#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 6.72 0.00 6.12 2.15 -1.26 -4.62 116.67 125.78 1a4u s ASP 2 Ca 0.00 0.89 0.31 0.00 0.43 0.00 0.00 52.55 54.18 1a4u s ASP 2 Cb 0.00 -2.39 1.67 0.00 -0.30 0.00 0.00 42.92 41.90 1a4u s ASP 2 CO 0.00 -0.45 2.12 0.18 -0.17 0.00 0.00 175.17 176.85 1a4u n LEU 3 N 5.86 0.00 -4.70 -1.34 4.77 -1.26 -4.83 117.00 115.50 1a4u n LEU 3 Ca 0.03 0.18 -0.43 0.00 -0.03 0.00 0.00 56.01 55.75 1a4u n LEU 3 Cb 0.48 -0.18 -0.03 0.00 -2.33 0.00 0.00 43.42 41.36 1a4u n LEU 3 CO 0.45 0.00 1.37 0.41 -1.33 0.00 0.00 177.39 178.29 1a4u n THR 4 N -1.18 0.15 -1.53 -5.08 -1.04 -1.24 -1.95 114.28 102.42 1a4u n THR 4 Ca 0.18 -0.03 -0.16 0.00 -2.04 0.00 0.00 64.05 62.00 1a4u n THR 4 Cb 0.19 -1.91 -0.06 0.00 -1.82 0.00 0.00 70.33 66.73 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 4.51 -4.91 -4.88 8.00 5.03 -0.12 -4.91 115.26 117.98 1a4u n ASN 5 Ca 0.17 0.36 -0.31 0.00 0.87 0.00 0.00 54.58 55.68 1a4u n ASN 5 Cb 0.34 -3.83 -0.05 0.00 -1.02 0.00 0.00 39.78 35.22 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 -0.25 3.52 -0.14 -0.82 -4.29 119.74 118.06 1a4u s LYS 6 Ca 0.00 0.24 -0.09 0.00 -1.36 0.00 0.00 55.97 54.76 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 0.11 -0.80 -0.76 0.00 0.00 175.35 174.15 1a4u s ASN 7 N -2.64 5.48 -0.01 2.83 0.01 -1.26 -1.07 114.94 118.27 1a4u s ASN 7 Ca 0.47 -0.11 0.06 0.00 -0.71 0.00 0.00 52.86 52.57 1a4u s ASN 7 Cb -0.11 -1.99 -0.02 0.00 0.41 0.00 0.00 41.25 39.54 1a4u s ASN 7 CO 0.24 -0.02 -0.20 -0.69 -1.51 0.00 0.00 177.10 174.93 1a4u s VAL 8 N 1.55 1.56 -0.14 1.60 1.01 -0.22 -0.88 120.40 124.87 1a4u s VAL 8 Ca 0.06 -0.86 -0.00 0.00 0.00 0.00 0.00 61.98 61.18 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 0.43 -0.13 -0.63 0.00 0.00 0.00 175.10 174.83 1a4u s ILE 9 N -0.48 3.00 -0.22 2.22 1.01 -0.40 -0.12 121.20 126.21 1a4u s ILE 9 Ca 0.08 -0.67 0.01 0.00 0.00 0.00 0.00 60.65 60.06 1a4u s ILE 9 Cb -0.08 -2.27 0.06 0.00 0.01 0.00 0.00 42.46 40.18 1a4u s ILE 9 CO -0.01 0.51 -0.06 0.12 0.00 0.00 0.00 174.94 175.51 1a4u s PHE 10 N 0.53 2.33 -0.24 3.97 2.19 0.83 -0.63 117.98 126.96 1a4u s PHE 10 Ca -0.08 -1.66 -0.25 0.00 0.33 0.00 0.00 56.93 55.26 1a4u s PHE 10 Cb -0.16 -1.56 -0.00 0.00 -1.31 0.00 0.00 43.02 39.99 1a4u s PHE 10 CO 0.04 -0.75 0.84 0.08 1.83 0.00 0.00 175.22 177.26 1a4u s VAL 11 N 1.42 4.83 -0.43 3.12 1.01 0.31 -1.69 120.40 128.97 1a4u s VAL 11 Ca -0.04 1.60 -0.02 0.00 0.00 0.00 0.00 61.98 63.52 1a4u s VAL 11 Cb -0.18 -4.13 0.00 0.00 0.00 0.00 0.00 36.38 32.07 1a4u s VAL 11 CO -0.07 -0.08 0.37 0.00 0.00 0.00 0.00 175.10 175.32 1a4u n ALA 12 N 6.02 -0.52 0.16 5.51 0.00 0.52 -1.13 120.51 131.07 1a4u n ALA 12 Ca 0.06 0.07 0.02 0.00 0.00 0.00 0.00 53.44 53.60 1a4u n ALA 12 Cb 0.47 -1.75 0.25 0.00 0.00 0.00 0.00 19.45 18.42 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 0.97 -0.28 0.00 0.00 -1.78 -3.24 119.26 115.25 1a4u h ALA 13 Ca -0.19 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.27 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 0.62 0.00 1.28 0.00 0.00 0.00 179.25 181.33 1a4u n LEU 14 N -3.65 1.77 -4.34 0.00 4.77 -1.26 -1.77 117.00 112.52 1a4u n LEU 14 Ca -0.01 -0.89 -0.25 0.00 -0.03 0.00 0.00 56.01 54.84 1a4u n LEU 14 Cb 0.57 -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 -0.88 1.41 0.00 -0.72 0.00 -1.22 -4.68 107.32 101.23 1a4u s GLY 15 Ca 0.20 -1.40 0.00 0.00 0.00 0.00 0.00 44.72 43.51 1a4u s GLY 15 CO 0.12 -1.42 0.00 0.61 0.00 0.00 0.00 173.10 172.41 1a4u n GLY 16 N 0.74 2.66 0.12 0.20 0.00 -1.26 0.78 105.19 108.43 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 0.93 -0.07 -0.61 -0.00 -1.26 -2.59 119.36 115.77 1a4u n ILE 17 Ca 0.00 0.36 -0.01 0.00 -0.00 0.00 0.00 62.75 63.10 1a4u n ILE 17 Cb 0.00 -1.30 0.25 0.00 -0.00 0.00 0.00 39.64 38.59 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 1.65 0.74 0.82 3.28 0.00 0.14 -0.90 103.07 108.79 1a4u h GLY 18 Ca 0.00 -0.41 -0.05 0.00 0.00 0.00 0.00 47.33 46.86 1a4u h GLY 18 CO 0.00 0.39 -0.08 -2.00 0.00 0.00 0.00 176.54 174.85 1a4u h LEU 19 N 0.66 0.44 -1.18 3.11 5.85 -1.08 0.15 115.31 123.27 1a4u h LEU 19 Ca 0.15 -0.39 -0.08 0.00 0.84 0.00 0.00 57.88 58.40 1a4u h LEU 19 Cb 0.28 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.17 1a4u h LEU 19 CO -0.00 0.73 -0.37 0.44 -0.34 0.00 0.00 178.44 178.90 1a4u h ASP 20 N 0.15 0.00 0.02 1.25 3.32 -1.68 -0.78 116.42 118.70 1a4u h ASP 20 Ca 0.05 0.00 -0.23 0.00 0.02 0.00 0.00 57.03 56.87 1a4u h ASP 20 Cb 0.55 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.11 1a4u h ASP 20 CO 0.03 0.37 -0.88 0.74 -1.72 0.00 0.00 179.24 177.78 1a4u h THR 21 N 0.00 1.31 -0.63 0.35 2.02 -0.98 -3.00 112.91 111.98 1a4u h THR 21 Ca -0.00 -2.15 -0.07 0.00 0.77 0.00 0.00 66.41 64.96 1a4u h THR 21 Cb 0.75 2.18 -0.02 0.00 -1.74 0.00 0.00 68.15 69.31 1a4u h THR 21 CO 0.05 0.66 0.12 0.28 0.37 0.00 0.00 175.52 177.00 1a4u h SER 22 N 0.42 0.98 -0.81 4.18 0.02 -0.26 -0.69 113.55 117.40 1a4u h SER 22 Ca -0.08 -0.25 0.05 0.00 -0.84 0.00 0.00 61.79 60.67 1a4u h SER 22 Cb 1.51 -0.26 -0.05 0.00 0.14 0.00 0.00 62.40 63.73 1a4u h SER 22 CO 0.17 0.98 0.50 0.03 -1.14 0.00 0.00 176.83 177.37 1a4u h ARG 23 N 0.94 0.92 -0.14 3.45 3.08 -1.15 -1.05 114.38 120.43 1a4u h ARG 23 Ca 0.19 -0.06 -0.18 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 30.25 1a4u h ARG 23 CO 0.01 0.61 -0.67 0.93 -1.07 0.00 0.00 179.97 179.78 1a4u h GLU 24 N 0.95 0.55 -0.13 0.04 4.39 -1.35 -3.24 114.58 115.79 1a4u h GLU 24 Ca 0.34 -0.41 -0.01 0.00 0.34 0.00 0.00 59.36 59.62 1a4u h GLU 24 Cb 0.10 0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.81 1a4u h GLU 24 CO -0.15 1.03 0.04 -0.07 -1.16 0.00 0.00 179.01 178.70 1a4u h LEU 25 N 0.40 0.19 -2.75 1.33 3.38 -0.55 -2.84 115.31 114.47 1a4u h LEU 25 Ca -0.02 -0.20 -0.00 0.00 0.09 0.00 0.00 57.88 57.75 1a4u h LEU 25 Cb 1.24 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.94 1a4u h LEU 25 CO 0.12 0.34 -0.00 -0.37 0.09 0.00 0.00 178.44 178.63 1a4u h VAL 26 N 0.03 0.24 0.00 1.22 -1.51 -1.28 0.16 116.25 115.11 1a4u h VAL 26 Ca 0.04 -0.01 0.00 0.00 -1.23 0.00 0.00 66.70 65.51 1a4u h VAL 26 Cb 0.22 1.00 0.00 0.00 -2.13 0.00 0.00 31.29 30.39 1a4u h VAL 26 CO -0.00 0.00 0.00 0.11 -1.23 0.00 0.00 177.57 176.45 1a4u h LYS 27 N 0.00 0.00 -0.12 5.19 1.57 -1.53 -3.16 116.57 118.52 1a4u h LYS 27 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1a4u h LYS 27 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1a4u h LYS 27 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 179.45 179.42 1a4u n ARG 28 N -2.31 1.29 -3.36 3.15 3.00 0.04 -4.93 116.66 113.55 1a4u n ARG 28 Ca 0.03 -0.46 -0.16 0.00 -0.01 0.00 0.00 57.85 57.26 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 -0.16 -3.50 -4.79 0.55 3.02 -1.19 -3.59 115.26 105.60 1a4u n ASN 29 Ca 0.06 -0.64 -0.32 0.00 -0.03 0.00 0.00 54.58 53.65 1a4u n ASN 29 Cb 0.12 -5.11 0.05 0.00 -0.61 0.00 0.00 39.78 34.22 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 3.25 -0.13 3.41 1.43 -1.26 -0.95 118.68 118.42 1a4u s LEU 30 Ca 0.15 1.81 -0.19 0.00 -1.03 0.00 0.00 54.13 54.86 1a4u s LEU 30 Cb -0.02 -4.52 -0.17 0.00 0.03 0.00 0.00 46.19 41.51 1a4u s LEU 30 CO 0.73 -1.58 0.48 0.50 0.23 0.00 0.00 176.35 176.71 1a4u h LYS 31 N -0.39 0.00 -4.54 1.70 3.64 -1.29 -3.39 116.57 112.30 1a4u h LYS 31 Ca -0.45 0.00 -0.43 0.00 -1.27 0.00 0.00 60.65 58.49 1a4u h LYS 31 Cb 1.23 0.00 -0.31 0.00 -0.41 0.00 0.00 32.23 32.73 1a4u h LYS 31 CO 0.55 0.66 -0.79 -0.80 -2.27 0.00 0.00 179.45 176.80 1a4u s ASN 32 N -6.02 1.24 -0.27 4.20 0.01 -1.18 -1.96 114.94 110.96 1a4u s ASN 32 Ca -0.13 -0.19 0.02 0.00 -0.71 0.00 0.00 52.86 51.84 1a4u s ASN 32 Cb -0.02 -0.38 0.07 0.00 0.41 0.00 0.00 41.25 41.34 1a4u s ASN 32 CO 0.46 0.05 -0.02 0.12 -1.51 0.00 0.00 177.10 176.19 1a4u s PHE 33 N 0.29 2.74 -0.30 2.20 5.36 -0.30 -1.05 117.98 126.92 1a4u s PHE 33 Ca -0.05 -2.11 -0.11 0.00 -0.96 0.00 0.00 56.93 53.71 1a4u s PHE 33 Cb -0.10 -1.93 -0.03 0.00 -0.34 0.00 0.00 43.02 40.62 1a4u s PHE 33 CO 0.01 -0.84 0.19 0.08 -1.46 0.00 0.00 175.22 173.19 1a4u s VAL 34 N 1.27 5.10 -0.23 3.12 1.01 0.83 -1.64 120.40 129.86 1a4u s VAL 34 Ca -0.01 -0.06 -0.09 0.00 0.00 0.00 0.00 61.98 61.82 1a4u s VAL 34 Cb -0.19 -3.50 -0.04 0.00 0.00 0.00 0.00 36.38 32.64 1a4u s VAL 34 CO -0.09 0.16 0.12 -0.63 0.00 0.00 0.00 175.10 174.66 1a4u s ILE 35 N 1.71 4.99 -0.26 2.22 1.01 0.37 -0.12 121.20 131.12 1a4u s ILE 35 Ca 0.06 0.05 -0.00 0.00 0.00 0.00 0.00 60.65 60.76 1a4u s ILE 35 Cb -0.16 -3.31 0.04 0.00 0.01 0.00 0.00 42.46 39.03 1a4u s ILE 35 CO 0.09 0.36 -0.07 -0.76 0.00 0.00 0.00 174.94 174.57 1a4u s LEU 36 N 1.07 3.37 0.11 2.97 1.43 -0.68 -0.86 118.68 126.09 1a4u s LEU 36 Ca 0.06 -1.10 -0.06 0.00 -1.03 0.00 0.00 54.13 52.01 1a4u s LEU 36 Cb -0.14 -1.63 -0.02 0.00 0.03 0.00 0.00 46.19 44.43 1a4u s LEU 36 CO 0.04 -0.17 0.15 -0.62 0.23 0.00 0.00 176.35 175.98 1a4u s ASP 37 N 1.25 0.21 0.07 2.29 -1.08 -1.09 -0.35 116.67 117.96 1a4u s ASP 37 Ca -0.03 -0.91 -0.26 0.00 -0.52 0.00 0.00 52.55 50.83 1a4u s ASP 37 Cb -0.18 0.33 -0.16 0.00 -1.46 0.00 0.00 42.92 41.45 1a4u s ASP 37 CO -0.04 -0.76 1.65 -0.09 0.52 0.00 0.00 175.17 176.45 1a4u h ARG 38 N 2.79 -0.22 -5.28 4.34 2.43 -1.76 0.23 114.38 116.91 1a4u h ARG 38 Ca -0.34 0.02 -0.48 0.00 -0.81 0.00 0.00 59.98 58.37 1a4u h ARG 38 Cb 1.20 0.05 -0.28 0.00 -0.42 0.00 0.00 29.97 30.51 1a4u h ARG 38 CO 0.56 -0.10 -0.81 0.08 -1.51 0.00 0.00 179.97 178.19 1a4u s VAL 39 N -5.94 1.10 0.38 0.20 1.01 -1.26 -4.45 120.40 111.44 1a4u s VAL 39 Ca -0.14 -0.65 -0.26 0.00 0.00 0.00 0.00 61.98 60.92 1a4u s VAL 39 Cb 0.05 -0.93 -0.09 0.00 0.00 0.00 0.00 36.38 35.41 1a4u s VAL 39 CO 0.65 0.27 1.19 -0.70 0.00 0.00 0.00 175.10 176.50 1a4u s GLU 40 N -0.44 4.16 -0.46 2.72 2.12 -1.26 -5.00 118.70 120.53 1a4u s GLU 40 Ca 0.05 1.91 0.03 0.00 0.36 0.00 0.00 54.97 57.32 1a4u s GLU 40 Cb -0.06 -2.79 0.12 0.00 0.26 0.00 0.00 34.13 31.66 1a4u s GLU 40 CO -0.00 -0.25 0.20 1.21 -0.54 0.00 0.00 175.26 175.88 1a4u s ASN 41 N -0.99 4.57 0.25 -1.70 3.84 -1.26 -4.99 114.94 114.66 1a4u s ASN 41 Ca 0.54 -2.68 -0.03 0.00 0.21 0.00 0.00 52.86 50.90 1a4u s ASN 41 Cb -0.33 -1.66 0.46 0.00 -0.55 0.00 0.00 41.25 39.18 1a4u s ASN 41 CO 0.41 -0.30 1.76 1.55 -2.79 0.00 0.00 177.10 177.73 1a4u h PRO 42 N 6.96 0.57 0.06 0.43 0.13 -1.98 0.35 132.00 138.52 1a4u h PRO 42 Ca -0.06 -0.03 -0.00 0.00 -0.87 0.00 0.00 66.00 65.03 1a4u h PRO 42 Cb 0.94 -0.13 0.00 0.00 0.13 0.00 0.00 31.00 31.95 1a4u h PRO 42 CO 0.64 0.38 -0.03 1.15 -0.23 0.00 0.00 178.00 179.90 1a4u h THR 43 N 0.59 1.01 -0.64 1.56 2.02 -1.99 0.11 112.91 115.57 1a4u h THR 43 Ca 0.42 -0.24 -0.02 0.00 0.77 0.00 0.00 66.41 67.34 1a4u h THR 43 Cb 0.56 1.17 -0.03 0.00 -1.74 0.00 0.00 68.15 68.12 1a4u h THR 43 CO -0.34 0.06 0.32 0.00 0.37 0.00 0.00 175.52 175.93 1a4u h ALA 44 N 0.75 0.82 -0.46 6.16 0.00 -1.86 -0.46 119.26 124.22 1a4u h ALA 44 Ca -0.01 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1a4u h ALA 44 Cb 0.16 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1a4u h ALA 44 CO 0.01 0.37 0.23 1.25 0.00 0.00 0.00 179.25 181.12 1a4u h LEU 45 N 0.88 0.59 -0.78 0.00 5.85 -0.77 -1.71 115.31 119.36 1a4u h LEU 45 Ca 0.22 -0.11 -0.03 0.00 0.84 0.00 0.00 57.88 58.79 1a4u h LEU 45 Cb 0.09 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 40.94 1a4u h LEU 45 CO -0.03 0.53 0.35 0.00 -0.34 0.00 0.00 178.44 178.96 1a4u h ALA 46 N 1.08 1.01 -0.45 1.25 0.00 -0.48 -2.39 119.26 119.27 1a4u h ALA 46 Ca 0.16 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 1a4u h ALA 46 Cb 0.09 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1a4u h ALA 46 CO -0.02 0.59 0.13 1.49 0.00 0.00 0.00 179.25 181.44 1a4u h GLU 47 N 1.11 0.71 -0.27 0.00 4.81 -0.79 -1.94 114.58 118.21 1a4u h GLU 47 Ca 0.27 -0.16 -0.00 0.00 -0.13 0.00 0.00 59.36 59.33 1a4u h GLU 47 Cb 0.15 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.42 1a4u h GLU 47 CO -0.03 0.69 0.15 -0.07 -0.73 0.00 0.00 179.01 179.02 1a4u h LEU 48 N 0.59 0.33 -1.16 1.64 3.38 -1.15 -1.61 115.31 117.35 1a4u h LEU 48 Ca 0.14 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 1a4u h LEU 48 Cb 0.28 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 1a4u h LEU 48 CO -0.00 0.31 0.29 0.11 0.09 0.00 0.00 178.44 179.24 1a4u h LYS 49 N 0.33 0.88 0.00 1.13 1.57 -1.37 -1.75 116.57 117.36 1a4u h LYS 49 Ca 0.10 -0.12 -0.07 0.00 -1.87 0.00 0.00 60.65 58.69 1a4u h LYS 49 Cb 0.05 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.18 1a4u h LYS 49 CO -0.02 0.69 -0.31 0.00 -0.57 0.00 0.00 179.45 179.24 1a4u h ALA 50 N 1.44 1.37 -0.31 3.86 0.00 -0.92 -2.50 119.26 122.20 1a4u h ALA 50 Ca 0.22 -0.28 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 1a4u h ALA 50 Cb 0.10 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1a4u h ALA 50 CO -0.03 0.39 -0.04 0.82 0.00 0.00 0.00 179.25 180.39 1a4u h ILE 51 N 0.00 1.27 -2.00 0.00 2.04 -0.37 -3.40 117.51 115.05 1a4u h ILE 51 Ca -0.00 -1.04 -0.43 0.00 1.00 0.00 0.00 64.86 64.39 1a4u h ILE 51 Cb 0.59 1.34 -0.32 0.00 -0.74 0.00 0.00 36.82 37.69 1a4u h ILE 51 CO 0.04 0.34 -0.76 0.21 0.00 0.00 0.00 178.15 177.98 1a4u s ASN 52 N -6.13 1.06 0.42 1.72 3.84 -1.16 -4.97 114.94 109.73 1a4u s ASN 52 Ca -0.13 -2.10 0.25 0.00 0.21 0.00 0.00 52.86 51.09 1a4u s ASN 52 Cb 0.08 0.36 1.38 0.00 -0.55 0.00 0.00 41.25 42.52 1a4u s ASN 52 CO 0.77 -0.21 1.76 1.55 -2.79 0.00 0.00 177.10 178.18 1a4u h PRO 53 N 6.35 0.00 -0.02 0.43 0.13 -1.68 -1.66 132.00 135.55 1a4u h PRO 53 Ca 0.12 0.00 -0.07 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 0.23 0.00 -0.34 -0.22 -0.23 0.00 0.00 178.00 177.44 1a4u h LYS 54 N 0.00 0.03 -6.40 0.86 3.64 -1.94 -3.43 116.57 109.33 1a4u h LYS 54 Ca 0.00 -0.01 -0.53 0.00 -1.27 0.00 0.00 60.65 58.83 1a4u h LYS 54 Cb 0.17 -0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.96 1a4u h LYS 54 CO 0.00 0.37 0.29 0.08 -2.27 0.00 0.00 179.45 177.92 1a4u s VAL 55 N -4.27 4.73 -0.50 2.00 1.01 -0.63 -4.95 120.40 117.79 1a4u s VAL 55 Ca -0.03 1.91 -0.27 0.00 0.00 0.00 0.00 61.98 63.59 1a4u s VAL 55 Cb 0.15 -4.25 0.03 0.00 0.00 0.00 0.00 36.38 32.31 1a4u s VAL 55 CO 0.73 0.27 1.02 0.21 0.00 0.00 0.00 175.10 177.33 1a4u s ASN 56 N 0.42 6.50 -0.23 3.32 2.47 -0.83 -4.95 114.94 121.64 1a4u s ASN 56 Ca 0.46 0.13 -0.08 0.00 0.42 0.00 0.00 52.86 53.79 1a4u s ASN 56 Cb -0.21 -2.49 -0.04 0.00 -1.45 0.00 0.00 41.25 37.06 1a4u s ASN 56 CO 0.27 -1.20 0.10 -0.63 -3.72 0.00 0.00 177.10 171.92 1a4u s ILE 57 N 4.16 4.81 0.05 -5.21 1.01 -1.26 -1.15 121.20 123.61 1a4u s ILE 57 Ca 0.40 -0.01 0.08 0.00 0.00 0.00 0.00 60.65 61.11 1a4u s ILE 57 Cb -0.09 -3.23 -0.03 0.00 0.01 0.00 0.00 42.46 39.12 1a4u s ILE 57 CO 0.27 0.36 -0.21 0.42 0.00 0.00 0.00 174.94 175.78 1a4u s THR 58 N 1.15 1.73 -0.04 2.92 -4.23 -0.65 -4.99 115.64 111.52 1a4u s THR 58 Ca 0.05 -1.27 0.06 0.00 -1.18 0.00 0.00 61.69 59.35 1a4u s THR 58 Cb -0.14 -1.51 -0.01 0.00 1.34 0.00 0.00 72.50 72.17 1a4u s THR 58 CO 0.04 0.18 -0.23 0.12 -0.54 0.00 0.00 174.62 174.19 1a4u s PHE 59 N -0.85 2.22 -0.04 3.99 2.19 -1.26 -0.48 117.98 123.75 1a4u s PHE 59 Ca 0.08 -0.57 0.02 0.00 0.33 0.00 0.00 56.93 56.78 1a4u s PHE 59 Cb -0.09 -1.45 0.01 0.00 -1.31 0.00 0.00 43.02 40.18 1a4u s PHE 59 CO 0.02 -0.14 -0.08 -1.01 1.83 0.00 0.00 175.22 175.84 1a4u s HIS 60 N -0.28 0.98 0.14 10.12 3.76 -0.04 -4.96 115.29 125.01 1a4u s HIS 60 Ca 0.01 -0.28 -0.31 0.00 -0.15 0.00 0.00 55.06 54.33 1a4u s HIS 60 Cb -0.12 -0.74 -0.09 0.00 1.11 0.00 0.00 32.58 32.74 1a4u s HIS 60 CO 0.02 -0.16 1.43 0.99 -0.85 0.00 0.00 174.74 176.17 1a4u s THR 61 N 0.50 3.07 -0.17 1.30 2.01 -1.26 -2.67 115.64 118.42 1a4u s THR 61 Ca -0.08 0.78 -0.08 0.00 0.31 0.00 0.00 61.69 62.62 1a4u s THR 61 Cb -0.12 -3.50 0.06 0.00 0.01 0.00 0.00 72.50 68.96 1a4u s THR 61 CO 0.01 0.07 0.40 -0.47 -0.69 0.00 0.00 174.62 173.94 1a4u s TYR 62 N 0.96 -0.62 -0.33 4.92 5.04 0.79 -4.84 117.35 123.28 1a4u s TYR 62 Ca 0.65 1.29 -0.05 0.00 -2.44 0.00 0.00 57.07 56.52 1a4u s TYR 62 Cb -0.39 0.25 0.04 0.00 0.35 0.00 0.00 41.96 42.21 1a4u s TYR 62 CO 0.32 -0.36 0.07 0.34 -1.34 0.00 0.00 175.55 174.58 1a4u s ASP 63 N 1.64 5.18 0.36 4.32 -1.08 -1.26 -2.14 116.67 123.69 1a4u s ASP 63 Ca -0.08 -1.20 0.21 0.00 -0.52 0.00 0.00 52.55 50.96 1a4u s ASP 63 Cb -0.09 -1.82 1.15 0.00 -1.46 0.00 0.00 42.92 40.70 1a4u s ASP 63 CO -0.12 -0.31 1.62 -0.37 0.52 0.00 0.00 175.17 176.51 1a4u h VAL 64 N 6.27 0.00 -0.00 1.11 -1.51 -1.96 -1.56 116.25 118.60 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 1.07 0.47 0.00 0.00 -2.13 0.00 0.00 31.29 30.71 1a4u h VAL 64 CO 0.58 0.00 -0.04 0.35 -1.23 0.00 0.00 177.57 177.23 1a4u n THR 65 N -2.28 0.00 -1.50 7.19 -2.24 -1.26 -4.37 114.28 109.82 1a4u n THR 65 Ca -0.01 -0.04 -0.31 0.00 -2.27 0.00 0.00 64.05 61.41 1a4u n THR 65 Cb 0.12 -0.27 0.06 0.00 -2.10 0.00 0.00 70.33 68.14 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 -2.33 3.69 0.80 2.28 -7.23 -0.59 -5.01 120.40 112.01 1a4u s VAL 66 Ca 0.35 0.58 -0.13 0.00 -1.81 0.00 0.00 61.98 60.97 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 -0.68 1.17 -2.84 -0.31 0.00 0.00 175.10 172.87 1a4u s PRO 67 N -4.85 1.76 0.40 4.82 0.02 -1.26 -4.81 135.00 131.08 1a4u s PRO 67 Ca 0.60 1.60 0.10 0.00 0.02 0.00 0.00 61.00 63.33 1a4u s PRO 67 Cb -0.16 -1.81 0.91 0.00 0.02 0.00 0.00 34.50 33.46 1a4u s PRO 67 CO 0.53 -2.09 1.96 0.28 -0.33 0.00 0.00 177.00 177.36 1a4u h VAL 68 N -0.96 0.93 -0.96 3.83 2.07 -1.95 -0.66 116.25 118.56 1a4u h VAL 68 Ca -0.45 -0.19 0.01 0.00 0.82 0.00 0.00 66.70 66.89 1a4u h VAL 68 Cb 1.28 0.32 -0.05 0.00 -1.52 0.00 0.00 31.29 31.32 1a4u h VAL 68 CO 0.47 0.10 0.63 0.00 0.02 0.00 0.00 177.57 178.80 1a4u h ALA 69 N 1.66 1.33 -0.49 1.67 0.00 -1.97 0.64 119.26 122.09 1a4u h ALA 69 Ca 0.31 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 55.09 1a4u h ALA 69 Cb 0.46 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1a4u h ALA 69 CO -0.10 0.62 0.05 1.49 0.00 0.00 0.00 179.25 181.31 1a4u h GLU 70 N 1.28 0.83 -0.42 0.00 4.57 -1.48 -2.05 114.58 117.32 1a4u h GLU 70 Ca 0.36 -0.24 -0.10 0.00 -1.18 0.00 0.00 59.36 58.20 1a4u h GLU 70 Cb -0.13 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 28.36 1a4u h GLU 70 CO -0.08 0.84 -0.15 0.77 -1.18 0.00 0.00 179.01 179.21 1a4u h SER 71 N 0.70 0.78 -0.29 1.04 0.02 -0.97 -2.56 113.55 112.26 1a4u h SER 71 Ca 0.15 -0.25 -0.05 0.00 -0.84 0.00 0.00 61.79 60.79 1a4u h SER 71 Cb 0.43 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.74 1a4u h SER 71 CO 0.01 0.93 0.01 0.11 -1.14 0.00 0.00 176.83 176.76 1a4u h LYS 72 N 0.70 0.62 -0.00 3.45 1.57 -0.69 -0.12 116.57 122.09 1a4u h LYS 72 Ca 0.11 -0.14 -0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1a4u h LYS 72 Cb 0.64 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.86 1a4u h LYS 72 CO 0.04 0.63 0.00 -0.22 -0.57 0.00 0.00 179.45 179.33 1a4u h LYS 73 N 0.59 0.00 -0.26 3.15 3.64 -1.03 -0.35 116.57 122.32 1a4u h LYS 73 Ca 0.12 -0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.47 1a4u h LYS 73 Cb 0.35 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.16 1a4u h LYS 73 CO 0.01 0.16 0.03 1.25 -2.27 0.00 0.00 179.45 178.63 1a4u h LEU 74 N -0.16 0.42 -1.32 5.20 5.85 -1.23 -2.89 115.31 121.17 1a4u h LEU 74 Ca 0.00 -0.28 0.00 0.00 0.84 0.00 0.00 57.88 58.45 1a4u h LEU 74 Cb 0.16 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.05 1a4u h LEU 74 CO -0.00 0.59 0.42 -0.07 -0.34 0.00 0.00 178.44 179.04 1a4u h LEU 75 N 0.23 0.76 -0.66 2.25 3.38 -0.98 -2.09 115.31 118.20 1a4u h LEU 75 Ca 0.08 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1a4u h LEU 75 Cb 0.36 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 1a4u h LEU 75 CO 0.01 0.57 0.42 0.50 0.09 0.00 0.00 178.44 180.03 1a4u h LYS 76 N 0.89 0.88 -0.63 1.13 3.64 -0.90 0.25 116.57 121.84 1a4u h LYS 76 Ca 0.24 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.56 1a4u h LYS 76 Cb -0.07 -0.19 -0.03 0.00 -0.41 0.00 0.00 32.23 31.52 1a4u h LYS 76 CO -0.05 0.60 0.41 -0.22 -2.27 0.00 0.00 179.45 177.92 1a4u h LYS 77 N 0.90 0.83 -0.23 1.90 3.64 -1.20 0.14 116.57 122.55 1a4u h LYS 77 Ca 0.24 -0.05 -0.04 0.00 -1.27 0.00 0.00 60.65 59.52 1a4u h LYS 77 Cb -0.07 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.55 1a4u h LYS 77 CO -0.05 0.56 -0.02 0.82 -2.27 0.00 0.00 179.45 178.49 1a4u h ILE 78 N 0.85 1.27 -0.19 2.00 2.04 -0.91 -2.60 117.51 119.97 1a4u h ILE 78 Ca 0.23 -0.95 -0.08 0.00 1.00 0.00 0.00 64.86 65.06 1a4u h ILE 78 Cb -0.09 1.43 -0.01 0.00 -0.74 0.00 0.00 36.82 37.41 1a4u h ILE 78 CO -0.05 0.29 -0.24 -0.26 0.00 0.00 0.00 178.15 177.90 1a4u h PHE 79 N 0.18 0.38 -0.65 1.37 0.04 -0.80 0.68 116.94 118.13 1a4u h PHE 79 Ca 0.06 -0.07 -0.06 0.00 2.80 0.00 0.00 57.97 60.70 1a4u h PHE 79 Cb 0.44 -0.10 -0.03 0.00 2.20 0.00 0.00 35.95 38.47 1a4u h PHE 79 CO 0.04 0.56 0.15 0.22 -0.60 0.00 0.00 178.31 178.69 1a4u h ASP 80 N 0.31 0.98 0.03 2.17 3.58 -0.88 0.69 116.42 123.31 1a4u h ASP 80 Ca 0.05 -0.23 -0.11 0.00 0.42 0.00 0.00 57.03 57.15 1a4u h ASP 80 Cb 0.59 -0.26 0.01 0.00 1.72 0.00 0.00 39.33 41.40 1a4u h ASP 80 CO 0.04 0.96 -0.47 1.56 -2.88 0.00 0.00 179.24 178.46 1a4u h GLN 81 N 0.96 0.26 0.00 0.28 4.20 -1.18 -3.36 115.11 116.27 1a4u h GLN 81 Ca 0.20 -0.32 -0.15 0.00 0.06 0.00 0.00 58.65 58.45 1a4u h GLN 81 Cb 0.36 0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.22 1a4u h GLN 81 CO 0.00 1.06 -0.88 -0.07 -0.67 0.00 0.00 178.83 178.27 1a4u h LEU 82 N -0.40 0.00 0.00 1.46 3.38 -0.89 -3.48 115.31 115.37 1a4u h LEU 82 Ca -0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1a4u h LEU 82 Cb 1.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.00 1a4u h LEU 82 CO 0.09 0.61 0.00 1.17 0.09 0.00 0.00 178.44 180.40 1a4u n LYS 83 N -3.14 0.00 -4.11 1.13 0.00 0.24 -4.86 118.16 107.42 1a4u n LYS 83 Ca -0.02 0.00 -0.13 0.00 0.00 0.00 0.00 58.31 58.16 1a4u n LYS 83 Cb 0.81 0.00 -0.11 0.00 0.00 0.00 0.00 35.03 35.73 1a4u n LYS 83 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 1a4u s THR 84 N -0.00 0.66 -0.05 3.15 -4.23 -1.26 -4.90 115.64 109.01 1a4u s THR 84 Ca 0.00 -1.43 -0.01 0.00 -1.18 0.00 0.00 61.69 59.08 1a4u s THR 84 Cb 0.00 -1.06 0.03 0.00 1.34 0.00 0.00 72.50 72.81 1a4u s THR 84 CO 0.00 -0.55 0.01 -0.69 -0.54 0.00 0.00 174.62 172.85 1a4u s VAL 85 N -2.21 0.24 -0.06 2.29 1.01 -1.26 -4.82 120.40 115.60 1a4u s VAL 85 Ca -0.01 0.16 -0.09 0.00 0.00 0.00 0.00 61.98 62.04 1a4u s VAL 85 Cb -0.04 -0.39 -0.30 0.00 0.00 0.00 0.00 36.38 35.65 1a4u s VAL 85 CO -0.01 0.21 0.63 0.44 0.00 0.00 0.00 175.10 176.37 1a4u h ASP 86 N 8.01 0.57 -4.19 3.32 3.32 -1.40 -3.47 116.42 122.58 1a4u h ASP 86 Ca -0.25 -0.90 -0.21 0.00 0.02 0.00 0.00 57.03 55.69 1a4u h ASP 86 Cb 1.13 -0.18 -0.25 0.00 0.22 0.00 0.00 39.33 40.24 1a4u h ASP 86 CO 0.30 1.77 -0.71 -0.63 -1.72 0.00 0.00 179.24 178.25 1a4u s ILE 87 N -2.58 0.05 -0.10 0.35 1.01 -1.10 -2.76 121.20 116.06 1a4u s ILE 87 Ca -0.16 -0.34 0.03 0.00 0.00 0.00 0.00 60.65 60.18 1a4u s ILE 87 Cb 0.06 -0.11 0.00 0.00 0.01 0.00 0.00 42.46 42.42 1a4u s ILE 87 CO 0.84 -0.18 -0.22 -0.22 0.00 0.00 0.00 174.94 175.16 1a4u s LEU 88 N -0.54 2.03 -0.24 2.97 2.96 -0.49 -1.27 118.68 124.10 1a4u s LEU 88 Ca -0.06 -0.53 -0.01 0.00 -0.22 0.00 0.00 54.13 53.30 1a4u s LEU 88 Cb -0.04 -1.34 0.02 0.00 0.50 0.00 0.00 46.19 45.34 1a4u s LEU 88 CO -0.00 0.12 -0.08 -0.63 -1.32 0.00 0.00 176.35 174.44 1a4u s ILE 89 N 0.50 2.79 -0.53 6.68 1.01 0.20 -0.77 121.20 131.09 1a4u s ILE 89 Ca -0.16 -0.99 -0.18 0.00 0.00 0.00 0.00 60.65 59.33 1a4u s ILE 89 Cb -0.17 -2.39 0.09 0.00 0.01 0.00 0.00 42.46 40.00 1a4u s ILE 89 CO 0.06 0.25 0.59 0.20 0.00 0.00 0.00 174.94 176.04 1a4u s ASN 90 N 1.33 6.19 -0.10 3.58 0.01 -0.45 -0.53 114.94 124.97 1a4u s ASN 90 Ca 0.01 -1.30 0.15 0.00 -0.71 0.00 0.00 52.86 51.00 1a4u s ASN 90 Cb -0.16 -2.26 0.22 0.00 0.41 0.00 0.00 41.25 39.46 1a4u s ASN 90 CO -0.05 -0.91 1.11 0.61 -1.51 0.00 0.00 177.10 176.34 1a4u n GLY 91 N 5.23 4.18 3.77 0.66 0.00 -0.29 -1.49 105.19 117.25 1a4u n GLY 91 Ca -0.10 -0.88 -0.38 0.00 0.00 0.00 0.00 46.02 44.66 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 -2.36 3.17 -0.16 4.61 0.00 -1.21 -4.74 121.76 121.08 1a4u s ALA 92 Ca 0.25 0.96 -0.32 0.00 0.00 0.00 0.00 51.96 52.85 1a4u s ALA 92 Cb 0.22 -3.38 0.14 0.00 0.00 0.00 0.00 23.12 20.09 1a4u s ALA 92 CO 0.02 -0.50 1.12 0.20 0.00 0.00 0.00 175.76 176.60 1a4u s GLY 93 N -1.12 -0.28 -0.06 0.00 0.00 -1.26 -4.65 107.32 99.94 1a4u s GLY 93 Ca 0.56 1.68 -0.12 0.00 0.00 0.00 0.00 44.72 46.84 1a4u s GLY 93 CO 0.39 0.63 0.29 -1.50 0.00 0.00 0.00 173.10 172.91 1a4u s ILE 94 N -2.20 0.03 -0.29 0.90 2.07 -1.26 -5.00 121.20 115.45 1a4u s ILE 94 Ca 0.07 -0.27 0.00 0.00 -1.41 0.00 0.00 60.65 59.04 1a4u s ILE 94 Cb -0.01 -0.51 0.09 0.00 0.13 0.00 0.00 42.46 42.16 1a4u s ILE 94 CO -0.05 -0.15 0.04 -0.22 -1.91 0.00 0.00 174.94 172.66 1a4u s LEU 95 N -0.62 2.79 -0.32 8.50 0.20 -1.26 -4.92 118.68 123.06 1a4u s LEU 95 Ca -0.07 -1.57 -0.06 0.00 0.69 0.00 0.00 54.13 53.12 1a4u s LEU 95 Cb -0.04 -1.09 0.19 0.00 -0.43 0.00 0.00 46.19 44.82 1a4u s LEU 95 CO 0.02 -0.35 0.95 -0.62 -0.29 0.00 0.00 176.35 176.06 1a4u s ASP 96 N 1.42 -0.65 0.00 3.68 -1.08 -1.26 -4.62 116.67 114.17 1a4u s ASP 96 Ca 0.05 -0.11 0.05 0.00 -0.52 0.00 0.00 52.55 52.02 1a4u s ASP 96 Cb -0.18 1.13 0.29 0.00 -1.46 0.00 0.00 42.92 42.70 1a4u s ASP 96 CO -0.15 -0.10 0.93 0.47 0.52 0.00 0.00 175.17 176.85 1a4u n ASP 97 N 4.57 0.00 0.03 -0.34 9.92 -0.71 -1.36 116.55 128.66 1a4u n ASP 97 Ca 0.08 -1.29 0.12 0.00 -0.53 0.00 0.00 54.79 53.17 1a4u n ASP 97 Cb 0.59 0.00 0.15 0.00 -0.64 0.00 0.00 41.12 41.22 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 -0.61 0.30 -3.65 1.24 8.25 -1.26 -4.31 115.22 115.18 1a4u n HIS 98 Ca 0.04 0.09 -0.32 0.00 -0.26 0.00 0.00 57.72 57.27 1a4u n HIS 98 Cb 0.02 -0.46 -0.08 0.00 1.12 0.00 0.00 29.99 30.58 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 -1.88 2.45 0.44 -0.41 6.02 -0.46 -4.96 117.38 118.58 1a4u n GLN 99 Ca 0.04 -4.53 -0.19 0.00 -0.01 0.00 0.00 57.00 52.30 1a4u n GLN 99 Cb 0.41 -2.35 -0.09 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 3.96 0.19 -0.40 5.09 2.04 -1.77 -1.44 117.51 125.17 1a4u h ILE 100 Ca 0.17 0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.03 1a4u h ILE 100 Cb 0.75 0.19 -0.02 0.00 -0.74 0.00 0.00 36.82 37.00 1a4u h ILE 100 CO 0.83 0.00 0.26 -0.33 0.00 0.00 0.00 178.15 178.92 1a4u h GLU 101 N -1.10 0.52 -0.82 2.37 3.07 -1.96 -2.58 114.58 114.09 1a4u h GLU 101 Ca -0.11 -0.03 -0.04 0.00 -0.50 0.00 0.00 59.36 58.68 1a4u h GLU 101 Cb 0.84 -0.12 -0.04 0.00 -0.84 0.00 0.00 28.75 28.60 1a4u h GLU 101 CO 0.18 0.34 0.38 -0.09 -1.40 0.00 0.00 179.01 178.42 1a4u h ARG 102 N 0.54 1.19 -0.34 2.33 2.43 -1.96 0.03 114.38 118.60 1a4u h ARG 102 Ca 0.15 -0.19 0.02 0.00 -0.81 0.00 0.00 59.98 59.15 1a4u h ARG 102 Cb -0.05 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 29.26 1a4u h ARG 102 CO -0.04 0.93 0.19 1.15 -1.51 0.00 0.00 179.97 180.69 1a4u h THR 103 N 1.18 1.02 -0.37 0.20 2.02 -1.01 -0.29 112.91 115.66 1a4u h THR 103 Ca 0.28 -0.13 -0.16 0.00 0.77 0.00 0.00 66.41 67.17 1a4u h THR 103 Cb 0.15 0.60 -0.01 0.00 -1.74 0.00 0.00 68.15 67.15 1a4u h THR 103 CO -0.03 0.07 -0.39 0.40 0.37 0.00 0.00 175.52 175.94 1a4u h ILE 104 N 0.39 1.27 -0.58 3.11 2.04 -1.20 -1.13 117.51 121.41 1a4u h ILE 104 Ca 0.14 -1.56 -0.06 0.00 1.00 0.00 0.00 64.86 64.37 1a4u h ILE 104 Cb 0.02 1.40 -0.03 0.00 -0.74 0.00 0.00 36.82 37.47 1a4u h ILE 104 CO -0.07 0.52 0.11 0.00 0.00 0.00 0.00 178.15 178.71 1a4u h ALA 105 N 0.82 1.10 0.04 1.87 0.00 -0.68 -1.22 119.26 121.18 1a4u h ALA 105 Ca 0.06 -0.23 -0.16 0.00 0.00 0.00 0.00 54.91 54.57 1a4u h ALA 105 Cb 0.97 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1a4u h ALA 105 CO 0.09 0.59 -0.85 0.82 0.00 0.00 0.00 179.25 179.91 1a4u h ILE 106 N 0.88 1.28 -0.01 0.00 2.04 -1.03 0.18 117.51 120.84 1a4u h ILE 106 Ca 0.18 -2.32 -0.18 0.00 1.00 0.00 0.00 64.86 63.55 1a4u h ILE 106 Cb 0.36 2.80 -0.01 0.00 -0.74 0.00 0.00 36.82 39.23 1a4u h ILE 106 CO 0.00 0.54 -0.78 0.78 0.00 0.00 0.00 178.15 178.69 1a4u h ASN 107 N -0.78 0.19 0.00 1.72 2.35 -1.29 -3.37 115.58 114.39 1a4u h ASN 107 Ca -0.21 -0.14 0.00 0.00 -0.55 0.00 0.00 56.30 55.40 1a4u h ASN 107 Cb 1.34 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 39.65 1a4u h ASN 107 CO -0.05 0.90 -0.08 0.33 -1.65 0.00 0.00 177.43 176.88 1a4u n PHE 108 N -3.70 0.00 -0.16 1.19 7.35 -0.66 -4.60 117.46 116.88 1a4u n PHE 108 Ca -0.03 0.00 -0.02 0.00 -0.76 0.00 0.00 57.45 56.64 1a4u n PHE 108 Cb 0.74 -0.04 0.07 0.00 0.35 0.00 0.00 39.48 40.60 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 -0.08 0.77 -0.88 -2.13 2.02 -1.34 -2.03 112.91 109.23 1a4u h THR 109 Ca 0.00 -0.10 -0.01 0.00 0.77 0.00 0.00 66.41 67.07 1a4u h THR 109 Cb 0.08 0.44 -0.04 0.00 -1.74 0.00 0.00 68.15 66.89 1a4u h THR 109 CO 0.00 0.06 0.53 1.23 0.37 0.00 0.00 175.52 177.70 1a4u h GLY 110 N 0.30 1.29 1.01 2.16 0.00 -0.80 -0.38 103.07 106.66 1a4u h GLY 110 Ca 0.25 -0.54 -0.09 0.00 0.00 0.00 0.00 47.33 46.96 1a4u h GLY 110 CO -0.29 0.52 -0.04 -2.00 0.00 0.00 0.00 176.54 174.73 1a4u h LEU 111 N 1.22 0.86 -0.49 3.11 6.46 -1.61 -1.16 115.31 123.70 1a4u h LEU 111 Ca 0.32 -0.33 -0.06 0.00 -0.12 0.00 0.00 57.88 57.69 1a4u h LEU 111 Cb -0.04 -0.23 -0.02 0.00 -0.73 0.00 0.00 40.66 39.64 1a4u h LEU 111 CO -0.06 0.99 0.08 0.58 -0.62 0.00 0.00 178.44 179.40 1a4u h VAL 112 N 0.72 1.25 -0.38 1.05 2.07 -0.99 -2.07 116.25 117.91 1a4u h VAL 112 Ca 0.13 -0.93 -0.08 0.00 0.82 0.00 0.00 66.70 66.63 1a4u h VAL 112 Cb 0.57 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 1a4u h VAL 112 CO 0.03 0.33 -0.08 0.78 0.02 0.00 0.00 177.57 178.65 1a4u h ASN 113 N 0.69 0.73 -0.79 0.57 2.35 -0.94 0.58 115.58 118.77 1a4u h ASN 113 Ca 0.15 -0.36 -0.02 0.00 -0.55 0.00 0.00 56.30 55.52 1a4u h ASN 113 Cb 0.40 -0.20 -0.04 0.00 0.05 0.00 0.00 38.32 38.54 1a4u h ASN 113 CO 0.01 0.92 0.41 0.74 -1.65 0.00 0.00 177.43 177.85 1a4u h THR 114 N 0.53 1.24 -0.47 2.81 2.02 -1.20 0.74 112.91 118.59 1a4u h THR 114 Ca 0.10 -0.65 -0.03 0.00 0.77 0.00 0.00 66.41 66.59 1a4u h THR 114 Cb 0.59 0.22 -0.02 0.00 -1.74 0.00 0.00 68.15 67.20 1a4u h THR 114 CO 0.04 0.28 0.17 0.74 0.37 0.00 0.00 175.52 177.12 1a4u h THR 115 N 1.11 1.21 -0.49 3.16 2.02 -1.16 -1.57 112.91 117.19 1a4u h THR 115 Ca 0.28 -0.68 -0.04 0.00 0.77 0.00 0.00 66.41 66.73 1a4u h THR 115 Cb 0.08 0.78 -0.02 0.00 -1.74 0.00 0.00 68.15 67.25 1a4u h THR 115 CO -0.04 0.25 0.14 0.74 0.37 0.00 0.00 175.52 176.98 1a4u h THR 116 N 0.62 1.20 -0.17 3.16 2.02 -0.39 -2.46 112.91 116.90 1a4u h THR 116 Ca 0.16 -0.71 -0.03 0.00 0.77 0.00 0.00 66.41 66.59 1a4u h THR 116 Cb 0.22 0.68 -0.01 0.00 -1.74 0.00 0.00 68.15 67.31 1a4u h THR 116 CO -0.01 0.27 -0.03 0.00 0.37 0.00 0.00 175.52 176.12 1a4u h ALA 117 N 1.44 0.23 0.00 6.16 0.00 -0.39 -3.16 119.26 123.54 1a4u h ALA 117 Ca 0.16 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 1a4u h ALA 117 Cb 0.23 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1a4u h ALA 117 CO -0.01 -0.02 -0.23 0.97 0.00 0.00 0.00 179.25 179.96 1a4u h ILE 118 N 0.03 0.67 0.00 0.00 2.10 -1.14 -2.62 117.51 116.54 1a4u h ILE 118 Ca 0.04 -1.03 0.00 0.00 1.08 0.00 0.00 64.86 64.95 1a4u h ILE 118 Cb 0.45 1.66 0.00 0.00 -1.09 0.00 0.00 36.82 37.84 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 -1.53 2.19 -0.00 -1.40 -0.56 115.31 114.01 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 0.64 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.30 1a4u h LEU 119 CO 0.03 0.00 -0.24 -0.78 -0.00 0.00 0.00 178.44 177.45 1a4u h ASP 120 N 0.00 0.00 0.00 -0.43 3.58 -1.58 0.54 116.42 118.54 1a4u h ASP 120 Ca 0.00 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.45 1a4u h ASP 120 Cb 0.09 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.14 1a4u h ASP 120 CO 0.00 0.24 -1.92 0.49 -2.88 0.00 0.00 179.24 175.17 1a4u n PHE 121 N -3.91 0.00 -0.03 0.28 3.01 -0.28 -4.61 117.46 111.92 1a4u n PHE 121 Ca -0.02 0.00 0.03 0.00 1.01 0.00 0.00 57.45 58.47 1a4u n PHE 121 Cb 0.33 -0.46 -0.13 0.00 -0.01 0.00 0.00 39.48 39.20 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 -2.20 0.00 -1.63 1.38 8.01 -0.85 -4.34 117.44 117.81 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 0.53 -0.55 -0.06 0.00 -2.01 0.00 0.00 31.31 29.22 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 -2.29 2.64 0.27 -0.99 -0.08 0.17 -0.68 116.55 115.60 1a4u n ASP 123 Ca -0.12 0.87 0.13 0.00 -1.51 0.00 0.00 54.79 54.16 1a4u n ASP 123 Cb 0.66 -1.24 0.77 0.00 2.34 0.00 0.00 41.12 43.65 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 9.23 0.00 0.00 -0.67 2.10 -1.31 0.99 116.57 126.91 1a4u h LYS 124 Ca -0.42 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.21 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 0.97 0.09 -0.10 0.00 -2.00 0.00 0.00 179.45 178.42 1a4u h ARG 125 N 0.00 0.00 -0.53 0.07 3.08 -1.82 -1.34 114.38 113.84 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 0.25 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.30 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 -3.40 3.97 -0.87 0.04 5.02 -0.32 -4.90 118.16 117.71 1a4u n LYS 126 Ca -0.01 -2.94 0.00 0.00 -2.02 0.00 0.00 58.31 53.34 1a4u n LYS 126 Cb 0.27 -1.99 0.00 0.00 -0.02 0.00 0.00 35.03 33.30 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 0.59 0.68 3.76 0.72 0.00 -0.51 -5.00 105.19 105.44 1a4u n GLY 127 Ca 0.25 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.97 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 -1.96 1.64 0.00 -0.02 0.00 0.19 -4.93 107.32 102.24 1a4u s GLY 128 Ca 0.00 0.00 0.30 0.00 0.00 0.00 0.00 44.72 45.02 1a4u s GLY 128 CO 0.00 0.42 1.93 -1.55 0.00 0.00 0.00 173.10 173.91 1a4u n PRO 129 N -3.61 1.18 0.00 2.90 -0.04 -1.24 -3.96 135.00 130.22 1a4u n PRO 129 Ca 0.08 -0.44 0.00 0.00 -0.04 0.00 0.00 63.50 63.09 1a4u n PRO 129 Cb 0.55 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.52 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 1.14 -2.28 1.20 0.55 0.00 0.15 -4.98 105.19 100.97 1a4u n GLY 130 Ca 0.19 -1.59 0.01 0.00 0.00 0.00 0.00 46.02 44.64 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 -0.31 0.33 3.04 -0.02 0.00 -1.02 -4.80 105.19 102.42 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 -2.02 1.05 -0.12 -0.61 1.01 -1.11 -0.84 121.20 118.56 1a4u s ILE 132 Ca 0.10 -0.49 0.02 0.00 0.00 0.00 0.00 60.65 60.28 1a4u s ILE 132 Cb -0.00 -0.93 0.01 0.00 0.01 0.00 0.00 42.46 41.55 1a4u s ILE 132 CO -0.01 0.32 -0.18 -0.63 0.00 0.00 0.00 174.94 174.44 1a4u s ILE 133 N 0.28 1.75 -0.28 2.92 1.01 0.14 -1.39 121.20 125.63 1a4u s ILE 133 Ca -0.06 -0.79 -0.04 0.00 0.00 0.00 0.00 60.65 59.75 1a4u s ILE 133 Cb -0.11 -1.57 0.02 0.00 0.01 0.00 0.00 42.46 40.80 1a4u s ILE 133 CO 0.02 0.49 0.02 0.00 0.00 0.00 0.00 174.94 175.47 1a4u s ALA 134 N 0.91 2.91 -0.24 9.38 0.00 0.05 -2.13 121.76 132.64 1a4u s ALA 134 Ca -0.07 -1.49 -0.09 0.00 0.00 0.00 0.00 51.96 50.31 1a4u s ALA 134 Cb -0.15 -1.96 -0.04 0.00 0.00 0.00 0.00 23.12 20.96 1a4u s ALA 134 CO -0.02 -0.93 0.12 -0.80 0.00 0.00 0.00 175.76 174.13 1a4u s ASN 135 N 1.41 5.69 -0.44 0.00 0.01 -0.70 -1.34 114.94 119.57 1a4u s ASN 135 Ca 0.01 -0.02 -0.25 0.00 -0.71 0.00 0.00 52.86 51.89 1a4u s ASN 135 Cb -0.17 -2.02 0.02 0.00 0.41 0.00 0.00 41.25 39.49 1a4u s ASN 135 CO -0.00 0.04 0.89 -0.63 -1.51 0.00 0.00 177.10 175.89 1a4u s ILE 136 N 1.22 4.54 0.00 0.60 1.01 -0.55 -0.16 121.20 127.85 1a4u s ILE 136 Ca 0.06 0.79 0.00 0.00 0.00 0.00 0.00 60.65 61.50 1a4u s ILE 136 Cb -0.14 -4.38 0.00 0.00 0.01 0.00 0.00 42.46 37.94 1a4u s ILE 136 CO 0.05 -0.73 0.00 0.00 0.00 0.00 0.00 174.94 174.25 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 0.97 0.00 -0.75 0.00 0.00 64.21 64.43 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 0.56 0.00 0.00 2.46 -1.51 -1.67 0.23 116.25 116.32 1a4u h VAL 139 Ca 0.00 -0.10 0.00 0.00 -1.23 0.00 0.00 66.70 65.37 1a4u h VAL 139 Cb 0.00 0.99 0.00 0.00 -2.13 0.00 0.00 31.29 30.15 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 -2.87 1.05 0.30 7.19 -2.24 -1.26 -1.10 114.28 115.34 1a4u n THR 140 Ca -0.02 0.27 0.13 0.00 -2.27 0.00 0.00 64.05 62.16 1a4u n THR 140 Cb 0.11 -1.05 0.27 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 2.31 0.00 0.00 3.38 0.00 -0.74 -3.15 103.07 104.87 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 -0.87 0.74 0.00 0.00 0.00 176.54 176.41 1a4u h PHE 142 N 0.00 0.00 -3.27 5.60 0.04 -1.26 -3.37 116.94 114.67 1a4u h PHE 142 Ca 0.00 0.00 -0.40 0.00 2.80 0.00 0.00 57.97 60.37 1a4u h PHE 142 Cb 0.89 0.00 -0.39 0.00 2.20 0.00 0.00 35.95 38.65 1a4u h PHE 142 CO 0.00 0.81 -0.75 -0.80 -0.60 0.00 0.00 178.31 176.98 1a4u s ASN 143 N -6.33 1.40 0.81 2.17 -0.87 -1.03 -5.11 114.94 105.98 1a4u s ASN 143 Ca -0.22 -0.05 -0.11 0.00 -1.57 0.00 0.00 52.86 50.92 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 1.11 0.00 -2.57 0.00 0.00 177.10 175.81 1a4u s ALA 144 N 2.12 2.02 -0.60 0.60 0.00 -1.19 -4.13 121.76 120.57 1a4u s ALA 144 Ca 0.05 0.39 -0.15 0.00 0.00 0.00 0.00 51.96 52.25 1a4u s ALA 144 Cb -0.13 -3.33 0.15 0.00 0.00 0.00 0.00 23.12 19.81 1a4u s ALA 144 CO -0.04 -2.06 0.54 0.42 0.00 0.00 0.00 175.76 174.62 1a4u s ILE 145 N -2.79 5.17 0.07 0.00 1.01 -1.26 -4.93 121.20 118.47 1a4u s ILE 145 Ca 0.63 -1.78 0.20 0.00 0.00 0.00 0.00 60.65 59.70 1a4u s ILE 145 Cb -0.19 -4.29 0.20 0.00 0.01 0.00 0.00 42.46 38.19 1a4u s ILE 145 CO 0.56 -0.90 1.57 1.12 0.00 0.00 0.00 174.94 177.29 1a4u h HIS 146 N 8.55 0.00 0.00 3.97 2.07 -1.97 -0.35 115.15 127.42 1a4u h HIS 146 Ca -0.19 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.32 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 0.79 0.00 -0.06 1.96 -3.07 0.00 0.00 177.93 177.55 1a4u h GLN 147 N 0.00 0.00 -2.13 5.12 7.50 -1.98 -3.22 115.11 120.40 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 0.37 0.00 -0.41 0.00 0.05 0.00 0.00 27.48 27.49 1a4u h GLN 147 CO 0.00 0.06 -0.82 1.33 -1.50 0.00 0.00 178.83 177.90 1a4u n VAL 148 N -3.13 1.26 0.03 -0.54 0.24 -0.14 -1.82 118.33 114.22 1a4u n VAL 148 Ca 0.02 -4.83 0.01 0.00 -2.04 0.00 0.00 64.34 57.50 1a4u n VAL 148 Cb 0.46 -1.78 0.35 0.00 -1.47 0.00 0.00 33.84 31.40 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 3.84 0.47 -0.14 7.34 0.13 -1.60 -2.08 132.00 139.96 1a4u h PRO 149 Ca 0.14 -0.08 -0.07 0.00 -0.87 0.00 0.00 66.00 65.12 1a4u h PRO 149 Cb 0.74 -0.08 -0.00 0.00 0.13 0.00 0.00 31.00 31.79 1a4u h PRO 149 CO 0.68 0.46 -0.18 0.28 -0.23 0.00 0.00 178.00 179.02 1a4u h VAL 150 N 0.46 1.36 0.06 1.56 2.07 -1.92 -0.03 116.25 119.80 1a4u h VAL 150 Ca 0.11 -1.38 0.00 0.00 0.82 0.00 0.00 66.70 66.24 1a4u h VAL 150 Cb 0.23 1.95 -0.00 0.00 -1.52 0.00 0.00 31.29 31.95 1a4u h VAL 150 CO 0.00 0.40 -0.05 0.22 0.02 0.00 0.00 177.57 178.17 1a4u h TYR 151 N -0.03 -0.11 -0.71 1.57 3.20 -1.92 -0.32 116.97 118.64 1a4u h TYR 151 Ca 0.02 -0.00 0.04 0.00 3.14 0.00 0.00 58.73 61.92 1a4u h TYR 151 Cb 0.73 0.04 -0.05 0.00 1.54 0.00 0.00 36.73 39.00 1a4u h TYR 151 CO 0.09 -0.07 0.44 0.77 -1.64 0.00 0.00 178.16 177.75 1a4u h SER 152 N -0.11 0.71 -0.70 -2.11 0.02 -1.38 -1.80 113.55 108.19 1a4u h SER 152 Ca 0.00 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.88 1a4u h SER 152 Cb 0.10 -0.15 -0.03 0.00 0.14 0.00 0.00 62.40 62.46 1a4u h SER 152 CO -0.01 0.49 0.16 0.00 -1.14 0.00 0.00 176.83 176.33 1a4u h ALA 153 N 1.32 0.93 -0.22 3.77 0.00 -0.71 -0.64 119.26 123.70 1a4u h ALA 153 Ca 0.29 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 1a4u h ALA 153 Cb 0.05 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1a4u h ALA 153 CO -0.12 0.66 -0.09 0.66 0.00 0.00 0.00 179.25 180.35 1a4u h SER 154 N 1.06 0.32 0.39 0.00 4.64 -0.55 -1.83 113.55 117.58 1a4u h SER 154 Ca 0.22 -0.07 -0.21 0.00 -0.47 0.00 0.00 61.79 61.27 1a4u h SER 154 Cb 0.38 -0.09 -0.00 0.00 -0.31 0.00 0.00 62.40 62.39 1a4u h SER 154 CO 0.00 0.46 -0.87 0.11 -0.87 0.00 0.00 176.83 175.66 1a4u h LYS 155 N 0.33 0.34 -0.38 4.77 1.79 -0.80 -2.85 116.57 119.78 1a4u h LYS 155 Ca 0.07 -0.35 -0.04 0.00 -2.18 0.00 0.00 60.65 58.15 1a4u h LYS 155 Cb 0.37 0.09 -0.02 0.00 -1.58 0.00 0.00 32.23 31.09 1a4u h LYS 155 CO 0.02 1.02 0.05 0.00 -1.08 0.00 0.00 179.45 179.46 1a4u h ALA 156 N 0.86 1.38 -0.40 3.86 0.00 -0.70 -1.71 119.26 122.56 1a4u h ALA 156 Ca -0.06 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 1a4u h ALA 156 Cb 1.49 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 19.10 1a4u h ALA 156 CO 0.14 0.44 0.15 0.00 0.00 0.00 0.00 179.25 179.99 1a4u h ALA 157 N 1.50 0.51 -0.06 0.00 0.00 -1.19 -2.39 119.26 117.63 1a4u h ALA 157 Ca 0.12 -0.14 -0.12 0.00 0.00 0.00 0.00 54.91 54.78 1a4u h ALA 157 Cb 0.29 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1a4u h ALA 157 CO 0.00 0.12 -0.49 0.28 0.00 0.00 0.00 179.25 179.17 1a4u h VAL 158 N 0.49 1.35 -0.63 0.00 2.07 -1.22 -0.29 116.25 118.03 1a4u h VAL 158 Ca 0.13 -1.70 -0.08 0.00 0.82 0.00 0.00 66.70 65.87 1a4u h VAL 158 Cb 0.20 1.85 -0.03 0.00 -1.52 0.00 0.00 31.29 31.79 1a4u h VAL 158 CO -0.01 0.50 0.09 0.58 0.02 0.00 0.00 177.57 178.75 1a4u h VAL 159 N 0.12 1.26 -0.09 2.57 2.07 -1.19 0.10 116.25 121.09 1a4u h VAL 159 Ca 0.00 -1.03 -0.03 0.00 0.82 0.00 0.00 66.70 66.46 1a4u h VAL 159 Cb 0.91 0.68 -0.00 0.00 -1.52 0.00 0.00 31.29 31.36 1a4u h VAL 159 CO 0.07 0.38 -0.07 -1.28 0.02 0.00 0.00 177.57 176.70 1a4u h SER 160 N 0.98 0.22 -0.69 0.57 0.87 -1.10 -2.04 113.55 112.36 1a4u h SER 160 Ca 0.19 -0.45 0.03 0.00 -1.23 0.00 0.00 61.79 60.33 1a4u h SER 160 Cb 0.44 -0.06 -0.04 0.00 -0.44 0.00 0.00 62.40 62.30 1a4u h SER 160 CO 0.01 0.63 0.43 0.15 -0.53 0.00 0.00 176.83 177.52 1a4u h PHE 161 N -0.18 0.81 -0.63 2.24 3.57 -0.91 -1.25 116.94 120.60 1a4u h PHE 161 Ca 0.02 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.48 1a4u h PHE 161 Cb 0.55 -0.26 -0.03 0.00 2.79 0.00 0.00 35.95 39.00 1a4u h PHE 161 CO 0.08 0.46 0.15 1.15 -2.23 0.00 0.00 178.31 177.92 1a4u h THR 162 N 0.84 1.25 -0.91 4.41 2.02 -0.96 -0.40 112.91 119.16 1a4u h THR 162 Ca 0.28 -0.93 0.02 0.00 0.77 0.00 0.00 66.41 66.55 1a4u h THR 162 Cb 0.02 0.65 -0.05 0.00 -1.74 0.00 0.00 68.15 67.03 1a4u h THR 162 CO -0.11 0.35 0.60 0.78 0.37 0.00 0.00 175.52 177.51 1a4u h ASN 163 N 0.93 1.02 -0.32 4.18 -0.26 -0.74 -2.01 115.58 118.39 1a4u h ASN 163 Ca 0.20 -0.02 -0.10 0.00 -0.56 0.00 0.00 56.30 55.81 1a4u h ASN 163 Cb 0.36 -0.25 -0.01 0.00 -1.06 0.00 0.00 38.32 37.36 1a4u h ASN 163 CO 0.00 0.73 -0.21 0.28 -1.06 0.00 0.00 177.43 177.17 1a4u h SER 164 N 1.20 0.74 -0.61 5.81 0.02 -0.70 -2.84 113.55 117.17 1a4u h SER 164 Ca 0.35 -0.43 0.10 0.00 -0.84 0.00 0.00 61.79 60.96 1a4u h SER 164 Cb -0.08 -0.21 -0.07 0.00 0.14 0.00 0.00 62.40 62.18 1a4u h SER 164 CO -0.09 1.01 0.22 -0.07 -1.14 0.00 0.00 176.83 176.76 1a4u h LEU 165 N 0.47 0.21 -1.08 5.07 3.38 -0.53 -1.24 115.31 121.59 1a4u h LEU 165 Ca 0.07 0.08 0.01 0.00 0.09 0.00 0.00 57.88 58.12 1a4u h LEU 165 Cb 0.75 0.06 -0.05 0.00 0.09 0.00 0.00 40.66 41.52 1a4u h LEU 165 CO 0.06 0.13 0.62 0.00 0.09 0.00 0.00 178.44 179.33 1a4u h ALA 166 N 1.42 1.33 0.00 1.53 0.00 -1.28 -1.70 119.26 120.56 1a4u h ALA 166 Ca 0.31 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1a4u h ALA 166 Cb 0.39 -0.38 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1a4u h ALA 166 CO -0.31 0.62 0.00 0.87 0.00 0.00 0.00 179.25 180.43 1a4u h LYS 167 N 1.27 0.00 -0.01 0.00 1.57 -1.01 -2.70 116.57 115.70 1a4u h LYS 167 Ca 0.34 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.12 1a4u h LYS 167 Cb -0.14 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.17 1a4u h LYS 167 CO -0.07 0.00 -0.26 1.28 -0.57 0.00 0.00 179.45 179.82 1a4u n LEU 168 N -2.93 1.11 -0.26 2.94 4.77 -0.66 -4.45 117.00 117.52 1a4u n LEU 168 Ca 0.01 -0.31 0.06 0.00 -0.03 0.00 0.00 56.01 55.74 1a4u n LEU 168 Cb 0.32 -0.11 0.17 0.00 -2.33 0.00 0.00 43.42 41.47 1a4u n LEU 168 CO 0.27 0.21 0.83 0.00 -1.33 0.00 0.00 177.39 177.36 1a4u h ALA 169 N 3.72 0.81 0.00 -1.18 0.00 -1.24 0.14 119.26 121.51 1a4u h ALA 169 Ca 0.00 0.24 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1a4u h ALA 169 Cb 0.52 0.42 0.00 0.00 0.00 0.00 0.00 17.79 18.73 1a4u h ALA 169 CO 0.00 -0.43 0.05 -1.35 0.00 0.00 0.00 179.25 177.53 1a4u h PRO 170 N 0.11 0.00 0.02 0.00 0.11 -1.83 0.51 132.00 130.92 1a4u h PRO 170 Ca 0.42 0.00 -0.39 0.00 0.11 0.00 0.00 66.00 66.14 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 -0.67 0.00 -2.35 -0.89 -0.21 0.00 0.00 178.00 173.88 1a4u n ILE 171 N -2.96 1.55 -0.00 4.15 5.41 0.39 -4.63 119.36 123.28 1a4u n ILE 171 Ca -0.03 -0.55 0.01 0.00 1.00 0.00 0.00 62.75 63.18 1a4u n ILE 171 Cb 0.12 -1.56 -0.11 0.00 -0.71 0.00 0.00 39.64 37.38 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 -3.46 0.95 -0.80 1.39 -2.24 -0.57 -4.39 114.28 105.16 1a4u n THR 172 Ca -0.44 -0.68 0.00 0.00 -2.27 0.00 0.00 64.05 60.66 1a4u n THR 172 Cb 0.98 -0.50 0.00 0.00 -2.10 0.00 0.00 70.33 68.71 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 1.43 0.89 3.52 3.38 0.00 0.18 -1.26 105.19 113.33 1a4u n GLY 173 Ca -0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.50 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 -3.57 5.07 0.45 1.61 1.01 -1.25 -2.42 120.40 121.30 1a4u s VAL 174 Ca 0.00 -0.15 -0.01 0.00 0.00 0.00 0.00 61.98 61.83 1a4u s VAL 174 Cb 0.00 -3.53 -0.01 0.00 0.00 0.00 0.00 36.38 32.84 1a4u s VAL 174 CO 0.00 0.11 0.68 0.42 0.00 0.00 0.00 175.10 176.31 1a4u s THR 175 N 1.70 4.19 0.05 3.92 -4.23 -0.02 -4.06 115.64 117.19 1a4u s THR 175 Ca 0.06 -0.40 -0.27 0.00 -1.18 0.00 0.00 61.69 59.90 1a4u s THR 175 Cb -0.17 -3.56 0.07 0.00 1.34 0.00 0.00 72.50 70.19 1a4u s THR 175 CO 0.09 -0.41 0.66 0.00 -0.54 0.00 0.00 174.62 174.42 1a4u s ALA 176 N -2.57 -1.70 0.12 3.99 0.00 -1.26 -0.68 121.76 119.66 1a4u s ALA 176 Ca 0.48 0.93 -0.19 0.00 0.00 0.00 0.00 51.96 53.17 1a4u s ALA 176 Cb -0.10 0.41 0.05 0.00 0.00 0.00 0.00 23.12 23.47 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 -2.47 -0.33 0.01 0.00 -0.85 -0.91 0.27 117.35 113.07 1a4u s TYR 177 Ca -0.04 0.12 0.03 0.00 -0.52 0.00 0.00 57.07 56.66 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 -0.72 -0.03 -1.54 -1.52 0.00 0.00 175.55 171.72 1a4u s SER 178 N -2.60 4.86 -0.27 -0.18 1.04 -0.73 -1.72 113.70 114.10 1a4u s SER 178 Ca 0.01 -0.10 -0.04 0.00 0.48 0.00 0.00 55.95 56.30 1a4u s SER 178 Cb 0.01 -1.19 0.02 0.00 0.10 0.00 0.00 66.02 64.95 1a4u s SER 178 CO -0.10 0.27 0.01 -0.63 0.98 0.00 0.00 173.24 173.77 1a4u s ILE 179 N -1.07 3.41 -0.48 -1.02 -1.09 0.78 -1.18 121.20 120.55 1a4u s ILE 179 Ca 0.19 -0.89 0.03 0.00 -2.23 0.00 0.00 60.65 57.74 1a4u s ILE 179 Cb -0.11 -2.76 0.12 0.00 -1.58 0.00 0.00 42.46 38.13 1a4u s ILE 179 CO 0.10 0.12 0.22 0.20 -1.23 0.00 0.00 174.94 174.34 1a4u s ASN 180 N 1.40 4.62 0.41 3.58 0.01 0.75 0.03 114.94 125.74 1a4u s ASN 180 Ca 0.01 -2.69 -0.24 0.00 -0.71 0.00 0.00 52.86 49.23 1a4u s ASN 180 Cb -0.17 -1.68 -0.09 0.00 0.41 0.00 0.00 41.25 39.73 1a4u s ASN 180 CO -0.01 -0.31 1.08 -2.84 -1.51 0.00 0.00 177.10 173.51 1a4u s PRO 181 N 0.16 4.08 0.00 -0.60 0.02 -1.26 -1.11 135.00 136.29 1a4u s PRO 181 Ca 0.15 1.58 0.00 0.00 0.02 0.00 0.00 61.00 62.75 1a4u s PRO 181 Cb -0.23 -2.52 0.00 0.00 0.02 0.00 0.00 34.50 31.77 1a4u s PRO 181 CO -0.03 -0.23 0.00 0.41 -0.33 0.00 0.00 177.00 176.82 1a4u n GLY 182 N 0.37 0.10 3.68 0.52 0.00 0.80 -2.53 105.19 108.14 1a4u n GLY 182 Ca 0.05 -1.79 -0.42 0.00 0.00 0.00 0.00 46.02 43.86 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 0.35 2.98 0.06 -0.61 -1.09 -1.26 -4.93 121.20 116.69 1a4u s ILE 183 Ca 0.00 0.37 0.03 0.00 -2.23 0.00 0.00 60.65 58.82 1a4u s ILE 183 Cb 0.00 -3.24 -0.03 0.00 -1.58 0.00 0.00 42.46 37.61 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 2.97 0.73 -1.23 2.92 2.01 -1.26 -2.55 115.64 119.22 1a4u s THR 184 Ca 0.77 -1.23 -0.08 0.00 0.31 0.00 0.00 61.69 61.46 1a4u s THR 184 Cb -0.41 -0.84 0.20 0.00 0.01 0.00 0.00 72.50 71.46 1a4u s THR 184 CO 0.34 -0.38 1.76 0.54 -0.69 0.00 0.00 174.62 176.18 1a4u n ARG 185 N 1.26 3.79 -0.03 4.92 3.00 -1.12 -4.42 116.66 124.07 1a4u n ARG 185 Ca -0.21 -3.78 -0.04 0.00 -0.01 0.00 0.00 57.85 53.80 1a4u n ARG 185 Cb 0.55 -2.84 -0.03 0.00 0.00 0.00 0.00 32.46 30.14 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 2.96 0.37 -1.84 0.55 -2.24 -1.26 -4.17 114.28 108.65 1a4u n THR 186 Ca 0.36 -0.14 -0.42 0.00 -2.27 0.00 0.00 64.05 61.58 1a4u n THR 186 Cb 0.36 -0.73 -0.03 0.00 -2.10 0.00 0.00 70.33 67.83 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 3.86 0.01 -0.78 0.04 -1.26 -4.69 135.00 130.05 1a4u s PRO 187 Ca -0.09 2.18 -0.03 0.00 0.04 0.00 0.00 61.00 63.10 1a4u s PRO 187 Cb 0.02 -4.14 -0.01 0.00 0.04 0.00 0.00 34.50 30.42 1a4u s PRO 187 CO 0.15 -1.24 1.04 -0.07 0.04 0.00 0.00 177.00 176.92 1a4u h LEU 188 N 11.69 -0.15 -9.31 -3.56 3.38 -1.98 -3.37 115.31 112.00 1a4u h LEU 188 Ca -0.42 0.02 -0.56 0.00 0.09 0.00 0.00 57.88 57.01 1a4u h LEU 188 Cb 1.20 0.06 -0.05 0.00 0.09 0.00 0.00 40.66 41.97 1a4u h LEU 188 CO 0.96 -0.03 0.25 0.68 0.09 0.00 0.00 178.44 180.40 1a4u s VAL 189 N -3.20 4.95 -0.39 1.22 -7.23 -1.26 -5.03 120.40 109.46 1a4u s VAL 189 Ca -0.01 1.65 -0.08 0.00 -1.81 0.00 0.00 61.98 61.73 1a4u s VAL 189 Cb 0.01 -4.14 0.07 0.00 0.56 0.00 0.00 36.38 32.88 1a4u s VAL 189 CO 0.05 0.16 0.21 -1.38 -0.31 0.00 0.00 175.10 173.83 1a4u s HIS 190 N 1.28 3.33 0.00 2.82 -3.43 -1.26 -4.90 115.29 113.12 1a4u s HIS 190 Ca 0.41 -1.52 0.00 0.00 -0.80 0.00 0.00 55.06 53.15 1a4u s HIS 190 Cb -0.18 -2.76 0.00 0.00 -1.43 0.00 0.00 32.58 28.21 1a4u s HIS 190 CO 0.19 -0.81 0.00 2.41 -2.00 0.00 0.00 174.74 174.52 1a4u n THR 191 N 4.87 0.00 -3.82 -5.38 -1.04 -1.26 -4.88 114.28 102.77 1a4u n THR 191 Ca -0.10 0.00 -0.21 0.00 -2.04 0.00 0.00 64.05 61.70 1a4u n THR 191 Cb 0.43 0.00 -0.02 0.00 -1.82 0.00 0.00 70.33 68.92 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 3.21 -0.10 -1.42 -0.71 -1.26 -5.07 117.98 112.63 1a4u s PHE 192 Ca 0.00 -0.14 -0.21 0.00 -1.04 0.00 0.00 56.93 55.54 1a4u s PHE 192 Cb 0.00 -1.70 -0.04 0.00 -1.21 0.00 0.00 43.02 40.07 1a4u s PHE 192 CO 0.00 0.28 0.61 -0.80 -1.34 0.00 0.00 175.22 173.97 1a4u s ASN 193 N -4.02 6.84 0.40 1.98 0.01 -1.26 -4.80 114.94 114.08 1a4u s ASN 193 Ca 0.38 1.01 -0.06 0.00 -0.71 0.00 0.00 52.86 53.48 1a4u s ASN 193 Cb -0.09 -2.36 -0.05 0.00 0.41 0.00 0.00 41.25 39.17 1a4u s ASN 193 CO 0.29 -0.09 0.69 -0.94 -1.51 0.00 0.00 177.10 175.54 1a4u s SER 194 N 0.77 6.39 0.08 -1.22 1.04 -1.26 -1.74 113.70 117.76 1a4u s SER 194 Ca 0.32 0.88 -0.31 0.00 0.48 0.00 0.00 55.95 57.32 1a4u s SER 194 Cb -0.17 -2.22 -0.09 0.00 0.10 0.00 0.00 66.02 63.65 1a4u s SER 194 CO 0.14 -0.40 1.73 0.86 0.98 0.00 0.00 173.24 176.56 1a4u s TRP 195 N -2.42 2.23 -1.18 5.02 -0.00 -0.76 -1.85 118.94 119.99 1a4u s TRP 195 Ca 0.47 0.14 0.00 0.00 -0.00 0.00 0.00 56.10 56.71 1a4u s TRP 195 Cb -0.10 -4.05 0.00 0.00 -0.00 0.00 0.00 33.47 29.31 1a4u s TRP 195 CO 0.36 -4.32 0.00 1.28 -0.00 0.00 0.00 176.95 174.27 1a4u n LEU 196 N 5.83 -1.13 -3.95 5.86 4.77 -1.26 -1.74 117.00 125.38 1a4u n LEU 196 Ca 0.17 0.22 -0.30 0.00 -0.03 0.00 0.00 56.01 56.06 1a4u n LEU 196 Cb 0.40 -2.14 0.02 0.00 -2.33 0.00 0.00 43.42 39.37 1a4u n LEU 196 CO 0.64 -0.28 0.06 0.47 -1.33 0.00 0.00 177.39 176.95 1a4u n ASP 197 N -1.45 -4.12 0.24 -1.43 8.00 -0.77 -4.85 116.55 112.17 1a4u n ASP 197 Ca -0.15 -0.83 0.10 0.00 0.71 0.00 0.00 54.79 54.63 1a4u n ASP 197 Cb 0.56 -3.69 0.62 0.00 -0.02 0.00 0.00 41.12 38.59 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 -1.97 0.73 -1.37 2.53 -1.51 -1.56 -3.38 116.25 109.71 1a4u h VAL 198 Ca -0.59 -0.71 -0.16 0.00 -1.23 0.00 0.00 66.70 64.01 1a4u h VAL 198 Cb 1.38 1.44 -0.24 0.00 -2.13 0.00 0.00 31.29 31.74 1a4u h VAL 198 CO 0.68 0.17 -0.53 -0.70 -1.23 0.00 0.00 177.57 175.96 1a4u s GLU 199 N -4.18 0.70 0.00 5.19 2.56 -1.26 -5.01 118.70 116.69 1a4u s GLU 199 Ca -0.03 -0.35 0.13 0.00 0.00 0.00 0.00 54.97 54.73 1a4u s GLU 199 Cb 0.13 -0.19 0.60 0.00 2.00 0.00 0.00 34.13 36.67 1a4u s GLU 199 CO 0.62 -1.17 1.37 -0.35 -0.56 0.00 0.00 175.26 175.18 1a4u n PRO 200 N 4.54 0.09 -0.67 4.30 -0.04 -1.26 -2.90 135.00 139.05 1a4u n PRO 200 Ca 0.10 0.23 0.04 0.00 -0.04 0.00 0.00 63.50 63.82 1a4u n PRO 200 Cb 0.52 -1.50 0.28 0.00 -0.04 0.00 0.00 33.50 32.77 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 -1.40 3.23 -0.12 0.54 1.74 -1.26 -4.73 116.66 114.66 1a4u n ARG 201 Ca 0.05 -2.99 -0.05 0.00 -0.77 0.00 0.00 57.85 54.09 1a4u n ARG 201 Cb 0.13 -1.98 0.02 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 2.18 0.63 0.03 1.55 2.07 -1.85 -0.70 116.25 120.17 1a4u h VAL 202 Ca 0.08 -0.01 0.01 0.00 0.82 0.00 0.00 66.70 67.60 1a4u h VAL 202 Cb 1.73 0.59 -0.01 0.00 -1.52 0.00 0.00 31.29 32.08 1a4u h VAL 202 CO 0.39 0.01 -0.06 0.00 0.02 0.00 0.00 177.57 177.93 1a4u h ALA 203 N 1.39 -0.09 -0.47 1.67 0.00 -1.87 -0.13 119.26 119.77 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 0.09 -0.07 0.00 0.00 0.00 0.00 17.79 18.10 1a4u h ALA 203 CO -0.39 -0.56 0.02 1.49 0.00 0.00 0.00 179.25 179.82 1a4u h GLU 204 N -0.12 0.14 -0.26 0.00 4.81 -1.78 -1.70 114.58 115.67 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 0.13 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.47 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 -1.15 1.64 3.38 -0.87 -3.06 115.31 115.80 1a4u h LEU 205 Ca 0.23 -0.27 0.07 0.00 0.09 0.00 0.00 57.88 58.01 1a4u h LEU 205 Cb 0.34 -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 0.59 -0.07 0.09 0.00 0.00 178.44 179.26 1a4u h LEU 206 N 0.24 0.89 0.00 1.67 3.38 -0.64 -0.05 115.31 120.80 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 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1a4u h LEU 206 CO 0.01 0.56 0.00 0.18 0.09 0.00 0.00 178.44 179.28 1a4u n LEU 207 N -4.50 0.00 -0.40 1.67 4.77 -0.67 -2.72 117.00 115.14 1a4u n LEU 207 Ca 0.14 0.15 0.14 0.00 -0.03 0.00 0.00 56.01 56.41 1a4u n LEU 207 Cb 0.22 -0.15 0.58 0.00 -2.33 0.00 0.00 43.42 41.73 1a4u n LEU 207 CO 0.32 -0.03 0.90 -1.20 -1.33 0.00 0.00 177.39 176.05 1a4u n SER 208 N -1.15 1.26 -4.55 -1.43 7.64 -0.03 -4.87 113.62 110.48 1a4u n SER 208 Ca 0.15 -1.44 -0.26 0.00 1.01 0.00 0.00 58.87 58.33 1a4u n SER 208 Cb 0.14 -0.01 -0.11 0.00 -1.01 0.00 0.00 64.21 63.23 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 -1.98 2.38 0.10 1.43 3.76 -1.10 -5.09 115.29 114.79 1a4u s HIS 209 Ca 0.39 -0.59 -0.35 0.00 -0.15 0.00 0.00 55.06 54.36 1a4u s HIS 209 Cb 0.21 -1.47 -0.15 0.00 1.11 0.00 0.00 32.58 32.27 1a4u s HIS 209 CO 0.33 0.49 1.52 -0.35 -0.85 0.00 0.00 174.74 175.89 1a4u n PRO 210 N -0.82 1.77 -3.29 8.40 -0.04 -1.26 -4.99 135.00 134.77 1a4u n PRO 210 Ca -0.05 0.64 -0.14 0.00 -0.04 0.00 0.00 63.50 63.91 1a4u n PRO 210 Cb 0.65 -2.37 -0.04 0.00 -0.04 0.00 0.00 33.50 31.70 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 3.25 0.00 -4.29 0.52 -2.24 -1.26 -4.90 114.28 105.36 1a4u n THR 211 Ca 0.18 -1.25 -0.16 0.00 -2.27 0.00 0.00 64.05 60.56 1a4u n THR 211 Cb 0.25 0.39 -0.10 0.00 -2.10 0.00 0.00 70.33 68.77 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 -2.85 1.20 0.50 -0.78 -2.07 -1.06 -4.69 119.66 109.91 1a4u s GLN 212 Ca 0.08 -1.55 -0.09 0.00 -1.82 0.00 0.00 55.36 51.97 1a4u s GLN 212 Cb 0.00 -0.70 -0.05 0.00 -1.09 0.00 0.00 33.01 31.17 1a4u s GLN 212 CO 0.06 0.03 0.86 0.95 -1.32 0.00 0.00 175.29 175.87 1a4u s THR 213 N -3.30 4.79 0.38 3.63 -4.23 -1.26 -2.81 115.64 112.83 1a4u s THR 213 Ca 0.22 0.59 0.07 0.00 -1.18 0.00 0.00 61.69 61.38 1a4u s THR 213 Cb 0.03 -3.81 0.21 0.00 1.34 0.00 0.00 72.50 70.27 1a4u s THR 213 CO 0.04 -0.81 1.98 -1.28 -0.54 0.00 0.00 174.62 174.01 1a4u h SER 214 N 0.47 0.43 -0.16 3.99 0.87 -1.95 -2.30 113.55 114.90 1a4u h SER 214 Ca -0.46 -0.05 -0.18 0.00 -1.23 0.00 0.00 61.79 59.87 1a4u h SER 214 Cb 1.19 -0.11 -0.00 0.00 -0.44 0.00 0.00 62.40 63.04 1a4u h SER 214 CO 0.62 0.42 -0.56 -0.33 -0.53 0.00 0.00 176.83 176.45 1a4u h GLU 215 N 0.47 0.75 -0.80 2.24 3.07 -1.93 -1.17 114.58 117.22 1a4u h GLU 215 Ca 0.12 -0.48 -0.02 0.00 -0.50 0.00 0.00 59.36 58.48 1a4u h GLU 215 Cb 0.14 0.06 -0.04 0.00 -0.84 0.00 0.00 28.75 28.07 1a4u h GLU 215 CO -0.01 1.11 0.43 1.96 -1.40 0.00 0.00 179.01 181.10 1a4u h GLN 216 N 0.57 1.12 -0.25 2.33 4.20 -1.83 -1.56 115.11 119.70 1a4u h GLN 216 Ca 0.01 -0.14 -0.06 0.00 0.06 0.00 0.00 58.65 58.52 1a4u h GLN 216 Cb 1.14 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 28.70 1a4u h GLN 216 CO 0.12 0.83 -0.08 0.00 -0.67 0.00 0.00 178.83 179.03 1a4u h GLY 218 N 0.22 1.08 0.99 0.00 0.00 -0.89 0.82 103.07 105.29 1a4u h GLY 218 Ca 0.06 -0.34 -0.08 0.00 0.00 0.00 0.00 47.33 46.98 1a4u h GLY 218 CO 0.03 0.26 -0.01 1.46 0.00 0.00 0.00 176.54 178.28 1a4u h GLN 219 N 0.86 0.81 0.00 4.80 4.20 -1.28 -2.45 115.11 122.05 1a4u h GLN 219 Ca 0.31 -0.26 -0.09 0.00 0.06 0.00 0.00 58.65 58.67 1a4u h GLN 219 Cb 0.08 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 27.77 1a4u h GLN 219 CO -0.13 0.87 -0.41 -0.91 -0.67 0.00 0.00 178.83 177.58 1a4u h ASN 220 N 0.66 0.00 -0.09 1.46 2.35 -1.14 -2.25 115.58 116.58 1a4u h ASN 220 Ca 0.13 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.88 1a4u h ASN 220 Cb 0.51 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.88 1a4u h ASN 220 CO 0.03 0.41 0.04 0.15 -1.65 0.00 0.00 177.43 176.41 1a4u h PHE 221 N 0.00 0.12 -0.46 1.19 3.04 -0.52 -0.93 116.94 119.38 1a4u h PHE 221 Ca -0.00 -0.00 -0.08 0.00 3.98 0.00 0.00 57.97 61.86 1a4u h PHE 221 Cb 0.84 -0.04 -0.02 0.00 2.56 0.00 0.00 35.95 39.29 1a4u h PHE 221 CO 0.00 0.18 -0.06 0.28 -2.02 0.00 0.00 178.31 176.69 1a4u h VAL 222 N 0.03 1.25 -0.88 1.41 2.07 -1.27 -2.23 116.25 116.64 1a4u h VAL 222 Ca 0.03 -1.09 -0.01 0.00 0.82 0.00 0.00 66.70 66.44 1a4u h VAL 222 Cb 0.10 0.96 -0.04 0.00 -1.52 0.00 0.00 31.29 30.78 1a4u h VAL 222 CO -0.00 0.38 0.49 0.11 0.02 0.00 0.00 177.57 178.57 1a4u h LYS 223 N 0.73 1.21 -0.51 1.57 1.79 -1.12 -0.50 116.57 119.74 1a4u h LYS 223 Ca 0.13 -0.13 -0.04 0.00 -2.18 0.00 0.00 60.65 58.43 1a4u h LYS 223 Cb 0.53 -0.24 -0.02 0.00 -1.58 0.00 0.00 32.23 30.91 1a4u h LYS 223 CO 0.03 0.87 0.15 0.00 -1.08 0.00 0.00 179.45 179.42 1a4u h ALA 224 N 1.32 0.67 -0.67 3.86 0.00 -0.80 -0.34 119.26 123.30 1a4u h ALA 224 Ca 0.31 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1a4u h ALA 224 Cb 0.00 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 1a4u h ALA 224 CO -0.05 0.34 0.43 0.82 0.00 0.00 0.00 179.25 180.79 1a4u h ILE 225 N 0.70 1.18 -0.01 0.00 2.04 -0.81 -2.07 117.51 118.53 1a4u h ILE 225 Ca 0.16 -0.35 -0.09 0.00 1.00 0.00 0.00 64.86 65.58 1a4u h ILE 225 Cb 0.29 0.21 -0.01 0.00 -0.74 0.00 0.00 36.82 36.57 1a4u h ILE 225 CO -0.00 0.18 -0.43 -0.33 0.00 0.00 0.00 178.15 177.56 1a4u h GLU 226 N 0.91 0.03 -0.19 2.37 5.08 -0.82 -2.04 114.58 119.92 1a4u h GLU 226 Ca 0.24 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.57 1a4u h GLU 226 Cb -0.08 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 1a4u h GLU 226 CO -0.05 0.46 0.02 0.00 -1.00 0.00 0.00 179.01 178.44 1a4u h ALA 227 N 1.54 1.68 -6.65 3.43 0.00 -0.37 0.20 119.26 119.09 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 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1a4u h ALA 227 CO 0.06 0.24 -0.96 -1.71 0.00 0.00 0.00 179.25 176.88 1a4u n ASN 228 N -4.40 -3.21 -4.39 0.00 4.05 -0.77 -4.68 115.26 101.86 1a4u n ASN 228 Ca -0.00 -1.16 -0.41 0.00 0.45 0.00 0.00 54.58 53.46 1a4u n ASN 228 Cb 0.16 -2.45 -0.11 0.00 1.23 0.00 0.00 39.78 38.61 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 -6.81 2.84 0.19 1.20 1.02 -1.26 -5.00 119.74 111.91 1a4u s LYS 229 Ca 0.34 -1.10 -0.32 0.00 0.02 0.00 0.00 55.97 54.92 1a4u s LYS 229 Cb -0.16 -3.80 -0.11 0.00 -0.52 0.00 0.00 37.83 33.24 1a4u s LYS 229 CO 0.93 -0.74 1.61 1.21 -0.92 0.00 0.00 175.35 177.44 1a4u s ASN 230 N 1.63 6.51 0.00 2.83 2.47 -1.26 -2.11 114.94 125.01 1a4u s ASN 230 Ca 0.03 2.71 0.00 0.00 0.42 0.00 0.00 52.86 56.02 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 0.07 -0.87 0.00 0.61 -3.72 0.00 0.00 177.10 173.19 1a4u n GLY 231 N 3.71 0.83 3.77 1.21 0.00 0.14 -4.96 105.19 109.88 1a4u n GLY 231 Ca 0.14 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.78 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 -3.23 3.17 -0.56 4.61 0.00 -0.90 -4.92 121.76 119.94 1a4u s ALA 232 Ca 0.00 0.96 0.02 0.00 0.00 0.00 0.00 51.96 52.93 1a4u s ALA 232 Cb 0.00 -3.37 0.14 0.00 0.00 0.00 0.00 23.12 19.89 1a4u s ALA 232 CO 0.00 -0.49 0.32 0.42 0.00 0.00 0.00 175.76 176.01 1a4u s ILE 233 N -1.41 2.99 -0.03 0.00 1.01 -1.26 -1.77 121.20 120.74 1a4u s ILE 233 Ca 0.56 -3.19 -0.29 0.00 0.00 0.00 0.00 60.65 57.73 1a4u s ILE 233 Cb -0.30 -3.03 -0.03 0.00 0.01 0.00 0.00 42.46 39.11 1a4u s ILE 233 CO 0.38 -0.83 0.95 0.26 0.00 0.00 0.00 174.94 175.71 1a4u s TRP 234 N -0.20 3.62 -0.26 3.97 0.52 -0.32 -1.63 118.94 124.64 1a4u s TRP 234 Ca 0.17 1.62 -0.06 0.00 0.02 0.00 0.00 56.10 57.86 1a4u s TRP 234 Cb -0.24 -3.09 -0.01 0.00 -1.15 0.00 0.00 33.47 28.99 1a4u s TRP 234 CO -0.01 -0.03 0.03 0.21 0.02 0.00 0.00 176.95 177.16 1a4u s LYS 235 N 1.15 3.32 -0.77 4.98 2.20 0.20 -0.18 119.74 130.65 1a4u s LYS 235 Ca 0.50 -0.69 -0.05 0.00 -0.36 0.00 0.00 55.97 55.37 1a4u s LYS 235 Cb -0.20 -3.23 0.20 0.00 -1.51 0.00 0.00 37.83 33.09 1a4u s LYS 235 CO 0.25 -0.29 0.63 -0.51 -0.36 0.00 0.00 175.35 175.07 1a4u s LEU 236 N 1.52 5.69 -0.02 5.43 1.43 -0.27 -1.70 118.68 130.75 1a4u s LEU 236 Ca 0.04 -3.10 0.04 0.00 -1.03 0.00 0.00 54.13 50.08 1a4u s LEU 236 Cb -0.16 -1.96 -0.01 0.00 0.03 0.00 0.00 46.19 44.10 1a4u s LEU 236 CO 0.01 -0.35 -0.14 -0.62 0.23 0.00 0.00 176.35 175.47 1a4u s ASP 237 N 0.78 1.67 -1.48 2.29 2.15 -1.10 -0.14 116.67 120.84 1a4u s ASP 237 Ca 0.21 -0.26 -0.10 0.00 0.43 0.00 0.00 52.55 52.83 1a4u s ASP 237 Cb -0.14 -0.28 0.06 0.00 -0.30 0.00 0.00 42.92 42.26 1a4u s ASP 237 CO -0.07 0.15 0.85 0.18 -0.17 0.00 0.00 175.17 176.11 1a4u n LEU 238 N 2.90 -2.58 0.00 -1.34 4.77 -1.26 -1.88 117.00 117.61 1a4u n LEU 238 Ca -0.16 -0.83 0.00 0.00 -0.03 0.00 0.00 56.01 54.99 1a4u n LEU 238 Cb 0.55 -2.51 0.00 0.00 -2.33 0.00 0.00 43.42 39.13 1a4u n LEU 238 CO 0.25 0.44 0.00 0.61 -1.33 0.00 0.00 177.39 177.35 1a4u n GLY 239 N -1.67 0.54 3.70 -0.72 0.00 -1.26 -4.97 105.19 100.81 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 -2.52 3.07 -0.18 2.61 -4.23 -0.79 -4.97 115.64 108.63 1a4u s THR 240 Ca 0.00 -1.78 0.01 0.00 -1.18 0.00 0.00 61.69 58.74 1a4u s THR 240 Cb 0.00 -2.93 0.02 0.00 1.34 0.00 0.00 72.50 70.94 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 -3.79 2.16 -0.02 4.79 2.96 -1.26 -2.71 118.68 120.81 1a4u s LEU 241 Ca 0.36 -0.68 -0.03 0.00 -0.22 0.00 0.00 54.13 53.55 1a4u s LEU 241 Cb -0.03 -1.44 0.00 0.00 0.50 0.00 0.00 46.19 45.23 1a4u s LEU 241 CO 0.22 -0.02 0.08 -0.70 -1.32 0.00 0.00 176.35 174.60 1a4u s GLU 242 N 1.31 0.17 -0.26 1.98 2.12 -0.69 -4.98 118.70 118.35 1a4u s GLU 242 Ca 0.04 -0.02 -0.13 0.00 0.36 0.00 0.00 54.97 55.23 1a4u s GLU 242 Cb -0.13 0.07 -0.04 0.00 0.26 0.00 0.00 34.13 34.29 1a4u s GLU 242 CO -0.12 -0.03 0.27 0.00 -0.54 0.00 0.00 175.26 174.84 1a4u s ALA 243 N -0.28 3.56 0.23 6.30 0.00 -1.26 0.61 121.76 130.92 1a4u s ALA 243 Ca -0.03 -0.88 -0.04 0.00 0.00 0.00 0.00 51.96 51.00 1a4u s ALA 243 Cb -0.02 -2.53 -0.05 0.00 0.00 0.00 0.00 23.12 20.51 1a4u s ALA 243 CO 0.00 -0.46 0.47 0.96 0.00 0.00 0.00 175.76 176.73 1a4u s ILE 244 N 1.62 5.10 -0.25 0.00 -4.36 -0.64 -4.99 121.20 117.68 1a4u s ILE 244 Ca 0.11 -0.04 -0.13 0.00 -0.26 0.00 0.00 60.65 60.33 1a4u s ILE 244 Cb -0.15 -3.70 -0.04 0.00 1.25 0.00 0.00 42.46 39.82 1a4u s ILE 244 CO 0.09 -0.18 0.30 -0.70 0.24 0.00 0.00 174.94 174.69 1a4u s GLU 245 N -3.23 4.05 0.05 0.37 2.12 -1.26 -4.48 118.70 116.32 1a4u s GLU 245 Ca 0.42 -0.06 -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 30.62 1a4u s GLU 245 CO 0.28 -0.13 1.19 -0.46 -0.54 0.00 0.00 175.26 175.60 1a4u s TRP 246 N 1.62 3.41 0.24 5.30 -0.11 -1.26 -4.98 118.94 123.16 1a4u s TRP 246 Ca 0.13 1.30 -0.30 0.00 1.22 0.00 0.00 56.10 58.45 1a4u s TRP 246 Cb -0.15 -3.41 -0.10 0.00 -1.50 0.00 0.00 33.47 28.31 1a4u s TRP 246 CO 0.08 -1.24 1.37 0.99 -4.62 0.00 0.00 176.95 173.53 1a4u s THR 247 N 1.20 2.88 -0.87 5.86 2.01 -1.26 -4.96 115.64 120.51 1a4u s THR 247 Ca 0.58 0.75 -0.16 0.00 0.31 0.00 0.00 61.69 63.17 1a4u s THR 247 Cb -0.29 -3.48 0.18 0.00 0.01 0.00 0.00 72.50 68.92 1a4u s THR 247 CO 0.28 0.13 0.93 -0.54 -0.69 0.00 0.00 174.62 174.73 1a4u s LYS 248 N -0.47 3.59 0.05 4.92 -0.14 -1.26 -4.82 119.74 121.61 1a4u s LYS 248 Ca 0.57 -2.11 0.08 0.00 -1.36 0.00 0.00 55.97 53.15 1a4u s LYS 248 Cb -0.39 -4.65 -0.23 0.00 -1.68 0.00 0.00 37.83 30.88 1a4u s LYS 248 CO 0.43 -1.52 1.01 0.45 -0.76 0.00 0.00 175.35 174.96 1a4u h HIS 249 N 8.30 0.05 -3.22 3.18 3.86 -2.05 -3.47 115.15 121.80 1a4u h HIS 249 Ca 0.12 -0.04 -0.13 0.00 -1.16 0.00 0.00 60.37 59.16 1a4u h HIS 249 Cb 1.03 -0.00 -0.21 0.00 1.06 0.00 0.00 27.41 29.30 1a4u h HIS 249 CO 1.09 1.04 -0.37 -0.46 0.86 0.00 0.00 177.93 180.10 1a4u s TRP 250 N -2.66 -0.10 -0.12 2.45 -0.00 -1.26 -5.15 118.94 112.10 1a4u s TRP 250 Ca -0.02 0.14 0.01 0.00 -0.00 0.00 0.00 56.10 56.23 1a4u s TRP 250 Cb 0.09 0.04 0.02 0.00 -0.00 0.00 0.00 33.47 33.62 1a4u s TRP 250 CO 0.83 -0.33 -0.12 0.34 -0.00 0.00 0.00 176.95 177.66 1a4u s ASP 251 N -1.25 2.35 0.49 5.86 -1.08 -1.26 -5.00 116.67 116.78 1a4u s ASP 251 Ca -0.13 -0.39 0.31 0.00 -0.52 0.00 0.00 52.55 51.82 1a4u s ASP 251 Cb -0.06 -1.01 1.19 0.00 -1.46 0.00 0.00 42.92 41.59 1a4u s ASP 251 CO 0.03 -0.05 1.90 0.77 0.52 0.00 0.00 175.17 178.34 1a4u h SER 252 N 7.79 0.00 0.00 -0.34 4.64 -2.05 -3.46 113.55 120.14 1a4u h SER 252 Ca -0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.99 1a4u h SER 252 Cb 1.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 1a4u h SER 252 CO 0.47 0.00 0.00 1.41 -0.87 0.00 0.00 176.83 177.84 1a4u n HIS 253 N -2.95 0.00 -0.27 4.77 8.25 -1.26 -5.36 115.22 118.39 1a4u n HIS 253 Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.47 1a4u n HIS 253 Cb 0.32 -0.53 0.00 0.00 1.12 0.00 0.00 29.99 30.90 1a4u n HIS 253 CO 0.00 0.00 0.00 0.44 0.64 0.00 0.00 176.34 177.42