#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ba8 s VAL 17 N 0.00 3.26 -1.22 1.39 1.01 0.10 -4.02 120.40 120.93 1ba8 s VAL 17 Ca 0.00 -0.57 -0.02 0.00 0.00 0.00 0.00 61.98 61.39 1ba8 s VAL 17 Cb 0.00 -2.42 0.00 0.00 0.00 0.00 0.00 36.38 33.97 1ba8 s VAL 17 CO 0.00 0.49 0.32 -0.62 0.00 0.00 0.00 175.10 175.29 1ba8 n GLU 18 N 3.96 -2.97 -0.50 2.72 -0.58 -1.26 -1.77 120.64 120.23 1ba8 n GLU 18 Ca -0.18 0.71 0.00 0.00 -0.42 0.00 0.00 57.16 57.26 1ba8 n GLU 18 Cb 0.52 -5.09 0.00 0.00 -0.57 0.00 0.00 31.44 26.30 1ba8 n GLU 18 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1ba8 n GLY 19 N -1.24 2.31 3.37 0.62 0.00 -1.26 -4.74 105.19 104.25 1ba8 n GLY 19 Ca -0.11 -2.08 -0.19 0.00 0.00 0.00 0.00 46.02 43.64 1ba8 n GLY 19 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ba8 s SER 20 N -0.90 1.97 0.32 1.61 0.01 -0.19 -4.91 113.70 111.60 1ba8 s SER 20 Ca 0.00 -1.29 -0.28 0.00 1.31 0.00 0.00 55.95 55.70 1ba8 s SER 20 Cb 0.00 -0.01 -0.09 0.00 0.21 0.00 0.00 66.02 66.13 1ba8 s SER 20 CO 0.00 -0.56 1.11 -1.81 0.41 0.00 0.00 173.24 172.39 1ba8 s ASP 21 N -3.37 7.06 0.66 2.44 1.01 -1.26 -0.87 116.67 122.34 1ba8 s ASP 21 Ca 0.32 2.26 -0.12 0.00 0.71 0.00 0.00 52.55 55.72 1ba8 s ASP 21 Cb 0.07 -2.62 -0.01 0.00 1.01 0.00 0.00 42.92 41.37 1ba8 s ASP 21 CO 0.12 -0.29 1.05 0.00 0.21 0.00 0.00 175.17 176.26 1ba8 s ALA 22 N -1.28 2.77 0.33 5.23 0.00 0.26 -4.77 121.76 124.30 1ba8 s ALA 22 Ca 0.49 0.11 -0.05 0.00 0.00 0.00 0.00 51.96 52.50 1ba8 s ALA 22 Cb -0.30 -3.17 -0.05 0.00 0.00 0.00 0.00 23.12 19.60 1ba8 s ALA 22 CO 0.39 -1.02 0.61 -1.21 0.00 0.00 0.00 175.76 174.53 1ba8 s GLU 23 N -4.86 3.64 0.34 0.00 2.02 -1.26 -4.91 118.70 113.68 1ba8 s GLU 23 Ca 0.58 0.07 -0.29 0.00 0.02 0.00 0.00 54.97 55.36 1ba8 s GLU 23 Cb -0.14 -2.58 -0.11 0.00 0.10 0.00 0.00 34.13 31.41 1ba8 s GLU 23 CO 0.51 0.12 1.47 0.42 0.02 0.00 0.00 175.26 177.80 1ba8 s ILE 24 N -2.22 2.21 0.00 -1.63 -1.09 -1.26 -2.06 121.20 115.16 1ba8 s ILE 24 Ca 0.45 0.21 0.00 0.00 -2.23 0.00 0.00 60.65 59.08 1ba8 s ILE 24 Cb -0.10 -3.13 0.00 0.00 -1.58 0.00 0.00 42.46 37.64 1ba8 s ILE 24 CO 0.32 0.05 0.00 0.61 -1.23 0.00 0.00 174.94 174.69 1ba8 n GLY 25 N 0.94 0.38 0.20 6.18 0.00 -1.26 -4.90 105.19 106.72 1ba8 n GLY 25 Ca 0.02 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.02 1ba8 n GLY 25 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1ba8 h MET 26 N 1.01 0.27 -1.82 1.61 -1.53 -1.79 -3.36 114.93 109.33 1ba8 h MET 26 Ca 0.00 -0.12 -0.53 0.00 -3.44 0.00 0.00 59.70 55.61 1ba8 h MET 26 Cb 0.25 -0.01 -0.36 0.00 -0.55 0.00 0.00 31.60 30.93 1ba8 h MET 26 CO 0.00 0.62 -1.04 0.45 0.14 0.00 0.00 176.91 177.09 1ba8 n SER 27 N -4.04 -0.20 0.32 1.39 2.88 -1.26 -4.98 113.62 107.73 1ba8 n SER 27 Ca -0.01 -2.73 0.22 0.00 -1.33 0.00 0.00 58.87 55.01 1ba8 n SER 27 Cb 0.47 -0.37 1.12 0.00 -0.75 0.00 0.00 64.21 64.67 1ba8 n SER 27 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 1ba8 h PRO 28 N 4.10 0.00 -0.01 -1.46 0.13 -1.79 -1.15 132.00 131.82 1ba8 h PRO 28 Ca 0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.19 1ba8 h PRO 28 Cb 0.90 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.03 1ba8 h PRO 28 CO 0.44 0.00 -0.06 -2.67 -0.23 0.00 0.00 178.00 175.48 1ba8 n TRP 29 N -3.03 0.00 -2.15 1.56 2.14 -0.93 -2.55 117.44 112.48 1ba8 n TRP 29 Ca -0.02 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 59.12 1ba8 n TRP 29 Cb 0.10 -0.02 -0.03 0.00 -0.81 0.00 0.00 31.31 30.55 1ba8 n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 1ba8 s GLN 30 N -2.11 4.29 0.02 -2.67 2.00 -0.44 -0.54 119.66 120.22 1ba8 s GLN 30 Ca 0.34 2.08 0.07 0.00 -2.00 0.00 0.00 55.36 55.86 1ba8 s GLN 30 Cb 0.21 -3.41 -0.02 0.00 0.80 0.00 0.00 33.01 30.58 1ba8 s GLN 30 CO 0.37 -0.53 -0.22 0.08 -0.50 0.00 0.00 175.29 174.49 1ba8 s VAL 31 N 1.79 1.78 -0.22 1.34 1.01 -0.58 -4.25 120.40 121.26 1ba8 s VAL 31 Ca 0.66 -1.15 -0.08 0.00 0.00 0.00 0.00 61.98 61.41 1ba8 s VAL 31 Cb -0.35 -1.52 -0.04 0.00 0.00 0.00 0.00 36.38 34.47 1ba8 s VAL 31 CO 0.29 0.33 0.08 -0.32 0.00 0.00 0.00 175.10 175.48 1ba8 s MET 32 N -0.97 3.83 -0.30 2.72 1.75 -0.56 -1.41 119.30 124.36 1ba8 s MET 32 Ca 0.09 -0.40 -0.22 0.00 -1.25 0.00 0.00 55.69 53.90 1ba8 s MET 32 Cb -0.09 -3.32 -0.00 0.00 2.84 0.00 0.00 34.83 34.26 1ba8 s MET 32 CO 0.01 0.01 0.72 -0.51 -0.65 0.00 0.00 175.02 174.60 1ba8 s LEU 33 N 1.11 4.11 -0.10 4.11 1.43 0.30 -1.01 118.68 128.64 1ba8 s LEU 33 Ca 0.05 0.60 0.03 0.00 -1.03 0.00 0.00 54.13 53.77 1ba8 s LEU 33 Cb -0.14 -2.97 0.01 0.00 0.03 0.00 0.00 46.19 43.12 1ba8 s LEU 33 CO 0.04 -0.54 -0.18 0.12 0.23 0.00 0.00 176.35 176.01 1ba8 s PHE 34 N 2.79 2.13 0.07 0.29 5.36 -0.05 -0.58 117.98 127.99 1ba8 s PHE 34 Ca 0.29 -0.93 -0.29 0.00 -0.96 0.00 0.00 56.93 55.05 1ba8 s PHE 34 Cb -0.15 -1.48 -0.05 0.00 -0.34 0.00 0.00 43.02 41.00 1ba8 s PHE 34 CO 0.12 -0.43 0.91 0.50 -1.46 0.00 0.00 175.22 174.86 1ba8 s ARG 35 N 0.68 4.62 0.18 10.12 3.52 0.61 -0.64 118.95 138.03 1ba8 s ARG 35 Ca -0.13 1.33 -0.10 0.00 -0.13 0.00 0.00 55.73 56.71 1ba8 s ARG 35 Cb -0.16 -3.39 0.07 0.00 -1.56 0.00 0.00 34.95 29.91 1ba8 s ARG 35 CO 0.03 0.19 1.66 0.87 -0.81 0.00 0.00 175.30 177.24 1ba8 h LYS 36 N 5.83 1.04 -1.45 5.12 1.57 -1.68 -2.19 116.57 124.81 1ba8 h LYS 36 Ca -0.43 -0.29 0.10 0.00 -1.87 0.00 0.00 60.65 58.15 1ba8 h LYS 36 Cb 1.21 -0.12 -0.21 0.00 0.08 0.00 0.00 32.23 33.20 1ba8 h LYS 36 CO 0.72 0.98 -0.16 0.45 -0.57 0.00 0.00 179.45 180.87 1ba8 s SER 36 N -6.45 -1.20 0.60 0.86 0.15 -1.26 -3.78 113.70 102.62 1ba8 s SER 36 Ca -0.12 1.19 -0.19 0.00 0.70 0.00 0.00 55.95 57.52 1ba8 s SER 36 Cb 0.13 2.18 -0.04 0.00 -1.71 0.00 0.00 66.02 66.59 1ba8 s SER 36 CO 0.84 -0.23 1.20 -0.81 1.20 0.00 0.00 173.24 175.45 1ba8 n PRO 37 N 5.42 1.21 -2.37 5.44 -0.04 -1.26 -5.03 135.00 138.36 1ba8 n PRO 37 Ca -0.07 0.46 -0.42 0.00 -0.04 0.00 0.00 63.50 63.43 1ba8 n PRO 37 Cb 0.50 -2.41 -0.02 0.00 -0.04 0.00 0.00 33.50 31.52 1ba8 n PRO 37 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1ba8 s GLN 38 N -3.00 3.40 0.07 0.54 -0.21 -1.25 -4.65 119.66 114.56 1ba8 s GLN 38 Ca 0.77 0.64 -0.09 0.00 0.02 0.00 0.00 55.36 56.71 1ba8 s GLN 38 Cb -0.41 -4.09 -0.00 0.00 1.00 0.00 0.00 33.01 29.51 1ba8 s GLN 38 CO 0.45 -1.80 0.18 -1.83 -2.12 0.00 0.00 175.29 170.17 1ba8 s GLU 39 N 5.30 0.78 -0.14 2.91 -1.05 -0.82 -4.94 118.70 120.74 1ba8 s GLU 39 Ca 0.56 -0.86 -0.29 0.00 -0.15 0.00 0.00 54.97 54.23 1ba8 s GLU 39 Cb -0.12 0.32 -0.02 0.00 -0.44 0.00 0.00 34.13 33.87 1ba8 s GLU 39 CO 0.28 -0.24 1.26 -1.17 0.95 0.00 0.00 175.26 176.34 1ba8 s LEU 40 N -2.60 4.21 -0.20 1.83 2.96 -1.26 -0.28 118.68 123.33 1ba8 s LEU 40 Ca 0.02 1.73 -0.18 0.00 -0.22 0.00 0.00 54.13 55.48 1ba8 s LEU 40 Cb 0.03 -3.54 -0.15 0.00 0.50 0.00 0.00 46.19 43.03 1ba8 s LEU 40 CO -0.09 -0.73 0.09 0.18 -1.32 0.00 0.00 176.35 174.49 1ba8 n LEU 41 N 6.29 1.85 0.00 -0.68 4.32 0.25 -4.93 117.00 124.11 1ba8 n LEU 41 Ca 0.13 0.46 -0.03 0.00 -0.02 0.00 0.00 56.01 56.56 1ba8 n LEU 41 Cb 0.45 -0.94 0.02 0.00 -1.62 0.00 0.00 43.42 41.33 1ba8 n LEU 41 CO 0.56 0.12 0.77 0.00 -1.22 0.00 0.00 177.39 177.62 1ba8 s GLY 43 N -3.36 1.74 0.06 0.00 0.00 0.18 -0.54 107.32 105.40 1ba8 s GLY 43 Ca 0.22 -2.06 -0.18 0.00 0.00 0.00 0.00 44.72 42.69 1ba8 s GLY 43 CO 0.06 -1.59 0.85 0.00 0.00 0.00 0.00 173.10 172.42 1ba8 n ALA 44 N -2.33 -2.33 -3.15 3.20 0.00 -0.50 -3.63 120.51 111.76 1ba8 n ALA 44 Ca 0.15 -0.67 -0.12 0.00 0.00 0.00 0.00 53.44 52.80 1ba8 n ALA 44 Cb 0.61 0.26 -0.10 0.00 0.00 0.00 0.00 19.45 20.23 1ba8 n ALA 44 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1ba8 s SER 45 N -2.95 -0.11 -0.21 0.00 1.04 -0.21 -1.53 113.70 109.73 1ba8 s SER 45 Ca 0.20 0.06 -0.20 0.00 0.48 0.00 0.00 55.95 56.49 1ba8 s SER 45 Cb -0.01 0.31 -0.02 0.00 0.10 0.00 0.00 66.02 66.39 1ba8 s SER 45 CO 0.02 -0.32 0.61 -0.22 0.98 0.00 0.00 173.24 174.31 1ba8 s LEU 46 N -0.98 4.13 -0.07 2.42 2.96 0.29 -0.85 118.68 126.58 1ba8 s LEU 46 Ca -0.11 0.78 0.14 0.00 -0.22 0.00 0.00 54.13 54.72 1ba8 s LEU 46 Cb -0.05 -2.85 -0.20 0.00 0.50 0.00 0.00 46.19 43.58 1ba8 s LEU 46 CO 0.02 -0.28 0.20 2.30 -1.32 0.00 0.00 176.35 177.27 1ba8 n ILE 47 N 4.78 0.43 -3.02 6.68 -5.35 -0.78 -1.51 119.36 120.59 1ba8 n ILE 47 Ca -0.02 -0.45 0.00 0.00 -0.27 0.00 0.00 62.75 62.01 1ba8 n ILE 47 Cb 0.50 -0.20 0.00 0.00 -1.74 0.00 0.00 39.64 38.20 1ba8 n ILE 47 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1ba8 n SER 48 N -2.24 0.00 0.05 7.28 3.41 -1.21 -4.66 113.62 116.25 1ba8 n SER 48 Ca -0.12 -0.70 0.13 0.00 -0.26 0.00 0.00 58.87 57.93 1ba8 n SER 48 Cb 0.64 0.00 0.50 0.00 -0.26 0.00 0.00 64.21 65.09 1ba8 n SER 48 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1ba8 n ASP 49 N -1.14 0.42 0.00 4.04 5.75 -1.26 -3.98 116.55 120.37 1ba8 n ASP 49 Ca 0.00 0.51 0.00 0.00 -0.01 0.00 0.00 54.79 55.29 1ba8 n ASP 49 Cb 0.00 -0.61 0.00 0.00 -1.03 0.00 0.00 41.12 39.48 1ba8 n ASP 49 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1ba8 n ARG 50 N -1.88 1.97 -5.06 0.11 5.12 -1.26 -0.45 116.66 115.21 1ba8 n ARG 50 Ca 0.06 -0.20 -0.29 0.00 -1.93 0.00 0.00 57.85 55.50 1ba8 n ARG 50 Cb 0.39 -0.64 -0.16 0.00 -1.16 0.00 0.00 32.46 30.89 1ba8 n ARG 50 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 1ba8 s TRP 51 N -0.34 2.05 -0.04 -1.55 0.52 -1.26 -0.26 118.94 118.07 1ba8 s TRP 51 Ca 0.00 -0.56 0.07 0.00 0.02 0.00 0.00 56.10 55.63 1ba8 s TRP 51 Cb 0.00 -1.35 -0.02 0.00 -1.15 0.00 0.00 33.47 30.95 1ba8 s TRP 51 CO 0.00 -0.16 -0.25 0.08 0.02 0.00 0.00 176.95 176.64 1ba8 s VAL 52 N -0.16 2.10 -0.11 4.03 1.01 0.09 -1.87 120.40 125.49 1ba8 s VAL 52 Ca -0.01 -1.07 -0.02 0.00 0.00 0.00 0.00 61.98 60.88 1ba8 s VAL 52 Cb -0.12 -1.74 -0.03 0.00 0.00 0.00 0.00 36.38 34.49 1ba8 s VAL 52 CO 0.02 0.57 -0.03 -0.22 0.00 0.00 0.00 175.10 175.45 1ba8 s LEU 53 N -0.37 3.38 0.00 3.92 2.96 -0.03 -0.93 118.68 127.61 1ba8 s LEU 53 Ca 0.03 0.01 -0.04 0.00 -0.22 0.00 0.00 54.13 53.91 1ba8 s LEU 53 Cb -0.12 -1.78 0.02 0.00 0.50 0.00 0.00 46.19 44.80 1ba8 s LEU 53 CO 0.02 0.29 0.34 1.07 -1.32 0.00 0.00 176.35 176.74 1ba8 n THR 54 N 2.71 0.00 -3.16 3.68 5.66 -0.67 -1.04 114.28 121.46 1ba8 n THR 54 Ca -0.18 -0.83 -0.39 0.00 -3.05 0.00 0.00 64.05 59.60 1ba8 n THR 54 Cb 0.53 0.59 -0.05 0.00 -1.55 0.00 0.00 70.33 69.84 1ba8 n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1ba8 s ALA 55 N -2.00 3.45 0.28 1.79 0.00 -1.26 -1.56 121.76 122.46 1ba8 s ALA 55 Ca 0.13 0.07 0.02 0.00 0.00 0.00 0.00 51.96 52.18 1ba8 s ALA 55 Cb -0.01 -2.80 0.57 0.00 0.00 0.00 0.00 23.12 20.88 1ba8 s ALA 55 CO 0.10 0.12 1.82 0.00 0.00 0.00 0.00 175.76 177.79 1ba8 h ALA 56 N 5.77 1.50 0.00 0.00 0.00 -1.70 -1.93 119.26 122.89 1ba8 h ALA 56 Ca -0.44 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1ba8 h ALA 56 Cb 1.20 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1ba8 h ALA 56 CO 0.70 0.14 0.00 -2.39 0.00 0.00 0.00 179.25 177.70 1ba8 n HIS 57 N -4.68 0.00 0.14 0.00 1.44 -1.26 -1.36 115.22 109.50 1ba8 n HIS 57 Ca 0.19 0.00 0.02 0.00 -2.01 0.00 0.00 57.72 55.92 1ba8 n HIS 57 Cb 0.40 -0.32 0.09 0.00 0.12 0.00 0.00 29.99 30.28 1ba8 n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1ba8 n LEU 59 N -3.31 2.83 -3.89 0.00 4.77 -0.47 -4.83 117.00 112.10 1ba8 n LEU 59 Ca 0.01 -0.09 -0.28 0.00 -0.03 0.00 0.00 56.01 55.62 1ba8 n LEU 59 Cb 0.70 -0.59 -0.16 0.00 -2.33 0.00 0.00 43.42 41.04 1ba8 n LEU 59 CO 0.40 0.78 -0.42 -0.22 -1.33 0.00 0.00 177.39 176.61 1ba8 s LEU 60 N -6.01 1.64 0.09 2.23 2.96 -0.60 0.13 118.68 119.12 1ba8 s LEU 60 Ca -0.24 -0.69 -0.13 0.00 -0.22 0.00 0.00 54.13 52.85 1ba8 s LEU 60 Cb 0.06 -0.91 0.02 0.00 0.50 0.00 0.00 46.19 45.86 1ba8 s LEU 60 CO 0.43 -0.19 0.31 -0.47 -1.32 0.00 0.00 176.35 175.11 1ba8 s TYR 60 N 1.63 -0.07 0.00 5.38 5.04 0.58 -4.14 117.35 125.77 1ba8 s TYR 60 Ca 0.00 -0.23 0.00 0.00 -2.44 0.00 0.00 57.07 54.40 1ba8 s TYR 60 Cb -0.15 0.12 0.00 0.00 0.35 0.00 0.00 41.96 42.28 1ba8 s TYR 60 CO -0.08 -0.60 0.00 -2.30 -1.34 0.00 0.00 175.55 171.23 1ba8 n PRO 60 N 0.03 0.00 -0.46 4.97 -0.02 -1.26 -2.10 135.00 136.15 1ba8 n PRO 60 Ca -0.16 0.00 0.07 0.00 -2.02 0.00 0.00 63.50 61.39 1ba8 n PRO 60 Cb 0.62 -0.15 0.24 0.00 -0.02 0.00 0.00 33.50 34.20 1ba8 n PRO 60 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 1ba8 n TRP 60 N -0.02 0.90 -3.26 6.00 8.01 -1.26 -4.96 117.44 122.86 1ba8 n TRP 60 Ca 0.00 -0.98 -0.23 0.00 -1.31 0.00 0.00 57.50 54.98 1ba8 n TRP 60 Cb 0.00 -0.33 0.01 0.00 -2.01 0.00 0.00 31.31 28.98 1ba8 n TRP 60 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.69 176.43 1ba8 n ASP 60 N -0.66 -4.53 -4.64 -0.99 8.00 -1.19 -4.94 116.55 107.60 1ba8 n ASP 60 Ca 0.23 -0.36 -0.36 0.00 0.71 0.00 0.00 54.79 55.01 1ba8 n ASP 60 Cb 0.90 -3.71 -0.10 0.00 -0.02 0.00 0.00 41.12 38.19 1ba8 n ASP 60 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 1ba8 s LYS 60 N -5.92 4.01 -0.46 -1.24 2.20 -0.89 -5.00 119.74 112.44 1ba8 s LYS 60 Ca 0.37 -0.31 0.03 0.00 -0.36 0.00 0.00 55.97 55.70 1ba8 s LYS 60 Cb -0.19 -3.39 0.20 0.00 -1.51 0.00 0.00 37.83 32.95 1ba8 s LYS 60 CO 0.46 0.14 0.86 -1.71 -0.36 0.00 0.00 175.35 174.74 1ba8 n ASN 60 N 3.99 -2.79 -4.81 1.43 2.85 -1.16 -0.31 115.26 114.46 1ba8 n ASN 60 Ca -0.16 -2.34 -0.33 0.00 -0.11 0.00 0.00 54.58 51.64 1ba8 n ASN 60 Cb 0.52 1.44 -0.05 0.00 1.24 0.00 0.00 39.78 42.93 1ba8 n ASN 60 CO 0.00 0.00 0.00 -0.36 -2.11 0.00 0.00 177.26 174.79 1ba8 s PHE 60 N 0.87 3.17 0.38 1.20 0.08 0.12 -4.98 117.98 118.81 1ba8 s PHE 60 Ca 0.28 1.57 0.07 0.00 0.12 0.00 0.00 56.93 58.97 1ba8 s PHE 60 Cb 0.06 -2.95 -0.07 0.00 -0.57 0.00 0.00 43.02 39.49 1ba8 s PHE 60 CO -0.08 -0.51 0.01 0.95 -0.10 0.00 0.00 175.22 175.48 1ba8 s THR 60 N -2.16 1.82 0.55 0.64 -4.23 -1.26 -4.85 115.64 106.15 1ba8 s THR 60 Ca 0.64 -2.03 0.31 0.00 -1.18 0.00 0.00 61.69 59.43 1ba8 s THR 60 Cb -0.13 -2.88 0.46 0.00 1.34 0.00 0.00 72.50 71.29 1ba8 s THR 60 CO 0.20 -0.04 1.89 -0.33 -0.54 0.00 0.00 174.62 175.79 1ba8 h GLU 61 N 1.91 0.00 -0.02 3.99 3.07 -1.94 -2.10 114.58 119.48 1ba8 h GLU 61 Ca -0.43 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.43 1ba8 h GLU 61 Cb 1.24 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.15 1ba8 h GLU 61 CO 0.76 0.00 0.00 0.09 -1.40 0.00 0.00 179.01 178.46 1ba8 n ASN 62 N -4.13 1.76 0.09 1.42 3.02 -1.26 -3.71 115.26 112.46 1ba8 n ASN 62 Ca 0.16 -1.59 0.08 0.00 -0.03 0.00 0.00 54.58 53.20 1ba8 n ASN 62 Cb 0.89 -0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 40.05 1ba8 n ASN 62 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 1ba8 h ASP 63 N 2.75 0.00 -4.02 6.41 3.32 -1.78 -3.48 116.42 119.63 1ba8 h ASP 63 Ca 0.00 0.00 -0.38 0.00 0.02 0.00 0.00 57.03 56.67 1ba8 h ASP 63 Cb 0.59 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 39.99 1ba8 h ASP 63 CO 0.00 0.18 -0.63 -1.48 -1.72 0.00 0.00 179.24 175.59 1ba8 s LEU 64 N -5.59 1.96 0.06 1.55 0.05 -1.24 -1.82 118.68 113.64 1ba8 s LEU 64 Ca -0.00 -1.32 0.05 0.00 0.05 0.00 0.00 54.13 52.90 1ba8 s LEU 64 Cb 0.09 -0.16 -0.03 0.00 -2.05 0.00 0.00 46.19 44.04 1ba8 s LEU 64 CO 0.78 -0.63 -0.13 -0.76 -0.55 0.00 0.00 176.35 175.06 1ba8 s LEU 65 N -3.34 2.24 -0.13 1.48 1.02 0.18 -4.42 118.68 115.71 1ba8 s LEU 65 Ca 0.34 -0.55 -0.04 0.00 0.02 0.00 0.00 54.13 53.90 1ba8 s LEU 65 Cb 0.07 -0.51 -0.03 0.00 0.02 0.00 0.00 46.19 45.74 1ba8 s LEU 65 CO 0.12 -0.05 0.01 -0.69 0.02 0.00 0.00 176.35 175.76 1ba8 s VAL 66 N -1.13 4.38 -0.24 -1.59 1.01 0.17 -0.87 120.40 122.13 1ba8 s VAL 66 Ca -0.02 -0.20 -0.02 0.00 0.00 0.00 0.00 61.98 61.75 1ba8 s VAL 66 Cb -0.09 -2.90 0.02 0.00 0.00 0.00 0.00 36.38 33.41 1ba8 s VAL 66 CO 0.02 0.54 -0.06 -0.13 0.00 0.00 0.00 175.10 175.46 1ba8 s ARG 67 N -0.26 2.87 -0.05 2.72 0.52 -0.18 -1.15 118.95 123.42 1ba8 s ARG 67 Ca 0.06 -0.95 0.03 0.00 -0.52 0.00 0.00 55.73 54.35 1ba8 s ARG 67 Cb -0.12 -2.97 -0.03 0.00 0.52 0.00 0.00 34.95 32.35 1ba8 s ARG 67 CO 0.02 -0.38 -0.12 0.42 0.02 0.00 0.00 175.30 175.26 1ba8 s ILE 68 N 1.33 3.30 0.00 1.52 1.01 0.36 -1.50 121.20 127.22 1ba8 s ILE 68 Ca 0.01 -0.65 0.00 0.00 0.00 0.00 0.00 60.65 60.01 1ba8 s ILE 68 Cb -0.16 -2.32 0.00 0.00 0.01 0.00 0.00 42.46 39.99 1ba8 s ILE 68 CO -0.05 0.58 0.00 0.61 0.00 0.00 0.00 174.94 176.09 1ba8 n GLY 69 N 2.24 0.45 3.87 6.18 0.00 -1.26 -0.52 105.19 116.14 1ba8 n GLY 69 Ca -0.17 -0.92 -0.31 0.00 0.00 0.00 0.00 46.02 44.62 1ba8 n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ba8 s LYS 70 N -2.87 3.71 0.00 1.61 1.02 -1.26 -4.27 119.74 117.68 1ba8 s LYS 70 Ca 0.00 0.69 0.00 0.00 0.02 0.00 0.00 55.97 56.68 1ba8 s LYS 70 Cb 0.00 -2.18 0.00 0.00 -0.52 0.00 0.00 37.83 35.13 1ba8 s LYS 70 CO 0.00 -0.36 0.00 1.58 -0.92 0.00 0.00 175.35 175.65 1ba8 n HIS 71 N -2.17 0.00 -2.69 3.18 -0.00 -1.26 -4.94 115.22 107.34 1ba8 n HIS 71 Ca 0.05 0.00 -0.41 0.00 -0.00 0.00 0.00 57.72 57.36 1ba8 n HIS 71 Cb 0.54 0.33 -0.05 0.00 -0.00 0.00 0.00 29.99 30.81 1ba8 n HIS 71 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 1ba8 s SER 72 N -4.99 7.50 0.02 0.26 0.15 -1.26 -1.21 113.70 114.18 1ba8 s SER 72 Ca 0.00 1.93 -0.28 0.00 0.70 0.00 0.00 55.95 58.30 1ba8 s SER 72 Cb 0.00 -2.60 -0.16 0.00 -1.71 0.00 0.00 66.02 61.55 1ba8 s SER 72 CO 0.00 -0.01 1.22 -0.09 1.20 0.00 0.00 173.24 175.56 1ba8 h ARG 73 N 4.84 -0.86 0.00 5.44 2.43 -1.39 -3.39 114.38 121.46 1ba8 h ARG 73 Ca -0.44 0.06 -0.21 0.00 -0.81 0.00 0.00 59.98 58.58 1ba8 h ARG 73 Cb 1.21 0.19 -0.04 0.00 -0.42 0.00 0.00 29.97 30.91 1ba8 h ARG 73 CO 0.70 -0.54 -1.87 0.25 -1.51 0.00 0.00 179.97 177.01 1ba8 n THR 74 N -5.39 1.05 -2.27 0.20 -2.24 -1.26 -4.99 114.28 99.37 1ba8 n THR 74 Ca -0.12 -0.72 -0.35 0.00 -2.27 0.00 0.00 64.05 60.60 1ba8 n THR 74 Cb 0.37 -0.52 -0.00 0.00 -2.10 0.00 0.00 70.33 68.08 1ba8 n THR 74 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1ba8 s ARG 75 N -2.88 3.40 -0.49 -0.78 1.81 -1.26 -4.98 118.95 113.77 1ba8 s ARG 75 Ca -0.06 1.55 -0.23 0.00 -1.72 0.00 0.00 55.73 55.27 1ba8 s ARG 75 Cb 0.09 -2.02 0.04 0.00 -0.45 0.00 0.00 34.95 32.61 1ba8 s ARG 75 CO 0.84 -0.80 0.80 -0.47 -0.68 0.00 0.00 175.30 174.99 1ba8 s TYR 76 N -1.85 2.94 -1.32 -0.53 5.04 -1.26 -4.90 117.35 115.47 1ba8 s TYR 76 Ca 0.71 -0.02 -0.16 0.00 -2.44 0.00 0.00 57.07 55.17 1ba8 s TYR 76 Cb -0.22 -3.76 0.08 0.00 0.35 0.00 0.00 41.96 38.42 1ba8 s TYR 76 CO 0.27 -1.10 1.82 0.39 -1.34 0.00 0.00 175.55 175.58 1ba8 n GLU 77 N 6.84 3.17 0.00 4.97 1.02 -1.26 -4.89 120.64 130.49 1ba8 n GLU 77 Ca 0.00 -3.22 0.00 0.00 -0.02 0.00 0.00 57.16 53.92 1ba8 n GLU 77 Cb 0.47 -3.35 0.00 0.00 -0.02 0.00 0.00 31.44 28.55 1ba8 n GLU 77 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 1ba8 n ARG 77 N 7.16 0.00 -0.33 3.49 0.63 -1.26 -0.33 116.66 126.02 1ba8 n ARG 77 Ca 0.47 0.00 0.08 0.00 -0.92 0.00 0.00 57.85 57.48 1ba8 n ARG 77 Cb 0.43 0.00 0.17 0.00 0.45 0.00 0.00 32.46 33.52 1ba8 n ARG 77 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1ba8 n ASN 78 N -3.00 2.06 -0.06 6.15 5.03 -1.26 -4.74 115.26 119.45 1ba8 n ASN 78 Ca 0.00 -3.48 -0.11 0.00 0.87 0.00 0.00 54.58 51.86 1ba8 n ASN 78 Cb 0.00 -0.48 -0.04 0.00 -1.02 0.00 0.00 39.78 38.24 1ba8 n ASN 78 CO 0.00 0.00 0.00 -0.38 -1.83 0.00 0.00 177.26 175.05 1ba8 n ILE 79 N -1.28 1.25 -2.45 2.41 5.41 0.55 -5.04 119.36 120.21 1ba8 n ILE 79 Ca 0.18 0.05 -0.32 0.00 1.00 0.00 0.00 62.75 63.66 1ba8 n ILE 79 Cb 0.67 -1.96 -0.03 0.00 -0.71 0.00 0.00 39.64 37.61 1ba8 n ILE 79 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 176.55 174.72 1ba8 s GLU 80 N -2.49 3.93 -0.04 0.38 -1.05 -0.43 -4.78 118.70 114.22 1ba8 s GLU 80 Ca -0.21 0.90 0.07 0.00 -0.15 0.00 0.00 54.97 55.58 1ba8 s GLU 80 Cb 0.05 -2.17 -0.02 0.00 -0.44 0.00 0.00 34.13 31.56 1ba8 s GLU 80 CO 0.29 -0.24 -0.25 0.15 0.95 0.00 0.00 175.26 176.16 1ba8 s LYS 81 N -4.04 2.31 -0.15 -4.83 -0.14 0.32 -4.89 119.74 108.32 1ba8 s LYS 81 Ca 0.58 -0.91 -0.01 0.00 -1.36 0.00 0.00 55.97 54.26 1ba8 s LYS 81 Cb -0.10 -2.09 -0.02 0.00 -1.68 0.00 0.00 37.83 33.94 1ba8 s LYS 81 CO 0.31 0.47 -0.10 0.42 -0.76 0.00 0.00 175.35 175.69 1ba8 s ILE 82 N -0.39 3.23 0.14 2.17 1.01 -1.26 -0.49 121.20 125.61 1ba8 s ILE 82 Ca 0.03 -0.59 0.08 0.00 0.00 0.00 0.00 60.65 60.18 1ba8 s ILE 82 Cb -0.12 -2.38 -0.04 0.00 0.01 0.00 0.00 42.46 39.93 1ba8 s ILE 82 CO 0.01 0.51 -0.19 -0.44 0.00 0.00 0.00 174.94 174.83 1ba8 s SER 83 N 0.53 2.58 0.22 3.58 0.01 -0.30 -4.97 113.70 115.34 1ba8 s SER 83 Ca -0.07 -0.80 -0.04 0.00 1.31 0.00 0.00 55.95 56.34 1ba8 s SER 83 Cb -0.15 -0.14 -0.05 0.00 0.21 0.00 0.00 66.02 65.88 1ba8 s SER 83 CO 0.04 -0.02 0.46 -0.04 0.41 0.00 0.00 173.24 174.09 1ba8 s MET 84 N -2.51 3.62 -0.12 12.44 -1.94 -1.26 -0.65 119.30 128.87 1ba8 s MET 84 Ca 0.12 -0.08 -0.08 0.00 -1.71 0.00 0.00 55.69 53.95 1ba8 s MET 84 Cb -0.07 -2.75 -0.04 0.00 2.01 0.00 0.00 34.83 33.98 1ba8 s MET 84 CO 0.06 0.34 0.16 -0.51 -0.01 0.00 0.00 175.02 175.06 1ba8 s LEU 85 N -3.16 4.37 -0.11 -0.03 1.43 -1.26 -1.63 118.68 118.28 1ba8 s LEU 85 Ca 0.42 0.47 -0.15 0.00 -1.03 0.00 0.00 54.13 53.84 1ba8 s LEU 85 Cb -0.11 -2.11 -0.26 0.00 0.03 0.00 0.00 46.19 43.74 1ba8 s LEU 85 CO 0.27 0.37 0.51 -0.08 0.23 0.00 0.00 176.35 177.65 1ba8 h GLU 86 N 5.20 0.23 -2.22 1.70 4.81 -0.22 -3.44 114.58 120.64 1ba8 h GLU 86 Ca -0.53 -0.39 -0.06 0.00 -0.13 0.00 0.00 59.36 58.25 1ba8 h GLU 86 Cb 1.22 0.14 -0.18 0.00 0.63 0.00 0.00 28.75 30.56 1ba8 h GLU 86 CO 0.61 1.18 0.13 0.15 -0.73 0.00 0.00 179.01 180.36 1ba8 s LYS 87 N -2.48 1.03 -0.07 1.92 -0.14 -1.05 -4.99 119.74 113.96 1ba8 s LYS 87 Ca -0.21 0.13 0.03 0.00 -1.36 0.00 0.00 55.97 54.57 1ba8 s LYS 87 Cb 0.05 0.48 -0.02 0.00 -1.68 0.00 0.00 37.83 36.66 1ba8 s LYS 87 CO 0.75 -0.33 -0.16 0.42 -0.76 0.00 0.00 175.35 175.27 1ba8 s ILE 88 N -1.45 2.90 -0.16 2.17 1.01 -1.26 -0.61 121.20 123.79 1ba8 s ILE 88 Ca -0.10 -0.76 0.00 0.00 0.00 0.00 0.00 60.65 59.79 1ba8 s ILE 88 Cb -0.01 -2.15 0.04 0.00 0.01 0.00 0.00 42.46 40.35 1ba8 s ILE 88 CO 0.07 0.57 -0.09 -0.31 0.00 0.00 0.00 174.94 175.18 1ba8 s TYR 89 N -0.32 1.95 -0.10 3.97 1.51 0.12 -5.00 117.35 119.49 1ba8 s TYR 89 Ca 0.02 -1.20 -0.06 0.00 -1.01 0.00 0.00 57.07 54.83 1ba8 s TYR 89 Cb -0.13 -1.44 -0.04 0.00 -0.11 0.00 0.00 41.96 40.24 1ba8 s TYR 89 CO 0.02 -0.65 0.14 0.42 -1.11 0.00 0.00 175.55 174.38 1ba8 s ILE 90 N 1.55 5.40 0.18 2.71 1.01 -1.26 -1.37 121.20 129.42 1ba8 s ILE 90 Ca 0.02 0.10 -0.33 0.00 0.00 0.00 0.00 60.65 60.44 1ba8 s ILE 90 Cb -0.15 -3.38 -0.14 0.00 0.01 0.00 0.00 42.46 38.80 1ba8 s ILE 90 CO -0.08 0.56 1.49 1.57 0.00 0.00 0.00 174.94 178.48 1ba8 n HIS 91 N 1.80 2.13 -0.12 3.97 -0.00 -1.13 -4.82 115.22 117.05 1ba8 n HIS 91 Ca -0.18 0.37 0.16 0.00 -0.00 0.00 0.00 57.72 58.06 1ba8 n HIS 91 Cb 0.54 -2.49 0.54 0.00 -0.00 0.00 0.00 29.99 28.59 1ba8 n HIS 91 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 1ba8 h PRO 92 N 5.21 0.32 -0.66 1.57 0.13 -1.95 -2.14 132.00 134.48 1ba8 h PRO 92 Ca -0.45 -0.02 -0.34 0.00 -0.87 0.00 0.00 66.00 64.32 1ba8 h PRO 92 Cb 1.27 -0.07 -0.20 0.00 0.13 0.00 0.00 31.00 32.13 1ba8 h PRO 92 CO 0.83 0.21 0.27 0.54 -0.23 0.00 0.00 178.00 179.63 1ba8 n ARG 93 N -4.46 2.10 -1.79 0.86 1.74 -1.26 -4.96 116.66 108.88 1ba8 n ARG 93 Ca 0.13 -3.10 -0.42 0.00 -0.77 0.00 0.00 57.85 53.68 1ba8 n ARG 93 Cb 0.52 -2.00 -0.03 0.00 -1.02 0.00 0.00 32.46 29.93 1ba8 n ARG 93 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 1ba8 s TYR 94 N -3.26 1.78 -1.14 -1.55 5.04 -0.81 -4.70 117.35 112.71 1ba8 s TYR 94 Ca 0.51 -0.11 -0.11 0.00 -2.44 0.00 0.00 57.07 54.92 1ba8 s TYR 94 Cb 0.44 -4.12 0.24 0.00 0.35 0.00 0.00 41.96 38.88 1ba8 s TYR 94 CO 0.05 -4.79 1.21 1.21 -1.34 0.00 0.00 175.55 171.89 1ba8 s ASN 95 N 3.53 7.24 0.45 4.32 3.84 -0.28 -4.80 114.94 129.24 1ba8 s ASN 95 Ca 0.81 -3.40 0.24 0.00 0.21 0.00 0.00 52.86 50.72 1ba8 s ASN 95 Cb -0.41 -2.27 0.48 0.00 -0.55 0.00 0.00 41.25 38.50 1ba8 s ASN 95 CO 0.36 -0.44 1.66 4.11 -2.79 0.00 0.00 177.10 180.01 1ba8 h TRP 96 N 6.83 0.00 0.00 0.43 5.08 -1.91 -0.44 115.95 125.94 1ba8 h TRP 96 Ca 0.22 0.00 -0.05 0.00 1.08 0.00 0.00 58.89 60.14 1ba8 h TRP 96 Cb 0.87 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 27.03 1ba8 h TRP 96 CO 0.87 0.03 -0.24 0.00 -1.28 0.00 0.00 178.44 177.82 1ba8 h ARG 97 N 0.00 0.00 0.00 0.12 3.08 -2.00 -3.43 114.38 112.15 1ba8 h ARG 97 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1ba8 h ARG 97 Cb 0.95 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.00 1ba8 h ARG 97 CO 0.00 0.24 -0.12 -1.91 -1.07 0.00 0.00 179.97 177.11 1ba8 n GLU 97 N -3.70 0.00 0.00 0.04 2.13 -1.19 -5.00 120.64 112.91 1ba8 n GLU 97 Ca -0.01 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.81 1ba8 n GLU 97 Cb 0.35 -0.19 0.00 0.00 0.27 0.00 0.00 31.44 31.87 1ba8 n GLU 97 CO 0.00 0.00 0.00 0.27 -0.41 0.00 0.00 177.13 176.99 1ba8 n ASN 98 N -3.25 1.07 -1.13 4.31 6.94 -1.22 -4.99 115.26 116.99 1ba8 n ASN 98 Ca 0.00 -1.51 -0.11 0.00 -0.02 0.00 0.00 54.58 52.95 1ba8 n ASN 98 Cb 0.06 0.00 -0.01 0.00 -2.36 0.00 0.00 39.78 37.47 1ba8 n ASN 98 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 1ba8 n LEU 99 N -0.25 -1.34 -4.76 -4.53 4.32 -0.18 -4.96 117.00 105.29 1ba8 n LEU 99 Ca 0.00 0.05 -0.41 0.00 -0.02 0.00 0.00 56.01 55.62 1ba8 n LEU 99 Cb 0.33 -1.73 -0.01 0.00 -1.62 0.00 0.00 43.42 40.39 1ba8 n LEU 99 CO 0.00 -0.20 1.10 -0.62 -1.22 0.00 0.00 177.39 176.45 1ba8 s ASP 100 N -2.59 6.55 -1.20 -1.43 2.15 -1.24 -2.89 116.67 116.03 1ba8 s ASP 100 Ca 0.00 2.83 -0.01 0.00 0.43 0.00 0.00 52.55 55.80 1ba8 s ASP 100 Cb 0.00 -2.65 -0.01 0.00 -0.30 0.00 0.00 42.92 39.97 1ba8 s ASP 100 CO 0.00 -0.74 0.95 0.54 -0.17 0.00 0.00 175.17 175.75 1ba8 n ARG 101 N 1.32 -5.90 -2.56 4.34 1.74 -1.26 -1.13 116.66 113.21 1ba8 n ARG 101 Ca 0.03 0.82 -0.42 0.00 -0.77 0.00 0.00 57.85 57.51 1ba8 n ARG 101 Cb 0.40 -5.76 -0.01 0.00 -1.02 0.00 0.00 32.46 26.07 1ba8 n ARG 101 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1ba8 s ASP 102 N -4.25 6.67 -0.04 0.55 2.15 -1.14 -4.40 116.67 116.21 1ba8 s ASP 102 Ca 0.05 -2.07 -0.17 0.00 0.43 0.00 0.00 52.55 50.79 1ba8 s ASP 102 Cb -0.01 -2.58 0.03 0.00 -0.30 0.00 0.00 42.92 40.07 1ba8 s ASP 102 CO 0.74 -1.34 0.38 -0.51 -0.17 0.00 0.00 175.17 174.27 1ba8 s ILE 103 N 4.66 0.04 -0.04 4.11 2.07 -1.26 -4.05 121.20 126.72 1ba8 s ILE 103 Ca 0.52 -0.33 -0.26 0.00 -1.41 0.00 0.00 60.65 59.16 1ba8 s ILE 103 Cb 0.02 -0.66 0.06 0.00 0.13 0.00 0.00 42.46 42.01 1ba8 s ILE 103 CO 0.02 -0.18 0.58 0.00 -1.91 0.00 0.00 174.94 173.44 1ba8 s ALA 104 N -1.07 -1.49 -0.02 1.50 0.00 -0.60 -2.85 121.76 117.23 1ba8 s ALA 104 Ca -0.11 1.06 0.03 0.00 0.00 0.00 0.00 51.96 52.93 1ba8 s ALA 104 Cb -0.04 -0.00 -0.03 0.00 0.00 0.00 0.00 23.12 23.04 1ba8 s ALA 104 CO 0.04 -0.34 -0.08 -0.51 0.00 0.00 0.00 175.76 174.88 1ba8 s LEU 105 N -1.19 3.11 -0.06 0.00 1.43 -0.47 -1.67 118.68 119.83 1ba8 s LEU 105 Ca -0.11 -0.12 0.02 0.00 -1.03 0.00 0.00 54.13 52.89 1ba8 s LEU 105 Cb -0.02 -1.74 0.01 0.00 0.03 0.00 0.00 46.19 44.48 1ba8 s LEU 105 CO 0.08 0.31 -0.12 -0.04 0.23 0.00 0.00 176.35 176.81 1ba8 s MET 106 N -1.15 1.67 -0.19 1.70 -1.94 -0.11 0.14 119.30 119.43 1ba8 s MET 106 Ca 0.15 -0.42 -0.06 0.00 -1.71 0.00 0.00 55.69 53.64 1ba8 s MET 106 Cb -0.11 -1.39 -0.03 0.00 2.01 0.00 0.00 34.83 35.30 1ba8 s MET 106 CO 0.05 0.05 0.03 -1.59 -0.01 0.00 0.00 175.02 173.55 1ba8 s LYS 107 N 0.60 3.82 0.50 2.03 -2.85 0.22 -0.73 119.74 123.32 1ba8 s LYS 107 Ca -0.13 -0.42 -0.20 0.00 -1.00 0.00 0.00 55.97 54.21 1ba8 s LYS 107 Cb -0.15 -3.15 -0.08 0.00 -2.06 0.00 0.00 37.83 32.39 1ba8 s LYS 107 CO 0.04 0.17 1.05 -0.51 0.10 0.00 0.00 175.35 176.20 1ba8 s LEU 108 N 0.62 3.83 0.33 2.77 1.43 0.64 0.46 118.68 128.76 1ba8 s LEU 108 Ca 0.01 1.96 0.04 0.00 -1.03 0.00 0.00 54.13 55.12 1ba8 s LEU 108 Cb -0.13 -4.56 0.58 0.00 0.03 0.00 0.00 46.19 42.10 1ba8 s LEU 108 CO 0.02 -0.85 1.85 0.11 0.23 0.00 0.00 176.35 177.71 1ba8 h LYS 109 N 1.49 0.50 -3.73 1.70 1.79 -1.59 -3.40 116.57 113.32 1ba8 h LYS 109 Ca -0.50 -0.12 -0.20 0.00 -2.18 0.00 0.00 60.65 57.66 1ba8 h LYS 109 Cb 1.23 -0.06 -0.25 0.00 -1.58 0.00 0.00 32.23 31.56 1ba8 h LYS 109 CO 0.59 0.57 -0.66 0.15 -1.08 0.00 0.00 179.45 179.01 1ba8 s LYS 110 N -4.86 0.17 0.47 3.15 -0.14 -1.26 -4.98 119.74 112.28 1ba8 s LYS 110 Ca -0.07 -0.19 -0.24 0.00 -1.36 0.00 0.00 55.97 54.11 1ba8 s LYS 110 Cb 0.15 0.07 -0.08 0.00 -1.68 0.00 0.00 37.83 36.29 1ba8 s LYS 110 CO 0.77 -0.03 1.33 -2.30 -0.76 0.00 0.00 175.35 174.36 1ba8 n PRO 111 N 2.47 1.94 -3.55 -1.68 -0.02 -1.26 -4.88 135.00 128.01 1ba8 n PRO 111 Ca -0.17 0.70 -0.34 0.00 -2.02 0.00 0.00 63.50 61.67 1ba8 n PRO 111 Cb 0.58 -2.50 -0.05 0.00 -0.02 0.00 0.00 33.50 31.51 1ba8 n PRO 111 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1ba8 s VAL 112 N -1.23 5.06 -0.06 -1.45 0.11 0.41 -5.00 120.40 118.23 1ba8 s VAL 112 Ca 0.64 0.42 -0.11 0.00 -2.93 0.00 0.00 61.98 60.00 1ba8 s VAL 112 Cb -0.47 -3.65 -0.05 0.00 -1.53 0.00 0.00 36.38 30.69 1ba8 s VAL 112 CO 0.55 0.19 0.26 0.00 -3.33 0.00 0.00 175.10 172.78 1ba8 s ALA 113 N -1.51 3.79 0.72 1.54 0.00 -1.26 -4.79 121.76 120.26 1ba8 s ALA 113 Ca 0.37 -0.44 -0.11 0.00 0.00 0.00 0.00 51.96 51.77 1ba8 s ALA 113 Cb -0.13 -2.16 0.02 0.00 0.00 0.00 0.00 23.12 20.84 1ba8 s ALA 113 CO 0.20 0.55 1.07 -0.06 0.00 0.00 0.00 175.76 177.52 1ba8 s PHE 114 N -1.04 2.91 0.05 0.00 0.08 -1.26 -4.90 117.98 113.82 1ba8 s PHE 114 Ca 0.19 1.48 -0.03 0.00 0.12 0.00 0.00 56.93 58.68 1ba8 s PHE 114 Cb -0.14 -2.95 0.01 0.00 -0.57 0.00 0.00 43.02 39.37 1ba8 s PHE 114 CO 0.08 -1.43 0.17 -1.13 -0.10 0.00 0.00 175.22 172.81 1ba8 n SER 115 N -3.19 -0.38 0.29 1.36 3.41 -0.32 -4.93 113.62 109.87 1ba8 n SER 115 Ca 0.08 -1.23 0.18 0.00 -0.26 0.00 0.00 58.87 57.64 1ba8 n SER 115 Cb 0.53 0.62 0.88 0.00 -0.26 0.00 0.00 64.21 65.98 1ba8 n SER 115 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1ba8 h ASP 116 N 0.37 0.00 -0.01 4.04 3.32 -1.99 -3.15 116.42 119.00 1ba8 h ASP 116 Ca -0.06 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.99 1ba8 h ASP 116 Cb 0.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.78 1ba8 h ASP 116 CO 0.07 0.03 -0.27 -1.22 -1.72 0.00 0.00 179.24 176.14 1ba8 n TYR 117 N -3.23 0.00 -3.87 4.55 4.01 -1.26 -4.74 117.16 112.62 1ba8 n TYR 117 Ca -0.01 0.00 -0.28 0.00 -0.16 0.00 0.00 57.90 57.44 1ba8 n TYR 117 Cb 0.21 0.00 -0.16 0.00 -0.31 0.00 0.00 39.34 39.08 1ba8 n TYR 117 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1ba8 s ILE 118 N -1.56 1.09 -0.28 -0.72 1.01 -1.19 -4.18 121.20 115.38 1ba8 s ILE 118 Ca 0.09 -0.72 -0.20 0.00 0.00 0.00 0.00 60.65 59.82 1ba8 s ILE 118 Cb 0.09 -1.34 0.08 0.00 0.01 0.00 0.00 42.46 41.31 1ba8 s ILE 118 CO 0.31 0.03 0.72 -2.28 0.00 0.00 0.00 174.94 173.72 1ba8 s HIS 119 N 1.63 -0.92 0.58 3.97 2.46 -1.06 -1.18 115.29 120.77 1ba8 s HIS 119 Ca -0.01 1.99 -0.19 0.00 0.47 0.00 0.00 55.06 57.33 1ba8 s HIS 119 Cb -0.16 0.46 -0.04 0.00 -0.13 0.00 0.00 32.58 32.71 1ba8 s HIS 119 CO -0.07 -0.45 1.16 -1.25 -2.47 0.00 0.00 174.74 171.66 1ba8 s PRO 120 N 1.05 3.13 0.39 2.88 0.04 -1.26 -2.19 135.00 139.05 1ba8 s PRO 120 Ca -0.05 1.68 -0.00 0.00 0.04 0.00 0.00 61.00 62.66 1ba8 s PRO 120 Cb -0.05 -1.97 -0.02 0.00 0.04 0.00 0.00 34.50 32.50 1ba8 s PRO 120 CO -0.10 -1.04 0.62 0.54 0.04 0.00 0.00 177.00 177.05 1ba8 s VAL 121 N -1.76 4.75 0.43 -0.36 0.11 -0.57 -4.89 120.40 118.11 1ba8 s VAL 121 Ca 0.74 -0.39 -0.09 0.00 -2.93 0.00 0.00 61.98 59.31 1ba8 s VAL 121 Cb -0.26 -3.75 -0.05 0.00 -1.53 0.00 0.00 36.38 30.78 1ba8 s VAL 121 CO 0.31 -0.53 0.77 0.00 -3.33 0.00 0.00 175.10 172.32 1ba8 s LEU 123 N -4.12 4.39 0.57 0.00 1.43 -1.26 -1.76 118.68 117.93 1ba8 s LEU 123 Ca 0.50 0.53 -0.17 0.00 -1.03 0.00 0.00 54.13 53.96 1ba8 s LEU 123 Cb -0.10 -2.33 -0.05 0.00 0.03 0.00 0.00 46.19 43.74 1ba8 s LEU 123 CO 0.36 0.35 1.08 -2.16 0.23 0.00 0.00 176.35 176.20 1ba8 s PRO 124 N -1.31 3.35 0.34 1.29 0.04 -1.26 -4.92 135.00 132.52 1ba8 s PRO 124 Ca 0.20 1.35 0.07 0.00 0.04 0.00 0.00 61.00 62.66 1ba8 s PRO 124 Cb -0.13 -2.03 -0.01 0.00 0.04 0.00 0.00 34.50 32.37 1ba8 s PRO 124 CO 0.10 -0.80 0.42 0.16 0.04 0.00 0.00 177.00 176.91 1ba8 s ASP 125 N -2.37 5.71 0.43 6.66 1.47 -1.26 -4.92 116.67 122.39 1ba8 s ASP 125 Ca 0.67 -0.32 0.16 0.00 1.18 0.00 0.00 52.55 54.24 1ba8 s ASP 125 Cb -0.18 -1.09 1.07 0.00 -0.34 0.00 0.00 42.92 42.39 1ba8 s ASP 125 CO 0.32 -0.44 1.91 -0.09 0.68 0.00 0.00 175.17 177.55 1ba8 h ARG 126 N 0.99 0.38 0.01 2.11 2.43 -1.97 -0.87 114.38 117.45 1ba8 h ARG 126 Ca -0.45 -0.02 -0.20 0.00 -0.81 0.00 0.00 59.98 58.50 1ba8 h ARG 126 Cb 1.26 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 30.70 1ba8 h ARG 126 CO 0.54 0.25 -0.95 1.05 -1.51 0.00 0.00 179.97 179.35 1ba8 h GLU 127 N 0.39 0.03 -1.17 0.20 9.09 -2.03 -1.71 114.58 119.38 1ba8 h GLU 127 Ca 0.38 -0.04 0.00 0.00 0.05 0.00 0.00 59.36 59.75 1ba8 h GLU 127 Cb 0.91 0.01 0.00 0.00 -1.65 0.00 0.00 28.75 28.02 1ba8 h GLU 127 CO -0.12 0.96 0.00 2.41 0.05 0.00 0.00 179.01 182.31 1ba8 n THR 128 N -3.44 0.35 0.00 -1.06 -1.04 -0.33 -2.08 114.28 106.68 1ba8 n THR 128 Ca -0.01 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.00 1ba8 n THR 128 Cb 0.89 -0.60 0.00 0.00 -1.82 0.00 0.00 70.33 68.80 1ba8 n THR 128 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ba8 n ALA 129 N 0.58 0.00 0.31 2.41 0.00 -0.65 -1.08 120.51 122.08 1ba8 n ALA 129 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.56 1ba8 n ALA 129 Cb 0.22 0.00 0.14 0.00 0.00 0.00 0.00 19.45 19.81 1ba8 n ALA 129 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1ba8 h SER 129 N 0.00 0.00 0.00 0.00 4.64 -1.70 -3.39 113.55 113.10 1ba8 h SER 129 Ca 0.00 -0.05 -0.16 0.00 -0.47 0.00 0.00 61.79 61.11 1ba8 h SER 129 Cb 0.00 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.06 1ba8 h SER 129 CO 0.00 0.02 -1.93 0.18 -0.87 0.00 0.00 176.83 174.23 1ba8 n LEU 129 N -2.64 0.00 -4.38 5.97 4.77 -0.24 -4.73 117.00 115.75 1ba8 n LEU 129 Ca 0.03 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.58 1ba8 n LEU 129 Cb 0.50 0.21 0.00 0.00 -2.33 0.00 0.00 43.42 41.81 1ba8 n LEU 129 CO 0.36 0.21 2.06 0.18 -1.33 0.00 0.00 177.39 178.87 1ba8 n LEU 130 N -2.36 5.40 -4.00 2.23 4.77 -1.26 -4.84 117.00 116.94 1ba8 n LEU 130 Ca -0.16 -4.04 -0.21 0.00 -0.03 0.00 0.00 56.01 51.57 1ba8 n LEU 130 Cb 0.76 -1.71 -0.16 0.00 -2.33 0.00 0.00 43.42 39.98 1ba8 n LEU 130 CO 0.34 0.44 -0.44 -1.10 -1.33 0.00 0.00 177.39 175.30 1ba8 s GLN 131 N 3.62 1.07 0.30 3.23 -0.21 -1.26 -4.94 119.66 121.46 1ba8 s GLN 131 Ca 0.51 -0.32 -0.30 0.00 0.02 0.00 0.00 55.36 55.27 1ba8 s GLN 131 Cb 0.05 -0.98 -0.12 0.00 1.00 0.00 0.00 33.01 32.96 1ba8 s GLN 131 CO 0.04 0.10 1.46 0.00 -2.12 0.00 0.00 175.29 174.77 1ba8 n ALA 132 N 3.38 1.83 0.00 6.09 0.00 -1.26 -1.65 120.51 128.89 1ba8 n ALA 132 Ca -0.19 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.63 1ba8 n ALA 132 Cb 0.54 -2.36 0.00 0.00 0.00 0.00 0.00 19.45 17.63 1ba8 n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ba8 n GLY 133 N 1.64 3.15 3.76 0.00 0.00 -0.24 -4.94 105.19 108.56 1ba8 n GLY 133 Ca 0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 1ba8 n GLY 133 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ba8 s TYR 134 N -2.59 3.40 -0.01 1.61 1.51 -0.66 -4.64 117.35 115.97 1ba8 s TYR 134 Ca 0.00 1.58 -0.04 0.00 -1.01 0.00 0.00 57.07 57.60 1ba8 s TYR 134 Cb 0.00 -3.42 -0.04 0.00 -0.11 0.00 0.00 41.96 38.38 1ba8 s TYR 134 CO 0.00 -1.03 0.20 0.15 -1.11 0.00 0.00 175.55 173.76 1ba8 s LYS 135 N -1.43 3.47 0.50 -0.62 1.02 -1.26 -1.11 119.74 120.31 1ba8 s LYS 135 Ca 0.47 -0.26 0.01 0.00 0.02 0.00 0.00 55.97 56.21 1ba8 s LYS 135 Cb -0.34 -3.09 -0.01 0.00 -0.52 0.00 0.00 37.83 33.86 1ba8 s LYS 135 CO 0.44 0.67 0.04 0.20 -0.92 0.00 0.00 175.35 175.78 1ba8 s GLY 136 N -1.85 3.00 -0.03 -3.33 0.00 -0.05 -4.86 107.32 100.20 1ba8 s GLY 136 Ca 0.27 -0.37 0.02 0.00 0.00 0.00 0.00 44.72 44.64 1ba8 s GLY 136 CO 0.18 -2.11 -0.10 -1.60 0.00 0.00 0.00 173.10 169.47 1ba8 s ARG 137 N -3.83 1.08 0.01 2.90 3.52 0.02 -1.04 118.95 121.60 1ba8 s ARG 137 Ca 0.07 -0.32 0.08 0.00 -0.13 0.00 0.00 55.73 55.43 1ba8 s ARG 137 Cb 0.01 -0.99 -0.02 0.00 -1.56 0.00 0.00 34.95 32.38 1ba8 s ARG 137 CO 0.05 0.10 -0.26 0.08 -0.81 0.00 0.00 175.30 174.46 1ba8 s VAL 138 N 0.29 2.05 0.04 7.11 1.01 0.05 -0.18 120.40 130.77 1ba8 s VAL 138 Ca -0.05 -1.20 0.02 0.00 0.00 0.00 0.00 61.98 60.75 1ba8 s VAL 138 Cb -0.10 -1.72 -0.02 0.00 0.00 0.00 0.00 36.38 34.54 1ba8 s VAL 138 CO 0.01 0.48 -0.08 0.42 0.00 0.00 0.00 175.10 175.94 1ba8 s THR 139 N -0.68 0.54 0.00 3.92 -4.23 -1.25 -1.16 115.64 112.78 1ba8 s THR 139 Ca 0.10 -1.01 0.00 0.00 -1.18 0.00 0.00 61.69 59.61 1ba8 s THR 139 Cb -0.10 -0.60 0.00 0.00 1.34 0.00 0.00 72.50 73.15 1ba8 s THR 139 CO 0.00 -0.33 0.00 0.61 -0.54 0.00 0.00 174.62 174.36 1ba8 n GLY 140 N 1.59 0.86 1.15 3.99 0.00 -0.96 -4.54 105.19 107.29 1ba8 n GLY 140 Ca -0.22 -0.89 0.10 0.00 0.00 0.00 0.00 46.02 45.01 1ba8 n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1ba8 n TRP 141 N -0.29 0.83 -0.35 1.61 8.01 -1.26 -2.47 117.44 123.51 1ba8 n TRP 141 Ca 0.00 -0.50 -0.30 0.00 -1.31 0.00 0.00 57.50 55.40 1ba8 n TRP 141 Cb 0.00 -0.01 0.28 0.00 -2.01 0.00 0.00 31.31 29.58 1ba8 n TRP 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1ba8 n GLY 142 N 1.33 -3.79 3.67 6.99 0.00 -1.25 -4.44 105.19 107.71 1ba8 n GLY 142 Ca 0.21 -1.32 -0.40 0.00 0.00 0.00 0.00 46.02 44.51 1ba8 n GLY 142 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ba8 n ASN 143 N -5.65 1.97 0.15 1.61 3.02 0.12 -3.37 115.26 113.10 1ba8 n ASN 143 Ca 0.14 1.03 0.12 0.00 -0.03 0.00 0.00 54.58 55.83 1ba8 n ASN 143 Cb 0.59 -1.46 0.07 0.00 -0.61 0.00 0.00 39.78 38.38 1ba8 n ASN 143 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1ba8 h LEU 144 N 1.61 0.00 -7.92 3.41 3.38 -1.23 -1.17 115.31 113.39 1ba8 h LEU 144 Ca -0.47 -0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.34 1ba8 h LEU 144 Cb 1.32 0.00 -0.20 0.00 0.09 0.00 0.00 40.66 41.87 1ba8 h LEU 144 CO 0.57 0.00 -0.60 -0.54 0.09 0.00 0.00 178.44 177.97 1ba8 s LYS 145 N -3.30 0.45 0.18 1.13 3.01 -1.26 -4.35 119.74 115.60 1ba8 s LYS 145 Ca 0.03 -0.64 -0.13 0.00 -1.01 0.00 0.00 55.97 54.22 1ba8 s LYS 145 Cb 0.08 0.17 0.16 0.00 -1.01 0.00 0.00 37.83 37.23 1ba8 s LYS 145 CO 0.74 -0.10 1.77 1.49 0.51 0.00 0.00 175.35 179.77 1ba8 h GLU 146 N 4.17 0.44 -0.68 1.68 4.81 -1.91 -3.48 114.58 119.62 1ba8 h GLU 146 Ca -0.32 -0.03 -0.08 0.00 -0.13 0.00 0.00 59.36 58.81 1ba8 h GLU 146 Cb 1.19 -0.10 -0.16 0.00 0.63 0.00 0.00 28.75 30.31 1ba8 h GLU 146 CO 0.45 0.29 -0.34 -0.08 -0.73 0.00 0.00 179.01 178.60 1ba8 s THR 147 N -6.13 -0.68 0.19 0.32 -1.32 -1.26 -4.96 115.64 101.81 1ba8 s THR 147 Ca -0.13 -0.61 0.00 0.00 -1.21 0.00 0.00 61.69 59.74 1ba8 s THR 147 Cb 0.14 0.00 0.00 0.00 -1.51 0.00 0.00 72.50 71.13 1ba8 s THR 147 CO 0.73 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.75 1ba8 n GLY 150 N 2.93 -0.50 3.30 6.08 0.00 -1.26 -5.15 105.19 110.59 1ba8 n GLY 150 Ca 0.15 0.07 -0.28 0.00 0.00 0.00 0.00 46.02 45.95 1ba8 n GLY 150 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ba8 s GLN 151 N -2.00 1.61 0.55 1.61 -0.21 -1.26 -1.07 119.66 118.89 1ba8 s GLN 151 Ca 0.00 -1.03 -0.08 0.00 0.02 0.00 0.00 55.36 54.27 1ba8 s GLN 151 Cb 0.00 -1.76 -0.03 0.00 1.00 0.00 0.00 33.01 32.22 1ba8 s GLN 151 CO 0.00 0.45 0.90 -1.25 -2.12 0.00 0.00 175.29 173.27 1ba8 s PRO 152 N -1.21 3.50 0.08 2.91 0.04 -1.26 -4.96 135.00 134.10 1ba8 s PRO 152 Ca 0.10 0.41 0.22 0.00 0.04 0.00 0.00 61.00 61.77 1ba8 s PRO 152 Cb -0.09 -2.24 -0.17 0.00 0.04 0.00 0.00 34.50 32.04 1ba8 s PRO 152 CO 0.02 -0.40 0.77 -1.13 0.04 0.00 0.00 177.00 176.29 1ba8 n SER 153 N -2.50 0.43 -4.34 6.66 3.41 -1.26 -4.76 113.62 111.26 1ba8 n SER 153 Ca 0.03 0.15 -0.18 0.00 -0.26 0.00 0.00 58.87 58.61 1ba8 n SER 153 Cb 0.55 1.22 -0.10 0.00 -0.26 0.00 0.00 64.21 65.62 1ba8 n SER 153 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1ba8 s VAL 154 N -3.44 1.39 0.26 -3.33 0.11 -1.26 -1.06 120.40 113.07 1ba8 s VAL 154 Ca -0.04 -2.11 -0.30 0.00 -2.93 0.00 0.00 61.98 56.60 1ba8 s VAL 154 Cb 0.12 -2.18 -0.13 0.00 -1.53 0.00 0.00 36.38 32.66 1ba8 s VAL 154 CO 0.85 -0.48 1.35 -0.11 -3.33 0.00 0.00 175.10 173.37 1ba8 n LEU 155 N -0.40 3.02 -4.66 2.54 7.94 -0.35 -4.85 117.00 120.24 1ba8 n LEU 155 Ca -0.07 1.16 -0.27 0.00 -1.11 0.00 0.00 56.01 55.71 1ba8 n LEU 155 Cb 0.62 -1.42 -0.08 0.00 0.53 0.00 0.00 43.42 43.07 1ba8 n LEU 155 CO 0.36 -0.59 -0.34 -1.10 -1.11 0.00 0.00 177.39 174.61 1ba8 s GLN 156 N -0.75 2.39 0.01 1.96 -1.52 -1.03 -0.58 119.66 120.14 1ba8 s GLN 156 Ca 0.65 -1.06 0.01 0.00 -1.95 0.00 0.00 55.36 53.01 1ba8 s GLN 156 Cb -0.65 -2.38 -0.01 0.00 -0.22 0.00 0.00 33.01 29.75 1ba8 s GLN 156 CO 0.53 0.47 -0.03 0.54 -0.25 0.00 0.00 175.29 176.55 1ba8 s VAL 157 N -1.61 0.18 -0.01 1.09 0.11 -0.05 -2.28 120.40 117.83 1ba8 s VAL 157 Ca 0.26 -0.53 -0.05 0.00 -2.93 0.00 0.00 61.98 58.74 1ba8 s VAL 157 Cb -0.10 -0.24 0.00 0.00 -1.53 0.00 0.00 36.38 34.51 1ba8 s VAL 157 CO 0.18 -0.22 0.10 0.54 -3.33 0.00 0.00 175.10 172.37 1ba8 s VAL 158 N -0.76 0.06 -0.21 2.04 0.11 -0.31 -1.03 120.40 120.30 1ba8 s VAL 158 Ca -0.07 -0.46 -0.05 0.00 -2.93 0.00 0.00 61.98 58.47 1ba8 s VAL 158 Cb -0.05 -0.30 -0.02 0.00 -1.53 0.00 0.00 36.38 34.47 1ba8 s VAL 158 CO -0.00 -0.25 0.01 0.20 -3.33 0.00 0.00 175.10 171.72 1ba8 s ASN 159 N -0.83 4.84 0.03 3.54 0.01 -1.26 -0.77 114.94 120.49 1ba8 s ASN 159 Ca -0.09 -0.22 0.04 0.00 -0.71 0.00 0.00 52.86 51.88 1ba8 s ASN 159 Cb -0.05 -1.84 -0.02 0.00 0.41 0.00 0.00 41.25 39.75 1ba8 s ASN 159 CO 0.01 0.04 -0.12 -0.76 -1.51 0.00 0.00 177.10 174.75 1ba8 s LEU 160 N 1.16 2.13 0.25 0.60 1.43 -0.21 -4.94 118.68 119.10 1ba8 s LEU 160 Ca 0.03 -0.38 -0.19 0.00 -1.03 0.00 0.00 54.13 52.55 1ba8 s LEU 160 Cb -0.14 -0.55 -0.08 0.00 0.03 0.00 0.00 46.19 45.44 1ba8 s LEU 160 CO 0.01 0.04 0.74 -2.16 0.23 0.00 0.00 176.35 175.22 1ba8 s PRO 161 N -0.91 4.23 0.26 1.29 0.04 -1.26 -0.87 135.00 137.79 1ba8 s PRO 161 Ca 0.01 0.87 -0.29 0.00 0.04 0.00 0.00 61.00 61.63 1ba8 s PRO 161 Cb -0.07 -2.80 -0.09 0.00 0.04 0.00 0.00 34.50 31.58 1ba8 s PRO 161 CO 0.01 0.35 1.16 0.42 0.04 0.00 0.00 177.00 178.98 1ba8 s ILE 162 N -1.61 3.36 0.01 0.56 1.01 -0.26 -1.80 121.20 122.47 1ba8 s ILE 162 Ca 0.45 1.30 0.02 0.00 0.00 0.00 0.00 60.65 62.43 1ba8 s ILE 162 Cb -0.16 -3.83 -0.04 0.00 0.01 0.00 0.00 42.46 38.45 1ba8 s ILE 162 CO 0.20 0.28 0.00 -0.69 0.00 0.00 0.00 174.94 174.74 1ba8 s VAL 163 N -0.85 4.14 0.34 2.92 1.01 -1.00 -1.07 120.40 125.88 1ba8 s VAL 163 Ca 0.48 -0.65 -0.28 0.00 0.00 0.00 0.00 61.98 61.52 1ba8 s VAL 163 Cb -0.34 -2.86 -0.12 0.00 0.00 0.00 0.00 36.38 33.06 1ba8 s VAL 163 CO 0.42 0.34 1.38 -0.62 0.00 0.00 0.00 175.10 176.62 1ba8 n GLU 164 N 1.28 2.32 -0.25 2.72 4.71 -1.26 -4.63 120.64 125.54 1ba8 n GLU 164 Ca -0.14 0.82 0.05 0.00 -0.01 0.00 0.00 57.16 57.88 1ba8 n GLU 164 Cb 0.53 -2.46 0.18 0.00 -1.01 0.00 0.00 31.44 28.67 1ba8 n GLU 164 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1ba8 h ARG 165 N 3.01 0.33 -0.72 3.49 3.08 -1.98 -2.53 114.38 119.07 1ba8 h ARG 165 Ca -0.47 -0.02 0.03 0.00 0.07 0.00 0.00 59.98 59.59 1ba8 h ARG 165 Cb 1.27 -0.08 -0.04 0.00 0.08 0.00 0.00 29.97 31.20 1ba8 h ARG 165 CO 0.66 0.22 0.45 -1.35 -1.07 0.00 0.00 179.97 178.88 1ba8 h PRO 166 N 0.34 0.86 -0.79 0.04 0.11 -1.99 0.21 132.00 130.79 1ba8 h PRO 166 Ca 0.41 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 66.42 1ba8 h PRO 166 Cb 0.66 -0.20 -0.03 0.00 0.11 0.00 0.00 31.00 31.55 1ba8 h PRO 166 CO -0.45 0.57 0.31 0.28 -0.21 0.00 0.00 178.00 178.50 1ba8 h VAL 167 N 0.89 1.26 0.16 3.15 2.07 -1.84 -0.14 116.25 121.79 1ba8 h VAL 167 Ca 0.29 -0.82 -0.01 0.00 0.82 0.00 0.00 66.70 66.98 1ba8 h VAL 167 Cb 0.01 0.32 0.00 0.00 -1.52 0.00 0.00 31.29 30.11 1ba8 h VAL 167 CO -0.11 0.34 -0.08 0.00 0.02 0.00 0.00 177.57 177.74 1ba8 h LYS 169 N -0.32 0.06 0.00 0.00 6.56 -0.16 -2.91 116.57 119.81 1ba8 h LYS 169 Ca -0.02 -0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.56 1ba8 h LYS 169 Cb 0.25 -0.01 0.00 0.00 -0.57 0.00 0.00 32.23 31.90 1ba8 h LYS 169 CO 0.04 0.04 0.00 -0.25 -2.06 0.00 0.00 179.45 177.22 1ba8 n ASP 170 N -5.21 0.00 -0.53 0.86 8.00 -0.11 -3.03 116.55 116.54 1ba8 n ASP 170 Ca 0.01 0.21 0.12 0.00 0.71 0.00 0.00 54.79 55.85 1ba8 n ASP 170 Cb 0.18 -0.36 0.20 0.00 -0.02 0.00 0.00 41.12 41.12 1ba8 n ASP 170 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1ba8 n SER 171 N -1.36 1.90 -3.96 -2.24 3.41 -1.10 -4.97 113.62 105.30 1ba8 n SER 171 Ca 0.06 -1.46 -0.10 0.00 -0.26 0.00 0.00 58.87 57.12 1ba8 n SER 171 Cb 0.15 0.21 -0.07 0.00 -0.26 0.00 0.00 64.21 64.24 1ba8 n SER 171 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1ba8 s THR 172 N -2.30 0.07 -0.44 6.66 -1.32 -1.17 -4.90 115.64 112.24 1ba8 s THR 172 Ca 0.25 -1.39 0.22 0.00 -1.21 0.00 0.00 61.69 59.56 1ba8 s THR 172 Cb 0.19 -1.84 -0.20 0.00 -1.51 0.00 0.00 72.50 69.15 1ba8 s THR 172 CO 0.46 -0.31 0.83 0.54 -2.21 0.00 0.00 174.62 173.93 1ba8 n ARG 173 N -0.21 0.40 -2.20 7.08 1.74 -1.26 -4.92 116.66 117.28 1ba8 n ARG 173 Ca -0.07 -0.06 -0.41 0.00 -0.77 0.00 0.00 57.85 56.54 1ba8 n ARG 173 Cb 0.63 -1.58 -0.03 0.00 -1.02 0.00 0.00 32.46 30.46 1ba8 n ARG 173 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1ba8 s ILE 174 N -3.29 2.95 -0.26 0.55 -1.09 -1.26 -4.96 121.20 113.85 1ba8 s ILE 174 Ca 0.00 0.92 -0.29 0.00 -2.23 0.00 0.00 60.65 59.05 1ba8 s ILE 174 Cb 0.14 -3.59 -0.00 0.00 -1.58 0.00 0.00 42.46 37.43 1ba8 s ILE 174 CO 0.85 0.20 1.27 -0.60 -1.23 0.00 0.00 174.94 175.44 1ba8 s ARG 175 N -1.39 4.02 0.12 2.79 3.52 -1.26 -5.02 118.95 121.73 1ba8 s ARG 175 Ca 0.50 1.37 -0.26 0.00 -0.13 0.00 0.00 55.73 57.21 1ba8 s ARG 175 Cb -0.38 -3.83 -0.07 0.00 -1.56 0.00 0.00 34.95 29.11 1ba8 s ARG 175 CO 0.48 -0.98 0.79 0.42 -0.81 0.00 0.00 175.30 175.21 1ba8 s ILE 176 N 4.06 4.51 0.41 4.11 -1.09 -1.26 -4.85 121.20 127.09 1ba8 s ILE 176 Ca 0.55 1.72 0.05 0.00 -2.23 0.00 0.00 60.65 60.74 1ba8 s ILE 176 Cb -0.18 -4.15 -0.05 0.00 -1.58 0.00 0.00 42.46 36.49 1ba8 s ILE 176 CO 0.20 0.44 0.03 0.42 -1.23 0.00 0.00 174.94 174.80 1ba8 s THR 177 N -0.62 1.47 0.41 2.92 -4.23 -1.26 -5.04 115.64 109.29 1ba8 s THR 177 Ca 0.38 -2.00 0.39 0.00 -1.18 0.00 0.00 61.69 59.28 1ba8 s THR 177 Cb -0.22 -2.69 0.41 0.00 1.34 0.00 0.00 72.50 71.33 1ba8 s THR 177 CO 0.25 0.00 2.19 0.44 -0.54 0.00 0.00 174.62 176.97 1ba8 h ASP 178 N 1.76 0.00 -0.12 3.99 3.32 -2.04 -2.76 116.42 120.57 1ba8 h ASP 178 Ca -0.42 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.63 1ba8 h ASP 178 Cb 1.26 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.81 1ba8 h ASP 178 CO 0.74 0.00 0.00 0.59 -1.72 0.00 0.00 179.24 178.85 1ba8 n ASN 179 N -2.98 1.44 -3.97 6.45 3.02 -1.26 -4.88 115.26 113.09 1ba8 n ASN 179 Ca -0.02 -2.11 -0.09 0.00 -0.03 0.00 0.00 54.58 52.34 1ba8 n ASN 179 Cb 0.13 -0.37 -0.10 0.00 -0.61 0.00 0.00 39.78 38.83 1ba8 n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1ba8 s MET 180 N -1.51 0.51 0.04 3.52 -1.94 -1.04 -1.22 119.30 117.65 1ba8 s MET 180 Ca 0.10 -0.77 -0.00 0.00 -1.71 0.00 0.00 55.69 53.31 1ba8 s MET 180 Cb 0.07 0.19 -0.03 0.00 2.01 0.00 0.00 34.83 37.07 1ba8 s MET 180 CO 0.04 -0.11 -0.03 -0.59 -0.01 0.00 0.00 175.02 174.32 1ba8 s PHE 181 N -2.42 0.43 0.28 -0.03 -0.12 -0.94 -4.83 117.98 110.36 1ba8 s PHE 181 Ca -0.07 -0.83 0.12 0.00 -0.05 0.00 0.00 56.93 56.10 1ba8 s PHE 181 Cb -0.03 -0.31 -0.05 0.00 -0.63 0.00 0.00 43.02 42.00 1ba8 s PHE 181 CO -0.04 -0.29 -0.18 0.00 -0.05 0.00 0.00 175.22 174.66 1ba8 s ALA 183 N -2.50 -1.33 0.00 0.00 0.00 -0.05 -2.37 121.76 115.50 1ba8 s ALA 183 Ca 0.30 1.08 0.00 0.00 0.00 0.00 0.00 51.96 53.35 1ba8 s ALA 183 Cb -0.05 -0.26 0.00 0.00 0.00 0.00 0.00 23.12 22.81 1ba8 s ALA 183 CO 0.15 -0.30 0.00 0.41 0.00 0.00 0.00 175.76 176.02 1ba8 n GLY 184 N 1.62 1.02 3.87 0.00 0.00 -0.75 -2.01 105.19 108.94 1ba8 n GLY 184 Ca -0.18 -1.57 -0.31 0.00 0.00 0.00 0.00 46.02 43.96 1ba8 n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ba8 s TYR 184 N -1.67 3.42 0.31 1.61 2.02 -1.26 -4.43 117.35 117.35 1ba8 s TYR 184 Ca 0.00 1.04 -0.18 0.00 -0.37 0.00 0.00 57.07 57.56 1ba8 s TYR 184 Cb 0.00 -2.41 -0.09 0.00 -0.40 0.00 0.00 41.96 39.06 1ba8 s TYR 184 CO 0.00 0.08 0.78 0.15 -1.57 0.00 0.00 175.55 175.00 1ba8 s LYS 185 N -3.23 4.14 0.49 -0.62 3.01 -1.26 -4.82 119.74 117.44 1ba8 s LYS 185 Ca 0.51 0.84 0.33 0.00 -1.01 0.00 0.00 55.97 56.64 1ba8 s LYS 185 Cb -0.10 -2.53 1.45 0.00 -1.01 0.00 0.00 37.83 35.63 1ba8 s LYS 185 CO 0.23 0.20 1.72 -1.35 0.51 0.00 0.00 175.35 176.65 1ba8 h PRO 186 N 2.56 0.11 0.00 -1.68 0.11 -1.95 -0.99 132.00 130.16 1ba8 h PRO 186 Ca -0.48 -0.01 -0.22 0.00 0.11 0.00 0.00 66.00 65.41 1ba8 h PRO 186 Cb 1.18 -0.02 -0.03 0.00 0.11 0.00 0.00 31.00 32.23 1ba8 h PRO 186 CO 0.65 0.07 -1.09 0.38 -0.21 0.00 0.00 178.00 177.79 1ba8 h ASP 186 N 0.11 0.00 -0.03 -2.05 2.03 -1.95 -3.32 116.42 111.21 1ba8 h ASP 186 Ca 0.69 0.00 0.01 0.00 -0.73 0.00 0.00 57.03 57.00 1ba8 h ASP 186 Cb 2.40 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 40.90 1ba8 h ASP 186 CO -0.17 0.95 0.07 -0.33 -1.03 0.00 0.00 179.24 178.73 1ba8 h GLU 186 N 0.00 0.00 -6.27 4.15 5.08 -1.56 -3.46 114.58 112.52 1ba8 h GLU 186 Ca -0.06 0.00 -0.46 0.00 -1.00 0.00 0.00 59.36 57.84 1ba8 h GLU 186 Cb 1.78 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 31.02 1ba8 h GLU 186 CO 0.11 0.00 -0.81 0.41 -1.00 0.00 0.00 179.01 177.73 1ba8 n GLY 186 N -1.22 -0.38 3.07 -3.84 0.00 -1.25 -4.99 105.19 96.58 1ba8 n GLY 186 Ca -0.02 0.16 -0.11 0.00 0.00 0.00 0.00 46.02 46.04 1ba8 n GLY 186 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ba8 s LYS 186 N -6.38 0.37 0.00 1.61 1.02 -1.26 -5.19 119.74 109.91 1ba8 s LYS 186 Ca 0.33 -0.25 0.00 0.00 0.02 0.00 0.00 55.97 56.07 1ba8 s LYS 186 Cb -0.17 0.16 0.00 0.00 -0.52 0.00 0.00 37.83 37.30 1ba8 s LYS 186 CO 0.84 -0.08 0.00 2.89 -0.92 0.00 0.00 175.35 178.08 1ba8 n ARG 187 N 1.92 0.00 0.00 1.68 1.85 -1.26 -4.72 116.66 116.14 1ba8 n ARG 187 Ca -0.20 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.65 1ba8 n ARG 187 Cb 0.56 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.97 1ba8 n ARG 187 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1ba8 n GLY 188 N 0.00 4.00 3.70 2.89 0.00 -1.26 -4.93 105.19 109.60 1ba8 n GLY 188 Ca 0.00 -1.58 -0.01 0.00 0.00 0.00 0.00 46.02 44.43 1ba8 n GLY 188 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ba8 s ASP 189 N 0.00 -0.10 0.63 1.61 2.15 -0.73 -4.70 116.67 115.53 1ba8 s ASP 189 Ca 0.00 -0.29 -0.04 0.00 0.43 0.00 0.00 52.55 52.65 1ba8 s ASP 189 Cb 0.00 0.32 0.04 0.00 -0.30 0.00 0.00 42.92 42.98 1ba8 s ASP 189 CO 0.00 -0.60 0.91 0.00 -0.17 0.00 0.00 175.17 175.31 1ba8 s ALA 190 N -2.78 3.40 0.18 3.66 0.00 -1.26 0.00 121.76 124.96 1ba8 s ALA 190 Ca 0.14 -0.99 -0.06 0.00 0.00 0.00 0.00 51.96 51.05 1ba8 s ALA 190 Cb 0.02 -2.44 0.02 0.00 0.00 0.00 0.00 23.12 20.72 1ba8 s ALA 190 CO -0.01 -1.02 0.34 0.00 0.00 0.00 0.00 175.76 175.07 1ba8 n GLU 192 N -0.25 1.63 0.00 0.00 2.13 -1.26 -2.24 120.64 120.65 1ba8 n GLU 192 Ca -0.03 0.58 0.00 0.00 0.66 0.00 0.00 57.16 58.37 1ba8 n GLU 192 Cb 0.27 -2.16 0.00 0.00 0.27 0.00 0.00 31.44 29.82 1ba8 n GLU 192 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1ba8 n GLY 193 N 2.08 3.09 0.11 8.31 0.00 -1.26 -0.71 105.19 116.82 1ba8 n GLY 193 Ca 0.13 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.27 1ba8 n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1ba8 h ASP 194 N 0.09 0.00 -2.72 1.61 3.32 -1.79 -3.33 116.42 113.60 1ba8 h ASP 194 Ca 0.00 -0.05 -0.59 0.00 0.02 0.00 0.00 57.03 56.41 1ba8 h ASP 194 Cb 0.00 0.00 0.15 0.00 0.22 0.00 0.00 39.33 39.70 1ba8 h ASP 194 CO 0.00 0.03 -0.30 -1.20 -1.72 0.00 0.00 179.24 176.04 1ba8 n SER 195 N -2.59 -0.59 0.00 6.45 7.64 -1.26 -1.65 113.62 121.62 1ba8 n SER 195 Ca 0.01 0.86 0.00 0.00 1.01 0.00 0.00 58.87 60.75 1ba8 n SER 195 Cb 0.52 -1.18 0.00 0.00 -1.01 0.00 0.00 64.21 62.54 1ba8 n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ba8 n GLY 196 N 1.69 2.26 3.82 0.23 0.00 -0.59 0.50 105.19 113.10 1ba8 n GLY 196 Ca 0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 1ba8 n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ba8 s GLY 197 N -2.00 1.59 0.15 -0.02 0.00 -0.66 -2.71 107.32 103.68 1ba8 s GLY 197 Ca 0.00 -0.48 -0.17 0.00 0.00 0.00 0.00 44.72 44.08 1ba8 s GLY 197 CO 0.00 0.02 0.60 2.56 0.00 0.00 0.00 173.10 176.28 1ba8 s PRO 198 N -5.33 4.09 -0.33 2.90 0.04 -1.26 -0.96 135.00 134.15 1ba8 s PRO 198 Ca 0.62 0.63 -0.10 0.00 0.04 0.00 0.00 61.00 62.20 1ba8 s PRO 198 Cb -0.13 -2.97 0.01 0.00 0.04 0.00 0.00 34.50 31.44 1ba8 s PRO 198 CO 0.52 0.49 0.16 0.12 0.04 0.00 0.00 177.00 178.33 1ba8 s PHE 199 N -1.42 3.20 0.28 0.56 2.19 -0.31 -3.76 117.98 118.72 1ba8 s PHE 199 Ca 0.38 -0.73 0.12 0.00 0.33 0.00 0.00 56.93 57.02 1ba8 s PHE 199 Cb -0.16 -2.37 -0.05 0.00 -1.31 0.00 0.00 43.02 39.12 1ba8 s PHE 199 CO 0.20 -0.53 -0.17 0.14 1.83 0.00 0.00 175.22 176.69 1ba8 s VAL 200 N 1.58 2.64 0.05 3.12 -7.23 0.75 -1.52 120.40 119.80 1ba8 s VAL 200 Ca 0.04 -2.33 0.02 0.00 -1.81 0.00 0.00 61.98 57.90 1ba8 s VAL 200 Cb -0.18 -2.39 -0.03 0.00 0.56 0.00 0.00 36.38 34.34 1ba8 s VAL 200 CO 0.06 -0.39 -0.08 -0.04 -0.31 0.00 0.00 175.10 174.34 1ba8 s MET 201 N -3.54 0.58 -0.33 4.82 -1.94 0.75 -0.80 119.30 118.84 1ba8 s MET 201 Ca 0.30 -0.85 -0.11 0.00 -1.71 0.00 0.00 55.69 53.32 1ba8 s MET 201 Cb -0.05 -0.30 -0.01 0.00 2.01 0.00 0.00 34.83 36.48 1ba8 s MET 201 CO 0.16 0.05 0.20 0.21 -0.01 0.00 0.00 175.02 175.62 1ba8 s LYS 202 N -1.91 3.35 0.11 2.03 2.20 -1.26 -0.22 119.74 124.04 1ba8 s LYS 202 Ca -0.07 -0.73 -0.31 0.00 -0.36 0.00 0.00 55.97 54.51 1ba8 s LYS 202 Cb -0.08 -3.70 -0.09 0.00 -1.51 0.00 0.00 37.83 32.45 1ba8 s LYS 202 CO -0.00 -0.46 1.64 0.45 -0.36 0.00 0.00 175.35 176.61 1ba8 s SER 203 N 1.66 6.58 0.06 1.43 0.15 0.28 -4.89 113.70 118.98 1ba8 s SER 203 Ca 0.05 2.55 0.25 0.00 0.70 0.00 0.00 55.95 59.50 1ba8 s SER 203 Cb -0.17 -2.57 1.01 0.00 -1.71 0.00 0.00 66.02 62.57 1ba8 s SER 203 CO 0.08 -0.87 1.79 -0.81 1.20 0.00 0.00 173.24 174.63 1ba8 n PRO 204 N 5.03 0.07 -0.06 5.44 -0.04 -1.26 -1.03 135.00 143.14 1ba8 n PRO 204 Ca 0.15 0.13 -0.09 0.00 -0.04 0.00 0.00 63.50 63.65 1ba8 n PRO 204 Cb 0.40 -1.59 -0.08 0.00 -0.04 0.00 0.00 33.50 32.19 1ba8 n PRO 204 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 1ba8 h PHE 204 N 0.00 0.00 0.00 0.54 0.04 -1.96 -3.41 116.94 112.15 1ba8 h PHE 204 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1ba8 h PHE 204 Cb 0.49 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.64 1ba8 h PHE 204 CO 0.00 0.64 0.00 0.27 -0.60 0.00 0.00 178.31 178.62 1ba8 n ASN 204 N -4.66 1.55 -2.57 2.17 2.04 -1.25 -5.01 115.26 107.53 1ba8 n ASN 204 Ca -0.08 -1.62 -0.18 0.00 -0.44 0.00 0.00 54.58 52.26 1ba8 n ASN 204 Cb 0.31 0.00 -0.00 0.00 -2.53 0.00 0.00 39.78 37.56 1ba8 n ASN 204 CO 0.00 0.00 0.00 -3.20 -0.44 0.00 0.00 177.26 173.62 1ba8 n ASN 205 N -0.31 -5.15 -4.94 0.53 5.15 -0.20 -4.99 115.26 105.36 1ba8 n ASN 205 Ca 0.00 -0.01 -0.23 0.00 -0.60 0.00 0.00 54.58 53.73 1ba8 n ASN 205 Cb 0.18 -4.28 -0.03 0.00 -0.53 0.00 0.00 39.78 35.12 1ba8 n ASN 205 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 1ba8 s ARG 206 N -5.20 3.39 -0.11 1.20 0.52 -1.25 -4.80 118.95 112.69 1ba8 s ARG 206 Ca 0.07 -0.71 -0.16 0.00 -0.52 0.00 0.00 55.73 54.41 1ba8 s ARG 206 Cb -0.03 -2.89 -0.05 0.00 0.52 0.00 0.00 34.95 32.50 1ba8 s ARG 206 CO 0.09 0.47 0.39 -1.58 0.02 0.00 0.00 175.30 174.69 1ba8 s TRP 207 N -1.88 3.53 -0.08 -0.53 0.52 -1.26 -0.55 118.94 118.69 1ba8 s TRP 207 Ca 0.34 0.79 0.05 0.00 0.02 0.00 0.00 56.10 57.30 1ba8 s TRP 207 Cb -0.10 -2.41 -0.00 0.00 -1.15 0.00 0.00 33.47 29.81 1ba8 s TRP 207 CO 0.28 0.29 -0.24 0.71 0.02 0.00 0.00 176.95 178.02 1ba8 s TYR 208 N 0.22 2.47 -0.46 -1.98 2.02 0.69 -2.20 117.35 118.11 1ba8 s TYR 208 Ca 0.22 -0.91 -0.23 0.00 -0.37 0.00 0.00 57.07 55.78 1ba8 s TYR 208 Cb -0.14 -1.64 0.03 0.00 -0.40 0.00 0.00 41.96 39.80 1ba8 s TYR 208 CO 0.08 -0.34 0.79 -1.14 -1.57 0.00 0.00 175.55 173.38 1ba8 s GLN 209 N 0.16 3.38 -0.04 -0.62 0.74 -0.72 -0.18 119.66 122.38 1ba8 s GLN 209 Ca -0.13 -0.15 0.18 0.00 0.05 0.00 0.00 55.36 55.31 1ba8 s GLN 209 Cb -0.16 -3.96 -0.22 0.00 1.10 0.00 0.00 33.01 29.78 1ba8 s GLN 209 CO 0.07 -1.16 0.51 -1.33 -0.55 0.00 0.00 175.29 172.83 1ba8 n MET 210 N 6.77 0.65 -4.04 1.67 2.81 -0.57 -4.32 117.12 120.08 1ba8 n MET 210 Ca 0.02 0.08 -0.10 0.00 -1.81 0.00 0.00 57.70 55.88 1ba8 n MET 210 Cb 0.48 -1.66 -0.08 0.00 -0.71 0.00 0.00 33.22 31.25 1ba8 n MET 210 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1ba8 s GLY 211 N -4.98 0.76 -0.10 3.03 0.00 -0.96 -2.43 107.32 102.65 1ba8 s GLY 211 Ca -0.06 -1.14 0.04 0.00 0.00 0.00 0.00 44.72 43.56 1ba8 s GLY 211 CO 0.84 -1.00 -0.23 -0.42 0.00 0.00 0.00 173.10 172.29 1ba8 s ILE 212 N -4.03 1.99 -0.06 0.90 1.01 -0.83 -1.17 121.20 119.02 1ba8 s ILE 212 Ca 0.23 -0.98 -0.34 0.00 0.00 0.00 0.00 60.65 59.57 1ba8 s ILE 212 Cb 0.04 -1.72 -0.12 0.00 0.01 0.00 0.00 42.46 40.67 1ba8 s ILE 212 CO 0.04 0.54 1.86 0.52 0.00 0.00 0.00 174.94 177.91 1ba8 n VAL 213 N 3.54 0.54 0.00 2.92 0.31 -0.13 -1.01 118.33 124.50 1ba8 n VAL 213 Ca -0.19 -0.10 -0.01 0.00 -0.01 0.00 0.00 64.34 64.03 1ba8 n VAL 213 Cb 0.53 -1.88 -0.00 0.00 -0.91 0.00 0.00 33.84 31.57 1ba8 n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1ba8 n SER 214 N 6.42 0.33 -3.83 4.52 2.88 -0.73 -1.54 113.62 121.66 1ba8 n SER 214 Ca 0.22 0.05 -0.09 0.00 -1.33 0.00 0.00 58.87 57.71 1ba8 n SER 214 Cb 0.30 -0.23 -0.04 0.00 -0.75 0.00 0.00 64.21 63.48 1ba8 n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1ba8 s TRP 215 N -1.30 0.06 0.05 0.66 1.48 -0.98 -4.89 118.94 114.01 1ba8 s TRP 215 Ca -0.02 -0.42 -0.23 0.00 -1.06 0.00 0.00 56.10 54.37 1ba8 s TRP 215 Cb 0.00 0.30 0.08 0.00 -1.16 0.00 0.00 33.47 32.69 1ba8 s TRP 215 CO 0.03 -0.92 1.05 0.41 -4.06 0.00 0.00 176.95 173.46 1ba8 n GLY 216 N -0.33 0.42 2.88 3.67 0.00 -1.26 -1.25 105.19 109.32 1ba8 n GLY 216 Ca -0.08 -1.06 -0.30 0.00 0.00 0.00 0.00 46.02 44.58 1ba8 n GLY 216 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ba8 s GLU 217 N -2.02 1.23 2.35 1.61 2.02 -1.26 -5.02 118.70 117.60 1ba8 s GLU 217 Ca 0.24 -1.23 0.00 0.00 0.02 0.00 0.00 54.97 54.00 1ba8 s GLU 217 Cb -0.01 -2.53 0.00 0.00 0.10 0.00 0.00 34.13 31.69 1ba8 s GLU 217 CO 0.02 -0.82 0.00 0.41 0.02 0.00 0.00 175.26 174.88 1ba8 n GLY 219 N 4.64 -0.77 2.95 -1.39 0.00 -1.26 -4.74 105.19 104.62 1ba8 n GLY 219 Ca -0.04 -1.16 -0.14 0.00 0.00 0.00 0.00 46.02 44.67 1ba8 n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ba8 n ASP 221 N 4.83 -4.96 -4.75 0.00 2.03 -1.26 -4.56 116.55 107.88 1ba8 n ASP 221 Ca -0.15 -0.14 -0.40 0.00 0.52 0.00 0.00 54.79 54.62 1ba8 n ASP 221 Cb 0.51 -3.91 -0.05 0.00 -0.72 0.00 0.00 41.12 36.94 1ba8 n ASP 221 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1ba8 s ARG 221 N -5.19 4.78 0.30 -0.67 1.81 -1.26 -4.94 118.95 113.78 1ba8 s ARG 221 Ca 0.14 1.55 -0.29 0.00 -1.72 0.00 0.00 55.73 55.41 1ba8 s ARG 221 Cb -0.06 -3.28 -0.10 0.00 -0.45 0.00 0.00 34.95 31.05 1ba8 s ARG 221 CO 0.18 0.39 1.41 -0.51 -0.68 0.00 0.00 175.30 176.09 1ba8 s ASP 222 N -0.87 6.62 -0.79 0.23 1.11 -1.26 -1.68 116.67 120.03 1ba8 s ASP 222 Ca 0.43 2.76 0.00 0.00 0.18 0.00 0.00 52.55 55.92 1ba8 s ASP 222 Cb -0.27 -2.64 0.00 0.00 1.07 0.00 0.00 42.92 41.08 1ba8 s ASP 222 CO 0.33 -0.69 0.00 0.61 1.18 0.00 0.00 175.17 176.61 1ba8 n GLY 223 N 1.42 0.90 3.41 0.21 0.00 -1.26 -5.01 105.19 104.87 1ba8 n GLY 223 Ca 0.04 -0.33 -0.28 0.00 0.00 0.00 0.00 46.02 45.45 1ba8 n GLY 223 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ba8 s LYS 224 N -2.31 1.47 0.05 1.61 -0.14 -0.67 -4.80 119.74 114.94 1ba8 s LYS 224 Ca 0.00 -1.45 0.02 0.00 -1.36 0.00 0.00 55.97 53.19 1ba8 s LYS 224 Cb 0.00 -1.87 -0.03 0.00 -1.68 0.00 0.00 37.83 34.25 1ba8 s LYS 224 CO 0.00 0.42 -0.08 0.71 -0.76 0.00 0.00 175.35 175.64 1ba8 s TYR 225 N -1.40 0.74 0.30 3.18 1.51 -1.26 -4.65 117.35 115.77 1ba8 s TYR 225 Ca 0.18 -0.51 -0.24 0.00 -1.01 0.00 0.00 57.07 55.48 1ba8 s TYR 225 Cb -0.09 -0.44 -0.10 0.00 -0.11 0.00 0.00 41.96 41.23 1ba8 s TYR 225 CO 0.08 -0.07 0.89 0.20 -1.11 0.00 0.00 175.55 175.54 1ba8 s GLY 226 N -1.66 2.73 -0.01 0.71 0.00 -0.85 -4.68 107.32 103.55 1ba8 s GLY 226 Ca -0.08 0.42 0.06 0.00 0.00 0.00 0.00 44.72 45.12 1ba8 s GLY 226 CO 0.00 0.83 -0.20 -1.36 0.00 0.00 0.00 173.10 172.37 1ba8 s PHE 227 N -1.63 2.51 0.01 1.90 0.40 -0.38 -0.87 117.98 119.93 1ba8 s PHE 227 Ca 0.49 -0.30 0.03 0.00 -0.60 0.00 0.00 56.93 56.55 1ba8 s PHE 227 Cb -0.17 -1.53 -0.01 0.00 0.51 0.00 0.00 43.02 41.81 1ba8 s PHE 227 CO 0.22 0.12 -0.09 0.71 0.70 0.00 0.00 175.22 176.89 1ba8 s TYR 228 N -0.74 0.76 0.27 0.36 1.51 0.25 -1.77 117.35 118.00 1ba8 s TYR 228 Ca 0.12 -0.24 -0.30 0.00 -1.01 0.00 0.00 57.07 55.64 1ba8 s TYR 228 Cb -0.10 -0.47 -0.10 0.00 -0.11 0.00 0.00 41.96 41.17 1ba8 s TYR 228 CO 0.01 -0.02 1.47 0.99 -1.11 0.00 0.00 175.55 176.89 1ba8 s THR 229 N -0.55 2.49 -0.85 -0.71 2.01 -0.18 -2.21 115.64 115.64 1ba8 s THR 229 Ca -0.00 0.42 -0.23 0.00 0.31 0.00 0.00 61.69 62.19 1ba8 s THR 229 Cb -0.05 -3.27 0.07 0.00 0.01 0.00 0.00 72.50 69.26 1ba8 s THR 229 CO 0.00 0.07 1.23 -2.28 -0.69 0.00 0.00 174.62 172.95 1ba8 s HIS 230 N -0.13 2.63 0.11 4.92 2.46 -0.36 -1.96 115.29 122.97 1ba8 s HIS 230 Ca 0.59 -0.71 -0.24 0.00 0.47 0.00 0.00 55.06 55.17 1ba8 s HIS 230 Cb -0.43 -4.50 -0.08 0.00 -0.13 0.00 0.00 32.58 27.44 1ba8 s HIS 230 CO 0.46 -1.81 1.67 0.28 -2.47 0.00 0.00 174.74 172.88 1ba8 h VAL 231 N 6.22 0.63 -0.99 0.89 2.07 -1.80 -2.77 116.25 120.50 1ba8 h VAL 231 Ca -0.03 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.61 1ba8 h VAL 231 Cb 1.04 0.63 -0.08 0.00 -1.52 0.00 0.00 31.29 31.35 1ba8 h VAL 231 CO 1.27 0.00 0.62 0.15 0.02 0.00 0.00 177.57 179.62 1ba8 h PHE 232 N -0.28 1.12 0.00 1.57 3.57 -1.87 -1.49 116.94 119.56 1ba8 h PHE 232 Ca 0.04 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.57 1ba8 h PHE 232 Cb 0.32 -0.35 0.00 0.00 2.79 0.00 0.00 35.95 38.71 1ba8 h PHE 232 CO -0.19 0.44 0.00 0.00 -2.23 0.00 0.00 178.31 176.33 1ba8 h ARG 233 N 0.97 0.00 -0.35 1.11 3.08 -1.88 -2.18 114.38 115.14 1ba8 h ARG 233 Ca 0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.54 1ba8 h ARG 233 Cb 0.49 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.54 1ba8 h ARG 233 CO -0.27 0.00 0.00 1.28 -1.07 0.00 0.00 179.97 179.91 1ba8 n LEU 234 N -3.01 2.98 -0.33 3.04 4.77 -0.63 -4.69 117.00 119.13 1ba8 n LEU 234 Ca 0.00 -1.75 0.06 0.00 -0.03 0.00 0.00 56.01 54.30 1ba8 n LEU 234 Cb 0.27 -0.23 0.22 0.00 -2.33 0.00 0.00 43.42 41.35 1ba8 n LEU 234 CO 0.26 0.71 1.18 0.50 -1.33 0.00 0.00 177.39 178.70 1ba8 h LYS 235 N 2.73 0.83 -0.43 3.23 1.63 -0.70 -1.69 116.57 122.18 1ba8 h LYS 235 Ca 0.00 -0.05 -0.05 0.00 -0.85 0.00 0.00 60.65 59.70 1ba8 h LYS 235 Cb 0.76 -0.19 -0.02 0.00 -0.60 0.00 0.00 32.23 32.18 1ba8 h LYS 235 CO 0.00 0.55 0.06 0.87 -3.45 0.00 0.00 179.45 177.48 1ba8 h LYS 236 N 0.86 0.66 -0.17 1.90 6.56 -1.84 0.10 116.57 124.65 1ba8 h LYS 236 Ca 0.47 -0.14 -0.14 0.00 -1.06 0.00 0.00 60.65 59.78 1ba8 h LYS 236 Cb 0.50 -0.10 -0.01 0.00 -0.57 0.00 0.00 32.23 32.06 1ba8 h LYS 236 CO -0.28 0.64 -0.48 2.35 -2.06 0.00 0.00 179.45 179.61 1ba8 h TRP 237 N 0.64 0.53 0.28 -1.35 7.01 -1.67 -1.68 115.95 119.70 1ba8 h TRP 237 Ca 0.14 -0.17 -0.01 0.00 2.11 0.00 0.00 58.89 60.96 1ba8 h TRP 237 Cb 0.31 -0.11 0.00 0.00 -2.10 0.00 0.00 29.16 27.27 1ba8 h TRP 237 CO 0.01 0.83 -0.13 0.82 -2.79 0.00 0.00 178.44 177.18 1ba8 h ILE 238 N 0.34 0.75 -0.58 2.65 2.04 -0.63 -2.17 117.51 119.92 1ba8 h ILE 238 Ca 0.02 -0.17 0.03 0.00 1.00 0.00 0.00 64.86 65.74 1ba8 h ILE 238 Cb 0.98 0.84 -0.04 0.00 -0.74 0.00 0.00 36.82 37.86 1ba8 h ILE 238 CO 0.09 0.04 0.34 1.56 0.00 0.00 0.00 178.15 180.17 1ba8 h GLN 239 N -0.46 0.65 0.01 2.37 4.20 -0.85 -2.47 115.11 118.55 1ba8 h GLN 239 Ca -0.04 -0.04 0.03 0.00 0.06 0.00 0.00 58.65 58.66 1ba8 h GLN 239 Cb 0.35 -0.15 -0.05 0.00 0.30 0.00 0.00 27.48 27.94 1ba8 h GLN 239 CO 0.06 0.43 -0.31 0.87 -0.67 0.00 0.00 178.83 179.22 1ba8 h LYS 240 N 0.67 -0.44 -0.52 1.46 1.57 -1.16 -1.38 116.57 116.77 1ba8 h LYS 240 Ca 0.24 0.03 -0.09 0.00 -1.87 0.00 0.00 60.65 58.96 1ba8 h LYS 240 Cb 0.05 0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.44 1ba8 h LYS 240 CO -0.11 -0.30 -0.02 -0.39 -0.57 0.00 0.00 179.45 178.06 1ba8 h VAL 241 N -0.46 1.26 0.01 0.50 -1.51 -1.17 0.30 116.25 115.17 1ba8 h VAL 241 Ca 0.06 -1.10 -0.00 0.00 -1.23 0.00 0.00 66.70 64.43 1ba8 h VAL 241 Cb 0.54 0.88 0.00 0.00 -2.13 0.00 0.00 31.29 30.58 1ba8 h VAL 241 CO -0.25 0.39 -0.00 0.40 -1.23 0.00 0.00 177.57 176.87 1ba8 h ILE 242 N 0.83 1.17 0.85 7.19 2.04 -1.30 0.50 117.51 128.80 1ba8 h ILE 242 Ca 0.15 -0.54 -0.04 0.00 1.00 0.00 0.00 64.86 65.43 1ba8 h ILE 242 Cb 0.52 1.54 0.01 0.00 -0.74 0.00 0.00 36.82 38.15 1ba8 h ILE 242 CO 0.03 0.14 -0.41 0.44 0.00 0.00 0.00 178.15 178.35 1ba8 h ASP 243 N -0.24 -0.97 0.13 1.72 5.19 -1.27 0.89 116.42 121.87 1ba8 h ASP 243 Ca -0.00 0.03 -0.00 0.00 -0.62 0.00 0.00 57.03 56.44 1ba8 h ASP 243 Cb 0.23 0.25 -0.00 0.00 0.18 0.00 0.00 39.33 39.99 1ba8 h ASP 243 CO 0.00 -0.68 -0.00 -0.61 -3.12 0.00 0.00 179.24 174.83 1ba8 h GLN 244 N -1.18 0.00 0.00 3.56 5.75 -0.98 -3.34 115.11 118.93 1ba8 h GLN 244 Ca -0.12 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.38 1ba8 h GLN 244 Cb 0.88 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.43 1ba8 h GLN 244 CO 0.19 0.00 0.00 1.19 -2.65 0.00 0.00 178.83 177.57 1ba8 n PHE 245 N -3.14 0.00 0.00 3.99 3.72 0.18 -5.03 117.46 117.18 1ba8 n PHE 245 Ca -0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.37 1ba8 n PHE 245 Cb 0.10 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.64 1ba8 n PHE 245 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ba8 n GLY 246 N 0.33 3.17 2.45 1.37 0.00 0.31 -5.00 105.19 107.81 1ba8 n GLY 246 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.97 1ba8 n GLY 246 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48