#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h0g s PHE 4 N 0.00 1.28 -0.26 1.38 0.08 0.08 -4.98 117.98 115.57 3h0g s PHE 4 Ca 0.00 -0.71 0.03 0.00 0.12 0.00 0.00 56.93 56.37 3h0g s PHE 4 Cb 0.00 -0.65 0.06 0.00 -0.57 0.00 0.00 43.02 41.86 3h0g s PHE 4 CO 0.00 0.10 -0.10 -1.17 -0.10 0.00 0.00 175.22 173.95 3h0g s LEU 5 N -3.00 3.32 0.32 -0.37 2.96 -1.26 -0.64 118.68 120.01 3h0g s LEU 5 Ca 0.15 -1.37 0.03 0.00 -0.22 0.00 0.00 54.13 52.71 3h0g s LEU 5 Cb 0.01 -1.48 -0.04 0.00 0.50 0.00 0.00 46.19 45.17 3h0g s LEU 5 CO 0.01 -0.20 0.13 -0.75 -1.32 0.00 0.00 176.35 174.22 3h0g s LYS 6 N 1.15 1.63 -0.19 1.98 2.20 -0.47 -4.94 119.74 121.10 3h0g s LYS 6 Ca -0.08 -1.93 -0.07 0.00 -0.36 0.00 0.00 55.97 53.53 3h0g s LYS 6 Cb -0.20 -0.33 -0.04 0.00 -1.51 0.00 0.00 37.83 35.75 3h0g s LYS 6 CO -0.05 -0.39 0.06 -1.21 -0.36 0.00 0.00 175.35 173.39 3h0g s GLU 7 N -3.85 3.92 0.33 4.03 2.02 -1.26 -0.76 118.70 123.14 3h0g s GLU 7 Ca 0.34 -0.37 0.05 0.00 0.02 0.00 0.00 54.97 55.01 3h0g s GLU 7 Cb 0.06 -3.21 -0.07 0.00 0.10 0.00 0.00 34.13 31.01 3h0g s GLU 7 CO 0.16 0.22 0.02 -0.51 0.02 0.00 0.00 175.26 175.18 3h0g s LEU 8 N 0.50 2.39 0.28 1.80 1.43 0.54 -4.96 118.68 120.64 3h0g s LEU 8 Ca 0.03 -1.33 0.09 0.00 -1.03 0.00 0.00 54.13 51.89 3h0g s LEU 8 Cb -0.13 -0.54 -0.05 0.00 0.03 0.00 0.00 46.19 45.50 3h0g s LEU 8 CO 0.01 -0.52 -0.14 -0.94 0.23 0.00 0.00 176.35 175.00 3h0g s SER 9 N -3.52 3.21 -0.28 2.29 1.04 -1.26 -1.36 113.70 113.83 3h0g s SER 9 Ca 0.35 -1.10 -0.25 0.00 0.48 0.00 0.00 55.95 55.43 3h0g s SER 9 Cb 0.08 -0.25 0.14 0.00 0.10 0.00 0.00 66.02 66.09 3h0g s SER 9 CO 0.15 -0.14 1.13 -0.22 0.98 0.00 0.00 173.24 175.15 3h0g s LEU 10 N -3.47 -0.35 -0.12 2.42 2.96 -0.83 -4.99 118.68 114.30 3h0g s LEU 10 Ca 0.29 0.65 -0.04 0.00 -0.22 0.00 0.00 54.13 54.80 3h0g s LEU 10 Cb -0.01 1.69 -0.04 0.00 0.50 0.00 0.00 46.19 48.34 3h0g s LEU 10 CO 0.13 -0.13 0.03 0.42 -1.32 0.00 0.00 176.35 175.48 3h0g s THR 11 N 0.08 4.52 -0.18 3.68 -4.23 -1.26 -1.02 115.64 117.23 3h0g s THR 11 Ca 0.04 -0.15 -0.02 0.00 -1.18 0.00 0.00 61.69 60.37 3h0g s THR 11 Cb -0.05 -2.96 -0.01 0.00 1.34 0.00 0.00 72.50 70.82 3h0g s THR 11 CO -0.08 0.55 -0.08 -0.63 -0.54 0.00 0.00 174.62 173.85 3h0g s ILE 12 N -0.40 3.31 -0.41 2.99 1.01 -0.90 -4.94 121.20 121.85 3h0g s ILE 12 Ca 0.08 -0.54 -0.08 0.00 0.00 0.00 0.00 60.65 60.11 3h0g s ILE 12 Cb -0.12 -2.45 0.08 0.00 0.01 0.00 0.00 42.46 39.98 3h0g s ILE 12 CO 0.02 0.48 0.23 -0.94 0.00 0.00 0.00 174.94 174.73 3h0g s SER 13 N 0.87 5.52 0.56 3.58 1.04 -1.26 -0.07 113.70 123.95 3h0g s SER 13 Ca -0.02 -1.57 0.01 0.00 0.48 0.00 0.00 55.95 54.86 3h0g s SER 13 Cb -0.15 -1.94 0.04 0.00 0.10 0.00 0.00 66.02 64.07 3h0g s SER 13 CO 0.01 -0.52 0.79 -0.22 0.98 0.00 0.00 173.24 174.28 3h0g s LEU 14 N 1.37 3.25 0.07 2.42 2.96 -0.38 -4.94 118.68 123.43 3h0g s LEU 14 Ca 0.03 -0.05 0.07 0.00 -0.22 0.00 0.00 54.13 53.96 3h0g s LEU 14 Cb -0.23 -2.80 -0.03 0.00 0.50 0.00 0.00 46.19 43.64 3h0g s LEU 14 CO 0.01 -1.19 -0.18 -2.28 -1.32 0.00 0.00 176.35 171.38 3h0g s HIS 15 N -2.79 1.57 0.27 5.38 2.46 -1.26 -3.56 115.29 117.36 3h0g s HIS 15 Ca 0.58 -0.40 -0.04 0.00 0.47 0.00 0.00 55.06 55.67 3h0g s HIS 15 Cb -0.10 -0.90 0.54 0.00 -0.13 0.00 0.00 32.58 32.00 3h0g s HIS 15 CO 0.39 0.11 1.60 -1.35 -2.47 0.00 0.00 174.74 173.02 3h0g h PRO 16 N 4.50 0.04 -0.71 2.88 0.11 -1.97 0.04 132.00 136.89 3h0g h PRO 16 Ca -0.43 -0.00 0.21 0.00 0.11 0.00 0.00 66.00 65.89 3h0g h PRO 16 Cb 1.18 -0.01 -0.03 0.00 0.11 0.00 0.00 31.00 32.25 3h0g h PRO 16 CO 0.42 0.03 0.90 0.66 -0.21 0.00 0.00 178.00 179.79 3h0g h SER 17 N 0.04 0.00 -0.61 -2.05 4.64 -1.95 -1.02 113.55 112.59 3h0g h SER 17 Ca 0.49 0.00 -0.43 0.00 -0.47 0.00 0.00 61.79 61.38 3h0g h SER 17 Cb 0.89 0.00 -0.30 0.00 -0.31 0.00 0.00 62.40 62.68 3h0g h SER 17 CO -0.84 0.00 -0.41 -1.22 -0.87 0.00 0.00 176.83 173.49 3h0g n TYR 18 N -3.34 2.15 -0.05 4.77 0.53 0.00 -4.67 117.16 116.56 3h0g n TYR 18 Ca 0.15 -2.13 -0.14 0.00 -1.02 0.00 0.00 57.90 54.76 3h0g n TYR 18 Cb 1.13 -0.51 -0.12 0.00 -1.03 0.00 0.00 39.34 38.81 3h0g n TYR 18 CO 0.00 0.00 0.00 0.74 -1.02 0.00 0.00 176.86 176.58 3h0g h PHE 19 N 1.79 0.03 0.00 -0.72 -1.00 -1.31 -3.43 116.94 112.31 3h0g h PHE 19 Ca 0.33 -0.02 0.00 0.00 2.81 0.00 0.00 57.97 61.09 3h0g h PHE 19 Cb 1.39 -0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.95 3h0g h PHE 19 CO 0.96 0.86 0.00 0.41 -1.61 0.00 0.00 178.31 178.93 3h0g n GLY 20 N 1.18 0.35 0.16 -1.45 0.00 -1.26 -3.86 105.19 100.31 3h0g n GLY 20 Ca -0.10 -0.27 0.02 0.00 0.00 0.00 0.00 46.02 45.67 3h0g n GLY 20 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3h0g n PRO 21 N 0.00 1.93 -1.54 1.61 -0.02 -1.26 -4.65 135.00 131.08 3h0g n PRO 21 Ca 0.00 -1.37 -0.01 0.00 -2.02 0.00 0.00 63.50 60.11 3h0g n PRO 21 Cb 0.00 -1.07 0.09 0.00 -0.02 0.00 0.00 33.50 32.50 3h0g n PRO 21 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3h0g n ARG 22 N -0.11 1.41 -0.20 -0.52 1.74 -1.26 -4.89 116.66 112.82 3h0g n ARG 22 Ca 0.03 -3.04 -0.04 0.00 -0.77 0.00 0.00 57.85 54.02 3h0g n ARG 22 Cb 0.23 -1.18 0.02 0.00 -1.02 0.00 0.00 32.46 30.51 3h0g n ARG 22 CO 0.00 0.00 0.00 1.98 -1.52 0.00 0.00 177.63 178.09 3h0g h MET 23 N 1.48 -0.14 -0.69 5.56 1.85 -1.83 -0.67 114.93 120.49 3h0g h MET 23 Ca -0.04 0.01 0.16 0.00 -0.61 0.00 0.00 59.70 59.22 3h0g h MET 23 Cb 1.44 0.03 -0.13 0.00 0.43 0.00 0.00 31.60 33.37 3h0g h MET 23 CO 0.19 -0.09 -0.08 1.04 -0.40 0.00 0.00 176.91 177.57 3h0g n GLN 24 N -5.44 -0.06 -0.03 0.39 6.02 -1.26 0.16 117.38 117.17 3h0g n GLN 24 Ca 0.05 1.06 -0.11 0.00 -0.01 0.00 0.00 57.00 57.98 3h0g n GLN 24 Cb 0.35 -1.63 -0.05 0.00 1.02 0.00 0.00 30.24 29.93 3h0g n GLN 24 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 177.06 175.61 3h0g h ASP 25 N 0.00 0.17 -0.14 1.08 3.32 -1.53 -2.21 116.42 117.11 3h0g h ASP 25 Ca 0.37 -0.12 0.03 0.00 0.02 0.00 0.00 57.03 57.33 3h0g h ASP 25 Cb 0.68 -0.04 -0.03 0.00 0.22 0.00 0.00 39.33 40.15 3h0g h ASP 25 CO -0.68 0.25 -0.07 1.88 -1.72 0.00 0.00 179.24 178.90 3h0g h TYR 26 N 0.08 -0.16 -0.80 4.55 0.05 0.16 0.68 116.97 121.54 3h0g h TYR 26 Ca 0.04 0.02 0.10 0.00 0.05 0.00 0.00 58.73 58.94 3h0g h TYR 26 Cb 0.12 0.09 -0.07 0.00 1.01 0.00 0.00 36.73 37.88 3h0g h TYR 26 CO -0.03 -0.11 0.44 -0.07 -1.05 0.00 0.00 178.16 177.34 3h0g h LEU 27 N -0.06 0.61 -0.41 3.88 3.38 -0.94 0.12 115.31 121.89 3h0g h LEU 27 Ca 0.08 0.06 -0.09 0.00 0.09 0.00 0.00 57.88 58.01 3h0g h LEU 27 Cb 0.18 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 3h0g h LEU 27 CO -0.18 0.34 -0.10 0.11 0.09 0.00 0.00 178.44 178.70 3h0g h LYS 28 N 0.73 0.79 -0.74 1.13 1.57 -0.80 -1.75 116.57 117.50 3h0g h LYS 28 Ca 0.39 -0.31 -0.05 0.00 -1.87 0.00 0.00 60.65 58.82 3h0g h LYS 28 Cb 0.39 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.63 3h0g h LYS 28 CO -0.26 0.92 0.26 0.00 -0.57 0.00 0.00 179.45 179.80 3h0g h ALA 29 N 0.85 0.96 -0.51 3.86 0.00 -0.05 -2.31 119.26 122.07 3h0g h ALA 29 Ca 0.10 -0.21 -0.11 0.00 0.00 0.00 0.00 54.91 54.69 3h0g h ALA 29 Cb 0.63 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 3h0g h ALA 29 CO 0.04 0.62 -0.12 0.87 0.00 0.00 0.00 179.25 180.66 3h0g h LYS 30 N 1.08 0.96 0.24 0.00 1.57 -0.70 -2.94 116.57 116.78 3h0g h LYS 30 Ca 0.24 -0.36 -0.01 0.00 -1.87 0.00 0.00 60.65 58.65 3h0g h LYS 30 Cb 0.26 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.51 3h0g h LYS 30 CO -0.01 1.02 -0.12 1.25 -0.57 0.00 0.00 179.45 181.02 3h0g h LEU 31 N 0.86 -0.27 -1.00 2.94 5.85 -1.06 -1.58 115.31 121.04 3h0g h LEU 31 Ca 0.13 -0.02 0.14 0.00 0.84 0.00 0.00 57.88 58.98 3h0g h LEU 31 Cb 0.67 0.07 -0.09 0.00 0.37 0.00 0.00 40.66 41.68 3h0g h LEU 31 CO 0.05 -0.17 0.62 -0.07 -0.34 0.00 0.00 178.44 178.54 3h0g h LEU 32 N -0.36 0.88 -0.72 2.25 3.38 -1.42 -1.63 115.31 117.69 3h0g h LEU 32 Ca -0.03 0.06 -0.14 0.00 0.09 0.00 0.00 57.88 57.87 3h0g h LEU 32 Cb 0.27 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 3h0g h LEU 32 CO 0.05 0.42 -0.62 0.00 0.09 0.00 0.00 178.44 178.39 3h0g h ALA 33 N 1.57 0.93 0.02 1.53 0.00 -1.30 -2.46 119.26 119.56 3h0g h ALA 33 Ca 0.52 -0.56 -0.27 0.00 0.00 0.00 0.00 54.91 54.60 3h0g h ALA 33 Cb 0.62 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.28 3h0g h ALA 33 CO -0.30 0.76 -1.49 -0.44 0.00 0.00 0.00 179.25 177.78 3h0g h ASP 34 N 0.05 0.08 0.02 0.00 3.32 -0.44 -3.41 116.42 116.04 3h0g h ASP 34 Ca -0.01 -0.13 -0.39 0.00 0.02 0.00 0.00 57.03 56.53 3h0g h ASP 34 Cb 1.11 -0.03 -0.06 0.00 0.22 0.00 0.00 39.33 40.57 3h0g h ASP 34 CO 0.09 1.11 -2.42 0.52 -1.72 0.00 0.00 179.24 176.82 3h0g n VAL 35 N -3.21 1.53 -1.75 -1.35 0.31 -0.70 -4.77 118.33 108.38 3h0g n VAL 35 Ca -0.13 -0.57 -0.42 0.00 -0.01 0.00 0.00 64.34 63.21 3h0g n VAL 35 Cb 1.02 -1.48 -0.03 0.00 -0.91 0.00 0.00 33.84 32.44 3h0g n VAL 35 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 3h0g s GLU 36 N -2.52 4.14 0.00 5.55 2.02 -0.92 -1.63 118.70 125.34 3h0g s GLU 36 Ca -0.34 2.57 0.00 0.00 0.02 0.00 0.00 54.97 57.22 3h0g s GLU 36 Cb 0.09 -3.35 0.00 0.00 0.10 0.00 0.00 34.13 30.97 3h0g s GLU 36 CO 0.62 -0.78 0.00 0.41 0.02 0.00 0.00 175.26 175.53 3h0g n GLY 37 N 4.08 2.00 3.85 -1.39 0.00 -1.13 -4.91 105.19 107.69 3h0g n GLY 37 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 3h0g n GLY 37 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3h0g s THR 38 N -2.40 2.66 -0.01 2.61 -4.23 -0.64 -4.81 115.64 108.81 3h0g s THR 38 Ca 0.00 0.22 -0.11 0.00 -1.18 0.00 0.00 61.69 60.61 3h0g s THR 38 Cb 0.00 -3.10 0.01 0.00 1.34 0.00 0.00 72.50 70.76 3h0g s THR 38 CO 0.00 -0.28 0.24 0.00 -0.54 0.00 0.00 174.62 174.04 3h0g s SER 40 N -1.23 0.40 0.15 0.00 1.04 -0.57 -4.58 113.70 108.91 3h0g s SER 40 Ca -0.13 -1.02 0.01 0.00 0.48 0.00 0.00 55.95 55.29 3h0g s SER 40 Cb -0.06 0.24 -0.05 0.00 0.10 0.00 0.00 66.02 66.26 3h0g s SER 40 CO 0.03 -0.65 1.34 1.23 0.98 0.00 0.00 173.24 176.17 3h0g h GLY 41 N 3.03 0.26 0.67 7.32 0.00 -1.88 0.24 103.07 112.69 3h0g h GLY 41 Ca -0.34 -0.47 -0.01 0.00 0.00 0.00 0.00 47.33 46.51 3h0g h GLY 41 CO 0.63 0.42 -0.01 1.46 0.00 0.00 0.00 176.54 179.04 3h0g h GLN 42 N 0.12 0.08 0.00 4.80 4.20 -1.96 -3.37 115.11 118.99 3h0g h GLN 42 Ca -0.05 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.62 3h0g h GLN 42 Cb 1.56 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.34 3h0g h GLN 42 CO 0.14 0.43 -1.13 0.66 -0.67 0.00 0.00 178.83 178.26 3h0g n TYR 43 N -4.85 0.00 -2.47 2.96 4.01 -1.25 -5.10 117.16 110.46 3h0g n TYR 43 Ca -0.07 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.67 3h0g n TYR 43 Cb 0.21 -0.15 0.00 0.00 -0.31 0.00 0.00 39.34 39.10 3h0g n TYR 43 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3h0g n GLY 44 N 1.78 -0.47 3.67 2.72 0.00 0.83 -4.17 105.19 109.54 3h0g n GLY 44 Ca -0.01 -1.42 -0.43 0.00 0.00 0.00 0.00 46.02 44.17 3h0g n GLY 44 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3h0g s TYR 45 N 0.00 3.02 -1.41 1.61 4.12 -1.16 -1.51 117.35 122.02 3h0g s TYR 45 Ca 0.00 1.16 -0.11 0.00 0.02 0.00 0.00 57.07 58.13 3h0g s TYR 45 Cb 0.00 -3.43 0.08 0.00 -1.52 0.00 0.00 41.96 37.09 3h0g s TYR 45 CO 0.00 -1.33 2.21 -0.89 0.02 0.00 0.00 175.55 175.55 3h0g n ILE 46 N 5.22 4.02 0.00 2.71 5.41 0.09 -0.68 119.36 136.13 3h0g n ILE 46 Ca 0.13 -3.55 0.00 0.00 1.00 0.00 0.00 62.75 60.32 3h0g n ILE 46 Cb 0.45 -2.48 0.00 0.00 -0.71 0.00 0.00 39.64 36.91 3h0g n ILE 46 CO 0.00 0.00 0.00 -0.38 0.00 0.00 0.00 176.55 176.17 3h0g n ILE 47 N 4.02 0.00 -3.81 1.39 5.41 0.33 -2.82 119.36 123.87 3h0g n ILE 47 Ca 0.52 0.42 -0.09 0.00 1.00 0.00 0.00 62.75 64.60 3h0g n ILE 47 Cb 0.35 -0.61 -0.05 0.00 -0.71 0.00 0.00 39.64 38.63 3h0g n ILE 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3h0g s VAL 49 N -3.91 4.68 -0.98 0.00 1.01 -1.26 -0.39 120.40 119.56 3h0g s VAL 49 Ca 0.12 -0.07 -0.12 0.00 0.00 0.00 0.00 61.98 61.91 3h0g s VAL 49 Cb -0.00 -3.11 -0.08 0.00 0.00 0.00 0.00 36.38 33.19 3h0g s VAL 49 CO -0.01 0.46 2.14 0.18 0.00 0.00 0.00 175.10 177.87 3h0g n LEU 50 N 3.54 5.17 -4.60 3.92 4.77 0.27 -4.93 117.00 125.14 3h0g n LEU 50 Ca -0.17 -3.13 -0.36 0.00 -0.03 0.00 0.00 56.01 52.32 3h0g n LEU 50 Cb 0.52 -1.19 0.07 0.00 -2.33 0.00 0.00 43.42 40.50 3h0g n LEU 50 CO 0.35 0.47 0.49 -0.67 -1.33 0.00 0.00 177.39 176.71 3h0g n ASP 51 N 5.37 0.42 -0.11 -1.43 2.03 -1.26 -4.17 116.55 117.40 3h0g n ASP 51 Ca 0.50 0.71 0.00 0.00 0.52 0.00 0.00 54.79 56.51 3h0g n ASP 51 Cb 0.25 -1.38 0.00 0.00 -0.72 0.00 0.00 41.12 39.27 3h0g n ASP 51 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 3h0g n SER 52 N -1.25 -1.23 0.00 1.67 2.88 -1.26 -4.70 113.62 109.73 3h0g n SER 52 Ca 0.13 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.67 3h0g n SER 52 Cb 0.49 0.18 0.00 0.00 -0.75 0.00 0.00 64.21 64.13 3h0g n SER 52 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 3h0g n ASN 53 N -0.20 0.00 -2.32 -3.46 3.02 -1.26 -4.37 115.26 106.66 3h0g n ASN 53 Ca 0.00 0.00 -0.27 0.00 -0.03 0.00 0.00 54.58 54.28 3h0g n ASN 53 Cb 0.00 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.18 3h0g n ASN 53 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 3h0g n THR 54 N 0.00 3.24 -3.62 3.41 -2.24 -1.26 -4.78 114.28 109.02 3h0g n THR 54 Ca 0.00 -2.71 -0.29 0.00 -2.27 0.00 0.00 64.05 58.78 3h0g n THR 54 Cb 0.00 -1.38 -0.15 0.00 -2.10 0.00 0.00 70.33 66.69 3h0g n THR 54 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3h0g s ILE 55 N -3.12 0.25 -0.04 2.28 1.01 -1.26 -3.07 121.20 117.25 3h0g s ILE 55 Ca 0.50 -0.82 -0.14 0.00 0.00 0.00 0.00 60.65 60.19 3h0g s ILE 55 Cb 0.37 -1.11 -0.05 0.00 0.01 0.00 0.00 42.46 41.68 3h0g s ILE 55 CO -0.14 -0.59 0.38 -1.81 0.00 0.00 0.00 174.94 172.78 3h0g s ASP 56 N 1.95 6.73 -0.44 3.58 1.11 -0.20 -4.96 116.67 124.44 3h0g s ASP 56 Ca 0.07 0.86 0.02 0.00 0.18 0.00 0.00 52.55 53.69 3h0g s ASP 56 Cb -0.16 -2.23 0.13 0.00 1.07 0.00 0.00 42.92 41.72 3h0g s ASP 56 CO -0.26 0.29 0.21 -0.63 1.18 0.00 0.00 175.17 175.95 3h0g s ILE 57 N -0.80 1.73 0.40 0.77 -1.09 -1.26 -2.29 121.20 118.67 3h0g s ILE 57 Ca 0.22 -2.60 -0.00 0.00 -2.23 0.00 0.00 60.65 56.04 3h0g s ILE 57 Cb -0.16 -2.23 0.08 0.00 -1.58 0.00 0.00 42.46 38.58 3h0g s ILE 57 CO 0.11 -0.82 0.55 0.47 -1.23 0.00 0.00 174.94 174.02 3h0g n ASP 58 N 3.65 0.75 -0.03 3.58 8.00 -1.00 -4.99 116.55 126.50 3h0g n ASP 58 Ca 0.06 -1.63 0.00 0.00 0.71 0.00 0.00 54.79 53.93 3h0g n ASP 58 Cb 0.35 -0.36 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 3h0g n ASP 58 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3h0g n LYS 59 N -2.01 0.00 -4.38 -1.24 4.01 -1.26 -3.81 118.16 109.47 3h0g n LYS 59 Ca 0.09 0.00 -0.19 0.00 -0.51 0.00 0.00 58.31 57.70 3h0g n LYS 59 Cb 0.32 0.00 -0.10 0.00 -0.51 0.00 0.00 35.03 34.74 3h0g n LYS 59 CO 0.00 0.00 0.00 0.20 -1.11 0.00 0.00 177.40 176.49 3h0g s GLY 60 N -1.12 1.89 -0.23 0.72 0.00 -1.26 -5.01 107.32 102.30 3h0g s GLY 60 Ca 0.00 -1.96 -0.05 0.00 0.00 0.00 0.00 44.72 42.71 3h0g s GLY 60 CO 0.00 -1.70 -0.01 -1.60 0.00 0.00 0.00 173.10 169.79 3h0g s ARG 61 N -3.96 3.40 0.62 2.90 3.52 -1.23 -4.91 118.95 119.28 3h0g s ARG 61 Ca 0.37 -0.62 -0.18 0.00 -0.13 0.00 0.00 55.73 55.17 3h0g s ARG 61 Cb 0.08 -3.11 -0.03 0.00 -1.56 0.00 0.00 34.95 30.34 3h0g s ARG 61 CO 0.14 -0.22 1.23 0.08 -0.81 0.00 0.00 175.30 175.73 3h0g s VAL 62 N 1.51 2.43 0.20 7.11 1.01 -1.26 -3.13 120.40 128.27 3h0g s VAL 62 Ca 0.06 0.27 -0.26 0.00 0.00 0.00 0.00 61.98 62.04 3h0g s VAL 62 Cb -0.15 -3.09 -0.08 0.00 0.00 0.00 0.00 36.38 33.06 3h0g s VAL 62 CO -0.01 -0.06 0.82 -0.69 0.00 0.00 0.00 175.10 175.16 3h0g s VAL 63 N -1.55 4.30 0.01 2.92 1.01 0.19 -4.93 120.40 122.35 3h0g s VAL 63 Ca 0.79 1.76 -0.06 0.00 0.00 0.00 0.00 61.98 64.47 3h0g s VAL 63 Cb -0.33 -4.14 -0.03 0.00 0.00 0.00 0.00 36.38 31.88 3h0g s VAL 63 CO 0.36 0.45 0.92 -0.65 0.00 0.00 0.00 175.10 176.18 3h0g h PRO 64 N 4.08 -0.22 -2.80 2.72 0.11 -1.94 -3.20 132.00 130.76 3h0g h PRO 64 Ca -0.47 0.01 -0.80 0.00 0.11 0.00 0.00 66.00 64.86 3h0g h PRO 64 Cb 1.20 0.05 -0.28 0.00 0.11 0.00 0.00 31.00 32.08 3h0g h PRO 64 CO 0.66 -0.14 0.77 0.41 -0.21 0.00 0.00 178.00 179.49 3h0g n GLY 65 N -0.60 5.30 0.00 -0.55 0.00 -1.26 -4.30 105.19 103.78 3h0g n GLY 65 Ca -0.03 -2.66 0.00 0.00 0.00 0.00 0.00 46.02 43.33 3h0g n GLY 65 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3h0g n GLN 66 N 1.11 0.00 -0.82 1.61 3.00 -1.26 -5.01 117.38 116.01 3h0g n GLN 66 Ca 0.29 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.28 3h0g n GLN 66 Cb 0.32 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.56 3h0g n GLN 66 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3h0g n GLY 67 N -0.93 0.81 3.77 1.08 0.00 -1.21 -5.03 105.19 103.68 3h0g n GLY 67 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 3h0g n GLY 67 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3h0g s PHE 68 N -3.13 3.30 -0.07 1.61 0.08 -1.26 -4.20 117.98 114.31 3h0g s PHE 68 Ca 0.00 0.25 -0.01 0.00 0.12 0.00 0.00 56.93 57.29 3h0g s PHE 68 Cb 0.00 -1.78 -0.03 0.00 -0.57 0.00 0.00 43.02 40.63 3h0g s PHE 68 CO 0.00 0.56 0.00 0.00 -0.10 0.00 0.00 175.22 175.68 3h0g s ALA 69 N -1.08 3.30 -0.36 5.36 0.00 -1.23 0.53 121.76 128.28 3h0g s ALA 69 Ca 0.19 -0.84 -0.14 0.00 0.00 0.00 0.00 51.96 51.17 3h0g s ALA 69 Cb -0.12 -1.46 -0.01 0.00 0.00 0.00 0.00 23.12 21.54 3h0g s ALA 69 CO 0.09 0.60 0.32 -1.21 0.00 0.00 0.00 175.76 175.56 3h0g s GLU 70 N -1.05 3.42 -0.46 0.00 2.02 -1.18 -1.25 118.70 120.21 3h0g s GLU 70 Ca 0.15 -0.61 -0.12 0.00 0.02 0.00 0.00 54.97 54.41 3h0g s GLU 70 Cb -0.11 -3.84 0.09 0.00 0.10 0.00 0.00 34.13 30.37 3h0g s GLU 70 CO 0.04 -0.55 0.34 -0.06 0.02 0.00 0.00 175.26 175.05 3h0g s PHE 71 N 1.88 3.32 0.32 1.61 0.08 0.90 -3.57 117.98 122.52 3h0g s PHE 71 Ca 0.09 -1.41 -0.29 0.00 0.12 0.00 0.00 56.93 55.43 3h0g s PHE 71 Cb -0.17 -3.24 -0.10 0.00 -0.57 0.00 0.00 43.02 38.94 3h0g s PHE 71 CO 0.11 -0.89 1.29 -1.21 -0.10 0.00 0.00 175.22 174.42 3h0g s GLU 72 N 1.49 4.38 -0.04 0.44 2.02 -1.25 -2.12 118.70 123.63 3h0g s GLU 72 Ca 0.04 2.17 0.01 0.00 0.02 0.00 0.00 54.97 57.21 3h0g s GLU 72 Cb -0.25 -3.09 0.02 0.00 0.10 0.00 0.00 34.13 30.92 3h0g s GLU 72 CO 0.03 -0.15 -0.05 0.08 0.02 0.00 0.00 175.26 175.18 3h0g s VAL 73 N -1.09 0.58 -0.17 2.63 1.01 -0.19 -2.37 120.40 120.80 3h0g s VAL 73 Ca 0.49 -0.16 -0.05 0.00 0.00 0.00 0.00 61.98 62.26 3h0g s VAL 73 Cb -0.39 -0.59 -0.03 0.00 0.00 0.00 0.00 36.38 35.36 3h0g s VAL 73 CO 0.51 0.23 0.01 -0.54 0.00 0.00 0.00 175.10 175.31 3h0g s LYS 74 N 0.85 3.79 0.06 2.72 1.02 -0.97 -1.97 119.74 125.24 3h0g s LYS 74 Ca -0.12 -0.45 -0.04 0.00 0.02 0.00 0.00 55.97 55.38 3h0g s LYS 74 Cb -0.14 -3.05 -0.02 0.00 -0.52 0.00 0.00 37.83 34.09 3h0g s LYS 74 CO 0.01 0.23 0.05 1.52 -0.92 0.00 0.00 175.35 176.23 3h0g s TYR 75 N 0.45 0.35 -0.16 3.18 -0.85 -0.46 -1.03 117.35 118.82 3h0g s TYR 75 Ca -0.01 -0.81 -0.08 0.00 -0.52 0.00 0.00 57.07 55.64 3h0g s TYR 75 Cb -0.14 -0.25 -0.04 0.00 0.38 0.00 0.00 41.96 41.91 3h0g s TYR 75 CO 0.02 -0.41 0.13 1.03 -1.52 0.00 0.00 175.55 174.80 3h0g s ARG 76 N -3.54 3.85 0.08 -3.49 0.52 -1.17 -0.34 118.95 114.85 3h0g s ARG 76 Ca 0.03 -0.20 -0.01 0.00 -0.52 0.00 0.00 55.73 55.03 3h0g s ARG 76 Cb 0.05 -3.30 -0.04 0.00 0.52 0.00 0.00 34.95 32.18 3h0g s ARG 76 CO -0.09 0.50 -0.00 0.00 0.02 0.00 0.00 175.30 175.73 3h0g s ALA 77 N -0.22 0.64 -0.26 2.13 0.00 0.06 0.96 121.76 125.07 3h0g s ALA 77 Ca 0.11 -1.30 -0.09 0.00 0.00 0.00 0.00 51.96 50.67 3h0g s ALA 77 Cb -0.11 0.46 -0.04 0.00 0.00 0.00 0.00 23.12 23.42 3h0g s ALA 77 CO 0.01 -0.40 0.13 0.08 0.00 0.00 0.00 175.76 175.57 3h0g s VAL 78 N -3.95 4.84 0.19 0.00 1.01 0.48 -1.37 120.40 121.59 3h0g s VAL 78 Ca 0.13 0.01 0.10 0.00 0.00 0.00 0.00 61.98 62.21 3h0g s VAL 78 Cb 0.08 -3.28 -0.04 0.00 0.00 0.00 0.00 36.38 33.13 3h0g s VAL 78 CO -0.06 0.30 -0.20 -0.76 0.00 0.00 0.00 175.10 174.38 3h0g s LEU 79 N 1.64 2.46 -0.47 3.92 1.43 0.19 -0.51 118.68 127.34 3h0g s LEU 79 Ca 0.07 -0.89 0.03 0.00 -1.03 0.00 0.00 54.13 52.30 3h0g s LEU 79 Cb -0.15 -0.95 0.13 0.00 0.03 0.00 0.00 46.19 45.24 3h0g s LEU 79 CO 0.07 0.01 0.22 0.86 0.23 0.00 0.00 176.35 177.75 3h0g s TRP 80 N -2.06 2.82 -0.19 0.29 -0.00 0.14 -0.74 118.94 119.20 3h0g s TRP 80 Ca 0.19 -2.87 -0.04 0.00 -0.00 0.00 0.00 56.10 53.37 3h0g s TRP 80 Cb -0.06 -2.51 -0.02 0.00 -0.00 0.00 0.00 33.47 30.88 3h0g s TRP 80 CO 0.09 -0.78 -0.02 -0.98 -0.00 0.00 0.00 176.95 175.26 3h0g s ARG 81 N 0.11 3.58 0.22 5.86 1.70 -1.26 -2.99 118.95 126.16 3h0g s ARG 81 Ca 0.16 -0.54 -0.02 0.00 -0.47 0.00 0.00 55.73 54.86 3h0g s ARG 81 Cb -0.24 -3.03 -0.04 0.00 -0.57 0.00 0.00 34.95 31.06 3h0g s ARG 81 CO -0.02 0.02 0.42 -1.25 -1.08 0.00 0.00 175.30 173.40 3h0g s PRO 82 N 0.96 3.55 -0.03 3.89 0.04 -1.26 -4.76 135.00 137.38 3h0g s PRO 82 Ca 0.01 -0.26 -0.03 0.00 0.04 0.00 0.00 61.00 60.76 3h0g s PRO 82 Cb -0.14 -2.80 0.01 0.00 0.04 0.00 0.00 34.50 31.60 3h0g s PRO 82 CO 0.01 0.37 0.09 -0.06 0.04 0.00 0.00 177.00 177.45 3h0g s PHE 83 N -1.90 -0.10 0.09 0.56 0.08 -1.26 -5.05 117.98 110.40 3h0g s PHE 83 Ca 0.40 0.24 -0.36 0.00 0.12 0.00 0.00 56.93 57.32 3h0g s PHE 83 Cb -0.11 0.03 -0.16 0.00 -0.57 0.00 0.00 43.02 42.22 3h0g s PHE 83 CO 0.29 -0.05 1.45 0.54 -0.10 0.00 0.00 175.22 177.35 3h0g n ARG 84 N 3.00 1.51 0.00 0.44 1.74 -1.26 -2.04 116.66 120.05 3h0g n ARG 84 Ca -0.12 0.55 0.00 0.00 -0.77 0.00 0.00 57.85 57.50 3h0g n ARG 84 Cb 0.59 -2.24 0.00 0.00 -1.02 0.00 0.00 32.46 29.79 3h0g n ARG 84 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3h0g n GLY 85 N 2.95 1.05 3.75 -0.13 0.00 0.14 -4.98 105.19 107.97 3h0g n GLY 85 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.80 3h0g n GLY 85 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3h0g s GLU 86 N -0.74 4.69 -0.19 1.61 2.02 -0.86 -4.75 118.70 120.48 3h0g s GLU 86 Ca 0.00 1.33 -0.09 0.00 0.02 0.00 0.00 54.97 56.23 3h0g s GLU 86 Cb 0.00 -3.31 -0.05 0.00 0.10 0.00 0.00 34.13 30.88 3h0g s GLU 86 CO 0.00 0.44 0.10 0.08 0.02 0.00 0.00 175.26 175.90 3h0g s VAL 87 N -0.76 5.17 0.04 2.63 1.01 -1.26 -2.18 120.40 125.04 3h0g s VAL 87 Ca 0.40 0.10 -0.00 0.00 0.00 0.00 0.00 61.98 62.49 3h0g s VAL 87 Cb -0.24 -3.34 -0.03 0.00 0.00 0.00 0.00 36.38 32.77 3h0g s VAL 87 CO 0.29 0.45 -0.04 -0.69 0.00 0.00 0.00 175.10 175.11 3h0g s VAL 88 N 0.32 0.23 -0.02 2.92 1.01 -1.15 -5.02 120.40 118.70 3h0g s VAL 88 Ca 0.06 -1.33 -0.19 0.00 0.00 0.00 0.00 61.98 60.53 3h0g s VAL 88 Cb -0.12 -0.86 -0.05 0.00 0.00 0.00 0.00 36.38 35.35 3h0g s VAL 88 CO -0.01 -0.70 0.52 -1.81 0.00 0.00 0.00 175.10 173.10 3h0g s ASP 89 N -2.12 6.89 0.31 3.32 1.01 -1.26 -3.15 116.67 121.67 3h0g s ASP 89 Ca -0.05 1.06 0.05 0.00 0.71 0.00 0.00 52.55 54.32 3h0g s ASP 89 Cb -0.02 -2.32 -0.06 0.00 1.01 0.00 0.00 42.92 41.52 3h0g s ASP 89 CO -0.04 0.16 0.01 0.00 0.21 0.00 0.00 175.17 175.50 3h0g s ALA 90 N -0.35 2.38 -0.30 5.23 0.00 -0.61 -4.79 121.76 123.32 3h0g s ALA 90 Ca 0.28 -2.00 -0.00 0.00 0.00 0.00 0.00 51.96 50.24 3h0g s ALA 90 Cb -0.17 0.43 0.06 0.00 0.00 0.00 0.00 23.12 23.44 3h0g s ALA 90 CO 0.15 -0.20 -0.01 0.42 0.00 0.00 0.00 175.76 176.12 3h0g s ILE 91 N -3.15 2.75 0.20 0.00 1.01 -0.28 -2.16 121.20 119.57 3h0g s ILE 91 Ca 0.33 -1.58 -0.33 0.00 0.00 0.00 0.00 60.65 59.07 3h0g s ILE 91 Cb 0.07 -2.65 -0.13 0.00 0.01 0.00 0.00 42.46 39.75 3h0g s ILE 91 CO 0.14 -0.18 1.58 0.52 0.00 0.00 0.00 174.94 177.00 3h0g n VAL 92 N 4.54 0.25 -0.08 2.92 0.31 -1.26 -2.11 118.33 122.90 3h0g n VAL 92 Ca -0.11 -0.06 -0.18 0.00 -0.01 0.00 0.00 64.34 63.98 3h0g n VAL 92 Cb 0.43 -1.65 -0.06 0.00 -0.91 0.00 0.00 33.84 31.65 3h0g n VAL 92 CO 0.00 0.00 0.00 1.07 -1.32 0.00 0.00 176.83 176.58 3h0g n THR 93 N 3.16 0.90 -4.17 2.52 5.66 -0.61 -4.17 114.28 117.57 3h0g n THR 93 Ca 0.15 -0.23 -0.13 0.00 -3.05 0.00 0.00 64.05 60.79 3h0g n THR 93 Cb 0.31 -1.72 -0.11 0.00 -1.55 0.00 0.00 70.33 67.26 3h0g n THR 93 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 3h0g s THR 94 N -2.30 0.85 -0.27 1.09 -4.23 -1.14 -4.78 115.64 104.86 3h0g s THR 94 Ca -0.23 -1.68 -0.02 0.00 -1.18 0.00 0.00 61.69 58.58 3h0g s THR 94 Cb 0.09 -1.39 0.09 0.00 1.34 0.00 0.00 72.50 72.63 3h0g s THR 94 CO 0.29 -0.63 0.09 -0.69 -0.54 0.00 0.00 174.62 173.14 3h0g s VAL 95 N -2.69 0.49 0.14 2.29 1.01 -1.26 -2.22 120.40 118.16 3h0g s VAL 95 Ca 0.06 -0.99 0.10 0.00 0.00 0.00 0.00 61.98 61.15 3h0g s VAL 95 Cb -0.01 -1.29 -0.04 0.00 0.00 0.00 0.00 36.38 35.03 3h0g s VAL 95 CO -0.01 -0.58 -0.23 0.20 0.00 0.00 0.00 175.10 174.48 3h0g s ASN 96 N 1.83 3.05 0.00 3.32 0.01 -1.18 -4.70 114.94 117.27 3h0g s ASN 96 Ca 0.07 -0.78 0.00 0.00 -0.71 0.00 0.00 52.86 51.44 3h0g s ASN 96 Cb -0.17 -0.20 0.00 0.00 0.41 0.00 0.00 41.25 41.29 3h0g s ASN 96 CO -0.24 0.10 0.00 0.29 -1.51 0.00 0.00 177.10 175.74 3h0g n LYS 97 N 0.71 0.00 -0.00 -0.60 5.02 -1.26 0.06 118.16 122.09 3h0g n LYS 97 Ca -0.16 0.00 0.03 0.00 -2.02 0.00 0.00 58.31 56.15 3h0g n LYS 97 Cb 0.54 -0.92 -0.04 0.00 -0.02 0.00 0.00 35.03 34.60 3h0g n LYS 97 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 3h0g n MET 98 N 0.33 2.83 -1.04 1.97 2.81 -1.26 -4.97 117.12 117.79 3h0g n MET 98 Ca 0.00 -0.02 0.00 0.00 -1.81 0.00 0.00 57.70 55.87 3h0g n MET 98 Cb 0.00 -0.93 0.00 0.00 -0.71 0.00 0.00 33.22 31.58 3h0g n MET 98 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3h0g n GLY 99 N 1.63 0.12 2.95 3.03 0.00 0.11 -3.21 105.19 109.83 3h0g n GLY 99 Ca 0.00 -1.30 -0.30 0.00 0.00 0.00 0.00 46.02 44.42 3h0g n GLY 99 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3h0g s PHE 100 N -3.52 2.39 -1.31 1.61 0.08 -0.41 -3.07 117.98 113.75 3h0g s PHE 100 Ca 0.00 -1.72 -0.14 0.00 0.12 0.00 0.00 56.93 55.19 3h0g s PHE 100 Cb 0.00 -1.58 0.11 0.00 -0.57 0.00 0.00 43.02 40.98 3h0g s PHE 100 CO 0.00 -0.77 1.79 1.19 -0.10 0.00 0.00 175.22 177.33 3h0g n PHE 101 N 4.68 4.14 0.00 0.36 3.72 -0.94 -1.27 117.46 128.15 3h0g n PHE 101 Ca -0.12 -3.00 0.00 0.00 -0.05 0.00 0.00 57.45 54.27 3h0g n PHE 101 Cb 0.44 -2.35 0.00 0.00 -0.94 0.00 0.00 39.48 36.63 3h0g n PHE 101 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3h0g n ALA 102 N 6.17 0.00 0.00 4.37 0.00 -0.84 -1.58 120.51 128.64 3h0g n ALA 102 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.88 3h0g n ALA 102 Cb 0.41 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.86 3h0g n ALA 102 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3h0g n ASN 103 N 0.00 0.00 -4.20 0.00 3.02 -0.90 -4.31 115.26 108.87 3h0g n ASN 103 Ca 0.00 0.00 -0.36 0.00 -0.03 0.00 0.00 54.58 54.19 3h0g n ASN 103 Cb 0.00 0.00 -0.13 0.00 -0.61 0.00 0.00 39.78 39.04 3h0g n ASN 103 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3h0g s ILE 104 N 0.00 3.21 0.00 2.41 1.01 -0.78 -1.12 121.20 125.93 3h0g s ILE 104 Ca 0.00 -1.30 0.00 0.00 0.00 0.00 0.00 60.65 59.35 3h0g s ILE 104 Cb 0.00 -2.83 0.00 0.00 0.01 0.00 0.00 42.46 39.64 3h0g s ILE 104 CO 0.00 -0.11 0.00 0.61 0.00 0.00 0.00 174.94 175.44 3h0g n GLY 105 N 4.68 0.78 0.00 6.18 0.00 -1.26 -1.60 105.19 113.97 3h0g n GLY 105 Ca -0.13 0.46 0.01 0.00 0.00 0.00 0.00 46.02 46.36 3h0g n GLY 105 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3h0g n PRO 106 N 0.00 5.91 -3.62 1.61 -0.04 -1.26 -5.02 135.00 132.58 3h0g n PRO 106 Ca 0.00 -0.03 -0.35 0.00 -0.04 0.00 0.00 63.50 63.09 3h0g n PRO 106 Cb 0.00 -0.63 -0.05 0.00 -0.04 0.00 0.00 33.50 32.77 3h0g n PRO 106 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 3h0g s LEU 107 N -2.05 4.35 -0.27 1.53 2.96 -0.63 -5.08 118.68 119.50 3h0g s LEU 107 Ca 0.01 0.74 -0.10 0.00 -0.22 0.00 0.00 54.13 54.56 3h0g s LEU 107 Cb 0.02 -2.91 -0.05 0.00 0.50 0.00 0.00 46.19 43.75 3h0g s LEU 107 CO 0.10 0.19 0.17 0.20 -1.32 0.00 0.00 176.35 175.69 3h0g s ASN 108 N -1.75 5.94 -0.16 3.68 0.01 -1.26 -1.86 114.94 119.54 3h0g s ASN 108 Ca 0.32 -0.01 -0.04 0.00 -0.71 0.00 0.00 52.86 52.42 3h0g s ASN 108 Cb -0.14 -2.10 -0.03 0.00 0.41 0.00 0.00 41.25 39.40 3h0g s ASN 108 CO 0.18 -0.03 -0.04 -0.69 -1.51 0.00 0.00 177.10 175.01 3h0g s VAL 109 N 1.61 3.89 -0.20 1.60 1.01 -1.26 -4.58 120.40 122.47 3h0g s VAL 109 Ca 0.07 -0.36 -0.05 0.00 0.00 0.00 0.00 61.98 61.65 3h0g s VAL 109 Cb -0.15 -2.71 -0.02 0.00 0.00 0.00 0.00 36.38 33.50 3h0g s VAL 109 CO 0.09 0.49 -0.01 0.12 0.00 0.00 0.00 175.10 175.79 3h0g s PHE 110 N 0.39 3.02 -0.82 5.22 5.36 -1.25 -1.98 117.98 127.92 3h0g s PHE 110 Ca -0.04 -0.52 -0.08 0.00 -0.96 0.00 0.00 56.93 55.33 3h0g s PHE 110 Cb -0.14 -2.07 0.21 0.00 -0.34 0.00 0.00 43.02 40.68 3h0g s PHE 110 CO 0.03 -0.27 0.73 0.54 -1.46 0.00 0.00 175.22 174.79 3h0g s VAL 111 N 1.01 4.96 0.20 3.12 0.11 -0.40 -3.13 120.40 126.27 3h0g s VAL 111 Ca 0.01 -2.95 -0.31 0.00 -2.93 0.00 0.00 61.98 55.81 3h0g s VAL 111 Cb -0.14 -4.09 -0.16 0.00 -1.53 0.00 0.00 36.38 30.46 3h0g s VAL 111 CO 0.01 -1.02 0.91 -1.54 -3.33 0.00 0.00 175.10 170.13 3h0g n SER 112 N 3.41 0.37 -0.10 3.54 3.41 -1.26 -1.29 113.62 121.70 3h0g n SER 112 Ca 0.15 1.15 0.14 0.00 -0.26 0.00 0.00 58.87 60.05 3h0g n SER 112 Cb 0.42 -1.12 0.53 0.00 -0.26 0.00 0.00 64.21 63.78 3h0g n SER 112 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 3h0g h SER 113 N 2.20 0.32 0.54 4.04 4.64 -1.88 0.27 113.55 123.69 3h0g h SER 113 Ca -0.38 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 3h0g h SER 113 Cb 1.38 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.42 3h0g h SER 113 CO 0.63 0.18 0.00 1.12 -0.87 0.00 0.00 176.83 177.89 3h0g h HIS 114 N 0.35 0.00 -0.65 4.77 2.07 -1.88 -1.55 115.15 118.26 3h0g h HIS 114 Ca 0.31 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.83 3h0g h HIS 114 Cb 0.73 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.71 3h0g h HIS 114 CO -0.00 0.00 0.00 1.28 -3.07 0.00 0.00 177.93 176.14 3h0g n LEU 115 N -2.49 4.83 -4.47 6.12 4.77 0.96 -4.92 117.00 121.80 3h0g n LEU 115 Ca 0.00 -2.48 -0.33 0.00 -0.03 0.00 0.00 56.01 53.18 3h0g n LEU 115 Cb 0.18 -0.59 -0.13 0.00 -2.33 0.00 0.00 43.42 40.56 3h0g n LEU 115 CO 0.19 0.81 -0.44 -0.69 -1.33 0.00 0.00 177.39 175.92 3h0g s VAL 116 N -1.90 3.15 0.78 4.08 1.01 -0.59 -1.21 120.40 125.72 3h0g s VAL 116 Ca 0.52 -0.68 -0.17 0.00 0.00 0.00 0.00 61.98 61.65 3h0g s VAL 116 Cb 0.34 -2.26 -0.11 0.00 0.00 0.00 0.00 36.38 34.34 3h0g s VAL 116 CO 0.24 0.58 -0.21 -0.81 0.00 0.00 0.00 175.10 174.90 3h0g n PRO 117 N 2.59 0.04 -0.04 2.72 -0.04 -1.26 -4.83 135.00 134.17 3h0g n PRO 117 Ca -0.17 0.03 0.06 0.00 -0.04 0.00 0.00 63.50 63.38 3h0g n PRO 117 Cb 0.52 -1.25 0.31 0.00 -0.04 0.00 0.00 33.50 33.04 3h0g n PRO 117 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 3h0g n PRO 118 N 1.16 1.28 0.03 0.54 -0.04 -1.26 -3.35 135.00 133.36 3h0g n PRO 118 Ca 0.04 -0.42 0.11 0.00 -0.04 0.00 0.00 63.50 63.19 3h0g n PRO 118 Cb 0.52 -1.23 0.05 0.00 -0.04 0.00 0.00 33.50 32.80 3h0g n PRO 118 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3h0g n ASP 119 N -0.28 0.63 -4.35 3.54 8.00 -1.26 -4.62 116.55 118.21 3h0g n ASP 119 Ca 0.10 -0.14 -0.45 0.00 0.71 0.00 0.00 54.79 55.02 3h0g n ASP 119 Cb 0.14 0.67 -0.00 0.00 -0.02 0.00 0.00 41.12 41.90 3h0g n ASP 119 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 3h0g s MET 120 N -3.19 4.15 0.60 -1.24 -1.94 -1.21 -3.58 119.30 112.89 3h0g s MET 120 Ca 0.04 -3.10 -0.18 0.00 -1.71 0.00 0.00 55.69 50.75 3h0g s MET 120 Cb 0.14 -4.60 -0.03 0.00 2.01 0.00 0.00 34.83 32.35 3h0g s MET 120 CO 0.78 -1.30 1.15 0.15 -0.01 0.00 0.00 175.02 175.79 3h0g s LYS 121 N -0.85 3.03 -0.17 2.03 1.02 0.42 -4.74 119.74 120.48 3h0g s LYS 121 Ca 0.31 1.61 -0.21 0.00 0.02 0.00 0.00 55.97 57.70 3h0g s LYS 121 Cb -0.09 -1.96 -0.03 0.00 -0.52 0.00 0.00 37.83 35.23 3h0g s LYS 121 CO -0.07 -1.11 0.61 -0.59 -0.92 0.00 0.00 175.35 173.27 3h0g s PHE 122 N -1.91 3.42 -0.28 3.18 -0.12 -1.26 -2.77 117.98 118.25 3h0g s PHE 122 Ca 0.72 0.96 -0.01 0.00 -0.05 0.00 0.00 56.93 58.56 3h0g s PHE 122 Cb -0.25 -2.76 0.04 0.00 -0.63 0.00 0.00 43.02 39.43 3h0g s PHE 122 CO 0.34 -0.09 -0.03 -0.51 -0.05 0.00 0.00 175.22 174.88 3h0g s ASP 123 N 1.06 4.67 0.08 1.98 1.01 -0.39 -4.95 116.67 120.12 3h0g s ASP 123 Ca 0.29 -1.18 0.22 0.00 0.71 0.00 0.00 52.55 52.60 3h0g s ASP 123 Cb -0.16 -1.67 -0.18 0.00 1.01 0.00 0.00 42.92 41.92 3h0g s ASP 123 CO 0.11 -0.21 0.75 -0.81 0.21 0.00 0.00 175.17 175.22 3h0g n PRO 124 N 4.61 0.62 0.10 8.23 -0.04 -1.26 -1.63 135.00 145.62 3h0g n PRO 124 Ca -0.14 -0.05 -0.17 0.00 -0.04 0.00 0.00 63.50 63.10 3h0g n PRO 124 Cb 0.44 -1.66 -0.12 0.00 -0.04 0.00 0.00 33.50 32.12 3h0g n PRO 124 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 3h0g h THR 125 N 0.00 1.44 -2.00 0.52 1.35 -1.97 -3.41 112.91 108.84 3h0g h THR 125 Ca 0.00 -2.83 -0.63 0.00 -0.55 0.00 0.00 66.41 62.40 3h0g h THR 125 Cb 0.99 2.81 0.06 0.00 -1.73 0.00 0.00 68.15 70.28 3h0g h THR 125 CO 0.00 0.84 0.65 0.00 -0.25 0.00 0.00 175.52 176.75 3h0g n ALA 126 N -2.57 0.30 0.00 6.62 0.00 -1.26 -4.77 120.51 118.83 3h0g n ALA 126 Ca -0.09 0.48 0.00 0.00 0.00 0.00 0.00 53.44 53.82 3h0g n ALA 126 Cb 0.98 -2.23 0.00 0.00 0.00 0.00 0.00 19.45 18.21 3h0g n ALA 126 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3h0g n ASN 127 N 3.07 0.00 -4.16 0.00 3.02 -1.26 -2.80 115.26 113.13 3h0g n ASN 127 Ca 0.18 0.00 -0.35 0.00 -0.03 0.00 0.00 54.58 54.38 3h0g n ASN 127 Cb 0.24 0.00 -0.13 0.00 -0.61 0.00 0.00 39.78 39.28 3h0g n ASN 127 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 3h0g s PRO 128 N -1.10 2.34 -0.13 3.52 0.04 -1.26 -5.05 135.00 133.35 3h0g s PRO 128 Ca 0.00 -1.36 -0.14 0.00 0.04 0.00 0.00 61.00 59.55 3h0g s PRO 128 Cb 0.00 -3.22 -0.06 0.00 0.04 0.00 0.00 34.50 31.26 3h0g s PRO 128 CO 0.00 -0.68 0.46 -0.35 0.04 0.00 0.00 177.00 176.47 3h0g n PRO 129 N 4.60 0.00 -2.64 0.56 -0.04 -1.12 -4.91 135.00 131.45 3h0g n PRO 129 Ca -0.11 0.00 -0.06 0.00 -0.04 0.00 0.00 63.50 63.29 3h0g n PRO 129 Cb 0.43 -0.45 -0.02 0.00 -0.04 0.00 0.00 33.50 33.42 3h0g n PRO 129 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 3h0g n ASN 130 N 1.12 -0.37 -3.42 3.54 0.23 -0.65 -4.70 115.26 111.01 3h0g n ASN 130 Ca 0.09 -1.74 -0.27 0.00 -0.53 0.00 0.00 54.58 52.13 3h0g n ASN 130 Cb -0.01 0.75 -0.10 0.00 -2.08 0.00 0.00 39.78 38.34 3h0g n ASN 130 CO 0.00 0.00 0.00 -1.22 -0.93 0.00 0.00 177.26 175.11 3h0g n TYR 131 N -0.22 -0.16 -2.37 -2.53 4.01 -1.10 -1.26 117.16 113.53 3h0g n TYR 131 Ca 0.02 -3.50 -0.26 0.00 -0.16 0.00 0.00 57.90 54.00 3h0g n TYR 131 Cb 0.22 0.02 0.14 0.00 -0.31 0.00 0.00 39.34 39.40 3h0g n TYR 131 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 3h0g s SER 132 N -0.45 3.91 0.00 7.72 1.04 -1.11 -3.73 113.70 121.08 3h0g s SER 132 Ca 0.33 -0.18 0.00 0.00 0.48 0.00 0.00 55.95 56.58 3h0g s SER 132 Cb 0.06 -0.07 0.00 0.00 0.10 0.00 0.00 66.02 66.11 3h0g s SER 132 CO -0.17 -2.18 0.00 0.61 0.98 0.00 0.00 173.24 172.48 3h0g n GLY 133 N -3.15 0.83 0.75 7.32 0.00 -1.16 -0.44 105.19 109.34 3h0g n GLY 133 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 3h0g n GLY 133 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3h0g n GLU 134 N 0.00 0.00 0.00 1.61 2.13 -1.26 -4.74 120.64 118.38 3h0g n GLU 134 Ca 0.00 0.25 0.00 0.00 0.66 0.00 0.00 57.16 58.07 3h0g n GLU 134 Cb 0.00 -0.69 0.00 0.00 0.27 0.00 0.00 31.44 31.02 3h0g n GLU 134 CO 0.00 0.00 0.00 -0.40 -0.41 0.00 0.00 177.13 176.32 3h0g n ASP 135 N -0.19 0.00 -3.18 4.31 3.85 -1.26 -4.27 116.55 115.81 3h0g n ASP 135 Ca 0.00 0.00 -0.45 0.00 -0.71 0.00 0.00 54.79 53.63 3h0g n ASP 135 Cb 0.00 0.00 -0.07 0.00 -1.35 0.00 0.00 41.12 39.70 3h0g n ASP 135 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3h0g n GLN 136 N -1.15 0.00 -4.08 0.11 1.13 -1.26 -4.90 117.38 107.22 3h0g n GLN 136 Ca 0.00 0.00 -0.33 0.00 -1.94 0.00 0.00 57.00 54.73 3h0g n GLN 136 Cb 0.00 -1.01 -0.16 0.00 0.11 0.00 0.00 30.24 29.19 3h0g n GLN 136 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 3h0g s VAL 137 N 2.13 2.23 -0.47 5.09 1.01 -1.26 -3.00 120.40 126.12 3h0g s VAL 137 Ca 0.71 -1.07 -0.10 0.00 0.00 0.00 0.00 61.98 61.52 3h0g s VAL 137 Cb -1.01 -2.04 0.11 0.00 0.00 0.00 0.00 36.38 33.44 3h0g s VAL 137 CO 0.55 0.38 0.35 -0.63 0.00 0.00 0.00 175.10 175.75 3h0g s ILE 138 N 1.26 4.37 0.00 2.22 1.01 -1.24 -4.98 121.20 123.83 3h0g s ILE 138 Ca 0.02 -1.66 0.00 0.00 0.00 0.00 0.00 60.65 59.01 3h0g s ILE 138 Cb -0.15 -3.82 0.00 0.00 0.01 0.00 0.00 42.46 38.50 3h0g s ILE 138 CO -0.10 -0.73 0.00 -0.62 0.00 0.00 0.00 174.94 173.49 3h0g n GLU 139 N 4.96 3.44 -0.25 2.79 1.02 -1.26 -2.73 120.64 128.61 3h0g n GLU 139 Ca -0.09 0.00 -0.01 0.00 -0.02 0.00 0.00 57.16 57.04 3h0g n GLU 139 Cb 0.41 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.83 3h0g n GLU 139 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 3h0g n LYS 140 N 0.00 1.03 -2.70 3.49 4.81 -1.26 -3.95 118.16 119.58 3h0g n LYS 140 Ca 0.00 -0.07 -0.06 0.00 -0.87 0.00 0.00 58.31 57.31 3h0g n LYS 140 Cb 0.00 -1.03 0.09 0.00 0.02 0.00 0.00 35.03 34.11 3h0g n LYS 140 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3h0g n GLY 141 N 0.91 -0.51 3.14 3.14 0.00 -1.26 -4.74 105.19 105.88 3h0g n GLY 141 Ca 0.01 0.45 0.03 0.00 0.00 0.00 0.00 46.02 46.52 3h0g n GLY 141 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3h0g s SER 142 N -0.84 -1.36 0.00 1.61 1.04 -1.25 -5.04 113.70 107.86 3h0g s SER 142 Ca 0.24 -0.14 -0.34 0.00 0.48 0.00 0.00 55.95 56.19 3h0g s SER 142 Cb 0.27 1.80 -0.12 0.00 0.10 0.00 0.00 66.02 68.07 3h0g s SER 142 CO -0.14 -0.21 1.78 0.59 0.98 0.00 0.00 173.24 176.24 3h0g n ASN 143 N 4.96 3.36 -4.74 7.02 3.02 -1.25 -4.23 115.26 123.40 3h0g n ASN 143 Ca 0.07 1.01 -0.23 0.00 -0.03 0.00 0.00 54.58 55.40 3h0g n ASN 143 Cb 0.56 -1.40 -0.06 0.00 -0.61 0.00 0.00 39.78 38.28 3h0g n ASN 143 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3h0g s VAL 144 N 3.01 4.01 -0.22 2.41 1.01 -0.92 -2.26 120.40 127.44 3h0g s VAL 144 Ca 0.88 -1.60 -0.08 0.00 0.00 0.00 0.00 61.98 61.18 3h0g s VAL 144 Cb -0.68 -3.15 -0.04 0.00 0.00 0.00 0.00 36.38 32.52 3h0g s VAL 144 CO 0.47 -0.34 0.09 -0.13 0.00 0.00 0.00 175.10 175.18 3h0g s ARG 145 N -3.70 3.85 0.19 2.72 0.52 0.47 -1.57 118.95 121.43 3h0g s ARG 145 Ca 0.32 -0.39 0.05 0.00 -0.52 0.00 0.00 55.73 55.19 3h0g s ARG 145 Cb -0.07 -3.34 -0.05 0.00 0.52 0.00 0.00 34.95 32.01 3h0g s ARG 145 CO 0.22 0.02 -0.08 -0.51 0.02 0.00 0.00 175.30 174.97 3h0g s LEU 146 N 1.09 2.44 -0.48 2.53 1.02 -1.19 -0.95 118.68 123.15 3h0g s LEU 146 Ca 0.05 -1.08 0.02 0.00 0.02 0.00 0.00 54.13 53.14 3h0g s LEU 146 Cb -0.14 -0.40 0.13 0.00 0.02 0.00 0.00 46.19 45.80 3h0g s LEU 146 CO 0.04 -0.35 0.23 -0.54 0.02 0.00 0.00 176.35 175.75 3h0g s LYS 147 N -3.76 1.96 -0.24 1.70 1.02 -1.12 -2.94 119.74 116.37 3h0g s LYS 147 Ca 0.21 -2.32 -0.33 0.00 0.02 0.00 0.00 55.97 53.55 3h0g s LYS 147 Cb 0.03 -3.40 -0.15 0.00 -0.52 0.00 0.00 37.83 33.79 3h0g s LYS 147 CO 0.04 -1.07 1.05 -0.89 -0.92 0.00 0.00 175.35 173.56 3h0g n ILE 148 N 3.64 0.00 -0.11 2.17 5.41 -0.93 -3.53 119.36 126.02 3h0g n ILE 148 Ca 0.04 0.00 -0.14 0.00 1.00 0.00 0.00 62.75 63.66 3h0g n ILE 148 Cb 0.37 -0.24 -0.14 0.00 -0.71 0.00 0.00 39.64 38.92 3h0g n ILE 148 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07 3h0g n VAL 149 N 2.29 1.43 -3.63 1.39 0.31 0.11 0.24 118.33 120.46 3h0g n VAL 149 Ca 0.20 -0.72 -0.14 0.00 -0.01 0.00 0.00 64.34 63.67 3h0g n VAL 149 Cb -0.01 -0.92 -0.07 0.00 -0.91 0.00 0.00 33.84 31.94 3h0g n VAL 149 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 3h0g s GLY 150 N -5.96 -0.53 0.17 2.92 0.00 -0.89 -4.75 107.32 98.30 3h0g s GLY 150 Ca -0.22 1.96 0.10 0.00 0.00 0.00 0.00 44.72 46.56 3h0g s GLY 150 CO 0.71 1.68 -0.21 -0.51 0.00 0.00 0.00 173.10 174.77 3h0g s THR 151 N 0.33 2.07 0.04 0.90 -4.23 -1.26 0.15 115.64 113.64 3h0g s THR 151 Ca -0.00 -1.94 -0.00 0.00 -1.18 0.00 0.00 61.69 58.57 3h0g s THR 151 Cb -0.05 -1.95 -0.03 0.00 1.34 0.00 0.00 72.50 71.81 3h0g s THR 151 CO 0.01 -0.20 -0.03 -0.13 -0.54 0.00 0.00 174.62 173.73 3h0g s ARG 152 N -2.66 0.48 -0.33 3.99 1.81 0.85 -4.86 118.95 118.23 3h0g s ARG 152 Ca 0.17 -0.92 0.00 0.00 -1.72 0.00 0.00 55.73 53.26 3h0g s ARG 152 Cb -0.07 0.11 0.10 0.00 -0.45 0.00 0.00 34.95 34.65 3h0g s ARG 152 CO 0.08 -0.07 0.11 0.95 -0.68 0.00 0.00 175.30 175.69 3h0g s THR 153 N -2.63 1.07 -0.34 0.02 -4.23 -1.26 0.17 115.64 108.44 3h0g s THR 153 Ca -0.04 -1.64 0.01 0.00 -1.18 0.00 0.00 61.69 58.84 3h0g s THR 153 Cb -0.01 -1.80 0.09 0.00 1.34 0.00 0.00 72.50 72.11 3h0g s THR 153 CO -0.05 -0.70 0.06 -1.81 -0.54 0.00 0.00 174.62 171.58 3h0g s ASP 154 N 1.39 4.89 -0.23 3.99 1.01 -0.28 -4.76 116.67 122.68 3h0g s ASP 154 Ca 0.11 -1.81 -0.01 0.00 0.71 0.00 0.00 52.55 51.55 3h0g s ASP 154 Cb -0.18 -1.69 -0.01 0.00 1.01 0.00 0.00 42.92 42.04 3h0g s ASP 154 CO -0.20 -0.37 0.20 0.00 0.21 0.00 0.00 175.17 175.01 3h0g n ALA 155 N 4.46 -1.38 0.00 5.23 0.00 -1.26 -3.63 120.51 123.93 3h0g n ALA 155 Ca -0.04 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.41 3h0g n ALA 155 Cb 0.42 -1.11 0.00 0.00 0.00 0.00 0.00 19.45 18.76 3h0g n ALA 155 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3h0g n THR 156 N -1.56 0.00 -2.26 0.00 -2.24 -1.26 -4.84 114.28 102.11 3h0g n THR 156 Ca -0.01 0.00 -0.33 0.00 -2.27 0.00 0.00 64.05 61.44 3h0g n THR 156 Cb 0.52 0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.74 3h0g n THR 156 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3h0g s GLU 157 N 0.00 3.52 0.04 -0.78 2.02 -1.24 -2.91 118.70 119.36 3h0g s GLU 157 Ca 0.00 1.29 0.09 0.00 0.02 0.00 0.00 54.97 56.37 3h0g s GLU 157 Cb 0.00 -2.06 -0.03 0.00 0.10 0.00 0.00 34.13 32.14 3h0g s GLU 157 CO 0.00 -0.65 -0.26 0.42 0.02 0.00 0.00 175.26 174.79 3h0g s ILE 158 N -2.23 2.17 -0.19 -1.63 1.01 -1.26 -1.13 121.20 117.94 3h0g s ILE 158 Ca 0.66 -1.38 -0.10 0.00 0.00 0.00 0.00 60.65 59.83 3h0g s ILE 158 Cb -0.16 -1.85 0.07 0.00 0.01 0.00 0.00 42.46 40.53 3h0g s ILE 158 CO 0.29 0.37 0.45 -0.36 0.00 0.00 0.00 174.94 175.69 3h0g s PHE 159 N -0.81 -0.72 0.17 3.97 0.08 0.44 -4.75 117.98 116.35 3h0g s PHE 159 Ca 0.12 1.47 0.00 0.00 0.12 0.00 0.00 56.93 58.64 3h0g s PHE 159 Cb -0.10 0.33 -0.04 0.00 -0.57 0.00 0.00 43.02 42.64 3h0g s PHE 159 CO 0.02 -0.41 0.06 0.00 -0.10 0.00 0.00 175.22 174.79 3h0g s ALA 160 N 1.75 1.16 -0.05 5.36 0.00 -1.26 0.29 121.76 129.01 3h0g s ALA 160 Ca -0.08 -1.59 0.03 0.00 0.00 0.00 0.00 51.96 50.32 3h0g s ALA 160 Cb -0.09 0.87 -0.03 0.00 0.00 0.00 0.00 23.12 23.88 3h0g s ALA 160 CO -0.14 -0.45 -0.12 0.42 0.00 0.00 0.00 175.76 175.47 3h0g s ILE 161 N -3.92 3.24 0.25 0.00 1.01 0.40 -3.91 121.20 118.27 3h0g s ILE 161 Ca 0.28 -0.67 0.11 0.00 0.00 0.00 0.00 60.65 60.37 3h0g s ILE 161 Cb 0.07 -2.29 -0.05 0.00 0.01 0.00 0.00 42.46 40.21 3h0g s ILE 161 CO 0.05 0.59 -0.17 0.00 0.00 0.00 0.00 174.94 175.41 3h0g s ALA 162 N -0.76 2.78 0.39 9.38 0.00 -1.18 0.05 121.76 132.42 3h0g s ALA 162 Ca 0.12 -1.75 0.06 0.00 0.00 0.00 0.00 51.96 50.39 3h0g s ALA 162 Cb -0.11 -0.40 -0.07 0.00 0.00 0.00 0.00 23.12 22.54 3h0g s ALA 162 CO 0.01 0.33 0.02 0.95 0.00 0.00 0.00 175.76 177.08 3h0g s THR 163 N -2.20 1.75 -0.06 0.00 -4.23 -1.23 -4.33 115.64 105.34 3h0g s THR 163 Ca 0.27 -2.00 0.09 0.00 -1.18 0.00 0.00 61.69 58.88 3h0g s THR 163 Cb -0.06 -2.91 0.14 0.00 1.34 0.00 0.00 72.50 71.01 3h0g s THR 163 CO 0.14 0.00 1.03 0.23 -0.54 0.00 0.00 174.62 175.49 3h0g n MET 164 N -0.91 1.10 0.18 3.99 2.81 -0.35 -2.79 117.12 121.15 3h0g n MET 164 Ca -0.05 -1.81 0.03 0.00 -1.81 0.00 0.00 57.70 54.06 3h0g n MET 164 Cb 0.67 -1.07 0.32 0.00 -0.71 0.00 0.00 33.22 32.43 3h0g n MET 164 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 3h0g h LYS 165 N 0.00 0.00 -7.47 0.03 1.57 -1.97 -3.43 116.57 105.31 3h0g h LYS 165 Ca 0.00 0.00 -0.48 0.00 -1.87 0.00 0.00 60.65 58.30 3h0g h LYS 165 Cb 1.03 0.00 0.08 0.00 0.08 0.00 0.00 32.23 33.42 3h0g h LYS 165 CO 0.00 0.43 0.37 -1.21 -0.57 0.00 0.00 179.45 178.47 3h0g s GLU 166 N -3.87 2.53 0.51 3.15 0.41 -1.26 -5.03 118.70 115.15 3h0g s GLU 166 Ca -0.02 0.24 -0.21 0.00 -0.41 0.00 0.00 54.97 54.57 3h0g s GLU 166 Cb 0.13 -2.04 -0.06 0.00 -1.78 0.00 0.00 34.13 30.38 3h0g s GLU 166 CO 0.72 -1.19 1.20 -0.51 -0.49 0.00 0.00 175.26 174.99 3h0g s ASP 167 N -4.43 5.75 -0.99 -0.19 1.01 -1.26 -3.50 116.67 113.05 3h0g s ASP 167 Ca 0.59 2.38 -0.02 0.00 0.71 0.00 0.00 52.55 56.21 3h0g s ASP 167 Cb -0.11 -2.60 0.00 0.00 1.01 0.00 0.00 42.92 41.22 3h0g s ASP 167 CO 0.50 -1.21 0.26 -1.22 0.21 0.00 0.00 175.17 173.71 3h0g n TYR 168 N -0.92 -1.02 -4.44 4.23 4.01 -1.26 -5.03 117.16 112.72 3h0g n TYR 168 Ca 0.10 0.22 -0.22 0.00 -0.16 0.00 0.00 57.90 57.84 3h0g n TYR 168 Cb 0.48 -3.05 -0.10 0.00 -0.31 0.00 0.00 39.34 36.36 3h0g n TYR 168 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 3h0g s LEU 169 N -4.09 2.52 0.00 7.72 1.43 -1.23 -4.97 118.68 120.06 3h0g s LEU 169 Ca 0.13 -1.18 0.00 0.00 -1.03 0.00 0.00 54.13 52.05 3h0g s LEU 169 Cb -0.06 -0.70 0.00 0.00 0.03 0.00 0.00 46.19 45.47 3h0g s LEU 169 CO 0.16 -0.31 0.00 0.61 0.23 0.00 0.00 176.35 177.04 3h0g n GLY 170 N -0.61 0.24 3.68 -3.19 0.00 -0.12 -4.89 105.19 100.30 3h0g n GLY 170 Ca -0.05 -1.90 -0.42 0.00 0.00 0.00 0.00 46.02 43.65 3h0g n GLY 170 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3h0g n VAL 171 N 0.00 2.21 0.30 1.61 0.31 -1.26 -0.39 118.33 121.10 3h0g n VAL 171 Ca 0.00 -0.50 0.04 0.00 -0.01 0.00 0.00 64.34 63.87 3h0g n VAL 171 Cb 0.00 -1.48 0.03 0.00 -0.91 0.00 0.00 33.84 31.48 3h0g n VAL 171 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69