#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 8kme s VAL 17 N 0.00 2.16 -1.06 1.39 1.01 -0.45 -4.26 120.40 119.19 8kme s VAL 17 Ca 0.00 -0.91 -0.07 0.00 0.00 0.00 0.00 61.98 61.00 8kme s VAL 17 Cb 0.00 -1.91 0.01 0.00 0.00 0.00 0.00 36.38 34.48 8kme s VAL 17 CO 0.00 0.53 0.93 -0.62 0.00 0.00 0.00 175.10 175.94 8kme n GLU 18 N 4.57 -6.26 0.00 2.72 -0.58 -1.26 -2.81 120.64 117.01 8kme n GLU 18 Ca -0.21 0.65 0.00 0.00 -0.42 0.00 0.00 57.16 57.18 8kme n GLU 18 Cb 0.50 -5.15 0.00 0.00 -0.57 0.00 0.00 31.44 26.22 8kme n GLU 18 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 8kme n GLY 19 N -1.68 1.63 3.81 0.62 0.00 -1.26 -4.60 105.19 103.71 8kme n GLY 19 Ca 0.01 -1.75 -0.07 0.00 0.00 0.00 0.00 46.02 44.20 8kme n GLY 19 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 8kme s SER 20 N -1.00 -0.29 0.23 1.61 0.01 0.05 -4.92 113.70 109.39 8kme s SER 20 Ca 0.00 -0.53 -0.16 0.00 1.31 0.00 0.00 55.95 56.56 8kme s SER 20 Cb 0.00 0.71 -0.08 0.00 0.21 0.00 0.00 66.02 66.86 8kme s SER 20 CO 0.00 -1.29 0.67 -1.81 0.41 0.00 0.00 173.24 171.22 8kme s ASP 21 N -2.90 6.90 0.35 2.44 1.01 -1.26 0.40 116.67 123.60 8kme s ASP 21 Ca 0.10 1.26 -0.26 0.00 0.71 0.00 0.00 52.55 54.36 8kme s ASP 21 Cb -0.05 -2.36 -0.09 0.00 1.01 0.00 0.00 42.92 41.42 8kme s ASP 21 CO 0.05 -0.02 1.03 0.00 0.21 0.00 0.00 175.17 176.44 8kme s ALA 22 N -1.65 3.20 0.59 5.23 0.00 0.23 -4.77 121.76 124.58 8kme s ALA 22 Ca 0.45 0.71 -0.14 0.00 0.00 0.00 0.00 51.96 52.97 8kme s ALA 22 Cb -0.14 -3.26 -0.04 0.00 0.00 0.00 0.00 23.12 19.67 8kme s ALA 22 CO 0.20 -0.10 1.03 -1.21 0.00 0.00 0.00 175.76 175.67 8kme s GLU 23 N -2.10 3.54 0.48 0.00 2.02 -1.26 -4.86 118.70 116.53 8kme s GLU 23 Ca 0.52 0.98 -0.24 0.00 0.02 0.00 0.00 54.97 56.26 8kme s GLU 23 Cb -0.24 -2.07 -0.07 0.00 0.10 0.00 0.00 34.13 31.85 8kme s GLU 23 CO 0.30 -0.62 1.33 -0.89 0.02 0.00 0.00 175.26 175.40 8kme n ILE 24 N -2.19 3.12 -0.99 -1.63 -0.00 -1.26 -1.96 119.36 114.44 8kme n ILE 24 Ca 0.07 -0.50 0.00 0.00 -0.00 0.00 0.00 62.75 62.32 8kme n ILE 24 Cb 0.54 -1.66 0.00 0.00 -0.00 0.00 0.00 39.64 38.52 8kme n ILE 24 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 8kme n GLY 25 N 0.75 0.04 0.25 7.39 0.00 -1.26 -4.90 105.19 107.47 8kme n GLY 25 Ca 0.08 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.11 8kme n GLY 25 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 8kme h MET 26 N 0.09 0.33 -2.00 1.61 -1.53 -1.76 -3.32 114.93 108.35 8kme h MET 26 Ca 0.00 -0.07 -0.53 0.00 -3.44 0.00 0.00 59.70 55.66 8kme h MET 26 Cb 0.90 -0.05 -0.41 0.00 -0.55 0.00 0.00 31.60 31.49 8kme h MET 26 CO 0.00 0.44 -0.93 0.43 0.14 0.00 0.00 176.91 176.99 8kme n SER 27 N -4.28 2.74 0.06 1.39 7.64 -1.26 -4.95 113.62 114.96 8kme n SER 27 Ca 0.00 -3.33 0.18 0.00 1.01 0.00 0.00 58.87 56.73 8kme n SER 27 Cb 0.26 -0.57 0.44 0.00 -1.01 0.00 0.00 64.21 63.32 8kme n SER 27 CO 0.00 0.00 0.00 -0.65 -3.01 0.00 0.00 175.04 171.38 8kme h PRO 28 N 2.96 0.00 -0.02 1.43 0.10 -1.76 0.18 132.00 134.89 8kme h PRO 28 Ca 0.11 0.00 0.00 0.00 0.10 0.00 0.00 66.00 66.21 8kme h PRO 28 Cb 0.79 0.00 0.00 0.00 0.10 0.00 0.00 31.00 31.89 8kme h PRO 28 CO 0.66 0.00 -0.33 -2.67 0.10 0.00 0.00 178.00 175.77 8kme n TRP 29 N -3.09 0.00 -2.03 0.65 2.14 -1.04 -0.78 117.44 113.29 8kme n TRP 29 Ca 0.11 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 59.26 8kme n TRP 29 Cb 1.06 -0.00 -0.03 0.00 -0.81 0.00 0.00 31.31 31.53 8kme n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 8kme s GLN 30 N -2.33 4.22 0.19 -2.67 2.00 0.05 -0.30 119.66 120.82 8kme s GLN 30 Ca 0.22 2.19 0.09 0.00 -2.00 0.00 0.00 55.36 55.85 8kme s GLN 30 Cb 0.19 -3.70 -0.04 0.00 0.80 0.00 0.00 33.01 30.26 8kme s GLN 30 CO 0.49 -0.72 -0.07 0.08 -0.50 0.00 0.00 175.29 174.57 8kme s VAL 31 N 2.96 3.32 -0.20 1.34 1.01 -0.93 -4.21 120.40 123.69 8kme s VAL 31 Ca 0.71 -1.66 0.01 0.00 0.00 0.00 0.00 61.98 61.05 8kme s VAL 31 Cb -0.36 -2.67 0.03 0.00 0.00 0.00 0.00 36.38 33.38 8kme s VAL 31 CO 0.30 -0.15 -0.17 -0.32 0.00 0.00 0.00 175.10 174.75 8kme s MET 32 N -2.97 2.80 -0.15 2.72 1.75 -0.89 -2.36 119.30 120.20 8kme s MET 32 Ca 0.26 -0.96 -0.21 0.00 -1.25 0.00 0.00 55.69 53.53 8kme s MET 32 Cb -0.08 -2.66 -0.03 0.00 2.84 0.00 0.00 34.83 34.89 8kme s MET 32 CO 0.16 -0.30 0.63 -1.17 -0.65 0.00 0.00 175.02 173.69 8kme s LEU 33 N 1.25 4.21 -0.01 4.11 0.20 0.15 -0.90 118.68 127.68 8kme s LEU 33 Ca 0.01 0.92 0.01 0.00 0.69 0.00 0.00 54.13 55.77 8kme s LEU 33 Cb -0.15 -2.91 0.01 0.00 -0.43 0.00 0.00 46.19 42.71 8kme s LEU 33 CO -0.11 -0.19 -0.01 0.12 -0.29 0.00 0.00 176.35 175.86 8kme s PHE 34 N 1.44 0.27 0.00 5.38 5.36 -0.79 -0.70 117.98 128.95 8kme s PHE 34 Ca 0.31 -0.02 -0.15 0.00 -0.96 0.00 0.00 56.93 56.10 8kme s PHE 34 Cb -0.16 -0.27 -0.06 0.00 -0.34 0.00 0.00 43.02 42.20 8kme s PHE 34 CO 0.12 -0.06 0.42 -0.98 -1.46 0.00 0.00 175.22 173.27 8kme s ARG 35 N 0.43 3.95 0.19 10.12 1.70 0.06 -0.46 118.95 134.95 8kme s ARG 35 Ca -0.04 0.44 -0.11 0.00 -0.47 0.00 0.00 55.73 55.55 8kme s ARG 35 Cb -0.07 -3.23 0.12 0.00 -0.57 0.00 0.00 34.95 31.21 8kme s ARG 35 CO -0.01 0.68 1.84 0.87 -1.08 0.00 0.00 175.30 177.60 8kme h LYS 36 N 4.73 0.92 -2.13 3.89 1.57 -1.64 -3.25 116.57 120.66 8kme h LYS 36 Ca -0.51 -0.08 -0.07 0.00 -1.87 0.00 0.00 60.65 58.12 8kme h LYS 36 Cb 1.22 -0.20 -0.26 0.00 0.08 0.00 0.00 32.23 33.07 8kme h LYS 36 CO 0.62 0.65 -0.35 0.45 -0.57 0.00 0.00 179.45 180.24 8kme s SER 36 N -5.90 -0.37 1.46 0.86 0.15 -1.26 -3.99 113.70 104.64 8kme s SER 36 Ca -0.13 0.87 -0.24 0.00 0.70 0.00 0.00 55.95 57.15 8kme s SER 36 Cb 0.14 1.51 0.38 0.00 -1.71 0.00 0.00 66.02 66.34 8kme s SER 36 CO 0.78 -0.25 0.87 -2.65 1.20 0.00 0.00 173.24 173.18 8kme n PRO 37 N 5.40 -4.71 -3.18 5.44 -0.02 -1.26 -5.02 135.00 131.65 8kme n PRO 37 Ca -0.07 -1.40 -0.42 0.00 -2.02 0.00 0.00 63.50 59.59 8kme n PRO 37 Cb 0.50 -1.93 -0.00 0.00 -0.02 0.00 0.00 33.50 32.05 8kme n PRO 37 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 8kme n GLN 38 N -5.67 3.94 -4.20 -0.52 6.02 -1.26 -4.50 117.38 111.20 8kme n GLN 38 Ca 0.13 -4.53 -0.26 0.00 -0.01 0.00 0.00 57.00 52.32 8kme n GLN 38 Cb 0.59 -2.50 -0.08 0.00 1.02 0.00 0.00 30.24 29.28 8kme n GLN 38 CO 0.00 0.00 0.00 -1.83 -1.01 0.00 0.00 177.06 174.22 8kme s GLU 39 N -2.23 2.42 -0.44 -1.09 -1.05 -1.23 -4.96 118.70 110.12 8kme s GLU 39 Ca 0.31 -1.11 -0.27 0.00 -0.15 0.00 0.00 54.97 53.76 8kme s GLU 39 Cb 0.00 -2.36 0.03 0.00 -0.44 0.00 0.00 34.13 31.36 8kme s GLU 39 CO 0.03 0.45 1.03 -1.17 0.95 0.00 0.00 175.26 176.55 8kme s LEU 40 N -2.96 3.84 0.02 1.83 2.96 -1.26 -0.76 118.68 122.35 8kme s LEU 40 Ca 0.28 0.40 -0.28 0.00 -0.22 0.00 0.00 54.13 54.30 8kme s LEU 40 Cb -0.09 -3.38 -0.16 0.00 0.50 0.00 0.00 46.19 43.06 8kme s LEU 40 CO 0.19 -1.10 1.16 0.25 -1.32 0.00 0.00 176.35 175.54 8kme h LEU 41 N 10.73 -0.86 -8.00 -0.68 5.85 -1.26 -3.48 115.31 117.62 8kme h LEU 41 Ca -0.23 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.52 8kme h LEU 41 Cb 1.07 0.22 0.00 0.00 0.37 0.00 0.00 40.66 42.32 8kme h LEU 41 CO 1.06 -0.49 0.33 0.00 -0.34 0.00 0.00 178.44 179.00 8kme n GLY 43 N -0.56 0.18 0.00 0.00 0.00 -0.59 0.31 105.19 104.53 8kme n GLY 43 Ca -0.08 -1.87 0.00 0.00 0.00 0.00 0.00 46.02 44.07 8kme n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 8kme n ALA 44 N -3.01 0.00 -3.34 4.61 0.00 -1.00 -4.04 120.51 113.73 8kme n ALA 44 Ca -0.01 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.28 8kme n ALA 44 Cb 0.04 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.41 8kme n ALA 44 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 8kme s SER 45 N -2.51 -0.39 -0.26 0.00 1.04 -0.92 -2.20 113.70 108.46 8kme s SER 45 Ca 0.00 0.49 -0.20 0.00 0.48 0.00 0.00 55.95 56.72 8kme s SER 45 Cb 0.00 0.55 -0.02 0.00 0.10 0.00 0.00 66.02 66.65 8kme s SER 45 CO 0.00 -0.41 0.61 -0.22 0.98 0.00 0.00 173.24 174.20 8kme s LEU 46 N -0.85 4.07 -0.01 2.42 0.20 0.59 -0.32 118.68 124.79 8kme s LEU 46 Ca -0.09 0.64 0.06 0.00 0.69 0.00 0.00 54.13 55.43 8kme s LEU 46 Cb -0.03 -2.82 -0.09 0.00 -0.43 0.00 0.00 46.19 42.82 8kme s LEU 46 CO 0.05 -0.37 0.15 2.30 -0.29 0.00 0.00 176.35 178.18 8kme n ILE 47 N 5.22 0.00 -3.64 6.68 -0.00 -0.84 -1.43 119.36 125.35 8kme n ILE 47 Ca -0.01 -0.16 0.00 0.00 -0.00 0.00 0.00 62.75 62.57 8kme n ILE 47 Cb 0.49 0.42 0.00 0.00 -0.00 0.00 0.00 39.64 40.56 8kme n ILE 47 CO 0.00 0.00 0.00 -0.24 -0.00 0.00 0.00 176.55 176.31 8kme n SER 48 N -1.66 0.00 -0.46 7.28 2.88 -1.22 -4.63 113.62 115.81 8kme n SER 48 Ca -0.01 -0.65 0.12 0.00 -1.33 0.00 0.00 58.87 57.00 8kme n SER 48 Cb 0.15 0.00 0.22 0.00 -0.75 0.00 0.00 64.21 63.83 8kme n SER 48 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 8kme n ASP 49 N -1.94 1.73 0.00 -3.46 5.68 -1.26 -4.16 116.55 113.13 8kme n ASP 49 Ca 0.00 -1.35 0.00 0.00 -0.50 0.00 0.00 54.79 52.94 8kme n ASP 49 Cb 0.00 0.23 0.00 0.00 -1.14 0.00 0.00 41.12 40.21 8kme n ASP 49 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 8kme n ARG 50 N -0.04 3.57 -4.80 0.11 5.12 -1.26 0.25 116.66 119.60 8kme n ARG 50 Ca 0.12 0.00 -0.26 0.00 -1.93 0.00 0.00 57.85 55.78 8kme n ARG 50 Cb 0.43 -0.70 -0.16 0.00 -1.16 0.00 0.00 32.46 30.87 8kme n ARG 50 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 8kme s TRP 51 N -1.35 1.71 -0.07 -1.55 0.52 -1.26 0.26 118.94 117.20 8kme s TRP 51 Ca 0.00 -0.55 0.00 0.00 0.02 0.00 0.00 56.10 55.57 8kme s TRP 51 Cb 0.00 -1.18 -0.03 0.00 -1.15 0.00 0.00 33.47 31.11 8kme s TRP 51 CO 0.00 -0.22 -0.05 0.08 0.02 0.00 0.00 176.95 176.78 8kme s VAL 52 N 0.24 3.88 -0.15 4.03 1.01 -0.97 -1.98 120.40 126.46 8kme s VAL 52 Ca -0.08 -0.42 -0.01 0.00 0.00 0.00 0.00 61.98 61.46 8kme s VAL 52 Cb -0.13 -2.60 -0.02 0.00 0.00 0.00 0.00 36.38 33.63 8kme s VAL 52 CO 0.03 0.59 -0.11 -0.22 0.00 0.00 0.00 175.10 175.40 8kme s LEU 53 N -0.85 2.81 0.00 3.92 2.96 0.56 0.15 118.68 128.23 8kme s LEU 53 Ca 0.13 -0.31 0.06 0.00 -0.22 0.00 0.00 54.13 53.79 8kme s LEU 53 Cb -0.11 -1.65 -0.02 0.00 0.50 0.00 0.00 46.19 44.90 8kme s LEU 53 CO 0.02 0.14 0.23 1.07 -1.32 0.00 0.00 176.35 176.49 8kme n THR 54 N 3.71 0.00 -2.79 3.68 5.66 -0.70 -2.16 114.28 121.68 8kme n THR 54 Ca -0.18 -2.20 -0.42 0.00 -3.05 0.00 0.00 64.05 58.20 8kme n THR 54 Cb 0.52 1.03 -0.03 0.00 -1.55 0.00 0.00 70.33 70.30 8kme n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 8kme s ALA 55 N -3.18 3.62 0.44 1.79 0.00 -1.26 -1.37 121.76 121.80 8kme s ALA 55 Ca 0.32 0.05 0.23 0.00 0.00 0.00 0.00 51.96 52.56 8kme s ALA 55 Cb 0.02 -3.38 1.22 0.00 0.00 0.00 0.00 23.12 20.98 8kme s ALA 55 CO 0.23 -0.89 1.80 0.00 0.00 0.00 0.00 175.76 176.90 8kme h ALA 56 N 7.49 2.45 0.00 0.00 0.00 -1.75 -1.73 119.26 125.72 8kme h ALA 56 Ca -0.23 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.70 8kme h ALA 56 Cb 1.09 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.92 8kme h ALA 56 CO 0.90 -0.81 0.00 -2.39 0.00 0.00 0.00 179.25 176.95 8kme n HIS 57 N -4.49 0.00 0.08 0.00 1.44 -1.26 -2.02 115.22 108.97 8kme n HIS 57 Ca 0.24 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 56.06 8kme n HIS 57 Cb 0.93 0.00 -0.04 0.00 0.12 0.00 0.00 29.99 30.99 8kme n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 8kme n LEU 59 N -2.58 2.23 -3.91 0.00 4.77 -0.85 -4.85 117.00 111.80 8kme n LEU 59 Ca -0.01 0.07 -0.29 0.00 -0.03 0.00 0.00 56.01 55.75 8kme n LEU 59 Cb 0.56 -0.64 -0.16 0.00 -2.33 0.00 0.00 43.42 40.85 8kme n LEU 59 CO 0.42 0.63 -0.43 -0.22 -1.33 0.00 0.00 177.39 176.45 8kme s LEU 60 N -6.61 1.81 0.02 2.23 2.96 -0.90 0.84 118.68 119.01 8kme s LEU 60 Ca -0.27 -0.75 -0.28 0.00 -0.22 0.00 0.00 54.13 52.61 8kme s LEU 60 Cb 0.09 -0.99 0.08 0.00 0.50 0.00 0.00 46.19 45.87 8kme s LEU 60 CO 0.40 -0.18 0.74 -0.47 -1.32 0.00 0.00 176.35 175.52 8kme s TYR 60 N 1.57 -0.51 0.00 5.38 5.04 -0.61 -4.12 117.35 124.10 8kme s TYR 60 Ca -0.00 0.59 0.00 0.00 -2.44 0.00 0.00 57.07 55.22 8kme s TYR 60 Cb -0.16 0.49 0.00 0.00 0.35 0.00 0.00 41.96 42.65 8kme s TYR 60 CO -0.08 -0.64 0.00 -2.30 -1.34 0.00 0.00 175.55 171.19 8kme n PRO 60 N 0.20 0.00 -0.38 4.97 -0.02 -1.26 -1.47 135.00 137.03 8kme n PRO 60 Ca -0.15 0.00 0.08 0.00 -2.02 0.00 0.00 63.50 61.41 8kme n PRO 60 Cb 0.61 0.00 0.23 0.00 -0.02 0.00 0.00 33.50 34.32 8kme n PRO 60 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 8kme n TRP 60 N 0.00 0.83 -1.91 6.00 7.02 -1.26 -4.94 117.44 123.17 8kme n TRP 60 Ca 0.00 -0.79 -0.17 0.00 -1.02 0.00 0.00 57.50 55.52 8kme n TRP 60 Cb 0.00 -0.25 -0.04 0.00 -2.42 0.00 0.00 31.31 28.60 8kme n TRP 60 CO 0.00 0.00 0.00 -0.25 -2.02 0.00 0.00 177.69 175.42 8kme n ASP 60 N -0.28 -4.81 -4.70 -0.99 8.00 -1.13 -4.95 116.55 107.69 8kme n ASP 60 Ca 0.19 0.27 -0.42 0.00 0.71 0.00 0.00 54.79 55.54 8kme n ASP 60 Cb 0.78 -4.19 -0.03 0.00 -0.02 0.00 0.00 41.12 37.66 8kme n ASP 60 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 8kme s LYS 60 N -4.18 4.48 -0.40 -1.24 1.02 -0.54 -4.97 119.74 113.92 8kme s LYS 60 Ca 0.00 1.34 0.01 0.00 0.02 0.00 0.00 55.97 57.34 8kme s LYS 60 Cb 0.00 -3.50 0.19 0.00 -0.52 0.00 0.00 37.83 34.00 8kme s LYS 60 CO 0.00 -0.15 0.84 1.21 -0.92 0.00 0.00 175.35 176.33 8kme s ASN 60 N 1.03 -0.99 0.35 2.83 2.47 -1.10 -1.58 114.94 117.96 8kme s ASN 60 Ca 0.49 -0.77 -0.10 0.00 0.42 0.00 0.00 52.86 52.90 8kme s ASN 60 Cb -0.19 1.28 -0.07 0.00 -1.45 0.00 0.00 41.25 40.82 8kme s ASN 60 CO 0.22 -0.08 0.70 -0.36 -3.72 0.00 0.00 177.10 173.87 8kme s PHE 60 N 1.50 3.45 0.42 0.43 0.08 0.25 -4.99 117.98 119.11 8kme s PHE 60 Ca 0.20 0.98 0.07 0.00 0.12 0.00 0.00 56.93 58.30 8kme s PHE 60 Cb 0.02 -2.38 -0.07 0.00 -0.57 0.00 0.00 43.02 40.02 8kme s PHE 60 CO -0.09 0.02 0.03 0.99 -0.10 0.00 0.00 175.22 176.07 8kme s THR 60 N -2.19 1.96 0.20 0.64 2.01 -1.26 -4.87 115.64 112.13 8kme s THR 60 Ca 0.50 -1.96 -0.17 0.00 0.31 0.00 0.00 61.69 60.37 8kme s THR 60 Cb -0.10 -2.92 0.19 0.00 0.01 0.00 0.00 72.50 69.67 8kme s THR 60 CO 0.27 0.00 1.60 -0.33 -0.69 0.00 0.00 174.62 175.47 8kme h GLU 61 N 1.68 -0.09 -0.95 4.92 4.39 -1.95 -1.97 114.58 120.60 8kme h GLU 61 Ca -0.44 0.01 -0.44 0.00 0.34 0.00 0.00 59.36 58.82 8kme h GLU 61 Cb 1.25 0.02 -0.27 0.00 -0.10 0.00 0.00 28.75 29.65 8kme h GLU 61 CO 0.79 -0.06 0.56 0.27 -1.16 0.00 0.00 179.01 179.41 8kme n ASN 62 N -5.45 3.96 -0.04 1.42 0.23 -1.26 -3.61 115.26 110.51 8kme n ASN 62 Ca 0.06 -3.48 0.01 0.00 -0.53 0.00 0.00 54.58 50.64 8kme n ASN 62 Cb 0.36 -0.81 -0.13 0.00 -2.08 0.00 0.00 39.78 37.11 8kme n ASN 62 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 8kme n ASP 63 N -0.90 1.05 -4.55 0.53 8.00 -0.75 -4.92 116.55 115.01 8kme n ASP 63 Ca 0.55 0.00 -0.25 0.00 0.71 0.00 0.00 54.79 55.80 8kme n ASP 63 Cb 1.59 1.38 -0.09 0.00 -0.02 0.00 0.00 41.12 43.98 8kme n ASP 63 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 8kme s LEU 64 N -4.65 2.88 0.05 0.64 1.43 -1.21 -1.67 118.68 116.15 8kme s LEU 64 Ca -0.07 -0.76 0.02 0.00 -1.03 0.00 0.00 54.13 52.28 8kme s LEU 64 Cb 0.08 -1.46 -0.03 0.00 0.03 0.00 0.00 46.19 44.81 8kme s LEU 64 CO 0.69 0.05 -0.07 -0.76 0.23 0.00 0.00 176.35 176.49 8kme s LEU 65 N -3.29 2.31 -0.16 1.79 1.02 0.39 -4.55 118.68 116.17 8kme s LEU 65 Ca 0.28 -0.64 0.01 0.00 0.02 0.00 0.00 54.13 53.80 8kme s LEU 65 Cb -0.07 -0.12 0.02 0.00 0.02 0.00 0.00 46.19 46.04 8kme s LEU 65 CO 0.16 -0.27 -0.20 -0.69 0.02 0.00 0.00 176.35 175.37 8kme s VAL 66 N -1.86 2.01 -0.36 -1.59 1.01 0.34 -1.88 120.40 118.07 8kme s VAL 66 Ca -0.06 -0.92 -0.06 0.00 0.00 0.00 0.00 61.98 60.94 8kme s VAL 66 Cb -0.07 -1.81 0.06 0.00 0.00 0.00 0.00 36.38 34.57 8kme s VAL 66 CO -0.01 0.53 0.14 -0.13 0.00 0.00 0.00 175.10 175.64 8kme s ARG 67 N 1.17 2.51 -0.03 2.72 0.52 -0.07 0.95 118.95 126.71 8kme s ARG 67 Ca 0.01 -1.35 -0.03 0.00 -0.52 0.00 0.00 55.73 53.85 8kme s ARG 67 Cb -0.14 -3.52 -0.04 0.00 0.52 0.00 0.00 34.95 31.77 8kme s ARG 67 CO -0.10 -0.79 0.14 0.42 0.02 0.00 0.00 175.30 175.00 8kme s ILE 68 N 1.35 5.22 0.00 1.52 1.01 0.15 -2.09 121.20 128.37 8kme s ILE 68 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 60.65 60.49 8kme s ILE 68 Cb -0.21 -3.39 0.00 0.00 0.01 0.00 0.00 42.46 38.87 8kme s ILE 68 CO 0.01 0.39 0.00 0.61 0.00 0.00 0.00 174.94 175.95 8kme n GLY 69 N 1.22 0.78 3.76 6.18 0.00 -1.26 -1.69 105.19 114.18 8kme n GLY 69 Ca -0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.59 8kme n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 8kme s LYS 70 N -0.82 1.86 0.00 1.61 1.02 -1.26 -4.65 119.74 117.49 8kme s LYS 70 Ca 0.00 0.88 0.00 0.00 0.02 0.00 0.00 55.97 56.87 8kme s LYS 70 Cb 0.00 -1.87 0.00 0.00 -0.52 0.00 0.00 37.83 35.44 8kme s LYS 70 CO 0.00 -1.84 0.00 1.58 -0.92 0.00 0.00 175.35 174.17 8kme n HIS 71 N -3.62 -0.08 -2.87 3.18 -0.00 -1.26 -4.98 115.22 105.58 8kme n HIS 71 Ca 0.08 0.00 -0.40 0.00 -0.00 0.00 0.00 57.72 57.39 8kme n HIS 71 Cb 0.55 0.35 -0.05 0.00 -0.00 0.00 0.00 29.99 30.84 8kme n HIS 71 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 8kme s SER 72 N -4.29 7.40 0.04 0.26 0.15 -1.26 -0.94 113.70 115.06 8kme s SER 72 Ca 0.00 1.67 -0.22 0.00 0.70 0.00 0.00 55.95 58.10 8kme s SER 72 Cb 0.00 -2.53 -0.15 0.00 -1.71 0.00 0.00 66.02 61.63 8kme s SER 72 CO 0.00 0.06 1.43 -0.09 1.20 0.00 0.00 173.24 175.84 8kme h ARG 73 N 5.09 0.20 0.03 5.44 1.12 -1.60 -3.39 114.38 121.27 8kme h ARG 73 Ca -0.45 -0.08 -0.22 0.00 -1.11 0.00 0.00 59.98 58.12 8kme h ARG 73 Cb 1.21 -0.01 -0.02 0.00 -0.01 0.00 0.00 29.97 31.13 8kme h ARG 73 CO 0.70 0.50 -1.20 1.15 -3.11 0.00 0.00 179.97 178.00 8kme h THR 74 N -0.11 1.02 -3.94 0.20 2.02 -1.89 -3.49 112.91 106.73 8kme h THR 74 Ca 0.03 -2.26 -0.50 0.00 0.77 0.00 0.00 66.41 64.45 8kme h THR 74 Cb 0.42 2.49 0.03 0.00 -1.74 0.00 0.00 68.15 69.36 8kme h THR 74 CO 0.01 0.48 0.46 -0.13 0.37 0.00 0.00 175.52 176.71 8kme s ARG 75 N -2.39 4.15 -0.90 6.66 3.00 -1.26 -4.99 118.95 123.23 8kme s ARG 75 Ca -0.25 1.69 -0.24 0.00 0.00 0.00 0.00 55.73 56.92 8kme s ARG 75 Cb 0.05 -2.66 0.05 0.00 0.00 0.00 0.00 34.95 32.38 8kme s ARG 75 CO 0.65 -0.19 1.34 -0.47 0.00 0.00 0.00 175.30 176.63 8kme s TYR 76 N -1.50 2.50 -1.23 -0.53 5.04 -1.26 -4.82 117.35 115.54 8kme s TYR 76 Ca 0.56 -0.59 -0.20 0.00 -2.44 0.00 0.00 57.07 54.40 8kme s TYR 76 Cb -0.27 -4.62 -0.01 0.00 0.35 0.00 0.00 41.96 37.41 8kme s TYR 76 CO 0.34 -1.94 1.86 0.39 -1.34 0.00 0.00 175.55 174.86 8kme n GLU 77 N 8.81 2.44 -0.06 4.97 1.02 -1.26 -4.84 120.64 131.73 8kme n GLU 77 Ca 0.20 -2.82 0.01 0.00 -0.02 0.00 0.00 57.16 54.53 8kme n GLU 77 Cb 0.50 -3.53 0.03 0.00 -0.02 0.00 0.00 31.44 28.41 8kme n GLU 77 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 8kme n ARG 77 N 8.08 -0.02 -0.02 3.49 0.63 -1.26 -1.06 116.66 126.50 8kme n ARG 77 Ca 0.48 0.27 0.02 0.00 -0.92 0.00 0.00 57.85 57.70 8kme n ARG 77 Cb 0.45 -0.41 -0.08 0.00 0.45 0.00 0.00 32.46 32.87 8kme n ARG 77 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 8kme n ASN 78 N -4.28 2.56 -0.03 6.15 5.03 -1.26 -4.73 115.26 118.70 8kme n ASN 78 Ca 0.03 0.00 -0.13 0.00 0.87 0.00 0.00 54.58 55.35 8kme n ASN 78 Cb 0.09 1.25 -0.11 0.00 -1.02 0.00 0.00 39.78 39.99 8kme n ASN 78 CO 0.00 0.00 0.00 0.40 -1.83 0.00 0.00 177.26 175.83 8kme h ILE 79 N 0.00 1.52 -3.29 2.41 2.04 -1.73 -3.47 117.51 114.99 8kme h ILE 79 Ca -0.09 -1.53 -0.56 0.00 1.00 0.00 0.00 64.86 63.69 8kme h ILE 79 Cb 0.85 2.56 -0.03 0.00 -0.74 0.00 0.00 36.82 39.46 8kme h ILE 79 CO 0.00 0.40 -0.22 -1.83 0.00 0.00 0.00 178.15 176.50 8kme s GLU 80 N -3.61 3.70 -0.15 2.37 -1.05 -0.23 -4.85 118.70 114.88 8kme s GLU 80 Ca -0.17 0.07 -0.01 0.00 -0.15 0.00 0.00 54.97 54.71 8kme s GLU 80 Cb 0.00 -2.75 -0.02 0.00 -0.44 0.00 0.00 34.13 30.93 8kme s GLU 80 CO 0.68 0.39 -0.10 0.15 0.95 0.00 0.00 175.26 177.33 8kme s LYS 81 N -2.78 3.45 -0.23 -4.83 3.01 -0.68 -4.88 119.74 112.80 8kme s LYS 81 Ca 0.44 -0.64 -0.03 0.00 -1.01 0.00 0.00 55.97 54.73 8kme s LYS 81 Cb -0.12 -2.75 0.01 0.00 -1.01 0.00 0.00 37.83 33.96 8kme s LYS 81 CO 0.23 0.16 -0.06 0.42 0.51 0.00 0.00 175.35 176.61 8kme s ILE 82 N 0.52 3.05 0.12 2.17 1.01 -1.26 0.31 121.20 127.12 8kme s ILE 82 Ca -0.07 -0.75 0.10 0.00 0.00 0.00 0.00 60.65 59.94 8kme s ILE 82 Cb -0.15 -2.44 -0.04 0.00 0.01 0.00 0.00 42.46 39.83 8kme s ILE 82 CO 0.04 0.34 -0.25 -0.44 0.00 0.00 0.00 174.94 174.62 8kme s SER 83 N 1.40 3.40 0.02 3.58 0.01 0.27 -4.94 113.70 117.45 8kme s SER 83 Ca 0.04 -0.70 -0.12 0.00 1.31 0.00 0.00 55.95 56.48 8kme s SER 83 Cb -0.15 -0.29 -0.06 0.00 0.21 0.00 0.00 66.02 65.74 8kme s SER 83 CO -0.05 0.19 0.38 -0.04 0.41 0.00 0.00 173.24 174.14 8kme s MET 84 N -1.98 3.81 0.72 12.44 -1.94 -1.26 -0.50 119.30 130.59 8kme s MET 84 Ca 0.14 0.27 -0.06 0.00 -1.71 0.00 0.00 55.69 54.34 8kme s MET 84 Cb -0.10 -3.12 0.08 0.00 2.01 0.00 0.00 34.83 33.70 8kme s MET 84 CO 0.06 0.64 1.01 -0.51 -0.01 0.00 0.00 175.02 176.22 8kme s LEU 85 N -1.42 2.89 0.00 -0.03 1.43 -1.26 0.15 118.68 120.44 8kme s LEU 85 Ca 0.27 0.24 0.00 0.00 -1.03 0.00 0.00 54.13 53.60 8kme s LEU 85 Cb -0.15 -2.80 0.00 0.00 0.03 0.00 0.00 46.19 43.27 8kme s LEU 85 CO 0.15 -1.71 0.00 1.21 0.23 0.00 0.00 176.35 176.23 8kme n GLU 86 N -2.93 0.00 0.00 1.70 2.13 0.16 -4.29 120.64 117.41 8kme n GLU 86 Ca 0.10 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.92 8kme n GLU 86 Cb 0.60 -0.07 0.00 0.00 0.27 0.00 0.00 31.44 32.25 8kme n GLU 86 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 8kme n LYS 87 N 0.00 0.00 -3.03 5.31 4.76 -1.21 -4.93 118.16 119.06 8kme n LYS 87 Ca 0.00 0.00 -0.40 0.00 -2.87 0.00 0.00 58.31 55.04 8kme n LYS 87 Cb 0.04 0.00 -0.05 0.00 -1.84 0.00 0.00 35.03 33.18 8kme n LYS 87 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 8kme s ILE 88 N 0.00 5.00 -0.23 -0.18 1.01 -1.26 -2.72 121.20 122.82 8kme s ILE 88 Ca 0.00 1.42 0.02 0.00 0.00 0.00 0.00 60.65 62.09 8kme s ILE 88 Cb 0.00 -4.04 0.05 0.00 0.01 0.00 0.00 42.46 38.48 8kme s ILE 88 CO 0.00 0.16 -0.13 -0.31 0.00 0.00 0.00 174.94 174.66 8kme s TYR 89 N 1.41 2.99 0.20 3.97 1.51 0.62 -4.96 117.35 123.09 8kme s TYR 89 Ca 0.35 -2.02 -0.12 0.00 -1.01 0.00 0.00 57.07 54.27 8kme s TYR 89 Cb -0.17 -1.88 -0.07 0.00 -0.11 0.00 0.00 41.96 39.73 8kme s TYR 89 CO 0.15 -0.84 0.57 0.42 -1.11 0.00 0.00 175.55 174.73 8kme s ILE 90 N 1.20 4.87 0.43 2.71 -1.09 -1.26 0.68 121.20 128.74 8kme s ILE 90 Ca -0.04 0.68 -0.25 0.00 -2.23 0.00 0.00 60.65 58.81 8kme s ILE 90 Cb -0.17 -3.67 -0.08 0.00 -1.58 0.00 0.00 42.46 36.95 8kme s ILE 90 CO -0.08 0.06 1.32 -2.28 -1.23 0.00 0.00 174.94 172.74 8kme s HIS 91 N -1.67 2.71 0.55 3.97 5.65 -0.49 -4.83 115.29 121.18 8kme s HIS 91 Ca 0.44 1.38 0.23 0.00 0.25 0.00 0.00 55.06 57.36 8kme s HIS 91 Cb -0.13 -3.71 1.46 0.00 -1.18 0.00 0.00 32.58 29.02 8kme s HIS 91 CO 0.20 -2.29 2.11 -1.35 -0.65 0.00 0.00 174.74 172.75 8kme h PRO 92 N 2.48 0.00 -0.89 2.88 0.11 -1.92 -2.70 132.00 131.95 8kme h PRO 92 Ca -0.50 0.00 -0.49 0.00 0.11 0.00 0.00 66.00 65.12 8kme h PRO 92 Cb 1.25 0.00 -0.42 0.00 0.11 0.00 0.00 31.00 31.94 8kme h PRO 92 CO 0.62 0.00 -0.88 0.54 -0.21 0.00 0.00 178.00 178.07 8kme n ARG 93 N -4.24 3.07 -2.05 1.05 1.74 -1.26 -5.07 116.66 109.91 8kme n ARG 93 Ca 0.02 -4.07 -0.41 0.00 -0.77 0.00 0.00 57.85 52.61 8kme n ARG 93 Cb 0.29 -2.08 -0.03 0.00 -1.02 0.00 0.00 32.46 29.62 8kme n ARG 93 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 8kme s TYR 94 N -3.59 3.09 -0.72 -1.55 5.04 -1.02 -4.66 117.35 113.93 8kme s TYR 94 Ca 0.44 1.01 -0.05 0.00 -2.44 0.00 0.00 57.07 56.03 8kme s TYR 94 Cb 0.40 -3.78 0.19 0.00 0.35 0.00 0.00 41.96 39.11 8kme s TYR 94 CO -0.03 -2.59 0.58 1.21 -1.34 0.00 0.00 175.55 173.39 8kme s ASN 95 N 0.51 5.73 0.44 4.32 3.84 0.30 -4.83 114.94 125.25 8kme s ASN 95 Ca 0.61 -2.97 0.24 0.00 0.21 0.00 0.00 52.86 50.94 8kme s ASN 95 Cb -0.41 -1.95 0.43 0.00 -0.55 0.00 0.00 41.25 38.77 8kme s ASN 95 CO 0.40 -0.38 1.64 4.11 -2.79 0.00 0.00 177.10 180.08 8kme h TRP 96 N 7.03 0.00 0.14 0.43 5.08 -1.93 0.48 115.95 127.18 8kme h TRP 96 Ca 0.04 0.00 -0.29 0.00 1.08 0.00 0.00 58.89 59.73 8kme h TRP 96 Cb 0.95 0.00 0.01 0.00 -3.00 0.00 0.00 29.16 27.12 8kme h TRP 96 CO 0.79 0.00 -1.31 0.00 -1.28 0.00 0.00 178.44 176.64 8kme h ARG 97 N 0.00 0.29 0.00 0.12 3.08 -2.00 -3.45 114.38 112.43 8kme h ARG 97 Ca 0.00 -0.50 0.00 0.00 0.07 0.00 0.00 59.98 59.55 8kme h ARG 97 Cb 0.95 0.19 0.00 0.00 0.08 0.00 0.00 29.97 31.19 8kme h ARG 97 CO 0.00 1.22 0.00 -1.91 -1.07 0.00 0.00 179.97 178.21 8kme n GLU 97 N -3.54 0.00 -0.07 0.04 2.13 -1.23 -4.94 120.64 113.03 8kme n GLU 97 Ca -0.11 0.00 0.02 0.00 0.66 0.00 0.00 57.16 57.74 8kme n GLU 97 Cb 1.04 -0.17 0.03 0.00 0.27 0.00 0.00 31.44 32.61 8kme n GLU 97 CO 0.00 0.00 0.00 0.27 -0.41 0.00 0.00 177.13 176.99 8kme n ASN 98 N -1.88 1.34 -2.72 4.31 6.94 -1.23 -4.99 115.26 117.03 8kme n ASN 98 Ca 0.00 -1.98 -0.16 0.00 -0.02 0.00 0.00 54.58 52.42 8kme n ASN 98 Cb 0.00 -0.11 0.06 0.00 -2.36 0.00 0.00 39.78 37.36 8kme n ASN 98 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 8kme n LEU 99 N -0.51 -3.09 -4.64 -4.53 4.77 0.17 -4.97 117.00 104.20 8kme n LEU 99 Ca 0.03 -0.40 -0.40 0.00 -0.03 0.00 0.00 56.01 55.21 8kme n LEU 99 Cb 0.45 -2.33 -0.06 0.00 -2.33 0.00 0.00 43.42 39.15 8kme n LEU 99 CO 0.00 0.44 0.37 -0.62 -1.33 0.00 0.00 177.39 176.25 8kme s ASP 100 N -3.36 6.61 0.00 -1.43 2.15 -1.23 -3.69 116.67 115.72 8kme s ASP 100 Ca 0.35 0.75 0.00 0.00 0.43 0.00 0.00 52.55 54.07 8kme s ASP 100 Cb -0.15 -2.34 0.00 0.00 -0.30 0.00 0.00 42.92 40.13 8kme s ASP 100 CO 0.52 -0.32 0.00 0.54 -0.17 0.00 0.00 175.17 175.74 8kme n ARG 101 N 5.40 0.00 -2.65 4.34 1.74 -1.26 0.11 116.66 124.34 8kme n ARG 101 Ca -0.01 0.00 -0.43 0.00 -0.77 0.00 0.00 57.85 56.64 8kme n ARG 101 Cb 0.49 -2.47 -0.01 0.00 -1.02 0.00 0.00 32.46 29.45 8kme n ARG 101 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 8kme s ASP 102 N -2.98 6.78 -0.26 0.55 2.15 -1.24 -4.16 116.67 117.50 8kme s ASP 102 Ca 0.00 -2.26 -0.19 0.00 0.43 0.00 0.00 52.55 50.53 8kme s ASP 102 Cb 0.00 -2.54 0.07 0.00 -0.30 0.00 0.00 42.92 40.15 8kme s ASP 102 CO 0.00 -1.19 0.67 -0.51 -0.17 0.00 0.00 175.17 173.98 8kme s ILE 103 N 3.95 -0.00 0.07 4.11 2.07 -1.26 -4.14 121.20 126.00 8kme s ILE 103 Ca 0.49 0.01 -0.09 0.00 -1.41 0.00 0.00 60.65 59.65 8kme s ILE 103 Cb 0.02 -0.96 0.00 0.00 0.13 0.00 0.00 42.46 41.65 8kme s ILE 103 CO 0.02 0.00 0.20 0.00 -1.91 0.00 0.00 174.94 173.25 8kme s ALA 104 N 1.03 -0.31 0.01 1.50 0.00 -0.47 -1.40 121.76 122.13 8kme s ALA 104 Ca -0.05 -0.45 0.08 0.00 0.00 0.00 0.00 51.96 51.54 8kme s ALA 104 Cb -0.05 0.40 -0.02 0.00 0.00 0.00 0.00 23.12 23.44 8kme s ALA 104 CO -0.10 -0.45 -0.26 -0.51 0.00 0.00 0.00 175.76 174.45 8kme s LEU 105 N -2.51 2.14 -0.01 0.00 1.43 0.21 -1.71 118.68 118.23 8kme s LEU 105 Ca 0.00 -0.52 0.08 0.00 -1.03 0.00 0.00 54.13 52.66 8kme s LEU 105 Cb 0.02 -1.33 -0.02 0.00 0.03 0.00 0.00 46.19 44.90 8kme s LEU 105 CO -0.08 0.29 -0.24 -0.04 0.23 0.00 0.00 176.35 176.51 8kme s MET 106 N -0.94 1.95 -0.37 1.70 -1.94 0.12 -0.28 119.30 119.54 8kme s MET 106 Ca 0.11 -0.89 -0.07 0.00 -1.71 0.00 0.00 55.69 53.14 8kme s MET 106 Cb -0.10 -1.90 0.06 0.00 2.01 0.00 0.00 34.83 34.90 8kme s MET 106 CO 0.01 0.52 0.16 0.21 -0.01 0.00 0.00 175.02 175.91 8kme s LYS 107 N -0.62 2.55 0.44 2.03 2.47 -1.10 -2.30 119.74 123.20 8kme s LYS 107 Ca 0.09 -1.34 -0.24 0.00 -1.56 0.00 0.00 55.97 52.93 8kme s LYS 107 Cb -0.09 -3.57 -0.08 0.00 -1.46 0.00 0.00 37.83 32.63 8kme s LYS 107 CO -0.01 -0.80 1.21 -0.51 0.16 0.00 0.00 175.35 175.41 8kme s LEU 108 N 1.38 4.09 0.26 5.43 1.43 0.14 0.35 118.68 131.76 8kme s LEU 108 Ca 0.01 2.43 -0.03 0.00 -1.03 0.00 0.00 54.13 55.51 8kme s LEU 108 Cb -0.21 -4.12 0.55 0.00 0.03 0.00 0.00 46.19 42.44 8kme s LEU 108 CO 0.02 -0.90 1.65 0.50 0.23 0.00 0.00 176.35 177.85 8kme h LYS 109 N 2.28 0.18 -3.75 1.70 1.63 0.13 -3.41 116.57 115.32 8kme h LYS 109 Ca -0.49 -0.01 -0.13 0.00 -0.85 0.00 0.00 60.65 59.16 8kme h LYS 109 Cb 1.25 -0.04 -0.18 0.00 -0.60 0.00 0.00 32.23 32.65 8kme h LYS 109 CO 0.61 0.12 -0.52 0.15 -3.45 0.00 0.00 179.45 176.36 8kme s LYS 110 N -6.03 0.56 0.75 1.90 1.02 -1.26 -4.99 119.74 111.69 8kme s LYS 110 Ca -0.13 -0.68 -0.16 0.00 0.02 0.00 0.00 55.97 55.02 8kme s LYS 110 Cb 0.23 0.22 -0.01 0.00 -0.52 0.00 0.00 37.83 37.75 8kme s LYS 110 CO 0.76 -0.14 0.64 -2.30 -0.92 0.00 0.00 175.35 173.40 8kme n PRO 111 N 0.92 0.27 -4.16 -1.68 -0.01 -1.25 -4.87 135.00 124.21 8kme n PRO 111 Ca -0.20 0.14 -0.23 0.00 -0.01 0.00 0.00 63.50 63.19 8kme n PRO 111 Cb 0.58 -1.95 -0.06 0.00 -0.01 0.00 0.00 33.50 32.06 8kme n PRO 111 CO 0.00 0.00 0.00 0.14 -0.01 0.00 0.00 175.50 175.63 8kme s VAL 112 N -1.96 4.15 -0.16 -1.45 -7.23 0.14 -4.98 120.40 108.90 8kme s VAL 112 Ca 0.67 -1.46 -0.07 0.00 -1.81 0.00 0.00 61.98 59.30 8kme s VAL 112 Cb -0.33 -3.19 -0.04 0.00 0.56 0.00 0.00 36.38 33.37 8kme s VAL 112 CO 0.57 -0.28 0.09 0.00 -0.31 0.00 0.00 175.10 175.17 8kme s ALA 113 N -2.05 3.59 0.68 1.32 0.00 -1.26 -4.79 121.76 119.26 8kme s ALA 113 Ca 0.31 -0.71 -0.11 0.00 0.00 0.00 0.00 51.96 51.45 8kme s ALA 113 Cb -0.08 -1.95 -0.00 0.00 0.00 0.00 0.00 23.12 21.09 8kme s ALA 113 CO 0.23 0.34 1.06 -0.06 0.00 0.00 0.00 175.76 177.33 8kme s PHE 114 N -0.15 3.34 0.00 0.00 0.08 -1.26 -4.91 117.98 115.07 8kme s PHE 114 Ca 0.09 1.22 0.00 0.00 0.12 0.00 0.00 56.93 58.36 8kme s PHE 114 Cb -0.12 -2.91 0.00 0.00 -0.57 0.00 0.00 43.02 39.43 8kme s PHE 114 CO 0.01 -1.08 0.00 -1.13 -0.10 0.00 0.00 175.22 172.92 8kme n SER 115 N -2.98 0.00 0.20 1.36 3.41 -0.34 -4.95 113.62 110.32 8kme n SER 115 Ca 0.07 -0.51 0.08 0.00 -0.26 0.00 0.00 58.87 58.25 8kme n SER 115 Cb 0.55 0.00 0.34 0.00 -0.26 0.00 0.00 64.21 64.84 8kme n SER 115 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 8kme h ASP 116 N 0.00 0.00 0.00 4.04 3.32 -1.98 -3.33 116.42 118.46 8kme h ASP 116 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 8kme h ASP 116 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 8kme h ASP 116 CO 0.00 0.29 -0.61 -1.22 -1.72 0.00 0.00 179.24 175.97 8kme n TYR 117 N -3.35 0.00 -4.02 4.55 4.01 -1.26 -4.73 117.16 112.36 8kme n TYR 117 Ca 0.01 0.00 -0.30 0.00 -0.16 0.00 0.00 57.90 57.44 8kme n TYR 117 Cb 0.51 -0.05 -0.16 0.00 -0.31 0.00 0.00 39.34 39.33 8kme n TYR 117 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 8kme s ILE 118 N -1.85 1.60 -0.28 -0.72 1.01 -1.25 -4.35 121.20 115.36 8kme s ILE 118 Ca 0.01 -0.67 -0.19 0.00 0.00 0.00 0.00 60.65 59.80 8kme s ILE 118 Cb 0.04 -1.51 0.11 0.00 0.01 0.00 0.00 42.46 41.12 8kme s ILE 118 CO 0.25 0.45 0.86 -2.28 0.00 0.00 0.00 174.94 174.21 8kme s HIS 119 N 1.47 -0.75 0.58 3.97 2.46 0.04 -1.20 115.29 121.88 8kme s HIS 119 Ca 0.05 1.58 -0.19 0.00 0.47 0.00 0.00 55.06 56.97 8kme s HIS 119 Cb -0.13 0.43 -0.04 0.00 -0.13 0.00 0.00 32.58 32.72 8kme s HIS 119 CO -0.11 -0.37 1.17 -1.25 -2.47 0.00 0.00 174.74 171.72 8kme s PRO 120 N 1.10 3.07 0.17 2.88 0.05 -1.26 -2.48 135.00 138.52 8kme s PRO 120 Ca -0.06 1.71 0.01 0.00 0.05 0.00 0.00 61.00 62.71 8kme s PRO 120 Cb -0.05 -1.95 -0.04 0.00 0.05 0.00 0.00 34.50 32.51 8kme s PRO 120 CO -0.13 -1.10 0.33 0.54 0.05 0.00 0.00 177.00 176.69 8kme s VAL 121 N -1.73 5.27 0.58 -0.36 0.11 -0.51 -4.90 120.40 118.86 8kme s VAL 121 Ca 0.75 -0.48 -0.09 0.00 -2.93 0.00 0.00 61.98 59.23 8kme s VAL 121 Cb -0.27 -3.73 -0.03 0.00 -1.53 0.00 0.00 36.38 30.83 8kme s VAL 121 CO 0.32 -0.11 0.94 0.00 -3.33 0.00 0.00 175.10 172.92 8kme s LEU 123 N -5.03 3.69 0.83 0.00 1.43 -1.26 -1.23 118.68 117.10 8kme s LEU 123 Ca 0.53 0.17 -0.11 0.00 -1.03 0.00 0.00 54.13 53.68 8kme s LEU 123 Cb -0.11 -1.89 0.09 0.00 0.03 0.00 0.00 46.19 44.31 8kme s LEU 123 CO 0.50 0.37 1.09 -2.16 0.23 0.00 0.00 176.35 176.38 8kme s PRO 124 N -1.01 1.85 0.27 1.29 0.04 -1.26 -4.93 135.00 131.26 8kme s PRO 124 Ca 0.15 0.75 0.09 0.00 0.04 0.00 0.00 61.00 62.03 8kme s PRO 124 Cb -0.11 -1.88 -0.04 0.00 0.04 0.00 0.00 34.50 32.50 8kme s PRO 124 CO 0.04 -1.82 0.03 0.16 0.04 0.00 0.00 177.00 175.46 8kme s ASP 125 N -3.70 4.65 0.17 6.66 -4.77 -1.26 -4.92 116.67 113.50 8kme s ASP 125 Ca 0.62 -0.63 -0.24 0.00 -3.30 0.00 0.00 52.55 49.00 8kme s ASP 125 Cb -0.16 -0.88 0.06 0.00 -1.09 0.00 0.00 42.92 40.85 8kme s ASP 125 CO 0.55 -0.04 1.58 -0.09 0.70 0.00 0.00 175.17 177.87 8kme h ARG 126 N 1.81 -0.23 -0.72 2.11 2.43 -1.98 0.38 114.38 118.18 8kme h ARG 126 Ca -0.45 0.02 0.07 0.00 -0.81 0.00 0.00 59.98 58.81 8kme h ARG 126 Cb 1.25 0.05 -0.05 0.00 -0.42 0.00 0.00 29.97 30.80 8kme h ARG 126 CO 0.61 -0.15 0.47 0.93 -1.51 0.00 0.00 179.97 180.32 8kme h GLU 127 N -0.23 0.68 -1.16 0.20 3.07 -2.05 0.25 114.58 115.34 8kme h GLU 127 Ca 0.19 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 59.00 8kme h GLU 127 Cb 0.56 -0.15 0.00 0.00 -0.84 0.00 0.00 28.75 28.32 8kme h GLU 127 CO -0.63 0.45 0.00 2.41 -1.40 0.00 0.00 179.01 179.84 8kme n THR 128 N -4.48 0.38 0.00 1.13 -1.04 0.13 -1.24 114.28 109.16 8kme n THR 128 Ca 0.11 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.12 8kme n THR 128 Cb 0.26 -0.62 0.00 0.00 -1.82 0.00 0.00 70.33 68.15 8kme n THR 128 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 8kme n ALA 129 N 0.56 0.00 0.88 2.41 0.00 0.87 -2.35 120.51 122.88 8kme n ALA 129 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.54 8kme n ALA 129 Cb 0.23 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.59 8kme n ALA 129 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 8kme n SER 129 N 0.00 0.84 -0.08 0.00 3.41 -0.37 -4.59 113.62 112.83 8kme n SER 129 Ca 0.00 -0.81 -0.12 0.00 -0.26 0.00 0.00 58.87 57.69 8kme n SER 129 Cb 0.00 1.04 -0.08 0.00 -0.26 0.00 0.00 64.21 64.91 8kme n SER 129 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 8kme n LEU 129 N -1.60 2.92 -3.51 1.04 4.77 -0.99 -4.74 117.00 114.88 8kme n LEU 129 Ca 0.03 -0.08 -0.38 0.00 -0.03 0.00 0.00 56.01 55.56 8kme n LEU 129 Cb 0.36 -0.57 -0.04 0.00 -2.33 0.00 0.00 43.42 40.84 8kme n LEU 129 CO 0.43 0.76 2.35 0.18 -1.33 0.00 0.00 177.39 179.78 8kme n LEU 130 N -3.01 5.06 -3.93 2.23 4.77 -1.26 -4.79 117.00 116.07 8kme n LEU 130 Ca -0.29 -3.20 -0.23 0.00 -0.03 0.00 0.00 56.01 52.26 8kme n LEU 130 Cb 0.81 -1.23 -0.17 0.00 -2.33 0.00 0.00 43.42 40.50 8kme n LEU 130 CO 0.16 0.28 -0.43 -1.10 -1.33 0.00 0.00 177.39 174.97 8kme s GLN 131 N 4.13 1.20 0.11 3.23 -0.21 -1.26 -4.98 119.66 121.88 8kme s GLN 131 Ca 0.52 -0.21 -0.36 0.00 0.02 0.00 0.00 55.36 55.33 8kme s GLN 131 Cb 0.14 -1.15 -0.17 0.00 1.00 0.00 0.00 33.01 32.83 8kme s GLN 131 CO 0.03 -0.10 1.24 0.00 -2.12 0.00 0.00 175.29 174.35 8kme n ALA 132 N 4.21 -1.21 0.00 6.09 0.00 -1.26 -1.53 120.51 126.81 8kme n ALA 132 Ca -0.21 0.51 0.00 0.00 0.00 0.00 0.00 53.44 53.74 8kme n ALA 132 Cb 0.51 -2.02 0.00 0.00 0.00 0.00 0.00 19.45 17.94 8kme n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 8kme n GLY 133 N 2.24 2.51 3.73 0.00 0.00 0.01 -4.93 105.19 108.76 8kme n GLY 133 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 8kme n GLY 133 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 8kme s TYR 134 N -2.53 3.53 0.12 1.61 1.51 -0.58 -4.62 117.35 116.38 8kme s TYR 134 Ca 0.00 1.50 -0.09 0.00 -1.01 0.00 0.00 57.07 57.47 8kme s TYR 134 Cb 0.00 -3.33 -0.06 0.00 -0.11 0.00 0.00 41.96 38.46 8kme s TYR 134 CO 0.00 -0.86 0.43 0.15 -1.11 0.00 0.00 175.55 174.16 8kme s LYS 135 N -0.00 3.75 0.45 -0.62 1.02 -1.26 -0.81 119.74 122.27 8kme s LYS 135 Ca 0.52 0.15 0.02 0.00 0.02 0.00 0.00 55.97 56.68 8kme s LYS 135 Cb -0.30 -2.90 -0.01 0.00 -0.52 0.00 0.00 37.83 34.10 8kme s LYS 135 CO 0.34 0.49 0.08 0.41 -0.92 0.00 0.00 175.35 175.76 8kme n GLY 136 N 0.54 3.38 2.82 -3.33 0.00 -0.36 -4.84 105.19 103.40 8kme n GLY 136 Ca -0.05 -2.23 -0.15 0.00 0.00 0.00 0.00 46.02 43.59 8kme n GLY 136 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 8kme s ARG 137 N -3.68 0.07 0.06 1.61 3.52 -0.70 -0.97 118.95 118.86 8kme s ARG 137 Ca 0.12 0.09 0.07 0.00 -0.13 0.00 0.00 55.73 55.88 8kme s ARG 137 Cb 0.01 -0.23 -0.03 0.00 -1.56 0.00 0.00 34.95 33.13 8kme s ARG 137 CO 0.08 -0.10 -0.18 0.08 -0.81 0.00 0.00 175.30 174.37 8kme s VAL 138 N 0.68 2.79 0.02 7.11 1.01 -0.11 -1.67 120.40 130.24 8kme s VAL 138 Ca -0.06 -1.25 0.03 0.00 0.00 0.00 0.00 61.98 60.70 8kme s VAL 138 Cb -0.09 -2.19 -0.02 0.00 0.00 0.00 0.00 36.38 34.08 8kme s VAL 138 CO -0.02 0.29 -0.08 0.42 0.00 0.00 0.00 175.10 175.71 8kme s THR 139 N -0.96 0.64 0.00 3.92 -4.23 -1.25 -2.28 115.64 111.47 8kme s THR 139 Ca 0.15 -0.73 0.00 0.00 -1.18 0.00 0.00 61.69 59.93 8kme s THR 139 Cb -0.10 -0.61 0.00 0.00 1.34 0.00 0.00 72.50 73.12 8kme s THR 139 CO 0.06 -0.09 0.00 0.61 -0.54 0.00 0.00 174.62 174.66 8kme n GLY 140 N 2.15 0.09 0.92 3.99 0.00 -1.05 -4.47 105.19 106.82 8kme n GLY 140 Ca -0.18 -0.93 0.01 0.00 0.00 0.00 0.00 46.02 44.92 8kme n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 8kme n TRP 141 N -0.18 0.81 -2.12 1.61 8.01 -1.26 -1.74 117.44 122.58 8kme n TRP 141 Ca 0.00 -1.36 -0.28 0.00 -1.31 0.00 0.00 57.50 54.55 8kme n TRP 141 Cb 0.00 -0.39 0.18 0.00 -2.01 0.00 0.00 31.31 29.09 8kme n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 8kme s GLY 142 N -2.51 1.80 0.92 6.99 0.00 -1.26 -4.68 107.32 108.58 8kme s GLY 142 Ca 0.42 -1.44 -0.15 0.00 0.00 0.00 0.00 44.72 43.55 8kme s GLY 142 CO 0.01 -0.68 -0.16 0.70 0.00 0.00 0.00 173.10 172.98 8kme n ASN 143 N -3.59 -3.88 -0.00 1.64 3.02 0.06 -3.44 115.26 109.07 8kme n ASN 143 Ca 0.16 0.31 0.10 0.00 -0.03 0.00 0.00 54.58 55.12 8kme n ASN 143 Cb 0.60 -0.99 -0.09 0.00 -0.61 0.00 0.00 39.78 38.69 8kme n ASN 143 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 8kme n LEU 144 N 1.18 0.92 -3.91 3.41 4.77 -0.84 -1.67 117.00 120.87 8kme n LEU 144 Ca 0.03 -0.44 -0.10 0.00 -0.03 0.00 0.00 56.01 55.48 8kme n LEU 144 Cb 0.54 -0.02 -0.09 0.00 -2.33 0.00 0.00 43.42 41.52 8kme n LEU 144 CO 0.52 0.23 -0.19 -0.54 -1.33 0.00 0.00 177.39 176.08 8kme s LYS 145 N -3.02 0.60 0.18 3.23 -0.14 -1.26 -4.30 119.74 115.03 8kme s LYS 145 Ca 0.08 -0.70 -0.26 0.00 -1.36 0.00 0.00 55.97 53.73 8kme s LYS 145 Cb 0.16 0.24 0.04 0.00 -1.68 0.00 0.00 37.83 36.59 8kme s LYS 145 CO 0.86 -0.15 1.55 1.49 -0.76 0.00 0.00 175.35 178.33 8kme h GLU 146 N 3.68 -0.06 0.45 1.68 4.81 -1.91 -3.48 114.58 119.75 8kme h GLU 146 Ca -0.32 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 58.89 8kme h GLU 146 Cb 1.19 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.58 8kme h GLU 146 CO 0.49 -0.04 -0.22 1.79 -0.73 0.00 0.00 179.01 180.31 8kme h THR 147 N -0.06 0.00 0.00 0.32 1.35 -1.97 -3.45 112.91 109.10 8kme h THR 147 Ca 0.21 -0.05 0.00 0.00 -0.55 0.00 0.00 66.41 66.02 8kme h THR 147 Cb 0.50 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 66.92 8kme h THR 147 CO -0.90 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 174.98 8kme n GLY 150 N -0.98 0.00 3.06 5.82 0.00 -1.26 -5.00 105.19 106.83 8kme n GLY 150 Ca -0.07 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.73 8kme n GLY 150 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 8kme s GLN 151 N -0.21 1.12 0.66 1.61 -0.21 -1.26 -1.98 119.66 119.39 8kme s GLN 151 Ca 0.00 -0.42 -0.12 0.00 0.02 0.00 0.00 55.36 54.84 8kme s GLN 151 Cb 0.00 -1.04 -0.01 0.00 1.00 0.00 0.00 33.01 32.96 8kme s GLN 151 CO 0.00 0.20 1.06 -1.25 -2.12 0.00 0.00 175.29 173.18 8kme s PRO 152 N -0.05 3.04 -0.10 2.91 0.05 -1.26 -4.97 135.00 134.62 8kme s PRO 152 Ca 0.00 1.04 -0.15 0.00 0.05 0.00 0.00 61.00 61.95 8kme s PRO 152 Cb -0.07 -2.00 -0.27 0.00 0.05 0.00 0.00 34.50 32.20 8kme s PRO 152 CO 0.00 -1.02 0.54 0.66 0.05 0.00 0.00 177.00 177.24 8kme h SER 153 N -0.34 0.40 -2.59 6.66 4.64 -1.98 -3.44 113.55 116.89 8kme h SER 153 Ca -0.45 -0.86 -0.54 0.00 -0.47 0.00 0.00 61.79 59.47 8kme h SER 153 Cb 1.21 -0.13 -0.14 0.00 -0.31 0.00 0.00 62.40 63.03 8kme h SER 153 CO 0.57 1.66 -0.72 -0.69 -0.87 0.00 0.00 176.83 176.78 8kme s VAL 154 N -2.49 2.03 0.24 0.95 1.01 -1.26 -1.63 120.40 119.25 8kme s VAL 154 Ca -0.20 -2.25 -0.30 0.00 0.00 0.00 0.00 61.98 59.23 8kme s VAL 154 Cb 0.05 -2.35 -0.14 0.00 0.00 0.00 0.00 36.38 33.94 8kme s VAL 154 CO 0.77 -0.38 1.11 -0.11 0.00 0.00 0.00 175.10 176.49 8kme n LEU 155 N -0.59 1.86 -4.83 3.92 7.94 -0.12 -4.84 117.00 120.35 8kme n LEU 155 Ca -0.06 1.16 -0.23 0.00 -1.11 0.00 0.00 56.01 55.77 8kme n LEU 155 Cb 0.62 -1.28 -0.04 0.00 0.53 0.00 0.00 43.42 43.24 8kme n LEU 155 CO 0.39 -1.26 -0.17 -1.10 -1.11 0.00 0.00 177.39 174.14 8kme s GLN 156 N -1.02 2.97 -0.06 1.96 -1.52 -0.71 -0.60 119.66 120.67 8kme s GLN 156 Ca 0.65 -0.97 -0.09 0.00 -1.95 0.00 0.00 55.36 53.00 8kme s GLN 156 Cb -0.75 -2.62 0.02 0.00 -0.22 0.00 0.00 33.01 29.44 8kme s GLN 156 CO 0.56 0.43 0.22 0.08 -0.25 0.00 0.00 175.29 176.33 8kme s VAL 157 N -2.01 0.02 -0.22 1.09 1.01 0.16 -2.52 120.40 117.94 8kme s VAL 157 Ca 0.32 -0.17 -0.15 0.00 0.00 0.00 0.00 61.98 61.98 8kme s VAL 157 Cb -0.09 -0.37 0.06 0.00 0.00 0.00 0.00 36.38 35.99 8kme s VAL 157 CO 0.25 -0.09 0.56 0.54 0.00 0.00 0.00 175.10 176.35 8kme s VAL 158 N -0.30 -0.01 -0.26 2.92 0.11 -0.97 -0.77 120.40 121.13 8kme s VAL 158 Ca -0.04 0.03 -0.13 0.00 -2.93 0.00 0.00 61.98 58.91 8kme s VAL 158 Cb -0.03 -0.81 -0.04 0.00 -1.53 0.00 0.00 36.38 33.97 8kme s VAL 158 CO 0.01 0.01 0.29 0.20 -3.33 0.00 0.00 175.10 172.28 8kme s ASN 159 N 1.10 6.18 0.20 3.54 0.01 -1.26 -0.93 114.94 123.78 8kme s ASN 159 Ca -0.06 0.20 0.11 0.00 -0.71 0.00 0.00 52.86 52.39 8kme s ASN 159 Cb -0.06 -2.17 -0.04 0.00 0.41 0.00 0.00 41.25 39.39 8kme s ASN 159 CO -0.11 -0.09 -0.22 -0.76 -1.51 0.00 0.00 177.10 174.42 8kme s LEU 160 N 1.72 2.46 0.34 0.60 1.43 -0.14 -4.90 118.68 120.17 8kme s LEU 160 Ca 0.12 -0.89 -0.21 0.00 -1.03 0.00 0.00 54.13 52.12 8kme s LEU 160 Cb -0.15 -1.07 -0.10 0.00 0.03 0.00 0.00 46.19 44.90 8kme s LEU 160 CO 0.09 0.07 0.85 -2.16 0.23 0.00 0.00 176.35 175.43 8kme s PRO 161 N -2.82 4.27 0.13 1.29 0.04 -1.26 -1.22 135.00 135.43 8kme s PRO 161 Ca 0.21 1.02 -0.27 0.00 0.04 0.00 0.00 61.00 62.00 8kme s PRO 161 Cb -0.07 -2.54 -0.07 0.00 0.04 0.00 0.00 34.50 31.86 8kme s PRO 161 CO 0.10 0.18 0.83 0.42 0.04 0.00 0.00 177.00 178.56 8kme s ILE 162 N -1.86 4.47 -0.10 0.56 1.01 0.01 -1.44 121.20 123.86 8kme s ILE 162 Ca 0.53 1.80 -0.02 0.00 0.00 0.00 0.00 60.65 62.96 8kme s ILE 162 Cb -0.13 -4.19 -0.03 0.00 0.01 0.00 0.00 42.46 38.12 8kme s ILE 162 CO 0.18 0.43 -0.00 -0.69 0.00 0.00 0.00 174.94 174.86 8kme s VAL 163 N -0.59 4.25 0.32 2.92 1.01 -1.01 -0.81 120.40 126.50 8kme s VAL 163 Ca 0.39 -0.26 -0.29 0.00 0.00 0.00 0.00 61.98 61.82 8kme s VAL 163 Cb -0.23 -2.80 -0.11 0.00 0.00 0.00 0.00 36.38 33.24 8kme s VAL 163 CO 0.27 0.59 1.56 -1.61 0.00 0.00 0.00 175.10 175.91 8kme s GLU 164 N -0.71 4.12 0.30 2.72 8.01 -1.26 -4.58 118.70 127.31 8kme s GLU 164 Ca 0.11 2.58 0.07 0.00 0.01 0.00 0.00 54.97 57.74 8kme s GLU 164 Cb -0.12 -3.00 0.78 0.00 -4.31 0.00 0.00 34.13 27.48 8kme s GLU 164 CO 0.02 -0.60 1.75 0.07 0.01 0.00 0.00 175.26 176.50 8kme h ARG 165 N 4.26 0.62 -0.58 1.61 0.11 -1.98 -1.31 114.38 117.10 8kme h ARG 165 Ca -0.48 -0.04 0.10 0.00 0.10 0.00 0.00 59.98 59.66 8kme h ARG 165 Cb 1.23 -0.14 -0.08 0.00 1.11 0.00 0.00 29.97 32.09 8kme h ARG 165 CO 0.75 0.41 0.15 -1.35 0.10 0.00 0.00 179.97 180.02 8kme h PRO 166 N 0.63 0.29 -0.67 0.08 0.11 -2.00 -1.03 132.00 129.41 8kme h PRO 166 Ca 0.60 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 66.62 8kme h PRO 166 Cb 1.03 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 32.05 8kme h PRO 166 CO -0.44 0.19 0.14 0.28 -0.21 0.00 0.00 178.00 177.96 8kme h VAL 167 N 0.30 1.26 -0.35 3.15 2.07 -1.61 -1.33 116.25 119.73 8kme h VAL 167 Ca 0.30 -0.98 -0.01 0.00 0.82 0.00 0.00 66.70 66.83 8kme h VAL 167 Cb 0.42 0.59 -0.02 0.00 -1.52 0.00 0.00 31.29 30.77 8kme h VAL 167 CO -0.36 0.37 0.18 0.00 0.02 0.00 0.00 177.57 177.78 8kme h LYS 169 N 0.44 0.05 -0.36 0.00 1.57 -0.92 -2.50 116.57 114.85 8kme h LYS 169 Ca 0.12 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.90 8kme h LYS 169 Cb 0.09 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.39 8kme h LYS 169 CO -0.02 0.04 0.00 -0.25 -0.57 0.00 0.00 179.45 178.65 8kme n ASP 170 N -5.07 0.36 -0.05 0.86 8.00 -0.53 -2.59 116.55 117.54 8kme n ASP 170 Ca -0.06 -1.83 0.03 0.00 0.71 0.00 0.00 54.79 53.64 8kme n ASP 170 Cb 0.04 -0.18 -0.03 0.00 -0.02 0.00 0.00 41.12 40.93 8kme n ASP 170 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 8kme n SER 171 N -0.29 0.53 -4.17 -2.24 3.41 -0.94 -5.02 113.62 104.90 8kme n SER 171 Ca 0.00 -0.77 -0.11 0.00 -0.26 0.00 0.00 58.87 57.74 8kme n SER 171 Cb 0.09 0.83 -0.10 0.00 -0.26 0.00 0.00 64.21 64.77 8kme n SER 171 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 8kme s THR 172 N -1.46 0.62 -2.90 6.66 -1.32 -1.07 -4.89 115.64 111.30 8kme s THR 172 Ca 0.04 -1.93 0.24 0.00 -1.21 0.00 0.00 61.69 58.82 8kme s THR 172 Cb 0.05 -1.74 0.21 0.00 -1.51 0.00 0.00 72.50 69.51 8kme s THR 172 CO 0.24 -0.81 1.26 -1.14 -2.21 0.00 0.00 174.62 171.96 8kme n ARG 173 N -0.06 2.29 -2.97 7.08 0.63 -1.26 -4.93 116.66 117.45 8kme n ARG 173 Ca -0.11 -1.94 -0.36 0.00 -0.92 0.00 0.00 57.85 54.51 8kme n ARG 173 Cb 0.61 -1.46 -0.06 0.00 0.45 0.00 0.00 32.46 32.00 8kme n ARG 173 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 8kme s ILE 174 N -1.91 4.42 -0.35 5.15 1.01 -1.26 -4.99 121.20 123.27 8kme s ILE 174 Ca 0.29 1.50 -0.29 0.00 0.00 0.00 0.00 60.65 62.15 8kme s ILE 174 Cb 0.20 -3.90 -0.00 0.00 0.01 0.00 0.00 42.46 38.76 8kme s ILE 174 CO 0.30 0.16 1.44 -0.60 0.00 0.00 0.00 174.94 176.24 8kme s ARG 175 N -2.07 3.68 -0.31 2.79 3.52 -1.26 -4.99 118.95 120.31 8kme s ARG 175 Ca 0.47 1.17 -0.20 0.00 -0.13 0.00 0.00 55.73 57.03 8kme s ARG 175 Cb -0.17 -4.00 -0.01 0.00 -1.56 0.00 0.00 34.95 29.21 8kme s ARG 175 CO 0.22 -1.43 0.64 0.42 -0.81 0.00 0.00 175.30 174.33 8kme s ILE 176 N 5.24 4.93 0.61 4.11 -1.09 -1.26 -4.81 121.20 128.92 8kme s ILE 176 Ca 0.63 0.85 0.07 0.00 -2.23 0.00 0.00 60.65 59.97 8kme s ILE 176 Cb -0.17 -4.01 0.09 0.00 -1.58 0.00 0.00 42.46 36.79 8kme s ILE 176 CO 0.30 -0.16 0.84 0.42 -1.23 0.00 0.00 174.94 175.10 8kme s THR 177 N 2.63 2.19 0.19 2.92 -4.23 -1.26 -5.03 115.64 113.05 8kme s THR 177 Ca 0.25 -0.89 0.05 0.00 -1.18 0.00 0.00 61.69 59.93 8kme s THR 177 Cb -0.15 -2.30 -0.12 0.00 1.34 0.00 0.00 72.50 71.28 8kme s THR 177 CO 0.12 0.00 1.44 0.44 -0.54 0.00 0.00 174.62 176.08 8kme h ASP 178 N 0.01 0.15 0.00 3.99 3.32 -2.02 -2.98 116.42 118.89 8kme h ASP 178 Ca -0.32 -0.12 0.00 0.00 0.02 0.00 0.00 57.03 56.61 8kme h ASP 178 Cb 1.28 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.79 8kme h ASP 178 CO 0.41 0.89 0.00 0.59 -1.72 0.00 0.00 179.24 179.41 8kme n ASN 179 N -3.67 0.74 -3.97 6.45 3.02 -1.26 -4.76 115.26 111.81 8kme n ASN 179 Ca -0.02 -1.37 -0.12 0.00 -0.03 0.00 0.00 54.58 53.04 8kme n ASN 179 Cb 0.76 -0.34 -0.12 0.00 -0.61 0.00 0.00 39.78 39.46 8kme n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 8kme s MET 180 N -0.94 0.31 0.06 3.52 -1.94 -1.13 -1.60 119.30 117.58 8kme s MET 180 Ca 0.00 -0.44 0.00 0.00 -1.71 0.00 0.00 55.69 53.54 8kme s MET 180 Cb 0.00 -0.10 -0.04 0.00 2.01 0.00 0.00 34.83 36.70 8kme s MET 180 CO 0.00 0.01 -0.05 -0.59 -0.01 0.00 0.00 175.02 174.38 8kme s PHE 181 N -0.89 0.63 0.07 -0.03 -0.12 -0.93 -4.84 117.98 111.87 8kme s PHE 181 Ca -0.08 -0.88 0.06 0.00 -0.05 0.00 0.00 56.93 55.98 8kme s PHE 181 Cb -0.06 -0.41 -0.03 0.00 -0.63 0.00 0.00 43.02 41.89 8kme s PHE 181 CO -0.00 -0.24 -0.15 0.00 -0.05 0.00 0.00 175.22 174.77 8kme s ALA 183 N -1.23 -0.50 0.00 0.00 0.00 -0.47 -2.40 121.76 117.16 8kme s ALA 183 Ca -0.01 -0.04 0.00 0.00 0.00 0.00 0.00 51.96 51.91 8kme s ALA 183 Cb -0.10 0.18 0.00 0.00 0.00 0.00 0.00 23.12 23.20 8kme s ALA 183 CO 0.02 -0.30 0.00 0.41 0.00 0.00 0.00 175.76 175.90 8kme n GLY 184 N 1.04 0.99 3.88 0.00 0.00 -0.52 -1.80 105.19 108.77 8kme n GLY 184 Ca -0.21 -1.54 -0.33 0.00 0.00 0.00 0.00 46.02 43.94 8kme n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 8kme s TYR 184 N -1.70 3.51 0.51 1.61 2.02 -1.26 -4.34 117.35 117.68 8kme s TYR 184 Ca 0.00 0.78 -0.19 0.00 -0.37 0.00 0.00 57.07 57.29 8kme s TYR 184 Cb 0.00 -2.17 -0.08 0.00 -0.40 0.00 0.00 41.96 39.31 8kme s TYR 184 CO 0.00 0.41 1.04 0.15 -1.57 0.00 0.00 175.55 175.58 8kme s LYS 185 N -2.40 3.72 0.38 -0.62 -0.14 -1.26 -4.77 119.74 114.65 8kme s LYS 185 Ca 0.40 1.31 0.06 0.00 -1.36 0.00 0.00 55.97 56.38 8kme s LYS 185 Cb -0.13 -2.09 0.35 0.00 -1.68 0.00 0.00 37.83 34.29 8kme s LYS 185 CO 0.21 -0.49 1.04 -1.35 -0.76 0.00 0.00 175.35 174.00 8kme h PRO 186 N 1.32 0.00 0.00 -1.68 0.11 -1.93 -1.42 132.00 128.41 8kme h PRO 186 Ca -0.49 0.00 -0.22 0.00 0.11 0.00 0.00 66.00 65.40 8kme h PRO 186 Cb 1.22 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.29 8kme h PRO 186 CO 0.59 0.00 -2.02 -3.47 -0.21 0.00 0.00 178.00 172.89 8kme n ASP 186 N -1.99 1.06 0.00 -2.05 2.03 -1.26 -4.60 116.55 109.73 8kme n ASP 186 Ca -0.00 0.00 0.01 0.00 0.52 0.00 0.00 54.79 55.32 8kme n ASP 186 Cb 0.60 1.12 0.08 0.00 -0.72 0.00 0.00 41.12 42.20 8kme n ASP 186 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 8kme n GLU 186 N -2.47 0.07 0.00 -0.67 1.02 -0.53 -4.81 120.64 113.24 8kme n GLU 186 Ca -0.20 0.14 0.00 0.00 -0.02 0.00 0.00 57.16 57.08 8kme n GLU 186 Cb 0.88 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.80 8kme n GLU 186 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 8kme n GLY 186 N -0.93 2.83 3.86 0.62 0.00 -1.26 -5.00 105.19 105.31 8kme n GLY 186 Ca 0.02 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.79 8kme n GLY 186 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 8kme s LYS 186 N -0.14 2.31 0.12 1.61 3.01 -1.26 -5.15 119.74 120.24 8kme s LYS 186 Ca 0.00 -1.88 -0.02 0.00 -1.01 0.00 0.00 55.97 53.07 8kme s LYS 186 Cb 0.00 -2.13 0.01 0.00 -1.01 0.00 0.00 37.83 34.70 8kme s LYS 186 CO 0.00 -0.41 0.19 2.89 0.51 0.00 0.00 175.35 178.53 8kme n ARG 187 N -1.60 0.27 0.00 1.68 1.85 -1.26 -4.79 116.66 112.81 8kme n ARG 187 Ca -0.01 -0.86 0.00 0.00 -1.00 0.00 0.00 57.85 55.99 8kme n ARG 187 Cb 0.64 0.89 0.00 0.00 -1.05 0.00 0.00 32.46 32.94 8kme n ARG 187 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 8kme n GLY 188 N -0.18 4.07 0.00 2.89 0.00 -1.24 -4.90 105.19 105.83 8kme n GLY 188 Ca -0.01 -1.62 0.00 0.00 0.00 0.00 0.00 46.02 44.39 8kme n GLY 188 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 8kme n ASP 189 N 0.00 0.00 -3.27 1.61 2.03 -1.12 -4.60 116.55 111.19 8kme n ASP 189 Ca 0.00 0.00 -0.21 0.00 0.52 0.00 0.00 54.79 55.10 8kme n ASP 189 Cb 0.00 0.00 0.17 0.00 -0.72 0.00 0.00 41.12 40.57 8kme n ASP 189 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 8kme n ALA 190 N -0.30 -2.23 -3.57 -1.67 0.00 -1.26 -1.34 120.51 110.14 8kme n ALA 190 Ca 0.00 -1.17 0.03 0.00 0.00 0.00 0.00 53.44 52.30 8kme n ALA 190 Cb 0.00 -0.08 0.02 0.00 0.00 0.00 0.00 19.45 19.39 8kme n ALA 190 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 8kme n GLU 192 N -0.43 1.72 0.00 0.00 2.13 -1.26 -2.07 120.64 120.72 8kme n GLU 192 Ca -0.03 0.61 0.00 0.00 0.66 0.00 0.00 57.16 58.39 8kme n GLU 192 Cb 0.39 -2.13 0.00 0.00 0.27 0.00 0.00 31.44 29.97 8kme n GLU 192 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 8kme n GLY 193 N 1.49 2.02 0.10 8.31 0.00 -1.26 -0.76 105.19 115.09 8kme n GLY 193 Ca 0.10 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.99 8kme n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 8kme h ASP 194 N 0.00 0.15 -2.24 1.61 3.32 -1.76 -3.32 116.42 114.18 8kme h ASP 194 Ca 0.00 -0.29 -0.57 0.00 0.02 0.00 0.00 57.03 56.19 8kme h ASP 194 Cb 0.00 -0.05 0.21 0.00 0.22 0.00 0.00 39.33 39.71 8kme h ASP 194 CO 0.00 1.26 -1.34 -1.54 -1.72 0.00 0.00 179.24 175.90 8kme n SER 195 N -3.22 -4.33 0.00 6.45 3.41 -1.26 -1.18 113.62 113.48 8kme n SER 195 Ca -0.19 0.42 0.00 0.00 -0.26 0.00 0.00 58.87 58.83 8kme n SER 195 Cb 1.04 -0.88 0.00 0.00 -0.26 0.00 0.00 64.21 64.12 8kme n SER 195 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 8kme n GLY 196 N 2.79 2.68 3.57 5.00 0.00 -1.08 -1.54 105.19 116.60 8kme n GLY 196 Ca 0.04 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.76 8kme n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 8kme s GLY 197 N -0.45 1.61 -0.07 -0.02 0.00 -0.33 -3.21 107.32 104.85 8kme s GLY 197 Ca 0.00 0.23 -0.13 0.00 0.00 0.00 0.00 44.72 44.82 8kme s GLY 197 CO 0.00 0.81 0.32 2.56 0.00 0.00 0.00 173.10 176.80 8kme s PRO 198 N -4.52 3.92 -0.28 2.90 0.04 -1.26 -1.00 135.00 134.80 8kme s PRO 198 Ca 0.68 0.21 -0.08 0.00 0.04 0.00 0.00 61.00 61.85 8kme s PRO 198 Cb -0.24 -3.28 -0.02 0.00 0.04 0.00 0.00 34.50 31.00 8kme s PRO 198 CO 0.62 0.57 0.11 0.12 0.04 0.00 0.00 177.00 178.45 8kme s PHE 199 N -0.59 3.13 0.14 0.56 2.19 0.16 -3.86 117.98 119.70 8kme s PHE 199 Ca 0.20 -0.52 0.08 0.00 0.33 0.00 0.00 56.93 57.02 8kme s PHE 199 Cb -0.15 -2.29 -0.04 0.00 -1.31 0.00 0.00 43.02 39.24 8kme s PHE 199 CO 0.09 -0.41 -0.17 0.14 1.83 0.00 0.00 175.22 176.69 8kme s VAL 200 N 1.61 1.65 0.11 3.12 -7.23 -0.67 -0.83 120.40 118.16 8kme s VAL 200 Ca 0.05 -1.80 0.03 0.00 -1.81 0.00 0.00 61.98 58.45 8kme s VAL 200 Cb -0.16 -1.70 -0.04 0.00 0.56 0.00 0.00 36.38 35.04 8kme s VAL 200 CO 0.05 -0.31 -0.08 -0.04 -0.31 0.00 0.00 175.10 174.41 8kme s MET 201 N -2.62 0.88 -0.22 4.82 -1.94 0.12 -1.71 119.30 118.64 8kme s MET 201 Ca 0.12 -1.30 -0.07 0.00 -1.71 0.00 0.00 55.69 52.73 8kme s MET 201 Cb -0.06 -0.39 -0.04 0.00 2.01 0.00 0.00 34.83 36.36 8kme s MET 201 CO 0.05 0.03 0.07 0.21 -0.01 0.00 0.00 175.02 175.37 8kme s LYS 202 N -3.47 3.81 0.02 2.03 2.20 -1.26 -0.22 119.74 122.85 8kme s LYS 202 Ca 0.11 -0.41 -0.30 0.00 -0.36 0.00 0.00 55.97 55.00 8kme s LYS 202 Cb 0.02 -3.27 -0.06 0.00 -1.51 0.00 0.00 37.83 33.00 8kme s LYS 202 CO -0.02 0.04 1.50 0.45 -0.36 0.00 0.00 175.35 176.96 8kme s SER 203 N 1.01 6.75 0.00 1.43 0.15 0.50 -4.84 113.70 118.70 8kme s SER 203 Ca 0.04 2.25 0.26 0.00 0.70 0.00 0.00 55.95 59.20 8kme s SER 203 Cb -0.14 -2.56 1.46 0.00 -1.71 0.00 0.00 66.02 63.07 8kme s SER 203 CO 0.03 -0.79 1.90 -0.81 1.20 0.00 0.00 173.24 174.77 8kme n PRO 204 N 5.54 0.64 -0.12 5.44 -0.04 -1.26 -0.79 135.00 144.41 8kme n PRO 204 Ca 0.14 0.02 -0.24 0.00 -0.04 0.00 0.00 63.50 63.38 8kme n PRO 204 Cb 0.42 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.29 8kme n PRO 204 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 8kme n PHE 204 N -1.12 0.00 -0.49 0.54 3.72 -1.26 -4.69 117.46 114.17 8kme n PHE 204 Ca 0.17 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.62 8kme n PHE 204 Cb 0.14 -0.86 0.13 0.00 -0.94 0.00 0.00 39.48 37.94 8kme n PHE 204 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 8kme n ASN 204 N -3.89 2.71 -1.81 4.37 2.04 -1.24 -4.98 115.26 112.46 8kme n ASN 204 Ca -0.46 -2.45 -0.13 0.00 -0.44 0.00 0.00 54.58 51.09 8kme n ASN 204 Cb 0.85 -0.27 -0.04 0.00 -2.53 0.00 0.00 39.78 37.80 8kme n ASN 204 CO 0.00 0.00 0.00 0.59 -0.44 0.00 0.00 177.26 177.41 8kme n ASN 205 N -0.44 -3.76 -4.96 0.53 4.13 0.03 -4.95 115.26 105.84 8kme n ASN 205 Ca 0.11 0.26 -0.22 0.00 1.68 0.00 0.00 54.58 56.42 8kme n ASN 205 Cb 0.52 -3.37 -0.00 0.00 -1.54 0.00 0.00 39.78 35.39 8kme n ASN 205 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 8kme s ARG 206 N -3.90 3.25 -0.16 3.52 0.52 -1.24 -4.75 118.95 116.18 8kme s ARG 206 Ca 0.00 -0.63 -0.07 0.00 -0.52 0.00 0.00 55.73 54.51 8kme s ARG 206 Cb 0.00 -2.70 -0.04 0.00 0.52 0.00 0.00 34.95 32.72 8kme s ARG 206 CO 0.00 0.03 0.08 -1.58 0.02 0.00 0.00 175.30 173.85 8kme s TRP 207 N -2.31 3.33 -0.04 -0.53 0.52 -1.26 0.19 118.94 118.84 8kme s TRP 207 Ca 0.43 0.21 0.06 0.00 0.02 0.00 0.00 56.10 56.82 8kme s TRP 207 Cb -0.10 -2.03 -0.01 0.00 -1.15 0.00 0.00 33.47 30.18 8kme s TRP 207 CO 0.34 0.32 -0.22 0.71 0.02 0.00 0.00 176.95 178.13 8kme s TYR 208 N -0.05 2.09 -0.41 -1.98 2.02 0.70 -2.36 117.35 117.35 8kme s TYR 208 Ca 0.07 -0.55 -0.25 0.00 -0.37 0.00 0.00 57.07 55.98 8kme s TYR 208 Cb -0.12 -1.37 0.02 0.00 -0.40 0.00 0.00 41.96 40.09 8kme s TYR 208 CO 0.01 -0.14 0.88 -1.14 -1.57 0.00 0.00 175.55 173.58 8kme s GLN 209 N -0.22 3.65 -0.04 -0.62 0.74 -0.37 0.15 119.66 122.95 8kme s GLN 209 Ca 0.00 0.27 0.13 0.00 0.05 0.00 0.00 55.36 55.82 8kme s GLN 209 Cb -0.11 -3.87 -0.22 0.00 1.10 0.00 0.00 33.01 29.91 8kme s GLN 209 CO 0.02 -1.06 0.65 -1.33 -0.55 0.00 0.00 175.29 173.02 8kme n MET 210 N 6.85 0.63 -4.16 1.67 2.81 -0.01 -4.35 117.12 120.56 8kme n MET 210 Ca 0.05 0.27 -0.12 0.00 -1.81 0.00 0.00 57.70 56.10 8kme n MET 210 Cb 0.48 -1.78 -0.09 0.00 -0.71 0.00 0.00 33.22 31.12 8kme n MET 210 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 8kme s GLY 211 N -5.09 1.27 -0.12 3.03 0.00 -0.99 -2.73 107.32 102.69 8kme s GLY 211 Ca -0.05 -1.54 0.01 0.00 0.00 0.00 0.00 44.72 43.14 8kme s GLY 211 CO 0.82 -1.24 -0.13 -0.42 0.00 0.00 0.00 173.10 172.13 8kme s ILE 212 N -4.11 1.40 -0.09 0.90 1.01 -0.86 0.37 121.20 119.82 8kme s ILE 212 Ca 0.36 -0.55 -0.39 0.00 0.00 0.00 0.00 60.65 60.07 8kme s ILE 212 Cb 0.05 -1.32 -0.16 0.00 0.01 0.00 0.00 42.46 41.04 8kme s ILE 212 CO 0.12 0.43 1.51 0.52 0.00 0.00 0.00 174.94 177.51 8kme n VAL 213 N 4.57 0.13 0.00 2.92 0.31 -0.17 -0.94 118.33 125.16 8kme n VAL 213 Ca -0.17 -0.02 -0.01 0.00 -0.01 0.00 0.00 64.34 64.13 8kme n VAL 213 Cb 0.50 -0.95 -0.00 0.00 -0.91 0.00 0.00 33.84 32.48 8kme n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 8kme n SER 214 N 3.74 0.46 -3.56 4.52 2.88 0.71 -2.65 113.62 119.72 8kme n SER 214 Ca 0.22 0.07 -0.05 0.00 -1.33 0.00 0.00 58.87 57.78 8kme n SER 214 Cb 0.15 -0.25 -0.00 0.00 -0.75 0.00 0.00 64.21 63.36 8kme n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 8kme s TRP 215 N -1.43 -0.06 -0.23 0.66 1.48 -0.64 -4.92 118.94 113.79 8kme s TRP 215 Ca -0.03 -0.37 -0.31 0.00 -1.06 0.00 0.00 56.10 54.33 8kme s TRP 215 Cb 0.00 0.71 0.16 0.00 -1.16 0.00 0.00 33.47 33.19 8kme s TRP 215 CO 0.04 -1.10 1.24 0.20 -4.06 0.00 0.00 176.95 173.27 8kme s GLY 216 N -3.04 -0.09 -0.81 3.67 0.00 -1.26 0.11 107.32 105.90 8kme s GLY 216 Ca 0.14 2.34 -0.19 0.00 0.00 0.00 0.00 44.72 47.01 8kme s GLY 216 CO 0.06 0.95 1.00 -0.54 0.00 0.00 0.00 173.10 174.57 8kme s GLU 217 N -1.37 3.41 0.69 2.90 2.02 -1.26 -4.82 118.70 120.26 8kme s GLU 217 Ca 0.06 -1.55 0.00 0.00 0.02 0.00 0.00 54.97 53.50 8kme s GLU 217 Cb -0.01 -4.63 0.00 0.00 0.10 0.00 0.00 34.13 29.60 8kme s GLU 217 CO -0.05 -1.71 0.00 0.41 0.02 0.00 0.00 175.26 173.94 8kme n GLY 219 N 5.30 -1.32 2.70 -1.39 0.00 -1.26 -4.78 105.19 104.44 8kme n GLY 219 Ca 0.12 -1.75 -0.21 0.00 0.00 0.00 0.00 46.02 44.18 8kme n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 8kme n ASP 221 N 5.30 -4.87 -4.85 0.00 2.03 -1.26 -4.43 116.55 108.47 8kme n ASP 221 Ca -0.06 -0.34 -0.35 0.00 0.52 0.00 0.00 54.79 54.56 8kme n ASP 221 Cb 0.49 -3.48 -0.06 0.00 -0.72 0.00 0.00 41.12 37.36 8kme n ASP 221 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 8kme s ARG 221 N -5.83 3.95 -0.02 -0.67 0.52 -1.26 -4.97 118.95 110.67 8kme s ARG 221 Ca 0.37 0.46 -0.30 0.00 -0.52 0.00 0.00 55.73 55.75 8kme s ARG 221 Cb -0.16 -2.88 -0.05 0.00 0.52 0.00 0.00 34.95 32.37 8kme s ARG 221 CO 0.46 0.45 1.49 -0.51 0.02 0.00 0.00 175.30 177.21 8kme s ASP 222 N -1.82 6.78 0.00 0.23 1.11 -1.26 -2.69 116.67 119.02 8kme s ASP 222 Ca 0.39 2.15 0.00 0.00 0.18 0.00 0.00 52.55 55.28 8kme s ASP 222 Cb -0.14 -2.55 0.00 0.00 1.07 0.00 0.00 42.92 41.30 8kme s ASP 222 CO 0.19 -0.80 0.00 0.61 1.18 0.00 0.00 175.17 176.35 8kme n GLY 223 N 3.82 0.47 2.89 0.21 0.00 -1.26 -4.92 105.19 106.40 8kme n GLY 223 Ca 0.15 -0.91 -0.15 0.00 0.00 0.00 0.00 46.02 45.10 8kme n GLY 223 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 8kme s LYS 224 N -2.72 0.28 0.25 1.61 1.02 -1.09 -4.85 119.74 114.24 8kme s LYS 224 Ca 0.00 -0.06 0.10 0.00 0.02 0.00 0.00 55.97 56.04 8kme s LYS 224 Cb 0.00 -0.33 -0.05 0.00 -0.52 0.00 0.00 37.83 36.93 8kme s LYS 224 CO 0.00 0.00 -0.18 0.71 -0.92 0.00 0.00 175.35 174.96 8kme s TYR 225 N 0.28 2.08 0.18 3.18 2.02 -1.26 -4.58 117.35 119.26 8kme s TYR 225 Ca -0.03 -0.42 -0.11 0.00 -0.37 0.00 0.00 57.07 56.15 8kme s TYR 225 Cb -0.05 -0.92 -0.07 0.00 -0.40 0.00 0.00 41.96 40.51 8kme s TYR 225 CO -0.01 0.59 0.53 0.20 -1.57 0.00 0.00 175.55 175.29 8kme s GLY 226 N -3.42 2.35 -0.13 0.71 0.00 -0.74 -4.57 107.32 101.52 8kme s GLY 226 Ca 0.27 -0.24 -0.01 0.00 0.00 0.00 0.00 44.72 44.74 8kme s GLY 226 CO 0.12 -0.05 -0.09 -1.36 0.00 0.00 0.00 173.10 171.72 8kme s PHE 227 N -1.65 2.90 0.02 1.90 0.40 0.12 -1.36 117.98 120.30 8kme s PHE 227 Ca 0.43 -0.41 0.07 0.00 -0.60 0.00 0.00 56.93 56.41 8kme s PHE 227 Cb -0.13 -1.86 -0.02 0.00 0.51 0.00 0.00 43.02 41.52 8kme s PHE 227 CO 0.20 -0.06 -0.21 0.71 0.70 0.00 0.00 175.22 176.56 8kme s TYR 228 N 0.17 1.82 0.18 0.36 1.51 -0.28 -0.21 117.35 120.91 8kme s TYR 228 Ca -0.05 -0.36 -0.31 0.00 -1.01 0.00 0.00 57.07 55.34 8kme s TYR 228 Cb -0.14 -1.13 -0.09 0.00 -0.11 0.00 0.00 41.96 40.49 8kme s TYR 228 CO 0.04 0.04 1.45 0.99 -1.11 0.00 0.00 175.55 176.96 8kme s THR 229 N -0.66 2.88 -0.78 -0.71 2.01 -0.11 -2.19 115.64 116.08 8kme s THR 229 Ca 0.08 0.67 -0.26 0.00 0.31 0.00 0.00 61.69 62.49 8kme s THR 229 Cb -0.08 -3.43 0.04 0.00 0.01 0.00 0.00 72.50 69.03 8kme s THR 229 CO 0.01 0.08 1.28 -2.28 -0.69 0.00 0.00 174.62 173.01 8kme s HIS 230 N 0.65 2.35 0.17 4.92 2.46 -0.62 -2.02 115.29 123.19 8kme s HIS 230 Ca 0.64 -0.21 -0.11 0.00 0.47 0.00 0.00 55.06 55.84 8kme s HIS 230 Cb -0.40 -4.61 0.06 0.00 -0.13 0.00 0.00 32.58 27.49 8kme s HIS 230 CO 0.35 -2.02 1.66 0.28 -2.47 0.00 0.00 174.74 172.54 8kme h VAL 231 N 6.14 1.26 -0.63 0.89 2.07 -1.84 -2.85 116.25 121.28 8kme h VAL 231 Ca -0.21 -0.98 -0.07 0.00 0.82 0.00 0.00 66.70 66.26 8kme h VAL 231 Cb 1.05 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 31.55 8kme h VAL 231 CO 1.29 0.36 0.11 0.15 0.02 0.00 0.00 177.57 179.51 8kme h PHE 232 N 0.86 1.08 0.00 1.57 3.57 -1.87 -1.50 116.94 120.66 8kme h PHE 232 Ca 0.18 -0.14 0.00 0.00 3.53 0.00 0.00 57.97 61.54 8kme h PHE 232 Cb 0.42 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 38.85 8kme h PHE 232 CO 0.03 0.91 0.00 0.00 -2.23 0.00 0.00 178.31 177.02 8kme h ARG 233 N 0.97 0.00 -0.43 1.11 2.47 -1.92 -2.59 114.38 113.99 8kme h ARG 233 Ca 0.20 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.92 8kme h ARG 233 Cb 0.40 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.72 8kme h ARG 233 CO 0.01 0.00 0.00 1.28 0.56 0.00 0.00 179.97 181.82 8kme n LEU 234 N -2.93 3.30 -0.05 3.04 4.77 -0.65 -4.80 117.00 119.68 8kme n LEU 234 Ca 0.00 -2.10 -0.06 0.00 -0.03 0.00 0.00 56.01 53.83 8kme n LEU 234 Cb 0.26 -0.32 -0.04 0.00 -2.33 0.00 0.00 43.42 40.99 8kme n LEU 234 CO 0.25 0.78 0.50 0.50 -1.33 0.00 0.00 177.39 178.09 8kme h LYS 235 N 2.57 -0.16 -0.50 3.23 3.11 -0.90 -2.15 116.57 121.78 8kme h LYS 235 Ca 0.00 0.01 0.09 0.00 -2.81 0.00 0.00 60.65 57.94 8kme h LYS 235 Cb 0.87 0.04 -0.03 0.00 -1.00 0.00 0.00 32.23 32.11 8kme h LYS 235 CO 0.03 -0.11 0.34 0.87 -2.81 0.00 0.00 179.45 177.77 8kme h LYS 236 N -0.16 0.30 0.45 1.90 6.56 -1.87 0.44 116.57 124.19 8kme h LYS 236 Ca 0.03 -0.02 -0.02 0.00 -1.06 0.00 0.00 60.65 59.58 8kme h LYS 236 Cb 0.24 -0.07 0.00 0.00 -0.57 0.00 0.00 32.23 31.84 8kme h LYS 236 CO -0.24 0.20 -0.22 2.35 -2.06 0.00 0.00 179.45 179.48 8kme h TRP 237 N 0.31 -0.56 -0.30 -1.35 7.01 -1.85 -2.26 115.95 116.94 8kme h TRP 237 Ca 0.23 -0.01 0.07 0.00 2.11 0.00 0.00 58.89 61.28 8kme h TRP 237 Cb 0.50 0.19 -0.08 0.00 -2.10 0.00 0.00 29.16 27.66 8kme h TRP 237 CO -0.00 -0.25 -0.35 0.82 -2.79 0.00 0.00 178.44 175.87 8kme h ILE 238 N -0.84 0.22 -0.27 2.65 2.04 -0.73 -1.78 117.51 118.80 8kme h ILE 238 Ca -0.06 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.86 8kme h ILE 238 Cb 0.56 0.22 -0.07 0.00 -0.74 0.00 0.00 36.82 36.80 8kme h ILE 238 CO 0.10 0.00 -0.16 1.56 0.00 0.00 0.00 178.15 179.65 8kme h GLN 239 N -0.33 -0.13 -1.15 2.37 4.20 -0.19 -2.43 115.11 117.45 8kme h GLN 239 Ca 0.14 0.01 0.32 0.00 0.06 0.00 0.00 58.65 59.18 8kme h GLN 239 Cb 0.56 0.03 -0.09 0.00 0.30 0.00 0.00 27.48 28.28 8kme h GLN 239 CO -0.48 -0.09 0.77 -0.22 -0.67 0.00 0.00 178.83 178.14 8kme h LYS 240 N -0.14 0.21 0.15 1.46 3.64 -0.77 -0.32 116.57 120.81 8kme h LYS 240 Ca 0.15 -0.01 -0.33 0.00 -1.27 0.00 0.00 60.65 59.19 8kme h LYS 240 Cb 0.36 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.13 8kme h LYS 240 CO -0.36 0.14 -1.61 -0.24 -2.27 0.00 0.00 179.45 175.11 8kme h VAL 241 N 0.22 1.08 0.02 2.00 3.04 -0.85 0.37 116.25 122.13 8kme h VAL 241 Ca 0.63 -2.68 0.00 0.00 -1.01 0.00 0.00 66.70 63.64 8kme h VAL 241 Cb 1.95 2.77 -0.00 0.00 -2.01 0.00 0.00 31.29 34.00 8kme h VAL 241 CO -0.23 0.83 -0.03 0.40 -1.01 0.00 0.00 177.57 177.53 8kme h ILE 242 N 0.09 0.94 0.11 3.17 5.03 -1.14 -1.53 117.51 124.17 8kme h ILE 242 Ca -0.28 0.00 -0.01 0.00 -0.12 0.00 0.00 64.86 64.45 8kme h ILE 242 Cb 2.06 0.94 0.00 0.00 -3.03 0.00 0.00 36.82 36.78 8kme h ILE 242 CO 0.17 0.00 -0.05 0.44 -0.68 0.00 0.00 178.15 178.03 8kme h ASP 243 N -0.06 -0.12 0.00 1.72 3.32 -1.21 -3.15 116.42 116.92 8kme h ASP 243 Ca 0.00 -0.44 0.00 0.00 0.02 0.00 0.00 57.03 56.61 8kme h ASP 243 Cb 0.06 0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.64 8kme h ASP 243 CO -0.01 0.50 0.58 1.56 -1.72 0.00 0.00 179.24 180.15 8kme h GLN 244 N -0.88 0.00 0.00 3.56 1.08 -0.28 -3.51 115.11 115.09 8kme h GLN 244 Ca -0.01 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.19 8kme h GLN 244 Cb 0.55 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.98 8kme h GLN 244 CO 0.02 0.00 0.00 1.19 -0.95 0.00 0.00 178.83 179.09