0.00 0.30 0.00 0.00 27.48 27.50 3m7w h GLN 96 CO -0.02 0.90 -0.08 -0.92 -0.67 0.00 0.00 178.83 178.04 3m7w h TYR 97 N 1.26 0.63 -0.34 2.96 3.20 -0.93 -0.48 116.97 123.27 3m7w h TYR 97 Ca 0.32 -0.14 -0.02 0.00 3.14 0.00 0.00 58.73 62.03 3m7w h TYR 97 Cb 0.00 -0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.11 3m7w h TYR 97 CO 0.01 0.76 0.14 0.82 -1.64 0.00 0.00 178.16 178.25 3m7w h ILE 98 N 0.31 1.18 -0.53 1.81 1.08 -1.03 -2.58 117.51 117.75 3m7w h ILE 98 Ca 0.07 -0.55 0.02 0.00 -0.39 0.00 0.00 64.86 64.01 3m7w h ILE 98 Cb 0.57 0.92 -0.03 0.00 -3.07 0.00 0.00 36.82 35.20 3m7w h ILE 98 CO 0.03 0.20 0.32 0.44 -0.69 0.00 0.00 178.15 178.45 3m7w h ASP 99 N 0.40 0.52 -0.25 1.72 3.32 -0.98 0.26 116.42 121.41 3m7w h ASP 99 Ca 0.11 0.00 0.05 0.00 0.02 0.00 0.00 57.03 57.22 3m7w h ASP 99 Cb 0.18 -0.11 -0.05 0.00 0.22 0.00 0.00 39.33 39.57 3m7w h ASP 99 CO -0.01 0.37 -0.07 0.25 -1.72 0.00 0.00 179.24 178.06 3m7w h LEU 100 N 0.64 -0.25 -0.44 1.55 5.85 -1.01 -0.56 115.31 121.09 3m7w h LEU 100 Ca 0.21 0.08 -0.05 0.00 0.84 0.00 0.00 57.88 58.96 3m7w h LEU 100 Cb 0.02 0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.19 3m7w h LEU 100 CO -0.09 -0.09 0.08 0.78 -0.34 0.00 0.00 178.44 178.78 3m7w h ASN 101 N -0.01 0.69 -0.75 1.25 2.35 -1.14 -0.37 115.58 117.60 3m7w h ASN 101 Ca 0.12 -0.25 0.01 0.00 -0.55 0.00 0.00 56.30 55.63 3m7w h ASN 101 Cb 0.20 -0.18 -0.04 0.00 0.05 0.00 0.00 38.32 38.34 3m7w h ASN 101 CO -0.26 0.77 0.50 0.03 -1.65 0.00 0.00 177.43 176.81 3m7w h ARG 102 N 0.59 0.98 -0.63 0.81 3.08 -0.74 0.19 114.38 118.65 3m7w h ARG 102 Ca 0.13 -0.06 -0.05 0.00 0.07 0.00 0.00 59.98 60.07 3m7w h ARG 102 Cb 0.37 -0.22 -0.03 0.00 0.08 0.00 0.00 29.97 30.17 3m7w h ARG 102 CO 0.01 0.65 0.19 0.00 -1.07 0.00 0.00 179.97 179.75 3m7w h ALA 103 N 1.53 0.83 0.14 0.04 0.00 -0.76 -1.18 119.26 119.88 3m7w h ALA 103 Ca 0.28 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3m7w h ALA 103 Cb -0.11 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.44 3m7w h ALA 103 CO -0.06 0.51 -0.07 0.00 0.00 0.00 0.00 179.25 179.63 3m7w h ALA 104 N 1.07 -0.19 -0.35 0.00 0.00 -0.10 -1.85 119.26 117.83 3m7w h ALA 104 Ca 0.20 -0.05 0.06 0.00 0.00 0.00 0.00 54.91 55.13 3m7w h ALA 104 Cb 0.30 0.08 -0.06 0.00 0.00 0.00 0.00 17.79 18.11 3m7w h ALA 104 CO -0.01 -0.60 -0.00 0.28 0.00 0.00 0.00 179.25 178.93 3m7w h VAL 105 N -0.22 0.74 0.00 0.00 2.07 -0.85 -2.67 116.25 115.32 3m7w h VAL 105 Ca -0.02 -0.03 -0.03 0.00 0.82 0.00 0.00 66.70 67.43 3m7w h VAL 105 Cb 0.17 0.63 -0.00 0.00 -1.52 0.00 0.00 31.29 30.56 3m7w h VAL 105 CO 0.03 0.02 -0.16 -0.78 0.02 0.00 0.00 177.57 176.70 3m7w h ASP 106 N 0.10 0.00 0.34 0.57 -0.00 -1.09 -3.08 116.42 113.26 3m7w h ASP 106 Ca 0.17 0.00 -0.02 0.00 -0.00 0.00 0.00 57.03 57.18 3m7w h ASP 106 Cb 0.24 0.00 -0.00 0.00 -0.00 0.00 0.00 39.33 39.56 3m7w h ASP 106 CO -0.29 0.16 -0.12 0.77 -0.00 0.00 0.00 179.24 179.76 3m7w h SER 107 N 0.00 0.00 0.00 2.28 4.64 -0.97 -3.46 113.55 116.04 3m7w h SER 107 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3m7w h SER 107 Cb 0.55 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.64 3m7w h SER 107 CO 0.02 0.12 0.00 0.61 -0.87 0.00 0.00 176.83 176.71 3m7w n GLY 108 N -0.74 0.50 0.10 -0.77 0.00 -1.16 -4.85 105.19 98.27 3m7w n GLY 108 Ca -0.02 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.12 3m7w n GLY 108 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3m7w h LEU 109 N 0.00 0.00 -8.78 0.99 3.38 -1.86 -3.47 115.31 105.58 3m7w h LEU 109 Ca 0.00 -0.09 -0.69 0.00 0.09 0.00 0.00 57.88 57.18 3m7w h LEU 109 Cb 0.13 0.00 -0.26 0.00 0.09 0.00 0.00 40.66 40.62 3m7w h LEU 109 CO 0.00 0.05 -0.86 0.68 0.09 0.00 0.00 178.44 178.40 3m7w s VAL 110 N -3.27 2.34 -0.05 1.22 -7.23 -1.26 -4.84 120.40 107.31 3m7w s VAL 110 Ca 0.03 -1.24 0.13 0.00 -1.81 0.00 0.00 61.98 59.09 3m7w s VAL 110 Cb 0.11 -1.91 -0.20 0.00 0.56 0.00 0.00 36.38 34.94 3m7w s VAL 110 CO 0.75 0.42 0.77 0.44 -0.31 0.00 0.00 175.10 177.17 3m7w h ASP 111 N 4.91 0.00 -5.13 4.85 3.32 -1.56 -3.46 116.42 119.35 3m7w h ASP 111 Ca -0.46 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.46 3m7w h ASP 111 Cb 1.14 0.00 -0.17 0.00 0.22 0.00 0.00 39.33 40.52 3m7w h ASP 111 CO 0.46 0.89 -0.60 -0.04 -1.72 0.00 0.00 179.24 178.23 3m7w s MET 112 N -2.69 0.56 0.06 3.56 -1.94 -0.89 -1.63 119.30 116.34 3m7w s MET 112 Ca -0.04 -0.91 0.05 0.00 -1.71 0.00 0.00 55.69 53.08 3m7w s MET 112 Cb 0.08 0.21 -0.03 0.00 2.01 0.00 0.00 34.83 37.11 3m7w s MET 112 CO 0.82 -0.12 -0.15 0.96 -0.01 0.00 0.00 175.02 176.51 3m7w s ILE 113 N -2.97 1.19 -0.21 2.53 -4.36 -0.36 -1.14 121.20 115.87 3m7w s ILE 113 Ca -0.02 -1.22 -0.12 0.00 -0.26 0.00 0.00 60.65 59.04 3m7w s ILE 113 Cb 0.01 -1.11 -0.05 0.00 1.25 0.00 0.00 42.46 42.56 3m7w s ILE 113 CO -0.06 -0.11 0.21 -0.62 0.24 0.00 0.00 174.94 174.59 3m7w s ASP 114 N -1.53 6.23 -0.08 4.36 -1.08 -0.07 -0.77 116.67 123.74 3m7w s ASP 114 Ca 0.00 0.26 0.04 0.00 -0.52 0.00 0.00 52.55 52.33 3m7w s ASP 114 Cb -0.09 -2.13 -0.00 0.00 -1.46 0.00 0.00 42.92 39.24 3m7w s ASP 114 CO 0.02 0.08 -0.22 -0.76 0.52 0.00 0.00 175.17 174.81 3m7w s LEU 115 N 0.83 2.02 0.02 -1.34 1.43 0.01 -4.62 118.68 117.02 3m7w s LEU 115 Ca 0.11 -0.50 -0.30 0.00 -1.03 0.00 0.00 54.13 52.40 3m7w s LEU 115 Cb -0.13 -1.30 -0.04 0.00 0.03 0.00 0.00 46.19 44.75 3m7w s LEU 115 CO 0.03 0.16 1.06 -1.61 0.23 0.00 0.00 176.35 176.22 3m7w s GLU 116 N 0.25 4.51 0.23 1.70 2.02 -1.26 -0.60 118.70 125.55 3m7w s GLU 116 Ca -0.14 1.54 -0.07 0.00 0.02 0.00 0.00 54.97 56.32 3m7w s GLU 116 Cb -0.16 -3.43 0.37 0.00 0.10 0.00 0.00 34.13 31.01 3m7w s GLU 116 CO 0.07 -0.13 1.71 1.25 0.02 0.00 0.00 175.26 178.18 3m7w h LEU 117 N 6.85 0.10 -1.17 1.80 5.85 -1.18 -1.53 115.31 126.02 3m7w h LEU 117 Ca -0.41 0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.43 3m7w h LEU 117 Cb 1.22 0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.38 3m7w h LEU 117 CO 0.78 0.04 0.00 0.49 -0.34 0.00 0.00 178.44 179.40 3m7w n PHE 118 N -5.09 0.00 0.10 1.25 3.72 -1.26 -3.94 117.46 112.23 3m7w n PHE 118 Ca 0.11 -0.08 -0.04 0.00 -0.05 0.00 0.00 57.45 57.38 3m7w n PHE 118 Cb 0.37 -0.12 0.12 0.00 -0.94 0.00 0.00 39.48 38.90 3m7w n PHE 118 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 176.76 177.86 3m7w h THR 119 N 0.00 1.41 0.00 4.37 2.02 -1.67 -3.48 112.91 115.56 3m7w h THR 119 Ca 0.00 -2.07 0.00 0.00 0.77 0.00 0.00 66.41 65.11 3m7w h THR 119 Cb 0.58 2.07 0.00 0.00 -1.74 0.00 0.00 68.15 69.06 3m7w h THR 119 CO 0.00 0.61 0.00 0.61 0.37 0.00 0.00 175.52 177.11 3m7w n GLY 120 N 0.31 4.02 0.16 2.16 0.00 -1.25 -4.89 105.19 105.70 3m7w n GLY 120 Ca -0.02 -0.75 -0.05 0.00 0.00 0.00 0.00 46.02 45.20 3m7w n GLY 120 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3m7w h ASP 121 N 0.00 -0.08 0.01 1.61 5.19 -1.94 0.10 116.42 121.32 3m7w h ASP 121 Ca 0.00 0.08 -0.00 0.00 -0.62 0.00 0.00 57.03 56.49 3m7w h ASP 121 Cb 0.00 0.12 0.00 0.00 0.18 0.00 0.00 39.33 39.63 3m7w h ASP 121 CO 0.00 -0.00 -0.01 0.44 -3.12 0.00 0.00 179.24 176.55 3m7w h ASP 122 N 0.15 -0.02 -0.36 6.45 3.32 -1.99 -0.42 116.42 123.55 3m7w h ASP 122 Ca 0.19 -0.18 0.02 0.00 0.02 0.00 0.00 57.03 57.08 3m7w h ASP 122 Cb 0.24 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.77 3m7w h ASP 122 CO -0.28 0.17 0.19 -0.33 -1.72 0.00 0.00 179.24 177.27 3m7w h GLU 123 N -0.20 0.38 0.44 3.56 3.07 -1.87 -1.52 114.58 118.44 3m7w h GLU 123 Ca -0.00 -0.02 -0.01 0.00 -0.50 0.00 0.00 59.36 58.82 3m7w h GLU 123 Cb 0.20 -0.09 -0.01 0.00 -0.84 0.00 0.00 28.75 28.01 3m7w h GLU 123 CO 0.00 0.25 -0.29 0.28 -1.40 0.00 0.00 179.01 177.85 3m7w h VAL 124 N 0.39 0.40 -0.51 3.13 2.07 -0.68 -1.14 116.25 119.91 3m7w h VAL 124 Ca 0.15 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.77 3m7w h VAL 124 Cb 0.04 0.40 -0.10 0.00 -1.52 0.00 0.00 31.29 30.11 3m7w h VAL 124 CO -0.09 0.00 -0.12 0.11 0.02 0.00 0.00 177.57 177.49 3m7w h LYS 125 N -0.71 0.00 -0.75 1.57 1.79 -0.94 0.16 116.57 117.69 3m7w h LYS 125 Ca -0.05 -0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.39 3m7w h LYS 125 Cb 0.59 -0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.20 3m7w h LYS 125 CO 0.03 0.00 0.34 0.00 -1.08 0.00 0.00 179.45 178.75 3m7w h ALA 126 N 1.51 1.19 0.00 3.86 0.00 -1.13 -1.07 119.26 123.61 3m7w h ALA 126 Ca 0.25 -0.16 -0.18 0.00 0.00 0.00 0.00 54.91 54.81 3m7w h ALA 126 Cb 0.38 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 3m7w h ALA 126 CO -0.52 0.61 -0.85 1.15 0.00 0.00 0.00 179.25 179.64 3m7w h THR 127 N 1.07 1.54 -0.28 0.00 2.02 -0.13 -1.18 112.91 115.96 3m7w h THR 127 Ca 0.26 -2.70 -0.02 0.00 0.77 0.00 0.00 66.41 64.71 3m7w h THR 127 Cb 0.14 2.49 -0.01 0.00 -1.74 0.00 0.00 68.15 69.02 3m7w h THR 127 CO -0.03 0.78 0.08 0.58 0.37 0.00 0.00 175.52 177.30 3m7w h VAL 128 N 0.05 1.21 -0.61 3.16 2.07 -0.48 -0.97 116.25 120.69 3m7w h VAL 128 Ca -0.03 -0.68 0.04 0.00 0.82 0.00 0.00 66.70 66.86 3m7w h VAL 128 Cb 1.47 1.13 -0.04 0.00 -1.52 0.00 0.00 31.29 32.33 3m7w h VAL 128 CO 0.12 0.22 0.35 1.23 0.02 0.00 0.00 177.57 179.52 3m7w h GLY 129 N 0.28 0.87 0.99 2.17 0.00 -1.07 -1.54 103.07 104.77 3m7w h GLY 129 Ca 0.09 -0.26 -0.02 0.00 0.00 0.00 0.00 47.33 47.15 3m7w h GLY 129 CO -0.00 0.19 0.29 -1.82 0.00 0.00 0.00 176.54 175.20 3m7w h TYR 130 N 0.68 0.80 -0.20 5.60 3.20 -1.01 -2.20 116.97 123.84 3m7w h TYR 130 Ca 0.26 -0.03 0.02 0.00 3.14 0.00 0.00 58.73 62.12 3m7w h TYR 130 Cb 0.09 -0.25 -0.02 0.00 1.54 0.00 0.00 36.73 38.08 3m7w h TYR 130 CO -0.07 0.60 0.04 0.00 -1.64 0.00 0.00 178.16 177.09 3m7w h ALA 131 N 1.12 0.20 -0.26 1.82 0.00 -0.71 -2.89 119.26 118.54 3m7w h ALA 131 Ca 0.20 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.11 3m7w h ALA 131 Cb 0.08 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3m7w h ALA 131 CO -0.03 -0.39 0.01 0.45 0.00 0.00 0.00 179.25 179.29 3m7w h HIS 132 N 0.12 0.39 0.00 0.00 3.86 -1.07 -0.17 115.15 118.28 3m7w h HIS 132 Ca 0.09 -0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.27 3m7w h HIS 132 Cb 0.08 -0.12 0.00 0.00 1.06 0.00 0.00 27.41 28.43 3m7w h HIS 132 CO -0.14 0.39 0.00 1.04 0.86 0.00 0.00 177.93 180.09 3m7w n GLN 133 N -4.34 0.06 -0.11 2.45 6.02 -0.85 -2.42 117.38 118.20 3m7w n GLN 133 Ca 0.01 0.35 0.09 0.00 -0.01 0.00 0.00 57.00 57.44 3m7w n GLN 133 Cb 0.20 -1.63 0.12 0.00 1.02 0.00 0.00 30.24 29.96 3m7w n GLN 133 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 3m7w n HIS 134 N -1.74 0.00 -3.01 1.08 8.25 -0.23 -5.00 115.22 114.57 3m7w n HIS 134 Ca 0.02 -0.90 -0.22 0.00 -0.26 0.00 0.00 57.72 56.36 3m7w n HIS 134 Cb 0.16 -0.14 0.03 0.00 1.12 0.00 0.00 29.99 31.16 3m7w n HIS 134 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 3m7w n ASN 135 N -1.29 -6.13 -4.51 0.41 5.15 -0.98 -5.00 115.26 102.91 3m7w n ASN 135 Ca 0.14 -0.28 -0.34 0.00 -0.60 0.00 0.00 54.58 53.50 3m7w n ASN 135 Cb 0.63 -4.96 -0.12 0.00 -0.53 0.00 0.00 39.78 34.81 3m7w n ASN 135 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3m7w s VAL 136 N -3.18 4.13 0.52 3.44 1.01 -0.31 -4.96 120.40 121.05 3m7w s VAL 136 Ca 0.30 -0.26 -0.16 0.00 0.00 0.00 0.00 61.98 61.85 3m7w s VAL 136 Cb -0.13 -2.85 -0.08 0.00 0.00 0.00 0.00 36.38 33.33 3m7w s VAL 136 CO 0.37 0.46 0.99 0.00 0.00 0.00 0.00 175.10 176.92 3m7w s ALA 137 N 0.59 3.06 -0.14 5.51 0.00 -0.65 -3.71 121.76 126.42 3m7w s ALA 137 Ca -0.01 0.18 0.02 0.00 0.00 0.00 0.00 51.96 52.15 3m7w s ALA 137 Cb -0.14 -3.12 0.01 0.00 0.00 0.00 0.00 23.12 19.87 3m7w s ALA 137 CO 0.02 -0.27 -0.22 0.08 0.00 0.00 0.00 175.76 175.37 3m7w s VAL 138 N -2.65 2.08 -0.27 0.00 1.01 -1.26 -1.23 120.40 118.08 3m7w s VAL 138 Ca 0.59 -0.97 -0.14 0.00 0.00 0.00 0.00 61.98 61.46 3m7w s VAL 138 Cb -0.10 -1.83 -0.04 0.00 0.00 0.00 0.00 36.38 34.40 3m7w s VAL 138 CO 0.32 0.55 0.31 -0.63 0.00 0.00 0.00 175.10 175.66 3m7w s ILE 139 N 0.85 5.22 -0.19 2.22 1.01 0.05 -1.40 121.20 128.96 3m7w s ILE 139 Ca -0.06 0.44 -0.09 0.00 0.00 0.00 0.00 60.65 60.94 3m7w s ILE 139 Cb -0.15 -3.64 -0.05 0.00 0.01 0.00 0.00 42.46 38.63 3m7w s ILE 139 CO -0.03 0.19 0.11 -0.32 0.00 0.00 0.00 174.94 174.90 3m7w s MET 140 N 1.92 4.11 0.22 2.79 1.75 -0.80 -0.81 119.30 128.48 3m7w s MET 140 Ca 0.12 -0.24 0.08 0.00 -1.25 0.00 0.00 55.69 54.40 3m7w s MET 140 Cb -0.16 -3.36 -0.05 0.00 2.84 0.00 0.00 34.83 34.10 3m7w s MET 140 CO 0.10 0.32 -0.14 -1.54 -0.65 0.00 0.00 175.02 173.11 3m7w s SER 141 N 0.30 2.71 -0.13 1.11 1.04 0.23 0.02 113.70 118.98 3m7w s SER 141 Ca 0.07 -1.05 -0.11 0.00 0.48 0.00 0.00 55.95 55.35 3m7w s SER 141 Cb -0.11 -0.16 0.04 0.00 0.10 0.00 0.00 66.02 65.88 3m7w s SER 141 CO -0.01 -0.17 0.33 0.21 0.98 0.00 0.00 173.24 174.57 3m7w s ASN 142 N -3.36 -0.35 0.00 7.02 3.84 -0.68 -0.58 114.94 120.83 3m7w s ASN 142 Ca 0.24 0.67 0.04 0.00 0.21 0.00 0.00 52.86 54.03 3m7w s ASN 142 Cb -0.01 0.66 -0.01 0.00 -0.55 0.00 0.00 41.25 41.34 3m7w s ASN 142 CO 0.08 -0.13 -0.13 -1.00 -2.79 0.00 0.00 177.10 173.14 3m7w s HIS 143 N 0.38 1.18 -0.19 0.43 3.76 -1.26 -1.50 115.29 118.10 3m7w s HIS 143 Ca -0.02 -0.25 -0.03 0.00 -0.15 0.00 0.00 55.06 54.61 3m7w s HIS 143 Cb -0.04 -0.75 0.06 0.00 1.11 0.00 0.00 32.58 32.97 3m7w s HIS 143 CO -0.02 -0.01 0.05 0.34 -0.85 0.00 0.00 174.74 174.25 3m7w s ASP 144 N -0.50 2.76 0.00 1.40 -1.08 -0.29 -4.93 116.67 114.03 3m7w s ASP 144 Ca 0.04 -0.76 0.22 0.00 -0.52 0.00 0.00 52.55 51.53 3m7w s ASP 144 Cb -0.06 -0.52 0.84 0.00 -1.46 0.00 0.00 42.92 41.72 3m7w s ASP 144 CO -0.00 -0.31 1.60 0.49 0.52 0.00 0.00 175.17 177.46 3m7w n PHE 145 N 5.10 0.16 0.00 -5.34 3.72 -1.26 -0.61 117.46 119.23 3m7w n PHE 145 Ca -0.08 -0.08 0.00 0.00 -0.05 0.00 0.00 57.45 57.23 3m7w n PHE 145 Cb 0.48 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.02 3m7w n PHE 145 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 3m7w n HIS 146 N 0.19 0.00 -3.91 1.38 8.25 -1.26 -4.80 115.22 115.07 3m7w n HIS 146 Ca 0.16 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.54 3m7w n HIS 146 Cb 0.31 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.39 3m7w n HIS 146 CO 0.00 0.00 0.00 -1.59 0.64 0.00 0.00 176.34 175.39 3m7w s LYS 147 N -1.88 1.78 -0.26 -0.41 -2.85 -1.21 -4.70 119.74 110.20 3m7w s LYS 147 Ca 0.00 -1.19 -0.02 0.00 -1.00 0.00 0.00 55.97 53.76 3m7w s LYS 147 Cb 0.00 0.55 0.03 0.00 -2.06 0.00 0.00 37.83 36.36 3m7w s LYS 147 CO 0.00 -0.79 -0.04 0.99 0.10 0.00 0.00 175.35 175.61 3m7w s THR 148 N -3.68 2.93 0.97 3.79 2.01 -0.94 -2.67 115.64 118.05 3m7w s THR 148 Ca 0.17 -1.13 -0.11 0.00 0.31 0.00 0.00 61.69 60.93 3m7w s THR 148 Cb -0.04 -2.55 0.17 0.00 0.01 0.00 0.00 72.50 70.09 3m7w s THR 148 CO 0.09 0.10 1.09 -2.84 -0.69 0.00 0.00 174.62 172.38 3m7w s PRO 149 N 1.31 0.64 0.72 4.92 0.02 -1.26 -4.96 135.00 136.39 3m7w s PRO 149 Ca -0.02 1.14 -0.16 0.00 0.02 0.00 0.00 61.00 61.99 3m7w s PRO 149 Cb -0.18 -1.71 0.03 0.00 0.02 0.00 0.00 34.50 32.66 3m7w s PRO 149 CO -0.03 -2.76 1.19 0.00 -0.33 0.00 0.00 177.00 175.07 3m7w n ALA 150 N -4.28 0.43 -0.30 -1.55 0.00 -1.26 -4.72 120.51 108.82 3m7w n ALA 150 Ca 0.08 -0.16 0.07 0.00 0.00 0.00 0.00 53.44 53.43 3m7w n ALA 150 Cb 0.53 -2.25 0.22 0.00 0.00 0.00 0.00 19.45 17.95 3m7w n ALA 150 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3m7w h ALA 151 N -0.15 1.31 -0.69 0.00 0.00 -1.93 -0.69 119.26 117.10 3m7w h ALA 151 Ca -0.48 0.07 0.09 0.00 0.00 0.00 0.00 54.91 54.58 3m7w h ALA 151 Cb 1.32 -0.06 -0.07 0.00 0.00 0.00 0.00 17.79 18.98 3m7w h ALA 151 CO 0.49 -0.02 0.35 1.49 0.00 0.00 0.00 179.25 181.56 3m7w h GLU 152 N 0.70 0.59 -0.22 0.00 4.81 -1.95 0.55 114.58 119.06 3m7w h GLU 152 Ca 0.46 -0.04 -0.18 0.00 -0.13 0.00 0.00 59.36 59.48 3m7w h GLU 152 Cb 0.60 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 29.84 3m7w h GLU 152 CO -0.33 0.39 -0.59 1.49 -0.73 0.00 0.00 179.01 179.24 3m7w h GLU 153 N 0.60 0.70 -0.34 1.92 4.81 -1.50 -0.95 114.58 119.82 3m7w h GLU 153 Ca 0.34 -0.46 0.00 0.00 -0.13 0.00 0.00 59.36 59.10 3m7w h GLU 153 Cb 0.33 0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.76 3m7w h GLU 153 CO -0.25 1.09 0.22 0.82 -0.73 0.00 0.00 179.01 180.15 3m7w h ILE 154 N 0.53 1.09 -0.76 2.32 2.04 -0.71 -1.19 117.51 120.84 3m7w h ILE 154 Ca 0.00 -0.18 -0.05 0.00 1.00 0.00 0.00 64.86 65.63 3m7w h ILE 154 Cb 1.17 0.61 -0.03 0.00 -0.74 0.00 0.00 36.82 37.83 3m7w h ILE 154 CO 0.12 0.09 0.29 0.58 0.00 0.00 0.00 178.15 179.23 3m7w h VAL 155 N 0.45 1.26 -0.77 1.67 2.07 -0.77 -1.49 116.25 118.67 3m7w h VAL 155 Ca 0.12 -0.82 0.04 0.00 0.82 0.00 0.00 66.70 66.86 3m7w h VAL 155 Cb -0.04 0.38 -0.05 0.00 -1.52 0.00 0.00 31.29 30.06 3m7w h VAL 155 CO -0.03 0.33 0.49 -0.61 0.02 0.00 0.00 177.57 177.77 3m7w h GLN 156 N 1.10 0.91 -0.22 1.57 4.15 -0.77 0.17 115.11 122.02 3m7w h GLN 156 Ca 0.25 -0.05 -0.02 0.00 0.77 0.00 0.00 58.65 59.59 3m7w h GLN 156 Cb 0.23 -0.20 -0.01 0.00 0.21 0.00 0.00 27.48 27.71 3m7w h GLN 156 CO -0.02 0.60 0.04 0.00 -1.93 0.00 0.00 178.83 177.52 3m7w h ARG 157 N 0.94 0.36 -0.69 1.69 3.08 -0.85 -0.54 114.38 118.36 3m7w h ARG 157 Ca 0.32 -0.09 0.00 0.00 0.07 0.00 0.00 59.98 60.28 3m7w h ARG 157 Cb 0.05 -0.04 -0.03 0.00 0.08 0.00 0.00 29.97 30.02 3m7w h ARG 157 CO -0.12 0.50 0.45 -0.07 -1.07 0.00 0.00 179.97 179.65 3m7w h LEU 158 N 0.17 0.80 -0.74 3.04 3.38 -0.80 -0.85 115.31 120.31 3m7w h LEU 158 Ca 0.07 -0.03 -0.11 0.00 0.09 0.00 0.00 57.88 57.90 3m7w h LEU 158 Cb 0.31 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 3m7w h LEU 158 CO 0.00 0.59 -0.23 0.03 0.09 0.00 0.00 178.44 178.92 3m7w h ARG 159 N 0.94 0.71 -0.61 1.13 3.08 -0.56 -2.31 114.38 116.75 3m7w h ARG 159 Ca 0.25 -0.28 -0.05 0.00 0.07 0.00 0.00 59.98 59.97 3m7w h ARG 159 Cb -0.09 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 29.90 3m7w h ARG 159 CO -0.05 0.88 0.17 -0.22 -1.07 0.00 0.00 179.97 179.68 3m7w h LYS 160 N 0.62 0.93 -0.45 0.04 1.63 -0.57 -1.19 116.57 117.59 3m7w h LYS 160 Ca 0.09 -0.19 0.00 0.00 -0.85 0.00 0.00 60.65 59.70 3m7w h LYS 160 Cb 0.72 -0.14 -0.02 0.00 -0.60 0.00 0.00 32.23 32.19 3m7w h LYS 160 CO 0.06 0.82 0.29 0.52 -3.45 0.00 0.00 179.45 177.69 3m7w h MET 161 N 0.90 0.60 -0.46 1.90 2.86 -0.77 -0.21 114.93 119.75 3m7w h MET 161 Ca 0.20 -0.04 0.02 0.00 -2.06 0.00 0.00 59.70 57.82 3m7w h MET 161 Cb 0.29 -0.13 -0.03 0.00 0.06 0.00 0.00 31.60 31.79 3m7w h MET 161 CO -0.00 0.41 0.28 1.96 1.06 0.00 0.00 176.91 180.61 3m7w h GLN 162 N 0.61 0.54 -0.84 1.72 4.20 -0.88 -1.98 115.11 118.48 3m7w h GLN 162 Ca 0.16 -0.03 0.06 0.00 0.06 0.00 0.00 58.65 58.90 3m7w h GLN 162 Cb -0.05 -0.12 -0.05 0.00 0.30 0.00 0.00 27.48 27.55 3m7w h GLN 162 CO -0.03 0.36 0.55 1.49 -0.67 0.00 0.00 178.83 180.53 3m7w h GLU 163 N 0.56 0.94 0.00 1.46 4.81 -0.78 -0.74 114.58 120.83 3m7w h GLU 163 Ca 0.18 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 3m7w h GLU 163 Cb -0.00 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 29.17 3m7w h GLU 163 CO -0.07 0.62 0.00 1.28 -0.73 0.00 0.00 179.01 180.11 3m7w n LEU 164 N -4.48 0.00 0.00 1.64 4.77 -0.13 -4.90 117.00 113.90 3m7w n LEU 164 Ca 0.12 0.22 0.00 0.00 -0.03 0.00 0.00 56.01 56.32 3m7w n LEU 164 Cb 0.18 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.05 3m7w n LEU 164 CO 0.33 -0.04 0.00 0.61 -1.33 0.00 0.00 177.39 176.97 3m7w n GLY 165 N 0.78 0.97 3.68 -0.72 0.00 -0.28 -4.64 105.19 104.98 3m7w n GLY 165 Ca 0.14 -0.01 -0.44 0.00 0.00 0.00 0.00 46.02 45.70 3m7w n GLY 165 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m7w n ALA 166 N -1.84 1.37 0.07 4.61 0.00 -0.79 -4.89 120.51 119.04 3m7w n ALA 166 Ca 0.00 0.40 -0.12 0.00 0.00 0.00 0.00 53.44 53.72 3m7w n ALA 166 Cb 0.00 -2.31 -0.03 0.00 0.00 0.00 0.00 19.45 17.11 3m7w n ALA 166 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3m7w h ASP 167 N 4.22 0.45 -2.50 0.00 3.32 -1.58 -3.43 116.42 116.89 3m7w h ASP 167 Ca -0.45 -0.36 -0.40 0.00 0.02 0.00 0.00 57.03 55.85 3m7w h ASP 167 Cb 1.27 -0.14 -0.36 0.00 0.22 0.00 0.00 39.33 40.32 3m7w h ASP 167 CO 0.76 1.15 -0.69 -0.63 -1.72 0.00 0.00 179.24 178.11 3m7w s ILE 168 N -3.27 -0.26 0.40 0.35 1.01 -0.82 -4.26 121.20 114.35 3m7w s ILE 168 Ca -0.05 -0.45 -0.26 0.00 0.00 0.00 0.00 60.65 59.89 3m7w s ILE 168 Cb 0.09 -0.88 -0.09 0.00 0.01 0.00 0.00 42.46 41.60 3m7w s ILE 168 CO 0.85 -0.47 1.28 -2.84 0.00 0.00 0.00 174.94 173.77 3m7w s PRO 169 N 2.26 3.98 -0.02 2.79 0.02 -1.24 -1.91 135.00 140.88 3m7w s PRO 169 Ca 0.08 2.11 0.00 0.00 0.02 0.00 0.00 61.00 63.21 3m7w s PRO 169 Cb -0.15 -2.75 0.02 0.00 0.02 0.00 0.00 34.50 31.65 3m7w s PRO 169 CO -0.27 -0.47 0.01 0.21 -0.33 0.00 0.00 177.00 176.15 3m7w s LYS 170 N -2.24 0.19 -0.02 5.54 2.20 0.10 -0.81 119.74 124.70 3m7w s LYS 170 Ca 0.57 0.09 0.01 0.00 -0.36 0.00 0.00 55.97 56.28 3m7w s LYS 170 Cb -0.37 -0.38 0.01 0.00 -1.51 0.00 0.00 37.83 35.58 3m7w s LYS 170 CO 0.47 -0.12 -0.02 -1.50 -0.36 0.00 0.00 175.35 173.82 3m7w s ILE 171 N 0.92 0.23 -0.13 5.43 2.07 -0.61 -1.69 121.20 127.42 3m7w s ILE 171 Ca -0.09 -0.02 0.00 0.00 -1.41 0.00 0.00 60.65 59.14 3m7w s ILE 171 Cb -0.12 -0.27 0.02 0.00 0.13 0.00 0.00 42.46 42.22 3m7w s ILE 171 CO -0.02 0.12 -0.12 0.00 -1.91 0.00 0.00 174.94 173.01 3m7w s ALA 172 N 0.57 1.65 0.12 1.50 0.00 -0.56 -1.80 121.76 123.24 3m7w s ALA 172 Ca -0.06 -0.75 0.05 0.00 0.00 0.00 0.00 51.96 51.20 3m7w s ALA 172 Cb -0.09 -0.97 -0.04 0.00 0.00 0.00 0.00 23.12 22.03 3m7w s ALA 172 CO -0.01 -0.34 -0.12 0.14 0.00 0.00 0.00 175.76 175.42 3m7w s VAL 173 N 1.48 1.22 -0.24 0.00 -7.23 -0.70 -1.14 120.40 113.79 3m7w s VAL 173 Ca 0.03 -1.77 -0.10 0.00 -1.81 0.00 0.00 61.98 58.33 3m7w s VAL 173 Cb -0.13 -1.56 -0.05 0.00 0.56 0.00 0.00 36.38 35.21 3m7w s VAL 173 CO -0.08 -0.51 0.14 -0.32 -0.31 0.00 0.00 175.10 174.02 3m7w s MET 174 N -2.91 4.01 0.05 4.82 1.75 0.22 -0.68 119.30 126.57 3m7w s MET 174 Ca 0.10 -0.30 -0.29 0.00 -1.25 0.00 0.00 55.69 53.95 3m7w s MET 174 Cb -0.03 -3.49 -0.05 0.00 2.84 0.00 0.00 34.83 34.10 3m7w s MET 174 CO 0.02 0.04 0.92 -1.25 -0.65 0.00 0.00 175.02 174.10 3m7w s PRO 175 N 1.08 4.60 0.15 4.11 0.04 -1.26 -2.21 135.00 141.50 3m7w s PRO 175 Ca 0.07 1.34 0.22 0.00 0.04 0.00 0.00 61.00 62.67 3m7w s PRO 175 Cb -0.14 -3.41 -0.07 0.00 0.04 0.00 0.00 34.50 30.92 3m7w s PRO 175 CO 0.04 0.12 0.92 1.04 0.04 0.00 0.00 177.00 179.17 3m7w n GLN 176 N 3.25 0.60 -4.15 4.56 6.02 -1.26 -4.97 117.38 121.44 3m7w n GLN 176 Ca 0.03 0.05 -0.10 0.00 -0.01 0.00 0.00 57.00 56.96 3m7w n GLN 176 Cb 0.50 -1.75 -0.10 0.00 1.02 0.00 0.00 30.24 29.91 3m7w n GLN 176 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 3m7w s THR 177 N -3.39 0.08 0.25 5.09 -4.23 -1.26 -5.05 115.64 107.13 3m7w s THR 177 Ca -0.02 -1.91 -0.05 0.00 -1.18 0.00 0.00 61.69 58.54 3m7w s THR 177 Cb 0.11 -2.11 0.19 0.00 1.34 0.00 0.00 72.50 72.03 3m7w s THR 177 CO 0.82 -0.39 1.85 0.11 -0.54 0.00 0.00 174.62 176.47 3m7w h LYS 178 N 2.81 1.12 -0.69 3.99 1.57 -1.95 -2.57 116.57 120.84 3m7w h LYS 178 Ca -0.35 -0.16 0.09 0.00 -1.87 0.00 0.00 60.65 58.36 3m7w h LYS 178 Cb 1.21 -0.21 -0.04 0.00 0.08 0.00 0.00 32.23 33.27 3m7w h LYS 178 CO 0.58 0.86 0.46 0.00 -0.57 0.00 0.00 179.45 180.78 3m7w h ALA 179 N 1.30 1.86 -0.22 3.86 0.00 -2.00 -1.38 119.26 122.68 3m7w h ALA 179 Ca 0.27 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.15 3m7w h ALA 179 Cb 0.11 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3m7w h ALA 179 CO -0.03 -0.01 0.06 -0.44 0.00 0.00 0.00 179.25 178.83 3m7w h ASP 180 N 0.59 0.28 -0.65 0.00 3.32 -1.87 -0.97 116.42 117.13 3m7w h ASP 180 Ca 0.32 -0.03 -0.04 0.00 0.02 0.00 0.00 57.03 57.30 3m7w h ASP 180 Cb 0.46 -0.07 -0.03 0.00 0.22 0.00 0.00 39.33 39.91 3m7w h ASP 180 CO -0.11 0.29 0.26 0.58 -1.72 0.00 0.00 179.24 178.54 3m7w h VAL 181 N 0.31 1.24 -0.06 -1.35 2.07 -1.32 -2.28 116.25 114.87 3m7w h VAL 181 Ca 0.08 -0.74 -0.10 0.00 0.82 0.00 0.00 66.70 66.76 3m7w h VAL 181 Cb 0.12 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 30.39 3m7w h VAL 181 CO -0.00 0.29 -0.41 -0.07 0.02 0.00 0.00 177.57 177.40 3m7w h LEU 182 N 0.91 0.13 -0.44 2.57 3.38 -1.33 -1.95 115.31 118.58 3m7w h LEU 182 Ca 0.22 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.11 3m7w h LEU 182 Cb 0.21 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 3m7w h LEU 182 CO -0.02 0.53 0.19 0.74 0.09 0.00 0.00 178.44 179.97 3m7w h THR 183 N 0.11 1.19 -0.52 0.22 2.02 -0.93 -0.33 112.91 114.68 3m7w h THR 183 Ca 0.01 -0.58 -0.01 0.00 0.77 0.00 0.00 66.41 66.60 3m7w h THR 183 Cb 0.78 0.76 -0.02 0.00 -1.74 0.00 0.00 68.15 67.92 3m7w h THR 183 CO 0.06 0.22 0.29 0.25 0.37 0.00 0.00 175.52 176.71 3m7w h LEU 184 N 0.57 0.64 -0.85 2.58 7.12 -1.03 -1.46 115.31 122.88 3m7w h LEU 184 Ca 0.15 -0.08 -0.10 0.00 0.13 0.00 0.00 57.88 57.98 3m7w h LEU 184 Cb 0.16 -0.16 -0.02 0.00 -0.53 0.00 0.00 40.66 40.12 3m7w h LEU 184 CO -0.01 0.53 -0.18 -0.07 -0.13 0.00 0.00 178.44 178.58 3m7w h LEU 185 N 0.69 0.66 -0.27 2.25 3.38 -1.22 -1.40 115.31 119.39 3m7w h LEU 185 Ca 0.18 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 3m7w h LEU 185 Cb 0.03 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 3m7w h LEU 185 CO -0.03 0.85 0.13 0.74 0.09 0.00 0.00 178.44 180.22 3m7w h THR 186 N 0.59 1.15 -0.69 0.22 2.02 -0.74 -0.39 112.91 115.07 3m7w h THR 186 Ca 0.09 -0.43 -0.02 0.00 0.77 0.00 0.00 66.41 66.83 3m7w h THR 186 Cb 0.64 0.93 -0.03 0.00 -1.74 0.00 0.00 68.15 67.94 3m7w h THR 186 CO 0.04 0.15 0.35 0.00 0.37 0.00 0.00 175.52 176.44 3m7w h ALA 187 N 0.99 1.32 -0.18 6.16 0.00 -1.10 -0.60 119.26 125.85 3m7w h ALA 187 Ca 0.09 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 3m7w h ALA 187 Cb 0.12 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 3m7w h ALA 187 CO -0.01 0.54 0.05 1.15 0.00 0.00 0.00 179.25 180.98 3m7w h THR 188 N 0.97 1.19 -0.27 0.00 2.02 -0.82 -0.56 112.91 115.44 3m7w h THR 188 Ca 0.24 -0.59 -0.02 0.00 0.77 0.00 0.00 66.41 66.81 3m7w h THR 188 Cb 0.07 1.24 -0.01 0.00 -1.74 0.00 0.00 68.15 67.71 3m7w h THR 188 CO -0.04 0.18 0.08 0.58 0.37 0.00 0.00 175.52 176.70 3m7w h VAL 189 N 0.11 1.20 -0.65 3.16 2.07 -0.74 -0.99 116.25 120.40 3m7w h VAL 189 Ca 0.06 -0.62 0.03 0.00 0.82 0.00 0.00 66.70 66.98 3m7w h VAL 189 Cb 0.23 1.11 -0.04 0.00 -1.52 0.00 0.00 31.29 31.07 3m7w h VAL 189 CO -0.00 0.21 0.41 -0.08 0.02 0.00 0.00 177.57 178.12 3m7w h GLU 190 N 0.27 0.78 0.02 1.57 4.81 -1.04 -0.49 114.58 120.50 3m7w h GLU 190 Ca 0.09 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.27 3m7w h GLU 190 Cb 0.24 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.44 3m7w h GLU 190 CO -0.00 0.52 -0.01 1.98 -0.73 0.00 0.00 179.01 180.76 3m7w h MET 191 N 0.80 -0.03 -0.65 1.92 4.05 -0.93 -1.32 114.93 118.78 3m7w h MET 191 Ca 0.26 0.00 -0.06 0.00 -0.28 0.00 0.00 59.70 59.62 3m7w h MET 191 Cb 0.01 0.01 -0.03 0.00 -0.80 0.00 0.00 31.60 30.79 3m7w h MET 191 CO -0.10 0.20 0.16 0.37 0.23 0.00 0.00 176.91 177.77 3m7w h GLN 192 N -0.25 1.01 0.11 0.39 -0.00 -1.03 0.23 115.11 115.58 3m7w h GLN 192 Ca -0.00 -0.23 -0.28 0.00 -0.00 0.00 0.00 58.65 58.14 3m7w h GLN 192 Cb 0.24 -0.14 0.03 0.00 0.00 0.00 0.00 27.48 27.60 3m7w h GLN 192 CO 0.00 0.89 -1.17 0.93 0.00 0.00 0.00 178.83 179.49 3m7w h GLU 193 N 0.97 0.59 0.00 1.69 5.08 -1.10 -3.40 114.58 118.41 3m7w h GLU 193 Ca 0.21 -0.79 -0.22 0.00 -1.00 0.00 0.00 59.36 57.55 3m7w h GLU 193 Cb 0.33 0.26 -0.04 0.00 0.50 0.00 0.00 28.75 29.80 3m7w h GLU 193 CO -0.00 1.35 -1.84 0.54 -1.00 0.00 0.00 179.01 178.06 3m7w n ARG 194 N -3.85 1.98 0.00 2.33 1.74 -0.50 -4.87 116.66 113.49 3m7w n ARG 194 Ca -0.13 -0.01 0.00 0.00 -0.77 0.00 0.00 57.85 56.94 3m7w n ARG 194 Cb 0.95 -1.32 0.00 0.00 -1.02 0.00 0.00 32.46 31.07 3m7w n ARG 194 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 3m7w n TYR 195 N -2.46 0.00 -2.64 -1.55 4.01 -0.57 -5.05 117.16 108.90 3m7w n TYR 195 Ca -0.20 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.13 3m7w n TYR 195 Cb 0.90 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.88 3m7w n TYR 195 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3m7w s ALA 196 N -1.82 3.32 -0.14 -0.72 0.00 0.72 -4.91 121.76 118.21 3m7w s ALA 196 Ca 0.00 0.69 0.15 0.00 0.00 0.00 0.00 51.96 52.80 3m7w s ALA 196 Cb 0.00 -3.30 0.33 0.00 0.00 0.00 0.00 23.12 20.16 3m7w s ALA 196 CO 0.00 -0.06 1.17 -0.40 0.00 0.00 0.00 175.76 176.47 3m7w n ASP 197 N 2.31 1.71 -3.70 0.00 5.75 -1.26 -4.92 116.55 116.45 3m7w n ASP 197 Ca 0.02 -3.22 -0.08 0.00 -0.01 0.00 0.00 54.79 51.49 3m7w n ASP 197 Cb 0.47 -0.44 -0.02 0.00 -1.03 0.00 0.00 41.12 40.11 3m7w n ASP 197 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3m7w s ARG 198 N -2.45 1.55 0.66 0.11 1.70 -1.26 -4.07 118.95 115.19 3m7w s ARG 198 Ca 0.32 -0.78 -0.16 0.00 -0.47 0.00 0.00 55.73 54.64 3m7w s ARG 198 Cb 0.30 0.58 -0.00 0.00 -0.57 0.00 0.00 34.95 35.26 3m7w s ARG 198 CO -0.04 -0.70 1.15 -2.14 -1.08 0.00 0.00 175.30 172.49 3m7w s PRO 199 N -3.79 2.70 0.15 3.89 0.02 -1.25 -4.90 135.00 131.82 3m7w s PRO 199 Ca 0.08 1.59 0.06 0.00 0.02 0.00 0.00 61.00 62.75 3m7w s PRO 199 Cb -0.04 -1.92 -0.04 0.00 0.02 0.00 0.00 34.50 32.52 3m7w s PRO 199 CO -0.00 -1.36 -0.14 0.96 -0.33 0.00 0.00 177.00 176.13 3m7w s ILE 200 N -2.05 1.41 -0.13 2.83 -4.36 -1.26 -3.65 121.20 113.99 3m7w s ILE 200 Ca 0.71 -1.89 0.02 0.00 -0.26 0.00 0.00 60.65 59.23 3m7w s ILE 200 Cb -0.25 -1.71 0.01 0.00 1.25 0.00 0.00 42.46 41.76 3m7w s ILE 200 CO 0.39 -0.51 -0.17 -0.63 0.24 0.00 0.00 174.94 174.26 3m7w s ILE 201 N -2.52 1.72 0.07 8.37 1.01 0.01 -0.20 121.20 129.66 3m7w s ILE 201 Ca 0.13 -0.77 0.02 0.00 0.00 0.00 0.00 60.65 60.04 3m7w s ILE 201 Cb -0.03 -1.56 -0.03 0.00 0.01 0.00 0.00 42.46 40.85 3m7w s ILE 201 CO 0.04 0.48 -0.08 0.42 0.00 0.00 0.00 174.94 175.80 3m7w s THR 202 N 1.04 0.69 -0.25 2.92 -4.23 -1.26 -1.58 115.64 112.97 3m7w s THR 202 Ca -0.04 -1.45 -0.26 0.00 -1.18 0.00 0.00 61.69 58.76 3m7w s THR 202 Cb -0.15 -1.10 0.07 0.00 1.34 0.00 0.00 72.50 72.67 3m7w s THR 202 CO -0.04 -0.56 0.74 0.00 -0.54 0.00 0.00 174.62 174.22 3m7w s MET 203 N -2.50 0.84 -0.30 3.99 0.23 -0.74 -4.77 119.30 116.04 3m7w s MET 203 Ca -0.00 0.91 -0.12 0.00 -1.03 0.00 0.00 55.69 55.45 3m7w s MET 203 Cb -0.04 0.41 -0.04 0.00 -1.53 0.00 0.00 34.83 33.63 3m7w s MET 203 CO -0.01 -0.12 0.21 0.45 -2.03 0.00 0.00 175.02 173.52 3m7w s SER 204 N 0.22 6.04 1.02 -1.18 0.15 -1.26 -1.73 113.70 116.96 3m7w s SER 204 Ca -0.01 -0.18 -0.16 0.00 0.70 0.00 0.00 55.95 56.30 3m7w s SER 204 Cb -0.05 -2.13 0.21 0.00 -1.71 0.00 0.00 66.02 62.35 3m7w s SER 204 CO 0.01 -0.13 1.22 -0.04 1.20 0.00 0.00 173.24 175.51 3m7w s MET 205 N 1.74 0.25 0.14 5.44 1.00 0.15 -4.16 119.30 123.86 3m7w s MET 205 Ca 0.07 -0.17 0.00 0.00 0.00 0.00 0.00 55.69 55.59 3m7w s MET 205 Cb -0.17 -1.78 0.00 0.00 0.00 0.00 0.00 34.83 32.89 3m7w s MET 205 CO 0.11 -2.71 0.00 -1.13 0.00 0.00 0.00 175.02 171.28 3m7w n SER 206 N -4.03 -2.09 -0.29 3.03 3.41 -0.17 -3.19 113.62 110.29 3m7w n SER 206 Ca 0.13 0.31 0.09 0.00 -0.26 0.00 0.00 58.87 59.13 3m7w n SER 206 Cb 0.59 -1.21 0.32 0.00 -0.26 0.00 0.00 64.21 63.65 3m7w n SER 206 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 3m7w h LYS 207 N -0.35 0.81 -0.66 4.33 1.57 -1.85 -2.05 116.57 118.36 3m7w h LYS 207 Ca -0.03 -0.05 0.05 0.00 -1.87 0.00 0.00 60.65 58.75 3m7w h LYS 207 Cb 0.34 -0.18 -0.04 0.00 0.08 0.00 0.00 32.23 32.43 3m7w h LYS 207 CO 0.02 0.54 0.44 1.15 -0.57 0.00 0.00 179.45 181.02 3m7w h THR 208 N 0.83 1.04 -0.25 -0.16 2.02 -1.94 -2.67 112.91 111.79 3m7w h THR 208 Ca 0.43 -0.25 0.00 0.00 0.77 0.00 0.00 66.41 67.36 3m7w h THR 208 Cb 0.51 0.26 0.00 0.00 -1.74 0.00 0.00 68.15 67.18 3m7w h THR 208 CO -0.19 0.13 0.00 0.61 0.37 0.00 0.00 175.52 176.44 3m7w n GLY 209 N -1.46 0.92 0.43 2.16 0.00 -0.79 -4.63 105.19 101.83 3m7w n GLY 209 Ca 0.09 -0.57 0.24 0.00 0.00 0.00 0.00 46.02 45.78 3m7w n GLY 209 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 3m7w h VAL 210 N 3.30 0.62 0.00 1.61 3.04 -1.32 0.62 116.25 124.12 3m7w h VAL 210 Ca 0.00 -0.06 -0.00 0.00 -1.01 0.00 0.00 66.70 65.63 3m7w h VAL 210 Cb 0.72 0.42 -0.00 0.00 -2.01 0.00 0.00 31.29 30.42 3m7w h VAL 210 CO 0.00 0.03 -0.01 0.16 -1.01 0.00 0.00 177.57 176.74 3m7w h ILE 211 N 0.18 0.39 0.00 3.17 3.07 -1.85 0.01 117.51 122.48 3m7w h ILE 211 Ca 0.44 -0.06 -0.02 0.00 1.55 0.00 0.00 64.86 66.77 3m7w h ILE 211 Cb 1.43 1.04 -0.00 0.00 -0.27 0.00 0.00 36.82 39.01 3m7w h ILE 211 CO -0.09 0.01 -0.08 0.77 -1.05 0.00 0.00 178.15 177.72 3m7w h SER 212 N 0.00 0.00 0.48 2.16 4.64 -1.17 -1.57 113.55 118.08 3m7w h SER 212 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3m7w h SER 212 Cb 0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.13 3m7w h SER 212 CO 0.00 0.08 -0.63 0.54 -0.87 0.00 0.00 176.83 175.94 3m7w n ARG 213 N -3.33 0.07 -0.09 4.77 1.74 -0.03 -4.42 116.66 115.38 3m7w n ARG 213 Ca -0.01 0.01 -0.10 0.00 -0.77 0.00 0.00 57.85 56.98 3m7w n ARG 213 Cb 0.26 -1.53 -0.11 0.00 -1.02 0.00 0.00 32.46 30.06 3m7w n ARG 213 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3m7w n LEU 214 N -1.62 1.24 -2.12 0.55 4.77 -0.78 -4.70 117.00 114.34 3m7w n LEU 214 Ca 0.05 -0.04 -0.25 0.00 -0.03 0.00 0.00 56.01 55.74 3m7w n LEU 214 Cb 0.36 -0.07 0.15 0.00 -2.33 0.00 0.00 43.42 41.53 3m7w n LEU 214 CO 0.37 0.57 1.22 0.00 -1.33 0.00 0.00 177.39 178.21 3m7w n ALA 215 N -2.78 5.64 0.22 -1.18 0.00 -0.66 -4.65 120.51 117.10 3m7w n ALA 215 Ca -0.29 -3.13 0.06 0.00 0.00 0.00 0.00 53.44 50.07 3m7w n ALA 215 Cb 0.95 -1.41 0.52 0.00 0.00 0.00 0.00 19.45 19.50 3m7w n ALA 215 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3m7w h GLY 216 N 1.33 0.01 0.97 0.00 0.00 -1.79 -0.68 103.07 102.92 3m7w h GLY 216 Ca 0.57 -0.01 -0.02 0.00 0.00 0.00 0.00 47.33 47.87 3m7w h GLY 216 CO 1.15 0.01 0.22 -2.09 0.00 0.00 0.00 176.54 175.83 3m7w h GLU 217 N 0.01 0.73 0.00 4.80 4.81 -1.83 0.51 114.58 123.62 3m7w h GLU 217 Ca 0.00 -0.12 -0.00 0.00 -0.13 0.00 0.00 59.36 59.11 3m7w h GLU 217 Cb 0.27 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.53 3m7w h GLU 217 CO 0.02 0.62 -0.01 0.28 -0.73 0.00 0.00 179.01 179.19 3m7w h VAL 218 N 0.66 1.76 0.00 0.32 2.07 -1.90 -3.39 116.25 115.77 3m7w h VAL 218 Ca 0.17 -2.26 0.00 0.00 0.82 0.00 0.00 66.70 65.43 3m7w h VAL 218 Cb 0.15 3.30 0.00 0.00 -1.52 0.00 0.00 31.29 33.22 3m7w h VAL 218 CO -0.02 0.59 -0.26 0.49 0.02 0.00 0.00 177.57 178.39 3m7w n PHE 219 N -4.62 0.54 0.00 1.57 3.72 -0.28 -4.96 117.46 113.43 3m7w n PHE 219 Ca -0.10 0.16 0.00 0.00 -0.05 0.00 0.00 57.45 57.46 3m7w n PHE 219 Cb 0.47 -0.69 0.00 0.00 -0.94 0.00 0.00 39.48 38.31 3m7w n PHE 219 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3m7w n GLY 220 N 1.37 1.44 3.68 1.37 0.00 0.16 -4.05 105.19 109.17 3m7w n GLY 220 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 3m7w n GLY 220 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3m7w s SER 221 N -1.85 7.20 0.01 1.61 0.15 -1.15 -4.47 113.70 115.20 3m7w s SER 221 Ca 0.00 1.47 0.27 0.00 0.70 0.00 0.00 55.95 58.40 3m7w s SER 221 Cb 0.00 -2.54 0.96 0.00 -1.71 0.00 0.00 66.02 62.73 3m7w s SER 221 CO 0.00 -0.45 1.74 0.00 1.20 0.00 0.00 173.24 175.74 3m7w n ALA 222 N 5.07 2.73 -2.91 5.45 0.00 0.72 -4.34 120.51 127.23 3m7w n ALA 222 Ca 0.08 -0.18 -0.10 0.00 0.00 0.00 0.00 53.44 53.24 3m7w n ALA 222 Cb 0.49 -1.35 -0.05 0.00 0.00 0.00 0.00 19.45 18.53 3m7w n ALA 222 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3m7w s ALA 223 N -3.01 -0.61 -0.10 0.00 0.00 -1.26 -1.55 121.76 115.23 3m7w s ALA 223 Ca 0.13 -0.36 -0.16 0.00 0.00 0.00 0.00 51.96 51.57 3m7w s ALA 223 Cb 0.18 0.71 0.04 0.00 0.00 0.00 0.00 23.12 24.05 3m7w s ALA 223 CO 0.59 -0.64 0.40 -0.08 0.00 0.00 0.00 175.76 176.03 3m7w s THR 224 N -3.86 0.02 -0.11 0.00 -1.32 -0.20 -4.63 115.64 105.54 3m7w s THR 224 Ca 0.07 -0.16 -0.08 0.00 -1.21 0.00 0.00 61.69 60.31 3m7w s THR 224 Cb 0.02 -0.63 -0.04 0.00 -1.51 0.00 0.00 72.50 70.34 3m7w s THR 224 CO -0.08 -0.09 0.17 -0.36 -2.21 0.00 0.00 174.62 172.05 3m7w s PHE 225 N -0.43 3.60 0.32 9.09 0.40 -1.26 -0.83 117.98 128.87 3m7w s PHE 225 Ca -0.06 0.57 0.05 0.00 -0.60 0.00 0.00 56.93 56.90 3m7w s PHE 225 Cb -0.03 -2.00 -0.06 0.00 0.51 0.00 0.00 43.02 41.44 3m7w s PHE 225 CO 0.03 0.70 0.01 0.20 0.70 0.00 0.00 175.22 176.85 3m7w s GLY 226 N -0.94 2.05 -0.11 4.36 0.00 -0.17 -4.57 107.32 107.95 3m7w s GLY 226 Ca 0.16 -2.04 -0.03 0.00 0.00 0.00 0.00 44.72 42.80 3m7w s GLY 226 CO 0.05 -1.87 0.01 0.00 0.00 0.00 0.00 173.10 171.28 3m7w s ALA 227 N -3.11 3.27 0.00 3.20 0.00 0.28 -4.41 121.76 120.99 3m7w s ALA 227 Ca 0.34 -0.80 0.00 0.00 0.00 0.00 0.00 51.96 51.50 3m7w s ALA 227 Cb 0.07 -1.55 0.00 0.00 0.00 0.00 0.00 23.12 21.64 3m7w s ALA 227 CO 0.15 0.49 0.00 0.28 0.00 0.00 0.00 175.76 176.67 3m7w n VAL 228 N 2.50 0.00 -0.09 0.00 0.31 -1.26 -0.89 118.33 118.90 3m7w n VAL 228 Ca -0.18 0.23 -0.13 0.00 -0.01 0.00 0.00 64.34 64.25 3m7w n VAL 228 Cb 0.53 -0.87 -0.09 0.00 -0.91 0.00 0.00 33.84 32.51 3m7w n VAL 228 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 3m7w n LYS 229 N -1.44 0.55 -4.03 5.55 5.02 -1.26 -4.78 118.16 117.76 3m7w n LYS 229 Ca 0.00 0.10 -0.10 0.00 -2.02 0.00 0.00 58.31 56.29 3m7w n LYS 229 Cb 0.00 -1.38 -0.11 0.00 -0.02 0.00 0.00 35.03 33.53 3m7w n LYS 229 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 3m7w s LYS 230 N -2.37 0.45 0.49 1.97 -2.85 -1.26 -5.15 119.74 111.00 3m7w s LYS 230 Ca -0.24 -0.80 -0.19 0.00 -1.00 0.00 0.00 55.97 53.74 3m7w s LYS 230 Cb 0.06 0.01 -0.09 0.00 -2.06 0.00 0.00 37.83 35.76 3m7w s LYS 230 CO 0.44 -0.03 0.99 0.00 0.10 0.00 0.00 175.35 176.85 3m7w s ALA 231 N -2.01 2.99 -2.74 0.59 0.00 -1.26 -4.79 121.76 114.53 3m7w s ALA 231 Ca -0.09 0.37 0.24 0.00 0.00 0.00 0.00 51.96 52.48 3m7w s ALA 231 Cb -0.06 -3.17 0.38 0.00 0.00 0.00 0.00 23.12 20.27 3m7w s ALA 231 CO -0.02 -0.17 1.37 -1.13 0.00 0.00 0.00 175.76 175.80 3m7w n SER 232 N -1.15 2.96 -3.56 0.00 3.41 -1.26 -4.97 113.62 109.04 3m7w n SER 232 Ca 0.07 -1.94 -0.11 0.00 -0.26 0.00 0.00 58.87 56.64 3m7w n SER 232 Cb 0.54 -0.09 -0.05 0.00 -0.26 0.00 0.00 64.21 64.35 3m7w n SER 232 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3m7w s ALA 233 N -1.81 -1.90 0.33 7.33 0.00 -1.26 -5.13 121.76 119.31 3m7w s ALA 233 Ca 0.33 1.46 -0.29 0.00 0.00 0.00 0.00 51.96 53.45 3m7w s ALA 233 Cb 0.21 -0.43 -0.11 0.00 0.00 0.00 0.00 23.12 22.79 3m7w s ALA 233 CO 0.31 -0.39 1.57 -2.14 0.00 0.00 0.00 175.76 175.10 3m7w s PRO 234 N -1.52 4.10 0.00 0.00 0.02 -1.26 -3.18 135.00 133.16 3m7w s PRO 234 Ca -0.01 2.60 0.00 0.00 0.02 0.00 0.00 61.00 63.61 3m7w s PRO 234 Cb -0.01 -3.00 0.00 0.00 0.02 0.00 0.00 34.50 31.52 3m7w s PRO 234 CO 0.00 -0.62 0.00 0.41 -0.33 0.00 0.00 177.00 176.47 3m7w n GLY 235 N 1.55 1.41 3.77 0.52 0.00 -1.26 -1.00 105.19 110.19 3m7w n GLY 235 Ca 0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.68 3m7w n GLY 235 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3m7w s GLN 236 N -0.79 4.27 0.43 1.61 -0.21 -1.19 -4.66 119.66 119.11 3m7w s GLN 236 Ca 0.00 2.10 0.07 0.00 0.02 0.00 0.00 55.36 57.55 3m7w s GLN 236 Cb 0.00 -2.96 -0.02 0.00 1.00 0.00 0.00 33.01 31.03 3m7w s GLN 236 CO 0.00 -0.22 0.37 0.96 -2.12 0.00 0.00 175.29 174.28 3m7w s ILE 237 N -1.21 2.51 0.44 1.08 -4.36 -1.26 -4.74 121.20 113.66 3m7w s ILE 237 Ca 0.51 -1.39 -0.26 0.00 -0.26 0.00 0.00 60.65 59.25 3m7w s ILE 237 Cb -0.37 -2.90 -0.09 0.00 1.25 0.00 0.00 42.46 40.35 3m7w s ILE 237 CO 0.49 0.00 1.44 -0.94 0.24 0.00 0.00 174.94 176.16 3m7w s SER 238 N -4.13 5.93 0.39 4.36 1.04 -1.26 -0.55 113.70 119.48 3m7w s SER 238 Ca 0.46 2.95 0.06 0.00 0.48 0.00 0.00 55.95 59.91 3m7w s SER 238 Cb -0.02 -2.66 0.81 0.00 0.10 0.00 0.00 66.02 64.25 3m7w s SER 238 CO 0.27 -1.14 2.03 1.62 0.98 0.00 0.00 173.24 177.00 3m7w h VAL 239 N 2.40 1.09 -0.62 5.02 3.04 -1.32 -0.17 116.25 125.69 3m7w h VAL 239 Ca -0.51 -0.22 -0.09 0.00 -1.01 0.00 0.00 66.70 64.88 3m7w h VAL 239 Cb 1.26 0.40 -0.02 0.00 -2.01 0.00 0.00 31.29 30.92 3m7w h VAL 239 CO 0.61 0.12 0.04 0.00 -1.01 0.00 0.00 177.57 177.33 3m7w h ALA 240 N 1.69 0.84 -0.26 3.17 0.00 -1.90 -0.60 119.26 122.21 3m7w h ALA 240 Ca 0.20 -0.29 -0.14 0.00 0.00 0.00 0.00 54.91 54.68 3m7w h ALA 240 Cb 0.03 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 3m7w h ALA 240 CO -0.05 0.65 -0.41 -0.44 0.00 0.00 0.00 179.25 178.99 3m7w h ASP 241 N 0.98 0.65 -0.14 0.00 3.32 -1.69 -1.89 116.42 117.65 3m7w h ASP 241 Ca 0.18 -0.30 -0.00 0.00 0.02 0.00 0.00 57.03 56.93 3m7w h ASP 241 Cb 0.51 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.87 3m7w h ASP 241 CO 0.02 0.99 0.08 0.25 -1.72 0.00 0.00 179.24 178.86 3m7w h LEU 242 N 0.50 0.18 -1.11 1.55 5.85 -0.76 -1.36 115.31 120.16 3m7w h LEU 242 Ca 0.04 -0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.68 3m7w h LEU 242 Cb 0.93 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.87 3m7w h LEU 242 CO 0.08 0.20 0.48 -0.09 -0.34 0.00 0.00 178.44 178.78 3m7w h ARG 243 N 0.14 1.09 -0.05 1.25 9.65 -1.00 -0.84 114.38 124.61 3m7w h ARG 243 Ca 0.05 -0.10 -0.00 0.00 -1.10 0.00 0.00 59.98 58.83 3m7w h ARG 243 Cb 0.07 -0.23 -0.00 0.00 -1.39 0.00 0.00 29.97 28.41 3m7w h ARG 243 CO -0.01 0.76 0.03 1.15 2.80 0.00 0.00 179.97 184.70 3m7w h THR 244 N 1.11 1.10 -0.40 0.20 2.02 -1.06 -0.82 112.91 115.06 3m7w h THR 244 Ca 0.29 -0.30 -0.06 0.00 0.77 0.00 0.00 66.41 67.11 3m7w h THR 244 Cb -0.04 1.21 -0.01 0.00 -1.74 0.00 0.00 68.15 67.56 3m7w h THR 244 CO -0.05 0.09 0.02 0.58 0.37 0.00 0.00 175.52 176.52 3m7w h VAL 245 N -0.03 1.25 -0.60 3.16 2.07 -1.00 -1.50 116.25 119.60 3m7w h VAL 245 Ca 0.02 -0.97 0.02 0.00 0.82 0.00 0.00 66.70 66.59 3m7w h VAL 245 Cb 0.11 1.10 -0.04 0.00 -1.52 0.00 0.00 31.29 30.95 3m7w h VAL 245 CO -0.00 0.33 0.38 -0.07 0.02 0.00 0.00 177.57 178.23 3m7w h LEU 246 N 0.53 0.63 -0.43 2.57 3.38 -1.06 -0.61 115.31 120.32 3m7w h LEU 246 Ca 0.12 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 3m7w h LEU 246 Cb 0.44 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 3m7w h LEU 246 CO 0.02 0.45 0.20 0.74 0.09 0.00 0.00 178.44 179.94 3m7w h THR 247 N 0.76 1.19 -0.39 0.22 2.02 -1.05 0.13 112.91 115.79 3m7w h THR 247 Ca 0.23 -0.54 0.00 0.00 0.77 0.00 0.00 66.41 66.88 3m7w h THR 247 Cb -0.02 0.74 -0.02 0.00 -1.74 0.00 0.00 68.15 67.11 3m7w h THR 247 CO -0.08 0.20 0.26 0.40 0.37 0.00 0.00 175.52 176.67 3m7w h ILE 248 N 0.56 1.10 -0.05 3.11 2.04 -0.85 -1.17 117.51 122.24 3m7w h ILE 248 Ca 0.15 -0.18 -0.08 0.00 1.00 0.00 0.00 64.86 65.75 3m7w h ILE 248 Cb 0.14 0.53 -0.01 0.00 -0.74 0.00 0.00 36.82 36.73 3m7w h ILE 248 CO -0.02 0.10 -0.34 -0.07 0.00 0.00 0.00 178.15 177.82 3m7w h LEU 249 N 0.52 0.09 -0.52 1.44 3.38 -0.85 -1.08 115.31 118.28 3m7w h LEU 249 Ca 0.14 -0.03 -0.16 0.00 0.09 0.00 0.00 57.88 57.93 3m7w h LEU 249 Cb -0.06 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 3m7w h LEU 249 CO -0.03 0.43 -0.73 -0.74 0.09 0.00 0.00 178.44 177.45 3m7w h HIS 250 N 0.08 0.07 -0.18 1.13 2.76 -0.20 -3.27 115.15 115.55 3m7w h HIS 250 Ca 0.01 -0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.14 3m7w h HIS 250 Cb 0.64 -0.01 0.00 0.00 1.55 0.00 0.00 27.41 29.59 3m7w h HIS 250 CO 0.00 0.76 0.00 1.04 -1.30 0.00 0.00 177.93 178.44 3m7w n GLN 251 N -3.70 1.93 0.00 5.26 6.02 -0.49 -5.08 117.38 121.31 3m7w n GLN 251 Ca -0.01 -1.84 0.09 0.00 -0.01 0.00 0.00 57.00 55.23 3m7w n GLN 251 Cb 0.71 -1.39 0.55 0.00 1.02 0.00 0.00 30.24 31.14 3m7w n GLN 251 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05