#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3m47 h VAL 6 N 0.00 1.10 -0.05 1.55 3.04 -1.98 -2.97 116.25 116.94 3m47 h VAL 6 Ca 0.00 -0.18 0.00 0.00 -1.01 0.00 0.00 66.70 65.51 3m47 h VAL 6 Cb 0.00 0.56 0.00 0.00 -2.01 0.00 0.00 31.29 29.84 3m47 h VAL 6 CO 0.00 0.10 0.00 -0.90 -1.01 0.00 0.00 177.57 175.76 3m47 n ASP 7 N -4.48 1.33 -4.51 3.17 5.75 -1.26 -4.82 116.55 111.74 3m47 n ASP 7 Ca 0.02 -1.49 -0.25 0.00 -0.01 0.00 0.00 54.79 53.07 3m47 n ASP 7 Cb 0.06 -0.02 -0.10 0.00 -1.03 0.00 0.00 41.12 40.03 3m47 n ASP 7 CO 0.00 0.00 0.00 0.68 -0.11 0.00 0.00 177.20 177.77 3m47 s VAL 8 N -1.95 2.13 0.45 2.12 -7.23 -1.12 -5.11 120.40 109.69 3m47 s VAL 8 Ca 0.38 -2.21 -0.25 0.00 -1.81 0.00 0.00 61.98 58.08 3m47 s VAL 8 Cb 0.20 -2.55 -0.08 0.00 0.56 0.00 0.00 36.38 34.51 3m47 s VAL 8 CO 0.32 -0.25 1.39 0.00 -0.31 0.00 0.00 175.10 176.25 3m47 s MET 9 N -3.62 3.68 -0.27 4.82 0.23 -1.26 -4.86 119.30 118.01 3m47 s MET 9 Ca 0.31 2.34 -0.18 0.00 -1.03 0.00 0.00 55.69 57.13 3m47 s MET 9 Cb 0.02 -2.63 -0.02 0.00 -1.53 0.00 0.00 34.83 30.67 3m47 s MET 9 CO 0.15 -0.79 0.53 -0.51 -2.03 0.00 0.00 175.02 172.37 3m47 s ASP 10 N -0.61 6.43 -0.26 -1.18 1.01 -1.26 -5.00 116.67 115.80 3m47 s ASP 10 Ca 0.61 0.46 -0.09 0.00 0.71 0.00 0.00 52.55 54.24 3m47 s ASP 10 Cb -0.42 -2.28 -0.04 0.00 1.01 0.00 0.00 42.92 41.18 3m47 s ASP 10 CO 0.54 -0.33 0.14 -0.69 0.21 0.00 0.00 175.17 175.04 3m47 s VAL 11 N 2.35 4.89 0.16 -1.27 1.01 -1.26 -5.02 120.40 121.26 3m47 s VAL 11 Ca 0.21 0.03 -0.33 0.00 0.00 0.00 0.00 61.98 61.89 3m47 s VAL 11 Cb -0.16 -3.31 -0.12 0.00 0.00 0.00 0.00 36.38 32.79 3m47 s VAL 11 CO 0.10 0.30 1.72 0.80 0.00 0.00 0.00 175.10 178.01 3m47 n MET 12 N 4.92 2.56 -1.13 2.72 1.56 -1.26 -1.64 117.12 124.86 3m47 n MET 12 Ca -0.15 0.93 -0.04 0.00 -0.27 0.00 0.00 57.70 58.16 3m47 n MET 12 Cb 0.52 -2.76 -0.02 0.00 2.15 0.00 0.00 33.22 33.11 3m47 n MET 12 CO 0.00 0.00 0.00 0.09 -0.73 0.00 0.00 175.97 175.33 3m47 n ASN 13 N 4.35 -5.89 -2.13 6.12 3.02 -1.26 -2.91 115.26 116.55 3m47 n ASN 13 Ca 0.17 0.11 -0.20 0.00 -0.03 0.00 0.00 54.58 54.63 3m47 n ASN 13 Cb 0.33 -3.78 -0.03 0.00 -0.61 0.00 0.00 39.78 35.69 3m47 n ASN 13 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3m47 n ARG 14 N 0.27 -1.57 -3.88 3.52 1.74 -0.65 -4.96 116.66 111.13 3m47 n ARG 14 Ca -0.04 1.04 -0.27 0.00 -0.77 0.00 0.00 57.85 57.80 3m47 n ARG 14 Cb 0.54 -5.60 -0.17 0.00 -1.02 0.00 0.00 32.46 26.21 3m47 n ARG 14 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 3m47 s LEU 15 N -5.54 1.35 -0.21 0.55 2.96 -1.15 -1.07 118.68 115.56 3m47 s LEU 15 Ca 0.00 -0.49 -0.08 0.00 -0.22 0.00 0.00 54.13 53.34 3m47 s LEU 15 Cb 0.00 -0.83 -0.04 0.00 0.50 0.00 0.00 46.19 45.82 3m47 s LEU 15 CO 0.00 -0.17 0.10 -0.63 -1.32 0.00 0.00 176.35 174.33 3m47 s ILE 16 N 1.70 4.93 -0.24 6.68 1.01 0.40 -4.62 121.20 131.06 3m47 s ILE 16 Ca 0.03 0.02 -0.28 0.00 0.00 0.00 0.00 60.65 60.42 3m47 s ILE 16 Cb -0.14 -3.26 0.01 0.00 0.01 0.00 0.00 42.46 39.08 3m47 s ILE 16 CO -0.08 0.41 0.98 -0.22 0.00 0.00 0.00 174.94 176.04 3m47 s LEU 17 N 0.72 4.08 -0.81 2.97 2.96 -0.81 -1.05 118.68 126.75 3m47 s LEU 17 Ca 0.05 1.25 -0.23 0.00 -0.22 0.00 0.00 54.13 54.98 3m47 s LEU 17 Cb -0.13 -3.44 0.07 0.00 0.50 0.00 0.00 46.19 43.19 3m47 s LEU 17 CO 0.02 -0.65 1.16 0.00 -1.32 0.00 0.00 176.35 175.56 3m47 s ALA 18 N 3.14 3.02 -1.04 5.97 0.00 -0.04 -0.24 121.76 132.58 3m47 s ALA 18 Ca 0.41 -2.05 -0.17 0.00 0.00 0.00 0.00 51.96 50.16 3m47 s ALA 18 Cb -0.15 -4.11 0.15 0.00 0.00 0.00 0.00 23.12 19.00 3m47 s ALA 18 CO 0.07 -3.09 1.25 1.41 0.00 0.00 0.00 175.76 175.40 3m47 s MET 19 N 4.25 3.79 0.00 0.00 1.75 -0.42 -4.47 119.30 124.21 3m47 s MET 19 Ca 0.32 -2.08 0.24 0.00 -1.25 0.00 0.00 55.69 52.91 3m47 s MET 19 Cb -0.09 -4.98 0.45 0.00 2.84 0.00 0.00 34.83 33.05 3m47 s MET 19 CO 0.03 -1.77 1.40 -0.25 -0.65 0.00 0.00 175.02 173.78 3m47 n ASP 20 N 6.21 2.82 -4.76 1.11 10.43 -1.26 -4.54 116.55 126.56 3m47 n ASP 20 Ca 0.29 -1.90 -0.39 0.00 2.57 0.00 0.00 54.79 55.36 3m47 n ASP 20 Cb 0.47 -0.10 0.03 0.00 1.84 0.00 0.00 41.12 43.36 3m47 n ASP 20 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 3m47 s LEU 21 N -1.77 3.93 0.00 0.64 1.43 -1.26 -4.82 118.68 116.82 3m47 s LEU 21 Ca 0.34 2.75 0.17 0.00 -1.03 0.00 0.00 54.13 56.36 3m47 s LEU 21 Cb 0.21 -4.19 -0.14 0.00 0.03 0.00 0.00 46.19 42.10 3m47 s LEU 21 CO 0.31 -1.42 0.77 0.23 0.23 0.00 0.00 176.35 176.47 3m47 n MET 22 N -0.79 1.44 -4.57 1.70 2.81 -1.26 -4.47 117.12 111.99 3m47 n MET 22 Ca 0.09 -0.23 -0.34 0.00 -1.81 0.00 0.00 57.70 55.40 3m47 n MET 22 Cb 0.45 -1.31 -0.11 0.00 -0.71 0.00 0.00 33.22 31.54 3m47 n MET 22 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 3m47 s ASN 23 N -2.46 4.78 0.23 7.83 2.20 -1.26 -4.63 114.94 121.63 3m47 s ASN 23 Ca 0.09 0.01 -0.07 0.00 -0.94 0.00 0.00 52.86 51.95 3m47 s ASN 23 Cb 0.13 -1.25 0.28 0.00 -2.00 0.00 0.00 41.25 38.42 3m47 s ASN 23 CO 0.63 0.36 1.84 -0.09 -2.94 0.00 0.00 177.10 176.90 3m47 h ARG 24 N 5.27 0.84 0.15 3.55 2.43 -1.93 -1.18 114.38 123.51 3m47 h ARG 24 Ca -0.49 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.63 3m47 h ARG 24 Cb 1.18 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 30.53 3m47 h ARG 24 CO 0.53 0.55 -0.13 -0.44 -1.51 0.00 0.00 179.97 178.98 3m47 h ASP 25 N 0.86 -0.33 -0.51 -3.80 3.45 -1.99 -0.55 116.42 113.56 3m47 h ASP 25 Ca 0.34 0.03 -0.02 0.00 0.43 0.00 0.00 57.03 57.80 3m47 h ASP 25 Cb 0.16 0.11 -0.02 0.00 -0.56 0.00 0.00 39.33 39.01 3m47 h ASP 25 CO -0.17 -0.20 0.23 0.44 -1.57 0.00 0.00 179.24 177.98 3m47 h ASP 26 N -0.29 0.68 -0.29 6.45 3.32 -1.93 0.95 116.42 125.31 3m47 h ASP 26 Ca -0.00 -0.14 -0.01 0.00 0.02 0.00 0.00 57.03 56.90 3m47 h ASP 26 Cb 0.27 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 3m47 h ASP 26 CO -0.02 0.63 0.14 0.00 -1.72 0.00 0.00 179.24 178.28 3m47 h ALA 27 N 1.07 0.37 -0.47 3.45 0.00 -1.05 0.15 119.26 122.78 3m47 h ALA 27 Ca 0.17 -0.09 -0.14 0.00 0.00 0.00 0.00 54.91 54.86 3m47 h ALA 27 Cb 0.14 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3m47 h ALA 27 CO -0.02 -0.08 -0.24 -0.07 0.00 0.00 0.00 179.25 178.84 3m47 h LEU 28 N 0.33 1.03 0.76 0.00 3.38 -1.04 -2.15 115.31 117.62 3m47 h LEU 28 Ca 0.10 -0.40 -0.04 0.00 0.09 0.00 0.00 57.88 57.63 3m47 h LEU 28 Cb 0.10 -0.28 0.01 0.00 0.09 0.00 0.00 40.66 40.58 3m47 h LEU 28 CO -0.01 1.21 -0.36 -0.09 0.09 0.00 0.00 178.44 179.27 3m47 h ARG 29 N 0.85 -0.98 -0.89 1.13 2.43 -0.46 -0.56 114.38 115.90 3m47 h ARG 29 Ca 0.10 0.07 0.02 0.00 -0.81 0.00 0.00 59.98 59.36 3m47 h ARG 29 Cb 0.83 0.22 -0.05 0.00 -0.42 0.00 0.00 29.97 30.55 3m47 h ARG 29 CO 0.07 -0.64 0.59 0.28 -1.51 0.00 0.00 179.97 178.76 3m47 h VAL 30 N -1.09 1.19 0.12 0.20 2.07 -0.79 -2.98 116.25 114.97 3m47 h VAL 30 Ca -0.10 -0.40 -0.01 0.00 0.82 0.00 0.00 66.70 67.01 3m47 h VAL 30 Cb 0.79 -0.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.50 3m47 h VAL 30 CO 0.17 0.21 -0.06 0.74 0.02 0.00 0.00 177.57 178.65 3m47 h THR 31 N 1.16 1.04 -0.89 2.57 2.02 -1.34 -3.26 112.91 114.21 3m47 h THR 31 Ca 0.34 -0.76 0.24 0.00 0.77 0.00 0.00 66.41 67.00 3m47 h THR 31 Cb -0.06 1.51 -0.15 0.00 -1.74 0.00 0.00 68.15 67.71 3m47 h THR 31 CO -0.09 0.18 0.13 1.23 0.37 0.00 0.00 175.52 177.34 3m47 h GLY 32 N -0.53 1.24 1.58 2.16 0.00 -0.94 0.82 103.07 107.40 3m47 h GLY 32 Ca -0.02 0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.37 3m47 h GLY 32 CO 0.03 -0.42 0.17 0.83 0.00 0.00 0.00 176.54 177.16 3m47 h GLU 33 N 0.11 0.00 -0.00 4.80 5.08 -1.59 -3.02 114.58 119.96 3m47 h GLU 33 Ca 0.55 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.91 3m47 h GLU 33 Cb 1.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.36 3m47 h GLU 33 CO -0.75 0.00 -0.01 1.33 -1.00 0.00 0.00 179.01 178.58 3m47 n VAL 34 N -2.45 0.00 0.31 3.13 0.24 0.28 -4.35 118.33 115.50 3m47 n VAL 34 Ca -0.02 -0.49 0.19 0.00 -2.04 0.00 0.00 64.34 61.98 3m47 n VAL 34 Cb 0.21 1.05 1.02 0.00 -1.47 0.00 0.00 33.84 34.65 3m47 n VAL 34 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 3m47 h ARG 35 N 0.51 0.00 0.00 7.34 9.65 -1.48 0.41 114.38 130.81 3m47 h ARG 35 Ca 0.00 0.00 -0.05 0.00 -1.10 0.00 0.00 59.98 58.83 3m47 h ARG 35 Cb 0.11 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 28.69 3m47 h ARG 35 CO 0.00 0.00 -0.24 1.49 2.80 0.00 0.00 179.97 184.02 3m47 h GLU 36 N 0.00 0.00 0.00 0.20 4.81 -1.84 -3.26 114.58 114.49 3m47 h GLU 36 Ca 0.02 0.00 -0.22 0.00 -0.13 0.00 0.00 59.36 59.03 3m47 h GLU 36 Cb 0.28 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.62 3m47 h GLU 36 CO -0.00 0.24 -2.07 0.66 -0.73 0.00 0.00 179.01 177.12 3m47 n TYR 37 N -3.61 0.00 -4.68 0.92 4.01 0.14 -4.98 117.16 108.96 3m47 n TYR 37 Ca -0.01 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.50 3m47 n TYR 37 Cb 0.38 -0.71 -0.15 0.00 -0.31 0.00 0.00 39.34 38.54 3m47 n TYR 37 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 3m47 s ILE 38 N -2.67 1.16 -0.07 -0.72 1.01 -0.62 -4.58 121.20 114.72 3m47 s ILE 38 Ca -0.08 -0.62 0.01 0.00 0.00 0.00 0.00 60.65 59.96 3m47 s ILE 38 Cb 0.07 -0.98 0.01 0.00 0.01 0.00 0.00 42.46 41.57 3m47 s ILE 38 CO 0.72 0.33 0.75 -0.90 0.00 0.00 0.00 174.94 175.84 3m47 n ASP 39 N 2.83 1.51 -3.84 3.58 5.75 -1.26 -4.38 116.55 120.75 3m47 n ASP 39 Ca -0.15 -1.47 -0.24 0.00 -0.01 0.00 0.00 54.79 52.92 3m47 n ASP 39 Cb 0.55 -0.01 -0.17 0.00 -1.03 0.00 0.00 41.12 40.46 3m47 n ASP 39 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 3m47 s THR 40 N -0.49 0.62 -0.05 2.12 2.01 -1.26 -0.28 115.64 118.32 3m47 s THR 40 Ca 0.01 -0.06 0.05 0.00 0.31 0.00 0.00 61.69 62.00 3m47 s THR 40 Cb 0.01 -0.71 -0.00 0.00 0.01 0.00 0.00 72.50 71.81 3m47 s THR 40 CO 0.01 0.29 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.35 3m47 s VAL 41 N 1.68 1.56 -0.21 3.82 1.01 -0.35 -1.93 120.40 125.98 3m47 s VAL 41 Ca 0.02 -0.79 -0.09 0.00 0.00 0.00 0.00 61.98 61.12 3m47 s VAL 41 Cb -0.13 -1.34 -0.05 0.00 0.00 0.00 0.00 36.38 34.87 3m47 s VAL 41 CO -0.05 0.45 0.11 -0.75 0.00 0.00 0.00 175.10 174.86 3m47 s LYS 42 N 0.04 4.04 0.02 2.72 2.20 0.67 -1.25 119.74 128.18 3m47 s LYS 42 Ca -0.05 -0.30 0.09 0.00 -0.36 0.00 0.00 55.97 55.35 3m47 s LYS 42 Cb -0.12 -3.38 -0.03 0.00 -1.51 0.00 0.00 37.83 32.79 3m47 s LYS 42 CO 0.03 0.18 -0.26 0.42 -0.36 0.00 0.00 175.35 175.36 3m47 s ILE 43 N 0.67 2.07 0.36 5.43 -1.09 -0.24 -1.29 121.20 127.10 3m47 s ILE 43 Ca 0.06 -1.27 0.00 0.00 -2.23 0.00 0.00 60.65 57.21 3m47 s ILE 43 Cb -0.13 -1.75 0.00 0.00 -1.58 0.00 0.00 42.46 39.00 3m47 s ILE 43 CO 0.01 0.43 0.00 0.61 -1.23 0.00 0.00 174.94 174.76 3m47 n GLY 44 N 2.02 3.75 0.33 6.18 0.00 -1.26 -0.08 105.19 116.12 3m47 n GLY 44 Ca -0.17 -2.33 -0.01 0.00 0.00 0.00 0.00 46.02 43.52 3m47 n GLY 44 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3m47 h TYR 45 N 1.18 0.91 -0.68 1.61 0.99 -1.96 -2.89 116.97 116.13 3m47 h TYR 45 Ca -0.30 -0.03 0.07 0.00 2.00 0.00 0.00 58.73 60.48 3m47 h TYR 45 Cb 0.91 -0.29 -0.06 0.00 1.00 0.00 0.00 36.73 38.29 3m47 h TYR 45 CO 0.00 0.66 0.36 -1.35 -0.00 0.00 0.00 178.16 177.83 3m47 h PRO 46 N 0.93 0.62 -0.02 4.88 0.11 -1.95 0.32 132.00 136.88 3m47 h PRO 46 Ca 0.23 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.30 3m47 h PRO 46 Cb 0.07 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 31.04 3m47 h PRO 46 CO -0.03 0.41 -0.00 1.25 -0.21 0.00 0.00 178.00 179.41 3m47 h LEU 47 N 0.64 0.04 -0.77 2.35 5.85 -1.76 -2.20 115.31 119.46 3m47 h LEU 47 Ca 0.32 -0.35 -0.13 0.00 0.84 0.00 0.00 57.88 58.55 3m47 h LEU 47 Cb 0.26 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 3m47 h LEU 47 CO -0.22 0.39 -0.51 -0.37 -0.34 0.00 0.00 178.44 177.39 3m47 h VAL 48 N -0.30 1.35 -0.19 1.05 -1.51 -1.27 0.15 116.25 115.53 3m47 h VAL 48 Ca 0.01 -1.77 -0.13 0.00 -1.23 0.00 0.00 66.70 63.57 3m47 h VAL 48 Cb 0.37 1.85 -0.01 0.00 -2.13 0.00 0.00 31.29 31.36 3m47 h VAL 48 CO 0.00 0.53 -0.45 -0.07 -1.23 0.00 0.00 177.57 176.35 3m47 h LEU 49 N 0.21 0.50 -0.21 4.19 3.38 -0.42 0.21 115.31 123.17 3m47 h LEU 49 Ca 0.01 -0.23 -0.22 0.00 0.09 0.00 0.00 57.88 57.52 3m47 h LEU 49 Cb 0.98 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.59 3m47 h LEU 49 CO 0.08 0.89 -0.87 0.28 0.09 0.00 0.00 178.44 178.90 3m47 h SER 50 N 0.38 0.63 0.00 -0.43 0.02 -1.06 -3.39 113.55 109.70 3m47 h SER 50 Ca 0.03 -0.46 0.00 0.00 -0.84 0.00 0.00 61.79 60.51 3m47 h SER 50 Cb 0.94 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 63.29 3m47 h SER 50 CO 0.08 1.25 -0.35 -0.62 -1.14 0.00 0.00 176.83 176.05 3m47 n GLU 51 N -3.81 4.79 0.00 3.45 -0.58 0.01 -5.05 120.64 119.45 3m47 n GLU 51 Ca -0.07 -0.01 0.00 0.00 -0.42 0.00 0.00 57.16 56.67 3m47 n GLU 51 Cb 0.79 -0.75 0.00 0.00 -0.57 0.00 0.00 31.44 30.92 3m47 n GLU 51 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3m47 n GLY 52 N 1.30 2.22 0.20 0.62 0.00 0.74 -4.71 105.19 105.56 3m47 n GLY 52 Ca 0.00 -1.74 0.14 0.00 0.00 0.00 0.00 46.02 44.43 3m47 n GLY 52 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3m47 h MET 53 N 0.00 0.00 0.00 1.61 2.86 -1.94 -2.40 114.93 115.06 3m47 h MET 53 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3m47 h MET 53 Cb 0.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.66 3m47 h MET 53 CO 0.00 0.00 0.00 -0.44 1.06 0.00 0.00 176.91 177.53 3m47 h ASP 54 N 0.00 0.00 0.53 1.22 3.32 -1.92 -1.76 116.42 117.81 3m47 h ASP 54 Ca 0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 3m47 h ASP 54 Cb 0.33 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.88 3m47 h ASP 54 CO 0.00 0.00 -0.06 -0.29 -1.72 0.00 0.00 179.24 177.17 3m47 h ILE 55 N 0.00 0.26 0.16 0.35 2.10 -1.71 -2.67 117.51 116.00 3m47 h ILE 55 Ca 0.00 -0.45 -0.01 0.00 1.08 0.00 0.00 64.86 65.48 3m47 h ILE 55 Cb 0.04 1.35 0.00 0.00 -1.09 0.00 0.00 36.82 37.12 3m47 h ILE 55 CO 0.00 0.06 -0.07 0.40 -1.08 0.00 0.00 178.15 177.46 3m47 h ILE 56 N 0.00 0.95 -0.30 2.19 2.04 -1.56 -1.68 117.51 119.16 3m47 h ILE 56 Ca -0.00 -0.50 -0.02 0.00 1.00 0.00 0.00 64.86 65.34 3m47 h ILE 56 Cb 0.34 1.26 -0.02 0.00 -0.74 0.00 0.00 36.82 37.67 3m47 h ILE 56 CO 0.01 0.12 0.09 0.00 0.00 0.00 0.00 178.15 178.36 3m47 h ALA 57 N 0.35 1.59 -0.52 1.87 0.00 -1.58 -2.48 119.26 118.49 3m47 h ALA 57 Ca -0.02 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 3m47 h ALA 57 Cb 0.35 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 3m47 h ALA 57 CO 0.04 0.32 0.25 1.49 0.00 0.00 0.00 179.25 181.35 3m47 h GLU 58 N 0.43 0.74 -0.07 0.00 4.81 -1.25 -1.32 114.58 117.92 3m47 h GLU 58 Ca 0.10 -0.10 0.02 0.00 -0.13 0.00 0.00 59.36 59.25 3m47 h GLU 58 Cb 0.15 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.38 3m47 h GLU 58 CO -0.01 0.61 -0.04 0.74 -0.73 0.00 0.00 179.01 179.58 3m47 h PHE 59 N 0.69 -0.08 -0.60 0.92 -1.00 -0.88 -0.37 116.94 115.62 3m47 h PHE 59 Ca 0.18 0.01 -0.04 0.00 2.81 0.00 0.00 57.97 60.92 3m47 h PHE 59 Cb 0.11 0.05 -0.03 0.00 3.61 0.00 0.00 35.95 39.69 3m47 h PHE 59 CO -0.01 -0.06 0.20 0.00 -1.61 0.00 0.00 178.31 176.84 3m47 h ARG 60 N -0.03 0.89 0.05 1.51 3.08 -1.27 -0.13 114.38 118.48 3m47 h ARG 60 Ca 0.04 -0.16 -0.27 0.00 0.07 0.00 0.00 59.98 59.66 3m47 h ARG 60 Cb 0.09 -0.15 0.02 0.00 0.08 0.00 0.00 29.97 30.02 3m47 h ARG 60 CO -0.09 0.75 -1.12 -0.22 -1.07 0.00 0.00 179.97 178.22 3m47 h LYS 61 N 0.87 0.61 0.00 0.04 3.64 -1.12 0.29 116.57 120.89 3m47 h LYS 61 Ca 0.20 -0.73 -0.17 0.00 -1.27 0.00 0.00 60.65 58.69 3m47 h LYS 61 Cb 0.22 0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 32.24 3m47 h LYS 61 CO -0.01 1.31 -0.79 0.00 -2.27 0.00 0.00 179.45 177.69 3m47 h ARG 62 N 0.31 0.00 0.00 1.90 3.08 -0.88 -3.37 114.38 115.42 3m47 h ARG 62 Ca -0.15 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.90 3m47 h ARG 62 Cb 1.78 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.83 3m47 h ARG 62 CO 0.21 0.79 -0.18 1.19 -1.07 0.00 0.00 179.97 180.91 3m47 n PHE 63 N -3.41 0.00 -2.30 3.04 3.01 -0.08 -5.01 117.46 112.72 3m47 n PHE 63 Ca 0.00 0.00 -0.18 0.00 1.01 0.00 0.00 57.45 58.28 3m47 n PHE 63 Cb 0.81 -0.00 -0.01 0.00 -0.01 0.00 0.00 39.48 40.27 3m47 n PHE 63 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3m47 n GLY 64 N 1.25 -0.25 3.93 1.37 0.00 0.10 -4.99 105.19 106.60 3m47 n GLY 64 Ca 0.00 -0.11 -0.26 0.00 0.00 0.00 0.00 46.02 45.64 3m47 n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m47 s ARG 66 N -3.60 4.61 -0.16 0.00 3.52 0.62 -4.40 118.95 119.53 3m47 s ARG 66 Ca 0.39 1.71 0.00 0.00 -0.13 0.00 0.00 55.73 57.71 3m47 s ARG 66 Cb -0.10 -3.11 -0.00 0.00 -1.56 0.00 0.00 34.95 30.17 3m47 s ARG 66 CO 0.30 0.21 -0.15 0.42 -0.81 0.00 0.00 175.30 175.27 3m47 s ILE 67 N -1.24 2.66 -0.25 4.11 -1.09 -1.26 -1.21 121.20 122.91 3m47 s ILE 67 Ca 0.46 -0.77 -0.09 0.00 -2.23 0.00 0.00 60.65 58.02 3m47 s ILE 67 Cb -0.30 -2.12 -0.04 0.00 -1.58 0.00 0.00 42.46 38.43 3m47 s ILE 67 CO 0.38 0.51 0.11 -0.63 -1.23 0.00 0.00 174.94 174.08 3m47 s ILE 68 N 0.83 4.73 -0.53 2.92 1.01 -0.38 -1.05 121.20 128.73 3m47 s ILE 68 Ca -0.05 -0.03 -0.24 0.00 0.00 0.00 0.00 60.65 60.33 3m47 s ILE 68 Cb -0.15 -3.22 0.04 0.00 0.01 0.00 0.00 42.46 39.14 3m47 s ILE 68 CO -0.00 0.32 0.90 0.00 0.00 0.00 0.00 174.94 176.16 3m47 s ALA 69 N 1.51 3.20 -1.29 9.38 0.00 0.20 -1.08 121.76 133.68 3m47 s ALA 69 Ca 0.06 -1.20 -0.13 0.00 0.00 0.00 0.00 51.96 50.68 3m47 s ALA 69 Cb -0.15 -3.67 0.13 0.00 0.00 0.00 0.00 23.12 19.42 3m47 s ALA 69 CO 0.06 -2.28 1.76 -3.47 0.00 0.00 0.00 175.76 171.83 3m47 n ASP 70 N 7.26 4.90 -0.62 0.00 2.03 0.89 -1.36 116.55 129.65 3m47 n ASP 70 Ca 0.02 -2.98 0.10 0.00 0.52 0.00 0.00 54.79 52.45 3m47 n ASP 70 Cb 0.47 -1.60 0.04 0.00 -0.72 0.00 0.00 41.12 39.31 3m47 n ASP 70 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 3m47 n PHE 71 N 5.78 0.00 -4.19 -0.67 0.99 -1.25 -4.16 117.46 113.95 3m47 n PHE 71 Ca 0.43 0.00 -0.40 0.00 -0.00 0.00 0.00 57.45 57.48 3m47 n PHE 71 Cb 0.41 0.00 -0.03 0.00 -1.00 0.00 0.00 39.48 38.85 3m47 n PHE 71 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.76 178.39 3m47 n LYS 72 N 0.47 -0.57 -1.70 -1.08 5.02 -0.67 -4.75 118.16 114.88 3m47 n LYS 72 Ca 0.10 0.08 -0.44 0.00 -2.02 0.00 0.00 58.31 56.03 3m47 n LYS 72 Cb 0.47 -2.99 -0.04 0.00 -0.02 0.00 0.00 35.03 32.45 3m47 n LYS 72 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3m47 n VAL 73 N -4.86 0.04 -2.70 -0.18 0.31 -0.95 -4.38 118.33 105.61 3m47 n VAL 73 Ca -0.21 -0.01 -0.05 0.00 -0.01 0.00 0.00 64.34 64.06 3m47 n VAL 73 Cb 0.63 -1.82 0.09 0.00 -0.91 0.00 0.00 33.84 31.82 3m47 n VAL 73 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3m47 n ALA 74 N 3.95 2.36 -3.98 3.52 0.00 -1.26 -1.10 120.51 124.00 3m47 n ALA 74 Ca 0.17 -1.92 -0.07 0.00 0.00 0.00 0.00 53.44 51.62 3m47 n ALA 74 Cb 0.33 -0.93 -0.01 0.00 0.00 0.00 0.00 19.45 18.84 3m47 n ALA 74 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3m47 n ASP 75 N -0.66 2.01 -4.76 0.00 -0.08 -1.26 -4.96 116.55 106.83 3m47 n ASP 75 Ca -0.02 -1.45 -0.30 0.00 -1.51 0.00 0.00 54.79 51.51 3m47 n ASP 75 Cb 0.84 0.05 0.10 0.00 2.34 0.00 0.00 41.12 44.46 3m47 n ASP 75 CO 0.00 0.00 0.00 0.27 0.12 0.00 0.00 177.20 177.59 3m47 s ILE 76 N -1.14 3.10 0.19 5.18 -4.36 -1.26 -4.70 121.20 118.21 3m47 s ILE 76 Ca 0.02 0.36 -0.12 0.00 -0.26 0.00 0.00 60.65 60.65 3m47 s ILE 76 Cb -0.00 -2.92 0.12 0.00 1.25 0.00 0.00 42.46 40.90 3m47 s ILE 76 CO 0.01 -0.47 1.73 -0.65 0.24 0.00 0.00 174.94 175.80 3m47 h PRO 77 N -1.24 0.28 -0.76 0.37 0.11 -1.88 0.21 132.00 129.10 3m47 h PRO 77 Ca -0.47 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.58 3m47 h PRO 77 Cb 1.26 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 32.27 3m47 h PRO 77 CO 0.55 0.19 0.29 1.49 -0.21 0.00 0.00 178.00 180.30 3m47 h GLU 78 N 0.29 1.13 -0.17 1.05 4.81 -1.94 -0.72 114.58 119.04 3m47 h GLU 78 Ca 0.26 -0.21 -0.21 0.00 -0.13 0.00 0.00 59.36 59.08 3m47 h GLU 78 Cb 0.34 -0.18 0.01 0.00 0.63 0.00 0.00 28.75 29.55 3m47 h GLU 78 CO -0.31 0.93 -0.72 1.15 -0.73 0.00 0.00 179.01 179.32 3m47 h THR 79 N 1.10 1.29 -0.87 0.32 2.02 -1.83 -2.79 112.91 112.16 3m47 h THR 79 Ca 0.25 -1.94 0.08 0.00 0.77 0.00 0.00 66.41 65.57 3m47 h THR 79 Cb 0.23 1.92 -0.07 0.00 -1.74 0.00 0.00 68.15 68.50 3m47 h THR 79 CO -0.02 0.61 0.53 0.78 0.37 0.00 0.00 175.52 177.79 3m47 h ASN 80 N 0.53 0.80 -0.89 4.18 4.21 -0.49 -0.45 115.58 123.47 3m47 h ASN 80 Ca -0.04 0.03 -0.00 0.00 1.21 0.00 0.00 56.30 57.50 3m47 h ASN 80 Cb 1.34 -0.13 -0.04 0.00 -1.12 0.00 0.00 38.32 38.36 3m47 h ASN 80 CO 0.15 0.49 0.55 -0.08 -1.29 0.00 0.00 177.43 177.24 3m47 h GLU 81 N 0.92 1.21 -0.16 0.81 4.81 -1.00 -0.59 114.58 120.58 3m47 h GLU 81 Ca 0.40 -0.10 -0.19 0.00 -0.13 0.00 0.00 59.36 59.34 3m47 h GLU 81 Cb 0.26 -0.26 -0.00 0.00 0.63 0.00 0.00 28.75 29.39 3m47 h GLU 81 CO -0.21 0.84 -0.65 0.87 -0.73 0.00 0.00 179.01 179.13 3m47 h LYS 82 N 1.23 0.62 -0.30 1.92 1.57 -1.12 -1.02 116.57 119.47 3m47 h LYS 82 Ca 0.32 -0.45 -0.02 0.00 -1.87 0.00 0.00 60.65 58.63 3m47 h LYS 82 Cb -0.07 0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 3m47 h LYS 82 CO -0.06 1.07 0.10 0.82 -0.57 0.00 0.00 179.45 180.80 3m47 h ILE 83 N 0.45 1.20 -0.47 1.86 2.04 -0.79 -1.13 117.51 120.66 3m47 h ILE 83 Ca -0.02 -0.64 -0.03 0.00 1.00 0.00 0.00 64.86 65.18 3m47 h ILE 83 Cb 1.24 1.06 -0.02 0.00 -0.74 0.00 0.00 36.82 38.35 3m47 h ILE 83 CO 0.13 0.21 0.19 0.00 0.00 0.00 0.00 178.15 178.68 3m47 h ARG 85 N 0.62 0.65 -0.58 0.00 2.43 -1.03 0.61 114.38 117.08 3m47 h ARG 85 Ca 0.16 -0.07 -0.05 0.00 -0.81 0.00 0.00 59.98 59.21 3m47 h ARG 85 Cb 0.19 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.58 3m47 h ARG 85 CO -0.01 0.49 0.15 0.00 -1.51 0.00 0.00 179.97 179.09 3m47 h ALA 86 N 1.12 1.16 -0.26 2.80 0.00 -1.06 0.10 119.26 123.12 3m47 h ALA 86 Ca 0.17 -0.21 -0.14 0.00 0.00 0.00 0.00 54.91 54.72 3m47 h ALA 86 Cb 0.02 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 3m47 h ALA 86 CO -0.03 0.57 -0.41 1.15 0.00 0.00 0.00 179.25 180.54 3m47 h THR 87 N 0.86 1.30 -0.27 0.00 2.02 -0.70 -1.91 112.91 114.21 3m47 h THR 87 Ca 0.19 -1.60 -0.13 0.00 0.77 0.00 0.00 66.41 65.63 3m47 h THR 87 Cb 0.31 1.70 -0.01 0.00 -1.74 0.00 0.00 68.15 68.41 3m47 h THR 87 CO -0.00 0.51 -0.37 -0.26 0.37 0.00 0.00 175.52 175.77 3m47 h PHE 88 N 0.46 0.74 -0.58 3.16 0.04 -0.79 -2.50 116.94 117.47 3m47 h PHE 88 Ca 0.02 -0.20 -0.02 0.00 2.80 0.00 0.00 57.97 60.57 3m47 h PHE 88 Cb 1.00 -0.16 -0.03 0.00 2.20 0.00 0.00 35.95 38.96 3m47 h PHE 88 CO 0.08 0.91 0.28 -0.22 -0.60 0.00 0.00 178.31 178.75 3m47 h LYS 89 N 0.52 0.81 0.00 1.51 3.64 -0.85 0.99 116.57 123.20 3m47 h LYS 89 Ca 0.05 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 3m47 h LYS 89 Cb 0.88 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.54 3m47 h LYS 89 CO 0.08 0.63 0.00 0.00 -2.27 0.00 0.00 179.45 177.89 3m47 n ALA 90 N -2.45 1.84 0.00 5.00 0.00 -0.73 -4.87 120.51 119.30 3m47 n ALA 90 Ca 0.05 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.42 3m47 n ALA 90 Cb 0.13 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.31 3m47 n ALA 90 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3m47 n GLY 91 N 0.13 0.77 3.76 0.00 0.00 0.34 -3.61 105.19 106.57 3m47 n GLY 91 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 3m47 n GLY 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m47 n ALA 92 N -1.19 2.51 0.10 4.61 0.00 -0.96 -4.84 120.51 120.74 3m47 n ALA 92 Ca 0.00 0.36 -0.03 0.00 0.00 0.00 0.00 53.44 53.76 3m47 n ALA 92 Cb 0.00 -2.45 -0.01 0.00 0.00 0.00 0.00 19.45 16.99 3m47 n ALA 92 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3m47 h ASP 93 N 4.02 0.00 -5.10 0.00 3.32 -1.44 -3.42 116.42 113.79 3m47 h ASP 93 Ca -0.49 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 56.52 3m47 h ASP 93 Cb 1.23 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 40.66 3m47 h ASP 93 CO 0.73 0.80 -0.06 0.00 -1.72 0.00 0.00 179.24 178.99 3m47 s ALA 94 N -2.97 -0.84 0.00 3.45 0.00 -1.01 -1.85 121.76 118.55 3m47 s ALA 94 Ca 0.01 -0.21 0.00 0.00 0.00 0.00 0.00 51.96 51.77 3m47 s ALA 94 Cb 0.10 0.78 -0.01 0.00 0.00 0.00 0.00 23.12 23.99 3m47 s ALA 94 CO 0.79 -0.71 -0.01 -1.50 0.00 0.00 0.00 175.76 174.33 3m47 s ILE 95 N -3.85 0.07 -0.21 0.00 2.07 -0.47 -0.63 121.20 118.18 3m47 s ILE 95 Ca 0.07 -0.23 -0.11 0.00 -1.41 0.00 0.00 60.65 58.96 3m47 s ILE 95 Cb 0.01 -0.11 -0.05 0.00 0.13 0.00 0.00 42.46 42.44 3m47 s ILE 95 CO -0.07 -0.10 0.19 -0.63 -1.91 0.00 0.00 174.94 172.42 3m47 s ILE 96 N -0.35 5.35 0.19 2.00 1.01 -0.47 -0.41 121.20 128.53 3m47 s ILE 96 Ca -0.03 0.29 0.10 0.00 0.00 0.00 0.00 60.65 61.00 3m47 s ILE 96 Cb -0.02 -3.53 -0.04 0.00 0.01 0.00 0.00 42.46 38.87 3m47 s ILE 96 CO -0.00 0.37 -0.21 0.68 0.00 0.00 0.00 174.94 175.78 3m47 s VAL 97 N 0.77 2.15 0.34 2.92 -7.23 0.06 -1.68 120.40 117.72 3m47 s VAL 97 Ca 0.10 -2.02 -0.24 0.00 -1.81 0.00 0.00 61.98 58.01 3m47 s VAL 97 Cb -0.13 -2.03 -0.10 0.00 0.56 0.00 0.00 36.38 34.69 3m47 s VAL 97 CO 0.02 -0.22 0.92 -1.00 -0.31 0.00 0.00 175.10 174.51 3m47 s HIS 98 N -1.90 3.61 -0.39 2.82 3.76 -0.26 -0.41 115.29 122.52 3m47 s HIS 98 Ca 0.20 1.70 0.23 0.00 -0.15 0.00 0.00 55.06 57.03 3m47 s HIS 98 Cb -0.07 -2.87 -0.04 0.00 1.11 0.00 0.00 32.58 30.70 3m47 s HIS 98 CO 0.09 0.15 0.92 0.41 -0.85 0.00 0.00 174.74 175.47 3m47 n GLY 99 N 0.31 -1.24 0.25 -2.22 0.00 -1.24 -4.52 105.19 96.53 3m47 n GLY 99 Ca 0.03 -0.38 0.09 0.00 0.00 0.00 0.00 46.02 45.76 3m47 n GLY 99 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 173.32 173.59 3m47 h PHE 100 N 0.00 0.00 0.00 1.61 -5.15 -1.94 0.27 116.94 111.72 3m47 h PHE 100 Ca 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.77 3m47 h PHE 100 Cb 0.86 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.03 3m47 h PHE 100 CO 0.00 0.14 0.00 -2.30 -2.00 0.00 0.00 178.31 174.15 3m47 n PRO 101 N -4.01 0.65 0.00 6.09 -0.02 -1.26 -4.99 135.00 131.46 3m47 n PRO 101 Ca -0.02 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.46 3m47 n PRO 101 Cb 0.22 -1.46 0.00 0.00 -0.02 0.00 0.00 33.50 32.24 3m47 n PRO 101 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3m47 n GLY 102 N 0.28 0.33 0.24 -1.23 0.00 0.08 -4.57 105.19 100.33 3m47 n GLY 102 Ca 0.14 -2.08 -0.13 0.00 0.00 0.00 0.00 46.02 43.95 3m47 n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m47 h ALA 103 N 0.00 0.54 -0.13 4.61 0.00 -1.94 -2.53 119.26 119.81 3m47 h ALA 103 Ca 0.00 -0.51 -0.11 0.00 0.00 0.00 0.00 54.91 54.28 3m47 h ALA 103 Cb 0.00 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3m47 h ALA 103 CO 0.00 0.68 -0.43 0.38 0.00 0.00 0.00 179.25 179.89 3m47 h ASP 104 N 0.61 0.31 -0.37 0.00 3.04 -1.99 0.88 116.42 118.91 3m47 h ASP 104 Ca 0.02 -0.14 -0.11 0.00 -3.24 0.00 0.00 57.03 53.56 3m47 h ASP 104 Cb 1.13 -0.09 -0.02 0.00 -1.04 0.00 0.00 39.33 39.32 3m47 h ASP 104 CO 0.12 0.71 -0.17 0.28 -2.04 0.00 0.00 179.24 178.13 3m47 h SER 105 N 0.25 0.86 -0.27 4.15 0.02 -1.77 -1.45 113.55 115.33 3m47 h SER 105 Ca 0.02 -0.29 -0.10 0.00 -0.84 0.00 0.00 61.79 60.58 3m47 h SER 105 Cb 0.86 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 63.16 3m47 h SER 105 CO 0.07 1.02 -0.22 0.58 -1.14 0.00 0.00 176.83 177.14 3m47 h VAL 106 N 0.75 1.31 -0.57 2.27 2.07 -1.05 -3.18 116.25 117.84 3m47 h VAL 106 Ca 0.11 -1.36 -0.01 0.00 0.82 0.00 0.00 66.70 66.27 3m47 h VAL 106 Cb 0.69 1.58 -0.03 0.00 -1.52 0.00 0.00 31.29 32.02 3m47 h VAL 106 CO 0.05 0.43 0.33 -0.09 0.02 0.00 0.00 177.57 178.31 3m47 h ARG 107 N 0.36 0.78 -0.88 1.57 2.43 -0.65 -0.92 114.38 117.07 3m47 h ARG 107 Ca 0.05 -0.07 0.08 0.00 -0.81 0.00 0.00 59.98 59.23 3m47 h ARG 107 Cb 0.76 -0.16 -0.06 0.00 -0.42 0.00 0.00 29.97 30.09 3m47 h ARG 107 CO 0.06 0.56 0.57 0.00 -1.51 0.00 0.00 179.97 179.65 3m47 h ALA 108 N 1.57 1.60 -0.16 2.80 0.00 -1.25 0.11 119.26 123.93 3m47 h ALA 108 Ca 0.21 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 55.01 3m47 h ALA 108 Cb -0.00 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 3m47 h ALA 108 CO -0.04 0.24 -0.26 0.00 0.00 0.00 0.00 179.25 179.20 3m47 h LEU 110 N 0.09 0.82 -0.28 0.00 3.38 -0.63 -1.06 115.31 117.63 3m47 h LEU 110 Ca 0.01 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 3m47 h LEU 110 Cb 0.84 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 3m47 h LEU 110 CO 0.06 0.57 0.18 0.78 0.09 0.00 0.00 178.44 180.12 3m47 h ASN 111 N 0.95 0.32 -0.31 -0.43 2.35 -0.73 -0.81 115.58 116.92 3m47 h ASN 111 Ca 0.30 -0.01 -0.15 0.00 -0.55 0.00 0.00 56.30 55.89 3m47 h ASN 111 Cb 0.03 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 38.31 3m47 h ASN 111 CO -0.09 0.23 -0.38 0.58 -1.65 0.00 0.00 177.43 176.12 3m47 h VAL 112 N 0.38 1.28 -0.75 2.81 2.07 -1.33 -1.96 116.25 118.75 3m47 h VAL 112 Ca 0.11 -1.56 0.01 0.00 0.82 0.00 0.00 66.70 66.08 3m47 h VAL 112 Cb -0.04 1.40 -0.04 0.00 -1.52 0.00 0.00 31.29 31.10 3m47 h VAL 112 CO -0.03 0.52 0.49 0.00 0.02 0.00 0.00 177.57 178.57 3m47 h ALA 113 N 0.86 0.95 -0.26 1.67 0.00 -0.99 -0.53 119.26 120.95 3m47 h ALA 113 Ca 0.06 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 3m47 h ALA 113 Cb 0.96 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 3m47 h ALA 113 CO 0.09 0.38 0.03 1.49 0.00 0.00 0.00 179.25 181.24 3m47 h GLU 114 N 1.02 0.44 -0.68 0.00 4.81 -0.97 0.95 114.58 120.15 3m47 h GLU 114 Ca 0.27 -0.12 0.09 0.00 -0.13 0.00 0.00 59.36 59.47 3m47 h GLU 114 Cb -0.11 -0.05 -0.07 0.00 0.63 0.00 0.00 28.75 29.16 3m47 h GLU 114 CO -0.06 0.58 0.32 1.49 -0.73 0.00 0.00 179.01 180.61 3m47 h GLU 115 N 0.24 0.53 -0.02 1.92 4.81 -1.10 -3.02 114.58 117.94 3m47 h GLU 115 Ca 0.08 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.28 3m47 h GLU 115 Cb 0.36 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.62 3m47 h GLU 115 CO 0.01 0.35 -0.04 -1.33 -0.73 0.00 0.00 179.01 177.27 3m47 n MET 116 N -4.90 2.02 -2.77 1.92 2.81 -0.23 -4.96 117.12 111.02 3m47 n MET 116 Ca 0.10 -1.56 -0.10 0.00 -1.81 0.00 0.00 57.70 54.33 3m47 n MET 116 Cb 0.27 -1.47 0.02 0.00 -0.71 0.00 0.00 33.22 31.34 3m47 n MET 116 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3m47 n GLY 117 N 1.31 0.19 1.19 3.03 0.00 -0.11 -5.05 105.19 105.75 3m47 n GLY 117 Ca 0.15 -0.32 -0.11 0.00 0.00 0.00 0.00 46.02 45.74 3m47 n GLY 117 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3m47 n ARG 118 N -2.37 1.52 -4.51 1.61 5.12 0.14 -5.03 116.66 113.14 3m47 n ARG 118 Ca -0.03 -1.21 -0.23 0.00 -1.93 0.00 0.00 57.85 54.45 3m47 n ARG 118 Cb 0.54 0.35 -0.14 0.00 -1.16 0.00 0.00 32.46 32.06 3m47 n ARG 118 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 3m47 s GLU 119 N -2.59 1.21 -0.14 5.56 0.41 -0.77 -4.49 118.70 117.88 3m47 s GLU 119 Ca 0.01 -0.89 -0.02 0.00 -0.41 0.00 0.00 54.97 53.66 3m47 s GLU 119 Cb 0.00 -1.29 -0.02 0.00 -1.78 0.00 0.00 34.13 31.03 3m47 s GLU 119 CO 0.00 0.33 -0.08 0.08 -0.49 0.00 0.00 175.26 175.10 3m47 s VAL 120 N -0.84 3.50 -0.21 2.63 1.01 -1.26 -1.37 120.40 123.86 3m47 s VAL 120 Ca 0.05 -0.50 -0.08 0.00 0.00 0.00 0.00 61.98 61.44 3m47 s VAL 120 Cb -0.09 -2.50 -0.04 0.00 0.00 0.00 0.00 36.38 33.75 3m47 s VAL 120 CO 0.02 0.51 0.09 -0.36 0.00 0.00 0.00 175.10 175.36 3m47 s PHE 121 N 0.32 3.27 -0.21 5.22 0.40 0.45 -4.12 117.98 123.32 3m47 s PHE 121 Ca -0.07 0.09 -0.21 0.00 -0.60 0.00 0.00 56.93 56.15 3m47 s PHE 121 Cb -0.15 -2.15 -0.02 0.00 0.51 0.00 0.00 43.02 41.21 3m47 s PHE 121 CO 0.04 0.10 0.62 -1.17 0.70 0.00 0.00 175.22 175.51 3m47 s LEU 122 N 0.66 4.13 -0.43 -0.37 2.96 0.05 -0.76 118.68 124.93 3m47 s LEU 122 Ca 0.05 0.80 -0.26 0.00 -0.22 0.00 0.00 54.13 54.50 3m47 s LEU 122 Cb -0.13 -2.87 0.02 0.00 0.50 0.00 0.00 46.19 43.71 3m47 s LEU 122 CO 0.01 -0.28 0.95 -0.22 -1.32 0.00 0.00 176.35 175.49 3m47 s LEU 123 N 1.98 3.96 0.17 -0.68 2.96 0.45 -0.71 118.68 126.80 3m47 s LEU 123 Ca 0.28 0.35 0.22 0.00 -0.22 0.00 0.00 54.13 54.75 3m47 s LEU 123 Cb -0.16 -3.27 -0.03 0.00 0.50 0.00 0.00 46.19 43.23 3m47 s LEU 123 CO 0.10 -1.00 0.99 0.35 -1.32 0.00 0.00 176.35 175.47 3m47 n THR 124 N 6.29 0.69 -3.58 3.68 -2.24 -0.81 -3.63 114.28 114.69 3m47 n THR 124 Ca 0.07 -0.57 -0.06 0.00 -2.27 0.00 0.00 64.05 61.22 3m47 n THR 124 Cb 0.48 -0.39 -0.02 0.00 -2.10 0.00 0.00 70.33 68.31 3m47 n THR 124 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 3m47 s GLU 125 N -3.30 0.83 0.18 -0.78 2.12 -1.26 -4.27 118.70 112.21 3m47 s GLU 125 Ca -0.01 -0.36 0.05 0.00 0.36 0.00 0.00 54.97 55.01 3m47 s GLU 125 Cb 0.10 0.34 -0.05 0.00 0.26 0.00 0.00 34.13 34.78 3m47 s GLU 125 CO 0.80 -0.37 -0.08 -1.64 -0.54 0.00 0.00 175.26 173.43 3m47 s MET 126 N -3.04 1.20 0.00 4.30 -1.94 -1.26 -4.49 119.30 114.06 3m47 s MET 126 Ca 0.08 -1.55 0.10 0.00 -1.71 0.00 0.00 55.69 52.61 3m47 s MET 126 Cb -0.01 -0.73 0.04 0.00 2.01 0.00 0.00 34.83 36.15 3m47 s MET 126 CO -0.06 0.05 0.74 -1.13 -0.01 0.00 0.00 175.02 174.60 3m47 n SER 127 N -0.30 1.57 -4.84 3.03 3.41 -1.26 -4.81 113.62 110.41 3m47 n SER 127 Ca -0.08 -1.28 -0.32 0.00 -0.26 0.00 0.00 58.87 56.93 3m47 n SER 127 Cb 0.62 0.20 0.01 0.00 -0.26 0.00 0.00 64.21 64.77 3m47 n SER 127 CO 0.00 0.00 0.00 -1.38 -0.16 0.00 0.00 175.04 173.50 3m47 s HIS 128 N -1.06 3.36 0.26 7.33 -3.43 -1.26 -4.93 115.29 115.56 3m47 s HIS 128 Ca 0.10 1.41 -0.01 0.00 -0.80 0.00 0.00 55.06 55.76 3m47 s HIS 128 Cb 0.08 -2.82 0.53 0.00 -1.43 0.00 0.00 32.58 28.93 3m47 s HIS 128 CO 0.18 -0.78 1.78 -1.35 -2.00 0.00 0.00 174.74 172.57 3m47 h PRO 129 N 0.10 0.70 0.00 -0.38 0.11 -2.05 0.44 132.00 130.90 3m47 h PRO 129 Ca -0.45 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3m47 h PRO 129 Cb 1.20 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.15 3m47 h PRO 129 CO 0.60 0.46 0.00 0.78 -0.21 0.00 0.00 178.00 179.63 3m47 h GLY 130 N 0.72 0.00 2.00 -0.55 0.00 -1.99 -2.69 103.07 100.56 3m47 h GLY 130 Ca 0.46 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.79 3m47 h GLY 130 CO -0.33 0.00 -0.01 0.00 0.00 0.00 0.00 176.54 176.20 3m47 h ALA 131 N 1.99 1.02 -0.02 3.60 0.00 -1.22 -2.28 119.26 122.35 3m47 h ALA 131 Ca 0.00 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 3m47 h ALA 131 Cb 0.01 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3m47 h ALA 131 CO 0.00 0.01 -0.14 1.49 0.00 0.00 0.00 179.25 180.61 3m47 h GLU 132 N 0.00 0.04 -0.07 0.00 4.22 -1.67 0.53 114.58 117.62 3m47 h GLU 132 Ca -0.00 -0.01 -0.00 0.00 0.08 0.00 0.00 59.36 59.43 3m47 h GLU 132 Cb 0.25 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.49 3m47 h GLU 132 CO 0.00 0.18 0.04 0.52 -2.18 0.00 0.00 179.01 177.57 3m47 h MET 133 N 0.03 0.10 0.00 1.92 0.00 -1.66 -3.41 114.93 111.92 3m47 h MET 133 Ca 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 59.70 59.69 3m47 h MET 133 Cb 0.27 -0.02 0.00 0.00 0.00 0.00 0.00 31.60 31.85 3m47 h MET 133 CO 0.02 0.15 -0.34 1.19 0.00 0.00 0.00 176.91 177.92 3m47 n PHE 134 N -4.99 0.00 -0.05 -0.22 3.01 -1.24 -4.90 117.46 109.07 3m47 n PHE 134 Ca -0.06 0.00 -0.14 0.00 1.01 0.00 0.00 57.45 58.26 3m47 n PHE 134 Cb 0.07 0.00 -0.08 0.00 -0.01 0.00 0.00 39.48 39.46 3m47 n PHE 134 CO 0.00 0.00 0.00 0.82 1.01 0.00 0.00 176.76 178.59 3m47 h ILE 135 N 0.00 1.38 -0.51 4.37 2.04 -1.69 -3.12 117.51 119.98 3m47 h ILE 135 Ca 0.00 -1.50 0.08 0.00 1.00 0.00 0.00 64.86 64.44 3m47 h ILE 135 Cb 0.34 2.04 -0.06 0.00 -0.74 0.00 0.00 36.82 38.40 3m47 h ILE 135 CO 0.00 0.44 0.17 -0.61 0.00 0.00 0.00 178.15 178.14 3m47 h GLN 136 N -0.03 0.32 0.00 2.37 4.15 -1.13 -1.27 115.11 119.51 3m47 h GLN 136 Ca 0.01 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.41 3m47 h GLN 136 Cb 0.82 -0.07 0.00 0.00 0.21 0.00 0.00 27.48 28.44 3m47 h GLN 136 CO 0.05 0.21 0.00 0.78 -1.93 0.00 0.00 178.83 177.95 3m47 h GLY 137 N 0.33 0.00 0.27 2.39 0.00 -1.81 -2.75 103.07 101.50 3m47 h GLY 137 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.58 3m47 h GLY 137 CO -0.27 0.00 -0.89 0.00 0.00 0.00 0.00 176.54 175.38 3m47 n ALA 138 N -2.03 4.40 0.04 3.60 0.00 -0.56 -4.68 120.51 121.28 3m47 n ALA 138 Ca 0.00 -0.53 -0.11 0.00 0.00 0.00 0.00 53.44 52.80 3m47 n ALA 138 Cb 0.24 -0.86 -0.06 0.00 0.00 0.00 0.00 19.45 18.77 3m47 n ALA 138 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3m47 h ALA 139 N 2.97 -0.04 -0.88 0.00 0.00 -1.04 0.26 119.26 120.54 3m47 h ALA 139 Ca 0.00 0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.93 3m47 h ALA 139 Cb 0.51 0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.36 3m47 h ALA 139 CO 0.00 -0.54 0.57 -0.44 0.00 0.00 0.00 179.25 178.84 3m47 h ASP 140 N -0.08 1.03 0.03 0.00 5.19 -1.83 -0.67 116.42 120.08 3m47 h ASP 140 Ca 0.03 -0.04 -0.13 0.00 -0.62 0.00 0.00 57.03 56.27 3m47 h ASP 140 Cb 0.12 -0.26 -0.01 0.00 0.18 0.00 0.00 39.33 39.36 3m47 h ASP 140 CO -0.07 0.76 -0.43 -0.08 -3.12 0.00 0.00 179.24 176.30 3m47 h GLU 141 N 1.20 0.49 -0.44 3.56 4.81 -1.74 -0.94 114.58 121.52 3m47 h GLU 141 Ca 0.32 -0.26 -0.06 0.00 -0.13 0.00 0.00 59.36 59.23 3m47 h GLU 141 Cb -0.12 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.26 3m47 h GLU 141 CO -0.07 0.83 0.02 0.82 -0.73 0.00 0.00 179.01 179.89 3m47 h ILE 142 N 0.40 1.26 -0.70 2.32 2.04 -0.55 -0.20 117.51 122.09 3m47 h ILE 142 Ca 0.03 -0.99 0.00 0.00 1.00 0.00 0.00 64.86 64.90 3m47 h ILE 142 Cb 0.92 1.04 -0.03 0.00 -0.74 0.00 0.00 36.82 38.01 3m47 h ILE 142 CO 0.08 0.34 0.44 0.00 0.00 0.00 0.00 178.15 179.01 3m47 h ALA 143 N 0.91 0.89 -0.49 1.87 0.00 -0.87 -1.11 119.26 120.46 3m47 h ALA 143 Ca 0.13 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 3m47 h ALA 143 Cb 0.46 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 3m47 h ALA 143 CO 0.02 0.34 0.02 0.00 0.00 0.00 0.00 179.25 179.63 3m47 h ARG 144 N 0.95 0.81 -0.63 0.00 3.08 -0.98 -1.53 114.38 116.07 3m47 h ARG 144 Ca 0.25 -0.21 0.01 0.00 0.07 0.00 0.00 59.98 60.10 3m47 h ARG 144 Cb -0.07 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 29.85 3m47 h ARG 144 CO -0.05 0.80 0.41 1.98 -1.07 0.00 0.00 179.97 182.04 3m47 h MET 145 N 0.76 0.81 -0.10 0.04 4.05 -0.50 -0.58 114.93 119.40 3m47 h MET 145 Ca 0.15 -0.05 0.02 0.00 -0.28 0.00 0.00 59.70 59.54 3m47 h MET 145 Cb 0.43 -0.18 -0.02 0.00 -0.80 0.00 0.00 31.60 31.03 3m47 h MET 145 CO 0.02 0.53 -0.02 0.78 0.23 0.00 0.00 176.91 178.45 3m47 h GLY 146 N 0.83 0.08 0.70 1.39 0.00 -0.62 -2.14 103.07 103.32 3m47 h GLY 146 Ca 0.24 0.03 0.06 0.00 0.00 0.00 0.00 47.33 47.66 3m47 h GLY 146 CO -0.06 -0.03 0.51 -2.08 0.00 0.00 0.00 176.54 174.88 3m47 h VAL 147 N 0.01 1.02 0.00 4.60 2.07 -0.97 -0.06 116.25 122.93 3m47 h VAL 147 Ca 0.05 -0.32 -0.04 0.00 0.82 0.00 0.00 66.70 67.21 3m47 h VAL 147 Cb 0.07 0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 29.84 3m47 h VAL 147 CO -0.10 0.17 -0.17 0.44 0.02 0.00 0.00 177.57 177.93 3m47 h ASP 148 N 0.93 0.00 -0.08 0.57 3.32 -0.69 -1.74 116.42 118.74 3m47 h ASP 148 Ca 0.37 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.42 3m47 h ASP 148 Cb 0.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.74 3m47 h ASP 148 CO -0.18 0.17 0.00 0.18 -1.72 0.00 0.00 179.24 177.69 3m47 n LEU 149 N -3.45 2.34 -0.36 1.55 4.77 -0.71 -4.96 117.00 116.19 3m47 n LEU 149 Ca -0.01 -0.84 -0.04 0.00 -0.03 0.00 0.00 56.01 55.09 3m47 n LEU 149 Cb 0.35 -0.04 -0.02 0.00 -2.33 0.00 0.00 43.42 41.38 3m47 n LEU 149 CO 0.31 0.42 -0.04 0.61 -1.33 0.00 0.00 177.39 177.36 3m47 n GLY 150 N 1.28 0.65 3.76 -0.72 0.00 -0.65 -5.01 105.19 104.49 3m47 n GLY 150 Ca 0.17 -0.85 -0.41 0.00 0.00 0.00 0.00 46.02 44.93 3m47 n GLY 150 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3m47 s VAL 151 N -2.17 2.21 -0.54 1.61 1.01 -0.12 -4.92 120.40 117.48 3m47 s VAL 151 Ca 0.00 0.18 0.07 0.00 0.00 0.00 0.00 61.98 62.23 3m47 s VAL 151 Cb 0.00 -3.12 -0.02 0.00 0.00 0.00 0.00 36.38 33.24 3m47 s VAL 151 CO 0.00 0.03 0.45 0.29 0.00 0.00 0.00 175.10 175.88 3m47 n LYS 152 N 1.82 2.97 -4.35 2.72 4.76 -1.26 -4.64 118.16 120.18 3m47 n LYS 152 Ca 0.06 -0.37 -0.22 0.00 -2.87 0.00 0.00 58.31 54.92 3m47 n LYS 152 Cb 0.38 -0.94 -0.16 0.00 -1.84 0.00 0.00 35.03 32.48 3m47 n LYS 152 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 3m47 s ASN 153 N -1.21 1.27 0.04 4.39 0.01 -1.26 -0.29 114.94 117.88 3m47 s ASN 153 Ca 0.05 -0.20 0.04 0.00 -0.71 0.00 0.00 52.86 52.04 3m47 s ASN 153 Cb 0.05 -0.57 -0.02 0.00 0.41 0.00 0.00 41.25 41.12 3m47 s ASN 153 CO 0.20 -0.01 -0.12 -0.31 -1.51 0.00 0.00 177.10 175.35 3m47 s TYR 154 N 0.72 1.04 -0.18 2.20 1.51 0.61 -0.77 117.35 122.48 3m47 s TYR 154 Ca -0.12 -0.36 -0.03 0.00 -1.01 0.00 0.00 57.07 55.55 3m47 s TYR 154 Cb -0.14 -0.62 -0.01 0.00 -0.11 0.00 0.00 41.96 41.08 3m47 s TYR 154 CO 0.02 0.01 -0.07 0.08 -1.11 0.00 0.00 175.55 174.47 3m47 s VAL 155 N -0.92 3.30 0.42 0.71 1.01 0.11 -1.32 120.40 123.71 3m47 s VAL 155 Ca -0.01 -0.54 0.06 0.00 0.00 0.00 0.00 61.98 61.48 3m47 s VAL 155 Cb -0.08 -2.45 0.06 0.00 0.00 0.00 0.00 36.38 33.90 3m47 s VAL 155 CO 0.01 0.47 0.47 0.61 0.00 0.00 0.00 175.10 176.66 3m47 n GLY 156 N 4.23 2.34 3.77 4.51 0.00 -0.39 -1.93 105.19 117.72 3m47 n GLY 156 Ca -0.18 -2.23 -0.39 0.00 0.00 0.00 0.00 46.02 43.22 3m47 n GLY 156 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3m47 s PRO 157 N -3.84 4.27 0.12 1.61 0.02 -1.26 -4.65 135.00 131.27 3m47 s PRO 157 Ca 0.36 1.89 -0.24 0.00 0.02 0.00 0.00 61.00 63.03 3m47 s PRO 157 Cb -0.03 -2.88 -0.04 0.00 0.02 0.00 0.00 34.50 31.57 3m47 s PRO 157 CO 0.23 -0.15 1.66 1.03 -0.33 0.00 0.00 177.00 179.43 3m47 h SER 158 N 3.07 -0.57 -5.01 2.53 0.87 -1.91 -3.41 113.55 109.12 3m47 h SER 158 Ca -0.48 0.09 -0.39 0.00 -1.23 0.00 0.00 61.79 59.78 3m47 h SER 158 Cb 1.23 0.25 -0.04 0.00 -0.44 0.00 0.00 62.40 63.40 3m47 h SER 158 CO 0.64 -0.25 -0.20 0.35 -0.53 0.00 0.00 176.83 176.85 3m47 n THR 159 N -5.33 0.00 -2.37 2.23 -2.24 -1.26 -4.54 114.28 100.78 3m47 n THR 159 Ca -0.04 -1.47 -0.01 0.00 -2.27 0.00 0.00 64.05 60.25 3m47 n THR 159 Cb 0.24 -0.14 0.00 0.00 -2.10 0.00 0.00 70.33 68.33 3m47 n THR 159 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3m47 n ARG 160 N -1.32 -2.30 -0.29 -0.78 1.74 -1.26 -4.77 116.66 107.68 3m47 n ARG 160 Ca -0.03 2.02 0.11 0.00 -0.77 0.00 0.00 57.85 59.18 3m47 n ARG 160 Cb 0.42 -4.14 0.25 0.00 -1.02 0.00 0.00 32.46 27.97 3m47 n ARG 160 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 3m47 h PRO 161 N 1.99 0.16 0.00 5.56 0.11 -1.96 -0.55 132.00 137.31 3m47 h PRO 161 Ca 0.00 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.10 3m47 h PRO 161 Cb 0.14 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.21 3m47 h PRO 161 CO 0.08 0.10 0.00 1.05 -0.21 0.00 0.00 178.00 179.03 3m47 h GLU 162 N 0.16 0.00 -0.16 1.05 9.09 -2.00 -1.28 114.58 121.45 3m47 h GLU 162 Ca 0.51 0.00 -0.19 0.00 0.05 0.00 0.00 59.36 59.74 3m47 h GLU 162 Cb 1.00 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 28.10 3m47 h GLU 162 CO -0.68 0.00 -0.66 0.00 0.05 0.00 0.00 179.01 177.72 3m47 h ARG 163 N 0.00 0.61 -0.68 1.06 2.47 -1.40 -2.77 114.38 113.68 3m47 h ARG 163 Ca 0.00 -0.45 -0.08 0.00 -1.26 0.00 0.00 59.98 58.20 3m47 h ARG 163 Cb 0.34 0.08 -0.03 0.00 -1.65 0.00 0.00 29.97 28.71 3m47 h ARG 163 CO 0.00 1.07 0.13 -0.07 0.56 0.00 0.00 179.97 181.65 3m47 h LEU 164 N 0.44 1.06 -0.82 3.04 4.07 -1.19 -0.27 115.31 121.63 3m47 h LEU 164 Ca -0.02 -0.25 -0.04 0.00 0.08 0.00 0.00 57.88 57.65 3m47 h LEU 164 Cb 1.25 -0.28 -0.04 0.00 1.08 0.00 0.00 40.66 42.67 3m47 h LEU 164 CO 0.13 1.04 0.35 -1.28 -1.08 0.00 0.00 178.44 177.60 3m47 h SER 165 N 1.03 1.11 -0.26 -0.43 0.87 -1.50 0.21 113.55 114.59 3m47 h SER 165 Ca 0.21 -0.16 -0.05 0.00 -1.23 0.00 0.00 61.79 60.55 3m47 h SER 165 Cb 0.42 -0.29 -0.01 0.00 -0.44 0.00 0.00 62.40 62.09 3m47 h SER 165 CO 0.01 0.97 -0.03 -0.09 -0.53 0.00 0.00 176.83 177.16 3m47 h ARG 166 N 1.19 0.48 -0.44 2.24 9.65 -1.23 -0.23 114.38 126.03 3m47 h ARG 166 Ca 0.28 -0.17 -0.00 0.00 -1.10 0.00 0.00 59.98 58.98 3m47 h ARG 166 Cb 0.19 -0.03 -0.02 0.00 -1.39 0.00 0.00 29.97 28.71 3m47 h ARG 166 CO -0.03 0.68 0.27 1.25 2.80 0.00 0.00 179.97 184.94 3m47 h LEU 167 N 0.24 0.53 -1.00 3.80 5.85 -0.75 -1.64 115.31 122.34 3m47 h LEU 167 Ca 0.07 -0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.71 3m47 h LEU 167 Cb 0.48 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.34 3m47 h LEU 167 CO 0.02 0.43 0.39 -0.09 -0.34 0.00 0.00 178.44 178.85 3m47 h ARG 168 N 0.59 1.10 -0.45 1.25 9.65 -0.48 -0.41 114.38 125.63 3m47 h ARG 168 Ca 0.16 -0.14 0.03 0.00 -1.10 0.00 0.00 59.98 58.93 3m47 h ARG 168 Cb -0.00 -0.21 -0.04 0.00 -1.39 0.00 0.00 29.97 28.33 3m47 h ARG 168 CO -0.03 0.83 0.23 1.49 2.80 0.00 0.00 179.97 185.29 3m47 h GLU 169 N 1.10 0.45 -0.31 0.20 4.81 -0.63 -1.16 114.58 119.03 3m47 h GLU 169 Ca 0.27 -0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 59.42 3m47 h GLU 169 Cb 0.08 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.35 3m47 h GLU 169 CO -0.04 0.29 -0.02 0.82 -0.73 0.00 0.00 179.01 179.34 3m47 h ILE 170 N 0.46 1.26 0.00 2.32 2.04 -0.34 -3.25 117.51 119.99 3m47 h ILE 170 Ca 0.19 -0.99 0.00 0.00 1.00 0.00 0.00 64.86 65.06 3m47 h ILE 170 Cb 0.09 1.29 0.00 0.00 -0.74 0.00 0.00 36.82 37.46 3m47 h ILE 170 CO -0.13 0.32 -0.36 2.30 0.00 0.00 0.00 178.15 180.28 3m47 n ILE 171 N -4.53 0.39 0.00 -0.67 -5.35 -0.26 -4.94 119.36 104.00 3m47 n ILE 171 Ca -0.02 -0.24 0.00 0.00 -0.27 0.00 0.00 62.75 62.21 3m47 n ILE 171 Cb 0.28 -0.28 0.00 0.00 -1.74 0.00 0.00 39.64 37.90 3m47 n ILE 171 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3m47 n GLY 172 N 1.35 -0.27 0.03 3.28 0.00 -0.45 -4.45 105.19 104.68 3m47 n GLY 172 Ca 0.04 -1.80 0.13 0.00 0.00 0.00 0.00 46.02 44.39 3m47 n GLY 172 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3m47 n GLN 173 N -0.26 0.11 -0.06 1.61 1.13 -1.26 -4.14 117.38 114.50 3m47 n GLN 173 Ca 0.00 0.05 -0.12 0.00 -1.94 0.00 0.00 57.00 54.99 3m47 n GLN 173 Cb 0.00 -1.59 -0.14 0.00 0.11 0.00 0.00 30.24 28.62 3m47 n GLN 173 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 3m47 n ASP 174 N -1.76 0.91 -4.69 1.08 8.00 -1.26 -4.97 116.55 113.86 3m47 n ASP 174 Ca 0.05 0.14 -0.32 0.00 0.71 0.00 0.00 54.79 55.38 3m47 n ASP 174 Cb 0.38 0.16 0.14 0.00 -0.02 0.00 0.00 41.12 41.78 3m47 n ASP 174 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 3m47 s SER 175 N -6.08 3.31 -0.17 -2.24 0.01 -1.26 -4.89 113.70 102.38 3m47 s SER 175 Ca -0.14 2.24 -0.16 0.00 1.31 0.00 0.00 55.95 59.20 3m47 s SER 175 Cb 0.07 -2.57 -0.04 0.00 0.21 0.00 0.00 66.02 63.69 3m47 s SER 175 CO 0.78 -2.85 0.42 0.12 0.41 0.00 0.00 173.24 172.12 3m47 s PHE 176 N -2.45 3.42 -0.08 2.43 5.36 0.60 -4.97 117.98 122.28 3m47 s PHE 176 Ca 0.69 0.70 0.02 0.00 -0.96 0.00 0.00 56.93 57.38 3m47 s PHE 176 Cb -0.25 -2.52 0.01 0.00 -0.34 0.00 0.00 43.02 39.92 3m47 s PHE 176 CO 0.54 0.06 -0.15 -1.17 -1.46 0.00 0.00 175.22 173.05 3m47 s LEU 177 N 1.05 1.72 0.07 6.12 2.96 -1.26 -0.28 118.68 129.06 3m47 s LEU 177 Ca 0.21 -0.38 0.10 0.00 -0.22 0.00 0.00 54.13 53.84 3m47 s LEU 177 Cb -0.15 -0.99 -0.03 0.00 0.50 0.00 0.00 46.19 45.52 3m47 s LEU 177 CO 0.08 0.04 -0.25 0.27 -1.32 0.00 0.00 176.35 175.17 3m47 s ILE 178 N 0.74 2.27 0.11 6.68 -4.36 -0.43 0.21 121.20 126.41 3m47 s ILE 178 Ca -0.12 -1.49 -0.21 0.00 -0.26 0.00 0.00 60.65 58.56 3m47 s ILE 178 Cb -0.16 -1.94 0.05 0.00 1.25 0.00 0.00 42.46 41.67 3m47 s ILE 178 CO 0.03 0.27 0.52 -0.94 0.24 0.00 0.00 174.94 175.05 3m47 s SER 179 N -1.56 -0.43 0.00 4.36 1.04 -1.07 -1.26 113.70 114.78 3m47 s SER 179 Ca 0.13 -0.01 -0.01 0.00 0.48 0.00 0.00 55.95 56.54 3m47 s SER 179 Cb -0.10 0.52 -0.03 0.00 0.10 0.00 0.00 66.02 66.52 3m47 s SER 179 CO 0.04 -0.84 0.72 -2.65 0.98 0.00 0.00 173.24 171.49 3m47 n PRO 180 N -0.03 0.23 0.00 4.02 -0.02 -1.26 -1.51 135.00 136.43 3m47 n PRO 180 Ca -0.17 -0.09 0.00 0.00 -2.02 0.00 0.00 63.50 61.21 3m47 n PRO 180 Cb 0.63 -1.52 0.00 0.00 -0.02 0.00 0.00 33.50 32.58 3m47 n PRO 180 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3m47 n GLY 190 N 2.60 0.25 0.19 -1.23 0.00 -1.26 -4.58 105.19 101.15 3m47 n GLY 190 Ca 0.04 0.63 0.02 0.00 0.00 0.00 0.00 46.02 46.71 3m47 n GLY 190 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3m47 h GLU 191 N 0.00 0.03 -0.88 1.61 4.39 -2.02 -3.23 114.58 114.47 3m47 h GLU 191 Ca 0.00 -0.01 0.02 0.00 0.34 0.00 0.00 59.36 59.71 3m47 h GLU 191 Cb 0.00 -0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 28.60 3m47 h GLU 191 CO 0.00 0.40 0.57 1.15 -1.16 0.00 0.00 179.01 179.98 3m47 h THR 192 N 0.02 1.19 0.00 1.13 2.02 -1.96 -2.17 112.91 113.14 3m47 h THR 192 Ca -0.00 -0.39 0.00 0.00 0.77 0.00 0.00 66.41 66.79 3m47 h THR 192 Cb 0.68 -0.06 0.00 0.00 -1.74 0.00 0.00 68.15 67.03 3m47 h THR 192 CO 0.05 0.21 0.00 0.18 0.37 0.00 0.00 175.52 176.33 3m47 n LEU 193 N -4.50 0.00 0.22 2.58 4.77 -1.22 -0.61 117.00 118.24 3m47 n LEU 193 Ca 0.10 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 56.19 3m47 n LEU 193 Cb 0.05 0.00 0.35 0.00 -2.33 0.00 0.00 43.42 41.49 3m47 n LEU 193 CO 0.35 0.00 0.79 0.03 -1.33 0.00 0.00 177.39 177.23 3m47 h ARG 194 N 0.00 0.00 0.00 3.23 3.08 -1.54 -3.40 114.38 115.76 3m47 h ARG 194 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3m47 h ARG 194 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 3m47 h ARG 194 CO 0.00 0.16 -0.98 1.19 -1.07 0.00 0.00 179.97 179.27 3m47 n PHE 195 N -3.21 0.00 -3.11 3.04 3.01 -0.61 -5.05 117.46 111.54 3m47 n PHE 195 Ca 0.02 0.00 -0.31 0.00 1.01 0.00 0.00 57.45 58.16 3m47 n PHE 195 Cb 0.49 0.00 -0.05 0.00 -0.01 0.00 0.00 39.48 39.91 3m47 n PHE 195 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3m47 s ALA 196 N -1.99 3.40 -0.12 4.37 0.00 0.22 -4.85 121.76 122.80 3m47 s ALA 196 Ca 0.00 -0.14 0.16 0.00 0.00 0.00 0.00 51.96 51.97 3m47 s ALA 196 Cb 0.00 -2.65 -0.06 0.00 0.00 0.00 0.00 23.12 20.41 3m47 s ALA 196 CO 0.00 0.25 1.09 -0.44 0.00 0.00 0.00 175.76 176.65 3m47 h ASP 197 N 1.93 0.00 -5.04 0.00 3.32 -0.56 -3.39 116.42 112.69 3m47 h ASP 197 Ca -0.47 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.48 3m47 h ASP 197 Cb 1.18 0.00 -0.17 0.00 0.22 0.00 0.00 39.33 40.56 3m47 h ASP 197 CO 0.66 0.57 -0.20 0.00 -1.72 0.00 0.00 179.24 178.55 3m47 s ALA 198 N -2.93 -0.81 0.04 3.45 0.00 -1.18 -4.76 121.76 115.57 3m47 s ALA 198 Ca -0.00 0.17 0.04 0.00 0.00 0.00 0.00 51.96 52.17 3m47 s ALA 198 Cb 0.08 0.28 -0.04 0.00 0.00 0.00 0.00 23.12 23.45 3m47 s ALA 198 CO 0.79 -0.40 -0.04 0.96 0.00 0.00 0.00 175.76 177.07 3m47 s ILE 199 N -2.30 3.79 -0.22 0.00 -4.36 -0.23 -2.59 121.20 115.29 3m47 s ILE 199 Ca -0.07 -0.88 -0.11 0.00 -0.26 0.00 0.00 60.65 59.34 3m47 s ILE 199 Cb -0.02 -2.72 -0.05 0.00 1.25 0.00 0.00 42.46 40.92 3m47 s ILE 199 CO -0.01 0.27 0.16 -0.63 0.24 0.00 0.00 174.94 174.97 3m47 s ILE 200 N -1.13 5.37 -0.05 8.37 1.01 -0.57 -0.45 121.20 133.74 3m47 s ILE 200 Ca 0.21 0.21 0.02 0.00 0.00 0.00 0.00 60.65 61.09 3m47 s ILE 200 Cb -0.11 -3.50 0.01 0.00 0.01 0.00 0.00 42.46 38.87 3m47 s ILE 200 CO 0.12 0.37 -0.10 -0.69 0.00 0.00 0.00 174.94 174.64 3m47 s VAL 201 N 0.84 0.93 0.00 2.92 1.01 -0.21 -4.41 120.40 121.48 3m47 s VAL 201 Ca 0.08 -0.38 0.00 0.00 0.00 0.00 0.00 61.98 61.68 3m47 s VAL 201 Cb -0.13 -0.86 0.00 0.00 0.00 0.00 0.00 36.38 35.39 3m47 s VAL 201 CO 0.03 0.30 0.00 0.61 0.00 0.00 0.00 175.10 176.04 3m47 n GLY 202 N 3.72 0.65 0.27 4.51 0.00 -1.26 -0.86 105.19 112.21 3m47 n GLY 202 Ca -0.22 -0.00 0.05 0.00 0.00 0.00 0.00 46.02 45.85 3m47 n GLY 202 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3m47 h ARG 203 N 0.00 0.35 -1.23 1.61 9.65 -1.97 0.68 114.38 123.47 3m47 h ARG 203 Ca 0.00 -0.02 0.36 0.00 -1.10 0.00 0.00 59.98 59.21 3m47 h ARG 203 Cb 0.00 -0.08 -0.08 0.00 -1.39 0.00 0.00 29.97 28.42 3m47 h ARG 203 CO 0.00 0.23 0.84 0.77 2.80 0.00 0.00 179.97 184.61 3m47 h SER 204 N 0.36 0.19 0.00 -3.80 0.02 -1.95 -0.97 113.55 107.40 3m47 h SER 204 Ca 0.41 0.05 -0.37 0.00 -0.84 0.00 0.00 61.79 61.04 3m47 h SER 204 Cb 0.65 0.03 -0.06 0.00 0.14 0.00 0.00 62.40 63.17 3m47 h SER 204 CO -0.45 -0.01 -2.22 -0.38 -1.14 0.00 0.00 176.83 172.64 3m47 n ILE 205 N -4.40 1.47 0.60 3.27 5.41 0.09 -4.20 119.36 121.59 3m47 n ILE 205 Ca 0.29 -0.28 0.13 0.00 1.00 0.00 0.00 62.75 63.89 3m47 n ILE 205 Cb 1.23 -1.94 0.45 0.00 -0.71 0.00 0.00 39.64 38.66 3m47 n ILE 205 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3m47 n TYR 206 N -4.24 0.77 -0.68 1.39 0.18 -0.36 -2.07 117.16 112.15 3m47 n TYR 206 Ca -0.46 0.25 0.08 0.00 1.88 0.00 0.00 57.90 59.65 3m47 n TYR 206 Cb 0.81 -0.90 0.28 0.00 -0.38 0.00 0.00 39.34 39.14 3m47 n TYR 206 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 3m47 n LEU 207 N -2.15 4.09 -4.85 -3.48 4.77 -0.38 -5.01 117.00 109.99 3m47 n LEU 207 Ca 0.05 -2.60 -0.32 0.00 -0.03 0.00 0.00 56.01 53.10 3m47 n LEU 207 Cb 0.36 -0.49 -0.06 0.00 -2.33 0.00 0.00 43.42 40.90 3m47 n LEU 207 CO 0.27 0.72 0.46 0.00 -1.33 0.00 0.00 177.39 177.51 3m47 s ALA 208 N -2.10 3.28 0.21 -1.18 0.00 -0.88 -4.98 121.76 116.11 3m47 s ALA 208 Ca 0.41 0.05 -0.10 0.00 0.00 0.00 0.00 51.96 52.33 3m47 s ALA 208 Cb 0.29 -2.82 0.27 0.00 0.00 0.00 0.00 23.12 20.87 3m47 s ALA 208 CO 0.16 0.23 1.73 -0.44 0.00 0.00 0.00 175.76 177.44 3m47 h ASP 209 N 1.98 0.17 -3.10 0.00 3.32 -1.93 -3.33 116.42 113.54 3m47 h ASP 209 Ca -0.48 0.08 -0.58 0.00 0.02 0.00 0.00 57.03 56.08 3m47 h ASP 209 Cb 1.18 0.08 -0.40 0.00 0.22 0.00 0.00 39.33 40.41 3m47 h ASP 209 CO 0.64 0.10 -0.77 0.54 -1.72 0.00 0.00 179.24 178.04 3m47 s ASN 210 N -5.37 3.74 0.44 6.45 4.22 -1.26 -5.00 114.94 118.16 3m47 s ASN 210 Ca -0.13 -1.87 0.21 0.00 -2.14 0.00 0.00 52.86 48.93 3m47 s ASN 210 Cb 0.17 -0.77 1.17 0.00 1.28 0.00 0.00 41.25 43.11 3m47 s ASN 210 CO 0.74 -0.37 1.84 -0.65 -2.04 0.00 0.00 177.10 176.62 3m47 h PRO 211 N 7.70 0.31 -0.57 3.55 0.11 -1.73 -0.88 132.00 140.49 3m47 h PRO 211 Ca -0.09 -0.02 0.04 0.00 0.11 0.00 0.00 66.00 66.04 3m47 h PRO 211 Cb 0.99 -0.07 -0.04 0.00 0.11 0.00 0.00 31.00 31.99 3m47 h PRO 211 CO 0.44 0.21 0.32 0.00 -0.21 0.00 0.00 178.00 178.76 3m47 h ALA 212 N 1.59 0.74 0.05 -0.75 0.00 -1.90 0.28 119.26 119.27 3m47 h ALA 212 Ca 0.50 0.00 -0.23 0.00 0.00 0.00 0.00 54.91 55.18 3m47 h ALA 212 Cb 1.39 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 19.05 3m47 h ALA 212 CO -0.17 0.02 -1.04 0.00 0.00 0.00 0.00 179.25 178.06 3m47 h ALA 213 N 1.28 0.31 -0.65 0.00 0.00 -1.56 -2.61 119.26 116.03 3m47 h ALA 213 Ca 0.24 -0.79 -0.08 0.00 0.00 0.00 0.00 54.91 54.28 3m47 h ALA 213 Cb 0.09 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 3m47 h ALA 213 CO -0.13 0.94 0.11 0.00 0.00 0.00 0.00 179.25 180.16 3m47 h ALA 214 N 0.77 0.96 -0.03 0.00 0.00 -0.76 0.34 119.26 120.55 3m47 h ALA 214 Ca -0.08 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.56 3m47 h ALA 214 Cb 1.72 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 19.26 3m47 h ALA 214 CO 0.17 0.65 0.01 0.00 0.00 0.00 0.00 179.25 180.08 3m47 h ALA 215 N 1.11 0.03 -0.97 0.00 0.00 -0.50 -1.94 119.26 116.98 3m47 h ALA 215 Ca 0.20 -0.10 0.05 0.00 0.00 0.00 0.00 54.91 55.05 3m47 h ALA 215 Cb 0.43 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.15 3m47 h ALA 215 CO 0.01 -0.36 0.63 0.00 0.00 0.00 0.00 179.25 179.53 3m47 h ALA 216 N 0.81 1.31 -0.23 0.00 0.00 -1.13 -1.01 119.26 119.01 3m47 h ALA 216 Ca 0.01 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 3m47 h ALA 216 Cb 0.20 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3m47 h ALA 216 CO -0.00 0.47 -0.09 0.78 0.00 0.00 0.00 179.25 180.42 3m47 h GLY 217 N 1.19 0.51 1.72 0.00 0.00 -0.88 -1.39 103.07 104.22 3m47 h GLY 217 Ca 0.40 -0.44 -0.02 0.00 0.00 0.00 0.00 47.33 47.28 3m47 h GLY 217 CO -0.14 0.40 0.09 0.00 0.00 0.00 0.00 176.54 176.89 3m47 h ALA 218 N 0.73 1.68 -0.16 3.60 0.00 -0.95 -1.94 119.26 122.22 3m47 h ALA 218 Ca 0.05 -0.08 -0.19 0.00 0.00 0.00 0.00 54.91 54.69 3m47 h ALA 218 Cb 0.57 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 3m47 h ALA 218 CO 0.03 0.26 -0.66 0.82 0.00 0.00 0.00 179.25 179.70 3m47 h ILE 219 N 0.37 1.32 -0.57 0.00 2.04 -1.02 -3.02 117.51 116.63 3m47 h ILE 219 Ca 0.09 -1.93 0.01 0.00 1.00 0.00 0.00 64.86 64.03 3m47 h ILE 219 Cb 0.10 1.90 -0.03 0.00 -0.74 0.00 0.00 36.82 38.05 3m47 h ILE 219 CO -0.01 0.60 0.38 -0.33 0.00 0.00 0.00 178.15 178.79 3m47 h GLU 220 N 0.44 0.74 -0.61 2.37 4.39 -0.53 -1.47 114.58 119.92 3m47 h GLU 220 Ca -0.02 -0.04 0.14 0.00 0.34 0.00 0.00 59.36 59.78 3m47 h GLU 220 Cb 1.24 -0.17 -0.03 0.00 -0.10 0.00 0.00 28.75 29.69 3m47 h GLU 220 CO 0.13 0.49 0.42 0.77 -1.16 0.00 0.00 179.01 179.66 3m47 h SER 221 N 0.77 0.19 -0.19 1.42 0.02 -1.32 -3.28 113.55 111.15 3m47 h SER 221 Ca 0.21 0.01 -0.58 0.00 -0.84 0.00 0.00 61.79 60.58 3m47 h SER 221 Cb -0.08 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.43 3m47 h SER 221 CO -0.05 0.10 2.11 -0.38 -1.14 0.00 0.00 176.83 177.48 3m47 n ILE 222 N -4.43 2.28 -0.43 3.27 5.41 -0.55 -4.95 119.36 119.96 3m47 n ILE 222 Ca 0.11 -2.13 0.00 0.00 1.00 0.00 0.00 62.75 61.73 3m47 n ILE 222 Cb 0.54 -2.33 0.00 0.00 -0.71 0.00 0.00 39.64 37.14 3m47 n ILE 222 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 176.55 177.72