#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uk8 n LEU 4 N 0.00 0.21 0.17 1.20 4.77 -1.26 -1.70 117.00 120.39 1uk8 n LEU 4 Ca 0.00 0.57 0.13 0.00 -0.03 0.00 0.00 56.01 56.68 1uk8 n LEU 4 Cb 0.00 -0.56 0.41 0.00 -2.33 0.00 0.00 43.42 40.94 1uk8 n LEU 4 CO 0.00 -0.48 0.88 -0.33 -1.33 0.00 0.00 177.39 176.13 1uk8 h GLU 5 N 0.00 0.00 -5.55 3.23 5.08 -2.02 -3.42 114.58 111.90 1uk8 h GLU 5 Ca 0.00 0.00 -0.59 0.00 -1.00 0.00 0.00 59.36 57.77 1uk8 h GLU 5 Cb 0.17 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 29.32 1uk8 h GLU 5 CO 0.00 0.00 -0.17 0.42 -1.00 0.00 0.00 179.01 178.26 1uk8 s ILE 6 N -3.28 5.19 0.00 3.13 1.01 -0.69 -4.69 121.20 121.88 1uk8 s ILE 6 Ca 0.07 0.80 0.00 0.00 0.00 0.00 0.00 60.65 61.52 1uk8 s ILE 6 Cb 0.09 -3.76 0.00 0.00 0.01 0.00 0.00 42.46 38.80 1uk8 s ILE 6 CO 0.56 0.28 0.00 0.61 0.00 0.00 0.00 174.94 176.39 1uk8 n GLY 7 N 3.65 1.91 3.98 6.18 0.00 -1.26 -4.95 105.19 114.69 1uk8 n GLY 7 Ca -0.08 -0.04 -0.21 0.00 0.00 0.00 0.00 46.02 45.70 1uk8 n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1uk8 s LYS 8 N 2.83 2.99 -0.01 1.61 1.02 0.70 -4.86 119.74 124.02 1uk8 s LYS 8 Ca 0.00 -0.80 0.05 0.00 0.02 0.00 0.00 55.97 55.25 1uk8 s LYS 8 Cb 0.00 -2.67 -0.01 0.00 -0.52 0.00 0.00 37.83 34.63 1uk8 s LYS 8 CO 0.00 -0.20 -0.17 0.45 -0.92 0.00 0.00 175.35 174.51 1uk8 s SER 9 N -4.24 2.01 -0.09 2.83 0.15 -1.26 -1.03 113.70 112.06 1uk8 s SER 9 Ca 0.49 -0.31 -0.22 0.00 0.70 0.00 0.00 55.95 56.60 1uk8 s SER 9 Cb -0.10 -0.22 0.05 0.00 -1.71 0.00 0.00 66.02 64.04 1uk8 s SER 9 CO 0.35 0.21 0.53 -0.51 1.20 0.00 0.00 173.24 175.02 1uk8 s ILE 10 N -0.41 0.02 -0.19 6.45 2.07 -0.61 -4.96 121.20 123.57 1uk8 s ILE 10 Ca 0.07 -0.14 -0.27 0.00 -1.41 0.00 0.00 60.65 58.90 1uk8 s ILE 10 Cb -0.07 -0.81 -0.00 0.00 0.13 0.00 0.00 42.46 41.71 1uk8 s ILE 10 CO -0.01 -0.08 0.93 -0.22 -1.91 0.00 0.00 174.94 173.65 1uk8 s LEU 11 N -0.72 4.15 -0.05 8.50 2.96 -1.26 -0.03 118.68 132.22 1uk8 s LEU 11 Ca -0.08 1.27 -0.01 0.00 -0.22 0.00 0.00 54.13 55.10 1uk8 s LEU 11 Cb -0.03 -3.38 0.03 0.00 0.50 0.00 0.00 46.19 43.31 1uk8 s LEU 11 CO 0.05 -0.51 -0.00 0.00 -1.32 0.00 0.00 176.35 174.57 1uk8 s ALA 12 N 2.58 0.56 -1.41 5.97 0.00 -0.23 -4.79 121.76 124.44 1uk8 s ALA 12 Ca 0.41 -0.01 -0.06 0.00 0.00 0.00 0.00 51.96 52.30 1uk8 s ALA 12 Cb -0.16 -0.58 0.04 0.00 0.00 0.00 0.00 23.12 22.42 1uk8 s ALA 12 CO 0.10 -0.30 0.50 0.00 0.00 0.00 0.00 175.76 176.07 1uk8 n ALA 13 N 4.74 -1.00 -0.97 0.00 0.00 -1.26 -0.86 120.51 121.17 1uk8 n ALA 13 Ca -0.14 0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.48 1uk8 n ALA 13 Cb 0.50 -3.20 0.00 0.00 0.00 0.00 0.00 19.45 16.75 1uk8 n ALA 13 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1uk8 n GLY 14 N -1.31 0.60 3.29 0.00 0.00 -1.26 -5.00 105.19 101.51 1uk8 n GLY 14 Ca -0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.62 1uk8 n GLY 14 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1uk8 s VAL 15 N -2.53 2.52 -0.11 1.61 1.01 -0.04 -5.07 120.40 117.78 1uk8 s VAL 15 Ca 0.00 -0.86 -0.29 0.00 0.00 0.00 0.00 61.98 60.83 1uk8 s VAL 15 Cb 0.00 -2.01 -0.04 0.00 0.00 0.00 0.00 36.38 34.33 1uk8 s VAL 15 CO 0.00 0.55 1.63 -0.22 0.00 0.00 0.00 175.10 177.05 1uk8 s LEU 16 N 0.30 4.17 -0.11 3.92 2.96 -1.26 -1.06 118.68 127.60 1uk8 s LEU 16 Ca -0.14 2.02 0.01 0.00 -0.22 0.00 0.00 54.13 55.79 1uk8 s LEU 16 Cb -0.17 -3.53 -0.02 0.00 0.50 0.00 0.00 46.19 42.97 1uk8 s LEU 16 CO 0.07 -1.03 -0.13 -0.89 -1.32 0.00 0.00 176.35 173.06 1uk8 s THR 17 N 4.43 3.13 -0.03 3.68 2.01 0.95 -1.07 115.64 128.74 1uk8 s THR 17 Ca 0.72 -0.65 -0.20 0.00 0.31 0.00 0.00 61.69 61.87 1uk8 s THR 17 Cb -0.30 -2.30 -0.05 0.00 0.01 0.00 0.00 72.50 69.86 1uk8 s THR 17 CO 0.28 0.54 0.58 0.21 -0.69 0.00 0.00 174.62 175.54 1uk8 s ASN 18 N 0.04 6.93 0.21 3.53 2.47 -1.26 -1.57 114.94 125.29 1uk8 s ASN 18 Ca -0.04 1.10 -0.20 0.00 0.42 0.00 0.00 52.86 54.14 1uk8 s ASN 18 Cb -0.14 -2.35 0.04 0.00 -1.45 0.00 0.00 41.25 37.34 1uk8 s ASN 18 CO 0.04 0.08 0.60 -0.72 -3.72 0.00 0.00 177.10 173.38 1uk8 s TYR 19 N -0.02 -0.24 0.04 0.43 1.13 -0.20 -0.82 117.35 117.67 1uk8 s TYR 19 Ca 0.31 -0.10 0.08 0.00 -1.41 0.00 0.00 57.07 55.94 1uk8 s TYR 19 Cb -0.18 0.52 -0.03 0.00 -1.10 0.00 0.00 41.96 41.18 1uk8 s TYR 19 CO 0.16 -0.99 -0.22 -1.01 -2.51 0.00 0.00 175.55 170.98 1uk8 s HIS 20 N -3.86 2.46 -0.23 -3.49 3.76 -0.18 -0.21 115.29 113.54 1uk8 s HIS 20 Ca 0.08 -0.33 -0.03 0.00 -0.15 0.00 0.00 55.06 54.63 1uk8 s HIS 20 Cb -0.02 -1.44 0.10 0.00 1.11 0.00 0.00 32.58 32.32 1uk8 s HIS 20 CO -0.02 0.18 0.20 0.34 -0.85 0.00 0.00 174.74 174.59 1uk8 s ASP 21 N -1.29 1.94 -0.01 1.40 -1.08 -1.25 -0.92 116.67 115.45 1uk8 s ASP 21 Ca 0.13 -0.56 0.01 0.00 -0.52 0.00 0.00 52.55 51.61 1uk8 s ASP 21 Cb -0.10 0.19 0.00 0.00 -1.46 0.00 0.00 42.92 41.55 1uk8 s ASP 21 CO 0.03 -0.36 -0.05 -0.69 0.52 0.00 0.00 175.17 174.62 1uk8 s VAL 22 N 2.27 0.44 0.00 1.11 1.01 -0.42 -4.98 120.40 119.83 1uk8 s VAL 22 Ca 0.07 -0.19 0.00 0.00 0.00 0.00 0.00 61.98 61.86 1uk8 s VAL 22 Cb -0.15 -0.41 0.00 0.00 0.00 0.00 0.00 36.38 35.82 1uk8 s VAL 22 CO -0.20 0.15 0.00 0.61 0.00 0.00 0.00 175.10 175.66 1uk8 n GLY 23 N 3.28 1.00 3.14 4.51 0.00 -1.26 0.02 105.19 115.88 1uk8 n GLY 23 Ca -0.17 -2.05 -0.11 0.00 0.00 0.00 0.00 46.02 43.69 1uk8 n GLY 23 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1uk8 s GLU 24 N -1.61 0.76 0.00 1.61 2.02 -1.19 -4.49 118.70 115.80 1uk8 s GLU 24 Ca 0.00 -1.19 0.00 0.00 0.02 0.00 0.00 54.97 53.80 1uk8 s GLU 24 Cb 0.00 -0.24 0.00 0.00 0.10 0.00 0.00 34.13 33.99 1uk8 s GLU 24 CO 0.00 0.00 0.00 0.41 0.02 0.00 0.00 175.26 175.69 1uk8 n GLY 25 N 0.35 0.36 3.69 -1.39 0.00 -1.26 -3.11 105.19 103.82 1uk8 n GLY 25 Ca -0.15 -1.81 -0.44 0.00 0.00 0.00 0.00 46.02 43.62 1uk8 n GLY 25 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1uk8 n GLN 26 N 0.00 2.54 -2.51 1.61 -0.06 -1.26 -4.22 117.38 113.47 1uk8 n GLN 26 Ca 0.00 0.92 -0.39 0.00 -2.00 0.00 0.00 57.00 55.53 1uk8 n GLN 26 Cb 0.00 -2.77 -0.04 0.00 -4.06 0.00 0.00 30.24 23.37 1uk8 n GLN 26 CO 0.00 0.00 0.00 -1.25 -0.20 0.00 0.00 177.06 175.61 1uk8 s PRO 27 N 2.25 4.50 -0.07 3.69 0.04 -1.26 -1.28 135.00 142.87 1uk8 s PRO 27 Ca 0.82 1.70 -0.00 0.00 0.04 0.00 0.00 61.00 63.56 1uk8 s PRO 27 Cb -0.57 -3.00 0.02 0.00 0.04 0.00 0.00 34.50 31.00 1uk8 s PRO 27 CO 0.39 0.12 -0.03 0.08 0.04 0.00 0.00 177.00 177.60 1uk8 s VAL 28 N -1.31 0.55 -0.22 -0.36 1.01 0.30 -1.91 120.40 118.45 1uk8 s VAL 28 Ca 0.48 -0.05 -0.09 0.00 0.00 0.00 0.00 61.98 62.33 1uk8 s VAL 28 Cb -0.29 -0.62 -0.04 0.00 0.00 0.00 0.00 36.38 35.43 1uk8 s VAL 28 CO 0.36 0.26 0.11 -0.63 0.00 0.00 0.00 175.10 175.21 1uk8 s ILE 29 N 1.47 4.98 -0.22 2.22 -1.09 -0.00 -0.61 121.20 127.94 1uk8 s ILE 29 Ca -0.02 0.04 -0.08 0.00 -2.23 0.00 0.00 60.65 58.36 1uk8 s ILE 29 Cb -0.13 -3.30 -0.04 0.00 -1.58 0.00 0.00 42.46 37.41 1uk8 s ILE 29 CO -0.03 0.39 0.09 -0.76 -1.23 0.00 0.00 174.94 173.39 1uk8 s LEU 30 N 0.90 3.74 -0.24 2.97 1.43 0.35 -0.64 118.68 127.18 1uk8 s LEU 30 Ca 0.06 -0.02 -0.02 0.00 -1.03 0.00 0.00 54.13 53.11 1uk8 s LEU 30 Cb -0.13 -1.98 0.02 0.00 0.03 0.00 0.00 46.19 44.13 1uk8 s LEU 30 CO 0.03 0.07 -0.06 -0.63 0.23 0.00 0.00 176.35 175.99 1uk8 s ILE 31 N 1.01 2.95 1.11 -0.59 -1.09 0.44 -3.99 121.20 121.05 1uk8 s ILE 31 Ca 0.05 -0.93 -0.14 0.00 -2.23 0.00 0.00 60.65 57.39 1uk8 s ILE 31 Cb -0.14 -2.47 0.25 0.00 -1.58 0.00 0.00 42.46 38.52 1uk8 s ILE 31 CO 0.03 0.24 1.07 -1.38 -1.23 0.00 0.00 174.94 173.67 1uk8 s HIS 32 N 1.35 1.45 0.00 3.97 -3.43 -1.26 -0.96 115.29 116.42 1uk8 s HIS 32 Ca 0.01 0.90 0.00 0.00 -0.80 0.00 0.00 55.06 55.17 1uk8 s HIS 32 Cb -0.16 -3.24 0.00 0.00 -1.43 0.00 0.00 32.58 27.75 1uk8 s HIS 32 CO -0.04 -3.49 0.00 0.41 -2.00 0.00 0.00 174.74 169.62 1uk8 n GLY 33 N -0.44 -0.24 1.96 -1.38 0.00 -1.19 -2.49 105.19 101.41 1uk8 n GLY 33 Ca 0.06 -1.78 -0.20 0.00 0.00 0.00 0.00 46.02 44.11 1uk8 n GLY 33 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1uk8 n SER 34 N -2.15 4.40 -4.92 1.61 3.41 -1.26 -4.81 113.62 109.90 1uk8 n SER 34 Ca 0.00 -3.63 -0.26 0.00 -0.26 0.00 0.00 58.87 54.72 1uk8 n SER 34 Cb 0.00 -0.37 0.05 0.00 -0.26 0.00 0.00 64.21 63.63 1uk8 n SER 34 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1uk8 s GLY 35 N -3.57 1.65 0.16 5.00 0.00 -1.26 -4.88 107.32 104.42 1uk8 s GLY 35 Ca 0.48 -0.82 -0.31 0.00 0.00 0.00 0.00 44.72 44.07 1uk8 s GLY 35 CO 0.02 -0.48 1.44 2.56 0.00 0.00 0.00 173.10 176.64 1uk8 s PRO 36 N -5.10 4.29 0.00 2.90 0.04 -1.26 -2.36 135.00 133.51 1uk8 s PRO 36 Ca 0.57 2.19 0.00 0.00 0.04 0.00 0.00 61.00 63.80 1uk8 s PRO 36 Cb -0.11 -3.19 0.00 0.00 0.04 0.00 0.00 34.50 31.24 1uk8 s PRO 36 CO 0.45 -0.46 0.00 0.41 0.04 0.00 0.00 177.00 177.44 1uk8 n GLY 37 N 3.23 0.78 3.74 0.56 0.00 -1.26 -4.71 105.19 107.53 1uk8 n GLY 37 Ca 0.11 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.77 1uk8 n GLY 37 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1uk8 s VAL 38 N -3.10 2.37 0.16 1.61 0.11 -1.00 -4.75 120.40 115.80 1uk8 s VAL 38 Ca 0.00 0.22 -0.16 0.00 -2.93 0.00 0.00 61.98 59.11 1uk8 s VAL 38 Cb 0.00 -3.03 0.03 0.00 -1.53 0.00 0.00 36.38 31.85 1uk8 s VAL 38 CO 0.00 -0.06 0.44 -0.94 -3.33 0.00 0.00 175.10 171.21 1uk8 s SER 39 N -1.61 -0.21 0.20 3.54 1.04 -1.26 -2.60 113.70 112.81 1uk8 s SER 39 Ca 0.79 -0.46 -0.11 0.00 0.48 0.00 0.00 55.95 56.65 1uk8 s SER 39 Cb -0.33 0.51 0.14 0.00 0.10 0.00 0.00 66.02 66.45 1uk8 s SER 39 CO 0.38 -0.94 1.87 0.00 0.98 0.00 0.00 173.24 175.52 1uk8 h ALA 40 N 2.32 0.92 -0.32 5.32 0.00 -1.88 -2.30 119.26 123.32 1uk8 h ALA 40 Ca -0.31 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.52 1uk8 h ALA 40 Cb 1.25 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 1uk8 h ALA 40 CO 0.43 0.35 0.11 -0.92 0.00 0.00 0.00 179.25 179.21 1uk8 h TYR 41 N 0.98 0.50 -0.97 0.00 3.20 -1.88 0.38 116.97 119.18 1uk8 h TYR 41 Ca 0.26 -0.05 0.09 0.00 3.14 0.00 0.00 58.73 62.18 1uk8 h TYR 41 Cb -0.10 -0.15 -0.07 0.00 1.54 0.00 0.00 36.73 37.95 1uk8 h TYR 41 CO -0.02 0.49 0.63 0.00 -1.64 0.00 0.00 178.16 177.62 1uk8 h ALA 42 N 0.95 1.50 0.08 1.82 0.00 -1.88 0.11 119.26 121.83 1uk8 h ALA 42 Ca 0.10 -0.01 -0.22 0.00 0.00 0.00 0.00 54.91 54.78 1uk8 h ALA 42 Cb 0.22 -0.26 0.02 0.00 0.00 0.00 0.00 17.79 17.78 1uk8 h ALA 42 CO -0.01 0.32 -0.93 -0.91 0.00 0.00 0.00 179.25 177.73 1uk8 h ASN 43 N 1.05 0.67 -0.46 0.00 -0.26 -1.21 -3.39 115.58 111.99 1uk8 h ASN 43 Ca 0.44 -0.83 0.00 0.00 -0.56 0.00 0.00 56.30 55.36 1uk8 h ASN 43 Cb 0.31 -0.21 0.00 0.00 -1.06 0.00 0.00 38.32 37.36 1uk8 h ASN 43 CO -0.20 1.43 0.00 0.79 -1.06 0.00 0.00 177.43 178.39 1uk8 n TRP 44 N -4.01 0.66 -0.05 1.19 7.02 0.11 -4.69 117.44 117.66 1uk8 n TRP 44 Ca -0.13 -0.52 0.22 0.00 -1.02 0.00 0.00 57.50 56.05 1uk8 n TRP 44 Cb 0.84 -0.04 0.68 0.00 -2.42 0.00 0.00 31.31 30.38 1uk8 n TRP 44 CO 0.00 0.00 0.00 0.07 -2.02 0.00 0.00 177.69 175.74 1uk8 h ARG 45 N 2.71 0.03 -0.02 -0.99 0.11 -0.98 -0.17 114.38 115.06 1uk8 h ARG 45 Ca 0.00 -0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1uk8 h ARG 45 Cb 0.85 -0.01 0.00 0.00 1.11 0.00 0.00 29.97 31.93 1uk8 h ARG 45 CO 0.02 0.02 -0.29 1.28 0.10 0.00 0.00 179.97 181.09 1uk8 n LEU 46 N -4.36 2.40 -0.11 0.08 4.77 -1.26 -4.44 117.00 114.08 1uk8 n LEU 46 Ca 0.12 -0.85 -0.23 0.00 -0.03 0.00 0.00 56.01 55.02 1uk8 n LEU 46 Cb 0.68 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.65 1uk8 n LEU 46 CO 0.37 0.42 -1.24 0.41 -1.33 0.00 0.00 177.39 176.02 1uk8 n THR 47 N 0.51 1.55 -0.11 -5.08 -1.04 -0.19 -4.48 114.28 105.44 1uk8 n THR 47 Ca 0.11 -0.48 -0.05 0.00 -2.04 0.00 0.00 64.05 61.59 1uk8 n THR 47 Cb 0.52 -1.66 0.01 0.00 -1.82 0.00 0.00 70.33 67.38 1uk8 n THR 47 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 1uk8 h ILE 48 N -0.40 0.70 -0.90 12.58 2.04 -1.45 -1.86 117.51 128.21 1uk8 h ILE 48 Ca -0.58 -0.02 0.10 0.00 1.00 0.00 0.00 64.86 65.36 1uk8 h ILE 48 Cb 1.78 0.63 -0.08 0.00 -0.74 0.00 0.00 36.82 38.41 1uk8 h ILE 48 CO -0.19 0.01 0.54 -0.65 0.00 0.00 0.00 178.15 177.86 1uk8 h PRO 49 N 0.07 0.87 -0.01 2.37 0.11 -1.81 0.19 132.00 133.79 1uk8 h PRO 49 Ca 0.18 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.23 1uk8 h PRO 49 Cb 0.25 -0.20 -0.00 0.00 0.11 0.00 0.00 31.00 31.17 1uk8 h PRO 49 CO -0.32 0.57 -0.02 0.00 -0.21 0.00 0.00 178.00 178.03 1uk8 h ALA 50 N 1.48 0.02 -0.15 -0.75 0.00 -1.70 -3.33 119.26 114.83 1uk8 h ALA 50 Ca 0.43 -0.28 -0.15 0.00 0.00 0.00 0.00 54.91 54.92 1uk8 h ALA 50 Cb 0.38 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1uk8 h ALA 50 CO -0.24 -0.20 -0.53 -0.07 0.00 0.00 0.00 179.25 178.21 1uk8 h LEU 51 N -0.49 0.48 0.00 0.00 4.07 -1.17 -3.12 115.31 115.08 1uk8 h LEU 51 Ca 0.00 -0.25 0.00 0.00 0.08 0.00 0.00 57.88 57.71 1uk8 h LEU 51 Cb 0.56 -0.14 0.00 0.00 1.08 0.00 0.00 40.66 42.16 1uk8 h LEU 51 CO 0.00 0.92 0.00 -1.54 -1.08 0.00 0.00 178.44 176.74 1uk8 n SER 52 N -3.95 0.00 0.19 -0.43 3.41 0.65 -0.89 113.62 112.60 1uk8 n SER 52 Ca -0.03 0.34 0.13 0.00 -0.26 0.00 0.00 58.87 59.06 1uk8 n SER 52 Cb 0.58 -0.40 0.33 0.00 -0.26 0.00 0.00 64.21 64.46 1uk8 n SER 52 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1uk8 h LYS 53 N 0.00 0.00 0.00 4.33 1.79 -1.65 -3.36 116.57 117.68 1uk8 h LYS 53 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1uk8 h LYS 53 Cb 0.10 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.75 1uk8 h LYS 53 CO 0.00 0.00 0.00 1.19 -1.08 0.00 0.00 179.45 179.56 1uk8 n PHE 54 N -2.81 0.00 -4.12 -1.35 3.72 -0.49 -5.00 117.46 107.40 1uk8 n PHE 54 Ca 0.04 0.00 -0.10 0.00 -0.05 0.00 0.00 57.45 57.34 1uk8 n PHE 54 Cb 0.45 0.00 -0.10 0.00 -0.94 0.00 0.00 39.48 38.89 1uk8 n PHE 54 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 176.76 177.42 1uk8 s TYR 55 N -0.41 0.81 -0.37 1.38 2.02 -0.07 -4.61 117.35 116.11 1uk8 s TYR 55 Ca 0.00 -1.17 -0.19 0.00 -0.37 0.00 0.00 57.07 55.34 1uk8 s TYR 55 Cb 0.00 -0.42 0.00 0.00 -0.40 0.00 0.00 41.96 41.14 1uk8 s TYR 55 CO 0.00 -0.55 0.54 0.50 -1.57 0.00 0.00 175.55 174.47 1uk8 s ARG 56 N -4.04 3.53 -0.25 -0.62 3.52 -0.41 -3.19 118.95 117.50 1uk8 s ARG 56 Ca 0.24 -0.22 -0.10 0.00 -0.13 0.00 0.00 55.73 55.52 1uk8 s ARG 56 Cb 0.07 -3.84 -0.04 0.00 -1.56 0.00 0.00 34.95 29.57 1uk8 s ARG 56 CO 0.02 -0.73 0.14 0.08 -0.81 0.00 0.00 175.30 174.00 1uk8 s VAL 57 N 2.47 5.02 -0.19 7.11 1.01 0.10 -0.54 120.40 135.38 1uk8 s VAL 57 Ca 0.19 0.07 -0.02 0.00 0.00 0.00 0.00 61.98 62.22 1uk8 s VAL 57 Cb -0.15 -3.35 -0.00 0.00 0.00 0.00 0.00 36.38 32.88 1uk8 s VAL 57 CO 0.14 0.33 -0.11 -0.63 0.00 0.00 0.00 175.10 174.83 1uk8 s ILE 58 N 1.34 2.89 -0.34 2.22 1.01 0.22 -1.30 121.20 127.24 1uk8 s ILE 58 Ca 0.06 -0.67 0.01 0.00 0.00 0.00 0.00 60.65 60.06 1uk8 s ILE 58 Cb -0.15 -2.27 0.10 0.00 0.01 0.00 0.00 42.46 40.16 1uk8 s ILE 58 CO 0.06 0.48 0.10 0.00 0.00 0.00 0.00 174.94 175.58 1uk8 s ALA 59 N 1.23 1.97 0.24 9.38 0.00 -0.10 -0.50 121.76 133.99 1uk8 s ALA 59 Ca 0.03 -2.01 0.00 0.00 0.00 0.00 0.00 51.96 49.97 1uk8 s ALA 59 Cb -0.14 -1.75 -0.04 0.00 0.00 0.00 0.00 23.12 21.19 1uk8 s ALA 59 CO -0.05 -1.72 0.43 -1.25 0.00 0.00 0.00 175.76 173.17 1uk8 s PRO 60 N 1.27 3.51 -0.26 0.00 0.04 -1.26 -1.01 135.00 137.29 1uk8 s PRO 60 Ca 0.11 -0.38 -0.21 0.00 0.04 0.00 0.00 61.00 60.56 1uk8 s PRO 60 Cb -0.19 -2.80 -0.02 0.00 0.04 0.00 0.00 34.50 31.54 1uk8 s PRO 60 CO -0.18 0.34 0.64 -0.51 0.04 0.00 0.00 177.00 177.34 1uk8 s ASP 61 N -3.47 6.58 0.45 6.66 1.01 0.00 -4.49 116.67 123.42 1uk8 s ASP 61 Ca 0.38 0.69 -0.24 0.00 0.71 0.00 0.00 52.55 54.10 1uk8 s ASP 61 Cb -0.10 -2.34 -0.07 0.00 1.01 0.00 0.00 42.92 41.41 1uk8 s ASP 61 CO 0.31 -0.39 1.27 -0.04 0.21 0.00 0.00 175.17 176.52 1uk8 s MET 62 N 2.54 3.72 0.11 8.23 -1.94 -1.26 -4.59 119.30 126.10 1uk8 s MET 62 Ca 0.27 2.05 -0.35 0.00 -1.71 0.00 0.00 55.69 55.94 1uk8 s MET 62 Cb -0.15 -2.53 -0.15 0.00 2.01 0.00 0.00 34.83 34.01 1uk8 s MET 62 CO 0.09 -0.67 1.52 1.55 -0.01 0.00 0.00 175.02 177.51 1uk8 n VAL 63 N -0.33 0.05 0.00 -6.03 3.14 -1.26 -0.61 118.33 113.29 1uk8 n VAL 63 Ca 0.06 -0.01 0.00 0.00 -2.96 0.00 0.00 64.34 61.43 1uk8 n VAL 63 Cb 0.45 -1.31 0.00 0.00 -1.06 0.00 0.00 33.84 31.92 1uk8 n VAL 63 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1uk8 n GLY 64 N 3.21 0.15 3.33 7.55 0.00 -1.26 -5.06 105.19 113.11 1uk8 n GLY 64 Ca 0.18 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.03 1uk8 n GLY 64 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1uk8 s PHE 65 N -2.00 1.59 0.00 1.61 0.08 0.22 -4.75 117.98 114.73 1uk8 s PHE 65 Ca 0.00 -0.73 0.00 0.00 0.12 0.00 0.00 56.93 56.32 1uk8 s PHE 65 Cb 0.00 -0.83 0.00 0.00 -0.57 0.00 0.00 43.02 41.62 1uk8 s PHE 65 CO 0.00 0.17 0.00 0.41 -0.10 0.00 0.00 175.22 175.70 1uk8 n GLY 66 N -0.37 2.53 1.40 4.36 0.00 -1.07 -3.12 105.19 108.91 1uk8 n GLY 66 Ca -0.08 -0.26 0.09 0.00 0.00 0.00 0.00 46.02 45.78 1uk8 n GLY 66 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1uk8 n PHE 67 N 14.00 1.25 -2.46 1.61 3.72 -1.26 -4.95 117.46 129.38 1uk8 n PHE 67 Ca 0.00 -0.60 -0.33 0.00 -0.05 0.00 0.00 57.45 56.47 1uk8 n PHE 67 Cb 0.00 -0.18 -0.03 0.00 -0.94 0.00 0.00 39.48 38.32 1uk8 n PHE 67 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 1uk8 s THR 68 N -1.68 4.23 0.49 4.37 2.01 -1.18 -4.45 115.64 119.43 1uk8 s THR 68 Ca 0.47 1.20 -0.24 0.00 0.31 0.00 0.00 61.69 63.43 1uk8 s THR 68 Cb 0.30 -3.58 -0.07 0.00 0.01 0.00 0.00 72.50 69.16 1uk8 s THR 68 CO 0.24 -0.49 1.39 0.47 -0.69 0.00 0.00 174.62 175.54 1uk8 n ASP 69 N -1.34 3.01 -4.07 3.53 9.92 -0.23 -4.68 116.55 122.69 1uk8 n ASP 69 Ca 0.08 1.06 -0.35 0.00 -0.53 0.00 0.00 54.79 55.04 1uk8 n ASP 69 Cb 0.54 -1.59 -0.09 0.00 -0.64 0.00 0.00 41.12 39.34 1uk8 n ASP 69 CO 0.00 0.00 0.00 -0.13 0.13 0.00 0.00 177.20 177.20 1uk8 s ARG 70 N -2.62 2.83 0.24 -1.24 0.52 -1.26 -4.19 118.95 113.22 1uk8 s ARG 70 Ca 0.66 -2.94 -0.30 0.00 -0.52 0.00 0.00 55.73 52.62 1uk8 s ARG 70 Cb -0.44 -3.77 -0.14 0.00 0.52 0.00 0.00 34.95 31.11 1uk8 s ARG 70 CO 0.54 -1.22 1.15 -2.30 0.02 0.00 0.00 175.30 173.49 1uk8 n PRO 71 N 2.82 1.44 -1.89 3.54 -0.02 -1.26 -4.89 135.00 134.74 1uk8 n PRO 71 Ca 0.15 0.51 -0.42 0.00 -2.02 0.00 0.00 63.50 61.72 1uk8 n PRO 71 Cb 0.37 -1.99 -0.03 0.00 -0.02 0.00 0.00 33.50 31.83 1uk8 n PRO 71 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1uk8 s GLU 72 N -0.93 4.20 -1.73 -0.52 2.12 -1.26 -2.07 118.70 118.52 1uk8 s GLU 72 Ca 0.66 2.42 0.00 0.00 0.36 0.00 0.00 54.97 58.40 1uk8 s GLU 72 Cb -0.74 -3.13 0.00 0.00 0.26 0.00 0.00 34.13 30.52 1uk8 s GLU 72 CO 0.55 -0.62 0.00 0.09 -0.54 0.00 0.00 175.26 174.74 1uk8 n ASN 73 N 3.76 -5.22 -4.76 -1.70 5.03 -1.26 -4.95 115.26 106.15 1uk8 n ASN 73 Ca 0.13 0.21 -0.41 0.00 0.87 0.00 0.00 54.58 55.38 1uk8 n ASN 73 Cb 0.38 -4.31 -0.02 0.00 -1.02 0.00 0.00 39.78 34.81 1uk8 n ASN 73 CO 0.00 0.00 0.00 -0.47 -1.83 0.00 0.00 177.26 174.96 1uk8 s TYR 74 N -2.79 3.00 -0.63 3.10 5.04 -0.88 -4.96 117.35 119.24 1uk8 s TYR 74 Ca 0.00 1.20 -0.19 0.00 -2.44 0.00 0.00 57.07 55.64 1uk8 s TYR 74 Cb 0.00 -3.77 0.11 0.00 0.35 0.00 0.00 41.96 38.65 1uk8 s TYR 74 CO 0.00 -2.33 0.75 1.21 -1.34 0.00 0.00 175.55 173.84 1uk8 s ASN 75 N -0.02 6.24 0.08 4.32 2.47 -1.26 -5.03 114.94 121.73 1uk8 s ASN 75 Ca 0.54 -1.51 -0.30 0.00 0.42 0.00 0.00 52.86 52.01 1uk8 s ASN 75 Cb -0.41 -2.31 -0.05 0.00 -1.45 0.00 0.00 41.25 37.02 1uk8 s ASN 75 CO 0.49 -1.11 1.08 -0.31 -3.72 0.00 0.00 177.10 173.53 1uk8 s TYR 76 N 2.64 3.59 0.12 0.43 2.02 -1.26 -4.80 117.35 120.09 1uk8 s TYR 76 Ca 0.14 1.55 -0.25 0.00 -0.37 0.00 0.00 57.07 58.13 1uk8 s TYR 76 Cb -0.22 -3.25 0.07 0.00 -0.40 0.00 0.00 41.96 38.16 1uk8 s TYR 76 CO 0.05 -0.56 0.83 -1.54 -1.57 0.00 0.00 175.55 172.76 1uk8 s SER 77 N 0.64 -0.32 0.16 2.29 1.04 -1.26 -4.99 113.70 111.26 1uk8 s SER 77 Ca 0.53 -0.23 -0.15 0.00 0.48 0.00 0.00 55.95 56.58 1uk8 s SER 77 Cb -0.26 0.51 0.10 0.00 0.10 0.00 0.00 66.02 66.47 1uk8 s SER 77 CO 0.30 -0.89 1.73 0.50 0.98 0.00 0.00 173.24 175.87 1uk8 h LYS 78 N 2.00 0.23 -0.49 4.02 3.64 -1.95 -0.56 116.57 123.46 1uk8 h LYS 78 Ca -0.25 -0.01 -0.07 0.00 -1.27 0.00 0.00 60.65 59.06 1uk8 h LYS 78 Cb 1.25 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 33.00 1uk8 h LYS 78 CO 0.29 0.15 0.03 -0.44 -2.27 0.00 0.00 179.45 177.22 1uk8 h ASP 79 N 0.24 0.75 -0.59 4.20 3.32 -1.96 -1.27 116.42 121.11 1uk8 h ASP 79 Ca 0.19 -0.17 -0.10 0.00 0.02 0.00 0.00 57.03 56.97 1uk8 h ASP 79 Cb 0.21 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.54 1uk8 h ASP 79 CO -0.23 0.79 -0.02 -1.28 -1.72 0.00 0.00 179.24 176.78 1uk8 h SER 80 N 0.74 1.04 -0.17 6.45 0.87 -1.72 -0.67 113.55 120.09 1uk8 h SER 80 Ca 0.15 -0.32 -0.11 0.00 -1.23 0.00 0.00 61.79 60.28 1uk8 h SER 80 Cb 0.40 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 62.07 1uk8 h SER 80 CO 0.01 1.10 -0.28 -0.50 -0.53 0.00 0.00 176.83 176.64 1uk8 h TRP 81 N 0.94 0.74 -0.58 2.24 6.55 -0.82 -1.07 115.95 123.96 1uk8 h TRP 81 Ca 0.16 -0.18 -0.05 0.00 0.95 0.00 0.00 58.89 59.78 1uk8 h TRP 81 Cb 0.58 -0.17 -0.02 0.00 -0.86 0.00 0.00 29.16 28.69 1uk8 h TRP 81 CO 0.04 0.86 0.17 0.28 -1.05 0.00 0.00 178.44 178.74 1uk8 h VAL 82 N 0.56 1.24 -0.45 1.49 2.07 -1.01 -1.31 116.25 118.84 1uk8 h VAL 82 Ca 0.07 -0.83 0.00 0.00 0.82 0.00 0.00 66.70 66.76 1uk8 h VAL 82 Cb 0.76 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 31.19 1uk8 h VAL 82 CO 0.06 0.31 0.29 0.44 0.02 0.00 0.00 177.57 178.69 1uk8 h ASP 83 N 0.83 0.52 -0.25 0.57 3.32 -0.64 -0.51 116.42 120.25 1uk8 h ASP 83 Ca 0.19 -0.02 -0.07 0.00 0.02 0.00 0.00 57.03 57.14 1uk8 h ASP 83 Cb 0.30 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 1uk8 h ASP 83 CO -0.00 0.39 -0.13 -0.74 -1.72 0.00 0.00 179.24 177.04 1uk8 h HIS 84 N 0.61 0.62 -0.26 4.55 2.76 -0.49 0.95 115.15 123.89 1uk8 h HIS 84 Ca 0.16 -0.16 0.01 0.00 -2.20 0.00 0.00 60.37 58.19 1uk8 h HIS 84 Cb -0.05 -0.14 -0.02 0.00 1.55 0.00 0.00 27.41 28.75 1uk8 h HIS 84 CO 0.00 0.80 0.15 0.82 -1.30 0.00 0.00 177.93 178.40 1uk8 h ILE 85 N 0.26 1.03 -0.39 6.26 2.04 -0.55 0.46 117.51 126.63 1uk8 h ILE 85 Ca 0.06 -0.11 -0.06 0.00 1.00 0.00 0.00 64.86 65.75 1uk8 h ILE 85 Cb 0.64 0.69 -0.02 0.00 -0.74 0.00 0.00 36.82 37.39 1uk8 h ILE 85 CO 0.04 0.06 -0.02 0.40 0.00 0.00 0.00 178.15 178.63 1uk8 h ILE 86 N 0.32 1.22 -0.65 -0.67 1.08 -1.06 -1.36 117.51 116.39 1uk8 h ILE 86 Ca 0.10 -0.91 -0.07 0.00 -0.39 0.00 0.00 64.86 63.60 1uk8 h ILE 86 Cb -0.01 0.94 -0.03 0.00 -3.07 0.00 0.00 36.82 34.66 1uk8 h ILE 86 CO -0.05 0.31 0.14 1.23 -0.69 0.00 0.00 178.15 179.09 1uk8 h GLY 87 N 0.91 1.12 0.87 5.37 0.00 -0.03 0.10 103.07 111.41 1uk8 h GLY 87 Ca 0.12 -0.70 -0.03 0.00 0.00 0.00 0.00 47.33 46.72 1uk8 h GLY 87 CO 0.02 0.65 0.03 -2.22 0.00 0.00 0.00 176.54 175.02 1uk8 h ILE 88 N 0.98 1.24 -0.51 2.60 2.04 -0.45 -0.20 117.51 123.21 1uk8 h ILE 88 Ca 0.20 -0.82 -0.01 0.00 1.00 0.00 0.00 64.86 65.23 1uk8 h ILE 88 Cb 0.38 1.26 -0.02 0.00 -0.74 0.00 0.00 36.82 37.69 1uk8 h ILE 88 CO 0.01 0.26 0.27 0.24 0.00 0.00 0.00 178.15 178.93 1uk8 h MET 89 N 0.25 0.72 -0.43 2.37 2.86 -0.98 -1.95 114.93 117.77 1uk8 h MET 89 Ca 0.08 -0.09 -0.01 0.00 -2.06 0.00 0.00 59.70 57.62 1uk8 h MET 89 Cb 0.36 -0.14 -0.02 0.00 0.06 0.00 0.00 31.60 31.86 1uk8 h MET 89 CO 0.01 0.57 0.24 -0.44 1.06 0.00 0.00 176.91 178.35 1uk8 h ASP 90 N 0.68 0.54 -0.13 1.22 3.32 -0.66 0.13 116.42 121.53 1uk8 h ASP 90 Ca 0.18 -0.09 0.01 0.00 0.02 0.00 0.00 57.03 57.15 1uk8 h ASP 90 Cb 0.07 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.47 1uk8 h ASP 90 CO -0.03 0.47 0.09 0.00 -1.72 0.00 0.00 179.24 178.05 1uk8 h ALA 91 N 1.09 1.95 -0.62 3.45 0.00 -0.71 -1.99 119.26 122.43 1uk8 h ALA 91 Ca 0.15 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1uk8 h ALA 91 Cb 0.05 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1uk8 h ALA 91 CO -0.02 0.04 0.00 1.28 0.00 0.00 0.00 179.25 180.54 1uk8 n LEU 92 N -4.52 3.80 -3.34 0.00 4.77 -0.76 -4.95 117.00 112.00 1uk8 n LEU 92 Ca -0.01 -1.81 -0.24 0.00 -0.03 0.00 0.00 56.01 53.92 1uk8 n LEU 92 Cb 0.11 -0.41 0.04 0.00 -2.33 0.00 0.00 43.42 40.83 1uk8 n LEU 92 CO 0.34 0.91 0.09 1.21 -1.33 0.00 0.00 177.39 178.61 1uk8 n GLU 93 N 1.61 -5.81 -3.11 3.23 0.00 -0.59 -4.93 120.64 111.05 1uk8 n GLU 93 Ca 0.23 0.81 -0.44 0.00 0.00 0.00 0.00 57.16 57.76 1uk8 n GLU 93 Cb 0.62 -5.72 -0.05 0.00 0.00 0.00 0.00 31.44 26.29 1uk8 n GLU 93 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.13 177.55 1uk8 s ILE 94 N -3.21 4.81 0.10 6.31 -1.09 0.37 -4.92 121.20 123.57 1uk8 s ILE 94 Ca 0.45 -0.76 -0.09 0.00 -2.23 0.00 0.00 60.65 58.02 1uk8 s ILE 94 Cb -0.20 -4.43 -0.21 0.00 -1.58 0.00 0.00 42.46 36.04 1uk8 s ILE 94 CO 0.55 -1.02 1.25 -0.33 -1.23 0.00 0.00 174.94 174.15 1uk8 h GLU 95 N 9.14 0.54 -2.90 2.79 5.08 -1.92 -3.41 114.58 123.90 1uk8 h GLU 95 Ca -0.29 -0.59 -0.15 0.00 -1.00 0.00 0.00 59.36 57.34 1uk8 h GLU 95 Cb 1.09 0.17 -0.26 0.00 0.50 0.00 0.00 28.75 30.25 1uk8 h GLU 95 CO 1.05 1.21 -0.35 0.21 -1.00 0.00 0.00 179.01 180.14 1uk8 s LYS 96 N -3.27 0.36 0.14 2.33 2.20 -1.26 -4.44 119.74 115.79 1uk8 s LYS 96 Ca -0.08 0.53 -0.10 0.00 -0.36 0.00 0.00 55.97 55.97 1uk8 s LYS 96 Cb 0.08 0.10 -0.00 0.00 -1.51 0.00 0.00 37.83 36.50 1uk8 s LYS 96 CO 0.89 -0.08 0.26 0.00 -0.36 0.00 0.00 175.35 176.06 1uk8 s ALA 97 N 0.56 -0.17 0.42 3.13 0.00 -0.58 -4.63 121.76 120.49 1uk8 s ALA 97 Ca -0.03 -0.72 -0.10 0.00 0.00 0.00 0.00 51.96 51.11 1uk8 s ALA 97 Cb -0.05 0.71 -0.06 0.00 0.00 0.00 0.00 23.12 23.73 1uk8 s ALA 97 CO -0.03 -0.60 0.78 -1.01 0.00 0.00 0.00 175.76 174.89 1uk8 s HIS 98 N -3.92 3.48 -0.03 0.00 3.76 -0.80 -0.79 115.29 116.99 1uk8 s HIS 98 Ca 0.12 1.02 0.02 0.00 -0.15 0.00 0.00 55.06 56.06 1uk8 s HIS 98 Cb 0.04 -2.43 0.01 0.00 1.11 0.00 0.00 32.58 31.31 1uk8 s HIS 98 CO -0.05 -0.14 -0.06 0.42 -0.85 0.00 0.00 174.74 174.07 1uk8 s ILE 99 N -2.43 0.58 -0.26 0.60 1.01 -0.23 -0.82 121.20 119.65 1uk8 s ILE 99 Ca 0.51 -0.20 -0.03 0.00 0.00 0.00 0.00 60.65 60.92 1uk8 s ILE 99 Cb -0.10 -0.56 0.02 0.00 0.01 0.00 0.00 42.46 41.82 1uk8 s ILE 99 CO 0.33 0.21 -0.02 -0.69 0.00 0.00 0.00 174.94 174.78 1uk8 s VAL 100 N 0.54 3.22 -0.19 2.92 1.01 0.18 -0.77 120.40 127.32 1uk8 s VAL 100 Ca -0.07 -0.92 -0.02 0.00 0.00 0.00 0.00 61.98 60.96 1uk8 s VAL 100 Cb -0.11 -2.65 -0.01 0.00 0.00 0.00 0.00 36.38 33.62 1uk8 s VAL 100 CO 0.00 0.16 -0.08 -0.83 0.00 0.00 0.00 175.10 174.35 1uk8 s GLY 101 N 1.38 1.57 -0.37 4.51 0.00 0.30 -0.42 107.32 114.28 1uk8 s GLY 101 Ca 0.01 -1.10 -0.15 0.00 0.00 0.00 0.00 44.72 43.48 1uk8 s GLY 101 CO -0.02 0.26 0.35 0.21 0.00 0.00 0.00 173.10 173.89 1uk8 s ASN 102 N 1.17 6.15 1.43 1.64 2.47 -0.13 -1.31 114.94 126.36 1uk8 s ASN 102 Ca 0.02 -0.49 0.00 0.00 0.42 0.00 0.00 52.86 52.80 1uk8 s ASN 102 Cb -0.14 -2.19 0.00 0.00 -1.45 0.00 0.00 41.25 37.47 1uk8 s ASN 102 CO -0.02 -0.40 0.00 0.00 -3.72 0.00 0.00 177.10 172.96 1uk8 n ALA 103 N 5.34 0.00 -0.26 1.71 0.00 0.86 -0.66 120.51 127.51 1uk8 n ALA 103 Ca -0.10 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.41 1uk8 n ALA 103 Cb 0.49 0.00 0.18 0.00 0.00 0.00 0.00 19.45 20.12 1uk8 n ALA 103 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1uk8 h PHE 104 N 0.00 0.10 0.00 0.00 3.57 -1.84 0.48 116.94 119.25 1uk8 h PHE 104 Ca 0.00 0.05 -0.02 0.00 3.53 0.00 0.00 57.97 61.53 1uk8 h PHE 104 Cb 0.00 0.07 -0.00 0.00 2.79 0.00 0.00 35.95 38.81 1uk8 h PHE 104 CO 0.00 -0.19 -0.10 0.78 -2.23 0.00 0.00 178.31 176.57 1uk8 h GLY 105 N 0.16 0.00 1.27 2.40 0.00 -0.57 -1.94 103.07 104.40 1uk8 h GLY 105 Ca 0.43 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.64 1uk8 h GLY 105 CO -0.61 0.00 -0.24 -1.33 0.00 0.00 0.00 176.54 174.36 1uk8 h GLY 106 N 0.42 0.90 1.16 4.60 0.00 -0.14 0.17 103.07 110.19 1uk8 h GLY 106 Ca -0.00 -0.79 -0.09 0.00 0.00 0.00 0.00 47.33 46.45 1uk8 h GLY 106 CO 0.01 0.72 0.02 -1.33 0.00 0.00 0.00 176.54 175.96 1uk8 h GLY 107 N 0.94 1.09 1.36 4.60 0.00 -0.91 -1.78 103.07 108.37 1uk8 h GLY 107 Ca 0.09 -0.77 -0.11 0.00 0.00 0.00 0.00 47.33 46.55 1uk8 h GLY 107 CO 0.06 0.71 -0.19 1.41 0.00 0.00 0.00 176.54 178.53 1uk8 h LEU 108 N 0.93 0.74 -0.26 3.11 3.38 -1.17 -1.71 115.31 120.34 1uk8 h LEU 108 Ca 0.17 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 1uk8 h LEU 108 Cb 0.52 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1uk8 h LEU 108 CO 0.03 0.93 0.13 0.00 0.09 0.00 0.00 178.44 179.62 1uk8 h ALA 109 N 1.13 0.34 -0.29 1.53 0.00 -0.62 0.50 119.26 121.86 1uk8 h ALA 109 Ca 0.10 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1uk8 h ALA 109 Cb 0.68 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1uk8 h ALA 109 CO 0.05 -0.11 0.18 0.82 0.00 0.00 0.00 179.25 180.19 1uk8 h ILE 110 N 0.30 1.09 -0.38 0.00 2.04 -1.20 -1.14 117.51 118.22 1uk8 h ILE 110 Ca 0.09 -0.19 -0.04 0.00 1.00 0.00 0.00 64.86 65.72 1uk8 h ILE 110 Cb 0.10 0.70 -0.02 0.00 -0.74 0.00 0.00 36.82 36.86 1uk8 h ILE 110 CO -0.01 0.09 0.07 0.00 0.00 0.00 0.00 178.15 178.30 1uk8 h ALA 111 N 1.08 1.43 -0.31 1.87 0.00 -1.09 -1.63 119.26 120.61 1uk8 h ALA 111 Ca 0.10 -0.16 -0.15 0.00 0.00 0.00 0.00 54.91 54.70 1uk8 h ALA 111 Cb -0.02 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 1uk8 h ALA 111 CO -0.02 0.41 -0.38 1.15 0.00 0.00 0.00 179.25 180.41 1uk8 h THR 112 N 0.55 1.29 -0.04 0.00 2.02 -0.54 -2.13 112.91 114.06 1uk8 h THR 112 Ca 0.13 -1.56 -0.05 0.00 0.77 0.00 0.00 66.41 65.69 1uk8 h THR 112 Cb 0.24 1.57 -0.01 0.00 -1.74 0.00 0.00 68.15 68.21 1uk8 h THR 112 CO -0.00 0.51 -0.21 0.00 0.37 0.00 0.00 175.52 176.19 1uk8 h ALA 113 N 0.70 1.58 0.01 6.16 0.00 -0.80 0.27 119.26 127.18 1uk8 h ALA 113 Ca 0.04 -0.21 -0.22 0.00 0.00 0.00 0.00 54.91 54.52 1uk8 h ALA 113 Cb 0.97 -0.05 0.02 0.00 0.00 0.00 0.00 17.79 18.73 1uk8 h ALA 113 CO 0.09 0.31 -0.85 -0.07 0.00 0.00 0.00 179.25 178.73 1uk8 h LEU 114 N 0.06 0.74 0.00 0.00 3.38 -1.16 -2.54 115.31 115.79 1uk8 h LEU 114 Ca 0.01 -0.76 -0.18 0.00 0.09 0.00 0.00 57.88 57.04 1uk8 h LEU 114 Cb 0.41 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 1uk8 h LEU 114 CO 0.03 1.40 -1.08 0.03 0.09 0.00 0.00 178.44 178.91 1uk8 h ARG 115 N 0.15 0.00 -1.89 1.13 3.08 -1.22 -3.39 114.38 112.24 1uk8 h ARG 115 Ca -0.11 0.00 -0.50 0.00 0.07 0.00 0.00 59.98 59.44 1uk8 h ARG 115 Cb 1.54 0.00 -0.41 0.00 0.08 0.00 0.00 29.97 31.18 1uk8 h ARG 115 CO 0.17 0.57 -1.02 0.66 -1.07 0.00 0.00 179.97 179.28 1uk8 n TYR 116 N -3.14 1.57 -0.31 3.04 4.01 0.94 -4.94 117.16 118.33 1uk8 n TYR 116 Ca -0.05 -3.66 0.17 0.00 -0.16 0.00 0.00 57.90 54.20 1uk8 n TYR 116 Cb 0.87 -0.41 0.42 0.00 -0.31 0.00 0.00 39.34 39.92 1uk8 n TYR 116 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1uk8 h SER 117 N 2.96 0.59 0.57 7.72 0.87 -1.60 0.37 113.55 125.03 1uk8 h SER 117 Ca 0.09 0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.73 1uk8 h SER 117 Cb 0.87 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.81 1uk8 h SER 117 CO 0.61 0.20 0.00 -1.84 -0.53 0.00 0.00 176.83 175.27 1uk8 n GLU 118 N -4.65 0.02 0.00 2.24 0.00 -1.26 -2.68 120.64 114.31 1uk8 n GLU 118 Ca 0.22 0.20 0.10 0.00 0.00 0.00 0.00 57.16 57.68 1uk8 n GLU 118 Cb 0.68 -1.50 -0.11 0.00 0.00 0.00 0.00 31.44 30.51 1uk8 n GLU 118 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 1uk8 n ARG 119 N -1.48 0.24 -4.96 3.44 5.12 0.11 -4.74 116.66 114.40 1uk8 n ARG 119 Ca 0.05 -0.10 -0.33 0.00 -1.93 0.00 0.00 57.85 55.54 1uk8 n ARG 119 Cb 0.19 -1.48 -0.15 0.00 -1.16 0.00 0.00 32.46 29.86 1uk8 n ARG 119 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1uk8 s VAL 120 N -2.91 2.66 0.00 1.55 1.01 -1.09 -1.53 120.40 120.09 1uk8 s VAL 120 Ca 0.09 -0.81 0.00 0.00 0.00 0.00 0.00 61.98 61.26 1uk8 s VAL 120 Cb 0.16 -2.08 0.00 0.00 0.00 0.00 0.00 36.38 34.46 1uk8 s VAL 120 CO 0.82 0.54 0.00 -0.67 0.00 0.00 0.00 175.10 175.79 1uk8 n ASP 121 N 3.51 0.00 -4.91 3.32 -0.08 0.03 -4.89 116.55 113.53 1uk8 n ASP 121 Ca -0.18 0.00 -0.28 0.00 -1.51 0.00 0.00 54.79 52.81 1uk8 n ASP 121 Cb 0.53 0.00 -0.03 0.00 2.34 0.00 0.00 41.12 43.95 1uk8 n ASP 121 CO 0.00 0.00 0.00 -0.13 0.12 0.00 0.00 177.20 177.19 1uk8 s ARG 122 N 0.96 3.60 0.04 -0.67 0.52 -1.26 -4.41 118.95 117.73 1uk8 s ARG 122 Ca 0.00 -0.12 0.05 0.00 -0.52 0.00 0.00 55.73 55.14 1uk8 s ARG 122 Cb 0.00 -2.74 -0.02 0.00 0.52 0.00 0.00 34.95 32.71 1uk8 s ARG 122 CO 0.00 0.31 -0.16 -1.64 0.02 0.00 0.00 175.30 173.83 1uk8 s MET 123 N -3.35 1.06 -0.14 3.54 -1.94 -0.94 -1.07 119.30 116.46 1uk8 s MET 123 Ca 0.42 -0.79 0.02 0.00 -1.71 0.00 0.00 55.69 53.63 1uk8 s MET 123 Cb -0.11 -1.09 0.02 0.00 2.01 0.00 0.00 34.83 35.65 1uk8 s MET 123 CO 0.29 0.28 -0.19 0.08 -0.01 0.00 0.00 175.02 175.47 1uk8 s VAL 124 N -0.80 1.85 -0.24 -6.03 1.01 0.05 -0.65 120.40 115.58 1uk8 s VAL 124 Ca 0.03 -0.83 -0.01 0.00 0.00 0.00 0.00 61.98 61.17 1uk8 s VAL 124 Cb -0.08 -1.67 0.03 0.00 0.00 0.00 0.00 36.38 34.66 1uk8 s VAL 124 CO 0.01 0.51 -0.08 -0.76 0.00 0.00 0.00 175.10 174.78 1uk8 s LEU 125 N 1.09 3.14 -0.23 3.92 1.43 0.37 -0.54 118.68 127.86 1uk8 s LEU 125 Ca -0.02 -0.93 -0.06 0.00 -1.03 0.00 0.00 54.13 52.09 1uk8 s LEU 125 Cb -0.14 -1.63 -0.02 0.00 0.03 0.00 0.00 46.19 44.42 1uk8 s LEU 125 CO -0.06 -0.13 0.02 -0.04 0.23 0.00 0.00 176.35 176.37 1uk8 s MET 126 N 1.29 3.54 -1.82 1.70 -1.94 -0.42 -0.18 119.30 121.47 1uk8 s MET 126 Ca -0.01 -0.54 -0.22 0.00 -1.71 0.00 0.00 55.69 53.22 1uk8 s MET 126 Cb -0.17 -3.17 0.22 0.00 2.01 0.00 0.00 34.83 33.72 1uk8 s MET 126 CO -0.05 -0.17 0.54 0.41 -0.01 0.00 0.00 175.02 175.74 1uk8 n GLY 127 N 4.79 -0.37 3.78 -0.03 0.00 -0.02 -0.10 105.19 113.24 1uk8 n GLY 127 Ca -0.17 0.08 -0.37 0.00 0.00 0.00 0.00 46.02 45.56 1uk8 n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uk8 s ALA 128 N -3.29 3.00 0.85 4.61 0.00 -1.26 -3.61 121.76 122.06 1uk8 s ALA 128 Ca 0.76 0.84 -0.12 0.00 0.00 0.00 0.00 51.96 53.43 1uk8 s ALA 128 Cb -0.44 -3.34 0.11 0.00 0.00 0.00 0.00 23.12 19.45 1uk8 s ALA 128 CO 1.00 -0.49 1.18 0.00 0.00 0.00 0.00 175.76 177.45 1uk8 s ALA 129 N -1.61 2.36 0.00 0.00 0.00 -0.24 -4.70 121.76 117.57 1uk8 s ALA 129 Ca 0.62 -0.66 0.00 0.00 0.00 0.00 0.00 51.96 51.92 1uk8 s ALA 129 Cb -0.26 -2.97 0.00 0.00 0.00 0.00 0.00 23.12 19.90 1uk8 s ALA 129 CO 0.31 -1.92 0.00 0.41 0.00 0.00 0.00 175.76 174.56 1uk8 n GLY 130 N -3.02 1.19 3.21 0.00 0.00 -1.26 -2.63 105.19 102.68 1uk8 n GLY 130 Ca 0.08 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.94 1uk8 n GLY 130 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1uk8 s THR 131 N -0.14 1.14 -0.46 2.61 -1.32 -1.26 -0.44 115.64 115.76 1uk8 s THR 131 Ca 0.00 -1.73 -0.29 0.00 -1.21 0.00 0.00 61.69 58.46 1uk8 s THR 131 Cb 0.00 -1.50 0.03 0.00 -1.51 0.00 0.00 72.50 69.52 1uk8 s THR 131 CO 0.00 -0.53 1.14 -0.13 -2.21 0.00 0.00 174.62 172.89 1uk8 s ARG 132 N -2.88 3.76 0.15 7.08 0.52 -1.26 -4.79 118.95 121.53 1uk8 s ARG 132 Ca 0.09 0.63 0.10 0.00 -0.52 0.00 0.00 55.73 56.03 1uk8 s ARG 132 Cb -0.03 -3.89 -0.04 0.00 0.52 0.00 0.00 34.95 31.51 1uk8 s ARG 132 CO 0.01 -1.33 -0.22 -0.59 0.02 0.00 0.00 175.30 173.19 1uk8 s PHE 133 N 4.38 2.03 0.18 -0.53 -0.12 -1.26 -5.07 117.98 117.58 1uk8 s PHE 133 Ca 0.48 -0.41 -0.30 0.00 -0.05 0.00 0.00 56.93 56.65 1uk8 s PHE 133 Cb -0.08 -1.05 -0.09 0.00 -0.63 0.00 0.00 43.02 41.18 1uk8 s PHE 133 CO 0.30 0.35 1.35 -0.51 -0.05 0.00 0.00 175.22 176.66 1uk8 s ASP 134 N -2.37 6.84 0.23 1.98 1.01 -1.26 -4.92 116.67 118.18 1uk8 s ASP 134 Ca 0.14 2.41 -0.31 0.00 0.71 0.00 0.00 52.55 55.50 1uk8 s ASP 134 Cb -0.08 -2.60 -0.14 0.00 1.01 0.00 0.00 42.92 41.10 1uk8 s ASP 134 CO 0.07 -0.59 1.27 0.55 0.21 0.00 0.00 175.17 176.68 1uk8 n VAL 135 N 3.03 1.11 -3.91 -1.27 3.14 -1.26 -4.97 118.33 114.21 1uk8 n VAL 135 Ca 0.08 -0.28 -0.22 0.00 -2.96 0.00 0.00 64.34 60.96 1uk8 n VAL 135 Cb 0.42 -1.21 -0.02 0.00 -1.06 0.00 0.00 33.84 31.97 1uk8 n VAL 135 CO 0.00 0.00 0.00 0.42 -6.46 0.00 0.00 176.83 170.79 1uk8 s THR 136 N -0.28 5.25 0.33 1.55 -4.23 -1.26 -5.00 115.64 112.00 1uk8 s THR 136 Ca 0.68 -0.90 0.05 0.00 -1.18 0.00 0.00 61.69 60.35 1uk8 s THR 136 Cb -0.72 -3.85 0.11 0.00 1.34 0.00 0.00 72.50 69.39 1uk8 s THR 136 CO 0.52 -0.33 1.81 -0.08 -0.54 0.00 0.00 174.62 176.01 1uk8 h GLU 137 N 1.24 0.40 -0.18 3.99 4.57 -1.93 -1.14 114.58 121.53 1uk8 h GLU 137 Ca -0.51 -0.12 0.00 0.00 -1.18 0.00 0.00 59.36 57.55 1uk8 h GLU 137 Cb 1.22 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.77 1uk8 h GLU 137 CO 0.62 0.56 0.11 0.78 -1.18 0.00 0.00 179.01 179.90 1uk8 h GLY 138 N 0.92 0.25 1.09 1.92 0.00 -1.89 -0.10 103.07 105.26 1uk8 h GLY 138 Ca 0.07 -0.10 -0.10 0.00 0.00 0.00 0.00 47.33 47.20 1uk8 h GLY 138 CO 0.03 0.10 -0.01 -2.00 0.00 0.00 0.00 176.54 174.66 1uk8 h LEU 139 N 0.22 1.06 -1.32 3.11 5.85 -1.67 -0.87 115.31 121.68 1uk8 h LEU 139 Ca 0.06 -0.31 -0.04 0.00 0.84 0.00 0.00 57.88 58.43 1uk8 h LEU 139 Cb 0.00 -0.29 -0.02 0.00 0.37 0.00 0.00 40.66 40.73 1uk8 h LEU 139 CO -0.01 1.12 0.03 -1.13 -0.34 0.00 0.00 178.44 178.10 1uk8 h ASN 140 N 0.98 0.45 -0.22 1.25 -1.24 -0.94 0.02 115.58 115.87 1uk8 h ASN 140 Ca 0.17 -0.07 -0.14 0.00 0.71 0.00 0.00 56.30 56.97 1uk8 h ASN 140 Cb 0.58 -0.12 0.00 0.00 0.73 0.00 0.00 38.32 39.51 1uk8 h ASN 140 CO 0.03 0.49 -0.39 0.00 -1.29 0.00 0.00 177.43 176.27 1uk8 h ALA 141 N 1.57 0.35 0.22 1.57 0.00 -0.66 -0.46 119.26 121.85 1uk8 h ALA 141 Ca 0.11 -0.45 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 1uk8 h ALA 141 Cb 0.26 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1uk8 h ALA 141 CO 0.00 0.45 -0.11 0.28 0.00 0.00 0.00 179.25 179.87 1uk8 h VAL 142 N 0.37 0.82 0.00 0.00 2.07 -0.58 -2.15 116.25 116.78 1uk8 h VAL 142 Ca 0.01 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 67.33 1uk8 h VAL 142 Cb 0.99 0.94 0.00 0.00 -1.52 0.00 0.00 31.29 31.70 1uk8 h VAL 142 CO 0.09 0.05 0.00 -0.50 0.02 0.00 0.00 177.57 177.23 1uk8 h TRP 143 N -0.40 0.00 -0.57 1.57 6.55 -1.08 -2.95 115.95 119.07 1uk8 h TRP 143 Ca -0.03 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.81 1uk8 h TRP 143 Cb 0.30 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.60 1uk8 h TRP 143 CO -0.03 0.00 0.00 0.41 -1.05 0.00 0.00 178.44 177.77 1uk8 n GLY 144 N 0.44 2.19 3.71 1.49 0.00 -0.18 -4.83 105.19 108.00 1uk8 n GLY 144 Ca 0.02 -0.70 -0.43 0.00 0.00 0.00 0.00 46.02 44.91 1uk8 n GLY 144 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1uk8 n TYR 145 N 1.03 2.42 -4.76 1.61 9.36 -0.83 -4.98 117.16 121.02 1uk8 n TYR 145 Ca 0.22 0.46 -0.24 0.00 3.32 0.00 0.00 57.90 61.66 1uk8 n TYR 145 Cb 0.71 -2.47 -0.15 0.00 -0.63 0.00 0.00 39.34 36.80 1uk8 n TYR 145 CO 0.00 0.00 0.00 0.95 0.22 0.00 0.00 176.86 178.03 1uk8 s THR 146 N -0.67 1.40 0.24 2.97 -4.23 -1.26 -4.87 115.64 109.23 1uk8 s THR 146 Ca 0.60 -0.84 -0.31 0.00 -1.18 0.00 0.00 61.69 59.95 1uk8 s THR 146 Cb -0.57 -1.18 -0.11 0.00 1.34 0.00 0.00 72.50 71.98 1uk8 s THR 146 CO 0.57 0.33 1.62 -2.84 -0.54 0.00 0.00 174.62 173.76 1uk8 s PRO 147 N -0.60 4.15 0.00 3.99 0.02 -1.26 -4.79 135.00 136.50 1uk8 s PRO 147 Ca 0.06 2.54 0.00 0.00 0.02 0.00 0.00 61.00 63.62 1uk8 s PRO 147 Cb -0.07 -3.07 0.00 0.00 0.02 0.00 0.00 34.50 31.38 1uk8 s PRO 147 CO -0.00 -0.65 0.00 -1.13 -0.33 0.00 0.00 177.00 174.89 1uk8 n SER 148 N 3.06 0.00 0.03 2.53 3.41 -1.26 -4.96 113.62 116.43 1uk8 n SER 148 Ca 0.11 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.73 1uk8 n SER 148 Cb 0.37 0.00 0.31 0.00 -0.26 0.00 0.00 64.21 64.63 1uk8 n SER 148 CO 0.00 0.00 0.00 0.16 -0.16 0.00 0.00 175.04 175.04 1uk8 h ILE 149 N 1.08 1.20 -0.33 -1.33 3.07 -1.94 -0.88 117.51 118.38 1uk8 h ILE 149 Ca 0.00 -0.83 -0.16 0.00 1.55 0.00 0.00 64.86 65.42 1uk8 h ILE 149 Cb 0.00 1.05 -0.00 0.00 -0.27 0.00 0.00 36.82 37.60 1uk8 h ILE 149 CO 0.00 0.27 -0.41 -0.08 -1.05 0.00 0.00 178.15 176.89 1uk8 h GLU 150 N 0.42 0.86 -0.43 0.16 4.57 -1.95 -0.13 114.58 118.08 1uk8 h GLU 150 Ca 0.09 -0.49 -0.08 0.00 -1.18 0.00 0.00 59.36 57.70 1uk8 h GLU 150 Cb 0.37 0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 28.98 1uk8 h GLU 150 CO 0.02 1.13 -0.08 -0.91 -1.18 0.00 0.00 179.01 177.99 1uk8 h ASN 151 N 0.66 0.74 -0.07 1.04 2.35 -1.79 -1.39 115.58 117.11 1uk8 h ASN 151 Ca 0.04 -0.20 -0.17 0.00 -0.55 0.00 0.00 56.30 55.42 1uk8 h ASN 151 Cb 1.00 -0.20 -0.00 0.00 0.05 0.00 0.00 38.32 39.17 1uk8 h ASN 151 CO 0.10 0.85 -0.54 -0.03 -1.65 0.00 0.00 177.43 176.16 1uk8 h MET 152 N 0.69 0.66 -0.71 0.81 4.05 -1.06 -2.16 114.93 117.20 1uk8 h MET 152 Ca 0.12 -0.41 0.01 0.00 -0.28 0.00 0.00 59.70 59.14 1uk8 h MET 152 Cb 0.54 0.05 -0.04 0.00 -0.80 0.00 0.00 31.60 31.35 1uk8 h MET 152 CO 0.03 1.03 0.47 -0.09 0.23 0.00 0.00 176.91 178.58 1uk8 h ARG 153 N 0.51 0.93 -0.72 0.39 2.43 -0.67 0.48 114.38 117.73 1uk8 h ARG 153 Ca 0.01 -0.06 -0.02 0.00 -0.81 0.00 0.00 59.98 59.11 1uk8 h ARG 153 Cb 1.10 -0.21 -0.03 0.00 -0.42 0.00 0.00 29.97 30.41 1uk8 h ARG 153 CO 0.11 0.62 0.38 -0.97 -1.51 0.00 0.00 179.97 178.60 1uk8 h ASN 154 N 0.96 0.92 -0.51 -3.80 -1.24 -1.10 -0.34 115.58 110.47 1uk8 h ASN 154 Ca 0.26 -0.11 -0.09 0.00 0.71 0.00 0.00 56.30 57.08 1uk8 h ASN 154 Cb -0.11 -0.23 -0.02 0.00 0.73 0.00 0.00 38.32 38.69 1uk8 h ASN 154 CO -0.06 0.76 -0.01 -0.07 -1.29 0.00 0.00 177.43 176.76 1uk8 h LEU 155 N 1.00 0.92 -0.93 0.34 3.38 -0.71 -0.71 115.31 118.60 1uk8 h LEU 155 Ca 0.25 -0.25 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 1uk8 h LEU 155 Cb 0.06 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 1uk8 h LEU 155 CO -0.04 0.99 0.04 -0.07 0.09 0.00 0.00 178.44 179.45 1uk8 h LEU 156 N 0.87 0.79 -0.74 1.67 3.38 -0.49 -0.42 115.31 120.37 1uk8 h LEU 156 Ca 0.16 -0.18 -0.08 0.00 0.09 0.00 0.00 57.88 57.88 1uk8 h LEU 156 Cb 0.53 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.04 1uk8 h LEU 156 CO 0.03 0.83 0.11 0.44 0.09 0.00 0.00 178.44 179.93 1uk8 h ASP 157 N 0.78 1.02 -0.11 -0.43 3.32 -0.56 -2.45 116.42 117.99 1uk8 h ASP 157 Ca 0.16 -0.24 -0.08 0.00 0.02 0.00 0.00 57.03 56.89 1uk8 h ASP 157 Cb 0.41 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.68 1uk8 h ASP 157 CO 0.01 1.01 -0.17 0.40 -1.72 0.00 0.00 179.24 178.78 1uk8 h ILE 158 N 1.00 1.24 -0.01 0.35 2.04 -0.48 -3.19 117.51 118.47 1uk8 h ILE 158 Ca 0.20 -1.10 -0.18 0.00 1.00 0.00 0.00 64.86 64.78 1uk8 h ILE 158 Cb 0.42 1.21 -0.01 0.00 -0.74 0.00 0.00 36.82 37.71 1uk8 h ILE 158 CO 0.01 0.36 -0.81 -0.26 0.00 0.00 0.00 178.15 177.44 1uk8 h PHE 159 N 0.45 0.25 -2.38 1.37 -1.00 -0.78 -3.38 116.94 111.46 1uk8 h PHE 159 Ca 0.08 -0.13 -0.58 0.00 2.81 0.00 0.00 57.97 60.15 1uk8 h PHE 159 Cb 0.55 -0.03 -0.11 0.00 3.61 0.00 0.00 35.95 39.97 1uk8 h PHE 159 CO 0.02 0.91 -0.67 0.00 -1.61 0.00 0.00 178.31 176.95 1uk8 s ALA 160 N -3.31 3.08 -0.15 2.45 0.00 -0.95 -0.34 121.76 122.54 1uk8 s ALA 160 Ca -0.03 -1.63 -0.26 0.00 0.00 0.00 0.00 51.96 50.04 1uk8 s ALA 160 Cb 0.11 -0.72 -0.23 0.00 0.00 0.00 0.00 23.12 22.27 1uk8 s ALA 160 CO 0.82 0.31 0.64 -0.92 0.00 0.00 0.00 175.76 176.61 1uk8 h TYR 161 N 2.16 0.00 -2.43 0.00 3.20 -1.87 -3.42 116.97 114.60 1uk8 h TYR 161 Ca -0.44 0.00 -0.66 0.00 3.14 0.00 0.00 58.73 60.77 1uk8 h TYR 161 Cb 1.24 0.00 -0.16 0.00 1.54 0.00 0.00 36.73 39.35 1uk8 h TYR 161 CO 0.69 1.02 0.75 0.34 -1.64 0.00 0.00 178.16 179.31 1uk8 s ASP 162 N -6.28 6.42 0.36 -2.11 2.15 -1.26 -4.88 116.67 111.07 1uk8 s ASP 162 Ca -0.20 -1.56 0.26 0.00 0.43 0.00 0.00 52.55 51.48 1uk8 s ASP 162 Cb -0.01 -2.42 1.31 0.00 -0.30 0.00 0.00 42.92 41.50 1uk8 s ASP 162 CO 0.64 -1.25 1.78 0.03 -0.17 0.00 0.00 175.17 176.19 1uk8 h ARG 163 N 9.21 0.00 0.00 4.34 3.08 -1.92 -1.73 114.38 127.36 1uk8 h ARG 163 Ca -0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.02 1uk8 h ARG 163 Cb 1.04 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.09 1uk8 h ARG 163 CO 1.16 0.00 0.00 0.66 -1.07 0.00 0.00 179.97 180.72 1uk8 h SER 164 N 0.00 0.00 1.60 7.04 4.64 -1.99 -0.53 113.55 124.31 1uk8 h SER 164 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1uk8 h SER 164 Cb 0.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 1uk8 h SER 164 CO 0.00 0.00 -0.00 -0.07 -0.87 0.00 0.00 176.83 175.89 1uk8 h LEU 165 N 0.00 0.00 -8.25 5.97 3.38 -1.73 -3.41 115.31 111.27 1uk8 h LEU 165 Ca 0.00 -0.00 -0.61 0.00 0.09 0.00 0.00 57.88 57.36 1uk8 h LEU 165 Cb 0.27 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 40.89 1uk8 h LEU 165 CO 0.00 0.00 0.74 -0.69 0.09 0.00 0.00 178.44 178.58 1uk8 s VAL 166 N -3.13 4.19 0.32 1.22 1.01 -0.21 -4.96 120.40 118.84 1uk8 s VAL 166 Ca 0.10 -0.30 0.07 0.00 0.00 0.00 0.00 61.98 61.84 1uk8 s VAL 166 Cb 0.11 -4.77 -0.02 0.00 0.00 0.00 0.00 36.38 31.70 1uk8 s VAL 166 CO 0.62 -1.59 0.42 0.42 0.00 0.00 0.00 175.10 174.97 1uk8 s THR 167 N 4.40 4.16 0.32 3.92 -4.23 -1.26 -4.99 115.64 117.97 1uk8 s THR 167 Ca 0.27 -1.06 0.01 0.00 -1.18 0.00 0.00 61.69 59.74 1uk8 s THR 167 Cb -0.13 -3.44 0.20 0.00 1.34 0.00 0.00 72.50 70.48 1uk8 s THR 167 CO 0.09 -0.19 1.92 0.44 -0.54 0.00 0.00 174.62 176.33 1uk8 h ASP 168 N 1.00 0.69 -0.37 3.99 3.32 -1.99 -1.37 116.42 121.69 1uk8 h ASP 168 Ca -0.46 -0.08 -0.04 0.00 0.02 0.00 0.00 57.03 56.47 1uk8 h ASP 168 Cb 1.25 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 40.61 1uk8 h ASP 168 CO 0.55 0.62 0.09 -0.08 -1.72 0.00 0.00 179.24 178.70 1uk8 h GLU 169 N 0.76 0.60 -0.45 3.56 4.81 -1.99 -0.47 114.58 121.40 1uk8 h GLU 169 Ca 0.19 -0.14 -0.03 0.00 -0.13 0.00 0.00 59.36 59.24 1uk8 h GLU 169 Cb 0.13 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.41 1uk8 h GLU 169 CO -0.02 0.64 0.17 1.25 -0.73 0.00 0.00 179.01 180.32 1uk8 h LEU 170 N 0.46 0.62 -0.82 1.64 5.85 -1.82 -0.04 115.31 121.19 1uk8 h LEU 170 Ca 0.12 -0.18 -0.01 0.00 0.84 0.00 0.00 57.88 58.66 1uk8 h LEU 170 Cb 0.31 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.13 1uk8 h LEU 170 CO 0.00 0.63 0.49 0.00 -0.34 0.00 0.00 178.44 179.22 1uk8 h ALA 171 N 1.02 1.04 -0.13 1.25 0.00 -1.13 -0.68 119.26 120.63 1uk8 h ALA 171 Ca 0.15 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1uk8 h ALA 171 Cb 0.21 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1uk8 h ALA 171 CO -0.01 0.51 0.05 -0.09 0.00 0.00 0.00 179.25 179.72 1uk8 h ARG 172 N 1.12 0.19 -0.54 0.00 2.43 -0.72 -0.34 114.38 116.53 1uk8 h ARG 172 Ca 0.29 -0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.39 1uk8 h ARG 172 Cb -0.03 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.46 1uk8 h ARG 172 CO -0.05 0.28 0.17 -0.07 -1.51 0.00 0.00 179.97 178.79 1uk8 h LEU 173 N 0.06 0.79 -0.75 3.80 3.38 -0.73 -0.87 115.31 120.99 1uk8 h LEU 173 Ca 0.04 -0.21 -0.13 0.00 0.09 0.00 0.00 57.88 57.67 1uk8 h LEU 173 Cb 0.16 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 1uk8 h LEU 173 CO -0.00 0.79 -0.62 0.03 0.09 0.00 0.00 178.44 178.72 1uk8 h ARG 174 N 0.75 0.02 -0.20 1.13 2.47 -1.09 -1.28 114.38 116.17 1uk8 h ARG 174 Ca 0.17 -0.02 -0.02 0.00 -1.26 0.00 0.00 59.98 58.86 1uk8 h ARG 174 Cb 0.28 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.60 1uk8 h ARG 174 CO -0.00 0.63 0.06 -0.92 0.56 0.00 0.00 179.97 180.30 1uk8 h TYR 175 N 0.02 0.33 -0.97 3.04 3.20 -0.80 -1.09 116.97 120.69 1uk8 h TYR 175 Ca -0.01 -0.03 0.02 0.00 3.14 0.00 0.00 58.73 61.85 1uk8 h TYR 175 Cb 1.10 -0.10 -0.05 0.00 1.54 0.00 0.00 36.73 39.22 1uk8 h TYR 175 CO 0.00 0.41 0.64 0.93 -1.64 0.00 0.00 178.16 178.51 1uk8 h GLU 176 N 0.16 1.24 -0.68 1.82 5.08 -0.92 -1.60 114.58 119.66 1uk8 h GLU 176 Ca 0.07 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 58.30 1uk8 h GLU 176 Cb 0.24 -0.28 -0.03 0.00 0.50 0.00 0.00 28.75 29.18 1uk8 h GLU 176 CO -0.00 0.82 0.24 0.00 -1.00 0.00 0.00 179.01 179.07 1uk8 h ALA 177 N 1.41 1.13 0.00 3.43 0.00 -0.90 -2.78 119.26 121.55 1uk8 h ALA 177 Ca 0.37 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1uk8 h ALA 177 Cb -0.08 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.44 1uk8 h ALA 177 CO -0.10 0.61 0.00 0.66 0.00 0.00 0.00 179.25 180.42 1uk8 h SER 178 N 1.00 0.00 -0.52 0.00 4.64 -0.23 -3.06 113.55 115.40 1uk8 h SER 178 Ca 0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 1uk8 h SER 178 Cb 0.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 1uk8 h SER 178 CO -0.01 0.00 0.00 2.30 -0.87 0.00 0.00 176.83 178.25 1uk8 n ILE 179 N -2.98 1.62 -1.44 0.95 -5.35 -0.98 -3.31 119.36 107.85 1uk8 n ILE 179 Ca 0.01 -1.24 -0.34 0.00 -0.27 0.00 0.00 62.75 60.90 1uk8 n ILE 179 Cb 0.29 0.20 0.09 0.00 -1.74 0.00 0.00 39.64 38.48 1uk8 n ILE 179 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 1uk8 s GLN 180 N -1.71 2.16 -0.46 6.28 -0.21 -1.16 -4.78 119.66 119.78 1uk8 s GLN 180 Ca 0.42 1.75 -0.45 0.00 0.02 0.00 0.00 55.36 57.11 1uk8 s GLN 180 Cb 0.27 -1.84 -0.19 0.00 1.00 0.00 0.00 33.01 32.26 1uk8 s GLN 180 CO 0.21 -1.82 1.73 -2.30 -2.12 0.00 0.00 175.29 170.99 1uk8 n PRO 181 N -2.70 0.23 -0.36 2.91 -0.02 -1.26 -1.08 135.00 132.72 1uk8 n PRO 181 Ca 0.13 0.08 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 1uk8 n PRO 181 Cb 0.50 -1.63 0.00 0.00 -0.02 0.00 0.00 33.50 32.35 1uk8 n PRO 181 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1uk8 n GLY 182 N 4.70 1.79 0.29 -1.23 0.00 -1.26 -4.92 105.19 104.56 1uk8 n GLY 182 Ca 0.35 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.22 1uk8 n GLY 182 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1uk8 h PHE 183 N 0.00 -0.61 -0.14 1.61 -1.00 -1.38 -2.59 116.94 112.83 1uk8 h PHE 183 Ca 0.00 -0.01 -0.08 0.00 2.81 0.00 0.00 57.97 60.69 1uk8 h PHE 183 Cb 0.00 0.20 -0.01 0.00 3.61 0.00 0.00 35.95 39.75 1uk8 h PHE 183 CO 0.00 -0.29 -0.26 0.37 -1.61 0.00 0.00 178.31 176.52 1uk8 h GLN 184 N -0.90 0.26 -0.15 1.51 5.75 -1.75 -0.61 115.11 119.23 1uk8 h GLN 184 Ca -0.07 -0.09 -0.00 0.00 -0.15 0.00 0.00 58.65 58.34 1uk8 h GLN 184 Cb 0.59 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 29.12 1uk8 h GLN 184 CO 0.11 0.51 0.08 0.93 -2.65 0.00 0.00 178.83 177.81 1uk8 h GLU 185 N 0.23 0.21 -0.04 1.69 3.07 -1.91 -0.04 114.58 117.79 1uk8 h GLU 185 Ca 0.04 -0.02 -0.18 0.00 -0.50 0.00 0.00 59.36 58.70 1uk8 h GLU 185 Cb 0.59 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.45 1uk8 h GLU 185 CO 0.04 0.21 -0.75 0.66 -1.40 0.00 0.00 179.01 177.77 1uk8 h SER 186 N 0.15 0.31 0.03 1.42 4.64 -1.27 -3.15 113.55 115.67 1uk8 h SER 186 Ca 0.05 -0.21 -0.00 0.00 -0.47 0.00 0.00 61.79 61.16 1uk8 h SER 186 Cb 0.06 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.06 1uk8 h SER 186 CO -0.01 0.95 -0.02 0.15 -0.87 0.00 0.00 176.83 177.03 1uk8 h PHE 187 N 0.17 -0.04 0.00 4.77 3.57 -0.92 -2.29 116.94 122.20 1uk8 h PHE 187 Ca -0.03 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.46 1uk8 h PHE 187 Cb 1.32 0.01 -0.00 0.00 2.79 0.00 0.00 35.95 40.07 1uk8 h PHE 187 CO 0.03 0.32 -0.04 0.66 -2.23 0.00 0.00 178.31 177.06 1uk8 h SER 188 N -0.42 0.00 0.05 0.41 4.64 -1.09 -1.29 113.55 115.85 1uk8 h SER 188 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1uk8 h SER 188 Cb 0.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 1uk8 h SER 188 CO 0.01 0.04 -0.28 -1.54 -0.87 0.00 0.00 176.83 174.19 1uk8 n SER 189 N -3.75 1.89 -0.03 4.97 3.41 -1.19 -4.38 113.62 114.54 1uk8 n SER 189 Ca -0.03 -1.44 -0.15 0.00 -0.26 0.00 0.00 58.87 56.99 1uk8 n SER 189 Cb 0.13 0.24 -0.12 0.00 -0.26 0.00 0.00 64.21 64.21 1uk8 n SER 189 CO 0.00 0.00 0.00 -0.03 -0.16 0.00 0.00 175.04 174.85 1uk8 h MET 190 N 2.54 0.10 -2.21 4.33 -1.53 -0.63 -3.40 114.93 114.14 1uk8 h MET 190 Ca 0.00 -0.11 -0.56 0.00 -3.44 0.00 0.00 59.70 55.59 1uk8 h MET 190 Cb 0.71 0.03 -0.41 0.00 -0.55 0.00 0.00 31.60 31.37 1uk8 h MET 190 CO 0.00 0.87 -0.80 1.19 0.14 0.00 0.00 176.91 178.31 1uk8 n PHE 191 N -4.59 2.96 -1.64 1.39 3.72 -1.25 -5.09 117.46 112.96 1uk8 n PHE 191 Ca -0.10 -3.95 -0.33 0.00 -0.05 0.00 0.00 57.45 53.02 1uk8 n PHE 191 Cb 0.46 -0.47 0.06 0.00 -0.94 0.00 0.00 39.48 38.59 1uk8 n PHE 191 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 1uk8 s PRO 192 N -3.17 2.57 0.44 -1.08 0.04 -1.26 -4.72 135.00 127.83 1uk8 s PRO 192 Ca 0.46 1.51 -0.25 0.00 0.04 0.00 0.00 61.00 62.76 1uk8 s PRO 192 Cb 0.30 -1.91 -0.08 0.00 0.04 0.00 0.00 34.50 32.84 1uk8 s PRO 192 CO -0.12 -1.45 1.41 -1.21 0.04 0.00 0.00 177.00 175.67 1uk8 s GLU 193 N -4.04 3.73 -0.04 4.56 0.41 -1.26 -3.77 118.70 118.30 1uk8 s GLU 193 Ca 0.69 2.39 -0.30 0.00 -0.41 0.00 0.00 54.97 57.34 1uk8 s GLU 193 Cb -0.23 -2.68 -0.03 0.00 -1.78 0.00 0.00 34.13 29.42 1uk8 s GLU 193 CO 0.43 -0.77 1.07 -1.25 -0.49 0.00 0.00 175.26 174.24 1uk8 s PRO 194 N -2.42 4.45 0.15 0.39 0.04 -1.26 -5.10 135.00 131.25 1uk8 s PRO 194 Ca 0.60 1.52 0.22 0.00 0.04 0.00 0.00 61.00 63.37 1uk8 s PRO 194 Cb -0.43 -3.49 0.87 0.00 0.04 0.00 0.00 34.50 31.49 1uk8 s PRO 194 CO 0.56 -0.25 1.67 0.54 0.04 0.00 0.00 177.00 179.55 1uk8 n ARG 195 N 4.53 0.13 0.16 4.56 1.74 -1.25 -2.87 116.66 123.66 1uk8 n ARG 195 Ca 0.08 0.30 0.07 0.00 -0.77 0.00 0.00 57.85 57.53 1uk8 n ARG 195 Cb 0.49 -1.71 0.56 0.00 -1.02 0.00 0.00 32.46 30.78 1uk8 n ARG 195 CO 0.00 0.00 0.00 0.37 -1.52 0.00 0.00 177.63 176.48 1uk8 h GLN 196 N 0.00 0.19 -0.88 5.56 5.75 -1.97 -1.62 115.11 122.15 1uk8 h GLN 196 Ca 0.00 -0.01 0.09 0.00 -0.15 0.00 0.00 58.65 58.58 1uk8 h GLN 196 Cb 0.39 -0.04 -0.06 0.00 1.07 0.00 0.00 27.48 28.84 1uk8 h GLN 196 CO 0.00 0.13 0.57 0.00 -2.65 0.00 0.00 178.83 176.87 1uk8 h ARG 197 N 0.20 0.84 0.01 1.69 3.08 -1.90 -1.75 114.38 116.55 1uk8 h ARG 197 Ca 0.06 -0.05 -0.20 0.00 0.07 0.00 0.00 59.98 59.85 1uk8 h ARG 197 Cb -0.01 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 29.83 1uk8 h ARG 197 CO -0.01 0.56 -0.97 -1.49 -1.07 0.00 0.00 179.97 176.99 1uk8 h TRP 198 N 0.87 0.06 -0.28 3.04 -0.00 -1.52 -0.38 115.95 117.74 1uk8 h TRP 198 Ca 0.40 -0.04 -0.03 0.00 -0.00 0.00 0.00 58.89 59.22 1uk8 h TRP 198 Cb 0.40 -0.00 -0.01 0.00 -0.00 0.00 0.00 29.16 29.54 1uk8 h TRP 198 CO -0.00 0.98 0.08 0.82 -0.00 0.00 0.00 178.44 180.31 1uk8 h ILE 199 N 0.01 1.21 -0.69 1.49 2.04 -1.32 -1.63 117.51 118.62 1uk8 h ILE 199 Ca -0.02 -0.68 -0.07 0.00 1.00 0.00 0.00 64.86 65.09 1uk8 h ILE 199 Cb 1.69 1.13 -0.03 0.00 -0.74 0.00 0.00 36.82 38.86 1uk8 h ILE 199 CO 0.13 0.22 0.17 0.44 0.00 0.00 0.00 178.15 179.12 1uk8 h ASP 200 N 0.29 1.04 -0.15 1.72 3.32 -1.28 -2.25 116.42 119.10 1uk8 h ASP 200 Ca 0.09 -0.23 -0.07 0.00 0.02 0.00 0.00 57.03 56.83 1uk8 h ASP 200 Cb 0.27 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.53 1uk8 h ASP 200 CO -0.00 1.00 -0.13 0.00 -1.72 0.00 0.00 179.24 178.39 1uk8 h ALA 201 N 1.08 1.23 0.00 3.45 0.00 -0.92 -2.51 119.26 121.59 1uk8 h ALA 201 Ca 0.22 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1uk8 h ALA 201 Cb 0.36 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1uk8 h ALA 201 CO 0.00 0.50 -0.02 1.28 0.00 0.00 0.00 179.25 181.01 1uk8 n LEU 202 N -4.20 0.77 -4.86 0.00 4.77 -0.63 -4.75 117.00 108.11 1uk8 n LEU 202 Ca 0.01 0.56 -0.31 0.00 -0.03 0.00 0.00 56.01 56.23 1uk8 n LEU 202 Cb 0.33 -0.32 0.01 0.00 -2.33 0.00 0.00 43.42 41.10 1uk8 n LEU 202 CO 0.40 -0.17 0.71 0.00 -1.33 0.00 0.00 177.39 177.01 1uk8 s ALA 203 N -3.10 3.04 0.14 -1.18 0.00 -0.87 -3.99 121.76 115.80 1uk8 s ALA 203 Ca 0.11 -0.01 0.09 0.00 0.00 0.00 0.00 51.96 52.15 1uk8 s ALA 203 Cb 0.13 -3.10 -0.04 0.00 0.00 0.00 0.00 23.12 20.11 1uk8 s ALA 203 CO 0.60 -0.68 -0.16 -1.12 0.00 0.00 0.00 175.76 174.39 1uk8 s SER 204 N -3.92 3.94 0.62 0.00 0.01 0.41 -4.93 113.70 109.83 1uk8 s SER 204 Ca 0.56 -0.60 -0.17 0.00 1.31 0.00 0.00 55.95 57.06 1uk8 s SER 204 Cb -0.11 -0.56 -0.02 0.00 0.21 0.00 0.00 66.02 65.54 1uk8 s SER 204 CO 0.50 0.15 1.13 -0.94 0.41 0.00 0.00 173.24 174.49 1uk8 s SER 205 N -2.37 5.26 0.21 2.44 1.04 -1.26 -4.64 113.70 114.37 1uk8 s SER 205 Ca 0.20 2.11 -0.10 0.00 0.48 0.00 0.00 55.95 58.64 1uk8 s SER 205 Cb -0.10 -2.57 0.25 0.00 0.10 0.00 0.00 66.02 63.71 1uk8 s SER 205 CO 0.11 -1.53 1.77 0.44 0.98 0.00 0.00 173.24 175.02 1uk8 h ASP 206 N 0.46 0.38 -0.49 7.02 3.32 -1.99 -0.50 116.42 124.60 1uk8 h ASP 206 Ca -0.48 0.05 0.06 0.00 0.02 0.00 0.00 57.03 56.68 1uk8 h ASP 206 Cb 1.26 -0.01 -0.05 0.00 0.22 0.00 0.00 39.33 40.75 1uk8 h ASP 206 CO 0.55 0.23 0.21 -0.33 -1.72 0.00 0.00 179.24 178.19 1uk8 h GLU 207 N 0.53 0.41 -0.24 3.56 3.07 -2.00 -1.46 114.58 118.45 1uk8 h GLU 207 Ca 0.30 -0.02 -0.08 0.00 -0.50 0.00 0.00 59.36 59.05 1uk8 h GLU 207 Cb 0.28 -0.09 -0.01 0.00 -0.84 0.00 0.00 28.75 28.10 1uk8 h GLU 207 CO -0.24 0.27 -0.16 -0.44 -1.40 0.00 0.00 179.01 177.04 1uk8 h ASP 208 N 0.42 0.56 -0.65 1.42 3.32 -1.76 -3.13 116.42 116.60 1uk8 h ASP 208 Ca 0.23 -0.44 0.03 0.00 0.02 0.00 0.00 57.03 56.87 1uk8 h ASP 208 Cb 0.19 -0.16 -0.04 0.00 0.22 0.00 0.00 39.33 39.55 1uk8 h ASP 208 CO -0.20 0.87 0.43 0.40 -1.72 0.00 0.00 179.24 179.02 1uk8 h ILE 209 N 0.24 1.10 0.00 0.35 2.04 -0.87 -0.92 117.51 119.45 1uk8 h ILE 209 Ca 0.05 -0.27 -0.00 0.00 1.00 0.00 0.00 64.86 65.63 1uk8 h ILE 209 Cb 0.68 0.25 -0.00 0.00 -0.74 0.00 0.00 36.82 37.01 1uk8 h ILE 209 CO 0.04 0.14 -0.02 0.11 0.00 0.00 0.00 178.15 178.43 1uk8 h LYS 210 N 0.79 0.00 0.00 2.37 1.57 -1.21 -2.33 116.57 117.75 1uk8 h LYS 210 Ca 0.26 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.04 1uk8 h LYS 210 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.36 1uk8 h LYS 210 CO -0.07 0.02 -0.19 0.25 -0.57 0.00 0.00 179.45 178.90 1uk8 n THR 211 N -3.25 0.07 -1.70 -0.16 -2.24 -0.35 -4.72 114.28 101.92 1uk8 n THR 211 Ca -0.02 -0.04 -0.42 0.00 -2.27 0.00 0.00 64.05 61.30 1uk8 n THR 211 Cb 0.16 -0.26 -0.03 0.00 -2.10 0.00 0.00 70.33 68.10 1uk8 n THR 211 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1uk8 s LEU 212 N -3.20 4.42 0.00 3.22 1.43 -0.88 -4.88 118.68 118.80 1uk8 s LEU 212 Ca 0.12 2.67 0.25 0.00 -1.03 0.00 0.00 54.13 56.14 1uk8 s LEU 212 Cb 0.18 -3.54 0.46 0.00 0.03 0.00 0.00 46.19 43.31 1uk8 s LEU 212 CO 0.60 -1.03 1.38 -0.81 0.23 0.00 0.00 176.35 176.71 1uk8 n PRO 213 N 7.08 0.57 -2.20 1.29 -0.04 -1.26 -4.50 135.00 135.93 1uk8 n PRO 213 Ca 0.19 -0.38 -0.41 0.00 -0.04 0.00 0.00 63.50 62.87 1uk8 n PRO 213 Cb 0.40 -1.49 -0.03 0.00 -0.04 0.00 0.00 33.50 32.35 1uk8 n PRO 213 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1uk8 s ASN 214 N -2.69 6.89 0.12 3.54 -0.87 -1.26 -4.85 114.94 115.81 1uk8 s ASN 214 Ca 0.18 2.57 -0.31 0.00 -1.57 0.00 0.00 52.86 53.73 1uk8 s ASN 214 Cb 0.18 -2.64 -0.08 0.00 -0.02 0.00 0.00 41.25 38.69 1uk8 s ASN 214 CO 0.62 -0.45 1.47 -1.61 -2.57 0.00 0.00 177.10 174.56 1uk8 s GLU 215 N -1.58 4.27 -0.01 -0.60 0.41 -1.26 -4.49 118.70 115.44 1uk8 s GLU 215 Ca 0.49 2.18 0.03 0.00 -0.41 0.00 0.00 54.97 57.26 1uk8 s GLU 215 Cb -0.38 -3.28 -0.01 0.00 -1.78 0.00 0.00 34.13 28.69 1uk8 s GLU 215 CO 0.49 -0.53 -0.11 0.99 -0.49 0.00 0.00 175.26 175.61 1uk8 s THR 216 N 1.36 0.88 -0.25 3.63 2.01 0.68 -2.22 115.64 121.72 1uk8 s THR 216 Ca 0.67 -0.47 -0.01 0.00 0.31 0.00 0.00 61.69 62.19 1uk8 s THR 216 Cb -0.39 -0.74 0.03 0.00 0.01 0.00 0.00 72.50 71.42 1uk8 s THR 216 CO 0.30 0.25 -0.06 -0.22 -0.69 0.00 0.00 174.62 174.20 1uk8 s LEU 217 N -0.21 3.28 -0.24 4.42 2.96 0.18 -1.36 118.68 127.71 1uk8 s LEU 217 Ca 0.03 -0.96 -0.11 0.00 -0.22 0.00 0.00 54.13 52.88 1uk8 s LEU 217 Cb -0.05 -1.66 -0.05 0.00 0.50 0.00 0.00 46.19 44.93 1uk8 s LEU 217 CO -0.00 -0.15 0.17 -0.63 -1.32 0.00 0.00 176.35 174.42 1uk8 s ILE 218 N 1.30 5.35 -0.01 6.68 1.01 0.64 -0.48 121.20 135.69 1uk8 s ILE 218 Ca -0.01 0.20 0.08 0.00 0.00 0.00 0.00 60.65 60.92 1uk8 s ILE 218 Cb -0.17 -3.51 -0.02 0.00 0.01 0.00 0.00 42.46 38.77 1uk8 s ILE 218 CO -0.04 0.34 -0.25 -0.63 0.00 0.00 0.00 174.94 174.36 1uk8 s ILE 219 N 1.08 1.99 -0.02 2.92 1.01 0.75 -0.19 121.20 128.74 1uk8 s ILE 219 Ca 0.08 -1.10 -0.22 0.00 0.00 0.00 0.00 60.65 59.42 1uk8 s ILE 219 Cb -0.14 -1.66 0.04 0.00 0.01 0.00 0.00 42.46 40.72 1uk8 s ILE 219 CO 0.05 0.55 0.47 -2.28 0.00 0.00 0.00 174.94 173.72 1uk8 s HIS 220 N -0.61 -0.38 -0.16 3.97 2.46 -0.86 -0.84 115.29 118.87 1uk8 s HIS 220 Ca 0.10 0.62 -0.13 0.00 0.47 0.00 0.00 55.06 56.11 1uk8 s HIS 220 Cb -0.10 0.23 -0.05 0.00 -0.13 0.00 0.00 32.58 32.54 1uk8 s HIS 220 CO -0.01 -0.49 0.27 0.20 -2.47 0.00 0.00 174.74 172.24 1uk8 s GLY 221 N -1.31 2.18 0.27 1.59 0.00 -1.24 -0.96 107.32 107.86 1uk8 s GLY 221 Ca -0.12 -0.49 0.01 0.00 0.00 0.00 0.00 44.72 44.12 1uk8 s GLY 221 CO 0.06 0.37 1.76 -0.09 0.00 0.00 0.00 173.10 175.20 1uk8 h ARG 222 N 6.62 0.61 -0.57 2.90 2.43 -0.95 -1.25 114.38 124.17 1uk8 h ARG 222 Ca -0.41 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.72 1uk8 h ARG 222 Cb 1.16 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 30.58 1uk8 h ARG 222 CO 0.75 0.40 0.00 0.39 -1.51 0.00 0.00 179.97 180.01 1uk8 n GLU 223 N -4.87 2.35 -1.66 0.20 4.71 -0.61 -4.77 120.64 115.99 1uk8 n GLU 223 Ca 0.19 -1.41 -0.50 0.00 -0.01 0.00 0.00 57.16 55.43 1uk8 n GLU 223 Cb 0.49 -1.57 -0.05 0.00 -1.01 0.00 0.00 31.44 29.30 1uk8 n GLU 223 CO 0.00 0.00 0.00 -3.47 0.09 0.00 0.00 177.13 173.75 1uk8 n ASP 224 N 0.44 3.12 0.00 1.62 -0.08 -0.47 -4.70 116.55 116.48 1uk8 n ASP 224 Ca 0.13 0.89 0.11 0.00 -1.51 0.00 0.00 54.79 54.41 1uk8 n ASP 224 Cb 0.50 -1.33 0.13 0.00 2.34 0.00 0.00 41.12 42.77 1uk8 n ASP 224 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1uk8 n GLN 225 N 6.73 0.04 -0.09 -0.67 6.02 -1.26 -4.49 117.38 123.66 1uk8 n GLN 225 Ca 0.26 0.00 -0.10 0.00 -0.01 0.00 0.00 57.00 57.15 1uk8 n GLN 225 Cb 0.27 -1.51 -0.04 0.00 1.02 0.00 0.00 30.24 29.97 1uk8 n GLN 225 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 1uk8 n VAL 226 N -1.56 1.47 -4.14 5.09 0.31 -1.26 -3.78 118.33 114.45 1uk8 n VAL 226 Ca 0.05 0.11 -0.34 0.00 -0.01 0.00 0.00 64.34 64.14 1uk8 n VAL 226 Cb 0.35 -2.30 -0.14 0.00 -0.91 0.00 0.00 33.84 30.84 1uk8 n VAL 226 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1uk8 s VAL 227 N -2.51 3.23 0.43 2.52 1.01 -1.26 -4.28 120.40 119.54 1uk8 s VAL 227 Ca -0.23 -0.56 -0.25 0.00 0.00 0.00 0.00 61.98 60.94 1uk8 s VAL 227 Cb 0.04 -2.44 -0.08 0.00 0.00 0.00 0.00 36.38 33.91 1uk8 s VAL 227 CO 0.36 0.46 1.27 -2.16 0.00 0.00 0.00 175.10 175.03 1uk8 s PRO 228 N 1.15 3.82 0.42 2.72 0.04 -1.26 -4.70 135.00 137.19 1uk8 s PRO 228 Ca 0.02 2.07 0.15 0.00 0.04 0.00 0.00 61.00 63.27 1uk8 s PRO 228 Cb -0.14 -2.62 1.02 0.00 0.04 0.00 0.00 34.50 32.80 1uk8 s PRO 228 CO -0.02 -0.58 1.93 1.25 0.04 0.00 0.00 177.00 179.62 1uk8 h LEU 229 N 2.40 0.41 -1.99 -3.56 5.85 -1.85 -0.41 115.31 116.15 1uk8 h LEU 229 Ca -0.50 0.02 0.16 0.00 0.84 0.00 0.00 57.88 58.40 1uk8 h LEU 229 Cb 1.25 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 42.20 1uk8 h LEU 229 CO 0.61 0.22 0.40 0.77 -0.34 0.00 0.00 178.44 180.10 1uk8 h SER 230 N 0.44 0.01 -0.46 1.25 4.64 -1.98 -0.59 113.55 116.85 1uk8 h SER 230 Ca 0.35 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.59 1uk8 h SER 230 Cb 0.74 -0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.82 1uk8 h SER 230 CO -0.11 0.00 -0.01 -1.28 -0.87 0.00 0.00 176.83 174.56 1uk8 h SER 231 N 0.01 0.82 0.77 4.97 0.87 -1.43 -1.80 113.55 117.75 1uk8 h SER 231 Ca 0.26 -0.31 -0.11 0.00 -1.23 0.00 0.00 61.79 60.39 1uk8 h SER 231 Cb 1.04 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 62.76 1uk8 h SER 231 CO -0.01 0.93 -0.54 0.28 -0.53 0.00 0.00 176.83 176.97 1uk8 h SER 232 N 0.68 0.00 -0.64 6.23 0.02 -1.25 -1.54 113.55 117.06 1uk8 h SER 232 Ca 0.13 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.99 1uk8 h SER 232 Cb 0.52 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.04 1uk8 h SER 232 CO 0.03 0.54 0.04 -0.07 -1.14 0.00 0.00 176.83 176.23 1uk8 h LEU 233 N 0.00 1.07 -0.47 5.07 3.38 -1.12 -0.67 115.31 122.58 1uk8 h LEU 233 Ca -0.01 -0.29 -0.06 0.00 0.09 0.00 0.00 57.88 57.61 1uk8 h LEU 233 Cb 1.07 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 41.52 1uk8 h LEU 233 CO 0.07 1.10 0.06 -0.09 0.09 0.00 0.00 178.44 179.67 1uk8 h ARG 234 N 1.01 0.78 -0.60 1.13 9.65 -0.97 -1.78 114.38 123.60 1uk8 h ARG 234 Ca 0.18 -0.22 -0.00 0.00 -1.10 0.00 0.00 59.98 58.84 1uk8 h ARG 234 Cb 0.53 -0.09 -0.03 0.00 -1.39 0.00 0.00 29.97 28.99 1uk8 h ARG 234 CO 0.03 0.80 0.36 -0.07 2.80 0.00 0.00 179.97 183.89 1uk8 h LEU 235 N 0.65 0.71 -1.35 3.80 3.38 -1.02 -1.41 115.31 120.07 1uk8 h LEU 235 Ca 0.14 -0.04 -0.07 0.00 0.09 0.00 0.00 57.88 58.00 1uk8 h LEU 235 Cb 0.41 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 1uk8 h LEU 235 CO 0.01 0.55 -0.32 1.23 0.09 0.00 0.00 178.44 180.00 1uk8 h GLY 236 N 0.86 0.00 2.00 0.83 0.00 -0.54 -0.45 103.07 105.77 1uk8 h GLY 236 Ca 0.22 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 47.37 1uk8 h GLY 236 CO -0.04 0.00 -0.83 0.83 0.00 0.00 0.00 176.54 176.50 1uk8 h GLU 237 N 0.00 0.00 0.17 4.80 5.08 -0.45 -3.36 114.58 120.82 1uk8 h GLU 237 Ca -0.00 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 58.02 1uk8 h GLU 237 Cb 0.60 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.85 1uk8 h GLU 237 CO 0.04 0.83 -1.69 -0.07 -1.00 0.00 0.00 179.01 177.12 1uk8 h LEU 238 N 0.00 0.55 -9.05 1.33 3.38 -0.92 -3.45 115.31 107.14 1uk8 h LEU 238 Ca -0.01 -0.92 -0.59 0.00 0.09 0.00 0.00 57.88 56.45 1uk8 h LEU 238 Cb 1.54 -0.18 -0.08 0.00 0.09 0.00 0.00 40.66 42.03 1uk8 h LEU 238 CO 0.11 1.76 0.58 -0.63 0.09 0.00 0.00 178.44 180.34 1uk8 s ILE 239 N -2.55 4.79 0.05 1.22 1.01 -0.22 -4.09 121.20 121.41 1uk8 s ILE 239 Ca -0.17 1.72 -0.34 0.00 0.00 0.00 0.00 60.65 61.85 1uk8 s ILE 239 Cb 0.05 -4.18 -0.19 0.00 0.01 0.00 0.00 42.46 38.15 1uk8 s ILE 239 CO 0.83 -0.11 1.49 -0.78 0.00 0.00 0.00 174.94 176.37 1uk8 h ASP 240 N 7.60 -0.97 -0.94 3.58 3.58 -1.85 -3.26 116.42 124.16 1uk8 h ASP 240 Ca -0.22 0.03 -0.73 0.00 0.42 0.00 0.00 57.03 56.53 1uk8 h ASP 240 Cb 1.08 0.25 -0.10 0.00 1.72 0.00 0.00 39.33 42.29 1uk8 h ASP 240 CO 0.91 -0.66 2.65 0.54 -2.88 0.00 0.00 179.24 179.80 1uk8 n ARG 241 N -5.56 4.25 -4.35 0.28 1.74 -1.26 -4.93 116.66 106.82 1uk8 n ARG 241 Ca -0.15 -3.22 -0.25 0.00 -0.77 0.00 0.00 57.85 53.47 1uk8 n ARG 241 Cb 0.46 -2.72 -0.09 0.00 -1.02 0.00 0.00 32.46 29.09 1uk8 n ARG 241 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1uk8 s ALA 242 N -0.21 2.94 0.02 7.54 0.00 -1.23 -0.23 121.76 130.59 1uk8 s ALA 242 Ca 0.55 -1.67 0.02 0.00 0.00 0.00 0.00 51.96 50.87 1uk8 s ALA 242 Cb 0.17 -0.59 -0.01 0.00 0.00 0.00 0.00 23.12 22.69 1uk8 s ALA 242 CO -0.07 0.33 -0.08 -0.65 0.00 0.00 0.00 175.76 175.29 1uk8 s GLN 243 N -3.33 0.58 -0.07 0.00 -0.21 -0.46 -4.95 119.66 111.21 1uk8 s GLN 243 Ca 0.28 -0.48 0.04 0.00 0.02 0.00 0.00 55.36 55.22 1uk8 s GLN 243 Cb -0.07 -0.49 -0.00 0.00 1.00 0.00 0.00 33.01 33.45 1uk8 s GLN 243 CO 0.17 0.12 -0.21 -1.17 -2.12 0.00 0.00 175.29 172.07 1uk8 s LEU 244 N -0.78 1.99 -0.18 2.90 2.96 -1.26 -0.26 118.68 124.05 1uk8 s LEU 244 Ca -0.02 -0.47 -0.00 0.00 -0.22 0.00 0.00 54.13 53.42 1uk8 s LEU 244 Cb -0.06 -1.24 0.04 0.00 0.50 0.00 0.00 46.19 45.44 1uk8 s LEU 244 CO 0.00 0.17 -0.06 -2.28 -1.32 0.00 0.00 176.35 172.85 1uk8 s HIS 245 N 0.18 1.91 -0.18 5.38 5.65 0.74 -4.96 115.29 124.00 1uk8 s HIS 245 Ca -0.11 -1.24 -0.05 0.00 0.25 0.00 0.00 55.06 53.91 1uk8 s HIS 245 Cb -0.15 -1.41 -0.03 0.00 -1.18 0.00 0.00 32.58 29.81 1uk8 s HIS 245 CO 0.05 -0.66 -0.00 0.08 -0.65 0.00 0.00 174.74 173.57 1uk8 s VAL 246 N 1.57 4.09 -0.27 0.89 1.01 -1.26 -2.02 120.40 124.40 1uk8 s VAL 246 Ca -0.00 -0.28 -0.12 0.00 0.00 0.00 0.00 61.98 61.58 1uk8 s VAL 246 Cb -0.16 -2.83 -0.05 0.00 0.00 0.00 0.00 36.38 33.35 1uk8 s VAL 246 CO -0.08 0.46 0.26 -0.36 0.00 0.00 0.00 175.10 175.37 1uk8 s PHE 247 N 0.65 3.25 0.65 5.22 0.08 -0.13 -4.90 117.98 122.78 1uk8 s PHE 247 Ca -0.00 0.25 -0.12 0.00 0.12 0.00 0.00 56.93 57.17 1uk8 s PHE 247 Cb -0.14 -2.44 -0.02 0.00 -0.57 0.00 0.00 43.02 39.86 1uk8 s PHE 247 CO 0.02 -0.15 1.05 0.20 -0.10 0.00 0.00 175.22 176.24 1uk8 s GLY 248 N 1.60 1.79 -1.28 4.36 0.00 -1.26 -0.95 107.32 111.58 1uk8 s GLY 248 Ca 0.10 0.13 -0.00 0.00 0.00 0.00 0.00 44.72 44.95 1uk8 s GLY 248 CO 0.10 0.43 0.78 0.54 0.00 0.00 0.00 173.10 174.95 1uk8 n ARG 249 N -2.72 -5.38 -3.70 2.90 1.74 -1.26 -4.88 116.66 103.36 1uk8 n ARG 249 Ca 0.07 0.68 -0.13 0.00 -0.77 0.00 0.00 57.85 57.71 1uk8 n ARG 249 Cb 0.53 -5.37 -0.09 0.00 -1.02 0.00 0.00 32.46 26.52 1uk8 n ARG 249 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1uk8 n GLY 251 N 2.98 1.39 0.72 0.00 0.00 -1.26 -1.57 105.19 107.44 1uk8 n GLY 251 Ca -0.14 -0.96 0.10 0.00 0.00 0.00 0.00 46.02 45.01 1uk8 n GLY 251 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1uk8 n HIS 252 N 0.00 0.33 -1.91 1.61 -0.00 0.54 -3.65 115.22 112.14 1uk8 n HIS 252 Ca 0.00 -0.17 -0.22 0.00 0.46 0.00 0.00 57.72 57.80 1uk8 n HIS 252 Cb 0.00 0.00 0.05 0.00 -0.12 0.00 0.00 29.99 29.92 1uk8 n HIS 252 CO 0.00 0.00 0.00 1.87 0.46 0.00 0.00 176.34 178.67 1uk8 n TRP 253 N 0.65 2.49 -0.33 1.57 -0.00 -1.11 -4.91 117.44 115.80 1uk8 n TRP 253 Ca 0.16 -2.20 0.15 0.00 -0.00 0.00 0.00 57.50 55.62 1uk8 n TRP 253 Cb 0.39 -0.42 0.31 0.00 -0.00 0.00 0.00 31.31 31.59 1uk8 n TRP 253 CO 0.00 0.00 0.00 1.15 -0.00 0.00 0.00 177.69 178.84 1uk8 h THR 254 N 1.95 0.07 0.00 5.87 2.02 -1.90 0.16 112.91 121.08 1uk8 h THR 254 Ca 0.35 -0.01 0.00 0.00 0.77 0.00 0.00 66.41 67.52 1uk8 h THR 254 Cb 1.44 0.03 0.00 0.00 -1.74 0.00 0.00 68.15 67.88 1uk8 h THR 254 CO 0.75 0.01 0.00 0.06 0.37 0.00 0.00 175.52 176.70 1uk8 h GLN 255 N 0.04 0.00 0.00 6.66 -0.00 -1.91 -0.37 115.11 119.54 1uk8 h GLN 255 Ca 0.60 0.00 -0.31 0.00 -0.00 0.00 0.00 58.65 58.94 1uk8 h GLN 255 Cb 1.27 0.00 -0.06 0.00 -0.00 0.00 0.00 27.48 28.70 1uk8 h GLN 255 CO -0.86 0.00 -2.17 -0.89 -0.00 0.00 0.00 178.83 174.91 1uk8 n ILE 256 N -3.07 1.17 -0.03 1.86 2.08 0.30 -3.70 119.36 117.98 1uk8 n ILE 256 Ca -0.01 -0.52 -0.16 0.00 0.56 0.00 0.00 62.75 62.61 1uk8 n ILE 256 Cb 0.17 -1.06 -0.06 0.00 -0.75 0.00 0.00 39.64 37.95 1uk8 n ILE 256 CO 0.00 0.00 0.00 -0.33 0.56 0.00 0.00 176.55 176.78 1uk8 h GLU 257 N 0.00 0.79 -1.25 0.38 5.08 -0.72 -3.32 114.58 115.54 1uk8 h GLU 257 Ca -0.46 -0.61 -0.52 0.00 -1.00 0.00 0.00 59.36 56.77 1uk8 h GLU 257 Cb 1.80 0.12 -0.42 0.00 0.50 0.00 0.00 28.75 30.75 1uk8 h GLU 257 CO -0.05 1.23 -0.86 1.04 -1.00 0.00 0.00 179.01 179.37 1uk8 n GLN 258 N -3.94 2.92 -0.21 2.33 1.13 -0.16 -4.96 117.38 114.48 1uk8 n GLN 258 Ca -0.07 -4.16 -0.12 0.00 -1.94 0.00 0.00 57.00 50.72 1uk8 n GLN 258 Cb 0.72 -2.02 -0.09 0.00 0.11 0.00 0.00 30.24 28.96 1uk8 n GLN 258 CO 0.00 0.00 0.00 1.15 -1.44 0.00 0.00 177.06 176.77 1uk8 h THR 259 N 2.75 0.00 -0.67 5.09 2.02 -1.65 0.75 112.91 121.20 1uk8 h THR 259 Ca 0.21 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.41 1uk8 h THR 259 Cb 1.08 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 67.45 1uk8 h THR 259 CO 0.73 0.00 0.43 0.44 0.37 0.00 0.00 175.52 177.49 1uk8 h ASP 260 N -0.23 0.71 -0.35 4.18 3.32 -1.93 0.10 116.42 122.22 1uk8 h ASP 260 Ca 0.09 -0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.10 1uk8 h ASP 260 Cb 0.48 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.85 1uk8 h ASP 260 CO -0.65 0.50 0.09 0.03 -1.72 0.00 0.00 179.24 177.49 1uk8 h ARG 261 N 0.85 0.56 0.09 3.56 3.08 -1.89 -1.92 114.38 118.72 1uk8 h ARG 261 Ca 0.26 -0.13 -0.00 0.00 0.07 0.00 0.00 59.98 60.18 1uk8 h ARG 261 Cb -0.01 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 29.96 1uk8 h ARG 261 CO -0.09 0.61 -0.04 0.35 -1.07 0.00 0.00 179.97 179.72 1uk8 h PHE 262 N 0.42 -0.12 -0.74 3.04 3.57 -0.45 -1.45 116.94 121.21 1uk8 h PHE 262 Ca 0.11 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.61 1uk8 h PHE 262 Cb 0.29 0.04 -0.04 0.00 2.79 0.00 0.00 35.95 39.03 1uk8 h PHE 262 CO 0.01 -0.07 0.46 -0.91 -2.23 0.00 0.00 178.31 175.57 1uk8 h ASN 263 N -0.13 0.89 -0.28 0.41 2.35 -0.77 -0.96 115.58 117.09 1uk8 h ASN 263 Ca -0.01 -0.05 -0.01 0.00 -0.55 0.00 0.00 56.30 55.68 1uk8 h ASN 263 Cb 0.10 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.23 1uk8 h ASN 263 CO 0.02 0.68 0.15 0.03 -1.65 0.00 0.00 177.43 176.66 1uk8 h ARG 264 N 1.02 0.39 -0.23 0.81 3.08 -1.21 -0.81 114.38 117.42 1uk8 h ARG 264 Ca 0.27 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.27 1uk8 h ARG 264 Cb -0.05 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 29.91 1uk8 h ARG 264 CO -0.05 0.34 0.15 -0.07 -1.07 0.00 0.00 179.97 179.27 1uk8 h LEU 265 N 0.33 0.27 -0.24 3.04 3.38 -0.96 -1.88 115.31 119.25 1uk8 h LEU 265 Ca 0.10 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 1uk8 h LEU 265 Cb 0.07 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1uk8 h LEU 265 CO -0.02 0.21 0.01 0.58 0.09 0.00 0.00 178.44 179.31 1uk8 h VAL 266 N 0.30 1.25 -0.31 1.22 2.07 -1.09 -1.25 116.25 118.44 1uk8 h VAL 266 Ca 0.08 -0.88 -0.00 0.00 0.82 0.00 0.00 66.70 66.72 1uk8 h VAL 266 Cb -0.01 1.36 -0.02 0.00 -1.52 0.00 0.00 31.29 31.10 1uk8 h VAL 266 CO -0.02 0.27 0.19 0.58 0.02 0.00 0.00 177.57 178.62 1uk8 h VAL 267 N 0.19 1.11 -0.26 2.57 2.07 -1.11 -1.17 116.25 119.66 1uk8 h VAL 267 Ca 0.07 -0.26 -0.06 0.00 0.82 0.00 0.00 66.70 67.26 1uk8 h VAL 267 Cb 0.40 0.72 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 1uk8 h VAL 267 CO 0.01 0.11 -0.12 -0.33 0.02 0.00 0.00 177.57 177.26 1uk8 h GLU 268 N 0.40 0.42 -0.31 1.57 5.08 -1.33 0.13 114.58 120.54 1uk8 h GLU 268 Ca 0.11 -0.11 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 1uk8 h GLU 268 Cb 0.01 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 1uk8 h GLU 268 CO -0.02 0.55 0.11 0.35 -1.00 0.00 0.00 179.01 178.99 1uk8 h PHE 269 N 0.40 0.49 -0.10 4.33 3.57 -0.77 -2.44 116.94 122.41 1uk8 h PHE 269 Ca 0.08 -0.04 -0.16 0.00 3.53 0.00 0.00 57.97 61.37 1uk8 h PHE 269 Cb 0.45 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 39.04 1uk8 h PHE 269 CO 0.01 0.49 -0.63 0.74 -2.23 0.00 0.00 178.31 176.69 1uk8 h PHE 270 N 0.35 0.49 -0.19 0.41 0.04 -0.88 -2.98 116.94 114.17 1uk8 h PHE 270 Ca 0.10 -0.19 0.04 0.00 2.80 0.00 0.00 57.97 60.72 1uk8 h PHE 270 Cb 0.22 -0.08 -0.01 0.00 2.20 0.00 0.00 35.95 38.28 1uk8 h PHE 270 CO 0.00 0.90 0.13 -0.91 -0.60 0.00 0.00 178.31 177.84 1uk8 h ASN 271 N 0.28 0.05 -0.28 2.17 -0.26 -0.53 -1.41 115.58 115.59 1uk8 h ASN 271 Ca -0.01 -0.00 -0.00 0.00 -0.56 0.00 0.00 56.30 55.73 1uk8 h ASN 271 Cb 1.17 -0.01 -0.01 0.00 -1.06 0.00 0.00 38.32 38.40 1uk8 h ASN 271 CO 0.11 0.03 0.18 -0.08 -1.06 0.00 0.00 177.43 176.61 1uk8 h GLU 272 N 0.06 0.39 0.00 0.81 4.81 -1.28 -3.51 114.58 115.86 1uk8 h GLU 272 Ca 0.09 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 1uk8 h GLU 272 Cb 0.28 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.57 1uk8 h GLU 272 CO -0.01 0.28 0.00 0.00 -0.73 0.00 0.00 179.01 178.55