#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x08 n PRO 14 N 0.00 0.00 -1.41 3.23 -0.02 -1.18 -4.51 135.00 131.11 1x08 n PRO 14 Ca 0.00 0.00 -0.57 0.00 -2.02 0.00 0.00 63.50 60.91 1x08 n PRO 14 Cb 0.00 -0.31 -0.09 0.00 -0.02 0.00 0.00 33.50 33.08 1x08 n PRO 14 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1x08 n ALA 15 N 0.77 0.39 -2.71 3.55 0.00 -0.67 0.55 120.51 122.39 1x08 n ALA 15 Ca 0.06 0.14 -0.21 0.00 0.00 0.00 0.00 53.44 53.44 1x08 n ALA 15 Cb -0.01 -2.26 0.01 0.00 0.00 0.00 0.00 19.45 17.19 1x08 n ALA 15 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1x08 n HIS 16 N 7.89 -1.48 -1.13 0.00 8.25 -1.26 -2.45 115.22 125.02 1x08 n HIS 16 Ca 0.45 0.24 -0.05 0.00 -0.26 0.00 0.00 57.72 58.10 1x08 n HIS 16 Cb 0.08 -4.01 -0.02 0.00 1.12 0.00 0.00 29.99 27.16 1x08 n HIS 16 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1x08 n GLY 17 N -1.21 0.71 3.53 -1.41 0.00 0.19 -4.54 105.19 102.46 1x08 n GLY 17 Ca -0.17 -0.43 -0.42 0.00 0.00 0.00 0.00 46.02 45.00 1x08 n GLY 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x08 h ARG 19 N 8.71 0.00 -2.68 0.00 3.08 -1.90 -3.40 114.38 118.19 1x08 h ARG 19 Ca -0.26 0.00 -0.26 0.00 0.07 0.00 0.00 59.98 59.53 1x08 h ARG 19 Cb 1.11 0.00 -0.34 0.00 0.08 0.00 0.00 29.97 30.82 1x08 h ARG 19 CO 0.84 0.71 -0.57 -1.58 -1.07 0.00 0.00 179.97 178.30 1x08 s HIS 20 N -2.67 -0.38 -0.09 3.04 5.04 -1.26 -1.33 115.29 117.65 1x08 s HIS 20 Ca -0.02 0.65 -0.00 0.00 -1.54 0.00 0.00 55.06 54.14 1x08 s HIS 20 Cb 0.09 -0.18 -0.03 0.00 0.04 0.00 0.00 32.58 32.50 1x08 s HIS 20 CO 0.82 -0.47 -0.06 0.08 -2.34 0.00 0.00 174.74 172.78 1x08 s VAL 21 N 2.38 3.79 -0.03 0.89 1.01 -0.86 -0.82 120.40 126.77 1x08 s VAL 21 Ca 0.04 -0.43 0.06 0.00 0.00 0.00 0.00 61.98 61.65 1x08 s VAL 21 Cb -0.14 -2.58 -0.01 0.00 0.00 0.00 0.00 36.38 33.65 1x08 s VAL 21 CO -0.10 0.58 -0.20 0.00 0.00 0.00 0.00 175.10 175.38 1x08 s ALA 22 N -0.57 1.70 -0.06 5.51 0.00 0.13 -0.93 121.76 127.55 1x08 s ALA 22 Ca 0.09 -0.85 0.04 0.00 0.00 0.00 0.00 51.96 51.23 1x08 s ALA 22 Cb -0.12 -0.47 0.00 0.00 0.00 0.00 0.00 23.12 22.54 1x08 s ALA 22 CO 0.02 0.39 -0.17 0.42 0.00 0.00 0.00 175.76 176.42 1x08 s ILE 23 N -0.34 1.44 -0.53 0.00 1.01 0.15 -0.70 121.20 122.22 1x08 s ILE 23 Ca 0.04 -0.69 -0.19 0.00 0.00 0.00 0.00 60.65 59.82 1x08 s ILE 23 Cb -0.09 -1.26 0.07 0.00 0.01 0.00 0.00 42.46 41.19 1x08 s ILE 23 CO 0.00 0.42 0.64 -0.63 0.00 0.00 0.00 174.94 175.37 1x08 s ILE 24 N 0.29 4.87 -1.44 2.92 1.01 0.76 -0.81 121.20 128.80 1x08 s ILE 24 Ca -0.10 -0.63 -0.14 0.00 0.00 0.00 0.00 60.65 59.78 1x08 s ILE 24 Cb -0.14 -4.34 0.04 0.00 0.01 0.00 0.00 42.46 38.03 1x08 s ILE 24 CO 0.04 -0.88 2.19 0.23 0.00 0.00 0.00 174.94 176.52 1x08 n MET 25 N 6.18 2.89 -3.54 2.79 2.81 -1.24 -2.68 117.12 124.33 1x08 n MET 25 Ca -0.07 -2.67 -0.21 0.00 -1.81 0.00 0.00 57.70 52.94 1x08 n MET 25 Cb 0.45 -3.30 -0.03 0.00 -0.71 0.00 0.00 33.22 29.62 1x08 n MET 25 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1x08 s ALA 26 N 3.26 4.10 0.00 3.04 0.00 -1.25 -4.68 121.76 126.23 1x08 s ALA 26 Ca 0.48 -1.87 0.00 0.00 0.00 0.00 0.00 51.96 50.57 1x08 s ALA 26 Cb 0.13 -1.04 0.00 0.00 0.00 0.00 0.00 23.12 22.21 1x08 s ALA 26 CO -0.07 -0.24 0.00 0.41 0.00 0.00 0.00 175.76 175.86 1x08 n GLY 27 N -1.57 0.75 0.31 0.00 0.00 -1.26 -1.54 105.19 101.87 1x08 n GLY 27 Ca 0.04 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.97 1x08 n GLY 27 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1x08 h ASN 28 N 0.00 1.07 -0.09 1.61 2.35 -1.89 -0.22 115.58 118.41 1x08 h ASN 28 Ca 0.00 -0.31 -0.02 0.00 -0.55 0.00 0.00 56.30 55.42 1x08 h ASN 28 Cb 0.00 -0.29 -0.00 0.00 0.05 0.00 0.00 38.32 38.08 1x08 h ASN 28 CO 0.00 1.11 -0.02 1.23 -1.65 0.00 0.00 177.43 178.10 1x08 h GLY 29 N 0.99 0.19 0.64 2.83 0.00 -1.91 -1.58 103.07 104.23 1x08 h GLY 29 Ca 0.17 -0.15 0.08 0.00 0.00 0.00 0.00 47.33 47.43 1x08 h GLY 29 CO 0.03 0.14 0.53 3.21 0.00 0.00 0.00 176.54 180.45 1x08 h ARG 30 N -0.16 0.91 -0.70 4.80 2.47 -1.97 0.22 114.38 119.95 1x08 h ARG 30 Ca 0.02 -0.05 -0.07 0.00 -1.26 0.00 0.00 59.98 58.62 1x08 h ARG 30 Cb 0.43 -0.20 -0.03 0.00 -1.65 0.00 0.00 29.97 28.51 1x08 h ARG 30 CO 0.01 0.60 0.16 2.35 0.56 0.00 0.00 179.97 183.65 1x08 h TRP 31 N 0.93 1.19 -0.09 3.04 7.01 -0.86 -2.20 115.95 124.97 1x08 h TRP 31 Ca 0.40 -0.15 -0.24 0.00 2.11 0.00 0.00 58.89 61.01 1x08 h TRP 31 Cb 0.26 -0.33 0.01 0.00 -2.10 0.00 0.00 29.16 27.00 1x08 h TRP 31 CO -0.04 0.97 -0.87 0.00 -2.79 0.00 0.00 178.44 175.71 1x08 h ALA 32 N 1.08 0.22 -0.72 2.65 0.00 -0.87 -3.30 119.26 118.33 1x08 h ALA 32 Ca 0.22 -0.64 -0.02 0.00 0.00 0.00 0.00 54.91 54.47 1x08 h ALA 32 Cb 0.38 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 1x08 h ALA 32 CO 0.00 0.67 0.36 -0.22 0.00 0.00 0.00 179.25 180.06 1x08 h LYS 33 N 0.46 1.01 0.00 0.00 3.64 -0.47 0.59 116.57 121.80 1x08 h LYS 33 Ca -0.08 -0.13 -0.00 0.00 -1.27 0.00 0.00 60.65 59.17 1x08 h LYS 33 Cb 1.52 -0.19 -0.00 0.00 -0.41 0.00 0.00 32.23 33.14 1x08 h LYS 33 CO 0.18 0.77 -0.00 0.87 -2.27 0.00 0.00 179.45 178.99 1x08 h LYS 34 N 1.01 0.00 -0.42 1.90 1.57 -1.47 -0.54 116.57 118.62 1x08 h LYS 34 Ca 0.25 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.03 1x08 h LYS 34 Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.39 1x08 h LYS 34 CO -0.04 0.00 0.00 1.04 -0.57 0.00 0.00 179.45 179.88 1x08 n GLN 35 N -3.14 2.90 -1.19 3.15 6.02 -0.64 -4.97 117.38 119.50 1x08 n GLN 35 Ca -0.03 -2.26 -0.02 0.00 -0.01 0.00 0.00 57.00 54.68 1x08 n GLN 35 Cb 0.08 -1.39 -0.01 0.00 1.02 0.00 0.00 30.24 29.93 1x08 n GLN 35 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1x08 n GLY 36 N 0.67 0.51 3.59 1.08 0.00 -0.21 -5.04 105.19 105.79 1x08 n GLY 36 Ca 0.15 -0.96 -0.25 0.00 0.00 0.00 0.00 46.02 44.96 1x08 n GLY 36 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x08 s LYS 37 N -2.43 1.95 0.64 1.61 1.02 0.11 -4.98 119.74 117.65 1x08 s LYS 37 Ca 0.00 -1.83 -0.09 0.00 0.02 0.00 0.00 55.97 54.07 1x08 s LYS 37 Cb 0.00 -1.82 0.01 0.00 -0.52 0.00 0.00 37.83 35.49 1x08 s LYS 37 CO 0.00 0.15 0.99 0.96 -0.92 0.00 0.00 175.35 176.53 1x08 s ILE 38 N -2.56 3.73 0.28 2.17 -4.36 -1.26 -3.07 121.20 116.13 1x08 s ILE 38 Ca 0.34 0.29 0.02 0.00 -0.26 0.00 0.00 60.65 61.04 1x08 s ILE 38 Cb 0.01 -3.52 0.28 0.00 1.25 0.00 0.00 42.46 40.48 1x08 s ILE 38 CO 0.18 -0.61 1.79 0.03 0.24 0.00 0.00 174.94 176.57 1x08 h ARG 39 N -0.38 0.78 -0.60 0.37 3.08 -1.90 -1.62 114.38 114.12 1x08 h ARG 39 Ca -0.45 -0.05 0.07 0.00 0.07 0.00 0.00 59.98 59.62 1x08 h ARG 39 Cb 1.25 -0.18 -0.04 0.00 0.08 0.00 0.00 29.97 31.08 1x08 h ARG 39 CO 0.62 0.52 0.40 0.00 -1.07 0.00 0.00 179.97 180.44 1x08 h ALA 40 N 1.58 1.87 -0.39 0.04 0.00 -1.93 -0.15 119.26 120.28 1x08 h ALA 40 Ca 0.51 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 55.31 1x08 h ALA 40 Cb 0.68 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 1x08 h ALA 40 CO -0.33 0.02 -0.15 0.35 0.00 0.00 0.00 179.25 179.14 1x08 h PHE 41 N 0.54 0.78 -0.11 0.00 3.57 -1.67 -2.11 116.94 117.94 1x08 h PHE 41 Ca 0.27 -0.15 -0.18 0.00 3.53 0.00 0.00 57.97 61.44 1x08 h PHE 41 Cb 0.36 -0.20 -0.00 0.00 2.79 0.00 0.00 35.95 38.90 1x08 h PHE 41 CO -0.00 0.81 -0.70 0.78 -2.23 0.00 0.00 178.31 176.97 1x08 h GLY 42 N 0.98 0.53 1.17 2.40 0.00 -1.09 -1.97 103.07 105.08 1x08 h GLY 42 Ca 0.10 -0.72 -0.08 0.00 0.00 0.00 0.00 47.33 46.63 1x08 h GLY 42 CO 0.04 0.64 0.05 0.45 0.00 0.00 0.00 176.54 177.73 1x08 h HIS 43 N 0.34 1.08 -0.33 5.60 3.86 -0.93 0.31 115.15 125.07 1x08 h HIS 43 Ca -0.03 -0.16 -0.02 0.00 -1.16 0.00 0.00 60.37 59.00 1x08 h HIS 43 Cb 1.28 -0.29 -0.01 0.00 1.06 0.00 0.00 27.41 29.44 1x08 h HIS 43 CO 0.05 0.94 0.12 -0.22 0.86 0.00 0.00 177.93 179.67 1x08 h LYS 44 N 0.94 0.51 0.00 2.45 3.64 -1.29 -1.33 116.57 121.49 1x08 h LYS 44 Ca 0.18 -0.10 -0.04 0.00 -1.27 0.00 0.00 60.65 59.42 1x08 h LYS 44 Cb 0.47 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 1x08 h LYS 44 CO 0.02 0.53 -0.19 0.00 -2.27 0.00 0.00 179.45 177.54 1x08 h ALA 45 N 0.96 1.66 -0.40 5.00 0.00 -1.07 -1.69 119.26 123.70 1x08 h ALA 45 Ca 0.11 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 1x08 h ALA 45 Cb 0.22 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 1x08 h ALA 45 CO -0.01 0.23 0.17 0.78 0.00 0.00 0.00 179.25 180.43 1x08 h GLY 46 N 0.59 0.61 1.33 0.00 0.00 0.70 -1.63 103.07 104.66 1x08 h GLY 46 Ca -0.00 -0.28 0.05 0.00 0.00 0.00 0.00 47.33 47.10 1x08 h GLY 46 CO 0.02 0.27 0.33 0.00 0.00 0.00 0.00 176.54 177.16 1x08 h ALA 47 N 1.62 1.86 -0.47 3.60 0.00 -0.53 -1.72 119.26 123.62 1x08 h ALA 47 Ca 0.14 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 1x08 h ALA 47 Cb 0.10 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1x08 h ALA 47 CO -0.02 0.06 -0.08 0.87 0.00 0.00 0.00 179.25 180.08 1x08 h LYS 48 N 0.48 0.85 -0.26 0.00 1.57 -1.37 -2.31 116.57 115.53 1x08 h LYS 48 Ca 0.21 -0.28 -0.07 0.00 -1.87 0.00 0.00 60.65 58.64 1x08 h LYS 48 Cb 0.23 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 1x08 h LYS 48 CO -0.06 0.90 -0.15 0.77 -0.57 0.00 0.00 179.45 180.34 1x08 h SER 49 N 0.77 0.43 -0.25 0.86 0.02 -1.39 -2.16 113.55 111.83 1x08 h SER 49 Ca 0.13 -0.11 -0.00 0.00 -0.84 0.00 0.00 61.79 60.97 1x08 h SER 49 Cb 0.58 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 63.00 1x08 h SER 49 CO 0.04 0.61 0.15 0.58 -1.14 0.00 0.00 176.83 177.06 1x08 h VAL 50 N 0.41 1.09 -0.41 2.27 2.07 -0.94 -0.42 116.25 120.32 1x08 h VAL 50 Ca 0.07 -0.21 0.05 0.00 0.82 0.00 0.00 66.70 67.43 1x08 h VAL 50 Cb 0.51 0.78 -0.04 0.00 -1.52 0.00 0.00 31.29 31.02 1x08 h VAL 50 CO 0.03 0.09 0.15 -0.09 0.02 0.00 0.00 177.57 177.77 1x08 h ARG 51 N 0.31 0.31 -0.74 1.57 2.43 -1.00 -0.37 114.38 116.88 1x08 h ARG 51 Ca 0.09 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.23 1x08 h ARG 51 Cb 0.01 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 29.46 1x08 h ARG 51 CO -0.02 0.20 0.41 0.00 -1.51 0.00 0.00 179.97 179.06 1x08 h ARG 52 N 0.31 1.04 -0.44 0.20 3.08 -1.24 -1.45 114.38 115.88 1x08 h ARG 52 Ca 0.19 -0.12 -0.09 0.00 0.07 0.00 0.00 59.98 60.03 1x08 h ARG 52 Cb 0.16 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.00 1x08 h ARG 52 CO -0.19 0.77 -0.06 0.00 -1.07 0.00 0.00 179.97 179.42 1x08 h ALA 53 N 1.21 0.61 -0.38 0.04 0.00 -0.63 -0.81 119.26 119.30 1x08 h ALA 53 Ca 0.26 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1x08 h ALA 53 Cb 0.03 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1x08 h ALA 53 CO -0.04 0.45 0.17 0.28 0.00 0.00 0.00 179.25 180.11 1x08 h VAL 54 N 0.66 1.18 -0.38 0.00 2.07 -0.97 0.10 116.25 118.91 1x08 h VAL 54 Ca 0.12 -0.54 -0.00 0.00 0.82 0.00 0.00 66.70 67.10 1x08 h VAL 54 Cb 0.58 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 31.16 1x08 h VAL 54 CO 0.03 0.20 0.22 -1.28 0.02 0.00 0.00 177.57 176.76 1x08 h SER 55 N 0.47 0.46 -0.23 0.57 0.87 -1.17 -0.33 113.55 114.19 1x08 h SER 55 Ca 0.13 -0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.62 1x08 h SER 55 Cb 0.15 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 61.98 1x08 h SER 55 CO -0.01 0.40 0.15 0.15 -0.53 0.00 0.00 176.83 176.99 1x08 h PHE 56 N 0.49 0.29 0.23 2.24 3.57 -0.98 -0.78 116.94 122.01 1x08 h PHE 56 Ca 0.14 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.63 1x08 h PHE 56 Cb 0.03 -0.10 0.00 0.00 2.79 0.00 0.00 35.95 38.67 1x08 h PHE 56 CO -0.03 0.19 -0.11 0.00 -2.23 0.00 0.00 178.31 176.13 1x08 h ALA 57 N 1.08 -0.31 -0.54 2.41 0.00 -0.83 -1.87 119.26 119.20 1x08 h ALA 57 Ca 0.08 -0.08 0.04 0.00 0.00 0.00 0.00 54.91 54.95 1x08 h ALA 57 Cb -0.03 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 1x08 h ALA 57 CO -0.02 -0.65 0.36 0.00 0.00 0.00 0.00 179.25 178.93 1x08 h ALA 58 N 0.42 1.78 -0.00 0.00 0.00 -0.96 -2.42 119.26 118.08 1x08 h ALA 58 Ca -0.03 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1x08 h ALA 58 Cb 0.27 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1x08 h ALA 58 CO 0.05 0.15 -0.17 0.09 0.00 0.00 0.00 179.25 179.37 1x08 n ASN 59 N -4.47 0.36 -0.53 0.00 5.03 -0.31 -3.90 115.26 111.44 1x08 n ASN 59 Ca 0.07 -0.23 0.06 0.00 0.87 0.00 0.00 54.58 55.35 1x08 n ASN 59 Cb 0.18 -0.11 0.19 0.00 -1.02 0.00 0.00 39.78 39.01 1x08 n ASN 59 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 1x08 n ASN 60 N -1.21 2.33 -0.60 6.41 3.02 -0.72 -4.99 115.26 119.51 1x08 n ASN 60 Ca 0.11 -3.48 -0.08 0.00 -0.03 0.00 0.00 54.58 51.10 1x08 n ASN 60 Cb 0.31 -0.51 -0.03 0.00 -0.61 0.00 0.00 39.78 38.93 1x08 n ASN 60 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1x08 n GLY 61 N -1.17 0.91 3.74 7.41 0.00 -1.19 -1.67 105.19 113.22 1x08 n GLY 61 Ca 0.20 -0.28 -0.41 0.00 0.00 0.00 0.00 46.02 45.54 1x08 n GLY 61 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1x08 s ILE 62 N -2.06 3.76 0.08 -0.61 1.01 -1.02 -3.09 121.20 119.28 1x08 s ILE 62 Ca 0.00 1.52 -0.10 0.00 0.00 0.00 0.00 60.65 62.07 1x08 s ILE 62 Cb 0.00 -3.97 -0.25 0.00 0.01 0.00 0.00 42.46 38.25 1x08 s ILE 62 CO 0.00 0.26 1.18 -0.33 0.00 0.00 0.00 174.94 176.04 1x08 h GLU 63 N 5.11 0.51 -3.48 2.79 5.08 -1.48 -3.42 114.58 119.69 1x08 h GLU 63 Ca -0.44 -0.65 -0.18 0.00 -1.00 0.00 0.00 59.36 57.09 1x08 h GLU 63 Cb 1.21 0.21 -0.24 0.00 0.50 0.00 0.00 28.75 30.43 1x08 h GLU 63 CO 0.73 1.27 -0.55 0.00 -1.00 0.00 0.00 179.01 179.46 1x08 s ALA 64 N -3.03 -0.30 -0.09 3.43 0.00 -0.94 -0.95 121.76 119.88 1x08 s ALA 64 Ca -0.07 0.13 0.01 0.00 0.00 0.00 0.00 51.96 52.03 1x08 s ALA 64 Cb 0.07 -0.08 0.02 0.00 0.00 0.00 0.00 23.12 23.13 1x08 s ALA 64 CO 0.91 -0.12 -0.08 -1.17 0.00 0.00 0.00 175.76 175.29 1x08 s LEU 65 N -0.54 1.31 -0.18 0.00 2.96 -0.33 -2.03 118.68 119.87 1x08 s LEU 65 Ca -0.06 -0.26 0.01 0.00 -0.22 0.00 0.00 54.13 53.59 1x08 s LEU 65 Cb -0.04 -0.76 0.03 0.00 0.50 0.00 0.00 46.19 45.92 1x08 s LEU 65 CO 0.01 -0.06 -0.16 -0.89 -1.32 0.00 0.00 176.35 173.92 1x08 s THR 66 N 1.27 1.87 -0.13 3.68 2.01 -0.11 -0.82 115.64 123.41 1x08 s THR 66 Ca -0.04 -0.91 -0.00 0.00 0.31 0.00 0.00 61.69 61.05 1x08 s THR 66 Cb -0.14 -1.76 -0.02 0.00 0.01 0.00 0.00 72.50 70.60 1x08 s THR 66 CO -0.03 0.43 -0.12 -0.76 -0.69 0.00 0.00 174.62 173.45 1x08 s LEU 67 N 1.35 2.78 -0.53 4.42 1.43 0.00 0.32 118.68 128.46 1x08 s LEU 67 Ca 0.03 -0.29 -0.23 0.00 -1.03 0.00 0.00 54.13 52.60 1x08 s LEU 67 Cb -0.14 -1.63 0.04 0.00 0.03 0.00 0.00 46.19 44.49 1x08 s LEU 67 CO -0.11 0.18 0.88 -0.47 0.23 0.00 0.00 176.35 177.06 1x08 s TYR 68 N 0.27 2.86 -0.06 0.29 6.04 0.01 -1.10 117.35 125.66 1x08 s TYR 68 Ca -0.09 -0.02 0.14 0.00 0.04 0.00 0.00 57.07 57.14 1x08 s TYR 68 Cb -0.15 -3.95 -0.21 0.00 -1.04 0.00 0.00 41.96 36.61 1x08 s TYR 68 CO 0.05 -1.25 0.23 0.00 -1.54 0.00 0.00 175.55 173.05 1x08 n ALA 69 N 7.19 2.25 -3.15 3.97 0.00 -0.43 -3.67 120.51 126.66 1x08 n ALA 69 Ca 0.01 -0.55 0.04 0.00 0.00 0.00 0.00 53.44 52.95 1x08 n ALA 69 Cb 0.47 -0.35 -0.01 0.00 0.00 0.00 0.00 19.45 19.56 1x08 n ALA 69 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1x08 s PHE 70 N -2.80 -1.30 0.57 0.00 2.19 -0.95 -4.98 117.98 110.70 1x08 s PHE 70 Ca -0.06 1.39 -0.14 0.00 0.33 0.00 0.00 56.93 58.45 1x08 s PHE 70 Cb 0.08 0.46 -0.05 0.00 -1.31 0.00 0.00 43.02 42.20 1x08 s PHE 70 CO 0.61 -0.71 1.01 0.45 1.83 0.00 0.00 175.22 178.41 1x08 s SER 71 N 2.89 6.28 0.09 6.13 0.15 -1.26 0.46 113.70 128.44 1x08 s SER 71 Ca 0.15 1.57 0.18 0.00 0.70 0.00 0.00 55.95 58.55 1x08 s SER 71 Cb -0.14 -2.50 0.76 0.00 -1.71 0.00 0.00 66.02 62.43 1x08 s SER 71 CO -0.18 -0.83 1.56 -1.54 1.20 0.00 0.00 173.24 173.45 1x08 n SER 72 N -2.10 0.24 0.03 5.45 3.41 -0.88 -1.51 113.62 118.25 1x08 n SER 72 Ca 0.07 0.56 0.12 0.00 -0.26 0.00 0.00 58.87 59.36 1x08 n SER 72 Cb 0.54 -0.61 0.25 0.00 -0.26 0.00 0.00 64.21 64.12 1x08 n SER 72 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 1x08 n GLU 73 N -1.76 0.13 0.00 4.33 0.28 -1.26 -3.99 120.64 118.37 1x08 n GLU 73 Ca 0.03 0.04 0.07 0.00 -0.16 0.00 0.00 57.16 57.14 1x08 n GLU 73 Cb 0.20 -1.58 0.42 0.00 1.43 0.00 0.00 31.44 31.91 1x08 n GLU 73 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 1x08 n ASN 74 N -1.77 0.00 0.26 -1.84 5.03 -0.57 -2.47 115.26 113.90 1x08 n ASN 74 Ca 0.05 -0.78 0.15 0.00 0.87 0.00 0.00 54.58 54.87 1x08 n ASN 74 Cb 0.38 0.00 0.63 0.00 -1.02 0.00 0.00 39.78 39.77 1x08 n ASN 74 CO 0.00 0.00 0.00 -0.50 -1.83 0.00 0.00 177.26 174.93 1x08 h TRP 75 N 0.00 0.00 -0.17 3.10 4.06 -1.76 -2.47 115.95 118.71 1x08 h TRP 75 Ca 0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 1x08 h TRP 75 Cb 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.16 1x08 h TRP 75 CO 0.00 0.05 0.00 0.27 -3.56 0.00 0.00 178.44 175.20 1x08 n ASN 76 N -3.17 1.06 -4.70 -3.49 0.23 -1.03 -4.86 115.26 99.30 1x08 n ASN 76 Ca 0.00 -1.88 -0.29 0.00 -0.53 0.00 0.00 54.58 51.88 1x08 n ASN 76 Cb 0.33 -0.12 0.13 0.00 -2.08 0.00 0.00 39.78 38.05 1x08 n ASN 76 CO 0.00 0.00 0.00 -0.13 -0.93 0.00 0.00 177.26 176.20 1x08 s ARG 77 N -1.77 1.29 0.27 -3.83 1.81 -0.93 -4.93 118.95 110.86 1x08 s ARG 77 Ca 0.19 0.10 -0.31 0.00 -1.72 0.00 0.00 55.73 53.99 1x08 s ARG 77 Cb 0.10 -1.87 -0.12 0.00 -0.45 0.00 0.00 34.95 32.60 1x08 s ARG 77 CO 0.14 -2.06 1.57 -2.30 -0.68 0.00 0.00 175.30 171.97 1x08 n PRO 78 N -3.63 2.56 -0.32 3.54 -0.02 -1.26 -4.76 135.00 131.10 1x08 n PRO 78 Ca 0.09 0.91 0.21 0.00 -2.02 0.00 0.00 63.50 62.69 1x08 n PRO 78 Cb 0.60 -2.68 0.41 0.00 -0.02 0.00 0.00 33.50 31.81 1x08 n PRO 78 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1x08 h ALA 79 N 4.92 1.61 0.00 3.55 0.00 -1.92 0.47 119.26 127.89 1x08 h ALA 79 Ca -0.46 0.28 -0.11 0.00 0.00 0.00 0.00 54.91 54.62 1x08 h ALA 79 Cb 1.23 0.40 -0.02 0.00 0.00 0.00 0.00 17.79 19.41 1x08 h ALA 79 CO 0.81 -0.67 -0.52 -0.56 0.00 0.00 0.00 179.25 178.30 1x08 h GLN 80 N 0.09 0.00 -0.17 0.00 -0.00 -1.99 -0.02 115.11 113.01 1x08 h GLN 80 Ca 0.69 0.00 -0.11 0.00 -0.00 0.00 0.00 58.65 59.22 1x08 h GLN 80 Cb 1.59 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 29.07 1x08 h GLN 80 CO -0.78 0.52 -0.34 1.49 -0.00 0.00 0.00 178.83 179.73 1x08 h GLU 81 N 0.00 0.53 0.07 0.06 4.81 -0.46 -1.85 114.58 117.73 1x08 h GLU 81 Ca -0.01 -0.34 -0.00 0.00 -0.13 0.00 0.00 59.36 58.88 1x08 h GLU 81 Cb 1.00 0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.42 1x08 h GLU 81 CO 0.07 0.95 -0.03 0.28 -0.73 0.00 0.00 179.01 179.55 1x08 h VAL 82 N 0.17 1.02 -0.56 0.32 2.07 -0.99 -1.58 116.25 116.71 1x08 h VAL 82 Ca 0.01 -0.29 0.05 0.00 0.82 0.00 0.00 66.70 67.28 1x08 h VAL 82 Cb 0.93 1.21 -0.05 0.00 -1.52 0.00 0.00 31.29 31.87 1x08 h VAL 82 CO 0.07 0.07 0.30 0.28 0.02 0.00 0.00 177.57 178.31 1x08 h SER 83 N -0.22 0.43 -0.62 0.57 0.02 -1.06 -0.11 113.55 112.57 1x08 h SER 83 Ca -0.01 0.03 0.04 0.00 -0.84 0.00 0.00 61.79 61.01 1x08 h SER 83 Cb 0.19 -0.06 -0.03 0.00 0.14 0.00 0.00 62.40 62.64 1x08 h SER 83 CO 0.01 0.29 0.41 0.00 -1.14 0.00 0.00 176.83 176.41 1x08 h ALA 84 N 1.29 1.69 -0.21 3.77 0.00 -1.17 -0.35 119.26 124.29 1x08 h ALA 84 Ca 0.25 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.09 1x08 h ALA 84 Cb 0.14 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1x08 h ALA 84 CO -0.16 0.24 -0.03 -0.07 0.00 0.00 0.00 179.25 179.23 1x08 h LEU 85 N 0.71 0.38 -0.82 0.00 3.38 -0.17 -0.58 115.31 118.20 1x08 h LEU 85 Ca 0.25 -0.34 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 1x08 h LEU 85 Cb 0.11 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.72 1x08 h LEU 85 CO -0.07 0.64 0.51 0.24 0.09 0.00 0.00 178.44 179.85 1x08 h MET 86 N 0.12 1.10 0.00 1.13 2.86 -0.37 -1.07 114.93 118.70 1x08 h MET 86 Ca 0.06 -0.09 -0.07 0.00 -2.06 0.00 0.00 59.70 57.53 1x08 h MET 86 Cb 0.46 -0.24 -0.01 0.00 0.06 0.00 0.00 31.60 31.87 1x08 h MET 86 CO 0.02 0.76 -0.34 0.93 1.06 0.00 0.00 176.91 179.34 1x08 h GLU 87 N 1.12 0.00 -0.29 1.72 4.39 -0.90 -1.72 114.58 118.90 1x08 h GLU 87 Ca 0.30 0.00 -0.13 0.00 0.34 0.00 0.00 59.36 59.86 1x08 h GLU 87 Cb -0.07 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.57 1x08 h GLU 87 CO -0.06 0.34 -0.37 1.25 -1.16 0.00 0.00 179.01 179.02 1x08 h LEU 88 N 0.00 0.70 -0.34 1.33 5.85 -0.07 -0.74 115.31 122.04 1x08 h LEU 88 Ca -0.00 -0.30 -0.08 0.00 0.84 0.00 0.00 57.88 58.33 1x08 h LEU 88 Cb 0.63 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.45 1x08 h LEU 88 CO 0.04 1.00 -0.10 -0.26 -0.34 0.00 0.00 178.44 178.79 1x08 h PHE 89 N 0.56 0.76 -0.30 1.25 0.04 -0.77 -0.74 116.94 117.73 1x08 h PHE 89 Ca 0.05 -0.17 -0.00 0.00 2.80 0.00 0.00 57.97 60.65 1x08 h PHE 89 Cb 0.89 -0.18 -0.01 0.00 2.20 0.00 0.00 35.95 38.84 1x08 h PHE 89 CO 0.04 0.84 0.18 0.28 -0.60 0.00 0.00 178.31 179.05 1x08 h VAL 90 N 0.45 1.11 -0.64 -0.55 2.07 -1.21 -0.48 116.25 117.01 1x08 h VAL 90 Ca 0.08 -0.28 0.06 0.00 0.82 0.00 0.00 66.70 67.39 1x08 h VAL 90 Cb 0.61 0.75 -0.05 0.00 -1.52 0.00 0.00 31.29 31.08 1x08 h VAL 90 CO 0.04 0.11 0.35 -0.25 0.02 0.00 0.00 177.57 177.84 1x08 h TRP 91 N 0.38 0.64 -0.54 1.57 7.01 -0.99 -1.31 115.95 122.71 1x08 h TRP 91 Ca 0.11 0.02 -0.11 0.00 2.11 0.00 0.00 58.89 61.03 1x08 h TRP 91 Cb 0.03 -0.19 -0.02 0.00 -2.10 0.00 0.00 29.16 26.88 1x08 h TRP 91 CO -0.04 0.30 -0.09 0.00 -2.79 0.00 0.00 178.44 175.82 1x08 h ALA 92 N 1.34 0.83 0.00 2.65 0.00 -0.77 -0.03 119.26 123.28 1x08 h ALA 92 Ca 0.29 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1x08 h ALA 92 Cb 0.19 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 1x08 h ALA 92 CO -0.19 0.66 -0.08 -0.07 0.00 0.00 0.00 179.25 179.57 1x08 h LEU 93 N 0.89 0.00 0.07 0.00 3.38 -0.22 -0.10 115.31 119.33 1x08 h LEU 93 Ca 0.14 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.81 1x08 h LEU 93 Cb 0.64 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.36 1x08 h LEU 93 CO 0.04 0.08 -1.61 0.44 0.09 0.00 0.00 178.44 177.48 1x08 h ASP 94 N 0.00 0.24 0.14 -0.43 3.32 -0.82 -3.35 116.42 115.52 1x08 h ASP 94 Ca -0.00 -0.40 -0.35 0.00 0.02 0.00 0.00 57.03 56.30 1x08 h ASP 94 Cb 0.33 -0.08 -0.06 0.00 0.22 0.00 0.00 39.33 39.73 1x08 h ASP 94 CO 0.01 1.34 -2.19 -1.54 -1.72 0.00 0.00 179.24 175.14 1x08 n SER 95 N -3.33 0.38 -0.01 6.45 3.41 -0.06 -4.62 113.62 115.84 1x08 n SER 95 Ca -0.17 0.12 0.09 0.00 -0.26 0.00 0.00 58.87 58.65 1x08 n SER 95 Cb 1.04 0.60 -0.13 0.00 -0.26 0.00 0.00 64.21 65.45 1x08 n SER 95 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1x08 n GLU 96 N -2.87 0.67 -0.23 4.33 -0.58 -0.08 -4.60 120.64 117.27 1x08 n GLU 96 Ca -0.29 -0.11 0.01 0.00 -0.42 0.00 0.00 57.16 56.35 1x08 n GLU 96 Cb 1.12 -1.43 0.13 0.00 -0.57 0.00 0.00 31.44 30.68 1x08 n GLU 96 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1x08 h VAL 97 N 0.00 0.85 -0.68 2.62 2.07 -1.70 0.79 116.25 120.20 1x08 h VAL 97 Ca 0.00 -0.20 0.01 0.00 0.82 0.00 0.00 66.70 67.33 1x08 h VAL 97 Cb 0.71 0.23 -0.03 0.00 -1.52 0.00 0.00 31.29 30.67 1x08 h VAL 97 CO 0.00 0.10 0.45 0.11 0.02 0.00 0.00 177.57 178.25 1x08 h LYS 98 N 0.57 0.89 -0.45 1.57 1.79 -1.88 0.14 116.57 119.19 1x08 h LYS 98 Ca 0.33 -0.05 -0.04 0.00 -2.18 0.00 0.00 60.65 58.71 1x08 h LYS 98 Cb 0.35 -0.20 -0.02 0.00 -1.58 0.00 0.00 32.23 30.78 1x08 h LYS 98 CO -0.26 0.59 0.14 1.03 -1.08 0.00 0.00 179.45 179.86 1x08 h SER 99 N 0.91 0.66 -0.79 0.86 0.87 -1.58 0.88 113.55 115.36 1x08 h SER 99 Ca 0.25 -0.21 0.02 0.00 -1.23 0.00 0.00 61.79 60.62 1x08 h SER 99 Cb -0.09 -0.17 -0.04 0.00 -0.44 0.00 0.00 62.40 61.65 1x08 h SER 99 CO -0.06 0.69 0.52 -0.07 -0.53 0.00 0.00 176.83 177.38 1x08 h LEU 100 N 0.59 0.88 -0.16 2.23 3.38 -0.38 -1.01 115.31 120.84 1x08 h LEU 100 Ca 0.15 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 1x08 h LEU 100 Cb 0.27 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 1x08 h LEU 100 CO -0.00 0.62 0.10 -0.74 0.09 0.00 0.00 178.44 178.51 1x08 h HIS 101 N 1.04 0.21 -0.09 1.13 2.76 -0.27 -1.14 115.15 118.79 1x08 h HIS 101 Ca 0.30 0.00 0.01 0.00 -2.20 0.00 0.00 60.37 58.48 1x08 h HIS 101 Cb -0.07 -0.07 -0.00 0.00 1.55 0.00 0.00 27.41 28.82 1x08 h HIS 101 CO -0.02 0.16 0.06 0.00 -1.30 0.00 0.00 177.93 176.83 1x08 h ARG 102 N 0.19 0.10 -0.23 5.26 3.08 -0.26 -2.15 114.38 120.37 1x08 h ARG 102 Ca 0.06 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.10 1x08 h ARG 102 Cb 0.01 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.04 1x08 h ARG 102 CO -0.01 0.07 0.00 0.72 -1.07 0.00 0.00 179.97 179.68 1x08 n HIS 103 N -4.52 0.31 -2.34 3.04 8.25 -0.44 -4.91 115.22 114.60 1x08 n HIS 103 Ca -0.01 -0.15 -0.13 0.00 -0.26 0.00 0.00 57.72 57.16 1x08 n HIS 103 Cb 0.10 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.21 1x08 n HIS 103 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1x08 n ASN 104 N 0.32 -4.18 -4.79 0.41 5.15 -0.81 -4.78 115.26 106.58 1x08 n ASN 104 Ca 0.13 -0.04 -0.38 0.00 -0.60 0.00 0.00 54.58 53.69 1x08 n ASN 104 Cb 0.28 -3.31 -0.06 0.00 -0.53 0.00 0.00 39.78 36.17 1x08 n ASN 104 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1x08 s VAL 105 N -2.71 5.11 -0.31 3.44 1.01 -0.49 -0.48 120.40 125.97 1x08 s VAL 105 Ca 0.04 0.84 -0.11 0.00 0.00 0.00 0.00 61.98 62.74 1x08 s VAL 105 Cb -0.02 -3.73 -0.03 0.00 0.00 0.00 0.00 36.38 32.60 1x08 s VAL 105 CO 0.04 0.48 0.20 -0.60 0.00 0.00 0.00 175.10 175.23 1x08 s ARG 106 N -0.38 3.66 -0.12 2.72 3.52 -0.20 -4.53 118.95 123.62 1x08 s ARG 106 Ca 0.23 -0.52 -0.17 0.00 -0.13 0.00 0.00 55.73 55.15 1x08 s ARG 106 Cb -0.16 -3.70 -0.04 0.00 -1.56 0.00 0.00 34.95 29.49 1x08 s ARG 106 CO 0.11 -0.32 0.42 -1.17 -0.81 0.00 0.00 175.30 173.52 1x08 s LEU 107 N 1.72 4.28 0.01 -0.88 2.96 -1.26 -0.60 118.68 124.91 1x08 s LEU 107 Ca 0.06 0.73 0.02 0.00 -0.22 0.00 0.00 54.13 54.72 1x08 s LEU 107 Cb -0.17 -2.59 -0.01 0.00 0.50 0.00 0.00 46.19 43.92 1x08 s LEU 107 CO 0.10 0.05 -0.07 -0.13 -1.32 0.00 0.00 176.35 174.98 1x08 s ARG 108 N 0.48 0.56 -0.14 1.98 1.81 0.03 -4.46 118.95 119.20 1x08 s ARG 108 Ca 0.23 -0.37 -0.03 0.00 -1.72 0.00 0.00 55.73 53.85 1x08 s ARG 108 Cb -0.15 -0.50 -0.03 0.00 -0.45 0.00 0.00 34.95 33.83 1x08 s ARG 108 CO 0.08 0.13 -0.06 0.42 -0.68 0.00 0.00 175.30 175.20 1x08 s ILE 109 N -0.43 3.72 0.02 1.52 1.09 -1.26 -0.85 121.20 125.01 1x08 s ILE 109 Ca 0.00 -0.43 0.07 0.00 -1.10 0.00 0.00 60.65 59.20 1x08 s ILE 109 Cb -0.04 -2.61 -0.03 0.00 -1.06 0.00 0.00 42.46 38.72 1x08 s ILE 109 CO -0.00 0.51 -0.21 0.27 -0.10 0.00 0.00 174.94 175.41 1x08 s ILE 110 N 0.24 2.58 -2.79 2.92 -4.36 -0.14 -4.92 121.20 114.72 1x08 s ILE 110 Ca -0.04 -1.17 0.00 0.00 -0.26 0.00 0.00 60.65 59.18 1x08 s ILE 110 Cb -0.14 -2.04 0.00 0.00 1.25 0.00 0.00 42.46 41.53 1x08 s ILE 110 CO 0.03 0.40 0.00 0.61 0.24 0.00 0.00 174.94 176.23 1x08 n GLY 111 N 1.80 0.95 3.47 6.27 0.00 -1.26 -0.81 105.19 115.62 1x08 n GLY 111 Ca -0.16 -2.12 -0.44 0.00 0.00 0.00 0.00 46.02 43.30 1x08 n GLY 111 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1x08 s ASP 112 N -0.12 6.81 0.29 1.61 -1.08 -0.36 -4.84 116.67 118.97 1x08 s ASP 112 Ca 0.00 -2.40 0.25 0.00 -0.52 0.00 0.00 52.55 49.88 1x08 s ASP 112 Cb 0.00 -2.42 0.96 0.00 -1.46 0.00 0.00 42.92 40.00 1x08 s ASP 112 CO 0.00 -0.97 1.76 0.71 0.52 0.00 0.00 175.17 177.18 1x08 h THR 113 N 5.42 0.00 0.00 1.71 1.35 -1.87 -3.10 112.91 116.42 1x08 h THR 113 Ca 0.24 -0.35 0.00 0.00 -0.55 0.00 0.00 66.41 65.75 1x08 h THR 113 Cb 0.95 1.19 0.00 0.00 -1.73 0.00 0.00 68.15 68.56 1x08 h THR 113 CO 1.20 0.00 0.00 0.28 -0.25 0.00 0.00 175.52 176.75 1x08 h SER 114 N 0.00 0.00 0.06 5.36 0.02 -1.99 -1.86 113.55 115.15 1x08 h SER 114 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1x08 h SER 114 Cb 0.49 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.03 1x08 h SER 114 CO 0.00 0.00 -0.21 0.54 -1.14 0.00 0.00 176.83 176.02 1x08 n ARG 115 N -2.34 1.42 -2.44 3.45 5.12 -1.17 -4.94 116.66 115.76 1x08 n ARG 115 Ca -0.01 -1.02 -0.26 0.00 -1.93 0.00 0.00 57.85 54.62 1x08 n ARG 115 Cb 0.04 -1.48 0.03 0.00 -1.16 0.00 0.00 32.46 29.89 1x08 n ARG 115 CO 0.00 0.00 0.00 -0.06 -1.93 0.00 0.00 177.63 175.64 1x08 s PHE 116 N -2.28 3.28 0.67 -1.55 0.08 -0.70 -5.05 117.98 112.43 1x08 s PHE 116 Ca 0.27 0.64 -0.16 0.00 0.12 0.00 0.00 56.93 57.80 1x08 s PHE 116 Cb 0.19 -2.68 0.01 0.00 -0.57 0.00 0.00 43.02 39.97 1x08 s PHE 116 CO 0.45 -0.76 1.15 0.54 -0.10 0.00 0.00 175.22 176.50 1x08 s ASN 117 N -4.29 4.83 0.19 1.36 2.20 -1.26 -4.74 114.94 113.23 1x08 s ASN 117 Ca 0.53 2.18 -0.22 0.00 -0.94 0.00 0.00 52.86 54.41 1x08 s ASN 117 Cb -0.10 -2.57 0.11 0.00 -2.00 0.00 0.00 41.25 36.68 1x08 s ASN 117 CO 0.45 -1.82 1.57 0.28 -2.94 0.00 0.00 177.10 174.63 1x08 h SER 118 N 0.08 -1.40 -0.81 3.54 0.02 -1.97 0.09 113.55 113.12 1x08 h SER 118 Ca -0.48 0.26 0.01 0.00 -0.84 0.00 0.00 61.79 60.74 1x08 h SER 118 Cb 1.27 0.67 -0.04 0.00 0.14 0.00 0.00 62.40 64.44 1x08 h SER 118 CO 0.53 -0.31 0.53 -0.09 -1.14 0.00 0.00 176.83 176.35 1x08 h ARG 119 N -0.14 1.05 -0.17 3.45 2.43 -1.99 0.07 114.38 119.08 1x08 h ARG 119 Ca 0.23 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 59.31 1x08 h ARG 119 Cb 0.56 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 29.87 1x08 h ARG 119 CO -0.76 0.70 -0.02 1.25 -1.51 0.00 0.00 179.97 179.62 1x08 h LEU 120 N 1.08 0.31 -0.93 3.80 5.85 -1.54 -2.16 115.31 121.73 1x08 h LEU 120 Ca 0.30 -0.35 0.02 0.00 0.84 0.00 0.00 57.88 58.69 1x08 h LEU 120 Cb -0.11 -0.08 -0.05 0.00 0.37 0.00 0.00 40.66 40.78 1x08 h LEU 120 CO -0.07 0.58 0.61 1.56 -0.34 0.00 0.00 178.44 180.79 1x08 h GLN 121 N 0.03 1.19 -0.67 1.25 4.20 -0.59 -0.72 115.11 119.80 1x08 h GLN 121 Ca 0.04 -0.07 -0.08 0.00 0.06 0.00 0.00 58.65 58.60 1x08 h GLN 121 Cb 0.44 -0.27 -0.03 0.00 0.30 0.00 0.00 27.48 27.93 1x08 h GLN 121 CO 0.01 0.79 0.09 1.49 -0.67 0.00 0.00 178.83 180.54 1x08 h GLU 122 N 1.22 1.12 -0.46 1.46 4.57 -0.96 -1.32 114.58 120.22 1x08 h GLU 122 Ca 0.35 -0.31 -0.13 0.00 -1.18 0.00 0.00 59.36 58.09 1x08 h GLU 122 Cb -0.09 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 28.36 1x08 h GLU 122 CO -0.09 1.03 -0.24 0.00 -1.18 0.00 0.00 179.01 178.53 1x08 h ARG 123 N 1.04 0.96 0.03 1.92 3.08 -0.98 -1.56 114.38 118.87 1x08 h ARG 123 Ca 0.20 -0.42 -0.00 0.00 0.07 0.00 0.00 59.98 59.83 1x08 h ARG 123 Cb 0.46 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.49 1x08 h ARG 123 CO 0.02 1.09 -0.01 0.82 -1.07 0.00 0.00 179.97 180.81 1x08 h ILE 124 N 0.82 1.02 -0.90 2.04 2.04 -0.94 -1.41 117.51 120.18 1x08 h ILE 124 Ca 0.10 -0.13 0.08 0.00 1.00 0.00 0.00 64.86 65.90 1x08 h ILE 124 Cb 0.82 1.11 -0.07 0.00 -0.74 0.00 0.00 36.82 37.93 1x08 h ILE 124 CO 0.07 0.03 0.56 -0.09 0.00 0.00 0.00 178.15 178.73 1x08 h ARG 125 N -0.10 0.96 -0.11 2.37 2.43 -1.18 -1.58 114.38 117.18 1x08 h ARG 125 Ca -0.00 -0.06 -0.20 0.00 -0.81 0.00 0.00 59.98 58.91 1x08 h ARG 125 Cb 0.08 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 29.42 1x08 h ARG 125 CO 0.01 0.64 -0.76 0.87 -1.51 0.00 0.00 179.97 179.22 1x08 h LYS 126 N 0.99 0.57 -0.39 0.20 1.57 -1.06 -2.31 116.57 116.13 1x08 h LYS 126 Ca 0.41 -0.47 -0.13 0.00 -1.87 0.00 0.00 60.65 58.59 1x08 h LYS 126 Cb 0.24 0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 1x08 h LYS 126 CO -0.20 1.09 -0.26 0.77 -0.57 0.00 0.00 179.45 180.28 1x08 h SER 127 N 0.39 0.85 -0.48 0.86 0.02 -0.96 -0.06 113.55 114.16 1x08 h SER 127 Ca -0.04 -0.33 -0.12 0.00 -0.84 0.00 0.00 61.79 60.46 1x08 h SER 127 Cb 1.35 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 63.64 1x08 h SER 127 CO 0.14 1.06 -0.14 -0.33 -1.14 0.00 0.00 176.83 176.42 1x08 h GLU 128 N 0.71 0.97 -0.25 3.45 5.08 -1.32 -2.64 114.58 120.58 1x08 h GLU 128 Ca 0.09 -0.37 -0.03 0.00 -1.00 0.00 0.00 59.36 58.04 1x08 h GLU 128 Cb 0.80 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.99 1x08 h GLU 128 CO 0.07 1.04 0.02 0.00 -1.00 0.00 0.00 179.01 179.14 1x08 h ALA 129 N 0.97 0.33 -0.77 3.43 0.00 -1.10 0.16 119.26 122.28 1x08 h ALA 129 Ca 0.13 -0.20 0.06 0.00 0.00 0.00 0.00 54.91 54.90 1x08 h ALA 129 Cb 0.70 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.35 1x08 h ALA 129 CO 0.05 0.03 0.50 1.25 0.00 0.00 0.00 179.25 181.09 1x08 h LEU 130 N 0.21 0.74 -2.15 0.00 5.85 -0.97 -2.96 115.31 116.03 1x08 h LEU 130 Ca 0.07 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.79 1x08 h LEU 130 Cb 0.37 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.25 1x08 h LEU 130 CO 0.01 0.48 0.00 0.35 -0.34 0.00 0.00 178.44 178.94 1x08 n THR 131 N -4.48 0.42 -0.16 1.05 -2.24 -1.00 -4.62 114.28 103.25 1x08 n THR 131 Ca 0.11 -0.71 0.19 0.00 -2.27 0.00 0.00 64.05 61.37 1x08 n THR 131 Cb 0.21 0.99 0.57 0.00 -2.10 0.00 0.00 70.33 69.99 1x08 n THR 131 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1x08 h ALA 132 N 3.15 2.32 -0.12 6.98 0.00 -0.51 -0.65 119.26 130.44 1x08 h ALA 132 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1x08 h ALA 132 Cb 0.76 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.53 1x08 h ALA 132 CO 0.00 -0.54 0.00 0.41 0.00 0.00 0.00 179.25 179.12 1x08 n GLY 133 N -1.57 0.30 3.77 0.00 0.00 -1.26 -4.93 105.19 101.50 1x08 n GLY 133 Ca 0.16 -0.46 -0.37 0.00 0.00 0.00 0.00 46.02 45.35 1x08 n GLY 133 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1x08 s ASN 134 N -1.75 5.94 -0.03 1.61 0.01 -0.25 -4.97 114.94 115.51 1x08 s ASN 134 Ca 0.35 2.34 0.05 0.00 -0.71 0.00 0.00 52.86 54.88 1x08 s ASN 134 Cb 0.19 -2.60 0.09 0.00 0.41 0.00 0.00 41.25 39.34 1x08 s ASN 134 CO 0.29 -1.08 1.06 0.35 -1.51 0.00 0.00 177.10 176.21 1x08 n THR 135 N -0.75 1.17 0.00 1.60 -2.24 -1.24 -4.62 114.28 108.20 1x08 n THR 135 Ca 0.09 -1.23 0.00 0.00 -2.27 0.00 0.00 64.05 60.64 1x08 n THR 135 Cb 0.48 0.36 0.00 0.00 -2.10 0.00 0.00 70.33 69.08 1x08 n THR 135 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1x08 n GLY 136 N -0.55 0.59 3.76 3.38 0.00 0.37 -5.01 105.19 107.73 1x08 n GLY 136 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 1x08 n GLY 136 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1x08 s LEU 137 N 0.00 4.38 -0.20 0.99 2.96 -1.25 -4.78 118.68 120.78 1x08 s LEU 137 Ca 0.00 2.78 -0.13 0.00 -0.22 0.00 0.00 54.13 56.56 1x08 s LEU 137 Cb 0.00 -3.64 -0.05 0.00 0.50 0.00 0.00 46.19 43.01 1x08 s LEU 137 CO 0.00 -0.73 0.25 -0.89 -1.32 0.00 0.00 176.35 173.66 1x08 s THR 138 N -0.42 5.32 -0.26 3.68 2.01 -0.13 -1.03 115.64 124.81 1x08 s THR 138 Ca 0.57 0.41 -0.04 0.00 0.31 0.00 0.00 61.69 62.93 1x08 s THR 138 Cb -0.43 -3.58 0.01 0.00 0.01 0.00 0.00 72.50 68.51 1x08 s THR 138 CO 0.49 0.35 -0.01 -0.22 -0.69 0.00 0.00 174.62 174.55 1x08 s LEU 139 N 0.81 3.35 -0.21 4.42 2.96 0.24 -1.19 118.68 129.05 1x08 s LEU 139 Ca 0.13 -0.70 -0.07 0.00 -0.22 0.00 0.00 54.13 53.27 1x08 s LEU 139 Cb -0.13 -1.76 -0.03 0.00 0.50 0.00 0.00 46.19 44.77 1x08 s LEU 139 CO 0.04 -0.12 0.06 0.20 -1.32 0.00 0.00 176.35 175.20 1x08 s ASN 140 N 1.42 5.29 -0.31 3.68 0.01 -0.00 -0.79 114.94 124.25 1x08 s ASN 140 Ca 0.02 -0.09 -0.08 0.00 -0.71 0.00 0.00 52.86 52.01 1x08 s ASN 140 Cb -0.16 -1.92 0.01 0.00 0.41 0.00 0.00 41.25 39.58 1x08 s ASN 140 CO -0.02 0.07 0.11 -0.63 -1.51 0.00 0.00 177.10 175.12 1x08 s ILE 141 N 0.99 4.16 -0.45 0.60 -1.09 -0.03 -0.82 121.20 124.56 1x08 s ILE 141 Ca 0.04 -0.67 -0.24 0.00 -2.23 0.00 0.00 60.65 57.55 1x08 s ILE 141 Cb -0.14 -3.16 0.03 0.00 -1.58 0.00 0.00 42.46 37.60 1x08 s ILE 141 CO 0.03 0.04 0.86 0.00 -1.23 0.00 0.00 174.94 174.63 1x08 s ALA 142 N 1.53 3.27 -0.08 9.38 0.00 -0.26 -0.96 121.76 134.64 1x08 s ALA 142 Ca 0.03 -0.87 0.00 0.00 0.00 0.00 0.00 51.96 51.12 1x08 s ALA 142 Cb -0.17 -3.55 0.02 0.00 0.00 0.00 0.00 23.12 19.41 1x08 s ALA 142 CO 0.04 -1.97 -0.06 0.00 0.00 0.00 0.00 175.76 173.77 1x08 s ALA 143 N 3.52 1.07 -1.30 0.00 0.00 0.01 -1.31 121.76 123.75 1x08 s ALA 143 Ca 0.34 -0.35 -0.04 0.00 0.00 0.00 0.00 51.96 51.91 1x08 s ALA 143 Cb -0.11 -0.73 0.01 0.00 0.00 0.00 0.00 23.12 22.29 1x08 s ALA 143 CO 0.24 -0.25 0.97 -1.71 0.00 0.00 0.00 175.76 175.01 1x08 n ASN 144 N 4.61 -3.14 -4.55 0.00 4.05 0.17 -3.78 115.26 112.63 1x08 n ASN 144 Ca -0.16 -0.66 -0.31 0.00 0.45 0.00 0.00 54.58 53.90 1x08 n ASN 144 Cb 0.50 -4.73 -0.11 0.00 1.23 0.00 0.00 39.78 36.68 1x08 n ASN 144 CO 0.00 0.00 0.00 -0.47 -3.05 0.00 0.00 177.26 173.74 1x08 s TYR 145 N -3.42 2.75 -0.06 1.20 6.14 -1.04 -1.23 117.35 121.69 1x08 s TYR 145 Ca 0.21 -0.14 -0.07 0.00 0.64 0.00 0.00 57.07 57.71 1x08 s TYR 145 Cb -0.10 -1.52 0.02 0.00 0.42 0.00 0.00 41.96 40.78 1x08 s TYR 145 CO 0.76 0.34 0.19 0.20 0.64 0.00 0.00 175.55 177.68 1x08 s GLY 146 N -1.60 -0.12 0.25 8.97 0.00 -1.26 -2.08 107.32 111.48 1x08 s GLY 146 Ca 0.17 0.46 -0.02 0.00 0.00 0.00 0.00 44.72 45.33 1x08 s GLY 146 CO 0.08 0.37 1.71 -1.33 0.00 0.00 0.00 173.10 173.93 1x08 h GLY 147 N 5.63 0.77 0.88 0.20 0.00 -0.39 -0.76 103.07 109.40 1x08 h GLY 147 Ca -0.26 -0.58 -0.08 0.00 0.00 0.00 0.00 47.33 46.41 1x08 h GLY 147 CO 0.39 0.54 -0.14 3.21 0.00 0.00 0.00 176.54 180.53 1x08 h ARG 148 N 0.64 0.57 -0.68 4.80 3.08 -1.98 -2.21 114.38 118.60 1x08 h ARG 148 Ca 0.11 -0.25 0.06 0.00 0.07 0.00 0.00 59.98 59.96 1x08 h ARG 148 Cb 0.60 -0.01 -0.05 0.00 0.08 0.00 0.00 29.97 30.58 1x08 h ARG 148 CO 0.04 0.82 0.38 2.35 -1.07 0.00 0.00 179.97 182.50 1x08 h TRP 149 N 0.30 0.70 -0.10 3.04 7.01 -1.90 -0.16 115.95 124.84 1x08 h TRP 149 Ca 0.06 0.02 0.03 0.00 2.11 0.00 0.00 58.89 61.12 1x08 h TRP 149 Cb 0.66 -0.22 -0.04 0.00 -2.10 0.00 0.00 29.16 27.47 1x08 h TRP 149 CO 0.06 0.34 -0.13 0.22 -2.79 0.00 0.00 178.44 176.14 1x08 h ASP 150 N 0.70 -0.41 -0.53 2.65 1.82 -0.96 -0.83 116.42 118.86 1x08 h ASP 150 Ca 0.30 0.07 0.00 0.00 -0.39 0.00 0.00 57.03 57.02 1x08 h ASP 150 Cb 0.18 0.19 -0.03 0.00 0.68 0.00 0.00 39.33 40.36 1x08 h ASP 150 CO -0.18 -0.18 0.35 0.40 -1.61 0.00 0.00 179.24 178.02 1x08 h ILE 151 N -0.18 1.14 -0.43 2.25 2.04 -0.94 -2.33 117.51 119.06 1x08 h ILE 151 Ca 0.08 -0.26 -0.00 0.00 1.00 0.00 0.00 64.86 65.68 1x08 h ILE 151 Cb 0.29 0.37 -0.02 0.00 -0.74 0.00 0.00 36.82 36.72 1x08 h ILE 151 CO -0.20 0.13 0.26 0.58 0.00 0.00 0.00 178.15 178.92 1x08 h VAL 152 N 0.72 1.12 -0.69 1.67 2.07 -0.48 -1.21 116.25 119.44 1x08 h VAL 152 Ca 0.19 -0.27 -0.06 0.00 0.82 0.00 0.00 66.70 67.38 1x08 h VAL 152 Cb -0.08 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 30.18 1x08 h VAL 152 CO -0.04 0.13 0.19 1.56 0.02 0.00 0.00 177.57 179.42 1x08 h GLN 153 N 0.59 1.08 -0.44 1.57 1.08 -0.62 -0.69 115.11 117.68 1x08 h GLN 153 Ca 0.16 -0.24 -0.14 0.00 -1.45 0.00 0.00 58.65 56.98 1x08 h GLN 153 Cb -0.03 -0.15 -0.01 0.00 -0.05 0.00 0.00 27.48 27.24 1x08 h GLN 153 CO -0.03 0.94 -0.27 0.78 -0.95 0.00 0.00 178.83 179.30 1x08 h GLY 154 N 1.08 1.02 1.03 3.46 0.00 -1.16 -2.15 103.07 106.35 1x08 h GLY 154 Ca 0.22 -0.94 -0.00 0.00 0.00 0.00 0.00 47.33 46.61 1x08 h GLY 154 CO -0.00 0.85 0.60 -2.08 0.00 0.00 0.00 176.54 175.90 1x08 h VAL 155 N 0.79 1.26 -0.54 4.60 2.07 -0.74 -1.57 116.25 122.12 1x08 h VAL 155 Ca 0.09 -0.53 -0.11 0.00 0.82 0.00 0.00 66.70 66.98 1x08 h VAL 155 Cb 0.84 -0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 1x08 h VAL 155 CO 0.07 0.26 -0.10 0.03 0.02 0.00 0.00 177.57 177.86 1x08 h ARG 156 N 1.31 1.00 -1.00 1.57 3.08 -0.91 0.26 114.38 119.69 1x08 h ARG 156 Ca 0.35 -0.36 0.01 0.00 0.07 0.00 0.00 59.98 60.05 1x08 h ARG 156 Cb -0.09 -0.07 -0.05 0.00 0.08 0.00 0.00 29.97 29.84 1x08 h ARG 156 CO -0.07 1.04 0.66 1.96 -1.07 0.00 0.00 179.97 182.49 1x08 h GLN 157 N 0.89 1.31 0.03 0.04 4.20 -0.78 0.15 115.11 120.96 1x08 h GLN 157 Ca 0.14 -0.08 -0.27 0.00 0.06 0.00 0.00 58.65 58.50 1x08 h GLN 157 Cb 0.65 -0.30 0.02 0.00 0.30 0.00 0.00 27.48 28.16 1x08 h GLN 157 CO 0.05 0.87 -1.08 -0.07 -0.67 0.00 0.00 178.83 177.92 1x08 h LEU 158 N 1.35 0.85 -1.15 1.46 3.38 -0.93 -2.86 115.31 117.41 1x08 h LEU 158 Ca 0.37 -0.71 0.02 0.00 0.09 0.00 0.00 57.88 57.65 1x08 h LEU 158 Cb -0.15 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 40.29 1x08 h LEU 158 CO -0.08 1.51 0.58 0.00 0.09 0.00 0.00 178.44 180.54 1x08 h ALA 159 N 0.42 1.41 -0.63 1.53 0.00 -0.05 -0.07 119.26 121.87 1x08 h ALA 159 Ca -0.14 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 1x08 h ALA 159 Cb 1.74 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 19.16 1x08 h ALA 159 CO 0.21 0.54 0.37 0.93 0.00 0.00 0.00 179.25 181.29 1x08 h GLU 160 N 1.15 0.86 -0.18 0.00 4.39 -0.96 -0.11 114.58 119.74 1x08 h GLU 160 Ca 0.33 -0.09 -0.04 0.00 0.34 0.00 0.00 59.36 59.90 1x08 h GLU 160 Cb -0.08 -0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 28.38 1x08 h GLU 160 CO -0.08 0.63 -0.09 0.87 -1.16 0.00 0.00 179.01 179.18 1x08 h LYS 161 N 0.86 0.27 -0.41 2.33 1.57 -0.94 -0.25 116.57 120.00 1x08 h LYS 161 Ca 0.22 -0.06 -0.15 0.00 -1.87 0.00 0.00 60.65 58.80 1x08 h LYS 161 Cb 0.00 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.26 1x08 h LYS 161 CO -0.04 0.38 -0.33 0.28 -0.57 0.00 0.00 179.45 179.16 1x08 h VAL 162 N 0.26 1.27 0.52 0.50 2.07 -0.11 -0.80 116.25 119.96 1x08 h VAL 162 Ca 0.06 -1.50 -0.02 0.00 0.82 0.00 0.00 66.70 66.05 1x08 h VAL 162 Cb 0.33 1.31 -0.01 0.00 -1.52 0.00 0.00 31.29 31.40 1x08 h VAL 162 CO 0.02 0.51 -0.42 -0.61 0.02 0.00 0.00 177.57 177.09 1x08 h GLN 163 N 0.77 -0.88 0.00 1.57 5.75 -0.15 -2.27 115.11 119.91 1x08 h GLN 163 Ca 0.08 0.06 0.00 0.00 -0.15 0.00 0.00 58.65 58.64 1x08 h GLN 163 Cb 0.92 0.20 0.00 0.00 1.07 0.00 0.00 27.48 29.67 1x08 h GLN 163 CO 0.09 -0.58 0.02 1.04 -2.65 0.00 0.00 178.83 176.74 1x08 n GLN 164 N -4.98 0.00 -1.00 1.69 6.02 -0.19 -4.74 117.38 114.17 1x08 n GLN 164 Ca -0.11 0.14 -0.00 0.00 -0.01 0.00 0.00 57.00 57.02 1x08 n GLN 164 Cb 0.40 -1.52 -0.00 0.00 1.02 0.00 0.00 30.24 30.14 1x08 n GLN 164 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1x08 n GLY 165 N -1.10 0.41 0.59 1.08 0.00 -0.85 -4.90 105.19 100.42 1x08 n GLY 165 Ca 0.00 -0.03 0.13 0.00 0.00 0.00 0.00 46.02 46.12 1x08 n GLY 165 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1x08 n ASN 166 N -0.15 1.82 -3.69 1.61 3.02 -0.35 -4.89 115.26 112.63 1x08 n ASN 166 Ca -0.00 -1.64 -0.12 0.00 -0.03 0.00 0.00 54.58 52.79 1x08 n ASN 166 Cb 0.10 -0.04 -0.09 0.00 -0.61 0.00 0.00 39.78 39.14 1x08 n ASN 166 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1x08 s LEU 167 N -1.85 -0.14 -0.03 3.41 2.96 -0.97 -4.94 118.68 117.12 1x08 s LEU 167 Ca 0.35 1.07 -0.15 0.00 -0.22 0.00 0.00 54.13 55.18 1x08 s LEU 167 Cb 0.20 1.74 -0.05 0.00 0.50 0.00 0.00 46.19 48.58 1x08 s LEU 167 CO 0.31 -0.19 0.41 -1.10 -1.32 0.00 0.00 176.35 174.46 1x08 s GLN 168 N 0.75 4.00 0.56 1.98 -1.52 -1.26 -4.27 119.66 119.90 1x08 s GLN 168 Ca -0.04 0.40 0.32 0.00 -1.95 0.00 0.00 55.36 54.09 1x08 s GLN 168 Cb -0.05 -3.27 1.48 0.00 -0.22 0.00 0.00 33.01 30.95 1x08 s GLN 168 CO -0.06 0.58 1.84 -1.35 -0.25 0.00 0.00 175.29 176.06 1x08 h PRO 169 N 5.13 0.00 -0.05 2.91 0.11 -1.99 0.01 132.00 138.12 1x08 h PRO 169 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1x08 h PRO 169 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1x08 h PRO 169 CO 0.64 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 178.03 1x08 n ASP 170 N -4.06 0.73 0.01 -2.05 5.68 -1.26 -3.10 116.55 112.50 1x08 n ASP 170 Ca 0.18 -1.44 0.11 0.00 -0.50 0.00 0.00 54.79 53.14 1x08 n ASP 170 Cb 1.00 -0.03 0.03 0.00 -1.14 0.00 0.00 41.12 40.98 1x08 n ASP 170 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1x08 n GLN 171 N -0.35 0.09 -2.44 0.11 6.02 -0.01 -4.89 117.38 115.92 1x08 n GLN 171 Ca 0.17 -0.01 -0.43 0.00 -0.01 0.00 0.00 57.00 56.73 1x08 n GLN 171 Cb 0.20 -1.52 -0.02 0.00 1.02 0.00 0.00 30.24 29.91 1x08 n GLN 171 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1x08 s ILE 172 N -3.06 4.16 0.34 5.09 1.01 -1.18 -4.95 121.20 122.60 1x08 s ILE 172 Ca 0.07 1.31 0.03 0.00 0.00 0.00 0.00 60.65 62.06 1x08 s ILE 172 Cb 0.16 -4.17 -0.01 0.00 0.01 0.00 0.00 42.46 38.45 1x08 s ILE 172 CO 0.80 -0.48 0.10 -0.90 0.00 0.00 0.00 174.94 174.47 1x08 n ASP 173 N 7.58 1.40 -0.18 3.58 5.68 -1.26 -5.03 116.55 128.31 1x08 n ASP 173 Ca 0.15 -2.75 -0.04 0.00 -0.50 0.00 0.00 54.79 51.64 1x08 n ASP 173 Cb 0.47 0.77 0.05 0.00 -1.14 0.00 0.00 41.12 41.26 1x08 n ASP 173 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1x08 h GLU 174 N 0.00 0.56 -0.85 0.11 5.08 -1.99 -1.90 114.58 115.59 1x08 h GLU 174 Ca -0.26 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.04 1x08 h GLU 174 Cb 0.98 -0.13 -0.04 0.00 0.50 0.00 0.00 28.75 30.06 1x08 h GLU 174 CO 0.42 0.37 0.44 0.93 -1.00 0.00 0.00 179.01 180.17 1x08 h GLU 175 N 0.58 1.21 -0.59 2.33 4.39 -1.97 0.29 114.58 120.82 1x08 h GLU 175 Ca 0.23 -0.16 -0.09 0.00 0.34 0.00 0.00 59.36 59.67 1x08 h GLU 175 Cb 0.09 -0.23 -0.02 0.00 -0.10 0.00 0.00 28.75 28.49 1x08 h GLU 175 CO -0.13 0.91 -0.00 1.98 -1.16 0.00 0.00 179.01 180.60 1x08 h MET 176 N 1.20 1.02 -0.09 2.33 4.05 -1.82 -1.75 114.93 119.86 1x08 h MET 176 Ca 0.30 -0.32 -0.14 0.00 -0.28 0.00 0.00 59.70 59.26 1x08 h MET 176 Cb 0.07 -0.10 -0.01 0.00 -0.80 0.00 0.00 31.60 30.77 1x08 h MET 176 CO -0.04 1.00 -0.57 1.25 0.23 0.00 0.00 176.91 178.78 1x08 h LEU 177 N 0.94 0.31 -2.22 3.39 5.85 -0.90 -2.71 115.31 119.97 1x08 h LEU 177 Ca 0.17 -0.17 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 1x08 h LEU 177 Cb 0.55 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 41.49 1x08 h LEU 177 CO 0.03 0.82 -0.03 -1.13 -0.34 0.00 0.00 178.44 177.78 1x08 h ASN 178 N 0.21 0.00 0.06 1.25 -1.24 0.13 0.31 115.58 116.30 1x08 h ASN 178 Ca -0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 1x08 h ASN 178 Cb 1.06 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.11 1x08 h ASN 178 CO 0.09 0.03 -0.01 0.00 -1.29 0.00 0.00 177.43 176.25 1x08 n GLN 179 N -4.02 1.11 -0.02 6.67 1.13 -0.71 -3.40 117.38 118.14 1x08 n GLN 179 Ca -0.03 -0.27 0.03 0.00 -1.94 0.00 0.00 57.00 54.79 1x08 n GLN 179 Cb 0.12 -1.49 0.04 0.00 0.11 0.00 0.00 30.24 29.01 1x08 n GLN 179 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 1x08 n HIS 180 N -0.71 0.01 -3.80 1.08 8.25 0.08 -4.93 115.22 115.21 1x08 n HIS 180 Ca 0.21 -0.63 -0.21 0.00 -0.26 0.00 0.00 57.72 56.84 1x08 n HIS 180 Cb 0.19 -0.08 -0.02 0.00 1.12 0.00 0.00 29.99 31.20 1x08 n HIS 180 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 1x08 s VAL 181 N -1.50 4.31 0.49 1.59 -7.23 -1.12 -3.60 120.40 113.34 1x08 s VAL 181 Ca 0.09 -1.16 -0.24 0.00 -1.81 0.00 0.00 61.98 58.86 1x08 s VAL 181 Cb 0.08 -3.47 -0.07 0.00 0.56 0.00 0.00 36.38 33.47 1x08 s VAL 181 CO 0.01 -0.24 1.31 0.00 -0.31 0.00 0.00 175.10 175.87 1x08 n MET 183 N -0.46 -0.93 0.13 0.00 2.81 -1.26 -4.89 117.12 112.51 1x08 n MET 183 Ca 0.08 0.87 0.11 0.00 -1.81 0.00 0.00 57.70 56.96 1x08 n MET 183 Cb 0.42 -4.97 0.49 0.00 -0.71 0.00 0.00 33.22 28.46 1x08 n MET 183 CO 0.00 0.00 0.00 -2.39 1.51 0.00 0.00 175.97 175.09 1x08 n HIS 184 N -2.98 0.75 1.37 2.03 -0.00 -1.17 -1.57 115.22 113.65 1x08 n HIS 184 Ca -0.14 0.31 0.14 0.00 -0.00 0.00 0.00 57.72 58.04 1x08 n HIS 184 Cb 0.47 -1.00 0.61 0.00 -0.00 0.00 0.00 29.99 30.07 1x08 n HIS 184 CO 0.00 0.00 0.00 -0.85 -0.00 0.00 0.00 176.34 175.49 1x08 n GLU 185 N -2.20 0.60 -3.90 -1.40 0.00 -1.26 -4.89 120.64 107.59 1x08 n GLU 185 Ca 0.02 -0.19 -0.22 0.00 0.00 0.00 0.00 57.16 56.76 1x08 n GLU 185 Cb 0.19 -1.50 -0.05 0.00 0.00 0.00 0.00 31.44 30.09 1x08 n GLU 185 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 1x08 s LEU 186 N -2.53 3.37 0.60 -1.84 1.43 -0.61 -5.09 118.68 114.01 1x08 s LEU 186 Ca 0.27 -0.73 -0.19 0.00 -1.03 0.00 0.00 54.13 52.46 1x08 s LEU 186 Cb 0.20 -1.91 -0.04 0.00 0.03 0.00 0.00 46.19 44.47 1x08 s LEU 186 CO 0.49 -0.43 1.16 0.00 0.23 0.00 0.00 176.35 177.80 1x08 n ALA 187 N -1.32 0.79 -1.64 4.21 0.00 -1.26 -4.93 120.51 116.36 1x08 n ALA 187 Ca -0.01 0.03 -0.35 0.00 0.00 0.00 0.00 53.44 53.11 1x08 n ALA 187 Cb 0.61 -2.23 0.04 0.00 0.00 0.00 0.00 19.45 17.87 1x08 n ALA 187 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1x08 s PRO 188 N -2.99 2.83 0.09 0.00 0.04 -1.26 -4.90 135.00 128.81 1x08 s PRO 188 Ca 0.77 1.72 -0.31 0.00 0.04 0.00 0.00 61.00 63.23 1x08 s PRO 188 Cb -0.41 -1.92 -0.09 0.00 0.04 0.00 0.00 34.50 32.12 1x08 s PRO 188 CO 0.45 -1.29 1.71 0.08 0.04 0.00 0.00 177.00 177.99 1x08 s VAL 189 N -1.80 2.88 -0.20 -0.36 1.01 -1.26 -4.40 120.40 116.26 1x08 s VAL 189 Ca 0.75 0.35 0.13 0.00 0.00 0.00 0.00 61.98 63.21 1x08 s VAL 189 Cb -0.28 -3.22 -0.23 0.00 0.00 0.00 0.00 36.38 32.65 1x08 s VAL 189 CO 0.36 -0.00 0.03 0.47 0.00 0.00 0.00 175.10 175.96 1x08 n ASP 190 N 5.62 0.57 -3.73 3.32 8.00 -0.00 -4.13 116.55 126.19 1x08 n ASP 190 Ca 0.16 -0.01 -0.16 0.00 0.71 0.00 0.00 54.79 55.50 1x08 n ASP 190 Cb 0.40 0.57 -0.16 0.00 -0.02 0.00 0.00 41.12 41.90 1x08 n ASP 190 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1x08 s LEU 191 N -5.80 0.64 -0.18 0.64 2.96 -1.09 -0.36 118.68 115.48 1x08 s LEU 191 Ca -0.16 0.17 -0.05 0.00 -0.22 0.00 0.00 54.13 53.87 1x08 s LEU 191 Cb 0.07 0.10 -0.03 0.00 0.50 0.00 0.00 46.19 46.83 1x08 s LEU 191 CO 0.77 -0.17 -0.00 -0.69 -1.32 0.00 0.00 176.35 174.94 1x08 s VAL 192 N 1.47 4.08 -0.13 1.68 1.01 0.25 -0.69 120.40 128.08 1x08 s VAL 192 Ca -0.05 -0.28 -0.01 0.00 0.00 0.00 0.00 61.98 61.65 1x08 s VAL 192 Cb -0.12 -2.83 -0.02 0.00 0.00 0.00 0.00 36.38 33.41 1x08 s VAL 192 CO -0.04 0.46 -0.11 -0.63 0.00 0.00 0.00 175.10 174.77 1x08 s ILE 193 N 0.67 3.23 -0.18 2.22 1.01 0.12 -0.31 121.20 127.96 1x08 s ILE 193 Ca -0.00 -0.60 0.01 0.00 0.00 0.00 0.00 60.65 60.05 1x08 s ILE 193 Cb -0.14 -2.36 0.03 0.00 0.01 0.00 0.00 42.46 40.00 1x08 s ILE 193 CO 0.02 0.53 -0.14 -0.60 0.00 0.00 0.00 174.94 174.74 1x08 s ARG 194 N 0.25 2.38 0.60 2.79 3.52 -0.27 -0.17 118.95 128.05 1x08 s ARG 194 Ca -0.08 -0.75 -0.03 0.00 -0.13 0.00 0.00 55.73 54.75 1x08 s ARG 194 Cb -0.15 -2.35 0.03 0.00 -1.56 0.00 0.00 34.95 30.92 1x08 s ARG 194 CO 0.05 -0.30 0.87 0.95 -0.81 0.00 0.00 175.30 176.05 1x08 s THR 195 N 1.39 2.86 0.00 4.11 -4.23 -1.09 -1.89 115.64 116.79 1x08 s THR 195 Ca 0.02 -0.39 0.00 0.00 -1.18 0.00 0.00 61.69 60.15 1x08 s THR 195 Cb -0.14 -3.14 0.00 0.00 1.34 0.00 0.00 72.50 70.56 1x08 s THR 195 CO -0.10 -0.12 0.00 0.61 -0.54 0.00 0.00 174.62 174.47 1x08 n GLY 196 N -2.56 1.58 0.00 3.99 0.00 0.13 -3.91 105.19 104.41 1x08 n GLY 196 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 1x08 n GLY 196 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x08 n GLY 197 N -2.00 3.16 3.84 -0.02 0.00 -1.00 -4.76 105.19 104.41 1x08 n GLY 197 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1x08 n GLY 197 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1x08 s GLU 198 N -0.92 4.08 -0.73 1.61 0.41 -1.26 -4.93 118.70 116.96 1x08 s GLU 198 Ca 0.00 0.72 0.03 0.00 -0.41 0.00 0.00 54.97 55.31 1x08 s GLU 198 Cb 0.00 -2.62 0.30 0.00 -1.78 0.00 0.00 34.13 30.02 1x08 s GLU 198 CO 0.00 0.26 1.05 0.72 -0.49 0.00 0.00 175.26 176.81 1x08 n HIS 199 N 0.09 3.47 -3.96 1.61 8.25 -1.26 -4.91 115.22 118.51 1x08 n HIS 199 Ca 0.01 -3.68 -0.09 0.00 -0.26 0.00 0.00 57.72 53.70 1x08 n HIS 199 Cb 0.52 -0.72 -0.09 0.00 1.12 0.00 0.00 29.99 30.82 1x08 n HIS 199 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 1x08 s ARG 200 N -3.08 0.59 0.00 -0.41 0.52 -1.26 -5.04 118.95 110.27 1x08 s ARG 200 Ca 0.41 -0.86 0.22 0.00 -0.52 0.00 0.00 55.73 54.98 1x08 s ARG 200 Cb 0.18 0.22 -0.06 0.00 0.52 0.00 0.00 34.95 35.81 1x08 s ARG 200 CO -0.05 -0.14 1.02 0.44 0.02 0.00 0.00 175.30 176.59 1x08 n ILE 201 N 0.63 0.00 -3.99 1.52 -5.35 -1.26 -5.02 119.36 105.89 1x08 n ILE 201 Ca -0.18 -0.20 -0.31 0.00 -0.27 0.00 0.00 62.75 61.79 1x08 n ILE 201 Cb 0.59 1.19 -0.02 0.00 -1.74 0.00 0.00 39.64 39.66 1x08 n ILE 201 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 1x08 n SER 202 N -0.38 -1.57 -2.58 7.28 7.64 -1.26 -1.45 113.62 121.30 1x08 n SER 202 Ca 0.08 -1.11 -0.21 0.00 1.01 0.00 0.00 58.87 58.64 1x08 n SER 202 Cb 0.43 -2.61 0.01 0.00 -1.01 0.00 0.00 64.21 61.02 1x08 n SER 202 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1x08 n ASN 203 N -2.78 -5.90 -4.44 6.43 5.15 -1.26 -4.92 115.26 107.53 1x08 n ASN 203 Ca -0.24 -0.13 -0.39 0.00 -0.60 0.00 0.00 54.58 53.21 1x08 n ASN 203 Cb 0.65 -4.83 -0.11 0.00 -0.53 0.00 0.00 39.78 34.96 1x08 n ASN 203 CO 0.00 0.00 0.00 0.12 1.40 0.00 0.00 177.26 178.78 1x08 s PHE 204 N -3.08 3.20 -1.50 1.20 5.36 -0.53 0.42 117.98 123.05 1x08 s PHE 204 Ca 0.13 -0.58 -0.11 0.00 -0.96 0.00 0.00 56.93 55.41 1x08 s PHE 204 Cb -0.06 -2.39 0.07 0.00 -0.34 0.00 0.00 43.02 40.30 1x08 s PHE 204 CO 0.16 -0.47 0.89 1.28 -1.46 0.00 0.00 175.22 175.61 1x08 n LEU 205 N 5.01 -2.56 -0.20 6.12 4.77 -1.26 -4.85 117.00 124.02 1x08 n LEU 205 Ca -0.13 -0.82 0.01 0.00 -0.03 0.00 0.00 56.01 55.04 1x08 n LEU 205 Cb 0.49 -2.52 0.11 0.00 -2.33 0.00 0.00 43.42 39.17 1x08 n LEU 205 CO 0.35 0.44 0.92 -0.07 -1.33 0.00 0.00 177.39 177.70 1x08 h LEU 206 N -1.99 -0.01 -0.18 2.23 3.38 -1.84 0.53 115.31 117.43 1x08 h LEU 206 Ca -0.59 0.11 -0.07 0.00 0.09 0.00 0.00 57.88 57.43 1x08 h LEU 206 Cb 1.37 0.16 -0.00 0.00 0.09 0.00 0.00 40.66 42.28 1x08 h LEU 206 CO 0.66 0.00 -0.14 -0.25 0.09 0.00 0.00 178.44 178.80 1x08 h TRP 207 N 0.25 0.49 0.00 1.13 2.91 -1.89 -3.20 115.95 115.65 1x08 h TRP 207 Ca 0.32 -0.14 0.00 0.00 1.13 0.00 0.00 58.89 60.20 1x08 h TRP 207 Cb 0.48 -0.11 0.00 0.00 -0.51 0.00 0.00 29.16 29.02 1x08 h TRP 207 CO -0.25 0.76 0.00 1.96 -1.03 0.00 0.00 178.44 179.88 1x08 h GLN 208 N 0.08 0.00 -0.65 2.65 7.50 -1.68 -3.17 115.11 119.84 1x08 h GLN 208 Ca 0.03 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.18 1x08 h GLN 208 Cb 0.66 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.19 1x08 h GLN 208 CO 0.04 0.00 0.00 0.44 -1.50 0.00 0.00 178.83 177.81 1x08 n ILE 209 N -2.97 1.70 -0.34 2.54 -5.35 0.08 -4.21 119.36 110.81 1x08 n ILE 209 Ca 0.01 -0.97 0.19 0.00 -0.27 0.00 0.00 62.75 61.71 1x08 n ILE 209 Cb 0.29 -0.13 0.42 0.00 -1.74 0.00 0.00 39.64 38.48 1x08 n ILE 209 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1x08 h ALA 210 N 3.67 1.91 0.00 -1.28 0.00 -1.70 -2.62 119.26 119.23 1x08 h ALA 210 Ca 0.00 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1x08 h ALA 210 Cb 1.37 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.19 1x08 h ALA 210 CO 0.27 -0.37 -0.05 0.66 0.00 0.00 0.00 179.25 179.75 1x08 n TYR 211 N -4.83 0.00 -2.63 0.00 4.01 -1.26 -5.07 117.16 107.37 1x08 n TYR 211 Ca 0.27 -0.71 -0.35 0.00 -0.16 0.00 0.00 57.90 56.95 1x08 n TYR 211 Cb 0.79 -0.10 -0.05 0.00 -0.31 0.00 0.00 39.34 39.67 1x08 n TYR 211 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1x08 s ALA 212 N -1.92 3.00 0.33 -0.72 0.00 -0.99 -4.96 121.76 116.49 1x08 s ALA 212 Ca 0.18 0.57 -0.27 0.00 0.00 0.00 0.00 51.96 52.44 1x08 s ALA 212 Cb 0.16 -3.23 -0.09 0.00 0.00 0.00 0.00 23.12 19.96 1x08 s ALA 212 CO 0.02 -0.14 1.06 -1.21 0.00 0.00 0.00 175.76 175.49 1x08 s GLU 213 N -2.93 4.46 -0.14 0.00 0.41 0.51 -4.89 118.70 116.13 1x08 s GLU 213 Ca 0.62 1.65 -0.01 0.00 -0.41 0.00 0.00 54.97 56.82 1x08 s GLU 213 Cb -0.16 -2.92 -0.02 0.00 -1.78 0.00 0.00 34.13 29.25 1x08 s GLU 213 CO 0.20 0.09 -0.12 -0.51 -0.49 0.00 0.00 175.26 174.44 1x08 s LEU 214 N -1.93 2.77 -0.15 1.80 1.43 -1.26 -0.58 118.68 120.75 1x08 s LEU 214 Ca 0.50 -0.31 -0.00 0.00 -1.03 0.00 0.00 54.13 53.28 1x08 s LEU 214 Cb -0.27 -1.63 0.03 0.00 0.03 0.00 0.00 46.19 44.35 1x08 s LEU 214 CO 0.34 0.16 -0.08 -0.47 0.23 0.00 0.00 176.35 176.54 1x08 s TYR 215 N 0.39 1.81 -0.13 0.29 6.14 0.58 -4.97 117.35 121.46 1x08 s TYR 215 Ca -0.10 -1.08 -0.03 0.00 0.64 0.00 0.00 57.07 56.50 1x08 s TYR 215 Cb -0.16 -1.38 -0.03 0.00 0.42 0.00 0.00 41.96 40.82 1x08 s TYR 215 CO 0.05 -0.61 -0.01 -0.06 0.64 0.00 0.00 175.55 175.55 1x08 s PHE 216 N 1.60 3.10 0.01 4.97 0.08 -1.26 -1.11 117.98 125.36 1x08 s PHE 216 Ca 0.02 -0.06 0.02 0.00 0.12 0.00 0.00 56.93 57.03 1x08 s PHE 216 Cb -0.14 -1.90 -0.01 0.00 -0.57 0.00 0.00 43.02 40.39 1x08 s PHE 216 CO -0.08 0.18 -0.06 -0.08 -0.10 0.00 0.00 175.22 175.08 1x08 s THR 217 N -0.12 0.49 -0.87 0.64 -1.32 -0.79 -4.98 115.64 108.69 1x08 s THR 217 Ca 0.04 -0.46 0.22 0.00 -1.21 0.00 0.00 61.69 60.28 1x08 s THR 217 Cb -0.13 -0.45 0.21 0.00 -1.51 0.00 0.00 72.50 70.62 1x08 s THR 217 CO 0.02 0.00 1.70 0.47 -2.21 0.00 0.00 174.62 174.61 1x08 n ASP 218 N 2.56 0.24 -4.69 8.08 8.00 -1.26 -2.36 116.55 127.12 1x08 n ASP 218 Ca -0.15 0.54 -0.44 0.00 0.71 0.00 0.00 54.79 55.45 1x08 n ASP 218 Cb 0.57 -0.60 -0.02 0.00 -0.02 0.00 0.00 41.12 41.05 1x08 n ASP 218 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1x08 n VAL 219 N -1.74 1.30 -3.07 2.53 0.31 -1.26 -4.19 118.33 112.21 1x08 n VAL 219 Ca 0.05 -0.32 -0.37 0.00 -0.01 0.00 0.00 64.34 63.68 1x08 n VAL 219 Cb 0.27 -1.59 -0.06 0.00 -0.91 0.00 0.00 33.84 31.56 1x08 n VAL 219 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1x08 s LEU 220 N -0.36 4.44 0.25 7.52 1.43 -1.26 0.19 118.68 130.89 1x08 s LEU 220 Ca 0.63 1.49 -0.05 0.00 -1.03 0.00 0.00 54.13 55.18 1x08 s LEU 220 Cb -0.60 -3.45 0.48 0.00 0.03 0.00 0.00 46.19 42.66 1x08 s LEU 220 CO 0.54 0.11 1.66 -0.25 0.23 0.00 0.00 176.35 178.63 1x08 h TRP 221 N 3.80 0.15 0.00 0.29 2.91 -1.48 0.92 115.95 122.54 1x08 h TRP 221 Ca -0.48 0.05 0.00 0.00 1.13 0.00 0.00 58.89 59.59 1x08 h TRP 221 Cb 1.20 0.05 0.00 0.00 -0.51 0.00 0.00 29.16 29.90 1x08 h TRP 221 CO 0.64 -0.17 0.00 -1.35 -1.03 0.00 0.00 178.44 176.54 1x08 h PRO 222 N 0.19 0.00 0.00 2.65 0.11 -1.86 -1.89 132.00 131.20 1x08 h PRO 222 Ca 0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.54 1x08 h PRO 222 Cb 0.76 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.87 1x08 h PRO 222 CO -0.59 0.00 -0.85 -0.25 -0.21 0.00 0.00 178.00 176.10 1x08 n ASP 223 N -2.98 0.80 -4.66 -2.05 8.00 0.28 -4.74 116.55 111.20 1x08 n ASP 223 Ca -0.03 -0.69 -0.42 0.00 0.71 0.00 0.00 54.79 54.36 1x08 n ASP 223 Cb 0.08 0.76 -0.03 0.00 -0.02 0.00 0.00 41.12 41.91 1x08 n ASP 223 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1x08 s PHE 224 N -3.02 1.51 0.00 1.24 5.36 -0.71 -4.95 117.98 117.40 1x08 s PHE 224 Ca 0.08 -0.27 0.00 0.00 -0.96 0.00 0.00 56.93 55.78 1x08 s PHE 224 Cb 0.16 -4.16 0.00 0.00 -0.34 0.00 0.00 43.02 38.69 1x08 s PHE 224 CO 0.81 -5.09 0.00 -0.40 -1.46 0.00 0.00 175.22 169.08 1x08 n ASP 225 N 7.33 1.35 0.03 6.13 5.68 -1.26 -4.82 116.55 130.99 1x08 n ASP 225 Ca 0.19 -0.79 -0.00 0.00 -0.50 0.00 0.00 54.79 53.69 1x08 n ASP 225 Cb 0.41 0.00 0.30 0.00 -1.14 0.00 0.00 41.12 40.69 1x08 n ASP 225 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1x08 h GLU 226 N 0.00 0.44 -0.16 0.11 3.07 -1.92 -1.55 114.58 114.57 1x08 h GLU 226 Ca 0.00 -0.11 -0.13 0.00 -0.50 0.00 0.00 59.36 58.62 1x08 h GLU 226 Cb 0.00 -0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 27.84 1x08 h GLU 226 CO 0.00 0.54 -0.47 0.37 -1.40 0.00 0.00 179.01 178.05 1x08 h GLN 227 N 0.41 0.41 -0.36 2.33 4.15 -1.98 0.18 115.11 120.24 1x08 h GLN 227 Ca 0.08 -0.22 -0.11 0.00 0.77 0.00 0.00 58.65 59.17 1x08 h GLN 227 Cb 0.41 0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.10 1x08 h GLN 227 CO 0.02 0.79 -0.19 -0.44 -1.93 0.00 0.00 178.83 177.08 1x08 h ASP 228 N 0.33 0.80 -0.38 -0.69 3.32 -1.77 -0.34 116.42 117.69 1x08 h ASP 228 Ca 0.02 -0.41 -0.03 0.00 0.02 0.00 0.00 57.03 56.62 1x08 h ASP 228 Cb 0.95 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 40.26 1x08 h ASP 228 CO 0.08 1.04 0.11 0.15 -1.72 0.00 0.00 179.24 178.89 1x08 h PHE 229 N 0.57 0.62 -0.99 4.55 3.04 -1.14 -1.06 116.94 122.53 1x08 h PHE 229 Ca 0.08 -0.07 0.01 0.00 3.98 0.00 0.00 57.97 61.97 1x08 h PHE 229 Cb 0.74 -0.18 -0.05 0.00 2.56 0.00 0.00 35.95 39.03 1x08 h PHE 229 CO 0.06 0.60 0.65 1.49 -2.02 0.00 0.00 178.31 179.09 1x08 h GLU 230 N 0.46 1.29 -0.45 1.11 4.57 -0.86 -1.45 114.58 119.25 1x08 h GLU 230 Ca 0.12 -0.08 0.01 0.00 -1.18 0.00 0.00 59.36 58.23 1x08 h GLU 230 Cb 0.28 -0.29 -0.03 0.00 -0.16 0.00 0.00 28.75 28.55 1x08 h GLU 230 CO -0.00 0.86 0.28 0.78 -1.18 0.00 0.00 179.01 179.75 1x08 h GLY 231 N 1.33 0.63 1.66 1.92 0.00 -0.53 -1.03 103.07 107.06 1x08 h GLY 231 Ca 0.36 -0.22 -0.05 0.00 0.00 0.00 0.00 47.33 47.42 1x08 h GLY 231 CO -0.08 0.21 -0.04 0.00 0.00 0.00 0.00 176.54 176.63 1x08 h ALA 232 N 1.18 1.42 -0.24 3.60 0.00 -0.55 -2.10 119.26 122.58 1x08 h ALA 232 Ca 0.17 -0.20 -0.14 0.00 0.00 0.00 0.00 54.91 54.74 1x08 h ALA 232 Cb -0.03 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1x08 h ALA 232 CO -0.06 0.40 -0.44 -0.07 0.00 0.00 0.00 179.25 179.08 1x08 h LEU 233 N 0.41 0.65 -0.81 0.00 3.38 -0.50 -2.49 115.31 115.95 1x08 h LEU 233 Ca 0.09 -0.30 -0.11 0.00 0.09 0.00 0.00 57.88 57.65 1x08 h LEU 233 Cb 0.34 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 1x08 h LEU 233 CO 0.01 1.00 -0.51 0.78 0.09 0.00 0.00 178.44 179.81 1x08 h ASN 234 N 0.49 0.00 0.23 -0.43 2.35 -0.90 0.11 115.58 117.43 1x08 h ASN 234 Ca 0.03 0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 55.66 1x08 h ASN 234 Cb 0.97 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.32 1x08 h ASN 234 CO 0.09 0.51 -0.48 0.00 -1.65 0.00 0.00 177.43 175.90 1x08 h ALA 235 N 1.49 0.97 -0.05 -0.83 0.00 -1.21 -1.90 119.26 117.73 1x08 h ALA 235 Ca -0.01 -0.46 -0.02 0.00 0.00 0.00 0.00 54.91 54.42 1x08 h ALA 235 Cb 1.02 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.72 1x08 h ALA 235 CO 0.07 0.65 -0.06 0.35 0.00 0.00 0.00 179.25 180.25 1x08 h PHE 236 N 0.24 0.15 -0.53 0.00 3.57 -0.89 -2.74 116.94 116.74 1x08 h PHE 236 Ca 0.01 -0.05 0.11 0.00 3.53 0.00 0.00 57.97 61.57 1x08 h PHE 236 Cb 0.93 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 39.61 1x08 h PHE 236 CO 0.02 0.62 0.36 0.00 -2.23 0.00 0.00 178.31 177.09 1x08 h ALA 237 N 0.50 2.19 -0.85 2.41 0.00 -0.66 1.08 119.26 123.94 1x08 h ALA 237 Ca 0.00 -0.01 -0.55 0.00 0.00 0.00 0.00 54.91 54.36 1x08 h ALA 237 Cb 0.61 -0.03 -0.25 0.00 0.00 0.00 0.00 17.79 18.12 1x08 h ALA 237 CO 0.02 -0.32 0.71 0.09 0.00 0.00 0.00 179.25 179.74 1x08 n ASN 238 N -4.45 6.55 -0.11 0.00 3.02 -0.73 -4.47 115.26 115.08 1x08 n ASN 238 Ca 0.09 -3.53 0.00 0.00 -0.03 0.00 0.00 54.58 51.10 1x08 n ASN 238 Cb 0.44 -0.96 0.00 0.00 -0.61 0.00 0.00 39.78 38.65 1x08 n ASN 238 CO 0.00 0.00 0.00 -2.11 -2.62 0.00 0.00 177.26 172.53 1x08 n ARG 239 N -0.63 0.80 0.00 3.52 1.85 0.37 -4.95 116.66 117.63 1x08 n ARG 239 Ca 0.53 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 57.38 1x08 n ARG 239 Cb 0.82 -1.09 0.00 0.00 -1.05 0.00 0.00 32.46 31.15 1x08 n ARG 239 CO 0.00 0.00 0.00 -0.85 -0.01 0.00 0.00 177.63 176.77