#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a4u s ASP 2 N 0.00 6.54 0.00 6.12 -1.08 -1.26 -4.61 116.67 122.38 1a4u s ASP 2 Ca 0.00 0.42 0.29 0.00 -0.52 0.00 0.00 52.55 52.74 1a4u s ASP 2 Cb 0.00 -2.37 1.43 0.00 -1.46 0.00 0.00 42.92 40.52 1a4u s ASP 2 CO 0.00 -0.60 1.98 0.18 0.52 0.00 0.00 175.17 177.25 1a4u n LEU 3 N 6.14 0.00 -4.69 -1.34 4.77 -1.26 -4.81 117.00 115.80 1a4u n LEU 3 Ca 0.01 0.30 -0.44 0.00 -0.03 0.00 0.00 56.01 55.85 1a4u n LEU 3 Cb 0.48 -0.30 -0.04 0.00 -2.33 0.00 0.00 43.42 41.24 1a4u n LEU 3 CO 0.50 -0.02 1.35 0.41 -1.33 0.00 0.00 177.39 178.30 1a4u n THR 4 N -1.30 0.14 -1.52 -5.08 -1.04 -1.24 -1.87 114.28 102.38 1a4u n THR 4 Ca 0.13 -0.03 -0.16 0.00 -2.04 0.00 0.00 64.05 61.96 1a4u n THR 4 Cb 0.23 -1.86 -0.06 0.00 -1.82 0.00 0.00 70.33 66.82 1a4u n THR 4 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1a4u n ASN 5 N 4.43 -4.92 -4.88 8.00 5.03 -0.15 -4.91 115.26 117.86 1a4u n ASN 5 Ca 0.17 0.37 -0.31 0.00 0.87 0.00 0.00 54.58 55.68 1a4u n ASN 5 Cb 0.33 -3.85 -0.05 0.00 -1.02 0.00 0.00 39.78 35.19 1a4u n ASN 5 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 1a4u s LYS 6 N -3.46 3.76 -0.26 3.52 -0.14 -0.78 -4.29 119.74 118.09 1a4u s LYS 6 Ca 0.00 0.23 -0.09 0.00 -1.36 0.00 0.00 55.97 54.75 1a4u s LYS 6 Cb 0.00 -2.62 -0.04 0.00 -1.68 0.00 0.00 37.83 33.50 1a4u s LYS 6 CO 0.00 0.25 0.12 -0.80 -0.76 0.00 0.00 175.35 174.16 1a4u s ASN 7 N -2.65 5.49 -0.02 2.83 0.01 -1.26 -1.14 114.94 118.20 1a4u s ASN 7 Ca 0.47 -0.12 0.06 0.00 -0.71 0.00 0.00 52.86 52.56 1a4u s ASN 7 Cb -0.11 -2.00 -0.01 0.00 0.41 0.00 0.00 41.25 39.53 1a4u s ASN 7 CO 0.24 -0.03 -0.20 -0.69 -1.51 0.00 0.00 177.10 174.91 1a4u s VAL 8 N 1.64 1.56 -0.14 1.60 1.01 -0.22 -0.83 120.40 125.01 1a4u s VAL 8 Ca 0.07 -0.84 -0.01 0.00 0.00 0.00 0.00 61.98 61.19 1a4u s VAL 8 Cb -0.15 -1.30 -0.01 0.00 0.00 0.00 0.00 36.38 34.92 1a4u s VAL 8 CO 0.06 0.44 -0.11 -0.63 0.00 0.00 0.00 175.10 174.86 1a4u s ILE 9 N -0.45 3.12 -0.22 2.22 1.01 -0.38 -0.09 121.20 126.40 1a4u s ILE 9 Ca 0.07 -0.63 0.01 0.00 0.00 0.00 0.00 60.65 60.10 1a4u s ILE 9 Cb -0.08 -2.33 0.06 0.00 0.01 0.00 0.00 42.46 40.12 1a4u s ILE 9 CO -0.01 0.51 -0.06 0.12 0.00 0.00 0.00 174.94 175.50 1a4u s PHE 10 N 0.52 2.35 -0.23 3.97 2.19 0.97 -0.66 117.98 127.09 1a4u s PHE 10 Ca -0.08 -1.68 -0.24 0.00 0.33 0.00 0.00 56.93 55.26 1a4u s PHE 10 Cb -0.15 -1.57 -0.01 0.00 -1.31 0.00 0.00 43.02 39.98 1a4u s PHE 10 CO 0.04 -0.76 0.82 0.08 1.83 0.00 0.00 175.22 177.22 1a4u s VAL 11 N 1.41 4.85 -0.43 3.12 1.01 0.27 -1.72 120.40 128.91 1a4u s VAL 11 Ca -0.05 1.55 -0.02 0.00 0.00 0.00 0.00 61.98 63.46 1a4u s VAL 11 Cb -0.18 -4.11 0.00 0.00 0.00 0.00 0.00 36.38 32.09 1a4u s VAL 11 CO -0.07 -0.05 0.37 0.00 0.00 0.00 0.00 175.10 175.35 1a4u n ALA 12 N 5.88 -0.53 0.16 5.51 0.00 0.57 -1.16 120.51 130.93 1a4u n ALA 12 Ca 0.05 0.07 0.02 0.00 0.00 0.00 0.00 53.44 53.58 1a4u n ALA 12 Cb 0.48 -1.76 0.24 0.00 0.00 0.00 0.00 19.45 18.41 1a4u n ALA 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1a4u h ALA 13 N 0.32 0.95 -0.28 0.00 0.00 -1.78 -3.24 119.26 115.24 1a4u h ALA 13 Ca -0.19 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.26 1a4u h ALA 13 Cb 1.12 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1a4u h ALA 13 CO 0.18 0.63 0.00 1.28 0.00 0.00 0.00 179.25 181.34 1a4u n LEU 14 N -3.63 1.79 -4.33 0.00 4.77 -1.26 -1.76 117.00 112.57 1a4u n LEU 14 Ca -0.01 -0.90 -0.25 0.00 -0.03 0.00 0.00 56.01 54.83 1a4u n LEU 14 Cb 0.58 -0.26 -0.12 0.00 -2.33 0.00 0.00 43.42 41.28 1a4u n LEU 14 CO 0.39 0.39 -0.52 -0.83 -1.33 0.00 0.00 177.39 175.49 1a4u s GLY 15 N -0.87 1.40 0.00 -0.72 0.00 -1.23 -4.68 107.32 101.22 1a4u s GLY 15 Ca 0.20 -1.40 0.00 0.00 0.00 0.00 0.00 44.72 43.52 1a4u s GLY 15 CO 0.12 -1.41 0.00 0.61 0.00 0.00 0.00 173.10 172.41 1a4u n GLY 16 N 0.74 2.67 0.12 0.20 0.00 -1.26 0.79 105.19 108.44 1a4u n GLY 16 Ca -0.17 0.03 0.11 0.00 0.00 0.00 0.00 46.02 45.99 1a4u n GLY 16 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1a4u n ILE 17 N 0.00 0.94 -0.09 -0.61 -0.00 -1.26 -2.59 119.36 115.74 1a4u n ILE 17 Ca 0.00 0.36 -0.02 0.00 -0.00 0.00 0.00 62.75 63.10 1a4u n ILE 17 Cb 0.00 -1.30 0.23 0.00 -0.00 0.00 0.00 39.64 38.58 1a4u n ILE 17 CO 0.00 0.00 0.00 1.23 -0.00 0.00 0.00 176.55 177.78 1a4u h GLY 18 N 1.66 0.80 0.84 3.28 0.00 0.15 -0.90 103.07 108.90 1a4u h GLY 18 Ca 0.00 -0.44 -0.06 0.00 0.00 0.00 0.00 47.33 46.83 1a4u h GLY 18 CO 0.00 0.42 -0.07 -2.00 0.00 0.00 0.00 176.54 174.89 1a4u h LEU 19 N 0.72 0.47 -1.16 3.11 5.85 -1.08 0.15 115.31 123.38 1a4u h LEU 19 Ca 0.16 -0.37 -0.08 0.00 0.84 0.00 0.00 57.88 58.43 1a4u h LEU 19 Cb 0.26 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.15 1a4u h LEU 19 CO -0.00 0.74 -0.36 0.44 -0.34 0.00 0.00 178.44 178.91 1a4u h ASP 20 N 0.21 0.00 0.07 1.25 3.32 -1.68 -0.92 116.42 118.66 1a4u h ASP 20 Ca 0.06 0.00 -0.24 0.00 0.02 0.00 0.00 57.03 56.87 1a4u h ASP 20 Cb 0.53 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.10 1a4u h ASP 20 CO 0.03 0.36 -0.93 0.74 -1.72 0.00 0.00 179.24 177.72 1a4u h THR 21 N 0.00 1.31 -0.62 0.35 2.02 -0.97 -3.03 112.91 111.98 1a4u h THR 21 Ca -0.00 -2.21 -0.07 0.00 0.77 0.00 0.00 66.41 64.89 1a4u h THR 21 Cb 0.77 2.26 -0.02 0.00 -1.74 0.00 0.00 68.15 69.41 1a4u h THR 21 CO 0.05 0.68 0.12 0.28 0.37 0.00 0.00 175.52 177.02 1a4u h SER 22 N 0.38 0.96 -0.81 4.18 0.02 -0.28 -0.60 113.55 117.41 1a4u h SER 22 Ca -0.09 -0.25 0.05 0.00 -0.84 0.00 0.00 61.79 60.66 1a4u h SER 22 Cb 1.56 -0.26 -0.05 0.00 0.14 0.00 0.00 62.40 63.79 1a4u h SER 22 CO 0.18 0.97 0.51 0.03 -1.14 0.00 0.00 176.83 177.37 1a4u h ARG 23 N 0.92 0.92 -0.16 3.45 3.08 -1.19 -1.08 114.38 120.32 1a4u h ARG 23 Ca 0.19 -0.06 -0.19 0.00 0.07 0.00 0.00 59.98 60.00 1a4u h ARG 23 Cb 0.40 -0.21 -0.00 0.00 0.08 0.00 0.00 29.97 30.24 1a4u h ARG 23 CO 0.01 0.61 -0.65 0.93 -1.07 0.00 0.00 179.97 179.80 1a4u h GLU 24 N 0.95 0.62 -0.09 0.04 4.39 -1.36 -3.25 114.58 115.87 1a4u h GLU 24 Ca 0.34 -0.45 -0.01 0.00 0.34 0.00 0.00 59.36 59.59 1a4u h GLU 24 Cb 0.10 0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 28.82 1a4u h GLU 24 CO -0.15 1.07 0.03 -0.07 -1.16 0.00 0.00 179.01 178.73 1a4u h LEU 25 N 0.45 0.12 -2.67 1.33 3.38 -0.54 -2.82 115.31 114.55 1a4u h LEU 25 Ca -0.02 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.79 1a4u h LEU 25 Cb 1.23 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.95 1a4u h LEU 25 CO 0.13 0.26 0.03 -0.37 0.09 0.00 0.00 178.44 178.57 1a4u h VAL 26 N -0.02 0.25 0.00 1.22 -1.51 -1.29 0.45 116.25 115.35 1a4u h VAL 26 Ca 0.03 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.50 1a4u h VAL 26 Cb 0.17 0.97 0.00 0.00 -2.13 0.00 0.00 31.29 30.30 1a4u h VAL 26 CO -0.00 0.00 0.00 0.29 -1.23 0.00 0.00 177.57 176.63 1a4u n LYS 27 N -3.44 0.23 -0.07 5.19 5.02 -1.06 -3.19 118.16 120.83 1a4u n LYS 27 Ca -0.03 0.34 0.03 0.00 -2.02 0.00 0.00 58.31 56.63 1a4u n LYS 27 Cb 0.11 -1.85 0.10 0.00 -0.02 0.00 0.00 35.03 33.38 1a4u n LYS 27 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1a4u n ARG 28 N -2.26 1.32 -3.36 1.97 3.00 0.15 -4.93 116.66 112.55 1a4u n ARG 28 Ca 0.04 -0.49 -0.16 0.00 -0.01 0.00 0.00 57.85 57.22 1a4u n ARG 28 Cb 0.32 -1.13 0.08 0.00 0.00 0.00 0.00 32.46 31.73 1a4u n ARG 28 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 1a4u n ASN 29 N -0.12 -3.64 -4.79 0.55 3.02 -1.19 -3.60 115.26 105.49 1a4u n ASN 29 Ca 0.06 -0.65 -0.31 0.00 -0.03 0.00 0.00 54.58 53.64 1a4u n ASN 29 Cb 0.12 -5.15 0.06 0.00 -0.61 0.00 0.00 39.78 34.21 1a4u n ASN 29 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1a4u s LEU 30 N -6.01 3.18 -0.13 3.41 1.43 -1.26 -0.97 118.68 118.32 1a4u s LEU 30 Ca 0.16 1.77 -0.18 0.00 -1.03 0.00 0.00 54.13 54.84 1a4u s LEU 30 Cb -0.02 -4.52 -0.16 0.00 0.03 0.00 0.00 46.19 41.52 1a4u s LEU 30 CO 0.73 -1.65 0.43 0.50 0.23 0.00 0.00 176.35 176.60 1a4u h LYS 31 N -0.62 0.00 -4.63 1.70 3.64 -1.31 -3.39 116.57 111.96 1a4u h LYS 31 Ca -0.44 0.00 -0.44 0.00 -1.27 0.00 0.00 60.65 58.49 1a4u h LYS 31 Cb 1.22 0.00 -0.31 0.00 -0.41 0.00 0.00 32.23 32.73 1a4u h LYS 31 CO 0.54 0.63 -0.79 -0.80 -2.27 0.00 0.00 179.45 176.77 1a4u s ASN 32 N -6.04 1.31 -0.27 4.20 0.01 -1.18 -1.79 114.94 111.18 1a4u s ASN 32 Ca -0.14 -0.20 0.01 0.00 -0.71 0.00 0.00 52.86 51.82 1a4u s ASN 32 Cb -0.01 -0.38 0.07 0.00 0.41 0.00 0.00 41.25 41.34 1a4u s ASN 32 CO 0.44 0.07 -0.02 0.12 -1.51 0.00 0.00 177.10 176.19 1a4u s PHE 33 N 0.24 2.67 -0.29 2.20 5.36 0.42 -1.06 117.98 127.52 1a4u s PHE 33 Ca -0.04 -2.05 -0.11 0.00 -0.96 0.00 0.00 56.93 53.77 1a4u s PHE 33 Cb -0.09 -1.88 -0.04 0.00 -0.34 0.00 0.00 43.02 40.67 1a4u s PHE 33 CO 0.01 -0.83 0.17 0.08 -1.46 0.00 0.00 175.22 173.19 1a4u s VAL 34 N 1.30 5.08 -0.22 3.12 1.01 0.86 -1.73 120.40 129.82 1a4u s VAL 34 Ca -0.01 0.01 -0.08 0.00 0.00 0.00 0.00 61.98 61.89 1a4u s VAL 34 Cb -0.19 -3.46 -0.04 0.00 0.00 0.00 0.00 36.38 32.70 1a4u s VAL 34 CO -0.09 0.21 0.10 -0.63 0.00 0.00 0.00 175.10 174.70 1a4u s ILE 35 N 1.72 4.85 -0.26 2.22 1.01 0.24 -0.02 121.20 130.97 1a4u s ILE 35 Ca 0.07 -0.00 0.00 0.00 0.00 0.00 0.00 60.65 60.72 1a4u s ILE 35 Cb -0.16 -3.24 0.04 0.00 0.01 0.00 0.00 42.46 39.12 1a4u s ILE 35 CO 0.09 0.38 -0.08 -0.76 0.00 0.00 0.00 174.94 174.57 1a4u s LEU 36 N 0.99 3.31 0.04 2.97 1.43 -0.70 -0.80 118.68 125.92 1a4u s LEU 36 Ca 0.05 -1.14 -0.03 0.00 -1.03 0.00 0.00 54.13 51.98 1a4u s LEU 36 Cb -0.14 -1.61 -0.02 0.00 0.03 0.00 0.00 46.19 44.46 1a4u s LEU 36 CO 0.03 -0.16 0.04 -0.62 0.23 0.00 0.00 176.35 175.87 1a4u s ASP 37 N 1.22 0.28 0.16 2.29 -1.08 -1.09 -0.32 116.67 118.13 1a4u s ASP 37 Ca -0.04 -0.68 -0.03 0.00 -0.52 0.00 0.00 52.55 51.28 1a4u s ASP 37 Cb -0.18 0.21 0.02 0.00 -1.46 0.00 0.00 42.92 41.51 1a4u s ASP 37 CO -0.05 -0.52 1.41 -0.09 0.52 0.00 0.00 175.17 176.45 1a4u h ARG 38 N 3.61 0.47 -5.94 4.34 2.43 -1.58 0.18 114.38 117.90 1a4u h ARG 38 Ca -0.33 -0.38 -0.68 0.00 -0.81 0.00 0.00 59.98 57.78 1a4u h ARG 38 Cb 1.18 0.08 -0.27 0.00 -0.42 0.00 0.00 29.97 30.54 1a4u h ARG 38 CO 0.54 1.02 -0.81 0.08 -1.51 0.00 0.00 179.97 179.29 1a4u s VAL 39 N -3.64 2.72 0.30 0.20 1.01 -1.26 -4.68 120.40 115.05 1a4u s VAL 39 Ca -0.06 -0.82 -0.29 0.00 0.00 0.00 0.00 61.98 60.81 1a4u s VAL 39 Cb 0.10 -2.07 -0.10 0.00 0.00 0.00 0.00 36.38 34.32 1a4u s VAL 39 CO 0.85 0.57 1.14 -1.61 0.00 0.00 0.00 175.10 176.05 1a4u s GLU 40 N -0.23 4.55 -0.43 2.72 2.02 -1.26 -5.01 118.70 121.05 1a4u s GLU 40 Ca 0.00 1.88 0.03 0.00 0.02 0.00 0.00 54.97 56.90 1a4u s GLU 40 Cb -0.13 -3.13 0.16 0.00 0.10 0.00 0.00 34.13 31.13 1a4u s GLU 40 CO 0.03 0.11 0.32 1.21 0.02 0.00 0.00 175.26 176.95 1a4u s ASN 41 N -0.83 2.32 0.29 -0.19 3.84 -1.26 -5.01 114.94 114.10 1a4u s ASN 41 Ca 0.46 -2.93 0.02 0.00 0.21 0.00 0.00 52.86 50.62 1a4u s ASN 41 Cb -0.33 -0.61 0.60 0.00 -0.55 0.00 0.00 41.25 40.35 1a4u s ASN 41 CO 0.43 -0.20 1.81 1.55 -2.79 0.00 0.00 177.10 177.91 1a4u h PRO 42 N 5.99 0.88 0.86 0.43 0.13 -1.99 -2.24 132.00 136.06 1a4u h PRO 42 Ca 0.19 -0.05 -0.04 0.00 -0.87 0.00 0.00 66.00 65.22 1a4u h PRO 42 Cb 0.91 -0.20 0.01 0.00 0.13 0.00 0.00 31.00 31.85 1a4u h PRO 42 CO 0.40 0.58 -0.41 1.15 -0.23 0.00 0.00 178.00 179.49 1a4u h THR 43 N 0.91 0.14 -0.93 1.56 2.02 -1.99 -1.34 112.91 113.27 1a4u h THR 43 Ca 0.52 -0.04 0.10 0.00 0.77 0.00 0.00 66.41 67.76 1a4u h THR 43 Cb 0.61 0.14 -0.08 0.00 -1.74 0.00 0.00 68.15 67.09 1a4u h THR 43 CO -0.30 0.00 0.57 0.00 0.37 0.00 0.00 175.52 176.16 1a4u h ALA 44 N -1.04 1.35 -0.50 6.16 0.00 -1.95 -1.25 119.26 122.03 1a4u h ALA 44 Ca -0.12 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 1a4u h ALA 44 Cb 0.88 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 1a4u h ALA 44 CO 0.19 0.22 0.26 1.25 0.00 0.00 0.00 179.25 181.17 1a4u h LEU 45 N 0.95 0.63 -0.79 0.00 5.85 -1.32 -1.72 115.31 118.92 1a4u h LEU 45 Ca 0.44 -0.11 -0.04 0.00 0.84 0.00 0.00 57.88 59.01 1a4u h LEU 45 Cb 0.37 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.20 1a4u h LEU 45 CO -0.24 0.56 0.34 0.00 -0.34 0.00 0.00 178.44 178.76 1a4u h ALA 46 N 1.10 1.02 -0.45 1.25 0.00 -0.42 -2.34 119.26 119.42 1a4u h ALA 46 Ca 0.17 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 1a4u h ALA 46 Cb 0.08 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1a4u h ALA 46 CO -0.02 0.62 0.11 1.49 0.00 0.00 0.00 179.25 181.45 1a4u h GLU 47 N 1.13 0.71 -0.22 0.00 4.81 -0.97 -2.03 114.58 118.01 1a4u h GLU 47 Ca 0.27 -0.17 -0.00 0.00 -0.13 0.00 0.00 59.36 59.32 1a4u h GLU 47 Cb 0.18 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.46 1a4u h GLU 47 CO -0.03 0.71 0.12 -0.07 -0.73 0.00 0.00 179.01 179.02 1a4u h LEU 48 N 0.59 0.28 -1.34 1.64 3.38 -1.16 -1.71 115.31 116.98 1a4u h LEU 48 Ca 0.14 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 1a4u h LEU 48 Cb 0.32 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 1a4u h LEU 48 CO 0.00 0.28 0.37 0.11 0.09 0.00 0.00 178.44 179.30 1a4u h LYS 49 N 0.25 0.82 0.00 1.13 1.57 -1.37 -1.76 116.57 117.21 1a4u h LYS 49 Ca 0.08 -0.06 -0.08 0.00 -1.87 0.00 0.00 60.65 58.72 1a4u h LYS 49 Cb 0.07 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.19 1a4u h LYS 49 CO -0.01 0.57 -0.37 0.00 -0.57 0.00 0.00 179.45 179.06 1a4u h ALA 50 N 1.58 1.19 -0.31 3.86 0.00 -0.92 -2.65 119.26 122.01 1a4u h ALA 50 Ca 0.22 -0.34 -0.06 0.00 0.00 0.00 0.00 54.91 54.73 1a4u h ALA 50 Cb -0.04 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1a4u h ALA 50 CO -0.04 0.47 -0.05 0.82 0.00 0.00 0.00 179.25 180.44 1a4u h ILE 51 N 0.00 1.27 -1.97 0.00 2.04 -0.41 -3.40 117.51 115.04 1a4u h ILE 51 Ca -0.00 -1.07 -0.42 0.00 1.00 0.00 0.00 64.86 64.37 1a4u h ILE 51 Cb 0.75 1.35 -0.31 0.00 -0.74 0.00 0.00 36.82 37.86 1a4u h ILE 51 CO 0.05 0.34 -0.76 0.21 0.00 0.00 0.00 178.15 177.99 1a4u s ASN 52 N -6.16 0.96 0.40 1.72 3.84 -1.17 -4.97 114.94 109.56 1a4u s ASN 52 Ca -0.13 -2.12 0.24 0.00 0.21 0.00 0.00 52.86 51.06 1a4u s ASN 52 Cb 0.08 0.40 1.31 0.00 -0.55 0.00 0.00 41.25 42.49 1a4u s ASN 52 CO 0.78 -0.20 1.72 1.55 -2.79 0.00 0.00 177.10 178.15 1a4u h PRO 53 N 6.28 0.00 -0.05 0.43 0.13 -1.70 -1.59 132.00 135.50 1a4u h PRO 53 Ca 0.12 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.17 1a4u h PRO 53 Cb 1.01 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.13 1a4u h PRO 53 CO 0.22 0.00 -0.33 -0.22 -0.23 0.00 0.00 178.00 177.44 1a4u h LYS 54 N 0.00 0.09 -6.49 0.86 3.64 -1.94 -3.43 116.57 109.29 1a4u h LYS 54 Ca 0.00 -0.03 -0.53 0.00 -1.27 0.00 0.00 60.65 58.82 1a4u h LYS 54 Cb 0.18 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.97 1a4u h LYS 54 CO 0.00 0.41 0.33 0.08 -2.27 0.00 0.00 179.45 178.00 1a4u s VAL 55 N -4.29 4.60 -0.45 2.00 1.01 -0.60 -4.95 120.40 117.72 1a4u s VAL 55 Ca -0.04 1.99 -0.26 0.00 0.00 0.00 0.00 61.98 63.68 1a4u s VAL 55 Cb 0.14 -4.29 0.03 0.00 0.00 0.00 0.00 36.38 32.26 1a4u s VAL 55 CO 0.73 0.30 0.93 0.21 0.00 0.00 0.00 175.10 177.28 1a4u s ASN 56 N 0.15 6.52 -0.20 3.32 2.47 -0.74 -4.95 114.94 121.51 1a4u s ASN 56 Ca 0.46 0.19 -0.05 0.00 0.42 0.00 0.00 52.86 53.88 1a4u s ASN 56 Cb -0.22 -2.46 -0.02 0.00 -1.45 0.00 0.00 41.25 37.10 1a4u s ASN 56 CO 0.28 -1.04 -0.01 -0.63 -3.72 0.00 0.00 177.10 171.98 1a4u s ILE 57 N 3.75 3.83 0.04 -5.21 1.01 -1.26 -0.44 121.20 122.92 1a4u s ILE 57 Ca 0.38 -0.35 0.07 0.00 0.00 0.00 0.00 60.65 60.74 1a4u s ILE 57 Cb -0.10 -2.73 -0.02 0.00 0.01 0.00 0.00 42.46 39.62 1a4u s ILE 57 CO 0.26 0.43 -0.20 0.42 0.00 0.00 0.00 174.94 175.85 1a4u s THR 58 N 1.05 1.57 -0.04 2.92 -4.23 -0.71 -4.99 115.64 111.21 1a4u s THR 58 Ca 0.02 -1.16 0.07 0.00 -1.18 0.00 0.00 61.69 59.44 1a4u s THR 58 Cb -0.14 -1.37 -0.02 0.00 1.34 0.00 0.00 72.50 72.31 1a4u s THR 58 CO 0.01 0.18 -0.25 0.12 -0.54 0.00 0.00 174.62 174.14 1a4u s PHE 59 N -0.80 2.41 -0.04 3.99 2.19 -1.26 -0.59 117.98 123.88 1a4u s PHE 59 Ca 0.06 -0.57 0.02 0.00 0.33 0.00 0.00 56.93 56.77 1a4u s PHE 59 Cb -0.09 -1.56 0.01 0.00 -1.31 0.00 0.00 43.02 40.07 1a4u s PHE 59 CO 0.02 -0.12 -0.08 -1.01 1.83 0.00 0.00 175.22 175.85 1a4u s HIS 60 N -0.38 0.94 0.15 10.12 3.76 0.02 -4.96 115.29 124.93 1a4u s HIS 60 Ca 0.03 -0.26 -0.31 0.00 -0.15 0.00 0.00 55.06 54.37 1a4u s HIS 60 Cb -0.12 -0.71 -0.09 0.00 1.11 0.00 0.00 32.58 32.77 1a4u s HIS 60 CO 0.01 -0.15 1.43 0.99 -0.85 0.00 0.00 174.74 176.18 1a4u s THR 61 N 0.45 3.08 -0.17 1.30 2.01 -1.26 -2.67 115.64 118.38 1a4u s THR 61 Ca -0.07 0.79 -0.08 0.00 0.31 0.00 0.00 61.69 62.64 1a4u s THR 61 Cb -0.11 -3.51 0.07 0.00 0.01 0.00 0.00 72.50 68.96 1a4u s THR 61 CO 0.01 0.07 0.39 -0.47 -0.69 0.00 0.00 174.62 173.93 1a4u s TYR 62 N 0.92 -0.62 -0.34 4.92 5.04 0.63 -4.83 117.35 123.07 1a4u s TYR 62 Ca 0.65 1.29 -0.06 0.00 -2.44 0.00 0.00 57.07 56.51 1a4u s TYR 62 Cb -0.39 0.24 0.05 0.00 0.35 0.00 0.00 41.96 42.21 1a4u s TYR 62 CO 0.32 -0.37 0.10 0.34 -1.34 0.00 0.00 175.55 174.60 1a4u s ASP 63 N 1.74 5.26 0.40 4.32 -1.08 -1.26 -1.46 116.67 124.59 1a4u s ASP 63 Ca -0.07 -1.22 0.23 0.00 -0.52 0.00 0.00 52.55 50.97 1a4u s ASP 63 Cb -0.10 -1.85 1.23 0.00 -1.46 0.00 0.00 42.92 40.75 1a4u s ASP 63 CO -0.12 -0.34 1.66 -0.37 0.52 0.00 0.00 175.17 176.52 1a4u h VAL 64 N 6.23 0.00 -0.00 1.11 -1.51 -1.96 -1.48 116.25 118.63 1a4u h VAL 64 Ca -0.22 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.25 1a4u h VAL 64 Cb 1.08 0.50 0.00 0.00 -2.13 0.00 0.00 31.29 30.74 1a4u h VAL 64 CO 0.60 0.00 -0.04 0.35 -1.23 0.00 0.00 177.57 177.26 1a4u n THR 65 N -2.36 0.00 -1.47 7.19 -2.24 -1.26 -4.38 114.28 109.76 1a4u n THR 65 Ca -0.02 -0.03 -0.31 0.00 -2.27 0.00 0.00 64.05 61.42 1a4u n THR 65 Cb 0.16 -0.31 0.07 0.00 -2.10 0.00 0.00 70.33 68.15 1a4u n THR 65 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1a4u s VAL 66 N -2.35 3.71 0.81 2.28 -7.23 -0.56 -5.01 120.40 112.04 1a4u s VAL 66 Ca 0.34 0.57 -0.12 0.00 -1.81 0.00 0.00 61.98 60.96 1a4u s VAL 66 Cb 0.21 -3.19 0.08 0.00 0.56 0.00 0.00 36.38 34.04 1a4u s VAL 66 CO 0.43 -0.71 1.16 -2.84 -0.31 0.00 0.00 175.10 172.84 1a4u s PRO 67 N -4.91 1.72 0.40 4.82 0.02 -1.26 -4.81 135.00 130.98 1a4u s PRO 67 Ca 0.60 1.59 0.10 0.00 0.02 0.00 0.00 61.00 63.30 1a4u s PRO 67 Cb -0.16 -1.80 0.89 0.00 0.02 0.00 0.00 34.50 33.45 1a4u s PRO 67 CO 0.54 -2.12 1.97 0.28 -0.33 0.00 0.00 177.00 177.34 1a4u h VAL 68 N -1.04 0.95 -0.97 3.83 2.07 -1.95 -0.81 116.25 118.35 1a4u h VAL 68 Ca -0.45 -0.20 0.02 0.00 0.82 0.00 0.00 66.70 66.89 1a4u h VAL 68 Cb 1.27 0.32 -0.05 0.00 -1.52 0.00 0.00 31.29 31.32 1a4u h VAL 68 CO 0.47 0.11 0.64 0.00 0.02 0.00 0.00 177.57 178.80 1a4u h ALA 69 N 1.66 1.33 -0.48 1.67 0.00 -1.97 0.47 119.26 121.94 1a4u h ALA 69 Ca 0.30 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 55.08 1a4u h ALA 69 Cb 0.41 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1a4u h ALA 69 CO -0.10 0.60 0.03 1.49 0.00 0.00 0.00 179.25 181.28 1a4u h GLU 70 N 1.28 0.83 -0.41 0.00 4.57 -1.50 -2.06 114.58 117.30 1a4u h GLU 70 Ca 0.37 -0.25 -0.10 0.00 -1.18 0.00 0.00 59.36 58.20 1a4u h GLU 70 Cb -0.09 -0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 28.40 1a4u h GLU 70 CO -0.09 0.86 -0.14 0.77 -1.18 0.00 0.00 179.01 179.23 1a4u h SER 71 N 0.70 0.74 -0.22 1.04 0.02 -0.97 -2.57 113.55 112.29 1a4u h SER 71 Ca 0.14 -0.23 -0.07 0.00 -0.84 0.00 0.00 61.79 60.80 1a4u h SER 71 Cb 0.46 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.79 1a4u h SER 71 CO 0.02 0.89 -0.07 0.11 -1.14 0.00 0.00 176.83 176.65 1a4u h LYS 72 N 0.67 0.57 -0.00 3.45 1.57 -0.72 -0.24 116.57 121.87 1a4u h LYS 72 Ca 0.11 -0.15 -0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1a4u h LYS 72 Cb 0.62 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.86 1a4u h LYS 72 CO 0.04 0.65 0.00 -0.22 -0.57 0.00 0.00 179.45 179.35 1a4u h LYS 73 N 0.54 0.00 -0.30 3.15 3.64 -1.04 -0.48 116.57 122.08 1a4u h LYS 73 Ca 0.10 -0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.44 1a4u h LYS 73 Cb 0.44 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.25 1a4u h LYS 73 CO 0.02 0.16 0.02 1.25 -2.27 0.00 0.00 179.45 178.63 1a4u h LEU 74 N -0.16 0.50 -1.20 5.20 5.85 -1.24 -2.90 115.31 121.36 1a4u h LEU 74 Ca 0.00 -0.29 -0.00 0.00 0.84 0.00 0.00 57.88 58.43 1a4u h LEU 74 Cb 0.16 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.02 1a4u h LEU 74 CO -0.00 0.66 0.44 -0.07 -0.34 0.00 0.00 178.44 179.13 1a4u h LEU 75 N 0.32 0.87 -0.72 2.25 3.38 -1.01 -2.19 115.31 118.20 1a4u h LEU 75 Ca 0.09 -0.05 0.02 0.00 0.09 0.00 0.00 57.88 58.03 1a4u h LEU 75 Cb 0.39 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.88 1a4u h LEU 75 CO 0.01 0.67 0.47 0.50 0.09 0.00 0.00 178.44 180.17 1a4u h LYS 76 N 1.00 0.91 -0.73 1.13 3.64 -0.93 0.29 116.57 121.89 1a4u h LYS 76 Ca 0.26 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.58 1a4u h LYS 76 Cb -0.04 -0.20 -0.03 0.00 -0.41 0.00 0.00 32.23 31.54 1a4u h LYS 76 CO -0.05 0.60 0.43 -0.22 -2.27 0.00 0.00 179.45 177.94 1a4u h LYS 77 N 0.94 0.99 -0.26 1.90 3.64 -1.21 -1.20 116.57 121.37 1a4u h LYS 77 Ca 0.27 -0.10 -0.07 0.00 -1.27 0.00 0.00 60.65 59.49 1a4u h LYS 77 Cb -0.06 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 31.55 1a4u h LYS 77 CO -0.08 0.71 -0.10 0.82 -2.27 0.00 0.00 179.45 178.54 1a4u h ILE 78 N 0.99 1.29 0.00 2.00 2.04 -0.88 -2.71 117.51 120.25 1a4u h ILE 78 Ca 0.26 -1.15 -0.02 0.00 1.00 0.00 0.00 64.86 64.95 1a4u h ILE 78 Cb -0.02 1.51 -0.00 0.00 -0.74 0.00 0.00 36.82 37.57 1a4u h ILE 78 CO -0.05 0.36 -0.11 -0.26 0.00 0.00 0.00 178.15 178.09 1a4u h PHE 79 N 0.25 0.00 -0.13 1.37 0.04 -0.80 0.44 116.94 118.11 1a4u h PHE 79 Ca 0.06 0.00 -0.16 0.00 2.80 0.00 0.00 57.97 60.67 1a4u h PHE 79 Cb 0.59 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.73 1a4u h PHE 79 CO 0.06 0.11 -0.60 -0.44 -0.60 0.00 0.00 178.31 176.84 1a4u h ASP 80 N 0.00 0.49 0.39 2.17 3.32 -0.95 0.46 116.42 122.29 1a4u h ASP 80 Ca -0.00 -0.28 -0.32 0.00 0.02 0.00 0.00 57.03 56.46 1a4u h ASP 80 Cb 0.38 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.77 1a4u h ASP 80 CO 0.01 0.97 -1.70 1.56 -1.72 0.00 0.00 179.24 178.37 1a4u h GLN 81 N 0.32 0.17 0.00 3.56 1.08 -1.06 -3.38 115.11 115.80 1a4u h GLN 81 Ca -0.00 -0.30 -0.07 0.00 -1.45 0.00 0.00 58.65 56.83 1a4u h GLN 81 Cb 1.13 0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 28.66 1a4u h GLN 81 CO 0.10 0.95 -1.70 1.28 -0.95 0.00 0.00 178.83 178.52 1a4u n LEU 82 N -3.34 0.35 0.00 1.46 4.77 0.08 -4.96 117.00 115.36 1a4u n LEU 82 Ca -0.20 0.14 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 1a4u n LEU 82 Cb 1.04 0.05 0.00 0.00 -2.33 0.00 0.00 43.42 42.19 1a4u n LEU 82 CO 0.47 0.03 0.00 0.29 -1.33 0.00 0.00 177.39 176.85 1a4u n LYS 83 N -2.52 0.00 -4.10 3.23 4.76 0.16 -4.80 118.16 114.89 1a4u n LYS 83 Ca -0.07 0.00 -0.13 0.00 -2.87 0.00 0.00 58.31 55.24 1a4u n LYS 83 Cb 0.67 -0.09 -0.11 0.00 -1.84 0.00 0.00 35.03 33.67 1a4u n LYS 83 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 1a4u s THR 84 N 0.00 0.64 -0.06 -0.18 -4.23 -1.26 -4.92 115.64 105.63 1a4u s THR 84 Ca 0.00 -1.34 -0.01 0.00 -1.18 0.00 0.00 61.69 59.16 1a4u s THR 84 Cb 0.00 -0.95 0.03 0.00 1.34 0.00 0.00 72.50 72.92 1a4u s THR 84 CO 0.00 -0.51 0.01 -0.69 -0.54 0.00 0.00 174.62 172.89 1a4u s VAL 85 N -2.00 0.26 -0.05 2.29 1.01 -1.26 -4.81 120.40 115.83 1a4u s VAL 85 Ca -0.03 0.15 -0.11 0.00 0.00 0.00 0.00 61.98 61.99 1a4u s VAL 85 Cb -0.06 -0.42 -0.31 0.00 0.00 0.00 0.00 36.38 35.60 1a4u s VAL 85 CO -0.01 0.22 0.65 0.44 0.00 0.00 0.00 175.10 176.41 1a4u h ASP 86 N 8.07 0.61 -4.15 3.32 3.32 -1.37 -3.46 116.42 122.76 1a4u h ASP 86 Ca -0.24 -0.94 -0.22 0.00 0.02 0.00 0.00 57.03 55.66 1a4u h ASP 86 Cb 1.13 -0.20 -0.26 0.00 0.22 0.00 0.00 39.33 40.22 1a4u h ASP 86 CO 0.29 1.79 -0.72 -0.63 -1.72 0.00 0.00 179.24 178.26 1a4u s ILE 87 N -2.58 0.06 -0.11 0.35 1.01 -1.10 -2.76 121.20 116.09 1a4u s ILE 87 Ca -0.16 -0.32 0.04 0.00 0.00 0.00 0.00 60.65 60.21 1a4u s ILE 87 Cb 0.05 -0.12 0.00 0.00 0.01 0.00 0.00 42.46 42.41 1a4u s ILE 87 CO 0.85 -0.16 -0.23 -0.22 0.00 0.00 0.00 174.94 175.18 1a4u s LEU 88 N -0.49 2.08 -0.24 2.97 2.96 -0.51 -1.25 118.68 124.19 1a4u s LEU 88 Ca -0.05 -0.56 -0.01 0.00 -0.22 0.00 0.00 54.13 53.29 1a4u s LEU 88 Cb -0.03 -1.39 0.03 0.00 0.50 0.00 0.00 46.19 45.29 1a4u s LEU 88 CO -0.00 0.14 -0.08 -0.63 -1.32 0.00 0.00 176.35 174.46 1a4u s ILE 89 N 0.44 2.73 -0.54 6.68 1.01 0.17 -0.79 121.20 130.91 1a4u s ILE 89 Ca -0.17 -1.06 -0.18 0.00 0.00 0.00 0.00 60.65 59.24 1a4u s ILE 89 Cb -0.17 -2.38 0.08 0.00 0.01 0.00 0.00 42.46 40.00 1a4u s ILE 89 CO 0.07 0.22 0.62 0.20 0.00 0.00 0.00 174.94 176.05 1a4u s ASN 90 N 1.30 6.20 -0.09 3.58 0.01 -0.46 -0.56 114.94 124.92 1a4u s ASN 90 Ca -0.00 -1.20 0.14 0.00 -0.71 0.00 0.00 52.86 51.08 1a4u s ASN 90 Cb -0.16 -2.28 0.21 0.00 0.41 0.00 0.00 41.25 39.42 1a4u s ASN 90 CO -0.05 -0.94 1.10 0.61 -1.51 0.00 0.00 177.10 176.30 1a4u n GLY 91 N 5.22 4.06 3.77 0.66 0.00 -0.31 -1.44 105.19 117.14 1a4u n GLY 91 Ca -0.09 -0.81 -0.39 0.00 0.00 0.00 0.00 46.02 44.73 1a4u n GLY 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a4u s ALA 92 N -2.25 3.23 -0.15 4.61 0.00 -1.21 -4.74 121.76 121.25 1a4u s ALA 92 Ca 0.23 1.00 -0.32 0.00 0.00 0.00 0.00 51.96 52.86 1a4u s ALA 92 Cb 0.20 -3.39 0.13 0.00 0.00 0.00 0.00 23.12 20.07 1a4u s ALA 92 CO 0.02 -0.50 1.11 0.20 0.00 0.00 0.00 175.76 176.59 1a4u s GLY 93 N -1.02 -0.29 -0.06 0.00 0.00 -1.26 -4.65 107.32 100.04 1a4u s GLY 93 Ca 0.55 1.68 -0.11 0.00 0.00 0.00 0.00 44.72 46.83 1a4u s GLY 93 CO 0.41 0.65 0.27 -1.50 0.00 0.00 0.00 173.10 172.92 1a4u s ILE 94 N -2.18 0.03 -0.28 0.90 2.07 -1.26 -5.00 121.20 115.48 1a4u s ILE 94 Ca 0.06 -0.27 0.01 0.00 -1.41 0.00 0.00 60.65 59.04 1a4u s ILE 94 Cb -0.01 -0.48 0.08 0.00 0.13 0.00 0.00 42.46 42.18 1a4u s ILE 94 CO -0.05 -0.15 0.03 -0.22 -1.91 0.00 0.00 174.94 172.65 1a4u s LEU 95 N -0.58 2.83 -0.32 8.50 0.20 -1.26 -4.92 118.68 123.14 1a4u s LEU 95 Ca -0.07 -1.54 -0.07 0.00 0.69 0.00 0.00 54.13 53.14 1a4u s LEU 95 Cb -0.04 -1.12 0.19 0.00 -0.43 0.00 0.00 46.19 44.79 1a4u s LEU 95 CO 0.02 -0.34 0.96 -0.62 -0.29 0.00 0.00 176.35 176.08 1a4u s ASP 96 N 1.40 -0.61 0.00 3.68 -1.08 -1.26 -4.62 116.67 114.18 1a4u s ASP 96 Ca 0.04 -0.08 0.06 0.00 -0.52 0.00 0.00 52.55 52.05 1a4u s ASP 96 Cb -0.18 1.13 0.38 0.00 -1.46 0.00 0.00 42.92 42.79 1a4u s ASP 96 CO -0.14 -0.09 1.02 0.47 0.52 0.00 0.00 175.17 176.95 1a4u n ASP 97 N 4.61 0.00 0.04 -0.34 9.92 -0.69 -1.38 116.55 128.71 1a4u n ASP 97 Ca 0.08 -1.28 0.12 0.00 -0.53 0.00 0.00 54.79 53.18 1a4u n ASP 97 Cb 0.59 0.00 0.17 0.00 -0.64 0.00 0.00 41.12 41.24 1a4u n ASP 97 CO 0.00 0.00 0.00 1.41 0.13 0.00 0.00 177.20 178.74 1a4u n HIS 98 N -0.64 0.34 -3.60 1.24 8.25 -1.26 -4.29 115.22 115.26 1a4u n HIS 98 Ca 0.05 0.10 -0.32 0.00 -0.26 0.00 0.00 57.72 57.29 1a4u n HIS 98 Cb 0.02 -0.50 -0.08 0.00 1.12 0.00 0.00 29.99 30.55 1a4u n HIS 98 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1a4u n GLN 99 N -1.91 2.56 0.44 -0.41 6.02 -0.48 -4.96 117.38 118.64 1a4u n GLN 99 Ca 0.04 -4.54 -0.19 0.00 -0.01 0.00 0.00 57.00 52.29 1a4u n GLN 99 Cb 0.41 -2.35 -0.10 0.00 1.02 0.00 0.00 30.24 29.23 1a4u n GLN 99 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 1a4u h ILE 100 N 3.86 0.12 -0.38 5.09 2.04 -1.77 -1.22 117.51 125.25 1a4u h ILE 100 Ca 0.17 0.00 0.02 0.00 1.00 0.00 0.00 64.86 66.05 1a4u h ILE 100 Cb 0.74 0.12 -0.03 0.00 -0.74 0.00 0.00 36.82 36.91 1a4u h ILE 100 CO 0.86 0.00 0.21 -0.33 0.00 0.00 0.00 178.15 178.89 1a4u h GLU 101 N -1.15 0.42 -0.70 2.37 3.07 -1.96 -2.54 114.58 114.09 1a4u h GLU 101 Ca -0.11 -0.03 -0.04 0.00 -0.50 0.00 0.00 59.36 58.69 1a4u h GLU 101 Cb 0.90 -0.09 -0.03 0.00 -0.84 0.00 0.00 28.75 28.68 1a4u h GLU 101 CO 0.15 0.28 0.29 -0.09 -1.40 0.00 0.00 179.01 178.24 1a4u h ARG 102 N 0.43 1.02 -0.34 2.33 2.43 -1.96 -0.14 114.38 118.15 1a4u h ARG 102 Ca 0.15 -0.16 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1a4u h ARG 102 Cb 0.03 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.38 1a4u h ARG 102 CO -0.08 0.82 0.21 1.15 -1.51 0.00 0.00 179.97 180.56 1a4u h THR 103 N 1.00 1.10 -0.38 0.20 2.02 -0.91 -0.63 112.91 115.32 1a4u h THR 103 Ca 0.24 -0.22 -0.16 0.00 0.77 0.00 0.00 66.41 67.03 1a4u h THR 103 Cb 0.17 0.65 -0.01 0.00 -1.74 0.00 0.00 68.15 67.23 1a4u h THR 103 CO -0.02 0.10 -0.38 0.40 0.37 0.00 0.00 175.52 175.99 1a4u h ILE 104 N 0.44 1.27 -0.61 3.11 2.04 -1.21 -1.14 117.51 121.41 1a4u h ILE 104 Ca 0.12 -1.55 -0.06 0.00 1.00 0.00 0.00 64.86 64.37 1a4u h ILE 104 Cb -0.02 1.38 -0.03 0.00 -0.74 0.00 0.00 36.82 37.42 1a4u h ILE 104 CO -0.02 0.52 0.13 0.00 0.00 0.00 0.00 178.15 178.77 1a4u h ALA 105 N 0.82 1.07 0.03 1.87 0.00 -0.76 -1.22 119.26 121.07 1a4u h ALA 105 Ca 0.06 -0.24 -0.14 0.00 0.00 0.00 0.00 54.91 54.60 1a4u h ALA 105 Cb 0.97 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 1a4u h ALA 105 CO 0.09 0.61 -0.72 0.82 0.00 0.00 0.00 179.25 180.05 1a4u h ILE 106 N 0.93 1.35 -0.01 0.00 2.04 -1.10 0.18 117.51 120.90 1a4u h ILE 106 Ca 0.19 -2.32 -0.17 0.00 1.00 0.00 0.00 64.86 63.57 1a4u h ILE 106 Cb 0.36 2.88 -0.02 0.00 -0.74 0.00 0.00 36.82 39.30 1a4u h ILE 106 CO 0.00 0.54 -0.75 0.78 0.00 0.00 0.00 178.15 178.72 1a4u h ASN 107 N -0.83 0.12 0.00 1.72 2.35 -1.29 -3.37 115.58 114.28 1a4u h ASN 107 Ca -0.18 -0.09 0.00 0.00 -0.55 0.00 0.00 56.30 55.49 1a4u h ASN 107 Cb 1.29 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 39.62 1a4u h ASN 107 CO -0.05 0.83 -0.05 0.33 -1.65 0.00 0.00 177.43 176.84 1a4u n PHE 108 N -3.70 0.00 -0.18 1.19 7.35 -0.68 -4.60 117.46 116.84 1a4u n PHE 108 Ca -0.02 0.00 -0.02 0.00 -0.76 0.00 0.00 57.45 56.66 1a4u n PHE 108 Cb 0.73 -0.03 0.08 0.00 0.35 0.00 0.00 39.48 40.61 1a4u n PHE 108 CO 0.00 0.00 0.00 1.15 -0.76 0.00 0.00 176.76 177.15 1a4u h THR 109 N -0.05 0.76 -0.88 -2.13 2.02 -1.34 -1.98 112.91 109.32 1a4u h THR 109 Ca 0.00 -0.11 -0.00 0.00 0.77 0.00 0.00 66.41 67.06 1a4u h THR 109 Cb 0.05 0.40 -0.04 0.00 -1.74 0.00 0.00 68.15 66.82 1a4u h THR 109 CO 0.00 0.06 0.53 1.23 0.37 0.00 0.00 175.52 177.71 1a4u h GLY 110 N 0.33 1.27 1.01 2.16 0.00 -0.79 -0.39 103.07 106.67 1a4u h GLY 110 Ca 0.27 -0.52 -0.06 0.00 0.00 0.00 0.00 47.33 47.01 1a4u h GLY 110 CO -0.30 0.51 0.10 -2.00 0.00 0.00 0.00 176.54 174.84 1a4u h LEU 111 N 1.20 0.89 -0.54 3.11 6.46 -1.61 -1.10 115.31 123.73 1a4u h LEU 111 Ca 0.32 -0.26 -0.08 0.00 -0.12 0.00 0.00 57.88 57.74 1a4u h LEU 111 Cb -0.06 -0.24 -0.02 0.00 -0.73 0.00 0.00 40.66 39.62 1a4u h LEU 111 CO -0.06 0.92 0.03 0.58 -0.62 0.00 0.00 178.44 179.29 1a4u h VAL 112 N 0.82 1.26 -0.37 1.05 2.07 -0.97 -2.06 116.25 118.05 1a4u h VAL 112 Ca 0.17 -1.06 -0.11 0.00 0.82 0.00 0.00 66.70 66.52 1a4u h VAL 112 Cb 0.40 0.88 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 1a4u h VAL 112 CO 0.01 0.38 -0.19 0.78 0.02 0.00 0.00 177.57 178.56 1a4u h ASN 113 N 0.81 0.81 -0.74 0.57 2.35 -0.91 0.11 115.58 118.57 1a4u h ASN 113 Ca 0.16 -0.41 -0.04 0.00 -0.55 0.00 0.00 56.30 55.45 1a4u h ASN 113 Cb 0.49 -0.22 -0.03 0.00 0.05 0.00 0.00 38.32 38.61 1a4u h ASN 113 CO 0.02 1.04 0.30 0.74 -1.65 0.00 0.00 177.43 177.88 1a4u h THR 114 N 0.57 1.25 -0.46 2.81 2.02 -1.19 0.64 112.91 118.55 1a4u h THR 114 Ca 0.08 -0.78 -0.04 0.00 0.77 0.00 0.00 66.41 66.44 1a4u h THR 114 Cb 0.74 0.38 -0.02 0.00 -1.74 0.00 0.00 68.15 67.52 1a4u h THR 114 CO 0.06 0.32 0.15 0.74 0.37 0.00 0.00 175.52 177.15 1a4u h THR 115 N 1.06 1.22 -0.51 3.16 2.02 -1.21 -1.66 112.91 117.00 1a4u h THR 115 Ca 0.25 -0.73 -0.04 0.00 0.77 0.00 0.00 66.41 66.66 1a4u h THR 115 Cb 0.21 0.83 -0.02 0.00 -1.74 0.00 0.00 68.15 67.42 1a4u h THR 115 CO -0.02 0.26 0.17 0.74 0.37 0.00 0.00 175.52 177.04 1a4u h THR 116 N 0.61 1.20 -0.11 3.16 2.02 -0.56 -2.42 112.91 116.82 1a4u h THR 116 Ca 0.15 -0.67 -0.02 0.00 0.77 0.00 0.00 66.41 66.64 1a4u h THR 116 Cb 0.26 0.63 -0.00 0.00 -1.74 0.00 0.00 68.15 67.29 1a4u h THR 116 CO -0.01 0.25 -0.01 0.00 0.37 0.00 0.00 175.52 176.13 1a4u h ALA 117 N 1.46 0.14 0.00 6.16 0.00 -0.45 -3.15 119.26 123.41 1a4u h ALA 117 Ca 0.17 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 1a4u h ALA 117 Cb 0.20 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1a4u h ALA 117 CO -0.01 -0.16 -0.23 0.97 0.00 0.00 0.00 179.25 179.82 1a4u h ILE 118 N -0.10 0.75 0.00 0.00 2.10 -1.17 -2.52 117.51 116.58 1a4u h ILE 118 Ca 0.03 -0.98 0.00 0.00 1.08 0.00 0.00 64.86 64.99 1a4u h ILE 118 Cb 0.37 1.61 0.00 0.00 -1.09 0.00 0.00 36.82 37.71 1a4u h ILE 118 CO 0.01 0.23 0.00 -0.07 -1.08 0.00 0.00 178.15 177.24 1a4u h LEU 119 N 0.00 0.00 -1.57 2.19 -0.00 -1.39 -0.52 115.31 114.02 1a4u h LEU 119 Ca -0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 57.88 57.83 1a4u h LEU 119 Cb 0.59 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.24 1a4u h LEU 119 CO 0.03 0.00 -0.23 -0.78 -0.00 0.00 0.00 178.44 177.46 1a4u h ASP 120 N 0.00 0.00 0.00 -0.43 3.58 -1.56 0.43 116.42 118.44 1a4u h ASP 120 Ca 0.00 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.44 1a4u h ASP 120 Cb 0.05 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.10 1a4u h ASP 120 CO 0.00 0.23 -1.93 0.49 -2.88 0.00 0.00 179.24 175.15 1a4u n PHE 121 N -3.91 0.00 -0.04 0.28 3.01 -0.26 -4.61 117.46 111.92 1a4u n PHE 121 Ca -0.02 0.00 0.02 0.00 1.01 0.00 0.00 57.45 58.46 1a4u n PHE 121 Cb 0.31 -0.47 -0.14 0.00 -0.01 0.00 0.00 39.48 39.17 1a4u n PHE 121 CO 0.00 0.00 0.00 0.91 1.01 0.00 0.00 176.76 178.68 1a4u n TRP 122 N -2.21 0.00 -1.62 1.38 8.01 -0.86 -4.34 117.44 117.80 1a4u n TRP 122 Ca -0.04 0.00 -0.53 0.00 -1.31 0.00 0.00 57.50 55.62 1a4u n TRP 122 Cb 0.54 -0.60 -0.06 0.00 -2.01 0.00 0.00 31.31 29.17 1a4u n TRP 122 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.69 173.21 1a4u n ASP 123 N -2.35 2.59 0.27 -0.99 -0.08 0.13 -0.65 116.55 115.48 1a4u n ASP 123 Ca -0.14 0.83 0.13 0.00 -1.51 0.00 0.00 54.79 54.11 1a4u n ASP 123 Cb 0.72 -1.24 0.79 0.00 2.34 0.00 0.00 41.12 43.73 1a4u n ASP 123 CO 0.00 0.00 0.00 0.07 0.12 0.00 0.00 177.20 177.39 1a4u h LYS 124 N 9.46 0.00 0.00 -0.67 2.10 -1.33 0.10 116.57 126.23 1a4u h LYS 124 Ca -0.41 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.22 1a4u h LYS 124 Cb 1.31 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.63 1a4u h LYS 124 CO 0.98 0.08 -0.10 0.00 -2.00 0.00 0.00 179.45 178.41 1a4u h ARG 125 N 0.00 0.00 -0.53 0.07 3.08 -1.82 -1.38 114.38 113.81 1a4u h ARG 125 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1a4u h ARG 125 Cb 0.22 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.27 1a4u h ARG 125 CO 0.01 0.10 0.00 1.63 -1.07 0.00 0.00 179.97 180.64 1a4u n LYS 126 N -3.37 3.89 -0.87 0.04 5.02 -0.23 -4.90 118.16 117.75 1a4u n LYS 126 Ca -0.01 -2.91 0.00 0.00 -2.02 0.00 0.00 58.31 53.37 1a4u n LYS 126 Cb 0.28 -1.96 0.00 0.00 -0.02 0.00 0.00 35.03 33.33 1a4u n LYS 126 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1a4u n GLY 127 N 0.61 0.66 3.77 0.72 0.00 -0.52 -5.00 105.19 105.42 1a4u n GLY 127 Ca 0.25 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.96 1a4u n GLY 127 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1a4u s GLY 128 N -1.97 1.64 0.00 -0.02 0.00 0.19 -4.93 107.32 102.23 1a4u s GLY 128 Ca 0.00 0.00 0.29 0.00 0.00 0.00 0.00 44.72 45.01 1a4u s GLY 128 CO 0.00 0.42 1.91 -1.55 0.00 0.00 0.00 173.10 173.87 1a4u n PRO 129 N -3.58 1.02 0.00 2.90 -0.04 -1.24 -3.95 135.00 130.11 1a4u n PRO 129 Ca 0.08 -0.37 0.00 0.00 -0.04 0.00 0.00 63.50 63.16 1a4u n PRO 129 Cb 0.55 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.51 1a4u n PRO 129 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1a4u n GLY 130 N 1.19 -2.28 1.24 0.55 0.00 0.17 -4.98 105.19 101.08 1a4u n GLY 130 Ca 0.18 -1.62 0.01 0.00 0.00 0.00 0.00 46.02 44.59 1a4u n GLY 130 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1a4u n GLY 131 N -0.26 0.31 3.05 -0.02 0.00 -1.00 -4.79 105.19 102.47 1a4u n GLY 131 Ca 0.00 -0.87 -0.23 0.00 0.00 0.00 0.00 46.02 44.92 1a4u n GLY 131 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1a4u s ILE 132 N -2.01 1.10 -0.12 -0.61 1.01 -1.11 -0.84 121.20 118.62 1a4u s ILE 132 Ca 0.10 -0.51 0.02 0.00 0.00 0.00 0.00 60.65 60.26 1a4u s ILE 132 Cb -0.00 -0.97 0.01 0.00 0.01 0.00 0.00 42.46 41.51 1a4u s ILE 132 CO -0.01 0.33 -0.19 -0.63 0.00 0.00 0.00 174.94 174.44 1a4u s ILE 133 N 0.26 1.80 -0.29 2.92 1.01 0.21 -1.43 121.20 125.68 1a4u s ILE 133 Ca -0.06 -0.83 -0.05 0.00 0.00 0.00 0.00 60.65 59.72 1a4u s ILE 133 Cb -0.11 -1.60 0.03 0.00 0.01 0.00 0.00 42.46 40.78 1a4u s ILE 133 CO 0.02 0.50 0.04 0.00 0.00 0.00 0.00 174.94 175.49 1a4u s ALA 134 N 0.85 2.92 -0.24 9.38 0.00 0.03 -2.14 121.76 132.56 1a4u s ALA 134 Ca -0.08 -1.57 -0.10 0.00 0.00 0.00 0.00 51.96 50.21 1a4u s ALA 134 Cb -0.15 -2.02 -0.05 0.00 0.00 0.00 0.00 23.12 20.90 1a4u s ALA 134 CO -0.01 -1.05 0.14 -0.80 0.00 0.00 0.00 175.76 174.05 1a4u s ASN 135 N 1.39 5.89 -0.43 0.00 0.01 -0.70 -1.35 114.94 119.75 1a4u s ASN 135 Ca -0.00 0.04 -0.25 0.00 -0.71 0.00 0.00 52.86 51.94 1a4u s ASN 135 Cb -0.18 -2.06 0.02 0.00 0.41 0.00 0.00 41.25 39.44 1a4u s ASN 135 CO 0.00 0.05 0.88 -0.63 -1.51 0.00 0.00 177.10 175.89 1a4u s ILE 136 N 1.17 4.55 0.00 0.60 1.01 -0.52 -0.16 121.20 127.85 1a4u s ILE 136 Ca 0.07 0.75 0.00 0.00 0.00 0.00 0.00 60.65 61.47 1a4u s ILE 136 Cb -0.14 -4.37 0.00 0.00 0.01 0.00 0.00 42.46 37.96 1a4u s ILE 136 CO 0.05 -0.72 0.00 0.00 0.00 0.00 0.00 174.94 174.27 1a4u n SER 138 N 0.00 0.00 0.28 0.00 2.88 -1.26 -4.61 113.62 110.91 1a4u n SER 138 Ca 0.00 0.00 0.19 0.00 -1.33 0.00 0.00 58.87 57.73 1a4u n SER 138 Cb 0.00 0.00 0.91 0.00 -0.75 0.00 0.00 64.21 64.37 1a4u n SER 138 CO 0.00 0.00 0.00 -0.37 -1.23 0.00 0.00 175.04 173.44 1a4u h VAL 139 N 0.28 0.00 0.00 2.46 -1.51 -1.67 0.93 116.25 116.74 1a4u h VAL 139 Ca 0.00 -0.18 0.00 0.00 -1.23 0.00 0.00 66.70 65.29 1a4u h VAL 139 Cb 0.00 1.08 0.00 0.00 -2.13 0.00 0.00 31.29 30.24 1a4u h VAL 139 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 177.57 176.69 1a4u n THR 140 N -2.90 1.04 0.31 7.19 -2.24 -1.26 -1.11 114.28 115.31 1a4u n THR 140 Ca -0.01 0.28 0.13 0.00 -2.27 0.00 0.00 64.05 62.18 1a4u n THR 140 Cb 0.15 -1.11 0.28 0.00 -2.10 0.00 0.00 70.33 67.56 1a4u n THR 140 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1a4u h GLY 141 N 2.15 0.00 0.00 3.38 0.00 -1.00 -3.14 103.07 104.45 1a4u h GLY 141 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.21 1a4u h GLY 141 CO 0.00 0.00 -0.84 0.74 0.00 0.00 0.00 176.54 176.44 1a4u h PHE 142 N 0.00 0.00 -3.28 5.60 0.04 -1.27 -3.37 116.94 114.66 1a4u h PHE 142 Ca 0.00 0.00 -0.39 0.00 2.80 0.00 0.00 57.97 60.38 1a4u h PHE 142 Cb 0.88 0.00 -0.39 0.00 2.20 0.00 0.00 35.95 38.64 1a4u h PHE 142 CO 0.00 0.81 -0.75 -0.80 -0.60 0.00 0.00 178.31 176.97 1a4u s ASN 143 N -6.32 1.35 0.80 2.17 -0.87 -1.03 -5.11 114.94 105.93 1a4u s ASN 143 Ca -0.21 -0.02 -0.11 0.00 -1.57 0.00 0.00 52.86 50.95 1a4u s ASN 143 Cb 0.04 -0.22 0.08 0.00 -0.02 0.00 0.00 41.25 41.13 1a4u s ASN 143 CO 0.42 -0.25 1.12 0.00 -2.57 0.00 0.00 177.10 175.82 1a4u s ALA 144 N 2.12 2.04 -0.59 0.60 0.00 -1.19 -4.13 121.76 120.62 1a4u s ALA 144 Ca 0.05 0.43 -0.15 0.00 0.00 0.00 0.00 51.96 52.28 1a4u s ALA 144 Cb -0.12 -3.34 0.15 0.00 0.00 0.00 0.00 23.12 19.80 1a4u s ALA 144 CO -0.04 -2.02 0.54 0.42 0.00 0.00 0.00 175.76 174.66 1a4u s ILE 145 N -2.72 5.18 0.11 0.00 1.01 -1.26 -4.93 121.20 118.58 1a4u s ILE 145 Ca 0.64 -1.73 0.22 0.00 0.00 0.00 0.00 60.65 59.78 1a4u s ILE 145 Cb -0.20 -4.30 0.22 0.00 0.01 0.00 0.00 42.46 38.19 1a4u s ILE 145 CO 0.55 -0.89 1.63 1.12 0.00 0.00 0.00 174.94 177.34 1a4u h HIS 146 N 8.62 0.00 0.00 3.97 2.07 -1.97 -0.49 115.15 127.34 1a4u h HIS 146 Ca -0.21 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.30 1a4u h HIS 146 Cb 1.08 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 31.06 1a4u h HIS 146 CO 0.78 0.00 -0.03 1.96 -3.07 0.00 0.00 177.93 177.57 1a4u h GLN 147 N 0.00 0.00 -2.12 5.12 7.50 -1.98 -3.23 115.11 120.40 1a4u h GLN 147 Ca 0.00 0.00 -0.57 0.00 0.50 0.00 0.00 58.65 58.58 1a4u h GLN 147 Cb 0.35 0.00 -0.41 0.00 0.05 0.00 0.00 27.48 27.47 1a4u h GLN 147 CO 0.00 0.03 -0.82 1.33 -1.50 0.00 0.00 178.83 177.87 1a4u n VAL 148 N -3.11 1.23 0.04 -0.54 0.24 -0.19 -1.90 118.33 114.09 1a4u n VAL 148 Ca 0.02 -4.82 0.02 0.00 -2.04 0.00 0.00 64.34 57.52 1a4u n VAL 148 Cb 0.45 -1.79 0.36 0.00 -1.47 0.00 0.00 33.84 31.39 1a4u n VAL 148 CO 0.00 0.00 0.00 1.55 -2.14 0.00 0.00 176.83 176.24 1a4u h PRO 149 N 3.85 0.44 -0.14 7.34 0.13 -1.60 -2.05 132.00 139.97 1a4u h PRO 149 Ca 0.14 -0.08 -0.09 0.00 -0.87 0.00 0.00 66.00 65.11 1a4u h PRO 149 Cb 0.74 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 31.80 1a4u h PRO 149 CO 0.68 0.45 -0.25 0.28 -0.23 0.00 0.00 178.00 178.93 1a4u h VAL 150 N 0.43 1.37 0.14 1.56 2.07 -1.92 0.01 116.25 119.91 1a4u h VAL 150 Ca 0.10 -1.50 -0.00 0.00 0.82 0.00 0.00 66.70 66.11 1a4u h VAL 150 Cb 0.24 2.01 -0.00 0.00 -1.52 0.00 0.00 31.29 32.02 1a4u h VAL 150 CO 0.00 0.44 -0.08 0.22 0.02 0.00 0.00 177.57 178.18 1a4u h TYR 151 N 0.01 -0.20 -0.79 1.57 3.20 -1.92 -0.04 116.97 118.80 1a4u h TYR 151 Ca 0.01 -0.00 0.05 0.00 3.14 0.00 0.00 58.73 61.93 1a4u h TYR 151 Cb 0.83 0.07 -0.06 0.00 1.54 0.00 0.00 36.73 39.12 1a4u h TYR 151 CO 0.10 -0.13 0.48 0.77 -1.64 0.00 0.00 178.16 177.74 1a4u h SER 152 N -0.21 0.76 -0.62 -2.11 0.02 -1.37 -1.76 113.55 108.27 1a4u h SER 152 Ca -0.01 0.01 -0.08 0.00 -0.84 0.00 0.00 61.79 60.87 1a4u h SER 152 Cb 0.17 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 62.54 1a4u h SER 152 CO 0.02 0.50 0.09 0.00 -1.14 0.00 0.00 176.83 176.30 1a4u h ALA 153 N 1.37 0.82 -0.24 3.77 0.00 -0.68 -0.63 119.26 123.66 1a4u h ALA 153 Ca 0.34 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 1a4u h ALA 153 Cb 0.13 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1a4u h ALA 153 CO -0.16 0.58 -0.02 0.66 0.00 0.00 0.00 179.25 180.32 1a4u h SER 154 N 0.93 0.34 0.40 0.00 4.64 -0.43 -1.73 113.55 117.70 1a4u h SER 154 Ca 0.19 -0.05 -0.22 0.00 -0.47 0.00 0.00 61.79 61.24 1a4u h SER 154 Cb 0.44 -0.09 -0.00 0.00 -0.31 0.00 0.00 62.40 62.44 1a4u h SER 154 CO 0.01 0.42 -0.91 0.11 -0.87 0.00 0.00 176.83 175.59 1a4u h LYS 155 N 0.35 0.35 -0.39 4.77 1.79 -0.82 -2.86 116.57 119.76 1a4u h LYS 155 Ca 0.08 -0.37 -0.04 0.00 -2.18 0.00 0.00 60.65 58.14 1a4u h LYS 155 Cb 0.28 0.10 -0.02 0.00 -1.58 0.00 0.00 32.23 31.01 1a4u h LYS 155 CO 0.01 1.05 0.08 0.00 -1.08 0.00 0.00 179.45 179.51 1a4u h ALA 156 N 0.82 1.40 -0.42 3.86 0.00 -0.62 -1.68 119.26 122.63 1a4u h ALA 156 Ca -0.07 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 1a4u h ALA 156 Cb 1.54 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 19.14 1a4u h ALA 156 CO 0.15 0.43 0.19 0.00 0.00 0.00 0.00 179.25 180.03 1a4u h ALA 157 N 1.52 0.54 -0.03 0.00 0.00 -1.18 -2.35 119.26 117.75 1a4u h ALA 157 Ca 0.13 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.81 1a4u h ALA 157 Cb 0.25 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1a4u h ALA 157 CO -0.00 0.11 -0.52 0.28 0.00 0.00 0.00 179.25 179.12 1a4u h VAL 158 N 0.53 1.37 -0.60 0.00 2.07 -1.21 -0.19 116.25 118.21 1a4u h VAL 158 Ca 0.14 -1.79 -0.08 0.00 0.82 0.00 0.00 66.70 65.79 1a4u h VAL 158 Cb 0.14 1.93 -0.02 0.00 -1.52 0.00 0.00 31.29 31.81 1a4u h VAL 158 CO -0.02 0.52 0.06 0.58 0.02 0.00 0.00 177.57 178.73 1a4u h VAL 159 N 0.07 1.26 -0.08 2.57 2.07 -1.15 -0.26 116.25 120.73 1a4u h VAL 159 Ca -0.00 -1.05 -0.03 0.00 0.82 0.00 0.00 66.70 66.43 1a4u h VAL 159 Cb 0.94 0.73 -0.00 0.00 -1.52 0.00 0.00 31.29 31.44 1a4u h VAL 159 CO 0.07 0.39 -0.09 -1.28 0.02 0.00 0.00 177.57 176.68 1a4u h SER 160 N 0.94 0.21 -0.71 0.57 0.87 -1.08 -2.19 113.55 112.16 1a4u h SER 160 Ca 0.18 -0.49 0.04 0.00 -1.23 0.00 0.00 61.79 60.29 1a4u h SER 160 Cb 0.46 -0.06 -0.05 0.00 -0.44 0.00 0.00 62.40 62.32 1a4u h SER 160 CO 0.02 0.66 0.44 0.15 -0.53 0.00 0.00 176.83 177.57 1a4u h PHE 161 N -0.23 0.82 -0.67 2.24 3.57 -0.91 -1.11 116.94 120.65 1a4u h PHE 161 Ca 0.01 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.47 1a4u h PHE 161 Cb 0.60 -0.26 -0.03 0.00 2.79 0.00 0.00 35.95 39.05 1a4u h PHE 161 CO 0.09 0.45 0.16 1.15 -2.23 0.00 0.00 178.31 177.93 1a4u h THR 162 N 0.84 1.26 -0.94 4.41 2.02 -1.05 -0.59 112.91 118.86 1a4u h THR 162 Ca 0.30 -0.95 0.00 0.00 0.77 0.00 0.00 66.41 66.53 1a4u h THR 162 Cb 0.07 0.59 -0.05 0.00 -1.74 0.00 0.00 68.15 67.03 1a4u h THR 162 CO -0.13 0.36 0.60 0.78 0.37 0.00 0.00 175.52 177.50 1a4u h ASN 163 N 1.00 1.10 -0.39 4.18 -0.26 -0.72 -1.98 115.58 118.51 1a4u h ASN 163 Ca 0.21 -0.04 -0.10 0.00 -0.56 0.00 0.00 56.30 55.80 1a4u h ASN 163 Cb 0.36 -0.28 -0.01 0.00 -1.06 0.00 0.00 38.32 37.34 1a4u h ASN 163 CO 0.00 0.82 -0.16 0.28 -1.06 0.00 0.00 177.43 177.31 1a4u h SER 164 N 1.29 0.82 -0.56 5.81 0.02 -0.75 -2.79 113.55 117.39 1a4u h SER 164 Ca 0.34 -0.39 0.08 0.00 -0.84 0.00 0.00 61.79 60.98 1a4u h SER 164 Cb -0.11 -0.23 -0.06 0.00 0.14 0.00 0.00 62.40 62.14 1a4u h SER 164 CO -0.07 1.03 0.22 -0.07 -1.14 0.00 0.00 176.83 176.80 1a4u h LEU 165 N 0.61 0.25 -1.10 5.07 3.38 -0.64 -1.48 115.31 121.39 1a4u h LEU 165 Ca 0.09 0.06 0.02 0.00 0.09 0.00 0.00 57.88 58.14 1a4u h LEU 165 Cb 0.71 0.03 -0.05 0.00 0.09 0.00 0.00 40.66 41.44 1a4u h LEU 165 CO 0.05 0.16 0.61 0.00 0.09 0.00 0.00 178.44 179.35 1a4u h ALA 166 N 1.37 1.37 0.00 1.53 0.00 -1.24 -1.68 119.26 120.61 1a4u h ALA 166 Ca 0.27 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 1a4u h ALA 166 Cb 0.29 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 1a4u h ALA 166 CO -0.26 0.57 -0.04 0.87 0.00 0.00 0.00 179.25 180.39 1a4u h LYS 167 N 1.21 0.00 -0.01 0.00 1.57 -1.03 -2.73 116.57 115.58 1a4u h LYS 167 Ca 0.35 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.13 1a4u h LYS 167 Cb -0.09 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.22 1a4u h LYS 167 CO -0.09 0.04 -0.27 1.28 -0.57 0.00 0.00 179.45 179.85 1a4u n LEU 168 N -3.15 0.83 -0.27 2.94 4.77 -0.65 -4.44 117.00 117.02 1a4u n LEU 168 Ca 0.01 -0.16 0.06 0.00 -0.03 0.00 0.00 56.01 55.88 1a4u n LEU 168 Cb 0.36 -0.16 0.16 0.00 -2.33 0.00 0.00 43.42 41.45 1a4u n LEU 168 CO 0.29 0.16 0.79 0.00 -1.33 0.00 0.00 177.39 177.30 1a4u h ALA 169 N 3.55 0.77 0.00 -1.18 0.00 -1.22 0.16 119.26 121.34 1a4u h ALA 169 Ca 0.00 0.27 0.00 0.00 0.00 0.00 0.00 54.91 55.18 1a4u h ALA 169 Cb 0.48 0.48 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1a4u h ALA 169 CO 0.00 -0.44 0.05 -1.35 0.00 0.00 0.00 179.25 177.52 1a4u h PRO 170 N 0.07 0.00 0.02 0.00 0.11 -1.83 0.57 132.00 130.94 1a4u h PRO 170 Ca 0.43 0.00 -0.39 0.00 0.11 0.00 0.00 66.00 66.15 1a4u h PRO 170 Cb 0.75 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 31.80 1a4u h PRO 170 CO -0.73 0.00 -2.36 -0.89 -0.21 0.00 0.00 178.00 173.81 1a4u n ILE 171 N -2.95 1.55 0.00 4.15 5.41 0.47 -4.62 119.36 123.37 1a4u n ILE 171 Ca -0.03 -0.55 0.02 0.00 1.00 0.00 0.00 62.75 63.19 1a4u n ILE 171 Cb 0.11 -1.55 -0.11 0.00 -0.71 0.00 0.00 39.64 37.39 1a4u n ILE 171 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 1a4u n THR 172 N -3.44 0.86 -0.80 1.39 -2.24 -0.57 -4.39 114.28 105.09 1a4u n THR 172 Ca -0.44 -0.66 0.00 0.00 -2.27 0.00 0.00 64.05 60.68 1a4u n THR 172 Cb 0.98 -0.45 0.00 0.00 -2.10 0.00 0.00 70.33 68.76 1a4u n THR 172 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1a4u n GLY 173 N 1.41 0.94 3.52 3.38 0.00 0.20 -1.33 105.19 113.29 1a4u n GLY 173 Ca -0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.51 1a4u n GLY 173 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1a4u s VAL 174 N -3.62 5.08 0.46 1.61 1.01 -1.25 -2.39 120.40 121.29 1a4u s VAL 174 Ca 0.00 -0.19 -0.01 0.00 0.00 0.00 0.00 61.98 61.78 1a4u s VAL 174 Cb 0.00 -3.55 -0.01 0.00 0.00 0.00 0.00 36.38 32.82 1a4u s VAL 174 CO 0.00 0.08 0.70 0.42 0.00 0.00 0.00 175.10 176.30 1a4u s THR 175 N 1.70 4.23 0.05 3.92 -4.23 -0.02 -4.06 115.64 117.24 1a4u s THR 175 Ca 0.06 -0.33 -0.27 0.00 -1.18 0.00 0.00 61.69 59.97 1a4u s THR 175 Cb -0.17 -3.58 0.07 0.00 1.34 0.00 0.00 72.50 70.16 1a4u s THR 175 CO 0.09 -0.45 0.65 0.00 -0.54 0.00 0.00 174.62 174.37 1a4u s ALA 176 N -2.60 -1.69 0.12 3.99 0.00 -1.26 -0.62 121.76 119.70 1a4u s ALA 176 Ca 0.48 0.91 -0.19 0.00 0.00 0.00 0.00 51.96 53.15 1a4u s ALA 176 Cb -0.10 0.44 0.05 0.00 0.00 0.00 0.00 23.12 23.51 1a4u s ALA 176 CO 0.39 -0.57 0.47 1.52 0.00 0.00 0.00 175.76 177.57 1a4u s TYR 177 N -2.49 -0.33 0.02 0.00 -0.85 -0.91 0.31 117.35 113.10 1a4u s TYR 177 Ca -0.05 0.10 0.03 0.00 -0.52 0.00 0.00 57.07 56.63 1a4u s TYR 177 Cb -0.01 0.35 -0.04 0.00 0.38 0.00 0.00 41.96 42.65 1a4u s TYR 177 CO -0.02 -0.73 -0.03 -1.54 -1.52 0.00 0.00 175.55 171.71 1a4u s SER 178 N -2.65 4.87 -0.27 -0.18 1.04 -0.73 -1.71 113.70 114.06 1a4u s SER 178 Ca 0.01 -0.11 -0.04 0.00 0.48 0.00 0.00 55.95 56.29 1a4u s SER 178 Cb 0.01 -1.18 0.02 0.00 0.10 0.00 0.00 66.02 64.96 1a4u s SER 178 CO -0.11 0.26 0.00 -0.63 0.98 0.00 0.00 173.24 173.75 1a4u s ILE 179 N -1.09 3.31 -0.46 -1.02 -1.09 0.77 -1.23 121.20 120.40 1a4u s ILE 179 Ca 0.20 -0.95 0.03 0.00 -2.23 0.00 0.00 60.65 57.69 1a4u s ILE 179 Cb -0.11 -2.72 0.12 0.00 -1.58 0.00 0.00 42.46 38.16 1a4u s ILE 179 CO 0.10 0.11 0.20 0.20 -1.23 0.00 0.00 174.94 174.32 1a4u s ASN 180 N 1.38 4.67 0.43 3.58 0.01 0.79 0.03 114.94 125.83 1a4u s ASN 180 Ca 0.00 -2.60 -0.23 0.00 -0.71 0.00 0.00 52.86 49.33 1a4u s ASN 180 Cb -0.17 -1.68 -0.09 0.00 0.41 0.00 0.00 41.25 39.72 1a4u s ASN 180 CO -0.01 -0.33 1.06 -2.84 -1.51 0.00 0.00 177.10 173.47 1a4u s PRO 181 N 0.29 4.02 0.00 -0.60 0.02 -1.26 -0.93 135.00 136.54 1a4u s PRO 181 Ca 0.14 1.50 0.00 0.00 0.02 0.00 0.00 61.00 62.66 1a4u s PRO 181 Cb -0.23 -2.40 0.00 0.00 0.02 0.00 0.00 34.50 31.90 1a4u s PRO 181 CO -0.04 -0.27 0.00 0.41 -0.33 0.00 0.00 177.00 176.78 1a4u n GLY 182 N 0.18 0.32 3.68 0.52 0.00 0.83 -2.51 105.19 108.22 1a4u n GLY 182 Ca 0.06 -1.83 -0.42 0.00 0.00 0.00 0.00 46.02 43.83 1a4u n GLY 182 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1a4u s ILE 183 N 0.49 2.89 0.06 -0.61 -1.09 -1.26 -4.94 121.20 116.74 1a4u s ILE 183 Ca 0.00 0.30 0.03 0.00 -2.23 0.00 0.00 60.65 58.75 1a4u s ILE 183 Cb 0.00 -3.19 -0.03 0.00 -1.58 0.00 0.00 42.46 37.66 1a4u s ILE 183 CO 0.00 -0.01 -0.10 -0.89 -1.23 0.00 0.00 174.94 172.72 1a4u s THR 184 N 2.96 0.74 -1.21 2.92 2.01 -1.26 -2.53 115.64 119.26 1a4u s THR 184 Ca 0.78 -1.26 -0.08 0.00 0.31 0.00 0.00 61.69 61.43 1a4u s THR 184 Cb -0.42 -0.88 0.21 0.00 0.01 0.00 0.00 72.50 71.42 1a4u s THR 184 CO 0.34 -0.40 1.69 0.54 -0.69 0.00 0.00 174.62 176.10 1a4u n ARG 185 N 1.20 3.82 -0.03 4.92 3.00 -1.13 -4.43 116.66 124.01 1a4u n ARG 185 Ca -0.21 -3.88 -0.05 0.00 -0.01 0.00 0.00 57.85 53.70 1a4u n ARG 185 Cb 0.55 -2.81 -0.03 0.00 0.00 0.00 0.00 32.46 30.17 1a4u n ARG 185 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.63 177.88 1a4u n THR 186 N 2.91 0.38 -1.75 0.55 -2.24 -1.26 -4.17 114.28 108.69 1a4u n THR 186 Ca 0.35 -0.14 -0.43 0.00 -2.27 0.00 0.00 64.05 61.56 1a4u n THR 186 Cb 0.36 -0.81 -0.03 0.00 -2.10 0.00 0.00 70.33 67.75 1a4u n THR 186 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1a4u s PRO 187 N -2.13 3.59 0.20 -0.78 0.04 -1.26 -4.70 135.00 129.95 1a4u s PRO 187 Ca -0.09 2.10 -0.07 0.00 0.04 0.00 0.00 61.00 62.98 1a4u s PRO 187 Cb 0.02 -4.23 0.31 0.00 0.04 0.00 0.00 34.50 30.65 1a4u s PRO 187 CO 0.15 -1.58 1.14 1.28 0.04 0.00 0.00 177.00 178.04 1a4u n LEU 188 N 9.69 -0.30 -4.12 -3.56 4.77 -1.26 -4.16 117.00 118.06 1a4u n LEU 188 Ca 0.24 1.27 -0.27 0.00 -0.03 0.00 0.00 56.01 57.22 1a4u n LEU 188 Cb 0.44 -0.37 -0.16 0.00 -2.33 0.00 0.00 43.42 41.00 1a4u n LEU 188 CO 0.66 -1.20 -0.50 0.54 -1.33 0.00 0.00 177.39 175.56 1a4u s VAL 189 N -5.89 1.48 -0.30 4.08 0.11 -1.26 -5.11 120.40 113.51 1a4u s VAL 189 Ca -0.11 -0.71 -0.16 0.00 -2.93 0.00 0.00 61.98 58.08 1a4u s VAL 189 Cb 0.19 -1.30 -0.02 0.00 -1.53 0.00 0.00 36.38 33.72 1a4u s VAL 189 CO 0.57 0.43 0.40 -1.38 -3.33 0.00 0.00 175.10 171.79 1a4u s HIS 190 N 0.33 3.22 0.00 1.54 -3.43 -1.26 -4.91 115.29 110.79 1a4u s HIS 190 Ca -0.11 0.26 0.00 0.00 -0.80 0.00 0.00 55.06 54.41 1a4u s HIS 190 Cb -0.15 -2.67 0.00 0.00 -1.43 0.00 0.00 32.58 28.33 1a4u s HIS 190 CO 0.04 -0.35 0.00 2.41 -2.00 0.00 0.00 174.74 174.85 1a4u n THR 191 N 5.21 0.00 -4.01 -5.38 -1.04 -1.26 -4.88 114.28 102.92 1a4u n THR 191 Ca -0.08 0.00 -0.22 0.00 -2.04 0.00 0.00 64.05 61.71 1a4u n THR 191 Cb 0.50 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.98 1a4u n THR 191 CO 0.00 0.00 0.00 0.72 -0.64 0.00 0.00 175.07 175.15 1a4u s PHE 192 N 0.00 3.34 -0.09 -1.42 -0.71 -1.26 -5.08 117.98 112.76 1a4u s PHE 192 Ca 0.00 -0.03 -0.21 0.00 -1.04 0.00 0.00 56.93 55.64 1a4u s PHE 192 Cb 0.00 -1.53 -0.04 0.00 -1.21 0.00 0.00 43.02 40.24 1a4u s PHE 192 CO 0.00 0.47 0.62 -0.80 -1.34 0.00 0.00 175.22 174.17 1a4u s ASN 193 N -3.83 6.86 0.39 1.98 0.01 -1.26 -4.80 114.94 114.29 1a4u s ASN 193 Ca 0.34 1.03 -0.06 0.00 -0.71 0.00 0.00 52.86 53.45 1a4u s ASN 193 Cb -0.09 -2.36 -0.05 0.00 0.41 0.00 0.00 41.25 39.16 1a4u s ASN 193 CO 0.28 -0.08 0.69 -0.94 -1.51 0.00 0.00 177.10 175.53 1a4u s SER 194 N 0.76 6.40 0.09 -1.22 1.04 -1.26 -1.70 113.70 117.81 1a4u s SER 194 Ca 0.33 0.89 -0.31 0.00 0.48 0.00 0.00 55.95 57.34 1a4u s SER 194 Cb -0.17 -2.22 -0.09 0.00 0.10 0.00 0.00 66.02 63.64 1a4u s SER 194 CO 0.15 -0.39 1.74 0.86 0.98 0.00 0.00 173.24 176.58 1a4u s TRP 195 N -2.40 2.26 -1.17 5.02 -0.00 -0.80 -1.85 118.94 120.01 1a4u s TRP 195 Ca 0.47 0.15 0.00 0.00 -0.00 0.00 0.00 56.10 56.72 1a4u s TRP 195 Cb -0.10 -4.06 0.00 0.00 -0.00 0.00 0.00 33.47 29.31 1a4u s TRP 195 CO 0.35 -4.33 0.00 1.28 -0.00 0.00 0.00 176.95 174.25 1a4u n LEU 196 N 5.73 -1.11 -3.93 5.86 4.77 -1.26 -1.75 117.00 125.31 1a4u n LEU 196 Ca 0.17 0.22 -0.30 0.00 -0.03 0.00 0.00 56.01 56.07 1a4u n LEU 196 Cb 0.40 -2.11 0.02 0.00 -2.33 0.00 0.00 43.42 39.39 1a4u n LEU 196 CO 0.64 -0.29 0.06 0.47 -1.33 0.00 0.00 177.39 176.94 1a4u n ASP 197 N -1.41 -4.02 0.24 -1.43 8.00 -0.77 -4.86 116.55 112.29 1a4u n ASP 197 Ca -0.14 -0.82 0.09 0.00 0.71 0.00 0.00 54.79 54.63 1a4u n ASP 197 Cb 0.56 -3.75 0.58 0.00 -0.02 0.00 0.00 41.12 38.49 1a4u n ASP 197 CO 0.00 0.00 0.00 -0.37 -0.39 0.00 0.00 177.20 176.44 1a4u h VAL 198 N -1.99 0.77 -1.44 2.53 -1.51 -1.56 -3.39 116.25 109.66 1a4u h VAL 198 Ca -0.59 -0.81 -0.19 0.00 -1.23 0.00 0.00 66.70 63.89 1a4u h VAL 198 Cb 1.38 1.49 -0.25 0.00 -2.13 0.00 0.00 31.29 31.78 1a4u h VAL 198 CO 0.67 0.20 -0.54 -0.70 -1.23 0.00 0.00 177.57 175.96 1a4u s GLU 199 N -4.14 0.69 0.00 5.19 2.56 -1.26 -5.01 118.70 116.73 1a4u s GLU 199 Ca -0.02 -0.38 0.13 0.00 0.00 0.00 0.00 54.97 54.69 1a4u s GLU 199 Cb 0.13 -0.25 0.58 0.00 2.00 0.00 0.00 34.13 36.60 1a4u s GLU 199 CO 0.63 -1.16 1.37 -0.35 -0.56 0.00 0.00 175.26 175.19 1a4u n PRO 200 N 4.54 0.07 -0.70 4.30 -0.04 -1.26 -2.89 135.00 139.02 1a4u n PRO 200 Ca 0.09 0.24 0.03 0.00 -0.04 0.00 0.00 63.50 63.82 1a4u n PRO 200 Cb 0.51 -1.50 0.28 0.00 -0.04 0.00 0.00 33.50 32.76 1a4u n PRO 200 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1a4u n ARG 201 N -1.41 3.23 -0.12 0.54 1.74 -1.26 -4.74 116.66 114.64 1a4u n ARG 201 Ca 0.04 -3.00 -0.04 0.00 -0.77 0.00 0.00 57.85 54.08 1a4u n ARG 201 Cb 0.13 -1.99 0.03 0.00 -1.02 0.00 0.00 32.46 29.61 1a4u n ARG 201 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1a4u h VAL 202 N 2.19 0.65 0.05 1.55 2.07 -1.85 -0.67 116.25 120.24 1a4u h VAL 202 Ca 0.10 -0.02 0.01 0.00 0.82 0.00 0.00 66.70 67.60 1a4u h VAL 202 Cb 1.76 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 32.10 1a4u h VAL 202 CO 0.41 0.01 -0.07 0.00 0.02 0.00 0.00 177.57 177.94 1a4u h ALA 203 N 1.38 -0.12 -0.47 1.67 0.00 -1.87 -0.15 119.26 119.70 1a4u h ALA 203 Ca 0.20 -0.01 0.09 0.00 0.00 0.00 0.00 54.91 55.19 1a4u h ALA 203 Cb 0.30 0.11 -0.07 0.00 0.00 0.00 0.00 17.79 18.12 1a4u h ALA 203 CO -0.37 -0.58 0.03 1.49 0.00 0.00 0.00 179.25 179.82 1a4u h GLU 204 N -0.15 0.14 -0.26 0.00 4.81 -1.78 -1.78 114.58 115.55 1a4u h GLU 204 Ca 0.01 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.20 1a4u h GLU 204 Cb 0.16 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.50 1a4u h GLU 204 CO -0.04 0.09 0.04 -0.07 -0.73 0.00 0.00 179.01 178.30 1a4u h LEU 205 N 0.14 0.42 -1.17 1.64 3.38 -0.87 -3.05 115.31 115.81 1a4u h LEU 205 Ca 0.24 -0.27 0.07 0.00 0.09 0.00 0.00 57.88 58.02 1a4u h LEU 205 Cb 0.35 -0.11 -0.06 0.00 0.09 0.00 0.00 40.66 40.92 1a4u h LEU 205 CO -0.37 0.58 0.58 -0.07 0.09 0.00 0.00 178.44 179.25 1a4u h LEU 206 N 0.25 0.87 0.00 1.67 3.38 -0.65 -0.05 115.31 120.78 1a4u h LEU 206 Ca 0.08 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1a4u h LEU 206 Cb 0.34 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1a4u h LEU 206 CO 0.01 0.54 0.00 0.18 0.09 0.00 0.00 178.44 179.26 1a4u n LEU 207 N -4.50 0.00 -0.41 1.67 4.77 -0.70 -2.72 117.00 115.11 1a4u n LEU 207 Ca 0.14 0.17 0.13 0.00 -0.03 0.00 0.00 56.01 56.42 1a4u n LEU 207 Cb 0.23 -0.17 0.55 0.00 -2.33 0.00 0.00 43.42 41.70 1a4u n LEU 207 CO 0.32 -0.03 0.88 -1.20 -1.33 0.00 0.00 177.39 176.03 1a4u n SER 208 N -1.17 1.26 -4.53 -1.43 7.64 -0.03 -4.87 113.62 110.50 1a4u n SER 208 Ca 0.15 -1.48 -0.25 0.00 1.01 0.00 0.00 58.87 58.30 1a4u n SER 208 Cb 0.15 -0.03 -0.11 0.00 -1.01 0.00 0.00 64.21 63.22 1a4u n SER 208 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 1a4u s HIS 209 N -1.95 2.28 0.12 1.43 3.76 -1.10 -5.09 115.29 114.74 1a4u s HIS 209 Ca 0.37 -0.63 -0.35 0.00 -0.15 0.00 0.00 55.06 54.30 1a4u s HIS 209 Cb 0.20 -1.40 -0.15 0.00 1.11 0.00 0.00 32.58 32.34 1a4u s HIS 209 CO 0.31 0.43 1.49 -0.35 -0.85 0.00 0.00 174.74 175.78 1a4u n PRO 210 N -0.77 1.74 -3.51 8.40 -0.04 -1.26 -4.99 135.00 134.57 1a4u n PRO 210 Ca -0.05 0.63 -0.16 0.00 -0.04 0.00 0.00 63.50 63.88 1a4u n PRO 210 Cb 0.65 -2.35 -0.04 0.00 -0.04 0.00 0.00 33.50 31.71 1a4u n PRO 210 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1a4u n THR 211 N 3.12 0.00 -4.31 0.52 -2.24 -1.26 -4.90 114.28 105.21 1a4u n THR 211 Ca 0.18 -1.46 -0.16 0.00 -2.27 0.00 0.00 64.05 60.33 1a4u n THR 211 Cb 0.25 0.48 -0.10 0.00 -2.10 0.00 0.00 70.33 68.85 1a4u n THR 211 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1a4u s GLN 212 N -2.99 1.23 0.48 -0.78 -2.07 -1.05 -4.69 119.66 109.79 1a4u s GLN 212 Ca 0.10 -1.57 -0.10 0.00 -1.82 0.00 0.00 55.36 51.97 1a4u s GLN 212 Cb 0.00 -0.76 -0.05 0.00 -1.09 0.00 0.00 33.01 31.11 1a4u s GLN 212 CO 0.07 0.04 0.85 0.95 -1.32 0.00 0.00 175.29 175.89 1a4u s THR 213 N -3.26 4.77 0.40 3.63 -4.23 -1.26 -2.82 115.64 112.87 1a4u s THR 213 Ca 0.22 0.62 0.07 0.00 -1.18 0.00 0.00 61.69 61.43 1a4u s THR 213 Cb 0.03 -3.80 0.22 0.00 1.34 0.00 0.00 72.50 70.29 1a4u s THR 213 CO 0.05 -0.76 2.00 -1.28 -0.54 0.00 0.00 174.62 174.08 1a4u h SER 214 N 0.59 0.41 -0.19 3.99 0.87 -1.95 -2.28 113.55 115.00 1a4u h SER 214 Ca -0.46 -0.04 -0.18 0.00 -1.23 0.00 0.00 61.79 59.87 1a4u h SER 214 Cb 1.19 -0.10 -0.00 0.00 -0.44 0.00 0.00 62.40 63.05 1a4u h SER 214 CO 0.62 0.38 -0.57 -0.33 -0.53 0.00 0.00 176.83 176.40 1a4u h GLU 215 N 0.46 0.79 -0.85 2.24 3.07 -1.93 -1.25 114.58 117.11 1a4u h GLU 215 Ca 0.11 -0.51 -0.01 0.00 -0.50 0.00 0.00 59.36 58.45 1a4u h GLU 215 Cb 0.10 0.07 -0.04 0.00 -0.84 0.00 0.00 28.75 28.04 1a4u h GLU 215 CO -0.01 1.14 0.50 1.96 -1.40 0.00 0.00 179.01 181.20 1a4u h GLN 216 N 0.60 1.16 -0.23 2.33 4.20 -1.83 -1.48 115.11 119.86 1a4u h GLN 216 Ca 0.01 -0.11 -0.06 0.00 0.06 0.00 0.00 58.65 58.54 1a4u h GLN 216 Cb 1.17 -0.24 -0.01 0.00 0.30 0.00 0.00 27.48 28.70 1a4u h GLN 216 CO 0.12 0.82 -0.09 0.00 -0.67 0.00 0.00 178.83 179.01 1a4u h GLY 218 N 0.18 1.09 0.98 0.00 0.00 -0.87 0.10 103.07 104.55 1a4u h GLY 218 Ca 0.05 -0.33 -0.08 0.00 0.00 0.00 0.00 47.33 46.98 1a4u h GLY 218 CO 0.03 0.24 -0.04 1.46 0.00 0.00 0.00 176.54 178.24 1a4u h GLN 219 N 0.85 0.79 0.00 4.80 4.20 -1.28 -2.50 115.11 121.97 1a4u h GLN 219 Ca 0.31 -0.27 -0.08 0.00 0.06 0.00 0.00 58.65 58.67 1a4u h GLN 219 Cb 0.11 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.81 1a4u h GLN 219 CO -0.15 0.88 -0.39 -0.91 -0.67 0.00 0.00 178.83 177.59 1a4u h ASN 220 N 0.62 0.00 -0.15 1.46 2.35 -1.15 -2.23 115.58 116.49 1a4u h ASN 220 Ca 0.12 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.86 1a4u h ASN 220 Cb 0.54 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.91 1a4u h ASN 220 CO 0.03 0.39 0.07 0.15 -1.65 0.00 0.00 177.43 176.42 1a4u h PHE 221 N 0.00 0.22 -0.41 1.19 3.04 -0.48 -1.11 116.94 119.39 1a4u h PHE 221 Ca -0.00 -0.01 -0.10 0.00 3.98 0.00 0.00 57.97 61.84 1a4u h PHE 221 Cb 0.81 -0.07 -0.02 0.00 2.56 0.00 0.00 35.95 39.23 1a4u h PHE 221 CO 0.00 0.25 -0.14 0.28 -2.02 0.00 0.00 178.31 176.67 1a4u h VAL 222 N 0.12 1.26 -0.85 1.41 2.07 -1.28 -2.29 116.25 116.69 1a4u h VAL 222 Ca 0.05 -1.21 -0.01 0.00 0.82 0.00 0.00 66.70 66.35 1a4u h VAL 222 Cb 0.11 1.10 -0.04 0.00 -1.52 0.00 0.00 31.29 30.94 1a4u h VAL 222 CO -0.01 0.41 0.50 0.11 0.02 0.00 0.00 177.57 178.60 1a4u h LYS 223 N 0.68 1.16 -0.58 1.57 1.79 -1.11 -0.74 116.57 119.34 1a4u h LYS 223 Ca 0.11 -0.11 -0.06 0.00 -2.18 0.00 0.00 60.65 58.40 1a4u h LYS 223 Cb 0.63 -0.24 -0.02 0.00 -1.58 0.00 0.00 32.23 31.01 1a4u h LYS 223 CO 0.04 0.83 0.12 0.00 -1.08 0.00 0.00 179.45 179.36 1a4u h ALA 224 N 1.37 0.77 -0.62 3.86 0.00 -0.85 -0.71 119.26 123.07 1a4u h ALA 224 Ca 0.30 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1a4u h ALA 224 Cb -0.02 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 1a4u h ALA 224 CO -0.05 0.50 0.33 0.82 0.00 0.00 0.00 179.25 180.85 1a4u h ILE 225 N 0.85 1.20 -0.01 0.00 2.04 -0.83 -2.23 117.51 118.53 1a4u h ILE 225 Ca 0.18 -0.53 -0.09 0.00 1.00 0.00 0.00 64.86 65.42 1a4u h ILE 225 Cb 0.38 0.41 -0.01 0.00 -0.74 0.00 0.00 36.82 36.86 1a4u h ILE 225 CO 0.01 0.22 -0.43 -0.33 0.00 0.00 0.00 178.15 177.62 1a4u h GLU 226 N 0.85 0.02 -0.24 2.37 5.08 -0.92 -2.04 114.58 119.70 1a4u h GLU 226 Ca 0.22 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.55 1a4u h GLU 226 Cb 0.06 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 1a4u h GLU 226 CO -0.03 0.45 0.05 0.00 -1.00 0.00 0.00 179.01 178.48 1a4u h ALA 227 N 1.55 1.65 -6.66 3.43 0.00 -0.53 0.28 119.26 118.98 1a4u h ALA 227 Ca -0.00 -0.10 -0.53 0.00 0.00 0.00 0.00 54.91 54.27 1a4u h ALA 227 Cb 0.78 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1a4u h ALA 227 CO 0.06 0.27 -0.97 -1.71 0.00 0.00 0.00 179.25 176.90 1a4u n ASN 228 N -4.40 -3.39 -4.40 0.00 4.05 -0.77 -4.67 115.26 101.68 1a4u n ASN 228 Ca 0.01 -1.16 -0.41 0.00 0.45 0.00 0.00 54.58 53.46 1a4u n ASN 228 Cb 0.16 -2.42 -0.11 0.00 1.23 0.00 0.00 39.78 38.64 1a4u n ASN 228 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 177.26 173.67 1a4u s LYS 229 N -6.83 2.88 0.19 1.20 1.02 -1.26 -4.99 119.74 111.94 1a4u s LYS 229 Ca 0.36 -1.06 -0.31 0.00 0.02 0.00 0.00 55.97 54.98 1a4u s LYS 229 Cb -0.17 -3.81 -0.10 0.00 -0.52 0.00 0.00 37.83 33.23 1a4u s LYS 229 CO 0.93 -0.71 1.57 1.21 -0.92 0.00 0.00 175.35 177.42 1a4u s ASN 230 N 1.60 6.56 0.00 2.83 2.47 -1.26 -2.17 114.94 124.97 1a4u s ASN 230 Ca 0.03 2.67 0.00 0.00 0.42 0.00 0.00 52.86 55.98 1a4u s ASN 230 Cb -0.19 -2.60 0.00 0.00 -1.45 0.00 0.00 41.25 37.01 1a4u s ASN 230 CO 0.08 -0.83 0.00 0.61 -3.72 0.00 0.00 177.10 173.24 1a4u n GLY 231 N 3.44 0.83 3.77 1.21 0.00 0.15 -4.96 105.19 109.62 1a4u n GLY 231 Ca 0.13 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.76 1a4u n GLY 231 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a4u s ALA 232 N -3.25 3.18 -0.58 4.61 0.00 -0.92 -4.92 121.76 119.87 1a4u s ALA 232 Ca 0.00 0.93 0.02 0.00 0.00 0.00 0.00 51.96 52.91 1a4u s ALA 232 Cb 0.00 -3.36 0.15 0.00 0.00 0.00 0.00 23.12 19.90 1a4u s ALA 232 CO 0.00 -0.45 0.36 0.42 0.00 0.00 0.00 175.76 176.08 1a4u s ILE 233 N -1.41 3.05 -0.01 0.00 1.01 -1.26 -1.77 121.20 120.81 1a4u s ILE 233 Ca 0.56 -3.30 -0.30 0.00 0.00 0.00 0.00 60.65 57.61 1a4u s ILE 233 Cb -0.30 -3.05 -0.03 0.00 0.01 0.00 0.00 42.46 39.09 1a4u s ILE 233 CO 0.38 -0.85 1.00 0.26 0.00 0.00 0.00 174.94 175.72 1a4u s TRP 234 N -0.35 3.62 -0.26 3.97 0.52 -0.36 -1.62 118.94 124.45 1a4u s TRP 234 Ca 0.18 1.66 -0.06 0.00 0.02 0.00 0.00 56.10 57.90 1a4u s TRP 234 Cb -0.22 -3.15 -0.00 0.00 -1.15 0.00 0.00 33.47 28.95 1a4u s TRP 234 CO -0.03 -0.13 0.03 0.21 0.02 0.00 0.00 176.95 177.06 1a4u s LYS 235 N 1.16 3.25 -0.77 4.98 2.20 0.18 -0.15 119.74 130.58 1a4u s LYS 235 Ca 0.52 -0.74 -0.06 0.00 -0.36 0.00 0.00 55.97 55.33 1a4u s LYS 235 Cb -0.21 -3.24 0.20 0.00 -1.51 0.00 0.00 37.83 33.07 1a4u s LYS 235 CO 0.27 -0.33 0.65 -0.51 -0.36 0.00 0.00 175.35 175.06 1a4u s LEU 236 N 1.50 5.77 -0.02 5.43 1.43 -0.11 -1.78 118.68 130.91 1a4u s LEU 236 Ca 0.04 -3.07 0.04 0.00 -1.03 0.00 0.00 54.13 50.11 1a4u s LEU 236 Cb -0.16 -1.98 -0.01 0.00 0.03 0.00 0.00 46.19 44.07 1a4u s LEU 236 CO 0.01 -0.37 -0.13 -0.62 0.23 0.00 0.00 176.35 175.46 1a4u s ASP 237 N 0.90 1.60 -1.49 2.29 2.15 -1.10 -0.12 116.67 120.91 1a4u s ASP 237 Ca 0.21 -0.25 -0.10 0.00 0.43 0.00 0.00 52.55 52.84 1a4u s ASP 237 Cb -0.14 -0.26 0.07 0.00 -0.30 0.00 0.00 42.92 42.28 1a4u s ASP 237 CO -0.07 0.15 0.85 0.18 -0.17 0.00 0.00 175.17 176.10 1a4u n LEU 238 N 2.90 -2.57 0.00 -1.34 4.77 -1.26 -1.87 117.00 117.63 1a4u n LEU 238 Ca -0.15 -0.83 0.00 0.00 -0.03 0.00 0.00 56.01 54.99 1a4u n LEU 238 Cb 0.55 -2.50 0.00 0.00 -2.33 0.00 0.00 43.42 39.13 1a4u n LEU 238 CO 0.25 0.43 0.00 0.61 -1.33 0.00 0.00 177.39 177.35 1a4u n GLY 239 N -1.66 0.55 3.69 -0.72 0.00 -1.26 -4.97 105.19 100.82 1a4u n GLY 239 Ca -0.07 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.72 1a4u n GLY 239 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1a4u s THR 240 N -2.55 3.04 -0.18 2.61 -4.23 -0.78 -4.97 115.64 108.57 1a4u s THR 240 Ca 0.00 -1.80 0.01 0.00 -1.18 0.00 0.00 61.69 58.72 1a4u s THR 240 Cb 0.00 -2.91 0.02 0.00 1.34 0.00 0.00 72.50 70.95 1a4u s THR 240 CO 0.00 -0.23 -0.18 -0.22 -0.54 0.00 0.00 174.62 173.45 1a4u s LEU 241 N -3.78 2.13 -0.02 4.79 2.96 -1.26 -2.69 118.68 120.81 1a4u s LEU 241 Ca 0.36 -0.67 -0.03 0.00 -0.22 0.00 0.00 54.13 53.56 1a4u s LEU 241 Cb -0.03 -1.42 0.00 0.00 0.50 0.00 0.00 46.19 45.25 1a4u s LEU 241 CO 0.21 -0.03 0.07 -0.70 -1.32 0.00 0.00 176.35 174.58 1a4u s GLU 242 N 1.32 0.17 -0.26 1.98 2.12 -0.73 -4.98 118.70 118.32 1a4u s GLU 242 Ca 0.04 -0.06 -0.12 0.00 0.36 0.00 0.00 54.97 55.19 1a4u s GLU 242 Cb -0.14 0.07 -0.05 0.00 0.26 0.00 0.00 34.13 34.28 1a4u s GLU 242 CO -0.12 -0.03 0.24 0.00 -0.54 0.00 0.00 175.26 174.82 1a4u s ALA 243 N -0.35 3.57 0.23 6.30 0.00 -1.26 0.51 121.76 130.76 1a4u s ALA 243 Ca -0.04 -0.90 -0.04 0.00 0.00 0.00 0.00 51.96 50.98 1a4u s ALA 243 Cb -0.03 -2.50 -0.05 0.00 0.00 0.00 0.00 23.12 20.54 1a4u s ALA 243 CO 0.00 -0.43 0.47 0.96 0.00 0.00 0.00 175.76 176.77 1a4u s ILE 244 N 1.55 5.10 -0.25 0.00 -4.36 -0.64 -4.99 121.20 117.61 1a4u s ILE 244 Ca 0.10 -0.05 -0.13 0.00 -0.26 0.00 0.00 60.65 60.31 1a4u s ILE 244 Cb -0.15 -3.71 -0.04 0.00 1.25 0.00 0.00 42.46 39.81 1a4u s ILE 244 CO 0.08 -0.20 0.29 -0.70 0.24 0.00 0.00 174.94 174.66 1a4u s GLU 245 N -3.29 4.05 0.04 0.37 2.12 -1.26 -4.49 118.70 116.25 1a4u s GLU 245 Ca 0.42 -0.07 -0.30 0.00 0.36 0.00 0.00 54.97 55.38 1a4u s GLU 245 Cb -0.11 -3.60 -0.05 0.00 0.26 0.00 0.00 34.13 30.63 1a4u s GLU 245 CO 0.28 -0.13 1.18 -0.46 -0.54 0.00 0.00 175.26 175.59 1a4u s TRP 246 N 1.60 3.44 0.27 5.30 -0.11 -1.26 -4.99 118.94 123.20 1a4u s TRP 246 Ca 0.13 1.33 -0.29 0.00 1.22 0.00 0.00 56.10 58.48 1a4u s TRP 246 Cb -0.15 -3.39 -0.10 0.00 -1.50 0.00 0.00 33.47 28.33 1a4u s TRP 246 CO 0.08 -1.15 1.31 0.99 -4.62 0.00 0.00 176.95 173.56 1a4u s THR 247 N 1.16 2.92 -0.46 5.86 2.01 -1.26 -4.98 115.64 120.89 1a4u s THR 247 Ca 0.58 0.85 -0.16 0.00 0.31 0.00 0.00 61.69 63.27 1a4u s THR 247 Cb -0.28 -3.54 0.06 0.00 0.01 0.00 0.00 72.50 68.74 1a4u s THR 247 CO 0.28 0.17 0.41 -0.54 -0.69 0.00 0.00 174.62 174.26 1a4u s LYS 248 N -1.05 3.01 -0.10 4.92 -0.14 -1.26 -4.86 119.74 120.26 1a4u s LYS 248 Ca 0.52 -1.17 0.19 0.00 -1.36 0.00 0.00 55.97 54.16 1a4u s LYS 248 Cb -0.38 -4.08 -0.29 0.00 -1.68 0.00 0.00 37.83 31.40 1a4u s LYS 248 CO 0.46 -0.99 0.28 0.72 -0.76 0.00 0.00 175.35 175.06 1a4u n HIS 249 N 5.37 0.00 -3.67 3.18 8.25 -1.26 -5.00 115.22 122.09 1a4u n HIS 249 Ca -0.11 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.21 1a4u n HIS 249 Cb 0.45 -0.70 -0.08 0.00 1.12 0.00 0.00 29.99 30.78 1a4u n HIS 249 CO 0.00 0.00 0.00 -0.46 0.64 0.00 0.00 176.34 176.52 1a4u s TRP 250 N -3.01 -0.50 -0.02 4.41 -0.00 -1.26 -5.17 118.94 113.39 1a4u s TRP 250 Ca -0.09 1.10 0.05 0.00 -0.00 0.00 0.00 56.10 57.16 1a4u s TRP 250 Cb 0.10 0.22 -0.01 0.00 -0.00 0.00 0.00 33.47 33.78 1a4u s TRP 250 CO 0.84 -0.37 -0.16 0.34 -0.00 0.00 0.00 176.95 177.60 1a4u s ASP 251 N -0.38 1.86 0.25 5.86 -1.08 -1.26 -5.02 116.67 116.91 1a4u s ASP 251 Ca -0.05 -0.29 0.20 0.00 -0.52 0.00 0.00 52.55 51.88 1a4u s ASP 251 Cb -0.03 -0.25 0.07 0.00 -1.46 0.00 0.00 42.92 41.25 1a4u s ASP 251 CO 0.03 0.19 1.24 0.77 0.52 0.00 0.00 175.17 177.92 1a4u h SER 252 N 5.82 0.00 -0.07 -0.34 4.64 -2.06 -3.47 113.55 118.07 1a4u h SER 252 Ca -0.35 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.94 1a4u h SER 252 Cb 1.16 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.24 1a4u h SER 252 CO 0.48 0.25 -0.03 1.41 -0.87 0.00 0.00 176.83 178.08 1a4u n HIS 253 N -2.97 0.00 -0.54 4.77 -0.00 -1.26 -5.37 115.22 109.86 1a4u n HIS 253 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.71 1a4u n HIS 253 Cb 0.65 -0.97 0.00 0.00 -0.00 0.00 0.00 29.99 29.67 1a4u n HIS 253 CO 0.00 0.00 0.00 0.44 -0.00 0.00 0.00 176.34 176.78