#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 1.94 -0.08 3.15 -4.23 -1.26 -3.80 115.64 111.35 3m7w s THR 3 Ca 0.00 -1.96 0.00 0.00 -1.18 0.00 0.00 61.69 58.56 3m7w s THR 3 Cb 0.00 -2.89 0.02 0.00 1.34 0.00 0.00 72.50 70.97 3m7w s THR 3 CO 0.00 0.00 -0.06 -0.69 -0.54 0.00 0.00 174.62 173.33 3m7w s VAL 4 N -2.72 0.80 -0.21 2.29 1.01 -0.35 -4.92 120.40 116.31 3m7w s VAL 4 Ca 0.32 -0.19 -0.06 0.00 0.00 0.00 0.00 61.98 62.05 3m7w s VAL 4 Cb 0.08 -0.83 -0.03 0.00 0.00 0.00 0.00 36.38 35.60 3m7w s VAL 4 CO 0.17 0.31 0.03 -0.89 0.00 0.00 0.00 175.10 174.72 3m7w s THR 5 N 1.42 4.28 -0.18 3.92 2.01 -1.26 -0.32 115.64 125.50 3m7w s THR 5 Ca -0.02 -0.20 0.01 0.00 0.31 0.00 0.00 61.69 61.79 3m7w s THR 5 Cb -0.13 -2.95 0.03 0.00 0.01 0.00 0.00 72.50 69.46 3m7w s THR 5 CO -0.04 0.42 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.50 3m7w s VAL 6 N 0.95 1.64 0.00 3.82 1.01 0.65 -4.94 120.40 123.53 3m7w s VAL 6 Ca 0.03 -0.87 0.00 0.00 0.00 0.00 0.00 61.98 61.13 3m7w s VAL 6 Cb -0.14 -1.64 0.00 0.00 0.00 0.00 0.00 36.38 34.60 3m7w s VAL 6 CO 0.02 0.29 0.00 0.54 0.00 0.00 0.00 175.10 175.95 3m7w n ARG 7 N 4.71 0.00 -0.46 2.72 1.74 -1.26 -0.40 116.66 123.71 3m7w n ARG 7 Ca -0.16 0.00 0.09 0.00 -0.77 0.00 0.00 57.85 57.01 3m7w n ARG 7 Cb 0.48 0.00 0.30 0.00 -1.02 0.00 0.00 32.46 32.22 3m7w n ARG 7 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3m7w n ASP 8 N 7.19 4.16 -4.67 0.55 2.03 -1.26 -4.94 116.55 119.61 3m7w n ASP 8 Ca 0.00 -2.32 -0.35 0.00 0.52 0.00 0.00 54.79 52.64 3m7w n ASP 8 Cb 0.00 -0.49 -0.09 0.00 -0.72 0.00 0.00 41.12 39.82 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 -1.60 4.01 -0.39 -2.67 2.96 0.47 -5.06 118.68 116.40 3m7w s LEU 9 Ca 0.45 0.14 -0.11 0.00 -0.22 0.00 0.00 54.13 54.38 3m7w s LEU 9 Cb 0.27 -2.04 0.03 0.00 0.50 0.00 0.00 46.19 44.96 3m7w s LEU 9 CO 0.23 0.16 0.23 -0.69 -1.32 0.00 0.00 176.35 174.96 3m7w s VAL 10 N 0.49 4.64 -0.10 1.68 1.01 -1.26 -0.25 120.40 126.61 3m7w s VAL 10 Ca 0.06 -0.91 -0.21 0.00 0.00 0.00 0.00 61.98 60.92 3m7w s VAL 10 Cb -0.12 -3.63 -0.04 0.00 0.00 0.00 0.00 36.38 32.60 3m7w s VAL 10 CO -0.00 -0.29 0.61 -0.69 0.00 0.00 0.00 175.10 174.73 3m7w s VAL 11 N 1.56 5.10 0.00 2.92 1.01 0.56 -3.76 120.40 127.79 3m7w s VAL 11 Ca 0.02 1.22 0.00 0.00 0.00 0.00 0.00 61.98 63.23 3m7w s VAL 11 Cb -0.20 -3.94 0.00 0.00 0.00 0.00 0.00 36.38 32.24 3m7w s VAL 11 CO 0.07 0.26 0.00 0.61 0.00 0.00 0.00 175.10 176.04 3m7w n GLY 12 N 3.25 0.82 3.30 4.51 0.00 -1.26 -1.21 105.19 114.61 3m7w n GLY 12 Ca -0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.68 3m7w n GLY 12 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3m7w s GLU 13 N -0.43 1.96 4.98 1.61 2.12 -1.25 -4.91 118.70 122.78 3m7w s GLU 13 Ca 0.00 -0.94 0.00 0.00 0.36 0.00 0.00 54.97 54.39 3m7w s GLU 13 Cb 0.00 -1.95 0.00 0.00 0.26 0.00 0.00 34.13 32.44 3m7w s GLU 13 CO 0.00 0.53 0.00 0.41 -0.54 0.00 0.00 175.26 175.66 3m7w n GLY 14 N 2.30 1.78 3.79 -1.50 0.00 -1.26 -4.79 105.19 105.51 3m7w n GLY 14 Ca -0.16 -0.60 -0.35 0.00 0.00 0.00 0.00 46.02 44.90 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 -1.93 2.95 0.44 4.61 0.00 -1.26 -4.93 121.76 121.63 3m7w s ALA 15 Ca 0.00 0.66 -0.24 0.00 0.00 0.00 0.00 51.96 52.38 3m7w s ALA 15 Cb 0.00 -3.27 -0.09 0.00 0.00 0.00 0.00 23.12 19.76 3m7w s ALA 15 CO 0.00 -0.30 1.19 -2.30 0.00 0.00 0.00 175.76 174.35 3m7w n PRO 16 N -0.63 1.70 -3.06 0.00 -0.02 -1.26 -4.94 135.00 126.78 3m7w n PRO 16 Ca 0.08 0.61 -0.36 0.00 -2.02 0.00 0.00 63.50 61.80 3m7w n PRO 16 Cb 0.51 -2.30 -0.06 0.00 -0.02 0.00 0.00 33.50 31.63 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 -2.25 4.29 -0.16 -0.52 -0.14 -0.68 -4.85 119.74 115.43 3m7w s LYS 17 Ca 0.63 0.92 -0.17 0.00 -1.36 0.00 0.00 55.97 56.00 3m7w s LYS 17 Cb -0.51 -2.87 -0.04 0.00 -1.68 0.00 0.00 37.83 32.73 3m7w s LYS 17 CO 0.56 0.38 0.43 0.42 -0.76 0.00 0.00 175.35 176.39 3m7w s ILE 18 N -1.53 5.20 -0.06 2.17 1.01 -1.26 -0.94 121.20 125.79 3m7w s ILE 18 Ca 0.44 0.83 0.04 0.00 0.00 0.00 0.00 60.65 61.96 3m7w s ILE 18 Cb -0.17 -3.77 -0.02 0.00 0.01 0.00 0.00 42.46 38.51 3m7w s ILE 18 CO 0.21 0.30 -0.18 -0.63 0.00 0.00 0.00 174.94 174.63 3m7w s ILE 19 N 0.92 2.67 0.09 2.92 1.01 0.05 -0.18 121.20 128.67 3m7w s ILE 19 Ca 0.22 -0.86 0.09 0.00 0.00 0.00 0.00 60.65 60.11 3m7w s ILE 19 Cb -0.15 -2.02 -0.03 0.00 0.01 0.00 0.00 42.46 40.27 3m7w s ILE 19 CO 0.08 0.58 -0.23 0.68 0.00 0.00 0.00 174.94 176.05 3m7w s VAL 20 N -0.44 1.89 -0.18 2.92 -7.23 -0.89 -1.26 120.40 115.21 3m7w s VAL 20 Ca 0.05 -1.48 -0.07 0.00 -1.81 0.00 0.00 61.98 58.67 3m7w s VAL 20 Cb -0.12 -1.67 -0.04 0.00 0.56 0.00 0.00 36.38 35.11 3m7w s VAL 20 CO 0.02 0.10 0.05 -0.44 -0.31 0.00 0.00 175.10 174.52 3m7w s SER 21 N -1.66 5.56 -0.19 4.85 0.01 -1.26 -0.42 113.70 120.58 3m7w s SER 21 Ca 0.09 0.06 -0.12 0.00 1.31 0.00 0.00 55.95 57.29 3m7w s SER 21 Cb -0.10 -1.95 -0.05 0.00 0.21 0.00 0.00 66.02 64.14 3m7w s SER 21 CO 0.04 0.17 0.24 -0.22 0.41 0.00 0.00 173.24 173.88 3m7w s LEU 22 N 0.36 4.19 -0.20 2.44 0.20 0.89 -4.90 118.68 121.67 3m7w s LEU 22 Ca 0.02 0.35 -0.00 0.00 0.69 0.00 0.00 54.13 55.19 3m7w s LEU 22 Cb -0.12 -2.26 0.05 0.00 -0.43 0.00 0.00 46.19 43.42 3m7w s LEU 22 CO 0.00 0.09 -0.04 -0.04 -0.29 0.00 0.00 176.35 176.07 3m7w s MET 23 N 0.68 1.42 -0.02 1.98 -1.94 -1.26 -1.30 119.30 118.86 3m7w s MET 23 Ca 0.13 -0.68 -0.02 0.00 -1.71 0.00 0.00 55.69 53.40 3m7w s MET 23 Cb -0.13 -2.25 0.01 0.00 2.01 0.00 0.00 34.83 34.47 3m7w s MET 23 CO 0.03 -0.52 0.07 0.20 -0.01 0.00 0.00 175.02 174.79 3m7w s GLY 24 N 1.57 -0.04 0.03 -0.03 0.00 -1.26 -4.91 107.32 102.68 3m7w s GLY 24 Ca -0.02 0.16 -0.14 0.00 0.00 0.00 0.00 44.72 44.72 3m7w s GLY 24 CO -0.07 0.12 1.00 0.50 0.00 0.00 0.00 173.10 174.65 3m7w h LYS 25 N 5.95 0.49 -5.24 2.90 1.57 -1.92 -3.14 116.57 117.18 3m7w h LYS 25 Ca -0.25 -0.84 -0.55 0.00 -1.87 0.00 0.00 60.65 57.15 3m7w h LYS 25 Cb 1.21 0.31 -0.13 0.00 0.08 0.00 0.00 32.23 33.69 3m7w h LYS 25 CO 0.46 1.40 -0.57 0.95 -0.57 0.00 0.00 179.45 181.12 3m7w s THR 26 N -2.61 1.17 0.24 -0.16 -4.23 -1.26 -0.61 115.64 108.17 3m7w s THR 26 Ca -0.09 -2.00 -0.06 0.00 -1.18 0.00 0.00 61.69 58.36 3m7w s THR 26 Cb 0.05 -2.63 0.22 0.00 1.34 0.00 0.00 72.50 71.47 3m7w s THR 26 CO 0.93 0.00 1.88 -0.29 -0.54 0.00 0.00 174.62 176.60 3m7w h ILE 27 N 1.88 1.14 -0.30 2.99 6.09 -1.94 0.76 117.51 128.12 3m7w h ILE 27 Ca -0.40 -0.38 0.04 0.00 -1.37 0.00 0.00 64.86 62.75 3m7w h ILE 27 Cb 1.26 -0.07 -0.04 0.00 0.47 0.00 0.00 36.82 38.44 3m7w h ILE 27 CO 0.69 0.20 0.07 0.74 -3.07 0.00 0.00 178.15 176.78 3m7w h THR 28 N 1.11 0.87 -0.51 2.19 2.02 -1.99 0.33 112.91 116.93 3m7w h THR 28 Ca 0.36 -0.06 -0.04 0.00 0.77 0.00 0.00 66.41 67.44 3m7w h THR 28 Cb 0.02 0.67 -0.02 0.00 -1.74 0.00 0.00 68.15 67.08 3m7w h THR 28 CO -0.12 0.03 0.17 0.44 0.37 0.00 0.00 175.52 176.41 3m7w h ASP 29 N 0.19 0.73 -0.66 4.18 3.32 -1.81 -1.99 116.42 120.38 3m7w h ASP 29 Ca 0.14 -0.20 0.03 0.00 0.02 0.00 0.00 57.03 57.02 3m7w h ASP 29 Cb 0.14 -0.19 -0.04 0.00 0.22 0.00 0.00 39.33 39.46 3m7w h ASP 29 CO -0.17 0.73 0.41 0.58 -1.72 0.00 0.00 179.24 179.08 3m7w h VAL 30 N 0.68 1.09 -0.04 -1.35 2.07 -0.42 -0.92 116.25 117.37 3m7w h VAL 30 Ca 0.16 -0.28 -0.00 0.00 0.82 0.00 0.00 66.70 67.40 3m7w h VAL 30 Cb 0.26 0.21 -0.00 0.00 -1.52 0.00 0.00 31.29 30.23 3m7w h VAL 30 CO -0.01 0.15 0.01 0.11 0.02 0.00 0.00 177.57 177.85 3m7w h LYS 31 N 0.82 0.07 -0.51 1.57 1.57 -0.69 -1.13 116.57 118.27 3m7w h LYS 31 Ca 0.26 -0.02 -0.06 0.00 -1.87 0.00 0.00 60.65 58.97 3m7w h LYS 31 Cb 0.01 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 3m7w h LYS 31 CO -0.10 0.28 0.08 0.66 -0.57 0.00 0.00 179.45 179.80 3m7w h SER 32 N -0.16 0.75 -0.44 0.86 4.64 -1.25 -1.39 113.55 116.57 3m7w h SER 32 Ca 0.01 -0.15 -0.08 0.00 -0.47 0.00 0.00 61.79 61.10 3m7w h SER 32 Cb 0.24 -0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 62.12 3m7w h SER 32 CO 0.00 0.77 -0.05 -0.33 -0.87 0.00 0.00 176.83 176.34 3m7w h GLU 33 N 0.76 0.81 -0.88 4.77 4.39 -1.09 -1.06 114.58 122.27 3m7w h GLU 33 Ca 0.16 -0.28 -0.01 0.00 0.34 0.00 0.00 59.36 59.57 3m7w h GLU 33 Cb 0.35 -0.06 -0.04 0.00 -0.10 0.00 0.00 28.75 28.90 3m7w h GLU 33 CO 0.01 0.90 0.51 0.00 -1.16 0.00 0.00 179.01 179.26 3m7w h ALA 34 N 0.88 1.13 -0.63 3.43 0.00 -0.79 0.50 119.26 123.78 3m7w h ALA 34 Ca 0.12 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 3m7w h ALA 34 Cb 0.57 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 3m7w h ALA 34 CO 0.03 0.61 0.20 -0.07 0.00 0.00 0.00 179.25 180.02 3m7w h LEU 35 N 1.22 0.92 -1.12 0.00 3.38 -1.15 -2.48 115.31 116.09 3m7w h LEU 35 Ca 0.31 -0.21 -0.06 0.00 0.09 0.00 0.00 57.88 58.01 3m7w h LEU 35 Cb -0.01 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.48 3m7w h LEU 35 CO -0.06 0.88 -0.05 0.00 0.09 0.00 0.00 178.44 179.31 3m7w h ALA 36 N 1.07 1.27 0.00 1.53 0.00 -0.59 -2.93 119.26 119.61 3m7w h ALA 36 Ca 0.20 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3m7w h ALA 36 Cb 0.29 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.93 3m7w h ALA 36 CO -0.01 0.48 0.00 1.88 0.00 0.00 0.00 179.25 181.61 3m7w h TYR 37 N 0.53 0.00 -0.19 0.00 -1.99 -0.47 -3.22 116.97 111.62 3m7w h TYR 37 Ca 0.11 0.00 0.06 0.00 2.00 0.00 0.00 58.73 60.89 3m7w h TYR 37 Cb 0.41 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.14 3m7w h TYR 37 CO 0.02 0.00 0.18 0.00 -0.00 0.00 0.00 178.16 178.36 3m7w h ARG 38 N 0.00 0.00 -0.00 4.88 3.08 -1.28 -1.59 114.38 119.46 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 0.63 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.68 3m7w h ARG 38 CO 0.00 0.00 -0.09 0.39 -1.07 0.00 0.00 179.97 179.20 3m7w n GLU 39 N -4.01 0.37 -3.58 0.04 1.02 -1.22 -4.90 120.64 108.36 3m7w n GLU 39 Ca 0.02 -0.08 -0.31 0.00 -0.02 0.00 0.00 57.16 56.77 3m7w n GLU 39 Cb 0.31 -1.50 -0.04 0.00 -0.02 0.00 0.00 31.44 30.19 3m7w n GLU 39 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3m7w s ALA 40 N -2.68 3.73 -0.73 0.62 0.00 -0.60 -5.05 121.76 117.05 3m7w s ALA 40 Ca 0.23 -0.54 -0.17 0.00 0.00 0.00 0.00 51.96 51.48 3m7w s ALA 40 Cb 0.20 -2.19 0.15 0.00 0.00 0.00 0.00 23.12 21.27 3m7w s ALA 40 CO 0.51 0.55 0.78 0.34 0.00 0.00 0.00 175.76 177.94 3m7w s ASP 41 N -2.62 6.46 0.15 0.00 2.15 -1.26 -5.01 116.67 116.55 3m7w s ASP 41 Ca 0.42 -2.01 -0.01 0.00 0.43 0.00 0.00 52.55 51.38 3m7w s ASP 41 Cb -0.12 -2.28 -0.04 0.00 -0.30 0.00 0.00 42.92 40.18 3m7w s ASP 41 CO 0.25 -0.90 0.08 0.72 -0.17 0.00 0.00 175.17 175.15 3m7w s PHE 42 N 1.73 0.94 -0.17 -5.34 -0.12 -1.26 -4.80 117.98 108.95 3m7w s PHE 42 Ca 0.17 -1.27 0.09 0.00 -0.05 0.00 0.00 56.93 55.87 3m7w s PHE 42 Cb -0.17 -0.50 -0.17 0.00 -0.63 0.00 0.00 43.02 41.55 3m7w s PHE 42 CO -0.02 -0.55 -0.03 -0.25 -0.05 0.00 0.00 175.22 174.31 3m7w n ASP 43 N -0.14 1.60 -3.92 1.98 8.00 0.75 -4.98 116.55 119.83 3m7w n ASP 43 Ca -0.03 -0.04 -0.17 0.00 0.71 0.00 0.00 54.79 55.25 3m7w n ASP 43 Cb 0.64 0.45 -0.15 0.00 -0.02 0.00 0.00 41.12 42.04 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 -2.39 0.42 -0.30 0.53 1.01 -0.55 -4.10 121.20 115.82 3m7w s ILE 44 Ca -0.15 -0.14 -0.11 0.00 0.00 0.00 0.00 60.65 60.25 3m7w s ILE 44 Cb 0.06 -0.41 -0.03 0.00 0.01 0.00 0.00 42.46 42.08 3m7w s ILE 44 CO 0.58 0.16 0.18 -0.22 0.00 0.00 0.00 174.94 175.64 3m7w s LEU 45 N 0.39 4.10 -0.23 2.97 2.96 -0.65 -2.10 118.68 126.13 3m7w s LEU 45 Ca -0.05 -0.22 -0.14 0.00 -0.22 0.00 0.00 54.13 53.50 3m7w s LEU 45 Cb -0.08 -2.08 -0.04 0.00 0.50 0.00 0.00 46.19 44.48 3m7w s LEU 45 CO -0.00 -0.12 0.32 -0.70 -1.32 0.00 0.00 176.35 174.52 3m7w s GLU 46 N 1.71 4.10 -0.38 1.98 2.12 0.44 -0.67 118.70 127.99 3m7w s GLU 46 Ca 0.06 0.01 -0.20 0.00 0.36 0.00 0.00 54.97 55.20 3m7w s GLU 46 Cb -0.16 -3.57 0.01 0.00 0.26 0.00 0.00 34.13 30.66 3m7w s GLU 46 CO 0.09 -0.08 0.60 -0.46 -0.54 0.00 0.00 175.26 174.88 3m7w s TRP 47 N 1.45 3.13 -1.07 5.30 -0.00 0.59 -0.07 118.94 128.26 3m7w s TRP 47 Ca 0.14 0.15 -0.22 0.00 -0.00 0.00 0.00 56.10 56.18 3m7w s TRP 47 Cb -0.15 -3.14 0.06 0.00 -0.00 0.00 0.00 33.47 30.23 3m7w s TRP 47 CO 0.08 -0.69 1.50 1.03 -0.00 0.00 0.00 176.95 178.87 3m7w s ARG 48 N 2.65 3.67 0.46 5.86 1.81 -0.42 -1.79 118.95 131.19 3m7w s ARG 48 Ca 0.22 -1.31 0.15 0.00 -1.72 0.00 0.00 55.73 53.06 3m7w s ARG 48 Cb -0.15 -5.38 1.05 0.00 -0.45 0.00 0.00 34.95 30.02 3m7w s ARG 48 CO 0.16 -2.21 2.02 0.28 -0.68 0.00 0.00 175.30 174.87 3m7w h VAL 49 N 6.53 1.10 0.00 3.52 2.07 -0.94 -2.23 116.25 126.29 3m7w h VAL 49 Ca 0.25 -0.52 -0.00 0.00 0.82 0.00 0.00 66.70 67.24 3m7w h VAL 49 Cb 0.98 1.28 -0.00 0.00 -1.52 0.00 0.00 31.29 32.03 3m7w h VAL 49 CO 1.43 0.15 -0.01 -2.24 0.02 0.00 0.00 177.57 176.91 3m7w h ASP 50 N 0.00 0.00 1.25 0.57 2.03 -1.85 0.15 116.42 118.57 3m7w h ASP 50 Ca -0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 3m7w h ASP 50 Cb 0.27 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.77 3m7w h ASP 50 CO 0.02 0.01 0.00 0.45 -1.03 0.00 0.00 179.24 178.69 3m7w h HIS 51 N 0.00 0.00 -3.48 4.15 3.86 -1.69 -3.39 115.15 114.60 3m7w h HIS 51 Ca -0.00 0.00 -0.52 0.00 -1.16 0.00 0.00 60.37 58.69 3m7w h HIS 51 Cb 0.06 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 0.50 0.12 0.86 0.00 0.00 177.93 179.41 3m7w s PHE 52 N -3.30 3.54 0.27 2.45 5.36 0.04 -3.84 117.98 122.50 3m7w s PHE 52 Ca 0.06 1.52 0.07 0.00 -0.96 0.00 0.00 56.93 57.63 3m7w s PHE 52 Cb 0.09 -3.32 0.36 0.00 -0.34 0.00 0.00 43.02 39.82 3m7w s PHE 52 CO 0.53 -0.79 1.63 0.00 -1.46 0.00 0.00 175.22 175.13 3m7w h ALA 53 N 5.50 0.99 -2.21 11.12 0.00 -1.10 -3.36 119.26 130.18 3m7w h ALA 53 Ca -0.44 -0.50 -0.59 0.00 0.00 0.00 0.00 54.91 53.38 3m7w h ALA 53 Cb 1.21 -0.09 -0.42 0.00 0.00 0.00 0.00 17.79 18.50 3m7w h ALA 53 CO 0.74 0.69 -0.67 0.09 0.00 0.00 0.00 179.25 180.10 3m7w n ASN 54 N -3.90 3.75 0.25 0.00 3.02 -1.26 -4.87 115.26 112.25 3m7w n ASN 54 Ca -0.02 -3.49 0.15 0.00 -0.03 0.00 0.00 54.58 51.19 3m7w n ASN 54 Cb 0.57 -0.62 0.52 0.00 -0.61 0.00 0.00 39.78 39.65 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 2.91 0.11 -0.01 2.41 -1.51 -1.91 -2.67 116.25 115.58 3m7w h VAL 55 Ca 0.16 -0.75 0.00 0.00 -1.23 0.00 0.00 66.70 64.87 3m7w h VAL 55 Cb 0.62 1.68 0.00 0.00 -2.13 0.00 0.00 31.29 31.46 3m7w h VAL 55 CO 0.79 0.05 -0.02 0.35 -1.23 0.00 0.00 177.57 177.51 3m7w n THR 56 N -3.14 0.00 -3.33 7.19 -2.24 -1.26 -4.66 114.28 106.83 3m7w n THR 56 Ca 0.01 -0.20 -0.45 0.00 -2.27 0.00 0.00 64.05 61.15 3m7w n THR 56 Cb 0.38 0.32 -0.06 0.00 -2.10 0.00 0.00 70.33 68.87 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 -2.05 5.19 0.22 4.28 2.01 -1.01 -4.95 115.64 119.33 3m7w s THR 57 Ca 0.38 -1.19 -0.08 0.00 0.31 0.00 0.00 61.69 61.11 3m7w s THR 57 Cb 0.21 -4.23 0.17 0.00 0.01 0.00 0.00 72.50 68.66 3m7w s THR 57 CO 0.36 -0.72 1.72 0.00 -0.69 0.00 0.00 174.62 175.28 3m7w h ALA 58 N 8.84 0.81 -0.70 7.40 0.00 -1.85 -1.68 119.26 132.08 3m7w h ALA 58 Ca -0.29 0.12 0.01 0.00 0.00 0.00 0.00 54.91 54.75 3m7w h ALA 58 Cb 1.10 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.99 3m7w h ALA 58 CO 0.95 -0.26 0.47 1.49 0.00 0.00 0.00 179.25 181.90 3m7w h GLU 59 N 0.33 0.91 -0.08 0.00 4.81 -1.95 -1.33 114.58 117.27 3m7w h GLU 59 Ca 0.34 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.48 3m7w h GLU 59 Cb 0.49 -0.20 -0.00 0.00 0.63 0.00 0.00 28.75 29.67 3m7w h GLU 59 CO -0.39 0.60 -0.10 0.77 -0.73 0.00 0.00 179.01 179.16 3m7w h SER 60 N 0.94 0.23 -0.45 1.04 0.02 -1.63 -2.05 113.55 111.65 3m7w h SER 60 Ca 0.26 -0.51 0.04 0.00 -0.84 0.00 0.00 61.79 60.74 3m7w h SER 60 Cb -0.08 -0.06 -0.04 0.00 0.14 0.00 0.00 62.40 62.36 3m7w h SER 60 CO -0.06 0.69 0.21 0.58 -1.14 0.00 0.00 176.83 177.11 3m7w h VAL 61 N -0.23 0.94 -0.14 2.27 2.07 -1.16 -1.12 116.25 118.87 3m7w h VAL 61 Ca 0.01 -0.14 -0.11 0.00 0.82 0.00 0.00 66.70 67.28 3m7w h VAL 61 Cb 0.64 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.88 3m7w h VAL 61 CO 0.02 0.08 -0.40 -0.07 0.02 0.00 0.00 177.57 177.22 3m7w h LEU 62 N 0.42 0.32 -0.30 2.57 3.38 -1.27 -1.17 115.31 119.27 3m7w h LEU 62 Ca 0.20 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 3m7w h LEU 62 Cb 0.12 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 3m7w h LEU 62 CO -0.15 0.69 0.12 -0.08 0.09 0.00 0.00 178.44 179.11 3m7w h GLU 63 N 0.26 0.45 -0.06 1.13 4.81 -0.99 0.86 114.58 121.04 3m7w h GLU 63 Ca 0.02 -0.08 -0.00 0.00 -0.13 0.00 0.00 59.36 59.17 3m7w h GLU 63 Cb 0.82 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 30.12 3m7w h GLU 63 CO 0.07 0.47 0.04 0.00 -0.73 0.00 0.00 179.01 178.85 3m7w h ALA 64 N 0.96 0.08 -0.57 2.92 0.00 -1.01 0.26 119.26 121.91 3m7w h ALA 64 Ca 0.10 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 55.03 3m7w h ALA 64 Cb 0.19 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.90 3m7w h ALA 64 CO -0.01 -0.40 0.30 0.00 0.00 0.00 0.00 179.25 179.15 3m7w h ALA 65 N 0.97 0.74 -0.64 0.00 0.00 -1.14 -1.19 119.26 118.01 3m7w h ALA 65 Ca 0.02 0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.97 3m7w h ALA 65 Cb 0.05 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 3m7w h ALA 65 CO -0.00 -0.03 0.41 0.78 0.00 0.00 0.00 179.25 180.41 3m7w h GLY 66 N 0.58 0.91 1.00 0.00 0.00 -0.46 -1.53 103.07 103.56 3m7w h GLY 66 Ca 0.25 -0.32 -0.00 0.00 0.00 0.00 0.00 47.33 47.26 3m7w h GLY 66 CO -0.16 0.29 0.42 0.00 0.00 0.00 0.00 176.54 177.09 3m7w h ALA 67 N 1.25 0.89 0.05 3.60 0.00 -0.24 -0.77 119.26 124.05 3m7w h ALA 67 Ca 0.24 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 3m7w h ALA 67 Cb -0.04 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.47 3m7w h ALA 67 CO -0.08 0.35 -0.02 0.82 0.00 0.00 0.00 179.25 180.33 3m7w h ILE 68 N 0.95 0.99 -0.53 0.00 2.04 -0.95 -2.32 117.51 117.69 3m7w h ILE 68 Ca 0.25 -0.12 0.04 0.00 1.00 0.00 0.00 64.86 66.03 3m7w h ILE 68 Cb -0.04 1.07 -0.03 0.00 -0.74 0.00 0.00 36.82 37.09 3m7w h ILE 68 CO -0.05 0.03 0.36 0.03 0.00 0.00 0.00 178.15 178.52 3m7w h ARG 69 N -0.11 0.56 -0.35 2.37 2.47 -1.02 0.84 114.38 119.14 3m7w h ARG 69 Ca -0.01 -0.03 -0.15 0.00 -1.26 0.00 0.00 59.98 58.53 3m7w h ARG 69 Cb 0.10 -0.13 -0.01 0.00 -1.65 0.00 0.00 29.97 28.28 3m7w h ARG 69 CO 0.01 0.37 -0.39 0.93 0.56 0.00 0.00 179.97 181.46 3m7w h GLU 70 N 0.58 0.85 0.14 0.04 5.08 -0.91 -3.33 114.58 117.03 3m7w h GLU 70 Ca 0.22 -0.44 -0.20 0.00 -1.00 0.00 0.00 59.36 57.94 3m7w h GLU 70 Cb 0.15 0.01 0.02 0.00 0.50 0.00 0.00 28.75 29.43 3m7w h GLU 70 CO -0.06 1.08 -0.85 0.82 -1.00 0.00 0.00 179.01 179.01 3m7w h ILE 71 N 0.70 1.49 -3.45 3.13 2.04 -1.00 -3.41 117.51 117.00 3m7w h ILE 71 Ca 0.06 -2.50 -0.70 0.00 1.00 0.00 0.00 64.86 62.71 3m7w h ILE 71 Cb 0.96 3.12 -0.33 0.00 -0.74 0.00 0.00 36.82 39.83 3m7w h ILE 71 CO 0.09 0.71 -0.48 -0.63 0.00 0.00 0.00 178.15 177.84 3m7w s ILE 72 N -2.53 3.58 -1.31 -0.67 -1.09 0.25 -4.94 121.20 114.48 3m7w s ILE 72 Ca -0.13 -2.10 0.20 0.00 -2.23 0.00 0.00 60.65 56.40 3m7w s ILE 72 Cb 0.01 -3.41 -0.14 0.00 -1.58 0.00 0.00 42.46 37.34 3m7w s ILE 72 CO 0.84 -0.74 0.92 0.35 -1.23 0.00 0.00 174.94 175.09 3m7w n THR 73 N 4.54 0.00 -0.10 2.92 -2.24 -1.25 -4.44 114.28 113.71 3m7w n THR 73 Ca -0.02 -0.12 -0.17 0.00 -2.27 0.00 0.00 64.05 61.47 3m7w n THR 73 Cb 0.41 1.09 -0.08 0.00 -2.10 0.00 0.00 70.33 69.65 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 -0.94 1.86 -4.77 3.42 3.85 -1.26 -4.99 116.55 113.73 3m7w n ASP 74 Ca 0.06 0.47 -0.39 0.00 -0.71 0.00 0.00 54.79 54.21 3m7w n ASP 74 Cb 0.36 -0.90 -0.02 0.00 -1.35 0.00 0.00 41.12 39.21 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 -2.39 4.10 0.53 0.11 -0.14 -1.26 -4.83 119.74 115.85 3m7w s LYS 75 Ca -0.26 1.98 -0.22 0.00 -1.36 0.00 0.00 55.97 56.10 3m7w s LYS 75 Cb 0.06 -2.78 -0.05 0.00 -1.68 0.00 0.00 37.83 33.37 3m7w s LYS 75 CO 0.46 -0.33 1.38 -2.14 -0.76 0.00 0.00 175.35 173.96 3m7w s PRO 76 N -2.16 3.24 -0.21 -1.68 0.02 -1.26 -4.83 135.00 128.12 3m7w s PRO 76 Ca 0.55 2.29 -0.03 0.00 0.02 0.00 0.00 61.00 63.83 3m7w s PRO 76 Cb -0.34 -2.34 -0.00 0.00 0.02 0.00 0.00 34.50 31.84 3m7w s PRO 76 CO 0.44 -1.13 -0.07 -1.17 -0.33 0.00 0.00 177.00 174.73 3m7w s LEU 77 N -3.37 2.76 -0.23 -5.54 2.96 -1.26 -1.63 118.68 112.37 3m7w s LEU 77 Ca 0.70 -0.43 -0.09 0.00 -0.22 0.00 0.00 54.13 54.09 3m7w s LEU 77 Cb -0.41 -1.69 -0.04 0.00 0.50 0.00 0.00 46.19 44.54 3m7w s LEU 77 CO 0.50 -0.00 0.11 -0.22 -1.32 0.00 0.00 176.35 175.42 3m7w s LEU 78 N 1.37 3.86 -0.35 -0.68 2.96 0.15 -1.25 118.68 124.75 3m7w s LEU 78 Ca 0.05 0.02 -0.15 0.00 -0.22 0.00 0.00 54.13 53.82 3m7w s LEU 78 Cb -0.14 -2.02 -0.01 0.00 0.50 0.00 0.00 46.19 44.52 3m7w s LEU 78 CO -0.04 0.07 0.36 0.12 -1.32 0.00 0.00 176.35 175.54 3m7w s PHE 79 N 1.03 3.21 -0.19 5.38 5.36 -0.10 -0.30 117.98 132.37 3m7w s PHE 79 Ca 0.06 -0.10 -0.01 0.00 -0.96 0.00 0.00 56.93 55.91 3m7w s PHE 79 Cb -0.14 -2.69 0.05 0.00 -0.34 0.00 0.00 43.02 39.91 3m7w s PHE 79 CO 0.04 -0.47 -0.02 0.99 -1.46 0.00 0.00 175.22 174.30 3m7w s THR 80 N 2.00 0.97 -0.46 0.12 2.01 -0.74 -0.80 115.64 118.74 3m7w s THR 80 Ca 0.11 -0.71 -0.15 0.00 0.31 0.00 0.00 61.69 61.26 3m7w s THR 80 Cb -0.17 -1.28 0.07 0.00 0.01 0.00 0.00 72.50 71.13 3m7w s THR 80 CO 0.12 -0.03 0.38 0.12 -0.69 0.00 0.00 174.62 174.51 3m7w s PHE 81 N 1.67 3.25 -0.38 4.92 5.36 -1.26 -0.30 117.98 131.24 3m7w s PHE 81 Ca -0.01 -0.96 -0.23 0.00 -0.96 0.00 0.00 56.93 54.77 3m7w s PHE 81 Cb -0.17 -3.11 0.01 0.00 -0.34 0.00 0.00 43.02 39.42 3m7w s PHE 81 CO -0.07 -0.79 0.75 0.50 -1.46 0.00 0.00 175.22 174.15 3m7w s ARG 82 N 1.62 3.65 0.55 10.12 6.06 -1.26 -4.90 118.95 134.79 3m7w s ARG 82 Ca 0.04 0.15 -0.19 0.00 -2.50 0.00 0.00 55.73 53.23 3m7w s ARG 82 Cb -0.24 -3.84 -0.05 0.00 0.06 0.00 0.00 34.95 30.88 3m7w s ARG 82 CO 0.06 -0.89 1.13 -1.54 -2.50 0.00 0.00 175.30 171.56 3m7w s SER 83 N 1.90 5.66 0.26 -2.12 1.04 -1.26 -3.32 113.70 115.86 3m7w s SER 83 Ca 0.29 2.17 -0.01 0.00 0.48 0.00 0.00 55.95 58.89 3m7w s SER 83 Cb -0.13 -2.58 0.56 0.00 0.10 0.00 0.00 66.02 63.97 3m7w s SER 83 CO 0.18 -1.26 1.72 0.00 0.98 0.00 0.00 173.24 174.86 3m7w h ALA 84 N 1.11 1.22 0.00 5.32 0.00 -1.37 0.34 119.26 125.87 3m7w h ALA 84 Ca -0.50 0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.54 3m7w h ALA 84 Cb 1.26 0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.15 3m7w h ALA 84 CO 0.57 -0.24 0.00 1.57 0.00 0.00 0.00 179.25 181.15 3m7w h LYS 85 N 0.45 0.00 -0.26 0.00 2.10 -1.88 -0.54 116.57 116.44 3m7w h LYS 85 Ca 0.47 0.00 -0.09 0.00 -2.00 0.00 0.00 60.65 59.03 3m7w h LYS 85 Cb 0.78 0.00 -0.05 0.00 -0.90 0.00 0.00 32.23 32.06 3m7w h LYS 85 CO -0.45 0.00 -0.06 0.39 -2.00 0.00 0.00 179.45 177.33 3m7w n GLU 86 N -2.40 2.14 -0.58 0.07 1.02 0.04 -4.93 120.64 115.99 3m7w n GLU 86 Ca -0.01 -3.00 0.00 0.00 -0.02 0.00 0.00 57.16 54.13 3m7w n GLU 86 Cb 0.10 -1.78 0.00 0.00 -0.02 0.00 0.00 31.44 29.74 3m7w n GLU 86 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3m7w n GLY 87 N -0.95 0.71 1.64 0.62 0.00 -0.21 -4.76 105.19 102.23 3m7w n GLY 87 Ca 0.26 -0.03 -0.12 0.00 0.00 0.00 0.00 46.02 46.13 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 -2.58 -0.93 0.16 -0.02 0.00 1.00 -4.92 105.19 97.90 3m7w n GLY 88 Ca 0.00 -1.74 0.13 0.00 0.00 0.00 0.00 46.02 44.40 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 -2.12 0.54 -3.51 1.61 -0.58 -1.21 -4.17 120.64 111.19 3m7w n GLU 89 Ca 0.07 -0.32 -0.08 0.00 -0.42 0.00 0.00 57.16 56.40 3m7w n GLU 89 Cb 0.25 -1.49 -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 -2.68 0.78 -0.04 3.49 -2.07 -1.26 -4.93 119.66 112.95 3m7w s GLN 90 Ca 0.19 -0.26 -0.02 0.00 -1.82 0.00 0.00 55.36 53.45 3m7w s GLN 90 Cb 0.19 0.36 -0.04 0.00 -1.09 0.00 0.00 33.01 32.43 3m7w s GLN 90 CO 0.59 -0.34 0.09 0.00 -1.32 0.00 0.00 175.29 174.32 3m7w s ALA 91 N -2.94 3.64 0.10 2.60 0.00 -1.26 -1.34 121.76 122.56 3m7w s ALA 91 Ca 0.05 -0.81 0.02 0.00 0.00 0.00 0.00 51.96 51.22 3m7w s ALA 91 Cb -0.01 -1.67 -0.04 0.00 0.00 0.00 0.00 23.12 21.40 3m7w s ALA 91 CO -0.08 0.67 -0.07 -0.51 0.00 0.00 0.00 175.76 175.77 3m7w s LEU 92 N -1.52 2.49 0.74 0.00 1.43 -1.26 -4.99 118.68 115.57 3m7w s LEU 92 Ca 0.21 -0.96 -0.11 0.00 -1.03 0.00 0.00 54.13 52.23 3m7w s LEU 92 Cb -0.12 -0.11 0.04 0.00 0.03 0.00 0.00 46.19 46.03 3m7w s LEU 92 CO 0.11 -0.43 1.08 0.42 0.23 0.00 0.00 176.35 177.76 3m7w s THR 93 N -3.39 3.59 0.22 5.49 -4.23 -1.26 -4.86 115.64 111.20 3m7w s THR 93 Ca 0.10 0.52 -0.08 0.00 -1.18 0.00 0.00 61.69 61.05 3m7w s THR 93 Cb 0.04 -3.22 0.16 0.00 1.34 0.00 0.00 72.50 70.81 3m7w s THR 93 CO -0.04 -0.68 1.77 0.74 -0.54 0.00 0.00 174.62 175.88 3m7w h THR 94 N -0.91 0.83 -0.74 3.99 2.02 -1.99 -1.58 112.91 114.53 3m7w h THR 94 Ca -0.45 -0.18 -0.01 0.00 0.77 0.00 0.00 66.41 66.54 3m7w h THR 94 Cb 1.23 0.25 -0.04 0.00 -1.74 0.00 0.00 68.15 67.86 3m7w h THR 94 CO 0.57 0.10 0.43 1.23 0.37 0.00 0.00 175.52 178.22 3m7w h GLY 95 N 0.53 1.09 1.13 2.16 0.00 -1.99 -0.72 103.07 105.28 3m7w h GLY 95 Ca 0.33 -0.47 -0.11 0.00 0.00 0.00 0.00 47.33 47.07 3m7w h GLY 95 CO -0.27 0.46 -0.09 1.46 0.00 0.00 0.00 176.54 178.09 3m7w h GLN 96 N 1.02 1.02 -0.34 4.80 4.20 -1.85 -0.85 115.11 123.10 3m7w h GLN 96 Ca 0.26 -0.36 -0.04 0.00 0.06 0.00 0.00 58.65 58.57 3m7w h GLN 96 Cb -0.00 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 27.69 3m7w h GLN 96 CO -0.05 1.05 0.04 -0.92 -0.67 0.00 0.00 178.83 178.28 3m7w h TYR 97 N 0.91 0.62 -0.28 2.96 3.20 -0.98 -0.12 116.97 123.27 3m7w h TYR 97 Ca 0.14 -0.09 -0.06 0.00 3.14 0.00 0.00 58.73 61.87 3m7w h TYR 97 Cb 0.65 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.75 3m7w h TYR 97 CO 0.04 0.66 -0.04 0.82 -1.64 0.00 0.00 178.16 177.99 3m7w h ILE 98 N 0.40 1.27 -0.70 1.81 1.08 -1.11 -2.44 117.51 117.83 3m7w h ILE 98 Ca 0.10 -1.04 -0.01 0.00 -0.39 0.00 0.00 64.86 63.53 3m7w h ILE 98 Cb 0.38 1.39 -0.03 0.00 -3.07 0.00 0.00 36.82 35.49 3m7w h ILE 98 CO 0.01 0.33 0.41 0.44 -0.69 0.00 0.00 178.15 178.65 3m7w h ASP 99 N 0.29 0.85 -0.15 1.72 3.32 -1.08 -0.06 116.42 121.31 3m7w h ASP 99 Ca 0.07 -0.05 -0.00 0.00 0.02 0.00 0.00 57.03 57.07 3m7w h ASP 99 Cb 0.50 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.83 3m7w h ASP 99 CO 0.02 0.66 0.08 0.25 -1.72 0.00 0.00 179.24 178.54 3m7w h LEU 100 N 0.97 0.19 -0.92 1.55 5.85 -0.88 -1.48 115.31 120.60 3m7w h LEU 100 Ca 0.25 -0.10 -0.08 0.00 0.84 0.00 0.00 57.88 58.79 3m7w h LEU 100 Cb -0.02 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 3m7w h LEU 100 CO -0.05 0.24 -0.08 0.78 -0.34 0.00 0.00 178.44 178.99 3m7w h ASN 101 N 0.13 0.69 -0.46 1.25 2.35 -1.03 -2.11 115.58 116.40 3m7w h ASN 101 Ca 0.05 -0.19 -0.08 0.00 -0.55 0.00 0.00 56.30 55.54 3m7w h ASN 101 Cb 0.09 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.26 3m7w h ASN 101 CO -0.01 0.81 -0.00 0.03 -1.65 0.00 0.00 177.43 176.61 3m7w h ARG 102 N 0.65 0.88 -0.62 0.81 3.08 -0.82 -1.45 114.38 116.90 3m7w h ARG 102 Ca 0.12 -0.25 -0.06 0.00 0.07 0.00 0.00 59.98 59.85 3m7w h ARG 102 Cb 0.53 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.46 3m7w h ARG 102 CO 0.03 0.88 0.14 0.00 -1.07 0.00 0.00 179.97 179.95 3m7w h ALA 103 N 1.18 0.82 -0.27 0.04 0.00 -1.03 -1.34 119.26 118.66 3m7w h ALA 103 Ca 0.15 -0.24 0.01 0.00 0.00 0.00 0.00 54.91 54.83 3m7w h ALA 103 Cb 0.49 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 3m7w h ALA 103 CO 0.02 0.54 0.16 0.00 0.00 0.00 0.00 179.25 179.97 3m7w h ALA 104 N 1.04 0.34 -0.11 0.00 0.00 -1.02 -1.66 119.26 117.85 3m7w h ALA 104 Ca 0.19 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.10 3m7w h ALA 104 Cb 0.37 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 3m7w h ALA 104 CO 0.00 -0.21 0.05 0.28 0.00 0.00 0.00 179.25 179.37 3m7w h VAL 105 N 0.34 1.00 0.00 0.00 2.07 -1.06 -2.93 116.25 115.67 3m7w h VAL 105 Ca 0.10 -0.04 -0.01 0.00 0.82 0.00 0.00 66.70 67.57 3m7w h VAL 105 Cb -0.02 0.88 -0.00 0.00 -1.52 0.00 0.00 31.29 30.63 3m7w h VAL 105 CO -0.04 0.02 -0.06 -0.78 0.02 0.00 0.00 177.57 176.73 3m7w h ASP 106 N 0.11 0.00 0.47 0.57 3.58 -1.09 -3.11 116.42 116.95 3m7w h ASP 106 Ca 0.04 0.00 -0.05 0.00 0.42 0.00 0.00 57.03 57.44 3m7w h ASP 106 Cb 0.01 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.05 3m7w h ASP 106 CO -0.03 0.06 -0.24 0.77 -2.88 0.00 0.00 179.24 176.93 3m7w h SER 107 N 0.00 0.00 0.00 2.28 4.64 -1.10 -3.46 113.55 115.90 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 0.51 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 3m7w h SER 107 CO 0.01 0.24 0.00 0.61 -0.87 0.00 0.00 176.83 176.81 3m7w n GLY 108 N -0.45 0.41 0.02 -0.77 0.00 -1.18 -4.88 105.19 98.34 3m7w n GLY 108 Ca -0.01 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.11 3m7w n GLY 108 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3m7w n LEU 109 N 0.00 0.59 -4.35 0.99 4.77 -1.26 -4.94 117.00 112.80 3m7w n LEU 109 Ca 0.00 -0.11 -0.31 0.00 -0.03 0.00 0.00 56.01 55.56 3m7w n LEU 109 Cb 0.11 -0.06 -0.15 0.00 -2.33 0.00 0.00 43.42 40.99 3m7w n LEU 109 CO 0.00 0.08 -0.55 0.68 -1.33 0.00 0.00 177.39 176.26 3m7w s VAL 110 N -3.21 2.24 -0.17 4.08 -7.23 -1.26 -4.82 120.40 110.02 3m7w s VAL 110 Ca 0.03 -1.18 0.22 0.00 -1.81 0.00 0.00 61.98 59.23 3m7w s VAL 110 Cb 0.15 -1.83 -0.10 0.00 0.56 0.00 0.00 36.38 35.16 3m7w s VAL 110 CO 0.83 0.48 0.87 0.47 -0.31 0.00 0.00 175.10 177.45 3m7w n ASP 111 N 2.12 0.64 -3.72 4.85 8.00 -0.38 -4.87 116.55 123.18 3m7w n ASP 111 Ca -0.16 0.25 -0.12 0.00 0.71 0.00 0.00 54.79 55.47 3m7w n ASP 111 Cb 0.52 0.80 -0.07 0.00 -0.02 0.00 0.00 41.12 42.34 3m7w n ASP 111 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 3m7w s MET 112 N -3.34 0.84 0.08 -1.24 -1.94 -0.91 -1.90 119.30 110.90 3m7w s MET 112 Ca -0.03 -0.45 0.06 0.00 -1.71 0.00 0.00 55.69 53.56 3m7w s MET 112 Cb 0.10 0.37 -0.03 0.00 2.01 0.00 0.00 34.83 37.28 3m7w s MET 112 CO 0.82 -0.28 -0.15 0.96 -0.01 0.00 0.00 175.02 176.36 3m7w s ILE 113 N -2.49 1.24 -0.22 2.53 -4.36 -0.15 -0.93 121.20 116.83 3m7w s ILE 113 Ca -0.05 -1.41 -0.09 0.00 -0.26 0.00 0.00 60.65 58.83 3m7w s ILE 113 Cb -0.01 -1.22 -0.04 0.00 1.25 0.00 0.00 42.46 42.43 3m7w s ILE 113 CO -0.03 -0.23 0.11 -0.62 0.24 0.00 0.00 174.94 174.41 3m7w s ASP 114 N -1.89 5.85 -0.11 4.36 -1.08 0.02 -0.77 116.67 123.05 3m7w s ASP 114 Ca 0.01 0.08 0.03 0.00 -0.52 0.00 0.00 52.55 52.15 3m7w s ASP 114 Cb -0.09 -2.03 0.01 0.00 -1.46 0.00 0.00 42.92 39.34 3m7w s ASP 114 CO 0.03 0.10 -0.22 -0.76 0.52 0.00 0.00 175.17 174.84 3m7w s LEU 115 N 0.81 2.05 -0.04 -1.34 1.43 0.17 -4.58 118.68 117.17 3m7w s LEU 115 Ca 0.06 -0.55 -0.30 0.00 -1.03 0.00 0.00 54.13 52.31 3m7w s LEU 115 Cb -0.13 -1.37 -0.04 0.00 0.03 0.00 0.00 46.19 44.68 3m7w s LEU 115 CO 0.02 0.11 1.28 -1.61 0.23 0.00 0.00 176.35 176.38 3m7w s GLU 116 N 0.60 4.32 0.26 1.70 2.02 -1.26 -0.87 118.70 125.46 3m7w s GLU 116 Ca -0.13 1.78 -0.02 0.00 0.02 0.00 0.00 54.97 56.62 3m7w s GLU 116 Cb -0.17 -3.59 0.56 0.00 0.10 0.00 0.00 34.13 31.04 3m7w s GLU 116 CO 0.04 -0.52 1.67 1.25 0.02 0.00 0.00 175.26 177.71 3m7w h LEU 117 N 8.40 -0.03 -5.75 1.80 5.85 -1.13 -2.69 115.31 121.76 3m7w h LEU 117 Ca -0.35 0.17 -0.75 0.00 0.84 0.00 0.00 57.88 57.79 3m7w h LEU 117 Cb 1.16 0.24 -0.17 0.00 0.37 0.00 0.00 40.66 42.26 3m7w h LEU 117 CO 0.90 -0.10 1.85 0.49 -0.34 0.00 0.00 178.44 181.25 3m7w n PHE 118 N -5.20 2.61 -0.07 1.25 3.72 -1.26 -4.27 117.46 114.23 3m7w n PHE 118 Ca 0.17 -2.68 -0.07 0.00 -0.05 0.00 0.00 57.45 54.81 3m7w n PHE 118 Cb 0.55 -1.60 -0.12 0.00 -0.94 0.00 0.00 39.48 37.37 3m7w n PHE 118 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 3m7w n THR 119 N 1.07 1.02 0.00 4.37 -1.04 -1.02 -5.08 114.28 113.61 3m7w n THR 119 Ca 0.57 -0.64 0.00 0.00 -2.04 0.00 0.00 64.05 61.94 3m7w n THR 119 Cb 0.27 -0.58 0.00 0.00 -1.82 0.00 0.00 70.33 68.19 3m7w n THR 119 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3m7w n GLY 120 N 2.05 3.48 0.26 3.41 0.00 -1.26 -4.91 105.19 108.22 3m7w n GLY 120 Ca -0.24 -0.58 0.02 0.00 0.00 0.00 0.00 46.02 45.22 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 0.30 -0.29 1.61 5.19 -1.98 0.15 116.42 121.41 3m7w h ASP 121 Ca 0.00 0.08 -0.02 0.00 -0.62 0.00 0.00 57.03 56.48 3m7w h ASP 121 Cb 0.00 0.05 -0.01 0.00 0.18 0.00 0.00 39.33 39.54 3m7w h ASP 121 CO 0.00 0.16 0.11 0.44 -3.12 0.00 0.00 179.24 176.83 3m7w h ASP 122 N 0.47 0.40 -0.57 6.45 3.32 -1.99 -1.05 116.42 123.44 3m7w h ASP 122 Ca 0.35 -0.17 -0.06 0.00 0.02 0.00 0.00 57.03 57.17 3m7w h ASP 122 Cb 0.45 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.88 3m7w h ASP 122 CO -0.33 0.46 0.11 -0.33 -1.72 0.00 0.00 179.24 177.43 3m7w h GLU 123 N 0.32 0.93 0.11 3.56 3.07 -1.75 -1.76 114.58 119.05 3m7w h GLU 123 Ca 0.10 -0.24 -0.01 0.00 -0.50 0.00 0.00 59.36 58.71 3m7w h GLU 123 Cb 0.18 -0.11 0.00 0.00 -0.84 0.00 0.00 28.75 27.98 3m7w h GLU 123 CO -0.01 0.88 -0.05 0.28 -1.40 0.00 0.00 179.01 178.71 3m7w h VAL 124 N 0.83 1.00 -0.34 3.13 2.07 -0.58 -0.59 116.25 121.77 3m7w h VAL 124 Ca 0.17 -0.39 0.04 0.00 0.82 0.00 0.00 66.70 67.34 3m7w h VAL 124 Cb 0.39 1.24 -0.04 0.00 -1.52 0.00 0.00 31.29 31.37 3m7w h VAL 124 CO 0.01 0.09 0.13 0.11 0.02 0.00 0.00 177.57 177.93 3m7w h LYS 125 N -0.32 0.27 -0.89 1.57 1.57 -1.19 0.25 116.57 117.83 3m7w h LYS 125 Ca -0.01 -0.02 0.02 0.00 -1.87 0.00 0.00 60.65 58.77 3m7w h LYS 125 Cb 0.26 -0.06 -0.05 0.00 0.08 0.00 0.00 32.23 32.47 3m7w h LYS 125 CO 0.02 0.18 0.58 0.00 -0.57 0.00 0.00 179.45 179.66 3m7w h ALA 126 N 1.21 1.14 0.00 3.86 0.00 -1.24 -0.54 119.26 123.70 3m7w h ALA 126 Ca 0.15 -0.05 -0.21 0.00 0.00 0.00 0.00 54.91 54.80 3m7w h ALA 126 Cb 0.11 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 3m7w h ALA 126 CO -0.15 0.49 -0.90 1.15 0.00 0.00 0.00 179.25 179.85 3m7w h THR 127 N 1.17 1.47 -0.66 0.00 2.02 -0.60 -1.51 112.91 114.80 3m7w h THR 127 Ca 0.34 -2.58 -0.03 0.00 0.77 0.00 0.00 66.41 64.90 3m7w h THR 127 Cb -0.09 2.46 -0.03 0.00 -1.74 0.00 0.00 68.15 68.75 3m7w h THR 127 CO -0.09 0.76 0.28 0.58 0.37 0.00 0.00 175.52 177.42 3m7w h VAL 128 N 0.14 1.24 -0.72 3.16 2.07 -0.13 -0.76 116.25 121.25 3m7w h VAL 128 Ca -0.05 -0.72 -0.06 0.00 0.82 0.00 0.00 66.70 66.68 3m7w h VAL 128 Cb 1.53 0.47 -0.03 0.00 -1.52 0.00 0.00 31.29 31.74 3m7w h VAL 128 CO 0.14 0.29 0.20 1.23 0.02 0.00 0.00 177.57 179.45 3m7w h GLY 129 N 0.93 1.21 0.93 2.17 0.00 -1.02 -1.67 103.07 105.63 3m7w h GLY 129 Ca 0.22 -0.74 -0.06 0.00 0.00 0.00 0.00 47.33 46.76 3m7w h GLY 129 CO -0.02 0.69 0.01 -1.82 0.00 0.00 0.00 176.54 175.39 3m7w h TYR 130 N 1.07 0.71 -0.28 5.60 3.20 -0.97 -1.52 116.97 124.78 3m7w h TYR 130 Ca 0.23 -0.12 0.01 0.00 3.14 0.00 0.00 58.73 61.99 3m7w h TYR 130 Cb 0.34 -0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.40 3m7w h TYR 130 CO 0.03 0.74 0.15 0.00 -1.64 0.00 0.00 178.16 177.44 3m7w h ALA 131 N 0.87 0.34 -0.32 1.82 0.00 -1.01 -2.62 119.26 118.35 3m7w h ALA 131 Ca 0.11 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 3m7w h ALA 131 Cb 0.46 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 3m7w h ALA 131 CO 0.02 -0.23 0.17 0.45 0.00 0.00 0.00 179.25 179.66 3m7w h HIS 132 N 0.32 0.42 0.00 0.00 3.86 -1.12 0.22 115.15 118.85 3m7w h HIS 132 Ca 0.11 -0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.32 3m7w h HIS 132 Cb 0.01 -0.14 0.00 0.00 1.06 0.00 0.00 27.41 28.34 3m7w h HIS 132 CO -0.08 0.30 0.00 1.96 0.86 0.00 0.00 177.93 180.97 3m7w h GLN 133 N 0.44 0.00 -0.19 2.45 4.20 -0.90 -2.84 115.11 118.27 3m7w h GLN 133 Ca 0.12 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.83 3m7w h GLN 133 Cb 0.03 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.81 3m7w h GLN 133 CO -0.02 0.00 0.00 0.72 -0.67 0.00 0.00 178.83 178.86 3m7w n HIS 134 N -2.43 0.52 -3.48 2.96 8.25 -0.55 -4.99 115.22 115.51 3m7w n HIS 134 Ca 0.02 -0.79 -0.21 0.00 -0.26 0.00 0.00 57.72 56.48 3m7w n HIS 134 Cb 0.26 -0.19 0.07 0.00 1.12 0.00 0.00 29.99 31.25 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 -0.52 -5.60 -4.24 0.41 5.15 -0.91 -5.01 115.26 104.53 3m7w n ASN 135 Ca 0.16 -0.50 -0.33 0.00 -0.60 0.00 0.00 54.58 53.31 3m7w n ASN 135 Cb 0.67 -4.62 -0.16 0.00 -0.53 0.00 0.00 39.78 35.14 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 -3.29 2.40 0.53 3.44 1.01 -0.04 -4.94 120.40 119.50 3m7w s VAL 136 Ca 0.48 -0.87 -0.14 0.00 0.00 0.00 0.00 61.98 61.45 3m7w s VAL 136 Cb -0.21 -1.98 -0.06 0.00 0.00 0.00 0.00 36.38 34.13 3m7w s VAL 136 CO 0.66 0.54 0.97 0.00 0.00 0.00 0.00 175.10 177.27 3m7w s ALA 137 N 0.64 3.12 -0.13 5.51 0.00 -0.80 -3.47 121.76 126.63 3m7w s ALA 137 Ca -0.10 0.04 0.02 0.00 0.00 0.00 0.00 51.96 51.92 3m7w s ALA 137 Cb -0.16 -3.05 0.01 0.00 0.00 0.00 0.00 23.12 19.92 3m7w s ALA 137 CO 0.02 -0.35 -0.20 0.08 0.00 0.00 0.00 175.76 175.32 3m7w s VAL 138 N -2.76 1.90 -0.19 0.00 1.01 -1.26 -0.98 120.40 118.12 3m7w s VAL 138 Ca 0.57 -0.88 -0.14 0.00 0.00 0.00 0.00 61.98 61.52 3m7w s VAL 138 Cb -0.10 -1.69 -0.04 0.00 0.00 0.00 0.00 36.38 34.55 3m7w s VAL 138 CO 0.38 0.52 0.30 -0.63 0.00 0.00 0.00 175.10 175.68 3m7w s ILE 139 N 0.85 5.28 -0.17 2.22 1.01 0.05 -1.04 121.20 129.39 3m7w s ILE 139 Ca -0.07 0.54 -0.03 0.00 0.00 0.00 0.00 60.65 61.08 3m7w s ILE 139 Cb -0.15 -3.64 -0.02 0.00 0.01 0.00 0.00 42.46 38.65 3m7w s ILE 139 CO -0.01 0.33 -0.05 -0.32 0.00 0.00 0.00 174.94 174.89 3m7w s MET 140 N 0.86 3.57 0.27 2.79 1.75 -0.83 -0.66 119.30 127.06 3m7w s MET 140 Ca 0.16 -0.56 0.08 0.00 -1.25 0.00 0.00 55.69 54.12 3m7w s MET 140 Cb -0.14 -2.91 -0.05 0.00 2.84 0.00 0.00 34.83 34.57 3m7w s MET 140 CO 0.05 0.13 -0.11 -1.54 -0.65 0.00 0.00 175.02 172.90 3m7w s SER 141 N 0.65 3.04 -0.17 1.11 1.04 -0.05 -0.23 113.70 119.08 3m7w s SER 141 Ca -0.03 -1.12 -0.12 0.00 0.48 0.00 0.00 55.95 55.17 3m7w s SER 141 Cb -0.15 -0.22 0.05 0.00 0.10 0.00 0.00 66.02 65.81 3m7w s SER 141 CO 0.02 -0.20 0.43 0.21 0.98 0.00 0.00 173.24 174.68 3m7w s ASN 142 N -3.45 -0.50 0.04 7.02 3.04 -0.87 -0.52 114.94 119.70 3m7w s ASN 142 Ca 0.28 0.91 0.06 0.00 0.04 0.00 0.00 52.86 54.15 3m7w s ASN 142 Cb 0.01 0.84 -0.02 0.00 -1.54 0.00 0.00 41.25 40.53 3m7w s ASN 142 CO 0.12 -0.18 -0.18 -1.00 -3.04 0.00 0.00 177.10 172.82 3m7w s HIS 143 N 0.92 1.61 -0.19 0.43 3.76 -1.26 -1.62 115.29 118.94 3m7w s HIS 143 Ca -0.06 -0.37 -0.05 0.00 -0.15 0.00 0.00 55.06 54.44 3m7w s HIS 143 Cb -0.06 -0.96 0.07 0.00 1.11 0.00 0.00 32.58 32.74 3m7w s HIS 143 CO -0.07 0.08 0.10 0.34 -0.85 0.00 0.00 174.74 174.33 3m7w s ASP 144 N -1.17 2.57 0.00 1.40 -1.08 -0.33 -4.94 116.67 113.11 3m7w s ASP 144 Ca 0.05 -0.74 0.21 0.00 -0.52 0.00 0.00 52.55 51.56 3m7w s ASP 144 Cb -0.08 -0.27 0.78 0.00 -1.46 0.00 0.00 42.92 41.89 3m7w s ASP 144 CO 0.02 -0.37 1.57 0.49 0.52 0.00 0.00 175.17 177.40 3m7w n PHE 145 N 5.27 0.19 0.00 -5.34 3.72 -1.26 -1.08 117.46 118.96 3m7w n PHE 145 Ca -0.07 -0.09 0.00 0.00 -0.05 0.00 0.00 57.45 57.24 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 0.26 0.00 -3.96 1.38 8.25 -1.26 -4.82 115.22 115.06 3m7w n HIS 146 Ca 0.16 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.53 3m7w n HIS 146 Cb 0.32 0.00 -0.04 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 -1.89 1.72 -0.24 -0.41 -2.85 -1.22 -4.65 119.74 110.20 3m7w s LYS 147 Ca 0.00 -1.30 0.00 0.00 -1.00 0.00 0.00 55.97 53.68 3m7w s LYS 147 Cb 0.00 0.51 0.04 0.00 -2.06 0.00 0.00 37.83 36.32 3m7w s LYS 147 CO 0.00 -0.74 -0.11 0.99 0.10 0.00 0.00 175.35 175.59 3m7w s THR 148 N -3.67 2.45 0.93 3.79 2.01 -0.98 -2.63 115.64 117.53 3m7w s THR 148 Ca 0.21 -1.20 -0.11 0.00 0.31 0.00 0.00 61.69 60.89 3m7w s THR 148 Cb -0.02 -2.25 0.15 0.00 0.01 0.00 0.00 72.50 70.38 3m7w s THR 148 CO 0.10 0.21 1.09 -2.84 -0.69 0.00 0.00 174.62 172.50 3m7w s PRO 149 N 1.25 0.99 0.63 4.92 0.02 -1.26 -4.96 135.00 136.58 3m7w s PRO 149 Ca -0.01 0.92 -0.18 0.00 0.02 0.00 0.00 61.00 61.75 3m7w s PRO 149 Cb -0.17 -1.77 -0.04 0.00 0.02 0.00 0.00 34.50 32.55 3m7w s PRO 149 CO -0.07 -2.45 1.01 0.00 -0.33 0.00 0.00 177.00 175.16 3m7w n ALA 150 N -4.04 0.29 -0.28 -1.55 0.00 -1.26 -4.70 120.51 108.96 3m7w n ALA 150 Ca 0.07 -0.02 0.07 0.00 0.00 0.00 0.00 53.44 53.57 3m7w n ALA 150 Cb 0.55 -2.14 0.22 0.00 0.00 0.00 0.00 19.45 18.08 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 0.38 1.22 -0.67 0.00 0.00 -1.93 -0.81 119.26 117.46 3m7w h ALA 151 Ca -0.49 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 3m7w h ALA 151 Cb 1.36 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 19.17 3m7w h ALA 151 CO 0.51 -0.18 0.38 1.05 0.00 0.00 0.00 179.25 181.00 3m7w h GLU 152 N 0.52 0.92 -0.28 0.00 4.11 -1.96 -0.71 114.58 117.18 3m7w h GLU 152 Ca 0.46 -0.09 -0.19 0.00 0.07 0.00 0.00 59.36 59.61 3m7w h GLU 152 Cb 0.71 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.78 3m7w h GLU 152 CO -0.41 0.67 -0.57 1.49 0.07 0.00 0.00 179.01 180.26 3m7w h GLU 153 N 0.93 0.87 -0.41 1.06 4.81 -1.52 -0.97 114.58 119.35 3m7w h GLU 153 Ca 0.24 -0.57 0.02 0.00 -0.13 0.00 0.00 59.36 58.92 3m7w h GLU 153 Cb 0.01 0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.44 3m7w h GLU 153 CO -0.04 1.20 0.24 0.82 -0.73 0.00 0.00 179.01 180.51 3m7w h ILE 154 N 0.66 1.05 -0.57 2.32 2.04 -0.73 -1.67 117.51 120.61 3m7w h ILE 154 Ca 0.01 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 65.70 3m7w h ILE 154 Cb 1.18 0.51 -0.03 0.00 -0.74 0.00 0.00 36.82 37.75 3m7w h ILE 154 CO 0.13 0.09 0.38 0.58 0.00 0.00 0.00 178.15 179.32 3m7w h VAL 155 N 0.49 1.15 -0.86 1.67 2.07 -1.05 -1.25 116.25 118.48 3m7w h VAL 155 Ca 0.16 -0.28 0.04 0.00 0.82 0.00 0.00 66.70 67.44 3m7w h VAL 155 Cb -0.00 0.31 -0.05 0.00 -1.52 0.00 0.00 31.29 30.03 3m7w h VAL 155 CO -0.07 0.15 0.55 -0.61 0.02 0.00 0.00 177.57 177.60 3m7w h GLN 156 N 0.78 1.03 -0.24 1.57 4.15 -0.73 0.12 115.11 121.79 3m7w h GLN 156 Ca 0.21 -0.06 -0.02 0.00 0.77 0.00 0.00 58.65 59.55 3m7w h GLN 156 Cb -0.08 -0.23 -0.01 0.00 0.21 0.00 0.00 27.48 27.36 3m7w h GLN 156 CO -0.04 0.68 0.07 0.00 -1.93 0.00 0.00 178.83 177.60 3m7w h ARG 157 N 1.06 0.37 -0.80 1.69 3.08 -0.78 -0.46 114.38 118.53 3m7w h ARG 157 Ca 0.35 -0.08 -0.00 0.00 0.07 0.00 0.00 59.98 60.31 3m7w h ARG 157 Cb 0.03 -0.05 -0.04 0.00 0.08 0.00 0.00 29.97 29.99 3m7w h ARG 157 CO -0.12 0.46 0.49 -0.07 -1.07 0.00 0.00 179.97 179.66 3m7w h LEU 158 N 0.21 0.96 -0.79 3.04 3.38 -0.71 -0.66 115.31 120.74 3m7w h LEU 158 Ca 0.08 -0.06 -0.08 0.00 0.09 0.00 0.00 57.88 57.90 3m7w h LEU 158 Cb 0.25 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 3m7w h LEU 158 CO -0.00 0.73 0.00 0.03 0.09 0.00 0.00 178.44 179.30 3m7w h ARG 159 N 1.10 0.91 -0.62 1.13 3.08 -0.60 -2.52 114.38 116.87 3m7w h ARG 159 Ca 0.29 -0.27 -0.07 0.00 0.07 0.00 0.00 59.98 60.00 3m7w h ARG 159 Cb -0.06 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 29.87 3m7w h ARG 159 CO -0.06 0.91 0.11 -0.22 -1.07 0.00 0.00 179.97 179.64 3m7w h LYS 160 N 0.85 1.00 -0.79 0.04 3.64 -0.26 -1.04 116.57 119.99 3m7w h LYS 160 Ca 0.16 -0.25 0.03 0.00 -1.27 0.00 0.00 60.65 59.32 3m7w h LYS 160 Cb 0.50 -0.13 -0.05 0.00 -0.41 0.00 0.00 32.23 32.14 3m7w h LYS 160 CO 0.02 0.92 0.51 0.52 -2.27 0.00 0.00 179.45 179.15 3m7w h MET 161 N 0.94 0.98 -0.66 1.90 2.86 -0.88 -0.03 114.93 120.04 3m7w h MET 161 Ca 0.19 -0.06 -0.02 0.00 -2.06 0.00 0.00 59.70 57.75 3m7w h MET 161 Cb 0.40 -0.22 -0.03 0.00 0.06 0.00 0.00 31.60 31.81 3m7w h MET 161 CO 0.01 0.65 0.33 1.96 1.06 0.00 0.00 176.91 180.91 3m7w h GLN 162 N 1.01 0.94 -0.45 1.72 4.20 -1.03 -1.46 115.11 120.04 3m7w h GLN 162 Ca 0.31 -0.13 -0.01 0.00 0.06 0.00 0.00 58.65 58.88 3m7w h GLN 162 Cb -0.02 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 27.57 3m7w h GLN 162 CO -0.10 0.73 0.24 0.93 -0.67 0.00 0.00 178.83 179.96 3m7w h GLU 163 N 0.90 0.62 -0.00 1.46 5.08 -0.40 -2.02 114.58 120.21 3m7w h GLU 163 Ca 0.23 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 3m7w h GLU 163 Cb 0.10 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.22 3m7w h GLU 163 CO -0.03 0.46 -0.00 1.28 -1.00 0.00 0.00 179.01 179.72 3m7w n LEU 164 N -4.42 0.21 0.00 1.33 4.77 -0.10 -4.92 117.00 113.88 3m7w n LEU 164 Ca 0.04 -0.07 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 3m7w n LEU 164 Cb 0.10 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 3m7w n LEU 164 CO 0.36 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 177.07 3m7w n GLY 165 N 1.03 0.82 3.76 -0.72 0.00 -0.76 -4.66 105.19 104.66 3m7w n GLY 165 Ca 0.23 -0.15 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 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 -1.04 2.39 0.05 4.61 0.00 -0.58 -4.88 120.51 121.05 3m7w n ALA 166 Ca 0.00 0.35 -0.17 0.00 0.00 0.00 0.00 53.44 53.62 3m7w n ALA 166 Cb 0.00 -2.43 -0.08 0.00 0.00 0.00 0.00 19.45 16.95 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 3.67 0.76 -3.01 0.00 3.32 -1.43 -3.43 116.42 116.30 3m7w h ASP 167 Ca -0.49 -0.60 -0.54 0.00 0.02 0.00 0.00 57.03 55.42 3m7w h ASP 167 Cb 1.24 -0.23 -0.40 0.00 0.22 0.00 0.00 39.33 40.16 3m7w h ASP 167 CO 0.70 1.40 -0.77 -0.63 -1.72 0.00 0.00 179.24 178.22 3m7w s ILE 168 N -3.33 0.33 0.52 0.35 1.01 -0.79 -4.24 121.20 115.05 3m7w s ILE 168 Ca -0.08 -0.89 -0.22 0.00 0.00 0.00 0.00 60.65 59.46 3m7w s ILE 168 Cb 0.08 -1.18 -0.05 0.00 0.01 0.00 0.00 42.46 41.31 3m7w s ILE 168 CO 0.90 -0.60 1.27 -2.84 0.00 0.00 0.00 174.94 173.68 3m7w s PRO 169 N 1.91 3.32 -0.04 2.79 0.02 -1.23 -1.96 135.00 139.82 3m7w s PRO 169 Ca 0.07 2.03 -0.01 0.00 0.02 0.00 0.00 61.00 63.10 3m7w s PRO 169 Cb -0.17 -2.26 0.03 0.00 0.02 0.00 0.00 34.50 32.12 3m7w s PRO 169 CO -0.26 -0.98 0.08 0.21 -0.33 0.00 0.00 177.00 175.72 3m7w s LYS 170 N -2.89 0.02 -0.02 5.54 2.20 0.68 -0.81 119.74 124.46 3m7w s LYS 170 Ca 0.70 0.26 0.00 0.00 -0.36 0.00 0.00 55.97 56.57 3m7w s LYS 170 Cb -0.35 -0.20 0.02 0.00 -1.51 0.00 0.00 37.83 35.79 3m7w s LYS 170 CO 0.41 -0.16 0.00 -1.50 -0.36 0.00 0.00 175.35 173.75 3m7w s ILE 171 N 1.03 0.10 -0.12 5.43 2.07 -0.51 -2.06 121.20 127.15 3m7w s ILE 171 Ca -0.08 0.06 0.01 0.00 -1.41 0.00 0.00 60.65 59.22 3m7w s ILE 171 Cb -0.11 -0.16 0.02 0.00 0.13 0.00 0.00 42.46 42.33 3m7w s ILE 171 CO -0.04 0.09 -0.13 0.00 -1.91 0.00 0.00 174.94 172.95 3m7w s ALA 172 N 0.63 1.60 0.20 1.50 0.00 -0.64 -1.33 121.76 123.72 3m7w s ALA 172 Ca -0.06 -0.70 0.06 0.00 0.00 0.00 0.00 51.96 51.26 3m7w s ALA 172 Cb -0.09 -0.90 -0.05 0.00 0.00 0.00 0.00 23.12 22.09 3m7w s ALA 172 CO -0.01 -0.24 -0.09 0.14 0.00 0.00 0.00 175.76 175.55 3m7w s VAL 173 N 1.31 1.43 -0.20 0.00 -7.23 -0.50 -1.19 120.40 114.01 3m7w s VAL 173 Ca -0.01 -2.12 -0.05 0.00 -1.81 0.00 0.00 61.98 57.99 3m7w s VAL 173 Cb -0.14 -2.10 -0.03 0.00 0.56 0.00 0.00 36.38 34.68 3m7w s VAL 173 CO -0.06 -0.55 0.01 -0.32 -0.31 0.00 0.00 175.10 173.88 3m7w s MET 174 N -3.73 3.65 0.05 4.82 1.75 -0.24 -0.26 119.30 125.34 3m7w s MET 174 Ca 0.23 -0.50 -0.30 0.00 -1.25 0.00 0.00 55.69 53.86 3m7w s MET 174 Cb 0.02 -3.11 -0.04 0.00 2.84 0.00 0.00 34.83 34.53 3m7w s MET 174 CO 0.06 0.01 1.05 -1.25 -0.65 0.00 0.00 175.02 174.25 3m7w s PRO 175 N 1.01 4.54 0.15 4.11 0.04 -1.26 -2.33 135.00 141.26 3m7w s PRO 175 Ca 0.02 1.55 0.18 0.00 0.04 0.00 0.00 61.00 62.80 3m7w s PRO 175 Cb -0.14 -3.40 -0.05 0.00 0.04 0.00 0.00 34.50 30.94 3m7w s PRO 175 CO 0.02 -0.07 1.00 1.96 0.04 0.00 0.00 177.00 179.95 3m7w h GLN 176 N 6.51 0.00 -4.63 4.56 4.20 -1.94 -3.48 115.11 120.32 3m7w h GLN 176 Ca -0.42 0.00 -0.26 0.00 0.06 0.00 0.00 58.65 58.04 3m7w h GLN 176 Cb 1.22 0.00 -0.15 0.00 0.30 0.00 0.00 27.48 28.85 3m7w h GLN 176 CO 0.76 0.22 -0.62 0.95 -0.67 0.00 0.00 178.83 179.47 3m7w s THR 177 N -3.06 0.12 0.27 -0.54 -4.23 -1.26 -5.05 115.64 101.89 3m7w s THR 177 Ca -0.01 -1.99 -0.00 0.00 -1.18 0.00 0.00 61.69 58.50 3m7w s THR 177 Cb 0.09 -2.48 0.09 0.00 1.34 0.00 0.00 72.50 71.53 3m7w s THR 177 CO 0.79 -0.05 1.74 0.11 -0.54 0.00 0.00 174.62 176.67 3m7w h LYS 178 N 2.60 0.67 -0.08 3.99 1.57 -1.95 -2.51 116.57 120.86 3m7w h LYS 178 Ca -0.36 -0.21 0.02 0.00 -1.87 0.00 0.00 60.65 58.23 3m7w h LYS 178 Cb 1.24 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 33.49 3m7w h LYS 178 CO 0.55 0.77 0.06 0.00 -0.57 0.00 0.00 179.45 180.25 3m7w h ALA 179 N 1.26 2.05 -0.18 3.86 0.00 -2.00 -1.67 119.26 122.58 3m7w h ALA 179 Ca 0.11 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 3m7w h ALA 179 Cb 0.56 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 3m7w h ALA 179 CO 0.03 -0.10 -0.14 -0.44 0.00 0.00 0.00 179.25 178.61 3m7w h ASP 180 N 0.00 0.28 -0.68 0.00 3.32 -1.86 -1.35 116.42 116.13 3m7w h ASP 180 Ca 0.04 -0.06 -0.06 0.00 0.02 0.00 0.00 57.03 56.96 3m7w h ASP 180 Cb 0.15 -0.08 -0.03 0.00 0.22 0.00 0.00 39.33 39.60 3m7w h ASP 180 CO -0.00 0.45 0.19 0.58 -1.72 0.00 0.00 179.24 178.74 3m7w h VAL 181 N 0.28 1.26 -0.01 -1.35 2.07 -1.37 -2.03 116.25 115.11 3m7w h VAL 181 Ca 0.06 -0.92 -0.12 0.00 0.82 0.00 0.00 66.70 66.54 3m7w h VAL 181 Cb 0.42 0.55 -0.02 0.00 -1.52 0.00 0.00 31.29 30.73 3m7w h VAL 181 CO 0.03 0.35 -0.55 -0.07 0.02 0.00 0.00 177.57 177.35 3m7w h LEU 182 N 1.01 0.02 -0.62 2.57 3.38 -1.32 -2.35 115.31 118.01 3m7w h LEU 182 Ca 0.22 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.12 3m7w h LEU 182 Cb 0.34 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.05 3m7w h LEU 182 CO -0.00 0.57 0.18 0.74 0.09 0.00 0.00 178.44 180.02 3m7w h THR 183 N 0.02 1.25 -0.52 0.22 2.02 -0.90 0.10 112.91 115.10 3m7w h THR 183 Ca -0.00 -0.86 -0.03 0.00 0.77 0.00 0.00 66.41 66.28 3m7w h THR 183 Cb 0.98 0.63 -0.02 0.00 -1.74 0.00 0.00 68.15 68.00 3m7w h THR 183 CO 0.07 0.33 0.19 0.25 0.37 0.00 0.00 175.52 176.73 3m7w h LEU 184 N 0.89 0.74 -0.79 2.58 7.12 -0.97 -1.78 115.31 123.10 3m7w h LEU 184 Ca 0.20 -0.19 -0.09 0.00 0.13 0.00 0.00 57.88 57.94 3m7w h LEU 184 Cb 0.31 -0.19 -0.02 0.00 -0.53 0.00 0.00 40.66 40.23 3m7w h LEU 184 CO -0.00 0.72 -0.03 -0.07 -0.13 0.00 0.00 178.44 178.93 3m7w h LEU 185 N 0.71 0.86 -0.61 2.25 3.38 -1.28 -1.31 115.31 119.31 3m7w h LEU 185 Ca 0.17 -0.24 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 3m7w h LEU 185 Cb 0.23 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 3m7w h LEU 185 CO -0.01 0.94 0.38 0.74 0.09 0.00 0.00 178.44 180.58 3m7w h THR 186 N 0.81 1.17 -0.38 0.22 2.02 -0.45 -1.34 112.91 114.96 3m7w h THR 186 Ca 0.15 -0.36 -0.10 0.00 0.77 0.00 0.00 66.41 66.87 3m7w h THR 186 Cb 0.53 0.32 -0.02 0.00 -1.74 0.00 0.00 68.15 67.24 3m7w h THR 186 CO 0.03 0.17 -0.16 0.00 0.37 0.00 0.00 175.52 175.93 3m7w h ALA 187 N 1.20 1.00 0.18 6.16 0.00 -1.10 -0.53 119.26 126.16 3m7w h ALA 187 Ca 0.22 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 3m7w h ALA 187 Cb -0.04 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.59 3m7w h ALA 187 CO -0.04 0.59 -0.09 1.15 0.00 0.00 0.00 179.25 180.87 3m7w h THR 188 N 0.63 0.86 -0.23 0.00 2.02 -0.90 0.16 112.91 115.45 3m7w h THR 188 Ca 0.10 -0.18 0.03 0.00 0.77 0.00 0.00 66.41 67.14 3m7w h THR 188 Cb 0.63 0.97 -0.03 0.00 -1.74 0.00 0.00 68.15 67.98 3m7w h THR 188 CO 0.04 0.04 0.03 0.58 0.37 0.00 0.00 175.52 176.59 3m7w h VAL 189 N -0.32 0.87 -0.51 3.16 2.07 -1.14 0.31 116.25 120.69 3m7w h VAL 189 Ca -0.02 -0.04 -0.00 0.00 0.82 0.00 0.00 66.70 67.45 3m7w h VAL 189 Cb 0.25 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 30.75 3m7w h VAL 189 CO 0.04 0.02 0.31 -0.33 0.02 0.00 0.00 177.57 177.64 3m7w h GLU 190 N 0.11 0.69 -0.27 1.57 5.08 -0.96 -0.25 114.58 120.56 3m7w h GLU 190 Ca 0.11 -0.06 -0.03 0.00 -1.00 0.00 0.00 59.36 58.38 3m7w h GLU 190 Cb 0.12 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 3m7w h GLU 190 CO -0.16 0.50 0.06 1.98 -1.00 0.00 0.00 179.01 180.39 3m7w h MET 191 N 0.69 0.43 -0.46 2.33 4.05 -0.76 -0.41 114.93 120.80 3m7w h MET 191 Ca 0.18 -0.11 -0.08 0.00 -0.28 0.00 0.00 59.70 59.42 3m7w h MET 191 Cb -0.02 -0.06 -0.02 0.00 -0.80 0.00 0.00 31.60 30.71 3m7w h MET 191 CO -0.04 0.53 -0.04 0.37 0.23 0.00 0.00 176.91 177.97 3m7w h GLN 192 N 0.26 0.84 -0.00 0.39 -0.00 -0.80 0.40 115.11 116.19 3m7w h GLN 192 Ca 0.08 -0.28 -0.25 0.00 -0.00 0.00 0.00 58.65 58.20 3m7w h GLN 192 Cb 0.29 -0.07 0.01 0.00 0.00 0.00 0.00 27.48 27.72 3m7w h GLN 192 CO 0.00 0.91 -0.99 0.93 0.00 0.00 0.00 178.83 179.67 3m7w h GLU 193 N 0.68 0.59 0.00 1.69 5.08 -1.03 -3.37 114.58 118.23 3m7w h GLU 193 Ca 0.13 -0.63 -0.38 0.00 -1.00 0.00 0.00 59.36 57.48 3m7w h GLU 193 Cb 0.55 0.18 -0.07 0.00 0.50 0.00 0.00 28.75 29.91 3m7w h GLU 193 CO 0.03 1.24 -2.43 0.54 -1.00 0.00 0.00 179.01 177.39 3m7w n ARG 194 N -3.81 0.67 0.00 2.33 1.74 -0.17 -4.86 116.66 112.56 3m7w n ARG 194 Ca -0.09 0.10 0.00 0.00 -0.77 0.00 0.00 57.85 57.09 3m7w n ARG 194 Cb 0.86 -1.51 0.00 0.00 -1.02 0.00 0.00 32.46 30.79 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 -3.08 0.00 -2.29 -1.55 4.01 -0.68 -5.05 117.16 108.52 3m7w n TYR 195 Ca -0.41 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 56.91 3m7w n TYR 195 Cb 1.04 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 40.03 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 -1.98 3.49 -0.07 -0.72 0.00 0.13 -4.91 121.76 117.70 3m7w s ALA 196 Ca 0.00 1.03 0.11 0.00 0.00 0.00 0.00 51.96 53.10 3m7w s ALA 196 Cb 0.00 -3.46 0.16 0.00 0.00 0.00 0.00 23.12 19.83 3m7w s ALA 196 CO 0.00 -0.47 1.06 -0.40 0.00 0.00 0.00 175.76 175.94 3m7w n ASP 197 N 2.73 1.83 -3.54 0.00 5.68 -1.26 -4.95 116.55 117.04 3m7w n ASP 197 Ca 0.06 -2.56 -0.09 0.00 -0.50 0.00 0.00 54.79 51.69 3m7w n ASP 197 Cb 0.44 -0.27 -0.02 0.00 -1.14 0.00 0.00 41.12 40.13 3m7w n ASP 197 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3m7w s ARG 198 N -1.88 1.88 0.47 0.11 1.70 -1.26 -3.95 118.95 116.01 3m7w s ARG 198 Ca 0.18 -1.29 -0.21 0.00 -0.47 0.00 0.00 55.73 53.94 3m7w s ARG 198 Cb 0.16 0.56 -0.08 0.00 -0.57 0.00 0.00 34.95 35.02 3m7w s ARG 198 CO 0.02 -0.84 1.08 -2.14 -1.08 0.00 0.00 175.30 172.34 3m7w s PRO 199 N -3.36 3.79 0.14 3.89 0.02 -1.25 -4.85 135.00 133.38 3m7w s PRO 199 Ca 0.18 1.52 0.08 0.00 0.02 0.00 0.00 61.00 62.80 3m7w s PRO 199 Cb -0.04 -2.24 -0.04 0.00 0.02 0.00 0.00 34.50 32.20 3m7w s PRO 199 CO 0.11 -0.47 -0.19 0.96 -0.33 0.00 0.00 177.00 177.08 3m7w s ILE 200 N -1.78 1.76 -0.13 2.83 -4.36 -1.26 -3.48 121.20 114.78 3m7w s ILE 200 Ca 0.65 -1.79 0.02 0.00 -0.26 0.00 0.00 60.65 59.27 3m7w s ILE 200 Cb -0.21 -1.74 0.01 0.00 1.25 0.00 0.00 42.46 41.77 3m7w s ILE 200 CO 0.26 -0.24 -0.19 -0.63 0.24 0.00 0.00 174.94 174.38 3m7w s ILE 201 N -1.78 1.81 0.06 8.37 1.01 0.01 -0.01 121.20 130.66 3m7w s ILE 201 Ca 0.12 -0.83 0.02 0.00 0.00 0.00 0.00 60.65 59.97 3m7w s ILE 201 Cb -0.07 -1.62 -0.03 0.00 0.01 0.00 0.00 42.46 40.75 3m7w s ILE 201 CO 0.06 0.50 -0.08 0.42 0.00 0.00 0.00 174.94 175.84 3m7w s THR 202 N 0.91 0.59 -0.21 2.92 -4.23 -1.26 -1.42 115.64 112.94 3m7w s THR 202 Ca -0.06 -1.28 -0.24 0.00 -1.18 0.00 0.00 61.69 58.93 3m7w s THR 202 Cb -0.15 -0.86 0.06 0.00 1.34 0.00 0.00 72.50 72.89 3m7w s THR 202 CO -0.02 -0.49 0.64 0.00 -0.54 0.00 0.00 174.62 174.21 3m7w s MET 203 N -2.09 0.80 -0.28 3.99 0.23 -0.44 -4.79 119.30 116.72 3m7w s MET 203 Ca -0.05 0.77 -0.11 0.00 -1.03 0.00 0.00 55.69 55.27 3m7w s MET 203 Cb -0.07 0.39 -0.05 0.00 -1.53 0.00 0.00 34.83 33.57 3m7w s MET 203 CO -0.01 -0.13 0.20 0.45 -2.03 0.00 0.00 175.02 173.51 3m7w s SER 204 N 0.07 6.04 0.93 -1.18 0.15 -1.26 -1.41 113.70 117.04 3m7w s SER 204 Ca -0.02 0.02 -0.15 0.00 0.70 0.00 0.00 55.95 56.50 3m7w s SER 204 Cb -0.04 -2.13 0.16 0.00 -1.71 0.00 0.00 66.02 62.31 3m7w s SER 204 CO 0.02 -0.06 1.24 -0.04 1.20 0.00 0.00 173.24 175.60 3m7w s MET 205 N 1.76 0.95 0.03 5.44 1.00 0.64 -4.24 119.30 124.87 3m7w s MET 205 Ca 0.08 -0.13 0.00 0.00 0.00 0.00 0.00 55.69 55.64 3m7w s MET 205 Cb -0.16 -1.86 0.00 0.00 0.00 0.00 0.00 34.83 32.82 3m7w s MET 205 CO 0.11 -2.25 0.00 -1.13 0.00 0.00 0.00 175.02 171.75 3m7w n SER 206 N -3.72 -0.45 -0.18 3.03 3.41 -0.37 -3.24 113.62 112.10 3m7w n SER 206 Ca 0.12 0.06 0.04 0.00 -0.26 0.00 0.00 58.87 58.83 3m7w n SER 206 Cb 0.60 -0.25 0.31 0.00 -0.26 0.00 0.00 64.21 64.61 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 -0.07 0.82 -0.49 4.33 1.57 -1.85 -2.06 116.57 118.82 3m7w h LYS 207 Ca -0.01 -0.05 0.01 0.00 -1.87 0.00 0.00 60.65 58.73 3m7w h LYS 207 Cb 0.07 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.17 3m7w h LYS 207 CO 0.00 0.55 0.33 1.15 -0.57 0.00 0.00 179.45 180.90 3m7w h THR 208 N 0.85 1.12 -0.45 -0.16 2.02 -1.94 -2.54 112.91 111.79 3m7w h THR 208 Ca 0.28 -0.22 0.00 0.00 0.77 0.00 0.00 66.41 67.24 3m7w h THR 208 Cb 0.08 0.41 0.00 0.00 -1.74 0.00 0.00 68.15 66.89 3m7w h THR 208 CO -0.08 0.12 0.00 0.61 0.37 0.00 0.00 175.52 176.54 3m7w n GLY 209 N -1.46 1.36 0.41 2.16 0.00 -0.79 -4.61 105.19 102.26 3m7w n GLY 209 Ca 0.04 -0.59 0.20 0.00 0.00 0.00 0.00 46.02 45.68 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 3.25 0.68 -1.02 1.61 3.04 -1.33 0.99 116.25 123.47 3m7w h VAL 210 Ca 0.00 -0.11 0.26 0.00 -1.01 0.00 0.00 66.70 65.84 3m7w h VAL 210 Cb 0.73 0.34 -0.08 0.00 -2.01 0.00 0.00 31.29 30.27 3m7w h VAL 210 CO 0.00 0.06 0.67 -0.29 -1.01 0.00 0.00 177.57 177.00 3m7w h ILE 211 N 0.31 0.55 0.00 3.17 2.10 -1.84 0.23 117.51 122.03 3m7w h ILE 211 Ca 0.43 -0.12 -0.01 0.00 1.08 0.00 0.00 64.86 66.25 3m7w h ILE 211 Cb 1.20 0.18 -0.00 0.00 -1.09 0.00 0.00 36.82 37.11 3m7w h ILE 211 CO -0.13 0.06 -0.04 0.77 -1.08 0.00 0.00 178.15 177.73 3m7w h SER 212 N 0.34 0.00 0.75 2.19 4.64 -1.09 -0.77 113.55 119.60 3m7w h SER 212 Ca 0.56 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.88 3m7w h SER 212 Cb 1.52 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.61 3m7w h SER 212 CO -0.22 0.04 -0.41 0.54 -0.87 0.00 0.00 176.83 175.91 3m7w n ARG 213 N -3.16 0.09 -0.07 4.77 1.74 0.80 -4.33 116.66 116.50 3m7w n ARG 213 Ca 0.00 0.03 -0.08 0.00 -0.77 0.00 0.00 57.85 57.04 3m7w n ARG 213 Cb 0.32 -1.56 -0.10 0.00 -1.02 0.00 0.00 32.46 30.10 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 -1.70 0.58 -2.24 0.55 4.77 -0.71 -4.73 117.00 113.53 3m7w n LEU 214 Ca 0.05 -0.02 -0.30 0.00 -0.03 0.00 0.00 56.01 55.71 3m7w n LEU 214 Cb 0.37 0.15 0.11 0.00 -2.33 0.00 0.00 43.42 41.72 3m7w n LEU 214 CO 0.33 0.42 1.31 0.00 -1.33 0.00 0.00 177.39 178.12 3m7w n ALA 215 N -2.59 5.99 -0.13 -1.18 0.00 -0.38 -4.63 120.51 117.59 3m7w n ALA 215 Ca -0.23 -3.33 -0.03 0.00 0.00 0.00 0.00 53.44 49.85 3m7w n ALA 215 Cb 0.91 -1.56 0.19 0.00 0.00 0.00 0.00 19.45 18.99 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 1.70 0.89 1.09 0.00 0.00 -1.78 -1.53 103.07 103.43 3m7w h GLY 216 Ca 0.59 -0.52 -0.03 0.00 0.00 0.00 0.00 47.33 47.37 3m7w h GLY 216 CO 1.37 0.49 0.38 -2.09 0.00 0.00 0.00 176.54 176.68 3m7w h GLU 217 N 0.79 1.17 0.13 4.80 4.81 -1.82 0.44 114.58 124.91 3m7w h GLU 217 Ca 0.17 -0.18 -0.33 0.00 -0.13 0.00 0.00 59.36 58.90 3m7w h GLU 217 Cb 0.31 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.48 3m7w h GLU 217 CO 0.00 0.91 -1.69 -0.24 -0.73 0.00 0.00 179.01 177.26 3m7w h VAL 218 N 1.16 0.98 0.00 0.32 3.04 -1.90 -3.39 116.25 116.45 3m7w h VAL 218 Ca 0.28 -2.62 0.00 0.00 -1.01 0.00 0.00 66.70 63.34 3m7w h VAL 218 Cb 0.13 2.70 0.00 0.00 -2.01 0.00 0.00 31.29 32.11 3m7w h VAL 218 CO -0.03 0.82 -1.19 0.49 -1.01 0.00 0.00 177.57 176.64 3m7w n PHE 219 N -3.47 0.49 0.00 3.17 3.72 -0.59 -5.01 117.46 115.77 3m7w n PHE 219 Ca -0.22 0.14 0.00 0.00 -0.05 0.00 0.00 57.45 57.33 3m7w n PHE 219 Cb 1.06 -0.65 0.00 0.00 -0.94 0.00 0.00 39.48 38.94 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 1.28 1.29 3.71 1.37 0.00 0.15 -3.51 105.19 109.48 3m7w n GLY 220 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 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 -1.54 7.14 0.04 1.61 0.15 -0.81 -4.52 113.70 115.77 3m7w s SER 221 Ca 0.00 1.94 0.25 0.00 0.70 0.00 0.00 55.95 58.84 3m7w s SER 221 Cb 0.00 -2.58 0.54 0.00 -1.71 0.00 0.00 66.02 62.27 3m7w s SER 221 CO 0.00 -0.43 1.44 0.00 1.20 0.00 0.00 173.24 175.45 3m7w n ALA 222 N 3.94 3.22 -2.70 5.45 0.00 0.98 -4.13 120.51 127.29 3m7w n ALA 222 Ca 0.08 -0.29 -0.09 0.00 0.00 0.00 0.00 53.44 53.14 3m7w n ALA 222 Cb 0.47 -1.17 -0.07 0.00 0.00 0.00 0.00 19.45 18.68 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 -3.05 -0.42 -0.06 0.00 0.00 -1.26 -1.68 121.76 115.29 3m7w s ALA 223 Ca 0.10 -0.43 -0.12 0.00 0.00 0.00 0.00 51.96 51.51 3m7w s ALA 223 Cb 0.16 0.51 0.02 0.00 0.00 0.00 0.00 23.12 23.82 3m7w s ALA 223 CO 0.69 -0.52 0.29 -0.08 0.00 0.00 0.00 175.76 176.13 3m7w s THR 224 N -3.69 0.03 -0.12 0.00 -1.32 -0.11 -4.62 115.64 105.81 3m7w s THR 224 Ca 0.03 -0.27 -0.10 0.00 -1.21 0.00 0.00 61.69 60.15 3m7w s THR 224 Cb 0.03 -0.50 -0.05 0.00 -1.51 0.00 0.00 72.50 70.48 3m7w s THR 224 CO -0.10 -0.15 0.20 -0.36 -2.21 0.00 0.00 174.62 172.00 3m7w s PHE 225 N -0.61 3.57 0.37 9.09 0.40 -1.26 -0.77 117.98 128.77 3m7w s PHE 225 Ca -0.07 0.57 0.07 0.00 -0.60 0.00 0.00 56.93 56.90 3m7w s PHE 225 Cb -0.04 -2.08 -0.07 0.00 0.51 0.00 0.00 43.02 41.33 3m7w s PHE 225 CO 0.02 0.58 -0.01 0.20 0.70 0.00 0.00 175.22 176.71 3m7w s GLY 226 N -0.59 2.31 -0.10 4.36 0.00 -0.39 -4.55 107.32 108.37 3m7w s GLY 226 Ca 0.15 -2.19 -0.01 0.00 0.00 0.00 0.00 44.72 42.68 3m7w s GLY 226 CO 0.04 -2.02 -0.06 0.00 0.00 0.00 0.00 173.10 171.07 3m7w s ALA 227 N -2.82 3.00 0.00 3.20 0.00 0.11 -4.42 121.76 120.83 3m7w s ALA 227 Ca 0.34 -0.86 0.00 0.00 0.00 0.00 0.00 51.96 51.44 3m7w s ALA 227 Cb 0.08 -1.34 0.00 0.00 0.00 0.00 0.00 23.12 21.86 3m7w s ALA 227 CO 0.17 0.47 0.00 0.28 0.00 0.00 0.00 175.76 176.67 3m7w n VAL 228 N 2.62 0.00 -0.08 0.00 0.31 -1.26 -0.95 118.33 118.96 3m7w n VAL 228 Ca -0.18 0.09 -0.10 0.00 -0.01 0.00 0.00 64.34 64.14 3m7w n VAL 228 Cb 0.53 -0.52 -0.10 0.00 -0.91 0.00 0.00 33.84 32.84 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 -1.04 0.97 -3.92 5.55 5.02 -1.26 -4.80 118.16 118.68 3m7w n LYS 229 Ca 0.00 0.06 -0.11 0.00 -2.02 0.00 0.00 58.31 56.24 3m7w n LYS 229 Cb 0.00 -1.38 -0.12 0.00 -0.02 0.00 0.00 35.03 33.51 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 0.16 0.54 1.97 -2.85 -1.26 -5.16 119.74 110.77 3m7w s LYS 230 Ca -0.17 -0.28 -0.19 0.00 -1.00 0.00 0.00 55.97 54.33 3m7w s LYS 230 Cb 0.06 0.06 -0.06 0.00 -2.06 0.00 0.00 37.83 35.82 3m7w s LYS 230 CO 0.51 -0.03 1.09 0.00 0.10 0.00 0.00 175.35 177.02 3m7w s ALA 231 N -0.69 2.75 -2.95 0.59 0.00 -1.26 -4.84 121.76 115.35 3m7w s ALA 231 Ca -0.08 0.69 0.24 0.00 0.00 0.00 0.00 51.96 52.81 3m7w s ALA 231 Cb -0.05 -3.31 0.21 0.00 0.00 0.00 0.00 23.12 19.97 3m7w s ALA 231 CO -0.00 -0.65 1.27 -1.13 0.00 0.00 0.00 175.76 175.25 3m7w n SER 232 N -1.32 3.03 -3.52 0.00 3.41 -1.26 -4.97 113.62 108.99 3m7w n SER 232 Ca 0.10 -2.00 -0.12 0.00 -0.26 0.00 0.00 58.87 56.60 3m7w n SER 232 Cb 0.52 -0.02 -0.04 0.00 -0.26 0.00 0.00 64.21 64.41 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 -1.96 -1.82 0.41 7.33 0.00 -1.26 -5.14 121.76 119.33 3m7w s ALA 233 Ca 0.29 1.23 -0.26 0.00 0.00 0.00 0.00 51.96 53.21 3m7w s ALA 233 Cb 0.20 -0.02 -0.09 0.00 0.00 0.00 0.00 23.12 23.21 3m7w s ALA 233 CO 0.30 -0.49 1.37 -2.14 0.00 0.00 0.00 175.76 174.80 3m7w s PRO 234 N -2.05 3.90 0.00 0.00 0.02 -1.26 -3.25 135.00 132.36 3m7w s PRO 234 Ca -0.01 2.31 0.00 0.00 0.02 0.00 0.00 61.00 63.31 3m7w s PRO 234 Cb -0.01 -2.76 0.00 0.00 0.02 0.00 0.00 34.50 31.75 3m7w s PRO 234 CO -0.01 -0.60 0.00 0.41 -0.33 0.00 0.00 177.00 176.46 3m7w n GLY 235 N 0.62 1.29 3.77 0.52 0.00 -1.26 -1.24 105.19 108.88 3m7w n GLY 235 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.70 4.35 0.36 1.61 -0.21 -1.20 -4.67 119.66 119.20 3m7w s GLN 236 Ca 0.00 2.21 0.08 0.00 0.02 0.00 0.00 55.36 57.67 3m7w s GLN 236 Cb 0.00 -3.08 -0.03 0.00 1.00 0.00 0.00 33.01 30.90 3m7w s GLN 236 CO 0.00 -0.20 0.29 0.96 -2.12 0.00 0.00 175.29 174.22 3m7w s ILE 237 N -1.00 3.21 0.39 1.08 -4.36 -1.26 -4.74 121.20 114.52 3m7w s ILE 237 Ca 0.50 -1.42 -0.27 0.00 -0.26 0.00 0.00 60.65 59.20 3m7w s ILE 237 Cb -0.40 -3.10 -0.10 0.00 1.25 0.00 0.00 42.46 40.11 3m7w s ILE 237 CO 0.51 -0.13 1.43 -1.54 0.24 0.00 0.00 174.94 175.45 3m7w n SER 238 N -1.38 3.42 -0.33 4.36 3.41 -1.26 -0.71 113.62 121.13 3m7w n SER 238 Ca -0.01 1.19 0.10 0.00 -0.26 0.00 0.00 58.87 59.89 3m7w n SER 238 Cb 0.61 -1.59 0.30 0.00 -0.26 0.00 0.00 64.21 63.27 3m7w n SER 238 CO 0.00 0.00 0.00 -0.37 -0.16 0.00 0.00 175.04 174.51 3m7w h VAL 239 N 2.65 0.85 -0.32 -3.33 -1.51 -1.36 -0.55 116.25 112.68 3m7w h VAL 239 Ca -0.50 -0.29 -0.01 0.00 -1.23 0.00 0.00 66.70 64.67 3m7w h VAL 239 Cb 1.26 -0.08 -0.02 0.00 -2.13 0.00 0.00 31.29 30.33 3m7w h VAL 239 CO 0.63 0.16 0.17 0.00 -1.23 0.00 0.00 177.57 177.29 3m7w h ALA 240 N 1.58 0.41 -0.45 5.19 0.00 -1.87 -0.03 119.26 124.10 3m7w h ALA 240 Ca 0.50 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 55.23 3m7w h ALA 240 Cb 0.65 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 3m7w h ALA 240 CO -0.27 -0.05 -0.14 -0.44 0.00 0.00 0.00 179.25 178.35 3m7w h ASP 241 N 0.40 0.83 -0.36 0.00 3.32 -1.74 -1.62 116.42 117.25 3m7w h ASP 241 Ca 0.11 -0.27 -0.01 0.00 0.02 0.00 0.00 57.03 56.88 3m7w h ASP 241 Cb 0.07 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.38 3m7w h ASP 241 CO -0.02 0.98 0.18 0.25 -1.72 0.00 0.00 179.24 178.91 3m7w h LEU 242 N 0.75 0.46 -0.63 1.55 5.85 -0.79 -1.33 115.31 121.16 3m7w h LEU 242 Ca 0.12 -0.11 -0.00 0.00 0.84 0.00 0.00 57.88 58.72 3m7w h LEU 242 Cb 0.65 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.53 3m7w h LEU 242 CO 0.05 0.45 0.38 -0.09 -0.34 0.00 0.00 178.44 178.89 3m7w h ARG 243 N 0.45 0.86 -0.33 1.25 9.65 -0.83 -1.14 114.38 124.29 3m7w h ARG 243 Ca 0.12 -0.08 0.05 0.00 -1.10 0.00 0.00 59.98 58.98 3m7w h ARG 243 Cb 0.10 -0.18 -0.04 0.00 -1.39 0.00 0.00 29.97 28.46 3m7w h ARG 243 CO -0.02 0.61 0.07 1.15 2.80 0.00 0.00 179.97 184.58 3m7w h THR 244 N 0.86 0.85 -0.28 0.20 2.02 -0.95 -0.58 112.91 115.02 3m7w h THR 244 Ca 0.23 -0.06 -0.11 0.00 0.77 0.00 0.00 66.41 67.23 3m7w h THR 244 Cb -0.03 0.64 -0.00 0.00 -1.74 0.00 0.00 68.15 67.02 3m7w h THR 244 CO -0.04 0.03 -0.25 0.58 0.37 0.00 0.00 175.52 176.21 3m7w h VAL 245 N 0.19 1.30 -0.87 3.16 2.07 -1.02 -1.74 116.25 119.35 3m7w h VAL 245 Ca 0.15 -1.41 0.02 0.00 0.82 0.00 0.00 66.70 66.28 3m7w h VAL 245 Cb 0.17 1.59 -0.05 0.00 -1.52 0.00 0.00 31.29 31.48 3m7w h VAL 245 CO -0.20 0.45 0.57 -0.07 0.02 0.00 0.00 177.57 178.34 3m7w h LEU 246 N 0.39 0.97 -0.12 2.57 3.38 -1.12 0.23 115.31 121.61 3m7w h LEU 246 Ca 0.05 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 3m7w h LEU 246 Cb 0.81 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 3m7w h LEU 246 CO 0.06 0.69 0.06 0.74 0.09 0.00 0.00 178.44 180.09 3m7w h THR 247 N 1.15 1.11 -0.85 0.22 2.02 -0.99 0.49 112.91 116.05 3m7w h THR 247 Ca 0.33 -0.31 0.03 0.00 0.77 0.00 0.00 66.41 67.22 3m7w h THR 247 Cb -0.09 1.09 -0.05 0.00 -1.74 0.00 0.00 68.15 67.37 3m7w h THR 247 CO -0.09 0.10 0.55 0.40 0.37 0.00 0.00 175.52 176.86 3m7w h ILE 248 N 0.08 1.15 -0.13 3.11 2.04 -0.97 -1.40 117.51 121.41 3m7w h ILE 248 Ca 0.04 -0.37 -0.17 0.00 1.00 0.00 0.00 64.86 65.36 3m7w h ILE 248 Cb 0.10 -0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.15 3m7w h ILE 248 CO -0.01 0.20 -0.63 -0.07 0.00 0.00 0.00 178.15 177.64 3m7w h LEU 249 N 1.09 0.52 -1.34 1.44 3.38 -0.68 -2.25 115.31 117.47 3m7w h LEU 249 Ca 0.33 -0.31 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3m7w h LEU 249 Cb -0.02 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.58 3m7w h LEU 249 CO -0.11 1.02 0.00 -0.74 0.09 0.00 0.00 178.44 178.71 3m7w h HIS 250 N 0.33 0.00 -0.03 1.13 2.76 0.63 -3.08 115.15 116.89 3m7w h HIS 250 Ca -0.01 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.16 3m7w h HIS 250 Cb 1.18 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.14 3m7w h HIS 250 CO 0.04 0.00 0.00 1.04 -1.30 0.00 0.00 177.93 177.71 3m7w n GLN 251 N -2.80 2.42 0.00 5.26 6.02 -0.59 -5.06 117.38 122.64 3m7w n GLN 251 Ca 0.01 -1.93 0.15 0.00 -0.01 0.00 0.00 57.00 55.22 3m7w n GLN 251 Cb 0.26 -1.20 0.89 0.00 1.02 0.00 0.00 30.24 31.21 3m7w n GLN 251 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05