#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hai s VAL 17 N 0.00 3.83 -1.21 1.39 1.01 -0.09 -4.23 120.40 121.10 1hai s VAL 17 Ca 0.00 -0.39 -0.04 0.00 0.00 0.00 0.00 61.98 61.55 1hai s VAL 17 Cb 0.00 -2.65 0.00 0.00 0.00 0.00 0.00 36.38 33.73 1hai s VAL 17 CO 0.00 0.52 0.52 -0.62 0.00 0.00 0.00 175.10 175.52 1hai n GLU 18 N 3.24 -4.06 0.00 2.72 -0.58 -1.26 -1.88 120.64 118.82 1hai n GLU 18 Ca -0.18 0.71 0.00 0.00 -0.42 0.00 0.00 57.16 57.27 1hai n GLU 18 Cb 0.53 -5.16 0.00 0.00 -0.57 0.00 0.00 31.44 26.23 1hai n GLU 18 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1hai n GLY 19 N -1.39 3.74 3.17 0.62 0.00 -1.26 -4.62 105.19 105.46 1hai n GLY 19 Ca -0.08 -2.00 -0.11 0.00 0.00 0.00 0.00 46.02 43.83 1hai n GLY 19 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1hai s SER 20 N -0.32 0.24 0.33 1.61 0.01 -0.43 -4.89 113.70 110.25 1hai s SER 20 Ca 0.00 -1.28 -0.28 0.00 1.31 0.00 0.00 55.95 55.70 1hai s SER 20 Cb 0.00 0.33 -0.10 0.00 0.21 0.00 0.00 66.02 66.47 1hai s SER 20 CO 0.00 -0.78 1.22 -1.81 0.41 0.00 0.00 173.24 172.28 1hai s ASP 21 N -3.09 6.87 0.77 2.44 1.01 -1.26 -0.45 116.67 122.96 1hai s ASP 21 Ca 0.30 2.51 -0.11 0.00 0.71 0.00 0.00 52.55 55.96 1hai s ASP 21 Cb 0.07 -2.64 0.06 0.00 1.01 0.00 0.00 42.92 41.42 1hai s ASP 21 CO 0.06 -0.45 1.09 0.00 0.21 0.00 0.00 175.17 176.08 1hai s ALA 22 N -1.19 2.25 0.51 5.23 0.00 0.37 -4.72 121.76 124.19 1hai s ALA 22 Ca 0.49 0.16 -0.10 0.00 0.00 0.00 0.00 51.96 52.50 1hai s ALA 22 Cb -0.36 -3.23 -0.05 0.00 0.00 0.00 0.00 23.12 19.48 1hai s ALA 22 CO 0.47 -1.73 0.89 -1.21 0.00 0.00 0.00 175.76 174.17 1hai s GLU 23 N -4.95 3.70 0.30 0.00 2.02 -1.26 -4.92 118.70 113.59 1hai s GLU 23 Ca 0.61 0.57 -0.29 0.00 0.02 0.00 0.00 54.97 55.87 1hai s GLU 23 Cb -0.16 -2.25 -0.11 0.00 0.10 0.00 0.00 34.13 31.71 1hai s GLU 23 CO 0.56 -0.28 1.47 0.42 0.02 0.00 0.00 175.26 177.45 1hai s ILE 24 N -2.75 2.39 -2.02 -1.63 -1.09 -1.26 -2.53 121.20 112.30 1hai s ILE 24 Ca 0.53 0.34 0.00 0.00 -2.23 0.00 0.00 60.65 59.29 1hai s ILE 24 Cb -0.10 -3.22 0.00 0.00 -1.58 0.00 0.00 42.46 37.56 1hai s ILE 24 CO 0.41 0.06 0.00 0.61 -1.23 0.00 0.00 174.94 174.80 1hai n GLY 25 N 1.67 1.64 0.21 6.18 0.00 -1.26 -4.93 105.19 108.69 1hai n GLY 25 Ca 0.05 -0.08 -0.11 0.00 0.00 0.00 0.00 46.02 45.88 1hai n GLY 25 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1hai h MET 26 N 0.00 0.57 -2.39 1.61 -1.53 -1.86 -3.36 114.93 107.97 1hai h MET 26 Ca -0.40 -0.40 -0.59 0.00 -3.44 0.00 0.00 59.70 54.87 1hai h MET 26 Cb 1.28 0.06 -0.40 0.00 -0.55 0.00 0.00 31.60 31.99 1hai h MET 26 CO 0.58 1.01 -0.85 0.43 0.14 0.00 0.00 176.91 178.22 1hai n SER 27 N -3.93 1.28 0.00 1.39 7.64 -1.26 -5.00 113.62 113.73 1hai n SER 27 Ca -0.04 -2.85 0.08 0.00 1.01 0.00 0.00 58.87 57.07 1hai n SER 27 Cb 0.65 -0.64 0.36 0.00 -1.01 0.00 0.00 64.21 63.57 1hai n SER 27 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1hai n PRO 28 N 1.87 0.07 0.00 1.43 -0.04 -1.26 -1.28 135.00 135.79 1hai n PRO 28 Ca 0.25 0.20 0.12 0.00 -0.04 0.00 0.00 63.50 64.03 1hai n PRO 28 Cb 0.45 -1.50 0.14 0.00 -0.04 0.00 0.00 33.50 32.55 1hai n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1hai n TRP 29 N -1.44 0.00 -2.09 0.54 2.14 -1.08 -1.35 117.44 114.16 1hai n TRP 29 Ca 0.05 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 59.20 1hai n TRP 29 Cb 0.17 -0.11 -0.03 0.00 -0.81 0.00 0.00 31.31 30.53 1hai n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 1hai s GLN 30 N -2.80 4.28 0.10 -2.67 2.00 -0.40 -0.04 119.66 120.12 1hai s GLN 30 Ca 0.14 2.16 0.09 0.00 -2.00 0.00 0.00 55.36 55.76 1hai s GLN 30 Cb 0.18 -3.31 -0.04 0.00 0.80 0.00 0.00 33.01 30.65 1hai s GLN 30 CO 0.68 -0.53 -0.24 0.08 -0.50 0.00 0.00 175.29 174.78 1hai s VAL 31 N 1.45 2.00 -0.20 1.34 1.01 -0.91 -4.05 120.40 121.04 1hai s VAL 31 Ca 0.67 -1.58 -0.08 0.00 0.00 0.00 0.00 61.98 60.99 1hai s VAL 31 Cb -0.38 -1.77 -0.04 0.00 0.00 0.00 0.00 36.38 34.19 1hai s VAL 31 CO 0.30 0.08 0.08 -0.32 0.00 0.00 0.00 175.10 175.25 1hai s MET 32 N -1.82 3.97 -0.37 2.72 1.75 0.11 -1.88 119.30 123.79 1hai s MET 32 Ca 0.10 -0.34 -0.20 0.00 -1.25 0.00 0.00 55.69 54.01 1hai s MET 32 Cb -0.10 -3.29 0.00 0.00 2.84 0.00 0.00 34.83 34.29 1hai s MET 32 CO 0.04 0.20 0.62 -1.17 -0.65 0.00 0.00 175.02 174.06 1hai s LEU 33 N 0.59 4.30 -0.08 4.11 0.20 0.23 -1.56 118.68 126.47 1hai s LEU 33 Ca 0.04 0.05 0.05 0.00 0.69 0.00 0.00 54.13 54.96 1hai s LEU 33 Cb -0.13 -2.75 -0.00 0.00 -0.43 0.00 0.00 46.19 42.88 1hai s LEU 33 CO 0.01 -0.60 -0.24 0.12 -0.29 0.00 0.00 176.35 175.35 1hai s PHE 34 N 2.68 2.43 -0.05 5.38 5.36 -0.10 0.34 117.98 134.03 1hai s PHE 34 Ca 0.23 -0.89 -0.27 0.00 -0.96 0.00 0.00 56.93 55.05 1hai s PHE 34 Cb -0.15 -1.62 -0.03 0.00 -0.34 0.00 0.00 43.02 40.89 1hai s PHE 34 CO 0.15 -0.33 0.84 0.50 -1.46 0.00 0.00 175.22 174.92 1hai s ARG 35 N 0.16 4.48 0.10 10.12 3.52 0.47 -1.17 118.95 136.64 1hai s ARG 35 Ca -0.13 1.14 -0.24 0.00 -0.13 0.00 0.00 55.73 56.37 1hai s ARG 35 Cb -0.16 -3.46 -0.10 0.00 -1.56 0.00 0.00 34.95 29.66 1hai s ARG 35 CO 0.07 -0.02 1.69 0.87 -0.81 0.00 0.00 175.30 177.09 1hai h LYS 36 N 6.83 -0.22 -1.73 5.12 1.57 -1.79 -0.60 116.57 125.74 1hai h LYS 36 Ca -0.40 0.02 0.10 0.00 -1.87 0.00 0.00 60.65 58.49 1hai h LYS 36 Cb 1.20 0.05 -0.21 0.00 0.08 0.00 0.00 32.23 33.36 1hai h LYS 36 CO 0.76 -0.15 -0.09 0.45 -0.57 0.00 0.00 179.45 179.85 1hai s SER 36 N -5.00 -1.08 0.61 0.86 0.15 -1.26 -3.11 113.70 104.86 1hai s SER 36 Ca -0.14 1.37 -0.19 0.00 0.70 0.00 0.00 55.95 57.69 1hai s SER 36 Cb 0.07 2.19 -0.03 0.00 -1.71 0.00 0.00 66.02 66.54 1hai s SER 36 CO 0.66 -0.21 1.19 -0.81 1.20 0.00 0.00 173.24 175.27 1hai n PRO 37 N 5.38 1.16 -1.87 5.44 -0.04 -1.26 -5.03 135.00 138.78 1hai n PRO 37 Ca -0.10 0.44 -0.42 0.00 -0.04 0.00 0.00 63.50 63.38 1hai n PRO 37 Cb 0.50 -2.40 -0.03 0.00 -0.04 0.00 0.00 33.50 31.53 1hai n PRO 37 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1hai s GLN 38 N -3.03 4.17 0.01 0.54 -1.52 -1.18 -4.69 119.66 113.96 1hai s GLN 38 Ca 0.78 2.38 -0.29 0.00 -1.95 0.00 0.00 55.36 56.28 1hai s GLN 38 Cb -0.40 -3.88 0.07 0.00 -0.22 0.00 0.00 33.01 28.57 1hai s GLN 38 CO 0.45 -0.84 0.66 -1.83 -0.25 0.00 0.00 175.29 173.48 1hai s GLU 39 N 3.61 1.12 -0.42 2.91 -1.05 -0.24 -4.90 118.70 119.73 1hai s GLU 39 Ca 0.78 0.07 -0.28 0.00 -0.15 0.00 0.00 54.97 55.39 1hai s GLU 39 Cb -0.39 0.52 -0.01 0.00 -0.44 0.00 0.00 34.13 33.82 1hai s GLU 39 CO 0.34 -0.39 1.64 -1.17 0.95 0.00 0.00 175.26 176.63 1hai s LEU 40 N -1.60 3.49 -0.12 1.83 2.96 -1.26 0.18 118.68 124.15 1hai s LEU 40 Ca -0.08 0.89 -0.13 0.00 -0.22 0.00 0.00 54.13 54.59 1hai s LEU 40 Cb -0.00 -3.32 -0.11 0.00 0.50 0.00 0.00 46.19 43.25 1hai s LEU 40 CO 0.04 -1.72 0.30 -0.07 -1.32 0.00 0.00 176.35 173.58 1hai h LEU 41 N 13.53 0.00 0.00 -0.68 4.07 -0.48 -3.48 115.31 128.27 1hai h LEU 41 Ca -0.30 -0.41 0.11 0.00 0.08 0.00 0.00 57.88 57.36 1hai h LEU 41 Cb 1.14 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.86 1hai h LEU 41 CO 1.09 0.75 0.48 0.00 -1.08 0.00 0.00 178.44 179.68 1hai n GLY 43 N -0.62 0.25 3.64 0.00 0.00 -0.13 0.74 105.19 109.07 1hai n GLY 43 Ca -0.03 -1.97 -0.02 0.00 0.00 0.00 0.00 46.02 44.00 1hai n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hai s ALA 44 N -3.33 -2.00 0.01 4.61 0.00 -0.79 -3.96 121.76 116.29 1hai s ALA 44 Ca 0.69 0.71 0.00 0.00 0.00 0.00 0.00 51.96 53.36 1hai s ALA 44 Cb -0.03 0.37 -0.01 0.00 0.00 0.00 0.00 23.12 23.44 1hai s ALA 44 CO 0.46 -0.94 -0.02 -1.54 0.00 0.00 0.00 175.76 173.73 1hai s SER 45 N -2.79 0.13 -0.22 0.00 1.04 -0.04 -2.14 113.70 109.68 1hai s SER 45 Ca 0.12 -0.24 -0.20 0.00 0.48 0.00 0.00 55.95 56.11 1hai s SER 45 Cb 0.02 0.05 -0.02 0.00 0.10 0.00 0.00 66.02 66.16 1hai s SER 45 CO -0.03 -0.14 0.60 -0.22 0.98 0.00 0.00 173.24 174.43 1hai s LEU 46 N -0.70 4.11 0.00 2.42 1.98 0.94 -0.84 118.68 126.59 1hai s LEU 46 Ca -0.08 0.75 0.16 0.00 -2.89 0.00 0.00 54.13 52.07 1hai s LEU 46 Cb -0.05 -2.83 0.03 0.00 0.66 0.00 0.00 46.19 44.00 1hai s LEU 46 CO -0.00 -0.28 0.88 2.30 -1.89 0.00 0.00 176.35 177.35 1hai n ILE 47 N 4.84 0.00 -3.89 6.68 -5.35 -0.83 -1.83 119.36 118.99 1hai n ILE 47 Ca -0.02 -0.37 0.01 0.00 -0.27 0.00 0.00 62.75 62.09 1hai n ILE 47 Cb 0.50 1.22 0.01 0.00 -1.74 0.00 0.00 39.64 39.63 1hai n ILE 47 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1hai n SER 48 N 0.11 -0.96 0.04 7.28 3.41 -1.24 -4.77 113.62 117.50 1hai n SER 48 Ca 0.07 -1.33 0.10 0.00 -0.26 0.00 0.00 58.87 57.46 1hai n SER 48 Cb 0.35 1.51 0.43 0.00 -0.26 0.00 0.00 64.21 66.24 1hai n SER 48 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1hai n ASP 49 N -0.89 0.23 0.00 4.04 5.75 -1.26 -3.46 116.55 120.97 1hai n ASP 49 Ca 0.02 0.54 0.00 0.00 -0.01 0.00 0.00 54.79 55.34 1hai n ASP 49 Cb 0.40 -0.60 0.00 0.00 -1.03 0.00 0.00 41.12 39.89 1hai n ASP 49 CO 0.00 0.00 0.00 -1.14 -0.11 0.00 0.00 177.20 175.95 1hai n ARG 50 N -1.74 2.78 -4.83 0.11 3.00 -1.26 -1.48 116.66 113.24 1hai n ARG 50 Ca 0.04 0.00 -0.33 0.00 -0.00 0.00 0.00 57.85 57.56 1hai n ARG 50 Cb 0.25 -0.76 -0.14 0.00 0.00 0.00 0.00 32.46 31.81 1hai n ARG 50 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.63 176.05 1hai s TRP 51 N -1.47 2.76 0.05 -0.14 0.52 -1.22 0.02 118.94 119.46 1hai s TRP 51 Ca 0.00 -0.42 0.09 0.00 0.02 0.00 0.00 56.10 55.79 1hai s TRP 51 Cb 0.00 -1.75 -0.03 0.00 -1.15 0.00 0.00 33.47 30.54 1hai s TRP 51 CO 0.00 -0.03 -0.26 0.08 0.02 0.00 0.00 176.95 176.77 1hai s VAL 52 N -0.15 2.21 -0.12 4.03 1.01 -0.11 -1.96 120.40 125.31 1hai s VAL 52 Ca -0.01 -1.39 -0.03 0.00 0.00 0.00 0.00 61.98 60.55 1hai s VAL 52 Cb -0.13 -1.87 -0.03 0.00 0.00 0.00 0.00 36.38 34.34 1hai s VAL 52 CO 0.03 0.35 -0.00 -0.22 0.00 0.00 0.00 175.10 175.26 1hai s LEU 53 N -1.30 3.52 0.00 3.92 2.96 -0.02 -0.21 118.68 127.55 1hai s LEU 53 Ca 0.12 0.05 0.00 0.00 -0.22 0.00 0.00 54.13 54.08 1hai s LEU 53 Cb -0.10 -1.83 -0.00 0.00 0.50 0.00 0.00 46.19 44.76 1hai s LEU 53 CO 0.03 0.28 0.35 1.07 -1.32 0.00 0.00 176.35 176.76 1hai n THR 54 N 2.81 0.00 -2.94 3.68 5.66 -0.60 -0.87 114.28 122.01 1hai n THR 54 Ca -0.18 -1.58 -0.40 0.00 -3.05 0.00 0.00 64.05 58.84 1hai n THR 54 Cb 0.53 0.91 -0.04 0.00 -1.55 0.00 0.00 70.33 70.18 1hai n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1hai s ALA 55 N -2.69 3.30 0.40 1.79 0.00 -1.26 -0.84 121.76 122.46 1hai s ALA 55 Ca 0.26 0.27 0.07 0.00 0.00 0.00 0.00 51.96 52.56 1hai s ALA 55 Cb -0.00 -3.06 0.83 0.00 0.00 0.00 0.00 23.12 20.88 1hai s ALA 55 CO 0.18 -0.10 2.03 0.00 0.00 0.00 0.00 175.76 177.87 1hai h ALA 56 N 6.55 1.73 0.00 0.00 0.00 -1.70 -1.93 119.26 123.90 1hai h ALA 56 Ca -0.42 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1hai h ALA 56 Cb 1.20 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1hai h ALA 56 CO 0.74 0.22 0.00 -2.39 0.00 0.00 0.00 179.25 177.83 1hai n HIS 57 N -4.47 0.00 0.16 0.00 1.44 -1.26 -0.83 115.22 110.26 1hai n HIS 57 Ca 0.06 0.00 0.05 0.00 -2.01 0.00 0.00 57.72 55.81 1hai n HIS 57 Cb 0.12 -0.33 0.08 0.00 0.12 0.00 0.00 29.99 29.98 1hai n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1hai n LEU 59 N -3.22 2.51 -3.78 0.00 4.77 -0.01 -4.84 117.00 112.45 1hai n LEU 59 Ca 0.02 -0.11 -0.27 0.00 -0.03 0.00 0.00 56.01 55.62 1hai n LEU 59 Cb 0.68 -0.64 -0.17 0.00 -2.33 0.00 0.00 43.42 40.96 1hai n LEU 59 CO 0.39 0.84 -0.38 -0.22 -1.33 0.00 0.00 177.39 176.69 1hai s LEU 60 N -6.26 1.19 0.02 2.23 2.96 -0.85 0.13 118.68 118.11 1hai s LEU 60 Ca -0.29 -0.66 -0.22 0.00 -0.22 0.00 0.00 54.13 52.74 1hai s LEU 60 Cb 0.08 -0.64 0.05 0.00 0.50 0.00 0.00 46.19 46.18 1hai s LEU 60 CO 0.59 -0.26 0.50 -0.47 -1.32 0.00 0.00 176.35 175.39 1hai s TYR 60 N 1.83 -0.41 0.00 5.38 5.04 0.17 -4.19 117.35 125.17 1hai s TYR 60 Ca 0.00 0.54 0.00 0.00 -2.44 0.00 0.00 57.07 55.17 1hai s TYR 60 Cb -0.16 0.30 0.00 0.00 0.35 0.00 0.00 41.96 42.45 1hai s TYR 60 CO -0.07 -0.58 0.00 -2.30 -1.34 0.00 0.00 175.55 171.25 1hai n PRO 60 N 0.67 0.00 -0.25 4.97 -0.02 -1.26 -1.83 135.00 137.28 1hai n PRO 60 Ca -0.19 0.00 0.06 0.00 -2.02 0.00 0.00 63.50 61.35 1hai n PRO 60 Cb 0.59 0.00 0.18 0.00 -0.02 0.00 0.00 33.50 34.25 1hai n PRO 60 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 1hai n TRP 60 N 0.00 0.60 -1.93 6.00 8.01 -1.26 -4.98 117.44 123.87 1hai n TRP 60 Ca 0.00 -0.61 -0.15 0.00 -1.31 0.00 0.00 57.50 55.43 1hai n TRP 60 Cb 0.00 -0.11 -0.03 0.00 -2.01 0.00 0.00 31.31 29.16 1hai n TRP 60 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.69 176.43 1hai n ASP 60 N 0.20 -4.71 -4.51 -0.99 8.00 -1.05 -4.96 116.55 108.52 1hai n ASP 60 Ca 0.14 0.15 -0.42 0.00 0.71 0.00 0.00 54.79 55.38 1hai n ASP 60 Cb 0.56 -3.73 -0.09 0.00 -0.02 0.00 0.00 41.12 37.84 1hai n ASP 60 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 1hai s LYS 60 N -4.14 3.34 -0.42 -1.24 2.20 -0.76 -4.99 119.74 113.73 1hai s LYS 60 Ca 0.00 -0.61 0.05 0.00 -0.36 0.00 0.00 55.97 55.05 1hai s LYS 60 Cb 0.00 -3.88 0.17 0.00 -1.51 0.00 0.00 37.83 32.61 1hai s LYS 60 CO 0.00 -0.66 0.48 1.21 -0.36 0.00 0.00 175.35 176.02 1hai s ASN 60 N 1.75 0.34 0.12 1.43 2.47 -1.19 0.44 114.94 120.30 1hai s ASN 60 Ca 0.11 -1.93 -0.23 0.00 0.42 0.00 0.00 52.86 51.23 1hai s ASN 60 Cb -0.17 0.77 -0.07 0.00 -1.45 0.00 0.00 41.25 40.33 1hai s ASN 60 CO 0.12 -0.18 0.70 -0.36 -3.72 0.00 0.00 177.10 173.67 1hai s PHE 60 N 0.98 3.86 0.31 0.43 0.08 0.36 -4.98 117.98 119.02 1hai s PHE 60 Ca 0.24 1.50 0.07 0.00 0.12 0.00 0.00 56.93 58.86 1hai s PHE 60 Cb -0.06 -2.68 -0.03 0.00 -0.57 0.00 0.00 43.02 39.68 1hai s PHE 60 CO -0.08 0.51 0.29 0.95 -0.10 0.00 0.00 175.22 176.79 1hai s THR 60 N -1.01 3.94 0.26 0.64 -4.23 -1.26 -4.86 115.64 109.12 1hai s THR 60 Ca 0.34 -1.32 -0.09 0.00 -1.18 0.00 0.00 61.69 59.43 1hai s THR 60 Cb -0.22 -3.30 0.38 0.00 1.34 0.00 0.00 72.50 70.70 1hai s THR 60 CO 0.23 -0.23 1.58 -0.33 -0.54 0.00 0.00 174.62 175.34 1hai h GLU 61 N 1.28 0.00 -0.29 3.99 3.07 -1.93 0.22 114.58 120.92 1hai h GLU 61 Ca -0.46 -0.00 0.08 0.00 -0.50 0.00 0.00 59.36 58.47 1hai h GLU 61 Cb 1.25 -0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 29.14 1hai h GLU 61 CO 0.59 0.00 0.20 -0.91 -1.40 0.00 0.00 179.01 177.49 1hai h ASN 62 N 0.00 0.04 1.16 1.42 2.35 -1.96 -2.60 115.58 115.99 1hai h ASN 62 Ca 0.43 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.18 1hai h ASN 62 Cb 0.67 -0.01 0.00 0.00 0.05 0.00 0.00 38.32 39.03 1hai h ASN 62 CO -0.89 0.02 0.00 0.47 -1.65 0.00 0.00 177.43 175.39 1hai n ASP 63 N -4.46 0.73 -4.43 5.81 8.00 0.06 -4.93 116.55 117.33 1hai n ASP 63 Ca 0.04 0.61 -0.21 0.00 0.71 0.00 0.00 54.79 55.94 1hai n ASP 63 Cb 0.34 -0.79 -0.11 0.00 -0.02 0.00 0.00 41.12 40.54 1hai n ASP 63 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1hai s LEU 64 N -4.47 2.16 0.04 0.64 1.43 -0.98 -2.49 118.68 115.01 1hai s LEU 64 Ca 0.08 -1.35 0.00 0.00 -1.03 0.00 0.00 54.13 51.83 1hai s LEU 64 Cb 0.11 -0.36 -0.03 0.00 0.03 0.00 0.00 46.19 45.94 1hai s LEU 64 CO 0.51 -0.59 -0.04 -0.76 0.23 0.00 0.00 176.35 175.70 1hai s LEU 65 N -3.46 2.38 -0.04 1.79 1.02 -0.32 -4.49 118.68 115.57 1hai s LEU 65 Ca 0.36 -0.77 0.07 0.00 0.02 0.00 0.00 54.13 53.80 1hai s LEU 65 Cb 0.08 0.09 -0.02 0.00 0.02 0.00 0.00 46.19 46.36 1hai s LEU 65 CO 0.15 -0.43 -0.25 0.54 0.02 0.00 0.00 176.35 176.38 1hai s VAL 66 N -2.72 2.15 -0.15 -1.59 0.11 0.24 -0.92 120.40 117.51 1hai s VAL 66 Ca -0.03 -1.06 0.01 0.00 -2.93 0.00 0.00 61.98 57.98 1hai s VAL 66 Cb -0.01 -1.76 0.01 0.00 -1.53 0.00 0.00 36.38 33.09 1hai s VAL 66 CO -0.05 0.58 -0.18 -0.13 -3.33 0.00 0.00 175.10 171.98 1hai s ARG 67 N -0.46 3.11 -0.01 1.54 0.52 -0.60 0.55 118.95 123.60 1hai s ARG 67 Ca 0.05 -0.80 0.08 0.00 -0.52 0.00 0.00 55.73 54.54 1hai s ARG 67 Cb -0.11 -2.55 -0.02 0.00 0.52 0.00 0.00 34.95 32.78 1hai s ARG 67 CO 0.01 -0.03 -0.26 0.42 0.02 0.00 0.00 175.30 175.46 1hai s ILE 68 N 0.89 2.02 0.00 1.52 1.01 0.40 0.08 121.20 127.12 1hai s ILE 68 Ca -0.04 -1.11 0.00 0.00 0.00 0.00 0.00 60.65 59.50 1hai s ILE 68 Cb -0.15 -1.68 0.00 0.00 0.01 0.00 0.00 42.46 40.64 1hai s ILE 68 CO -0.02 0.55 0.00 0.61 0.00 0.00 0.00 174.94 176.08 1hai n GLY 69 N 2.40 0.68 3.88 6.18 0.00 -1.25 -0.83 105.19 116.24 1hai n GLY 69 Ca -0.16 -0.54 -0.30 0.00 0.00 0.00 0.00 46.02 45.01 1hai n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hai s LYS 70 N -1.02 3.60 0.13 1.61 1.02 -1.26 -4.44 119.74 119.39 1hai s LYS 70 Ca 0.00 0.62 0.00 0.00 0.02 0.00 0.00 55.97 56.61 1hai s LYS 70 Cb 0.00 -2.16 0.00 0.00 -0.52 0.00 0.00 37.83 35.15 1hai s LYS 70 CO 0.00 -0.47 0.00 1.58 -0.92 0.00 0.00 175.35 175.54 1hai n HIS 71 N -2.58 -0.96 -2.08 3.18 -0.00 -1.26 -4.96 115.22 106.56 1hai n HIS 71 Ca 0.05 0.17 -0.41 0.00 -0.00 0.00 0.00 57.72 57.53 1hai n HIS 71 Cb 0.54 0.33 -0.02 0.00 -0.00 0.00 0.00 29.99 30.84 1hai n HIS 71 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 1hai s SER 72 N -5.26 6.73 0.04 0.26 0.15 -1.26 -1.37 113.70 112.99 1hai s SER 72 Ca 0.00 2.70 -0.26 0.00 0.70 0.00 0.00 55.95 59.09 1hai s SER 72 Cb 0.00 -2.64 -0.17 0.00 -1.71 0.00 0.00 66.02 61.49 1hai s SER 72 CO 0.00 -0.58 1.46 -0.09 1.20 0.00 0.00 173.24 175.23 1hai h ARG 73 N 3.70 -0.24 0.00 5.44 2.43 -0.86 -3.39 114.38 121.46 1hai h ARG 73 Ca -0.48 0.02 -0.14 0.00 -0.81 0.00 0.00 59.98 58.56 1hai h ARG 73 Cb 1.23 0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 30.80 1hai h ARG 73 CO 0.68 0.01 -1.84 0.25 -1.51 0.00 0.00 179.97 177.56 1hai n THR 74 N -5.10 0.52 -1.72 0.20 -2.24 -1.26 -5.03 114.28 99.66 1hai n THR 74 Ca -0.09 -0.48 -0.34 0.00 -2.27 0.00 0.00 64.05 60.87 1hai n THR 74 Cb 0.19 -0.27 0.06 0.00 -2.10 0.00 0.00 70.33 68.22 1hai n THR 74 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1hai s ARG 75 N -2.67 2.60 -0.47 -0.78 1.81 -1.26 -4.96 118.95 113.22 1hai s ARG 75 Ca -0.06 1.67 -0.24 0.00 -1.72 0.00 0.00 55.73 55.38 1hai s ARG 75 Cb 0.07 -1.90 0.03 0.00 -0.45 0.00 0.00 34.95 32.70 1hai s ARG 75 CO 0.60 -1.46 0.87 -0.47 -0.68 0.00 0.00 175.30 174.16 1hai s TYR 76 N -1.96 2.93 -1.20 -0.53 5.04 -1.26 -4.89 117.35 115.48 1hai s TYR 76 Ca 0.73 0.22 -0.16 0.00 -2.44 0.00 0.00 57.07 55.42 1hai s TYR 76 Cb -0.27 -3.87 0.13 0.00 0.35 0.00 0.00 41.96 38.30 1hai s TYR 76 CO 0.40 -1.10 1.51 -1.21 -1.34 0.00 0.00 175.55 173.81 1hai s GLU 77 N 3.61 3.99 -0.06 4.97 2.02 -1.26 -4.96 118.70 127.01 1hai s GLU 77 Ca 0.33 -2.25 -0.36 0.00 0.02 0.00 0.00 54.97 52.71 1hai s GLU 77 Cb -0.11 -5.22 -0.14 0.00 0.10 0.00 0.00 34.13 28.76 1hai s GLU 77 CO 0.24 -1.95 1.72 -2.13 0.02 0.00 0.00 175.26 173.15 1hai n ARG 77 N 6.77 1.80 -1.13 1.61 0.63 -1.26 -1.13 116.66 123.95 1hai n ARG 77 Ca 0.39 0.66 -0.05 0.00 -0.92 0.00 0.00 57.85 57.94 1hai n ARG 77 Cb 0.45 -2.42 -0.02 0.00 0.45 0.00 0.00 32.46 30.91 1hai n ARG 77 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1hai n ASN 78 N 5.14 -4.01 0.06 6.15 5.03 -1.26 -4.81 115.26 121.56 1hai n ASN 78 Ca 0.22 0.11 0.00 0.00 0.87 0.00 0.00 54.58 55.78 1hai n ASN 78 Cb 0.24 -1.91 0.00 0.00 -1.02 0.00 0.00 39.78 37.09 1hai n ASN 78 CO 0.00 0.00 0.00 -0.38 -1.83 0.00 0.00 177.26 175.05 1hai n ILE 79 N -2.72 0.28 -2.80 2.41 5.41 -0.28 -5.11 119.36 116.55 1hai n ILE 79 Ca -0.05 0.09 -0.37 0.00 1.00 0.00 0.00 62.75 63.43 1hai n ILE 79 Cb 0.23 -0.94 -0.06 0.00 -0.71 0.00 0.00 39.64 38.15 1hai n ILE 79 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 176.55 174.72 1hai s GLU 80 N -2.00 4.56 -0.08 0.38 -1.05 -0.37 -4.80 118.70 115.34 1hai s GLU 80 Ca 0.00 1.30 0.02 0.00 -0.15 0.00 0.00 54.97 56.14 1hai s GLU 80 Cb 0.00 -2.78 -0.02 0.00 -0.44 0.00 0.00 34.13 30.89 1hai s GLU 80 CO 0.00 0.27 -0.14 0.15 0.95 0.00 0.00 175.26 176.49 1hai s LYS 81 N -2.09 2.79 -0.11 -4.83 -0.14 -0.01 -4.92 119.74 110.43 1hai s LYS 81 Ca 0.50 -0.70 0.01 0.00 -1.36 0.00 0.00 55.97 54.42 1hai s LYS 81 Cb -0.18 -2.45 -0.02 0.00 -1.68 0.00 0.00 37.83 33.50 1hai s LYS 81 CO 0.23 0.49 -0.14 0.42 -0.76 0.00 0.00 175.35 175.59 1hai s ILE 82 N -0.37 3.04 0.13 2.17 1.01 -1.26 -0.45 121.20 125.47 1hai s ILE 82 Ca 0.04 -0.68 0.04 0.00 0.00 0.00 0.00 60.65 60.05 1hai s ILE 82 Cb -0.12 -2.25 -0.04 0.00 0.01 0.00 0.00 42.46 40.05 1hai s ILE 82 CO 0.02 0.54 -0.10 -0.44 0.00 0.00 0.00 174.94 174.96 1hai s SER 83 N 0.06 1.71 0.21 3.58 0.01 0.19 -4.94 113.70 114.51 1hai s SER 83 Ca -0.05 -0.95 -0.03 0.00 1.31 0.00 0.00 55.95 56.22 1hai s SER 83 Cb -0.15 -0.01 -0.05 0.00 0.21 0.00 0.00 66.02 66.03 1hai s SER 83 CO 0.04 -0.31 0.43 -0.04 0.41 0.00 0.00 173.24 173.78 1hai s MET 84 N -3.46 3.59 -0.19 12.44 -1.94 -1.26 0.82 119.30 129.30 1hai s MET 84 Ca 0.13 -0.16 -0.09 0.00 -1.71 0.00 0.00 55.69 53.86 1hai s MET 84 Cb 0.01 -2.79 -0.05 0.00 2.01 0.00 0.00 34.83 34.01 1hai s MET 84 CO 0.00 0.37 0.12 -0.51 -0.01 0.00 0.00 175.02 174.99 1hai s LEU 85 N -3.16 4.14 -0.03 -0.03 1.43 -1.26 -0.65 118.68 119.12 1hai s LEU 85 Ca 0.41 0.22 -0.22 0.00 -1.03 0.00 0.00 54.13 53.51 1hai s LEU 85 Cb -0.11 -2.06 -0.25 0.00 0.03 0.00 0.00 46.19 43.79 1hai s LEU 85 CO 0.28 0.20 1.01 -0.08 0.23 0.00 0.00 176.35 177.99 1hai h GLU 86 N 6.52 0.29 -2.11 1.70 4.81 0.11 -3.44 114.58 122.46 1hai h GLU 86 Ca -0.41 -0.35 -0.06 0.00 -0.13 0.00 0.00 59.36 58.41 1hai h GLU 86 Cb 1.16 0.11 -0.20 0.00 0.63 0.00 0.00 28.75 30.45 1hai h GLU 86 CO 0.73 1.07 0.11 0.21 -0.73 0.00 0.00 179.01 180.40 1hai s LYS 87 N -2.95 0.90 -0.08 1.92 2.36 -1.11 -4.99 119.74 115.80 1hai s LYS 87 Ca -0.14 0.58 -0.01 0.00 -2.55 0.00 0.00 55.97 53.84 1hai s LYS 87 Cb 0.02 0.43 -0.03 0.00 -1.05 0.00 0.00 37.83 37.19 1hai s LYS 87 CO 0.79 -0.20 -0.02 0.42 1.55 0.00 0.00 175.35 177.89 1hai s ILE 88 N -0.42 4.11 -0.19 5.43 1.01 -1.26 0.38 121.20 130.26 1hai s ILE 88 Ca -0.06 -0.34 -0.04 0.00 0.00 0.00 0.00 60.65 60.22 1hai s ILE 88 Cb -0.03 -2.72 0.06 0.00 0.01 0.00 0.00 42.46 39.79 1hai s ILE 88 CO 0.05 0.59 0.06 -0.31 0.00 0.00 0.00 174.94 175.34 1hai s TYR 89 N -0.87 0.68 0.02 3.97 1.51 0.27 -5.00 117.35 117.93 1hai s TYR 89 Ca 0.13 -0.67 -0.16 0.00 -1.01 0.00 0.00 57.07 55.37 1hai s TYR 89 Cb -0.11 -0.91 -0.06 0.00 -0.11 0.00 0.00 41.96 40.77 1hai s TYR 89 CO 0.02 -0.59 0.45 0.42 -1.11 0.00 0.00 175.55 174.75 1hai s ILE 90 N 1.97 4.95 0.10 2.71 1.01 -1.26 -0.37 121.20 130.31 1hai s ILE 90 Ca 0.01 0.93 -0.31 0.00 0.00 0.00 0.00 60.65 61.27 1hai s ILE 90 Cb -0.17 -3.76 -0.11 0.00 0.01 0.00 0.00 42.46 38.44 1hai s ILE 90 CO -0.10 0.56 1.85 1.57 0.00 0.00 0.00 174.94 178.82 1hai n HIS 91 N 1.76 2.58 -0.05 3.97 -0.00 -1.14 -4.86 115.22 117.48 1hai n HIS 91 Ca -0.13 -0.16 0.16 0.00 -0.00 0.00 0.00 57.72 57.60 1hai n HIS 91 Cb 0.52 -2.73 0.59 0.00 -0.00 0.00 0.00 29.99 28.36 1hai n HIS 91 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 1hai h PRO 92 N 8.76 0.22 -0.63 1.57 0.13 -1.95 -2.23 132.00 137.86 1hai h PRO 92 Ca -0.47 -0.01 -0.27 0.00 -0.87 0.00 0.00 66.00 64.38 1hai h PRO 92 Cb 1.23 -0.05 -0.16 0.00 0.13 0.00 0.00 31.00 32.15 1hai h PRO 92 CO 0.94 0.14 0.24 0.54 -0.23 0.00 0.00 178.00 179.64 1hai n ARG 93 N -4.44 2.56 -1.97 0.86 1.74 -1.26 -4.98 116.66 109.17 1hai n ARG 93 Ca 0.10 -3.07 -0.42 0.00 -0.77 0.00 0.00 57.85 53.69 1hai n ARG 93 Cb 0.49 -2.03 -0.03 0.00 -1.02 0.00 0.00 32.46 29.88 1hai n ARG 93 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 1hai s TYR 94 N -3.15 3.04 -0.89 -1.55 5.04 -0.84 -4.71 117.35 114.28 1hai s TYR 94 Ca 0.51 0.81 -0.08 0.00 -2.44 0.00 0.00 57.07 55.86 1hai s TYR 94 Cb 0.43 -3.88 0.23 0.00 0.35 0.00 0.00 41.96 39.08 1hai s TYR 94 CO 0.08 -3.09 0.81 1.21 -1.34 0.00 0.00 175.55 173.22 1hai s ASN 95 N 0.80 6.48 0.26 4.32 3.84 0.01 -4.78 114.94 125.88 1hai s ASN 95 Ca 0.65 -3.20 0.25 0.00 0.21 0.00 0.00 52.86 50.76 1hai s ASN 95 Cb -0.43 -2.08 0.54 0.00 -0.55 0.00 0.00 41.25 38.73 1hai s ASN 95 CO 0.37 -0.37 1.61 4.11 -2.79 0.00 0.00 177.10 180.02 1hai h TRP 96 N 6.94 0.00 -0.18 0.43 5.08 -1.93 -0.37 115.95 125.93 1hai h TRP 96 Ca 0.12 0.00 -0.03 0.00 1.08 0.00 0.00 58.89 60.06 1hai h TRP 96 Cb 0.93 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 27.08 1hai h TRP 96 CO 0.83 0.00 -0.01 0.00 -1.28 0.00 0.00 178.44 177.99 1hai h ARG 97 N 0.00 0.32 0.00 0.12 3.08 -1.99 -3.43 114.38 112.48 1hai h ARG 97 Ca 0.00 -0.10 -0.11 0.00 0.07 0.00 0.00 59.98 59.84 1hai h ARG 97 Cb 0.83 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.84 1hai h ARG 97 CO 0.00 0.54 -1.14 -1.91 -1.07 0.00 0.00 179.97 176.39 1hai n GLU 97 N -4.71 0.19 -0.19 0.04 2.13 -1.24 -5.01 120.64 111.86 1hai n GLU 97 Ca -0.05 0.08 0.01 0.00 0.66 0.00 0.00 57.16 57.86 1hai n GLU 97 Cb 0.23 -0.83 0.01 0.00 0.27 0.00 0.00 31.44 31.12 1hai n GLU 97 CO 0.00 0.00 0.00 0.27 -0.41 0.00 0.00 177.13 176.99 1hai n ASN 98 N -3.56 0.33 -1.89 4.31 6.94 -1.21 -4.98 115.26 115.21 1hai n ASN 98 Ca -0.14 -1.60 -0.17 0.00 -0.02 0.00 0.00 54.58 52.65 1hai n ASN 98 Cb 0.48 -0.10 -0.01 0.00 -2.36 0.00 0.00 39.78 37.79 1hai n ASN 98 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 1hai n LEU 99 N -0.14 -1.74 -4.77 -4.53 4.77 -0.15 -4.97 117.00 105.46 1hai n LEU 99 Ca 0.01 0.01 -0.40 0.00 -0.03 0.00 0.00 56.01 55.60 1hai n LEU 99 Cb 0.56 -2.47 -0.01 0.00 -2.33 0.00 0.00 43.42 39.17 1hai n LEU 99 CO 0.00 -0.22 1.03 -0.62 -1.33 0.00 0.00 177.39 176.25 1hai s ASP 100 N -2.27 6.45 -1.25 -1.43 2.15 -1.24 -2.90 116.67 116.18 1hai s ASP 100 Ca 0.00 2.80 -0.01 0.00 0.43 0.00 0.00 52.55 55.78 1hai s ASP 100 Cb 0.00 -2.65 0.00 0.00 -0.30 0.00 0.00 42.92 39.97 1hai s ASP 100 CO 0.00 -0.77 0.90 0.54 -0.17 0.00 0.00 175.17 175.67 1hai n ARG 101 N 0.44 -6.06 -2.79 4.34 1.74 -1.26 -0.81 116.66 112.26 1hai n ARG 101 Ca 0.02 0.76 -0.44 0.00 -0.77 0.00 0.00 57.85 57.42 1hai n ARG 101 Cb 0.41 -5.62 -0.00 0.00 -1.02 0.00 0.00 32.46 26.23 1hai n ARG 101 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1hai s ASP 102 N -4.30 6.98 -0.03 0.55 2.15 -1.14 -4.38 116.67 116.50 1hai s ASP 102 Ca 0.04 -2.77 -0.19 0.00 0.43 0.00 0.00 52.55 50.06 1hai s ASP 102 Cb -0.02 -2.48 0.04 0.00 -0.30 0.00 0.00 42.92 40.16 1hai s ASP 102 CO 0.76 -0.92 0.40 -0.51 -0.17 0.00 0.00 175.17 174.73 1hai s ILE 103 N 2.68 0.04 0.00 4.11 2.07 -1.26 -3.92 121.20 124.91 1hai s ILE 103 Ca 0.47 -0.34 -0.26 0.00 -1.41 0.00 0.00 60.65 59.12 1hai s ILE 103 Cb 0.00 -0.70 0.06 0.00 0.13 0.00 0.00 42.46 41.94 1hai s ILE 103 CO 0.03 -0.19 0.58 0.00 -1.91 0.00 0.00 174.94 173.45 1hai s ALA 104 N -1.21 -1.49 -0.01 1.50 0.00 -0.02 -2.87 121.76 117.66 1hai s ALA 104 Ca -0.12 0.90 0.04 0.00 0.00 0.00 0.00 51.96 52.78 1hai s ALA 104 Cb -0.04 0.20 -0.03 0.00 0.00 0.00 0.00 23.12 23.25 1hai s ALA 104 CO 0.05 -0.43 -0.13 -0.51 0.00 0.00 0.00 175.76 174.75 1hai s LEU 105 N -1.58 2.85 -0.08 0.00 1.43 0.50 -1.56 118.68 120.23 1hai s LEU 105 Ca -0.09 -0.24 0.05 0.00 -1.03 0.00 0.00 54.13 52.82 1hai s LEU 105 Cb -0.01 -1.63 -0.01 0.00 0.03 0.00 0.00 46.19 44.57 1hai s LEU 105 CO 0.04 0.30 -0.24 -0.04 0.23 0.00 0.00 176.35 176.64 1hai s MET 106 N -1.15 2.84 -0.25 1.70 -1.94 0.71 -0.57 119.30 120.65 1hai s MET 106 Ca 0.14 -0.88 -0.11 0.00 -1.71 0.00 0.00 55.69 53.13 1hai s MET 106 Cb -0.11 -2.26 -0.05 0.00 2.01 0.00 0.00 34.83 34.43 1hai s MET 106 CO 0.04 0.28 0.19 0.21 -0.01 0.00 0.00 175.02 175.73 1hai s LYS 107 N 0.10 4.04 0.41 2.03 2.20 0.16 -0.94 119.74 127.75 1hai s LYS 107 Ca -0.11 -0.24 -0.24 0.00 -0.36 0.00 0.00 55.97 55.01 1hai s LYS 107 Cb -0.16 -3.58 -0.08 0.00 -1.51 0.00 0.00 37.83 32.50 1hai s LYS 107 CO 0.06 -0.02 1.10 -0.51 -0.36 0.00 0.00 175.35 175.62 1hai s LEU 108 N 1.30 4.12 0.41 5.43 1.43 0.10 0.15 118.68 131.62 1hai s LEU 108 Ca 0.08 2.15 0.09 0.00 -1.03 0.00 0.00 54.13 55.43 1hai s LEU 108 Cb -0.14 -4.17 0.90 0.00 0.03 0.00 0.00 46.19 42.81 1hai s LEU 108 CO 0.07 -0.62 2.01 0.11 0.23 0.00 0.00 176.35 178.15 1hai h LYS 109 N 2.43 0.52 -2.68 1.70 1.79 -1.17 -3.39 116.57 115.78 1hai h LYS 109 Ca -0.49 -0.03 -0.10 0.00 -2.18 0.00 0.00 60.65 57.85 1hai h LYS 109 Cb 1.23 -0.12 -0.21 0.00 -1.58 0.00 0.00 32.23 31.55 1hai h LYS 109 CO 0.62 0.35 -0.14 0.15 -1.08 0.00 0.00 179.45 179.34 1hai s LYS 110 N -5.49 0.71 0.54 3.15 1.02 -1.26 -4.92 119.74 113.49 1hai s LYS 110 Ca -0.08 0.18 -0.21 0.00 0.02 0.00 0.00 55.97 55.88 1hai s LYS 110 Cb 0.19 0.33 -0.05 0.00 -0.52 0.00 0.00 37.83 37.77 1hai s LYS 110 CO 0.74 -0.17 1.29 -2.14 -0.92 0.00 0.00 175.35 174.15 1hai s PRO 111 N -0.77 3.21 0.03 -1.68 0.02 -1.26 -4.93 135.00 129.62 1hai s PRO 111 Ca -0.08 2.06 -0.13 0.00 0.02 0.00 0.00 61.00 62.87 1hai s PRO 111 Cb -0.03 -2.21 -0.06 0.00 0.02 0.00 0.00 34.50 32.21 1hai s PRO 111 CO 0.04 -1.08 0.41 0.54 -0.33 0.00 0.00 177.00 176.58 1hai s VAL 112 N -1.40 5.05 -0.07 3.83 0.11 -0.55 -5.03 120.40 122.34 1hai s VAL 112 Ca 0.71 0.70 -0.14 0.00 -2.93 0.00 0.00 61.98 60.33 1hai s VAL 112 Cb -0.36 -3.68 -0.05 0.00 -1.53 0.00 0.00 36.38 30.75 1hai s VAL 112 CO 0.42 0.47 0.35 0.00 -3.33 0.00 0.00 175.10 173.02 1hai s ALA 113 N -1.20 3.67 0.91 1.54 0.00 -1.26 -4.74 121.76 120.68 1hai s ALA 113 Ca 0.27 -0.33 -0.12 0.00 0.00 0.00 0.00 51.96 51.79 1hai s ALA 113 Cb -0.16 -2.37 0.13 0.00 0.00 0.00 0.00 23.12 20.73 1hai s ALA 113 CO 0.15 0.35 1.09 -0.06 0.00 0.00 0.00 175.76 177.29 1hai s PHE 114 N -0.49 2.28 0.06 0.00 0.08 -1.26 -4.92 117.98 113.72 1hai s PHE 114 Ca 0.21 1.25 -0.12 0.00 0.12 0.00 0.00 56.93 58.39 1hai s PHE 114 Cb -0.15 -3.17 0.04 0.00 -0.57 0.00 0.00 43.02 39.17 1hai s PHE 114 CO 0.09 -2.46 0.56 -1.13 -0.10 0.00 0.00 175.22 172.19 1hai n SER 115 N -3.92 -0.80 0.30 1.36 3.41 -0.43 -4.97 113.62 108.57 1hai n SER 115 Ca 0.07 -1.36 0.20 0.00 -0.26 0.00 0.00 58.87 57.52 1hai n SER 115 Cb 0.55 1.29 1.01 0.00 -0.26 0.00 0.00 64.21 66.80 1hai n SER 115 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1hai h ASP 116 N 1.01 0.00 -0.00 4.04 5.19 -1.99 -3.25 116.42 121.41 1hai h ASP 116 Ca -0.13 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.28 1hai h ASP 116 Cb 0.61 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.12 1hai h ASP 116 CO 0.18 0.00 -0.19 -1.22 -3.12 0.00 0.00 179.24 174.88 1hai n TYR 117 N -2.99 0.00 -3.91 4.55 4.01 -1.26 -4.73 117.16 112.83 1hai n TYR 117 Ca -0.02 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.43 1hai n TYR 117 Cb 0.13 0.00 -0.16 0.00 -0.31 0.00 0.00 39.34 39.00 1hai n TYR 117 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1hai s ILE 118 N -1.26 1.25 -0.28 -0.72 1.01 -1.23 -3.91 121.20 116.07 1hai s ILE 118 Ca 0.04 -0.80 -0.24 0.00 0.00 0.00 0.00 60.65 59.65 1hai s ILE 118 Cb 0.05 -1.44 0.13 0.00 0.01 0.00 0.00 42.46 41.20 1hai s ILE 118 CO 0.19 0.08 1.03 -2.28 0.00 0.00 0.00 174.94 173.97 1hai s HIS 119 N 1.56 -0.48 0.61 3.97 2.46 -0.46 -1.32 115.29 121.62 1hai s HIS 119 Ca -0.01 1.15 -0.14 0.00 0.47 0.00 0.00 55.06 56.53 1hai s HIS 119 Cb -0.16 0.37 -0.03 0.00 -0.13 0.00 0.00 32.58 32.62 1hai s HIS 119 CO -0.08 -0.23 1.04 -1.25 -2.47 0.00 0.00 174.74 171.76 1hai s PRO 120 N 0.36 3.34 0.48 2.88 0.04 -1.26 -2.63 135.00 138.21 1hai s PRO 120 Ca 0.02 1.08 0.00 0.00 0.04 0.00 0.00 61.00 62.14 1hai s PRO 120 Cb -0.05 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.45 1hai s PRO 120 CO -0.08 -0.78 0.70 0.54 0.04 0.00 0.00 177.00 177.43 1hai s VAL 121 N -2.66 3.71 0.27 -0.36 0.11 -0.76 -4.91 120.40 115.79 1hai s VAL 121 Ca 0.61 -0.51 -0.02 0.00 -2.93 0.00 0.00 61.98 59.13 1hai s VAL 121 Cb -0.14 -3.38 -0.04 0.00 -1.53 0.00 0.00 36.38 31.28 1hai s VAL 121 CO 0.41 -0.27 0.49 0.00 -3.33 0.00 0.00 175.10 172.40 1hai s LEU 123 N -3.63 4.37 0.60 0.00 1.43 -1.26 -0.18 118.68 120.01 1hai s LEU 123 Ca 0.41 0.66 -0.16 0.00 -1.03 0.00 0.00 54.13 54.01 1hai s LEU 123 Cb -0.11 -2.36 -0.03 0.00 0.03 0.00 0.00 46.19 43.73 1hai s LEU 123 CO 0.31 0.28 1.06 -2.16 0.23 0.00 0.00 176.35 176.07 1hai s PRO 124 N -0.55 3.25 0.21 1.29 0.04 -1.26 -4.94 135.00 133.05 1hai s PRO 124 Ca 0.19 1.23 0.06 0.00 0.04 0.00 0.00 61.00 62.51 1hai s PRO 124 Cb -0.14 -2.02 -0.04 0.00 0.04 0.00 0.00 34.50 32.34 1hai s PRO 124 CO 0.07 -0.87 0.20 0.16 0.04 0.00 0.00 177.00 176.61 1hai s ASP 125 N -2.76 5.68 0.39 6.66 1.47 -1.26 -4.91 116.67 121.93 1hai s ASP 125 Ca 0.64 -0.14 0.24 0.00 1.18 0.00 0.00 52.55 54.47 1hai s ASP 125 Cb -0.17 -1.51 1.39 0.00 -0.34 0.00 0.00 42.92 42.29 1hai s ASP 125 CO 0.37 0.00 1.57 -1.14 0.68 0.00 0.00 175.17 176.66 1hai n ARG 126 N -0.87 -0.05 0.11 2.11 0.63 -1.26 -1.26 116.66 116.06 1hai n ARG 126 Ca -0.08 1.34 -0.18 0.00 -0.92 0.00 0.00 57.85 58.01 1hai n ARG 126 Cb 0.56 -2.47 -0.14 0.00 0.45 0.00 0.00 32.46 30.86 1hai n ARG 126 CO 0.00 0.00 0.00 1.49 -2.51 0.00 0.00 177.63 176.61 1hai h GLU 127 N 0.00 0.33 -0.57 -0.14 4.57 -2.04 -1.20 114.58 115.53 1hai h GLU 127 Ca 0.86 -0.57 0.00 0.00 -1.18 0.00 0.00 59.36 58.47 1hai h GLU 127 Cb 2.42 0.21 0.00 0.00 -0.16 0.00 0.00 28.75 31.22 1hai h GLU 127 CO -0.68 1.26 0.00 2.41 -1.18 0.00 0.00 179.01 180.82 1hai n THR 128 N -3.56 0.02 0.00 0.32 -1.04 -0.39 -0.78 114.28 108.85 1hai n THR 128 Ca -0.11 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.90 1hai n THR 128 Cb 1.05 -0.18 0.00 0.00 -1.82 0.00 0.00 70.33 69.38 1hai n THR 128 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1hai n ALA 129 N 0.59 0.00 0.14 2.41 0.00 -0.45 -1.27 120.51 121.92 1hai n ALA 129 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.45 1hai n ALA 129 Cb 0.03 0.00 0.13 0.00 0.00 0.00 0.00 19.45 19.61 1hai n ALA 129 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1hai h SER 129 N 0.00 0.00 0.00 0.00 0.02 -1.23 -3.36 113.55 108.98 1hai h SER 129 Ca 0.00 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 60.87 1hai h SER 129 Cb 0.00 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.52 1hai h SER 129 CO 0.00 0.59 -1.87 0.18 -1.14 0.00 0.00 176.83 174.59 1hai n LEU 129 N -3.48 0.00 -4.40 5.07 4.77 -0.39 -4.71 117.00 113.85 1hai n LEU 129 Ca 0.00 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.55 1hai n LEU 129 Cb 0.67 0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.88 1hai n LEU 129 CO 0.41 0.11 1.76 0.18 -1.33 0.00 0.00 177.39 178.52 1hai n LEU 130 N -2.24 5.36 -4.03 2.23 4.77 -1.26 -4.81 117.00 117.02 1hai n LEU 130 Ca -0.10 -4.25 -0.20 0.00 -0.03 0.00 0.00 56.01 51.43 1hai n LEU 130 Cb 0.61 -1.66 -0.15 0.00 -2.33 0.00 0.00 43.42 39.89 1hai n LEU 130 CO 0.35 0.59 -0.44 -1.10 -1.33 0.00 0.00 177.39 175.46 1hai s GLN 131 N 2.57 0.94 0.33 3.23 -0.21 -1.26 -4.94 119.66 120.31 1hai s GLN 131 Ca 0.47 -0.36 -0.29 0.00 0.02 0.00 0.00 55.36 55.20 1hai s GLN 131 Cb 0.02 -0.89 -0.11 0.00 1.00 0.00 0.00 33.01 33.03 1hai s GLN 131 CO 0.03 0.18 1.55 0.00 -2.12 0.00 0.00 175.29 174.93 1hai s ALA 132 N -0.06 3.67 0.00 6.09 0.00 -1.26 0.47 121.76 130.67 1hai s ALA 132 Ca 0.01 1.58 0.00 0.00 0.00 0.00 0.00 51.96 53.55 1hai s ALA 132 Cb -0.06 -3.63 0.00 0.00 0.00 0.00 0.00 23.12 19.42 1hai s ALA 132 CO 0.00 -1.02 0.00 0.41 0.00 0.00 0.00 175.76 175.15 1hai n GLY 133 N 1.42 2.97 3.74 0.00 0.00 0.13 -4.95 105.19 108.51 1hai n GLY 133 Ca 0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 1hai n GLY 133 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1hai s TYR 134 N -2.24 3.89 0.13 1.61 1.51 0.18 -4.69 117.35 117.73 1hai s TYR 134 Ca 0.00 1.85 -0.13 0.00 -1.01 0.00 0.00 57.07 57.78 1hai s TYR 134 Cb 0.00 -3.03 -0.07 0.00 -0.11 0.00 0.00 41.96 38.75 1hai s TYR 134 CO 0.00 0.27 0.50 0.15 -1.11 0.00 0.00 175.55 175.37 1hai s LYS 135 N -0.68 3.91 0.43 -0.62 1.02 -1.26 -0.63 119.74 121.91 1hai s LYS 135 Ca 0.44 0.40 0.03 0.00 0.02 0.00 0.00 55.97 56.86 1hai s LYS 135 Cb -0.25 -2.95 -0.04 0.00 -0.52 0.00 0.00 37.83 34.07 1hai s LYS 135 CO 0.32 0.50 0.05 0.20 -0.92 0.00 0.00 175.35 175.50 1hai s GLY 136 N -1.72 2.66 -0.03 -3.33 0.00 0.04 -4.84 107.32 100.09 1hai s GLY 136 Ca 0.36 -1.23 0.06 0.00 0.00 0.00 0.00 44.72 43.91 1hai s GLY 136 CO 0.19 -2.01 -0.22 -1.60 0.00 0.00 0.00 173.10 169.46 1hai s ARG 137 N -3.80 1.96 0.08 2.90 3.52 -0.31 -0.43 118.95 122.88 1hai s ARG 137 Ca 0.21 -0.77 0.09 0.00 -0.13 0.00 0.00 55.73 55.13 1hai s ARG 137 Cb 0.04 -1.79 -0.03 0.00 -1.56 0.00 0.00 34.95 31.62 1hai s ARG 137 CO 0.11 0.40 -0.24 0.08 -0.81 0.00 0.00 175.30 174.84 1hai s VAL 138 N -0.31 1.98 0.05 7.11 1.01 -0.08 -1.03 120.40 129.13 1hai s VAL 138 Ca 0.03 -1.50 -0.01 0.00 0.00 0.00 0.00 61.98 60.50 1hai s VAL 138 Cb -0.10 -1.74 -0.04 0.00 0.00 0.00 0.00 36.38 34.50 1hai s VAL 138 CO 0.01 0.15 -0.02 0.42 0.00 0.00 0.00 175.10 175.66 1hai s THR 139 N -0.96 0.21 0.00 3.92 -4.23 -1.25 -1.05 115.64 112.28 1hai s THR 139 Ca 0.10 -1.73 0.00 0.00 -1.18 0.00 0.00 61.69 58.89 1hai s THR 139 Cb -0.10 -1.44 0.00 0.00 1.34 0.00 0.00 72.50 72.30 1hai s THR 139 CO 0.04 -0.95 0.00 0.61 -0.54 0.00 0.00 174.62 173.77 1hai n GLY 140 N 0.18 1.94 0.91 3.99 0.00 -0.95 -4.58 105.19 106.69 1hai n GLY 140 Ca -0.15 -1.05 0.07 0.00 0.00 0.00 0.00 46.02 44.90 1hai n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1hai n TRP 141 N -0.88 0.78 -1.60 1.61 8.01 -1.26 -1.93 117.44 122.16 1hai n TRP 141 Ca 0.00 -0.60 -0.30 0.00 -1.31 0.00 0.00 57.50 55.29 1hai n TRP 141 Cb 0.00 -0.13 0.21 0.00 -2.01 0.00 0.00 31.31 29.38 1hai n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1hai s GLY 142 N -1.20 1.71 0.22 6.99 0.00 -1.26 -4.40 107.32 109.38 1hai s GLY 142 Ca 0.34 -1.12 -0.30 0.00 0.00 0.00 0.00 44.72 43.64 1hai s GLY 142 CO 0.17 -0.30 0.96 0.70 0.00 0.00 0.00 173.10 174.63 1hai n ASN 143 N -4.16 0.74 0.14 1.64 4.13 -0.65 -3.31 115.26 113.79 1hai n ASN 143 Ca 0.15 1.16 0.04 0.00 1.68 0.00 0.00 54.58 57.60 1hai n ASN 143 Cb 0.59 -1.18 0.04 0.00 -1.54 0.00 0.00 39.78 37.69 1hai n ASN 143 CO 0.00 0.00 0.00 -0.07 0.28 0.00 0.00 177.26 177.47 1hai h LEU 144 N 2.27 0.00 -7.80 3.41 3.38 0.28 -1.99 115.31 114.87 1hai h LEU 144 Ca -0.39 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.46 1hai h LEU 144 Cb 1.36 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 41.93 1hai h LEU 144 CO 0.63 0.43 -0.46 -0.54 0.09 0.00 0.00 178.44 178.59 1hai s LYS 145 N -3.00 0.61 0.30 1.13 1.02 -1.26 -4.26 119.74 114.28 1hai s LYS 145 Ca 0.04 -0.62 0.05 0.00 0.02 0.00 0.00 55.97 55.46 1hai s LYS 145 Cb 0.07 0.25 0.71 0.00 -0.52 0.00 0.00 37.83 38.34 1hai s LYS 145 CO 0.74 -0.16 1.79 1.49 -0.92 0.00 0.00 175.35 178.29 1hai h GLU 146 N 3.72 0.79 -1.55 1.68 4.81 -1.90 -3.44 114.58 118.69 1hai h GLU 146 Ca -0.32 -0.05 0.08 0.00 -0.13 0.00 0.00 59.36 58.95 1hai h GLU 146 Cb 1.19 -0.18 -0.24 0.00 0.63 0.00 0.00 28.75 30.15 1hai h GLU 146 CO 0.47 0.52 0.55 -0.08 -0.73 0.00 0.00 179.01 179.74 1hai s THR 147 N -5.87 0.00 0.00 0.32 -1.32 -1.26 -4.82 115.64 102.70 1hai s THR 147 Ca -0.11 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.37 1hai s THR 147 Cb 0.24 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 70.23 1hai s THR 147 CO 0.80 0.00 0.00 -2.67 -2.21 0.00 0.00 174.62 170.54 1hai n TRP 148 N 0.95 0.00 0.00 9.09 2.14 -1.26 -5.15 117.44 123.20 1hai n TRP 148 Ca -0.10 0.00 0.00 0.00 2.07 0.00 0.00 57.50 59.47 1hai n TRP 148 Cb 0.58 0.00 0.00 0.00 -0.81 0.00 0.00 31.31 31.08 1hai n TRP 148 CO 0.00 0.00 0.00 0.41 2.07 0.00 0.00 177.69 180.17 1hai n GLY 150 N 0.12 -1.15 3.86 -1.67 0.00 -1.26 -5.25 105.19 99.85 1hai n GLY 150 Ca 0.00 0.49 -0.37 0.00 0.00 0.00 0.00 46.02 46.14 1hai n GLY 150 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1hai s GLN 151 N -2.00 3.72 0.64 1.61 -1.52 -1.26 0.85 119.66 121.70 1hai s GLN 151 Ca 0.00 0.18 -0.07 0.00 -1.95 0.00 0.00 55.36 53.52 1hai s GLN 151 Cb 0.00 -3.19 0.03 0.00 -0.22 0.00 0.00 33.01 29.63 1hai s GLN 151 CO 0.00 0.71 0.96 -1.25 -0.25 0.00 0.00 175.29 175.46 1hai s PRO 152 N -1.15 2.69 -0.05 2.91 0.04 -1.26 -4.91 135.00 133.26 1hai s PRO 152 Ca 0.21 -0.03 0.08 0.00 0.04 0.00 0.00 61.00 61.31 1hai s PRO 152 Cb -0.15 -2.21 -0.24 0.00 0.04 0.00 0.00 34.50 31.94 1hai s PRO 152 CO 0.11 -0.90 0.63 0.66 0.04 0.00 0.00 177.00 177.53 1hai h SER 153 N -0.36 0.10 -2.29 6.66 4.64 -1.97 -3.42 113.55 116.92 1hai h SER 153 Ca -0.45 -0.22 -0.58 0.00 -0.47 0.00 0.00 61.79 60.07 1hai h SER 153 Cb 1.27 -0.03 -0.14 0.00 -0.31 0.00 0.00 62.40 63.19 1hai h SER 153 CO 0.61 1.20 -0.69 0.54 -0.87 0.00 0.00 176.83 177.61 1hai s VAL 154 N -2.59 2.10 0.05 0.95 0.11 -1.26 -0.23 120.40 119.52 1hai s VAL 154 Ca -0.08 -2.21 -0.35 0.00 -2.93 0.00 0.00 61.98 56.40 1hai s VAL 154 Cb 0.08 -2.52 -0.14 0.00 -1.53 0.00 0.00 36.38 32.26 1hai s VAL 154 CO 0.81 -0.27 1.60 -0.11 -3.33 0.00 0.00 175.10 173.80 1hai n LEU 155 N -0.70 2.77 -4.88 2.54 7.94 -0.47 -4.82 117.00 119.38 1hai n LEU 155 Ca -0.05 1.07 -0.28 0.00 -1.11 0.00 0.00 56.01 55.64 1hai n LEU 155 Cb 0.63 -1.34 -0.04 0.00 0.53 0.00 0.00 43.42 43.20 1hai n LEU 155 CO 0.41 -0.43 -0.16 -1.10 -1.11 0.00 0.00 177.39 175.01 1hai s GLN 156 N 1.68 3.24 0.01 1.96 -1.52 -0.81 0.14 119.66 124.37 1hai s GLN 156 Ca 0.85 -0.64 0.01 0.00 -1.95 0.00 0.00 55.36 53.63 1hai s GLN 156 Cb -0.78 -2.88 -0.01 0.00 -0.22 0.00 0.00 33.01 29.12 1hai s GLN 156 CO 0.45 0.54 -0.05 0.54 -0.25 0.00 0.00 175.29 176.52 1hai s VAL 157 N -1.64 0.35 -0.07 1.09 0.11 0.41 -2.23 120.40 118.41 1hai s VAL 157 Ca 0.33 -0.53 -0.08 0.00 -2.93 0.00 0.00 61.98 58.78 1hai s VAL 157 Cb -0.11 -0.37 0.02 0.00 -1.53 0.00 0.00 36.38 34.39 1hai s VAL 157 CO 0.26 -0.12 0.21 0.54 -3.33 0.00 0.00 175.10 172.66 1hai s VAL 158 N -0.64 0.01 -0.24 2.04 0.11 -0.21 -1.31 120.40 120.16 1hai s VAL 158 Ca -0.04 -0.07 -0.09 0.00 -2.93 0.00 0.00 61.98 58.85 1hai s VAL 158 Cb -0.05 -0.32 -0.04 0.00 -1.53 0.00 0.00 36.38 34.44 1hai s VAL 158 CO -0.00 -0.04 0.12 0.20 -3.33 0.00 0.00 175.10 172.04 1hai s ASN 159 N -0.06 5.62 0.10 3.54 0.01 -1.26 -0.90 114.94 121.99 1hai s ASN 159 Ca -0.02 -0.05 0.06 0.00 -0.71 0.00 0.00 52.86 52.14 1hai s ASN 159 Cb -0.02 -2.01 -0.03 0.00 0.41 0.00 0.00 41.25 39.59 1hai s ASN 159 CO 0.01 0.02 -0.14 -0.76 -1.51 0.00 0.00 177.10 174.71 1hai s LEU 160 N 1.33 2.35 0.26 0.60 1.43 0.43 -4.93 118.68 120.15 1hai s LEU 160 Ca 0.06 -0.73 -0.16 0.00 -1.03 0.00 0.00 54.13 52.26 1hai s LEU 160 Cb -0.15 -0.55 -0.08 0.00 0.03 0.00 0.00 46.19 45.44 1hai s LEU 160 CO 0.05 -0.11 0.70 -2.16 0.23 0.00 0.00 176.35 175.06 1hai s PRO 161 N -2.30 4.08 0.29 1.29 0.04 -1.26 -0.78 135.00 136.37 1hai s PRO 161 Ca 0.05 0.70 -0.29 0.00 0.04 0.00 0.00 61.00 61.50 1hai s PRO 161 Cb -0.07 -2.67 -0.10 0.00 0.04 0.00 0.00 34.50 31.70 1hai s PRO 161 CO 0.03 0.29 1.16 0.42 0.04 0.00 0.00 177.00 178.93 1hai s ILE 162 N -1.74 3.28 0.05 0.56 1.01 0.20 -1.57 121.20 122.99 1hai s ILE 162 Ca 0.48 1.29 0.07 0.00 0.00 0.00 0.00 60.65 62.49 1hai s ILE 162 Cb -0.13 -3.82 -0.03 0.00 0.01 0.00 0.00 42.46 38.48 1hai s ILE 162 CO 0.19 0.31 -0.18 0.54 0.00 0.00 0.00 174.94 175.79 1hai s VAL 163 N -1.13 2.76 -0.02 2.92 0.11 -1.00 0.23 120.40 124.27 1hai s VAL 163 Ca 0.46 -1.24 -0.38 0.00 -2.93 0.00 0.00 61.98 57.90 1hai s VAL 163 Cb -0.34 -2.17 -0.16 0.00 -1.53 0.00 0.00 36.38 32.18 1hai s VAL 163 CO 0.44 0.31 1.47 -0.62 -3.33 0.00 0.00 175.10 173.37 1hai n GLU 164 N 1.47 1.20 -0.32 1.54 4.71 -1.26 -4.54 120.64 123.45 1hai n GLU 164 Ca -0.16 0.44 0.17 0.00 -0.01 0.00 0.00 57.16 57.59 1hai n GLU 164 Cb 0.52 -2.10 0.34 0.00 -1.01 0.00 0.00 31.44 29.19 1hai n GLU 164 CO 0.00 0.00 0.00 -0.09 0.09 0.00 0.00 177.13 177.13 1hai h ARG 165 N 5.45 0.12 -0.27 3.49 2.43 -1.98 -1.40 114.38 122.22 1hai h ARG 165 Ca -0.47 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 58.67 1hai h ARG 165 Cb 1.33 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.84 1hai h ARG 165 CO 0.84 0.08 0.11 -1.35 -1.51 0.00 0.00 179.97 178.13 1hai h PRO 166 N 0.12 0.40 -0.17 0.20 0.11 -2.00 -0.27 132.00 130.40 1hai h PRO 166 Ca 0.62 -0.07 -0.03 0.00 0.11 0.00 0.00 66.00 66.62 1hai h PRO 166 Cb 1.33 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.37 1hai h PRO 166 CO -0.75 0.43 -0.02 0.28 -0.21 0.00 0.00 178.00 177.73 1hai h VAL 167 N 0.28 1.13 0.64 3.15 2.07 -1.66 -2.45 116.25 119.41 1hai h VAL 167 Ca 0.09 -0.51 -0.03 0.00 0.82 0.00 0.00 66.70 67.07 1hai h VAL 167 Cb 0.18 1.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.98 1hai h VAL 167 CO -0.01 0.17 -0.33 0.00 0.02 0.00 0.00 177.57 177.42 1hai h LYS 169 N -0.89 0.20 0.00 0.00 1.57 -0.86 -2.79 116.57 113.81 1hai h LYS 169 Ca -0.09 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.68 1hai h LYS 169 Cb 0.69 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.96 1hai h LYS 169 CO 0.13 0.13 0.00 -0.25 -0.57 0.00 0.00 179.45 178.90 1hai n ASP 170 N -5.16 0.00 0.03 0.86 9.92 -0.95 -3.11 116.55 118.14 1hai n ASP 170 Ca 0.07 0.22 0.12 0.00 -0.53 0.00 0.00 54.79 54.67 1hai n ASP 170 Cb 0.29 -0.39 0.24 0.00 -0.64 0.00 0.00 41.12 40.62 1hai n ASP 170 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 1hai n SER 171 N -1.39 0.57 -4.13 -2.24 3.41 -1.05 -4.98 113.62 103.81 1hai n SER 171 Ca 0.08 0.02 -0.11 0.00 -0.26 0.00 0.00 58.87 58.60 1hai n SER 171 Cb 0.21 0.13 -0.08 0.00 -0.26 0.00 0.00 64.21 64.20 1hai n SER 171 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1hai s THR 172 N -3.09 0.00 -1.47 6.66 -1.32 -1.18 -4.91 115.64 110.33 1hai s THR 172 Ca 0.09 -1.80 0.22 0.00 -1.21 0.00 0.00 61.69 58.98 1hai s THR 172 Cb 0.15 -2.40 -0.13 0.00 -1.51 0.00 0.00 72.50 68.61 1hai s THR 172 CO 0.70 0.00 0.98 0.54 -2.21 0.00 0.00 174.62 174.63 1hai n ARG 173 N -0.31 0.57 -2.53 7.08 1.74 -1.26 -4.89 116.66 117.06 1hai n ARG 173 Ca 0.01 -0.45 -0.41 0.00 -0.77 0.00 0.00 57.85 56.22 1hai n ARG 173 Cb 0.65 -1.49 -0.04 0.00 -1.02 0.00 0.00 32.46 30.56 1hai n ARG 173 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1hai s ILE 174 N -2.75 3.92 -0.40 0.55 1.01 -1.26 -5.00 121.20 117.25 1hai s ILE 174 Ca 0.13 1.65 -0.28 0.00 0.00 0.00 0.00 60.65 62.14 1hai s ILE 174 Cb 0.17 -4.05 -0.02 0.00 0.01 0.00 0.00 42.46 38.57 1hai s ILE 174 CO 0.73 0.28 1.81 -0.60 0.00 0.00 0.00 174.94 177.16 1hai s ARG 175 N -0.32 3.14 0.21 2.79 3.52 -1.26 -5.02 118.95 122.02 1hai s ARG 175 Ca 0.49 1.22 -0.30 0.00 -0.13 0.00 0.00 55.73 57.01 1hai s ARG 175 Cb -0.29 -4.24 -0.08 0.00 -1.56 0.00 0.00 34.95 28.77 1hai s ARG 175 CO 0.34 -2.09 0.96 0.42 -0.81 0.00 0.00 175.30 174.13 1hai s ILE 176 N 7.49 4.10 0.48 4.11 -1.09 -1.26 -4.87 121.20 130.16 1hai s ILE 176 Ca 0.76 2.02 0.02 0.00 -2.23 0.00 0.00 60.65 61.23 1hai s ILE 176 Cb -0.20 -4.29 -0.03 0.00 -1.58 0.00 0.00 42.46 36.37 1hai s ILE 176 CO 0.30 0.44 0.02 0.42 -1.23 0.00 0.00 174.94 174.89 1hai s THR 177 N -0.90 1.26 -0.24 2.92 -4.23 -1.26 -5.01 115.64 108.17 1hai s THR 177 Ca 0.43 -2.00 0.28 0.00 -1.18 0.00 0.00 61.69 59.22 1hai s THR 177 Cb -0.26 -2.34 0.31 0.00 1.34 0.00 0.00 72.50 71.54 1hai s THR 177 CO 0.32 0.00 1.83 0.44 -0.54 0.00 0.00 174.62 176.67 1hai h ASP 178 N 1.49 0.00 -0.29 3.99 3.32 -2.03 -2.94 116.42 119.96 1hai h ASP 178 Ca -0.43 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.62 1hai h ASP 178 Cb 1.30 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.85 1hai h ASP 178 CO 0.74 0.00 0.00 0.59 -1.72 0.00 0.00 179.24 178.85 1hai n ASN 179 N -2.59 3.23 -4.10 6.45 3.02 -1.26 -4.87 115.26 115.14 1hai n ASN 179 Ca 0.01 -2.42 -0.10 0.00 -0.03 0.00 0.00 54.58 52.04 1hai n ASN 179 Cb 0.26 -0.56 -0.10 0.00 -0.61 0.00 0.00 39.78 38.76 1hai n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1hai s MET 180 N -1.84 0.63 0.09 3.52 -1.94 -1.11 -1.07 119.30 117.59 1hai s MET 180 Ca 0.27 -1.06 -0.02 0.00 -1.71 0.00 0.00 55.69 53.16 1hai s MET 180 Cb 0.20 -0.09 -0.03 0.00 2.01 0.00 0.00 34.83 36.91 1hai s MET 180 CO 0.08 -0.03 0.05 -0.59 -0.01 0.00 0.00 175.02 174.53 1hai s PHE 181 N -2.82 0.60 0.25 -0.03 -0.12 -0.90 -4.83 117.98 110.12 1hai s PHE 181 Ca 0.01 -1.06 0.09 0.00 -0.05 0.00 0.00 56.93 55.93 1hai s PHE 181 Cb -0.00 -0.36 -0.05 0.00 -0.63 0.00 0.00 43.02 41.98 1hai s PHE 181 CO -0.04 -0.48 -0.15 0.00 -0.05 0.00 0.00 175.22 174.50 1hai s ALA 183 N -2.80 -1.20 0.00 0.00 0.00 0.14 -2.38 121.76 115.52 1hai s ALA 183 Ca 0.26 1.14 0.00 0.00 0.00 0.00 0.00 51.96 53.36 1hai s ALA 183 Cb -0.02 -0.48 0.00 0.00 0.00 0.00 0.00 23.12 22.62 1hai s ALA 183 CO 0.11 -0.26 0.00 0.41 0.00 0.00 0.00 175.76 176.02 1hai n GLY 184 N 2.18 2.50 3.78 0.00 0.00 -0.61 -0.30 105.19 112.74 1hai n GLY 184 Ca -0.16 -1.24 -0.39 0.00 0.00 0.00 0.00 46.02 44.23 1hai n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1hai s TYR 184 N -2.00 3.87 0.50 1.61 2.02 -1.26 -4.47 117.35 117.62 1hai s TYR 184 Ca 0.00 1.60 -0.19 0.00 -0.37 0.00 0.00 57.07 58.11 1hai s TYR 184 Cb 0.00 -2.74 -0.08 0.00 -0.40 0.00 0.00 41.96 38.74 1hai s TYR 184 CO 0.00 0.49 1.01 0.15 -1.57 0.00 0.00 175.55 175.63 1hai s LYS 185 N -1.26 3.85 0.38 -0.62 -0.14 -1.26 -4.81 119.74 115.88 1hai s LYS 185 Ca 0.36 1.18 0.10 0.00 -1.36 0.00 0.00 55.97 56.25 1hai s LYS 185 Cb -0.22 -2.11 0.87 0.00 -1.68 0.00 0.00 37.83 34.69 1hai s LYS 185 CO 0.25 -0.37 1.93 -1.35 -0.76 0.00 0.00 175.35 175.05 1hai h PRO 186 N 1.28 0.60 -0.68 -1.68 0.11 -1.96 0.55 132.00 130.21 1hai h PRO 186 Ca -0.48 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 65.52 1hai h PRO 186 Cb 1.20 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 32.15 1hai h PRO 186 CO 0.60 0.39 0.16 0.38 -0.21 0.00 0.00 178.00 179.32 1hai h ASP 186 N 0.61 1.03 0.00 -2.05 2.03 -1.99 -3.16 116.42 112.90 1hai h ASP 186 Ca 0.36 -0.24 0.00 0.00 -0.73 0.00 0.00 57.03 56.43 1hai h ASP 186 Cb 0.57 -0.27 0.00 0.00 -0.83 0.00 0.00 39.33 38.80 1hai h ASP 186 CO -0.13 1.00 0.37 -0.08 -1.03 0.00 0.00 179.24 179.36 1hai h GLU 186 N 1.02 0.00 -6.44 4.15 4.81 -1.26 -3.44 114.58 113.42 1hai h GLU 186 Ca 0.21 0.00 -0.36 0.00 -0.13 0.00 0.00 59.36 59.08 1hai h GLU 186 Cb 0.38 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.77 1hai h GLU 186 CO 0.00 0.00 -1.10 0.41 -0.73 0.00 0.00 179.01 177.60 1hai n GLY 186 N -1.26 -0.28 0.00 1.92 0.00 -1.20 -4.99 105.19 99.37 1hai n GLY 186 Ca -0.01 1.06 0.00 0.00 0.00 0.00 0.00 46.02 47.06 1hai n GLY 186 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1hai n LYS 186 N -0.69 0.00 -1.41 1.61 4.81 -1.26 -5.17 118.16 116.05 1hai n LYS 186 Ca -0.11 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.33 1hai n LYS 186 Cb 0.66 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.71 1hai n LYS 186 CO 0.00 0.00 0.00 2.89 1.17 0.00 0.00 177.40 181.46 1hai n ARG 187 N 0.00 2.47 0.00 1.64 1.85 -1.26 -4.53 116.66 116.83 1hai n ARG 187 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 1hai n ARG 187 Cb 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.41 1hai n ARG 187 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1hai n GLY 188 N 5.00 3.94 3.75 2.89 0.00 -1.25 -4.94 105.19 114.58 1hai n GLY 188 Ca 0.00 -1.48 -0.03 0.00 0.00 0.00 0.00 46.02 44.51 1hai n GLY 188 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1hai s ASP 189 N 0.00 -0.17 0.94 1.61 2.15 -0.79 -4.76 116.67 115.66 1hai s ASP 189 Ca 0.00 -0.40 -0.04 0.00 0.43 0.00 0.00 52.55 52.54 1hai s ASP 189 Cb 0.00 0.47 0.06 0.00 -0.30 0.00 0.00 42.92 43.15 1hai s ASP 189 CO 0.00 -0.87 0.34 0.00 -0.17 0.00 0.00 175.17 174.46 1hai n ALA 190 N -0.48 -0.35 -3.44 3.66 0.00 -1.26 -0.91 120.51 117.73 1hai n ALA 190 Ca -0.06 -0.45 0.05 0.00 0.00 0.00 0.00 53.44 52.97 1hai n ALA 190 Cb 0.61 -0.01 0.01 0.00 0.00 0.00 0.00 19.45 20.06 1hai n ALA 190 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1hai s GLU 192 N -2.02 4.28 0.00 0.00 8.01 -1.26 -2.19 118.70 125.52 1hai s GLU 192 Ca 0.12 2.25 0.00 0.00 0.01 0.00 0.00 54.97 57.35 1hai s GLU 192 Cb -0.01 -3.02 0.00 0.00 -4.31 0.00 0.00 34.13 26.79 1hai s GLU 192 CO 0.02 -0.27 0.00 0.41 0.01 0.00 0.00 175.26 175.44 1hai n GLY 193 N 0.74 3.23 0.18 -1.39 0.00 -1.26 -1.63 105.19 105.06 1hai n GLY 193 Ca 0.01 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.15 1hai n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1hai h ASP 194 N 0.00 0.00 -3.35 1.61 3.32 -1.78 -3.35 116.42 112.88 1hai h ASP 194 Ca 0.00 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 56.48 1hai h ASP 194 Cb 0.00 0.00 0.17 0.00 0.22 0.00 0.00 39.33 39.72 1hai h ASP 194 CO 0.00 0.00 -0.07 -1.20 -1.72 0.00 0.00 179.24 176.25 1hai n SER 195 N -2.79 0.09 0.00 6.45 7.64 -1.26 -2.19 113.62 121.56 1hai n SER 195 Ca 0.04 0.78 0.00 0.00 1.01 0.00 0.00 58.87 60.70 1hai n SER 195 Cb 0.48 -1.31 0.00 0.00 -1.01 0.00 0.00 64.21 62.37 1hai n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1hai n GLY 196 N 1.47 2.32 3.83 0.23 0.00 -1.09 -0.95 105.19 111.00 1hai n GLY 196 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 1hai n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1hai s GLY 197 N -2.12 1.62 0.14 -0.02 0.00 -0.93 -2.87 107.32 103.14 1hai s GLY 197 Ca 0.00 -0.31 -0.15 0.00 0.00 0.00 0.00 44.72 44.26 1hai s GLY 197 CO 0.00 0.12 0.55 2.56 0.00 0.00 0.00 173.10 176.32 1hai s PRO 198 N -5.26 4.00 -0.35 2.90 0.04 -1.26 -0.71 135.00 134.35 1hai s PRO 198 Ca 0.60 0.51 -0.11 0.00 0.04 0.00 0.00 61.00 62.04 1hai s PRO 198 Cb -0.13 -2.97 0.01 0.00 0.04 0.00 0.00 34.50 31.46 1hai s PRO 198 CO 0.53 0.50 0.20 0.12 0.04 0.00 0.00 177.00 178.39 1hai s PHE 199 N -1.42 3.22 0.23 0.56 2.19 0.37 -3.92 117.98 119.21 1hai s PHE 199 Ca 0.37 -0.76 0.12 0.00 0.33 0.00 0.00 56.93 56.98 1hai s PHE 199 Cb -0.15 -2.43 -0.05 0.00 -1.31 0.00 0.00 43.02 39.08 1hai s PHE 199 CO 0.19 -0.56 -0.22 0.14 1.83 0.00 0.00 175.22 176.60 1hai s VAL 200 N 1.59 2.45 0.07 3.12 -7.23 -0.20 -0.85 120.40 119.36 1hai s VAL 200 Ca 0.03 -2.16 0.04 0.00 -1.81 0.00 0.00 61.98 58.08 1hai s VAL 200 Cb -0.18 -2.22 -0.03 0.00 0.56 0.00 0.00 36.38 34.51 1hai s VAL 200 CO 0.07 -0.23 -0.10 -0.04 -0.31 0.00 0.00 175.10 174.49 1hai s MET 201 N -3.01 0.72 -0.27 4.82 -1.94 -0.42 -1.16 119.30 118.04 1hai s MET 201 Ca 0.25 -0.95 -0.12 0.00 -1.71 0.00 0.00 55.69 53.16 1hai s MET 201 Cb -0.07 -0.53 -0.05 0.00 2.01 0.00 0.00 34.83 36.20 1hai s MET 201 CO 0.12 0.10 0.23 0.21 -0.01 0.00 0.00 175.02 175.67 1hai s LYS 202 N -2.04 3.97 0.29 2.03 2.20 -1.26 -0.32 119.74 124.61 1hai s LYS 202 Ca -0.02 -0.23 -0.30 0.00 -0.36 0.00 0.00 55.97 55.06 1hai s LYS 202 Cb -0.08 -3.65 -0.11 0.00 -1.51 0.00 0.00 37.83 32.48 1hai s LYS 202 CO 0.01 -0.19 1.53 0.45 -0.36 0.00 0.00 175.35 176.79 1hai s SER 203 N 1.69 6.46 0.00 1.43 0.15 0.91 -4.91 113.70 119.43 1hai s SER 203 Ca 0.09 2.87 0.29 0.00 0.70 0.00 0.00 55.95 59.90 1hai s SER 203 Cb -0.16 -2.64 1.21 0.00 -1.71 0.00 0.00 66.02 62.73 1hai s SER 203 CO 0.10 -0.84 1.88 -0.81 1.20 0.00 0.00 173.24 174.78 1hai n PRO 204 N 2.01 0.25 -0.04 5.44 -0.04 -1.26 -0.35 135.00 141.01 1hai n PRO 204 Ca 0.07 -0.05 -0.22 0.00 -0.04 0.00 0.00 63.50 63.26 1hai n PRO 204 Cb 0.39 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.22 1hai n PRO 204 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 1hai h PHE 204 N 0.12 0.29 0.00 0.54 0.04 -1.96 -3.41 116.94 112.55 1hai h PHE 204 Ca 0.00 -0.21 0.00 0.00 2.80 0.00 0.00 57.97 60.56 1hai h PHE 204 Cb 0.42 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 38.56 1hai h PHE 204 CO 0.00 1.65 0.00 0.27 -0.60 0.00 0.00 178.31 179.63 1hai n ASN 204 N -3.91 1.37 0.00 2.17 2.04 -1.24 -5.04 115.26 110.65 1hai n ASN 204 Ca -0.31 -1.68 0.00 0.00 -0.44 0.00 0.00 54.58 52.15 1hai n ASN 204 Cb 0.89 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 38.14 1hai n ASN 204 CO 0.00 0.00 0.00 0.59 -0.44 0.00 0.00 177.26 177.41 1hai n ASN 205 N -0.34 -4.46 -4.90 0.53 4.13 0.53 -5.01 115.26 105.75 1hai n ASN 205 Ca 0.00 0.00 -0.28 0.00 1.68 0.00 0.00 54.58 55.98 1hai n ASN 205 Cb 0.32 -2.70 -0.02 0.00 -1.54 0.00 0.00 39.78 35.83 1hai n ASN 205 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 1hai s ARG 206 N -1.44 3.64 -0.07 3.52 0.52 -1.25 -4.79 118.95 119.08 1hai s ARG 206 Ca 0.00 0.12 -0.15 0.00 -0.52 0.00 0.00 55.73 55.18 1hai s ARG 206 Cb 0.00 -2.54 -0.05 0.00 0.52 0.00 0.00 34.95 32.88 1hai s ARG 206 CO 0.00 0.07 0.39 -1.58 0.02 0.00 0.00 175.30 174.20 1hai s TRP 207 N -2.29 3.61 0.02 -0.53 0.52 -1.26 -0.06 118.94 118.95 1hai s TRP 207 Ca 0.46 0.87 0.08 0.00 0.02 0.00 0.00 56.10 57.53 1hai s TRP 207 Cb -0.10 -2.35 -0.02 0.00 -1.15 0.00 0.00 33.47 29.84 1hai s TRP 207 CO 0.33 0.45 -0.24 0.71 0.02 0.00 0.00 176.95 178.22 1hai s TYR 208 N -0.33 2.12 -0.43 -1.98 2.02 0.56 -2.18 117.35 117.13 1hai s TYR 208 Ca 0.22 -0.40 -0.25 0.00 -0.37 0.00 0.00 57.07 56.27 1hai s TYR 208 Cb -0.15 -1.31 0.02 0.00 -0.40 0.00 0.00 41.96 40.12 1hai s TYR 208 CO 0.10 0.06 0.91 -1.14 -1.57 0.00 0.00 175.55 173.90 1hai s GLN 209 N -0.96 3.61 -0.05 -0.62 0.74 0.75 -1.30 119.66 121.84 1hai s GLN 209 Ca 0.10 0.25 0.16 0.00 0.05 0.00 0.00 55.36 55.92 1hai s GLN 209 Cb -0.09 -3.89 -0.21 0.00 1.10 0.00 0.00 33.01 29.92 1hai s GLN 209 CO 0.01 -1.13 0.57 -1.33 -0.55 0.00 0.00 175.29 172.86 1hai n MET 210 N 7.00 0.64 -4.10 1.67 2.81 -0.03 -4.41 117.12 120.70 1hai n MET 210 Ca 0.06 0.18 -0.10 0.00 -1.81 0.00 0.00 57.70 56.03 1hai n MET 210 Cb 0.48 -1.72 -0.09 0.00 -0.71 0.00 0.00 33.22 31.18 1hai n MET 210 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1hai s GLY 211 N -5.07 0.95 -0.09 3.03 0.00 -1.02 -1.55 107.32 103.57 1hai s GLY 211 Ca -0.05 -1.34 0.03 0.00 0.00 0.00 0.00 44.72 43.36 1hai s GLY 211 CO 0.83 -1.18 -0.17 -0.42 0.00 0.00 0.00 173.10 172.16 1hai s ILE 212 N -4.06 1.52 0.08 0.90 1.01 -0.80 -0.48 121.20 119.38 1hai s ILE 212 Ca 0.26 -0.70 -0.31 0.00 0.00 0.00 0.00 60.65 59.91 1hai s ILE 212 Cb 0.06 -1.36 -0.10 0.00 0.01 0.00 0.00 42.46 41.07 1hai s ILE 212 CO 0.05 0.44 1.91 0.55 0.00 0.00 0.00 174.94 177.89 1hai n VAL 213 N 3.79 0.58 0.02 2.92 3.14 0.12 -0.12 118.33 128.77 1hai n VAL 213 Ca -0.21 -0.10 -0.00 0.00 -2.96 0.00 0.00 64.34 61.07 1hai n VAL 213 Cb 0.52 -2.22 -0.00 0.00 -1.06 0.00 0.00 33.84 31.08 1hai n VAL 213 CO 0.00 0.00 0.00 -0.24 -6.46 0.00 0.00 176.83 170.13 1hai n SER 214 N 6.62 0.54 -3.78 6.55 2.88 -0.46 -2.67 113.62 123.29 1hai n SER 214 Ca 0.19 0.07 -0.09 0.00 -1.33 0.00 0.00 58.87 57.71 1hai n SER 214 Cb 0.39 -0.19 -0.04 0.00 -0.75 0.00 0.00 64.21 63.63 1hai n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1hai s TRP 215 N -1.48 0.32 0.03 0.66 1.48 -0.98 -4.92 118.94 114.03 1hai s TRP 215 Ca -0.01 -0.71 -0.14 0.00 -1.06 0.00 0.00 56.10 54.18 1hai s TRP 215 Cb 0.00 0.32 0.05 0.00 -1.16 0.00 0.00 33.47 32.68 1hai s TRP 215 CO 0.01 -1.11 0.66 0.41 -4.06 0.00 0.00 176.95 172.86 1hai n GLY 216 N -0.43 0.57 2.75 3.67 0.00 -1.26 -1.35 105.19 109.14 1hai n GLY 216 Ca -0.02 -0.98 -0.30 0.00 0.00 0.00 0.00 46.02 44.71 1hai n GLY 216 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1hai s GLU 217 N -2.01 0.84 1.18 1.61 2.02 -1.26 -5.01 118.70 116.06 1hai s GLU 217 Ca 0.15 -1.25 0.00 0.00 0.02 0.00 0.00 54.97 53.89 1hai s GLU 217 Cb -0.01 -2.11 0.00 0.00 0.10 0.00 0.00 34.13 32.11 1hai s GLU 217 CO 0.01 -1.01 0.00 0.41 0.02 0.00 0.00 175.26 174.69 1hai n GLY 219 N 4.63 -1.96 2.95 -1.39 0.00 -1.26 -4.79 105.19 103.36 1hai n GLY 219 Ca -0.00 -1.39 -0.15 0.00 0.00 0.00 0.00 46.02 44.48 1hai n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hai n ASP 221 N 2.90 -4.80 -4.75 0.00 2.03 -1.26 -4.62 116.55 106.04 1hai n ASP 221 Ca -0.13 0.28 -0.40 0.00 0.52 0.00 0.00 54.79 55.06 1hai n ASP 221 Cb 0.58 -4.20 -0.05 0.00 -0.72 0.00 0.00 41.12 36.74 1hai n ASP 221 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1hai s ARG 221 N -4.12 4.75 0.38 -0.67 0.52 -1.26 -4.91 118.95 113.64 1hai s ARG 221 Ca 0.00 1.63 -0.27 0.00 -0.52 0.00 0.00 55.73 56.57 1hai s ARG 221 Cb 0.00 -3.25 -0.10 0.00 0.52 0.00 0.00 34.95 32.13 1hai s ARG 221 CO 0.00 0.36 1.35 -0.51 0.02 0.00 0.00 175.30 176.51 1hai s ASP 222 N -0.95 6.44 0.00 0.23 1.11 -1.26 -1.66 116.67 120.58 1hai s ASP 222 Ca 0.43 2.76 0.00 0.00 0.18 0.00 0.00 52.55 55.92 1hai s ASP 222 Cb -0.29 -2.65 0.00 0.00 1.07 0.00 0.00 42.92 41.06 1hai s ASP 222 CO 0.36 -0.77 0.00 0.61 1.18 0.00 0.00 175.17 176.54 1hai n GLY 223 N 0.67 1.68 3.69 0.21 0.00 -1.26 -5.00 105.19 105.17 1hai n GLY 223 Ca 0.02 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.81 1hai n GLY 223 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hai s LYS 224 N -0.07 2.32 0.10 1.61 1.02 -0.66 -4.76 119.74 119.29 1hai s LYS 224 Ca 0.00 -1.53 -0.03 0.00 0.02 0.00 0.00 55.97 54.43 1hai s LYS 224 Cb 0.00 -2.14 -0.03 0.00 -0.52 0.00 0.00 37.83 35.14 1hai s LYS 224 CO 0.00 0.20 0.07 0.71 -0.92 0.00 0.00 175.35 175.40 1hai s TYR 225 N -2.40 0.57 0.18 3.18 2.02 -1.26 -4.77 117.35 114.86 1hai s TYR 225 Ca 0.35 -1.02 -0.08 0.00 -0.37 0.00 0.00 57.07 55.95 1hai s TYR 225 Cb -0.03 -0.33 -0.06 0.00 -0.40 0.00 0.00 41.96 41.13 1hai s TYR 225 CO 0.21 -0.49 0.47 0.20 -1.57 0.00 0.00 175.55 174.37 1hai s GLY 226 N -2.96 2.28 -0.05 0.71 0.00 0.59 -4.68 107.32 103.20 1hai s GLY 226 Ca 0.14 -0.39 0.01 0.00 0.00 0.00 0.00 44.72 44.48 1hai s GLY 226 CO -0.05 -0.25 -0.04 -1.36 0.00 0.00 0.00 173.10 171.40 1hai s PHE 227 N -1.70 3.00 0.03 1.90 0.40 -0.46 0.25 117.98 121.41 1hai s PHE 227 Ca 0.43 0.06 0.04 0.00 -0.60 0.00 0.00 56.93 56.86 1hai s PHE 227 Cb -0.12 -1.71 -0.02 0.00 0.51 0.00 0.00 43.02 41.68 1hai s PHE 227 CO 0.22 0.39 -0.11 0.71 0.70 0.00 0.00 175.22 177.13 1hai s TYR 228 N -0.89 0.94 0.08 0.36 1.51 -0.01 -1.36 117.35 117.99 1hai s TYR 228 Ca 0.14 -0.35 -0.31 0.00 -1.01 0.00 0.00 57.07 55.54 1hai s TYR 228 Cb -0.11 -0.56 -0.07 0.00 -0.11 0.00 0.00 41.96 41.10 1hai s TYR 228 CO 0.04 -0.00 1.36 0.99 -1.11 0.00 0.00 175.55 176.83 1hai s THR 229 N -0.88 3.49 -0.84 -0.71 2.01 0.83 -2.11 115.64 117.42 1hai s THR 229 Ca -0.02 1.04 -0.25 0.00 0.31 0.00 0.00 61.69 62.77 1hai s THR 229 Cb -0.07 -3.67 0.04 0.00 0.01 0.00 0.00 72.50 68.80 1hai s THR 229 CO 0.01 0.06 1.35 -2.28 -0.69 0.00 0.00 174.62 173.07 1hai s HIS 230 N 1.35 2.37 0.17 4.92 2.46 -0.23 -1.90 115.29 124.43 1hai s HIS 230 Ca 0.64 -0.34 -0.14 0.00 0.47 0.00 0.00 55.06 55.68 1hai s HIS 230 Cb -0.35 -4.65 0.08 0.00 -0.13 0.00 0.00 32.58 27.53 1hai s HIS 230 CO 0.29 -2.03 1.82 0.28 -2.47 0.00 0.00 174.74 172.63 1hai h VAL 231 N 6.32 1.07 -1.00 0.89 2.07 -1.60 -2.79 116.25 121.20 1hai h VAL 231 Ca -0.10 -0.21 0.02 0.00 0.82 0.00 0.00 66.70 67.23 1hai h VAL 231 Cb 1.04 0.41 -0.05 0.00 -1.52 0.00 0.00 31.29 31.17 1hai h VAL 231 CO 1.34 0.11 0.66 0.15 0.02 0.00 0.00 177.57 179.85 1hai h PHE 232 N 0.60 1.26 -0.23 1.57 3.57 -1.87 -1.27 116.94 120.57 1hai h PHE 232 Ca 0.19 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.72 1hai h PHE 232 Cb -0.00 -0.42 -0.01 0.00 2.79 0.00 0.00 35.95 38.30 1hai h PHE 232 CO -0.06 0.77 0.14 0.00 -2.23 0.00 0.00 178.31 176.93 1hai h ARG 233 N 1.34 0.30 -0.68 1.11 3.08 -1.88 -1.68 114.38 115.98 1hai h ARG 233 Ca 0.38 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.41 1hai h ARG 233 Cb -0.12 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 29.87 1hai h ARG 233 CO -0.09 0.22 0.00 1.28 -1.07 0.00 0.00 179.97 180.31 1hai n LEU 234 N -4.49 4.40 -0.08 3.04 4.77 -0.53 -4.59 117.00 119.52 1hai n LEU 234 Ca 0.00 -2.21 0.02 0.00 -0.03 0.00 0.00 56.01 53.79 1hai n LEU 234 Cb 0.09 -0.54 0.33 0.00 -2.33 0.00 0.00 43.42 40.96 1hai n LEU 234 CO 0.35 0.85 1.14 0.50 -1.33 0.00 0.00 177.39 178.90 1hai h LYS 235 N 4.09 0.71 -0.61 3.23 3.64 -0.75 -1.88 116.57 125.01 1hai h LYS 235 Ca 0.00 -0.06 -0.09 0.00 -1.27 0.00 0.00 60.65 59.22 1hai h LYS 235 Cb 1.27 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 32.92 1hai h LYS 235 CO 0.15 0.51 0.01 -0.22 -2.27 0.00 0.00 179.45 177.64 1hai h LYS 236 N 0.72 1.06 0.07 1.90 3.11 -1.81 0.14 116.57 121.76 1hai h LYS 236 Ca 0.19 -0.33 -0.00 0.00 -2.81 0.00 0.00 60.65 57.70 1hai h LYS 236 Cb 0.00 -0.10 0.00 0.00 -1.00 0.00 0.00 32.23 31.13 1hai h LYS 236 CO -0.03 1.02 -0.04 2.35 -2.81 0.00 0.00 179.45 179.95 1hai h TRP 237 N 0.97 -0.09 -0.44 1.91 7.01 -1.78 -0.39 115.95 123.14 1hai h TRP 237 Ca 0.17 -0.00 0.09 0.00 2.11 0.00 0.00 58.89 61.26 1hai h TRP 237 Cb 0.54 0.03 -0.09 0.00 -2.10 0.00 0.00 29.16 27.54 1hai h TRP 237 CO 0.04 0.12 -0.21 0.82 -2.79 0.00 0.00 178.44 176.42 1hai h ILE 238 N -0.30 0.38 -0.61 2.65 2.04 -0.99 -1.27 117.51 119.41 1hai h ILE 238 Ca -0.01 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.89 1hai h ILE 238 Cb 0.26 0.38 -0.04 0.00 -0.74 0.00 0.00 36.82 36.68 1hai h ILE 238 CO 0.02 0.00 0.36 1.56 0.00 0.00 0.00 178.15 180.09 1hai h GLN 239 N -0.12 0.68 -0.08 2.37 4.20 -0.52 -2.62 115.11 119.00 1hai h GLN 239 Ca 0.21 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.88 1hai h GLN 239 Cb 0.45 -0.15 -0.00 0.00 0.30 0.00 0.00 27.48 28.07 1hai h GLN 239 CO -0.51 0.45 0.05 -0.22 -0.67 0.00 0.00 178.83 177.92 1hai h LYS 240 N 0.70 0.11 -0.37 1.46 3.64 -0.51 -0.42 116.57 121.18 1hai h LYS 240 Ca 0.25 -0.01 -0.11 0.00 -1.27 0.00 0.00 60.65 59.51 1hai h LYS 240 Cb 0.07 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.85 1hai h LYS 240 CO -0.13 0.12 -0.24 -0.39 -2.27 0.00 0.00 179.45 176.54 1hai h VAL 241 N 0.08 1.27 -0.23 2.00 -1.51 -1.08 -2.22 116.25 114.56 1hai h VAL 241 Ca 0.03 -1.35 -0.08 0.00 -1.23 0.00 0.00 66.70 64.07 1hai h VAL 241 Cb 0.03 1.25 -0.01 0.00 -2.13 0.00 0.00 31.29 30.43 1hai h VAL 241 CO -0.01 0.45 -0.20 0.40 -1.23 0.00 0.00 177.57 176.98 1hai h ILE 242 N 0.64 1.24 0.00 7.19 2.04 -1.30 -2.22 117.51 125.11 1hai h ILE 242 Ca 0.09 -1.12 0.00 0.00 1.00 0.00 0.00 64.86 64.83 1hai h ILE 242 Cb 0.74 1.29 0.00 0.00 -0.74 0.00 0.00 36.82 38.11 1hai h ILE 242 CO 0.06 0.36 -0.23 -0.90 0.00 0.00 0.00 178.15 177.43 1hai n ASP 243 N -4.17 0.65 -0.08 1.72 5.68 -0.18 -2.09 116.55 118.07 1hai n ASP 243 Ca -0.00 0.36 -0.13 0.00 -0.50 0.00 0.00 54.79 54.52 1hai n ASP 243 Cb 0.36 -0.38 -0.08 0.00 -1.14 0.00 0.00 41.12 39.88 1hai n ASP 243 CO 0.00 0.00 0.00 1.56 -1.33 0.00 0.00 177.20 177.43 1hai h GLN 244 N 0.00 0.00 0.00 0.11 4.20 -1.05 -3.39 115.11 114.98 1hai h GLN 244 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1hai h GLN 244 Cb 0.69 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.47 1hai h GLN 244 CO 0.00 0.61 0.00 1.19 -0.67 0.00 0.00 178.83 179.96 1hai n PHE 245 N -4.55 0.00 -2.11 2.96 3.72 -0.87 -4.99 117.46 111.62 1hai n PHE 245 Ca -0.18 0.00 -0.00 0.00 -0.05 0.00 0.00 57.45 57.22 1hai n PHE 245 Cb 0.45 0.00 -0.00 0.00 -0.94 0.00 0.00 39.48 38.99 1hai n PHE 245 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1hai n GLY 246 N 0.62 -0.39 0.00 1.37 0.00 -0.89 -5.02 105.19 100.88 1hai n GLY 246 Ca 0.12 0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1hai n GLY 246 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48