#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b3e s THR 5 N 0.00 4.70 -0.23 -0.18 2.01 -1.26 0.15 115.64 120.83 1b3e s THR 5 Ca 0.00 -0.04 -0.21 0.00 0.31 0.00 0.00 61.69 61.75 1b3e s THR 5 Cb 0.00 -3.21 -0.02 0.00 0.01 0.00 0.00 72.50 69.28 1b3e s THR 5 CO 0.00 0.32 0.65 -0.69 -0.69 0.00 0.00 174.62 174.21 1b3e s VAL 6 N 1.57 4.98 -0.60 3.82 1.01 0.18 -4.89 120.40 126.47 1b3e s VAL 6 Ca 0.06 1.20 -0.21 0.00 0.00 0.00 0.00 61.98 63.03 1b3e s VAL 6 Cb -0.15 -3.96 0.07 0.00 0.00 0.00 0.00 36.38 32.34 1b3e s VAL 6 CO 0.06 0.05 0.84 -0.13 0.00 0.00 0.00 175.10 175.92 1b3e s ARG 7 N 2.33 3.13 0.08 2.72 0.52 -1.26 0.31 118.95 126.78 1b3e s ARG 7 Ca 0.28 -0.87 -0.26 0.00 -0.52 0.00 0.00 55.73 54.35 1b3e s ARG 7 Cb -0.16 -4.19 -0.06 0.00 0.52 0.00 0.00 34.95 31.07 1b3e s ARG 7 CO 0.09 -1.60 0.82 -0.46 0.02 0.00 0.00 175.30 174.17 1b3e s TRP 8 N 3.47 3.78 -0.51 -0.53 -0.11 0.14 0.01 118.94 125.19 1b3e s TRP 8 Ca 0.20 1.58 -0.19 0.00 1.22 0.00 0.00 56.10 58.91 1b3e s TRP 8 Cb -0.18 -2.87 0.07 0.00 -1.50 0.00 0.00 33.47 28.98 1b3e s TRP 8 CO 0.11 0.29 0.61 0.00 -4.62 0.00 0.00 176.95 173.34 1b3e s ALA 10 N 2.51 3.52 -0.60 0.00 0.00 0.29 -4.77 121.76 122.72 1b3e s ALA 10 Ca 0.13 0.04 -0.17 0.00 0.00 0.00 0.00 51.96 51.96 1b3e s ALA 10 Cb -0.21 -2.71 0.13 0.00 0.00 0.00 0.00 23.12 20.34 1b3e s ALA 10 CO 0.10 0.25 0.61 0.08 0.00 0.00 0.00 175.76 176.81 1b3e s VAL 11 N -0.55 5.13 0.09 0.00 1.01 -1.26 0.04 120.40 124.85 1b3e s VAL 11 Ca 0.30 -1.47 0.00 0.00 0.00 0.00 0.00 61.98 60.81 1b3e s VAL 11 Cb -0.19 -4.41 0.00 0.00 0.00 0.00 0.00 36.38 31.78 1b3e s VAL 11 CO 0.18 -0.99 0.00 -0.24 0.00 0.00 0.00 175.10 174.05 1b3e n SER 12 N 5.46 -3.07 -0.24 3.32 2.88 0.45 -4.31 113.62 118.11 1b3e n SER 12 Ca -0.08 0.41 -0.10 0.00 -1.33 0.00 0.00 58.87 57.77 1b3e n SER 12 Cb 0.42 -1.14 -0.08 0.00 -0.75 0.00 0.00 64.21 62.65 1b3e n SER 12 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 1b3e h GLU 13 N 0.00 -0.12 -0.68 -1.46 4.39 -1.93 -2.31 114.58 112.46 1b3e h GLU 13 Ca 0.01 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.72 1b3e h GLU 13 Cb 0.35 0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 28.99 1b3e h GLU 13 CO 0.00 -0.08 0.44 0.45 -1.16 0.00 0.00 179.01 178.66 1b3e h HIS 14 N -0.13 0.86 -0.46 4.33 3.86 -1.91 -0.81 115.15 120.89 1b3e h HIS 14 Ca 0.10 0.02 -0.06 0.00 -1.16 0.00 0.00 60.37 59.27 1b3e h HIS 14 Cb 0.38 -0.29 -0.02 0.00 1.06 0.00 0.00 27.41 28.54 1b3e h HIS 14 CO -0.89 0.55 0.04 0.93 0.86 0.00 0.00 177.93 179.43 1b3e h GLU 15 N 0.92 0.73 -0.43 2.45 5.08 -1.73 -0.98 114.58 120.63 1b3e h GLU 15 Ca 0.25 -0.17 -0.07 0.00 -1.00 0.00 0.00 59.36 58.36 1b3e h GLU 15 Cb -0.09 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.04 1b3e h GLU 15 CO -0.05 0.72 -0.02 0.00 -1.00 0.00 0.00 179.01 178.65 1b3e h ALA 16 N 1.35 0.58 0.13 3.43 0.00 -0.89 0.32 119.26 124.18 1b3e h ALA 16 Ca 0.15 -0.28 0.01 0.00 0.00 0.00 0.00 54.91 54.78 1b3e h ALA 16 Cb 0.37 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1b3e h ALA 16 CO 0.01 0.39 -0.17 1.15 0.00 0.00 0.00 179.25 180.63 1b3e h THR 17 N 0.60 0.62 -0.81 0.00 2.02 -0.78 -0.28 112.91 114.28 1b3e h THR 17 Ca 0.12 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.28 1b3e h THR 17 Cb 0.52 0.62 -0.04 0.00 -1.74 0.00 0.00 68.15 67.51 1b3e h THR 17 CO 0.03 0.00 0.44 0.50 0.37 0.00 0.00 175.52 176.86 1b3e h LYS 18 N -0.34 1.13 -0.69 6.66 3.64 -1.00 -2.54 116.57 123.42 1b3e h LYS 18 Ca 0.01 -0.13 -0.01 0.00 -1.27 0.00 0.00 60.65 59.25 1b3e h LYS 18 Cb 0.34 -0.22 -0.03 0.00 -0.41 0.00 0.00 32.23 31.91 1b3e h LYS 18 CO -0.07 0.83 0.37 0.00 -2.27 0.00 0.00 179.45 178.31 1b3e h GLN 20 N 0.95 0.48 -0.01 0.00 4.20 -0.84 0.45 115.11 120.34 1b3e h GLN 20 Ca 0.24 -0.11 -0.16 0.00 0.06 0.00 0.00 58.65 58.68 1b3e h GLN 20 Cb 0.05 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 27.74 1b3e h GLN 20 CO -0.04 0.54 -0.73 1.03 -0.67 0.00 0.00 178.83 178.97 1b3e h SER 21 N 0.46 0.08 0.43 1.46 0.87 -0.95 -0.64 113.55 115.26 1b3e h SER 21 Ca 0.10 -0.06 -0.02 0.00 -1.23 0.00 0.00 61.79 60.58 1b3e h SER 21 Cb 0.37 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 62.31 1b3e h SER 21 CO 0.02 0.78 -0.21 0.15 -0.53 0.00 0.00 176.83 177.04 1b3e h PHE 22 N 0.04 -0.54 -0.42 2.24 3.57 0.90 -2.29 116.94 120.44 1b3e h PHE 22 Ca -0.01 -0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.56 1b3e h PHE 22 Cb 1.29 0.18 -0.09 0.00 2.79 0.00 0.00 35.95 40.11 1b3e h PHE 22 CO 0.01 -0.21 -0.32 -0.09 -2.23 0.00 0.00 178.31 175.46 1b3e h ARG 23 N -0.97 -0.22 -0.36 1.11 2.43 -0.06 -1.76 114.38 114.55 1b3e h ARG 23 Ca -0.06 0.02 0.04 0.00 -0.81 0.00 0.00 59.98 59.16 1b3e h ARG 23 Cb 0.56 0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 30.13 1b3e h ARG 23 CO 0.10 -0.15 0.14 -0.44 -1.51 0.00 0.00 179.97 178.11 1b3e h ASP 24 N -0.23 0.17 -0.11 -3.80 3.32 -1.16 -2.14 116.42 112.47 1b3e h ASP 24 Ca 0.18 0.03 -0.11 0.00 0.02 0.00 0.00 57.03 57.15 1b3e h ASP 24 Cb 0.53 0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.08 1b3e h ASP 24 CO -0.55 0.13 -0.30 0.45 -1.72 0.00 0.00 179.24 177.25 1b3e h HIS 25 N 0.30 0.68 -0.60 4.55 3.86 -1.01 -2.88 115.15 120.04 1b3e h HIS 25 Ca 0.16 -0.17 -0.07 0.00 -1.16 0.00 0.00 60.37 59.14 1b3e h HIS 25 Cb 0.12 -0.16 -0.03 0.00 1.06 0.00 0.00 27.41 28.41 1b3e h HIS 25 CO -0.13 0.82 0.11 0.52 0.86 0.00 0.00 177.93 180.12 1b3e h MET 26 N 0.51 0.96 -0.59 2.45 2.86 -1.12 -2.53 114.93 117.46 1b3e h MET 26 Ca 0.06 -0.23 0.17 0.00 -2.06 0.00 0.00 59.70 57.65 1b3e h MET 26 Cb 0.77 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 32.28 1b3e h MET 26 CO 0.06 0.88 0.53 0.87 1.06 0.00 0.00 176.91 180.31 1b3e h LYS 27 N 0.91 0.00 0.00 1.72 1.79 -1.16 0.04 116.57 119.87 1b3e h LYS 27 Ca 0.19 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.66 1b3e h LYS 27 Cb 0.37 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.02 1b3e h LYS 27 CO 0.01 0.00 -0.76 -1.13 -1.08 0.00 0.00 179.45 176.48 1b3e n SER 28 N -3.92 0.68 -0.21 0.86 3.41 -0.96 -4.25 113.62 109.24 1b3e n SER 28 Ca 0.12 0.04 0.03 0.00 -0.26 0.00 0.00 58.87 58.79 1b3e n SER 28 Cb 0.76 0.36 0.02 0.00 -0.26 0.00 0.00 64.21 65.09 1b3e n SER 28 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 1b3e n VAL 29 N -2.10 0.03 -5.02 -3.33 0.24 -0.07 -5.00 118.33 103.08 1b3e n VAL 29 Ca 0.03 -0.51 -0.32 0.00 -2.04 0.00 0.00 64.34 61.49 1b3e n VAL 29 Cb 0.44 1.09 -0.15 0.00 -1.47 0.00 0.00 33.84 33.76 1b3e n VAL 29 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 1b3e s ILE 30 N -0.45 2.66 0.54 1.34 1.01 -0.76 -5.11 121.20 120.43 1b3e s ILE 30 Ca 0.06 -0.85 -0.22 0.00 0.00 0.00 0.00 60.65 59.65 1b3e s ILE 30 Cb 0.04 -2.03 -0.05 0.00 0.01 0.00 0.00 42.46 40.43 1b3e s ILE 30 CO 0.07 0.57 1.29 -0.81 0.00 0.00 0.00 174.94 176.05 1b3e n PRO 31 N 2.80 1.58 0.25 2.79 -0.04 -1.26 -4.86 135.00 136.26 1b3e n PRO 31 Ca -0.17 0.58 0.10 0.00 -0.04 0.00 0.00 63.50 63.97 1b3e n PRO 31 Cb 0.52 -2.48 0.55 0.00 -0.04 0.00 0.00 33.50 32.05 1b3e n PRO 31 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1b3e h SER 32 N 1.35 0.00 -0.49 3.54 0.02 -1.99 0.44 113.55 116.41 1b3e h SER 32 Ca -0.50 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.45 1b3e h SER 32 Cb 1.31 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.85 1b3e h SER 32 CO 0.56 0.00 0.00 -0.90 -1.14 0.00 0.00 176.83 175.35 1b3e n ASP 33 N -2.45 3.52 -4.83 3.07 5.75 -1.26 -4.99 116.55 115.35 1b3e n ASP 33 Ca -0.01 -1.97 -0.22 0.00 -0.01 0.00 0.00 54.79 52.57 1b3e n ASP 33 Cb 0.38 -0.32 0.07 0.00 -1.03 0.00 0.00 41.12 40.22 1b3e n ASP 33 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 1b3e s GLY 34 N -1.23 1.79 0.50 6.12 0.00 0.15 -5.05 107.32 109.61 1b3e s GLY 34 Ca 0.39 -1.63 -0.23 0.00 0.00 0.00 0.00 44.72 43.26 1b3e s GLY 34 CO 0.30 -1.19 1.29 2.56 0.00 0.00 0.00 173.10 176.06 1b3e s PRO 35 N -4.93 3.42 0.29 2.90 0.04 -1.26 -4.90 135.00 130.56 1b3e s PRO 35 Ca 0.62 2.09 0.07 0.00 0.04 0.00 0.00 61.00 63.82 1b3e s PRO 35 Cb -0.07 -2.35 -0.06 0.00 0.04 0.00 0.00 34.50 32.06 1b3e s PRO 35 CO 0.41 -0.92 -0.05 -1.54 0.04 0.00 0.00 177.00 174.94 1b3e s SER 36 N -1.05 2.80 -0.11 6.66 1.04 0.12 -4.99 113.70 118.18 1b3e s SER 36 Ca 0.68 -1.20 -0.02 0.00 0.48 0.00 0.00 55.95 55.88 1b3e s SER 36 Cb -0.37 -0.18 -0.03 0.00 0.10 0.00 0.00 66.02 65.55 1b3e s SER 36 CO 0.44 -0.35 -0.01 -0.69 0.98 0.00 0.00 173.24 173.61 1b3e s VAL 37 N -3.00 4.20 0.00 5.02 1.01 -1.26 0.51 120.40 126.88 1b3e s VAL 37 Ca 0.30 -0.27 0.07 0.00 0.00 0.00 0.00 61.98 62.08 1b3e s VAL 37 Cb 0.04 -2.79 -0.02 0.00 0.00 0.00 0.00 36.38 33.61 1b3e s VAL 37 CO 0.12 0.57 -0.22 0.00 0.00 0.00 0.00 175.10 175.57 1b3e s ALA 38 N -0.50 1.87 -0.20 5.51 0.00 0.15 -4.79 121.76 123.80 1b3e s ALA 38 Ca 0.08 -1.01 -0.05 0.00 0.00 0.00 0.00 51.96 50.98 1b3e s ALA 38 Cb -0.12 -0.45 -0.02 0.00 0.00 0.00 0.00 23.12 22.53 1b3e s ALA 38 CO 0.02 0.45 0.01 0.00 0.00 0.00 0.00 175.76 176.24 1b3e s VAL 40 N 1.02 3.28 -0.13 0.00 1.01 0.11 -4.94 120.40 120.74 1b3e s VAL 40 Ca 0.02 -0.64 -0.19 0.00 0.00 0.00 0.00 61.98 61.18 1b3e s VAL 40 Cb -0.14 -2.54 -0.04 0.00 0.00 0.00 0.00 36.38 33.65 1b3e s VAL 40 CO 0.02 0.35 0.50 -0.75 0.00 0.00 0.00 175.10 175.22 1b3e s LYS 41 N 1.44 4.32 0.35 2.72 2.20 -1.26 0.10 119.74 129.62 1b3e s LYS 41 Ca 0.04 0.48 0.04 0.00 -0.36 0.00 0.00 55.97 56.17 1b3e s LYS 41 Cb -0.15 -3.46 -0.06 0.00 -1.51 0.00 0.00 37.83 32.64 1b3e s LYS 41 CO -0.03 0.09 0.05 0.15 -0.36 0.00 0.00 175.35 175.24 1b3e s LYS 42 N 0.85 1.74 0.10 4.03 -0.14 0.11 -4.93 119.74 121.50 1b3e s LYS 42 Ca 0.26 -1.98 0.10 0.00 -1.36 0.00 0.00 55.97 53.00 1b3e s LYS 42 Cb -0.15 -1.02 -0.16 0.00 -1.68 0.00 0.00 37.83 34.82 1b3e s LYS 42 CO 0.11 -0.18 1.13 0.00 -0.76 0.00 0.00 175.35 175.64 1b3e h ALA 43 N 2.01 0.53 -2.95 5.17 0.00 -1.95 0.13 119.26 122.20 1b3e h ALA 43 Ca -0.41 -0.96 -0.04 0.00 0.00 0.00 0.00 54.91 53.50 1b3e h ALA 43 Cb 1.25 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 19.03 1b3e h ALA 43 CO 0.71 1.20 0.11 -1.54 0.00 0.00 0.00 179.25 179.73 1b3e s SER 44 N -6.45 0.04 0.39 0.00 1.04 -1.26 -4.65 113.70 102.81 1b3e s SER 44 Ca -0.00 -0.99 0.10 0.00 0.48 0.00 0.00 55.95 55.54 1b3e s SER 44 Cb 0.09 0.73 0.78 0.00 0.10 0.00 0.00 66.02 67.72 1b3e s SER 44 CO 0.81 -1.42 1.91 0.10 0.98 0.00 0.00 173.24 175.62 1b3e h TYR 45 N 2.07 0.24 -0.52 5.02 -0.00 -1.94 -2.49 116.97 119.35 1b3e h TYR 45 Ca -0.26 -0.03 -0.05 0.00 -0.00 0.00 0.00 58.73 58.39 1b3e h TYR 45 Cb 1.25 -0.07 -0.02 0.00 -0.00 0.00 0.00 36.73 37.89 1b3e h TYR 45 CO 0.90 0.37 0.12 1.25 -0.00 0.00 0.00 178.16 180.81 1b3e h LEU 46 N 0.22 0.79 -1.00 0.10 5.85 -1.96 -0.22 115.31 119.09 1b3e h LEU 46 Ca 0.04 -0.23 -0.03 0.00 0.84 0.00 0.00 57.88 58.50 1b3e h LEU 46 Cb 0.38 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.17 1b3e h LEU 46 CO 0.02 0.82 0.36 0.44 -0.34 0.00 0.00 178.44 179.74 1b3e h ASP 47 N 0.72 0.97 -0.70 1.25 5.19 -1.87 -0.64 116.42 121.34 1b3e h ASP 47 Ca 0.16 -0.11 -0.03 0.00 -0.62 0.00 0.00 57.03 56.43 1b3e h ASP 47 Cb 0.34 -0.25 -0.03 0.00 0.18 0.00 0.00 39.33 39.57 1b3e h ASP 47 CO 0.00 0.82 0.33 0.00 -3.12 0.00 0.00 179.24 177.27 1b3e h ILE 49 N 1.02 1.27 -0.37 0.00 2.04 0.17 -1.82 117.51 119.83 1b3e h ILE 49 Ca 0.25 -1.12 -0.04 0.00 1.00 0.00 0.00 64.86 64.95 1b3e h ILE 49 Cb 0.12 1.27 -0.01 0.00 -0.74 0.00 0.00 36.82 37.45 1b3e h ILE 49 CO -0.03 0.37 0.08 0.03 0.00 0.00 0.00 178.15 178.60 1b3e h ARG 50 N 0.48 0.60 -0.49 2.37 3.08 -0.73 -2.17 114.38 117.52 1b3e h ARG 50 Ca 0.09 -0.15 0.06 0.00 0.07 0.00 0.00 59.98 60.05 1b3e h ARG 50 Cb 0.57 -0.07 -0.05 0.00 0.08 0.00 0.00 29.97 30.49 1b3e h ARG 50 CO 0.03 0.65 0.20 0.00 -1.07 0.00 0.00 179.97 179.78 1b3e h ALA 51 N 0.92 0.60 -0.33 0.04 0.00 -0.69 0.18 119.26 119.98 1b3e h ALA 51 Ca 0.11 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1b3e h ALA 51 Cb 0.33 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1b3e h ALA 51 CO 0.00 -0.17 0.18 0.82 0.00 0.00 0.00 179.25 180.08 1b3e h ILE 52 N 0.40 1.14 -0.39 0.00 2.04 -1.18 0.16 117.51 119.68 1b3e h ILE 52 Ca 0.22 -0.37 -0.05 0.00 1.00 0.00 0.00 64.86 65.67 1b3e h ILE 52 Cb 0.19 0.78 -0.02 0.00 -0.74 0.00 0.00 36.82 37.04 1b3e h ILE 52 CO -0.20 0.14 0.05 0.00 0.00 0.00 0.00 178.15 178.14 1b3e h ALA 53 N 1.04 1.36 -0.10 1.87 0.00 -0.95 -1.42 119.26 121.06 1b3e h ALA 53 Ca 0.12 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1b3e h ALA 53 Cb 0.07 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1b3e h ALA 53 CO -0.02 0.45 0.00 0.00 0.00 0.00 0.00 179.25 179.68 1b3e n ALA 54 N -2.47 2.54 -2.68 0.00 0.00 0.58 -4.91 120.51 113.56 1b3e n ALA 54 Ca 0.02 -0.30 -0.16 0.00 0.00 0.00 0.00 53.44 53.00 1b3e n ALA 54 Cb 0.23 -1.14 0.02 0.00 0.00 0.00 0.00 19.45 18.56 1b3e n ALA 54 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1b3e n ASN 55 N -0.20 -4.82 -0.00 0.00 5.15 -0.44 -4.89 115.26 110.05 1b3e n ASN 55 Ca 0.12 -0.16 0.09 0.00 -0.60 0.00 0.00 54.58 54.03 1b3e n ASN 55 Cb 0.17 -3.75 -0.11 0.00 -0.53 0.00 0.00 39.78 35.56 1b3e n ASN 55 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1b3e n GLU 56 N -2.97 0.88 -3.98 1.20 1.02 0.43 -4.99 120.64 112.23 1b3e n GLU 56 Ca -0.11 -0.04 -0.11 0.00 -0.02 0.00 0.00 57.16 56.88 1b3e n GLU 56 Cb 0.60 -1.38 -0.03 0.00 -0.02 0.00 0.00 31.44 30.61 1b3e n GLU 56 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1b3e s ALA 57 N -2.86 -0.07 0.00 0.62 0.00 -1.22 -4.94 121.76 113.29 1b3e s ALA 57 Ca 0.03 -1.03 0.00 0.00 0.00 0.00 0.00 51.96 50.97 1b3e s ALA 57 Cb 0.13 1.01 0.00 0.00 0.00 0.00 0.00 23.12 24.26 1b3e s ALA 57 CO 0.76 -0.87 0.00 -0.25 0.00 0.00 0.00 175.76 175.40 1b3e n ASP 58 N -0.91 3.56 -3.66 0.00 8.00 0.10 -4.26 116.55 119.37 1b3e n ASP 58 Ca -0.02 0.00 -0.15 0.00 0.71 0.00 0.00 54.79 55.33 1b3e n ASP 58 Cb 0.61 0.69 -0.07 0.00 -0.02 0.00 0.00 41.12 42.33 1b3e n ASP 58 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1b3e s ALA 59 N -1.44 -1.16 -0.18 2.24 0.00 -1.05 -4.42 121.76 115.75 1b3e s ALA 59 Ca 0.00 0.65 -0.28 0.00 0.00 0.00 0.00 51.96 52.34 1b3e s ALA 59 Cb 0.00 0.11 0.08 0.00 0.00 0.00 0.00 23.12 23.31 1b3e s ALA 59 CO 0.00 -0.34 0.76 0.54 0.00 0.00 0.00 175.76 176.72 1b3e s VAL 60 N -1.51 0.00 -0.04 0.00 0.11 -1.24 -0.82 120.40 116.90 1b3e s VAL 60 Ca -0.11 0.00 -0.15 0.00 -2.93 0.00 0.00 61.98 58.79 1b3e s VAL 60 Cb -0.03 -1.00 -0.05 0.00 -1.53 0.00 0.00 36.38 33.77 1b3e s VAL 60 CO 0.05 0.00 0.39 -0.89 -3.33 0.00 0.00 175.10 171.32 1b3e s THR 61 N -0.35 5.11 0.06 5.04 2.01 -1.26 -1.13 115.64 125.12 1b3e s THR 61 Ca -0.04 0.80 0.03 0.00 0.31 0.00 0.00 61.69 62.79 1b3e s THR 61 Cb -0.03 -3.71 -0.03 0.00 0.01 0.00 0.00 72.50 68.75 1b3e s THR 61 CO 0.04 0.51 -0.09 -0.76 -0.69 0.00 0.00 174.62 173.63 1b3e s LEU 62 N -0.59 2.30 0.54 4.42 1.43 -0.44 -4.95 118.68 121.39 1b3e s LEU 62 Ca 0.23 -0.63 -0.20 0.00 -1.03 0.00 0.00 54.13 52.49 1b3e s LEU 62 Cb -0.16 -0.25 -0.05 0.00 0.03 0.00 0.00 46.19 45.76 1b3e s LEU 62 CO 0.11 -0.21 1.18 -0.62 0.23 0.00 0.00 176.35 177.04 1b3e s ASP 63 N -1.84 5.64 0.39 2.29 2.15 -1.26 -1.34 116.67 122.70 1b3e s ASP 63 Ca -0.05 2.31 0.15 0.00 0.43 0.00 0.00 52.55 55.39 1b3e s ASP 63 Cb -0.08 -2.59 1.01 0.00 -0.30 0.00 0.00 42.92 40.96 1b3e s ASP 63 CO 0.00 -1.28 1.82 0.00 -0.17 0.00 0.00 175.17 175.54 1b3e h ALA 64 N 1.32 2.10 -0.24 3.66 0.00 -1.78 -1.29 119.26 123.02 1b3e h ALA 64 Ca -0.50 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.40 1b3e h ALA 64 Cb 1.27 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 1b3e h ALA 64 CO 0.57 -0.43 -0.07 0.78 0.00 0.00 0.00 179.25 180.10 1b3e h GLY 65 N 0.49 0.41 2.00 0.00 0.00 -1.91 -1.49 103.07 102.56 1b3e h GLY 65 Ca 0.52 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 47.60 1b3e h GLY 65 CO -0.25 0.23 0.00 1.04 0.00 0.00 0.00 176.54 177.57 1b3e n LEU 66 N -4.27 0.32 0.25 3.11 4.77 -0.50 -2.63 117.00 118.05 1b3e n LEU 66 Ca 0.00 0.54 0.16 0.00 -0.03 0.00 0.00 56.01 56.68 1b3e n LEU 66 Cb 0.26 -0.45 0.54 0.00 -2.33 0.00 0.00 43.42 41.44 1b3e n LEU 66 CO 0.39 -0.15 0.94 0.58 -1.33 0.00 0.00 177.39 177.81 1b3e h VAL 67 N 0.00 0.00 -0.35 4.08 2.07 -1.15 -2.58 116.25 118.32 1b3e h VAL 67 Ca 0.00 -0.60 -0.13 0.00 0.82 0.00 0.00 66.70 66.79 1b3e h VAL 67 Cb 0.52 1.58 -0.01 0.00 -1.52 0.00 0.00 31.29 31.87 1b3e h VAL 67 CO 0.00 0.00 -0.28 0.22 0.02 0.00 0.00 177.57 177.53 1b3e h TYR 68 N 0.00 0.96 -0.24 1.57 3.20 -1.58 -2.74 116.97 118.15 1b3e h TYR 68 Ca 0.00 -0.27 -0.10 0.00 3.14 0.00 0.00 58.73 61.50 1b3e h TYR 68 Cb 0.62 -0.21 -0.00 0.00 1.54 0.00 0.00 36.73 38.68 1b3e h TYR 68 CO 0.00 1.05 -0.24 -0.44 -1.64 0.00 0.00 178.16 176.89 1b3e h ASP 69 N 0.60 0.61 0.11 -2.11 3.32 -1.63 -3.05 116.42 114.27 1b3e h ASP 69 Ca 0.06 -0.48 -0.02 0.00 0.02 0.00 0.00 57.03 56.62 1b3e h ASP 69 Cb 0.86 -0.17 -0.00 0.00 0.22 0.00 0.00 39.33 40.23 1b3e h ASP 69 CO 0.07 0.96 -0.09 0.00 -1.72 0.00 0.00 179.24 178.47 1b3e h ALA 70 N 0.67 1.77 -0.09 3.45 0.00 -1.51 -3.10 119.26 120.46 1b3e h ALA 70 Ca 0.04 -0.08 -0.19 0.00 0.00 0.00 0.00 54.91 54.68 1b3e h ALA 70 Cb 0.79 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.58 1b3e h ALA 70 CO 0.06 0.11 -0.67 -0.92 0.00 0.00 0.00 179.25 177.83 1b3e h TYR 71 N 0.00 0.84 -3.88 0.00 3.20 -1.41 0.25 116.97 115.97 1b3e h TYR 71 Ca -0.00 -0.40 -0.55 0.00 3.14 0.00 0.00 58.73 60.92 1b3e h TYR 71 Cb 0.17 -0.12 0.18 0.00 1.54 0.00 0.00 36.73 38.50 1b3e h TYR 71 CO 0.00 1.21 0.18 1.28 -1.64 0.00 0.00 178.16 179.18 1b3e n LEU 72 N -4.10 3.89 -4.82 2.82 4.77 -1.16 -2.95 117.00 115.46 1b3e n LEU 72 Ca -0.09 0.66 -0.33 0.00 -0.03 0.00 0.00 56.01 56.23 1b3e n LEU 72 Cb 0.69 -1.44 -0.00 0.00 -2.33 0.00 0.00 43.42 40.34 1b3e n LEU 72 CO 0.50 -1.89 0.71 0.00 -1.33 0.00 0.00 177.39 175.37 1b3e s ALA 73 N -1.84 2.84 -2.02 -1.18 0.00 -1.26 -0.57 121.76 117.73 1b3e s ALA 73 Ca 0.74 0.33 0.29 0.00 0.00 0.00 0.00 51.96 53.32 1b3e s ALA 73 Cb -0.34 -3.20 1.72 0.00 0.00 0.00 0.00 23.12 21.30 1b3e s ALA 73 CO 0.50 -0.63 2.11 -0.35 0.00 0.00 0.00 175.76 177.38 1b3e n PRO 74 N -1.90 1.04 0.17 0.00 -0.04 -1.26 -4.86 135.00 128.15 1b3e n PRO 74 Ca 0.08 -0.05 -0.12 0.00 -0.04 0.00 0.00 63.50 63.36 1b3e n PRO 74 Cb 0.53 -1.46 -0.07 0.00 -0.04 0.00 0.00 33.50 32.46 1b3e n PRO 74 CO 0.00 0.00 0.00 -0.91 -0.04 0.00 0.00 175.50 174.55 1b3e h ASN 75 N 0.12 -0.40 -6.32 3.54 2.35 -1.51 -3.48 115.58 109.89 1b3e h ASN 75 Ca 0.00 -0.16 -0.47 0.00 -0.55 0.00 0.00 56.30 55.12 1b3e h ASN 75 Cb 0.03 0.10 -0.02 0.00 0.05 0.00 0.00 38.32 38.48 1b3e h ASN 75 CO 0.00 0.01 -0.84 0.59 -1.65 0.00 0.00 177.43 175.54 1b3e n ASN 76 N -5.13 -1.65 -4.94 5.81 3.02 0.26 -4.75 115.26 107.88 1b3e n ASN 76 Ca -0.09 -0.89 -0.24 0.00 -0.03 0.00 0.00 54.58 53.32 1b3e n ASN 76 Cb 0.27 -3.58 -0.01 0.00 -0.61 0.00 0.00 39.78 35.86 1b3e n ASN 76 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1b3e s LEU 77 N -6.93 3.91 0.03 3.41 1.43 0.84 -3.27 118.68 118.11 1b3e s LEU 77 Ca 0.17 0.48 0.02 0.00 -1.03 0.00 0.00 54.13 53.77 1b3e s LEU 77 Cb -0.09 -3.36 -0.02 0.00 0.03 0.00 0.00 46.19 42.75 1b3e s LEU 77 CO 0.85 -0.39 -0.07 -1.59 0.23 0.00 0.00 176.35 175.38 1b3e s LYS 78 N -4.41 0.49 0.15 1.70 -2.85 0.10 -4.08 119.74 110.85 1b3e s LYS 78 Ca 0.42 -0.68 -0.30 0.00 -1.00 0.00 0.00 55.97 54.41 1b3e s LYS 78 Cb -0.10 -0.25 -0.07 0.00 -2.06 0.00 0.00 37.83 35.35 1b3e s LYS 78 CO 0.37 0.04 1.09 -1.25 0.10 0.00 0.00 175.35 175.70 1b3e s PRO 79 N -1.41 4.59 -0.00 1.78 0.04 -1.26 -0.65 135.00 138.09 1b3e s PRO 79 Ca -0.09 1.68 0.00 0.00 0.04 0.00 0.00 61.00 62.62 1b3e s PRO 79 Cb -0.09 -3.30 -0.00 0.00 0.04 0.00 0.00 34.50 31.15 1b3e s PRO 79 CO 0.00 0.06 -0.00 1.33 0.04 0.00 0.00 177.00 178.44 1b3e n VAL 80 N 2.60 0.01 -4.19 -0.36 0.24 -0.28 -4.85 118.33 111.51 1b3e n VAL 80 Ca 0.03 -0.00 -0.21 0.00 -2.04 0.00 0.00 64.34 62.12 1b3e n VAL 80 Cb 0.47 -0.73 -0.16 0.00 -1.47 0.00 0.00 33.84 31.94 1b3e n VAL 80 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1b3e s VAL 81 N -2.00 0.62 0.08 3.34 1.01 -1.20 -1.18 120.40 121.07 1b3e s VAL 81 Ca -0.00 -0.16 0.03 0.00 0.00 0.00 0.00 61.98 61.85 1b3e s VAL 81 Cb 0.00 -0.64 -0.04 0.00 0.00 0.00 0.00 36.38 35.70 1b3e s VAL 81 CO 0.00 0.25 0.08 0.00 0.00 0.00 0.00 175.10 175.43 1b3e s ALA 82 N 0.96 3.56 0.28 5.51 0.00 0.12 0.43 121.76 132.61 1b3e s ALA 82 Ca -0.10 -1.03 -0.17 0.00 0.00 0.00 0.00 51.96 50.66 1b3e s ALA 82 Cb -0.14 -1.42 -0.09 0.00 0.00 0.00 0.00 23.12 21.47 1b3e s ALA 82 CO 0.00 0.73 0.72 -1.21 0.00 0.00 0.00 175.76 176.01 1b3e s GLU 83 N -2.43 4.09 0.02 0.00 2.02 -0.48 -0.45 118.70 121.47 1b3e s GLU 83 Ca 0.29 0.73 0.07 0.00 0.02 0.00 0.00 54.97 56.09 1b3e s GLU 83 Cb -0.12 -2.63 -0.02 0.00 0.10 0.00 0.00 34.13 31.46 1b3e s GLU 83 CO 0.22 0.26 -0.22 -0.59 0.02 0.00 0.00 175.26 174.96 1b3e s PHE 84 N -1.78 1.93 0.49 1.61 -0.12 -0.38 -4.65 117.98 115.07 1b3e s PHE 84 Ca 0.49 -0.37 0.05 0.00 -0.05 0.00 0.00 56.93 57.05 1b3e s PHE 84 Cb -0.13 -1.19 -0.01 0.00 -0.63 0.00 0.00 43.02 41.06 1b3e s PHE 84 CO 0.19 0.04 0.22 0.71 -0.05 0.00 0.00 175.22 176.32 1b3e s TYR 85 N -0.66 2.02 0.00 3.49 2.02 0.04 -0.28 117.35 123.99 1b3e s TYR 85 Ca 0.08 -0.79 0.00 0.00 -0.37 0.00 0.00 57.07 56.00 1b3e s TYR 85 Cb -0.09 -1.85 0.00 0.00 -0.40 0.00 0.00 41.96 39.63 1b3e s TYR 85 CO 0.01 -0.06 0.00 0.41 -1.57 0.00 0.00 175.55 174.34 1b3e n GLY 86 N -1.45 1.40 3.70 0.71 0.00 -1.26 -0.97 105.19 107.32 1b3e n GLY 86 Ca -0.06 -0.46 -0.10 0.00 0.00 0.00 0.00 46.02 45.40 1b3e n GLY 86 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1b3e s SER 87 N -4.00 0.15 0.16 1.61 1.04 -0.80 -4.93 113.70 106.93 1b3e s SER 87 Ca 0.00 -1.09 0.02 0.00 0.48 0.00 0.00 55.95 55.36 1b3e s SER 87 Cb 0.00 0.73 -0.03 0.00 0.10 0.00 0.00 66.02 66.83 1b3e s SER 87 CO 0.00 -1.43 1.36 0.11 0.98 0.00 0.00 173.24 174.26 1b3e h LYS 88 N 2.08 0.22 0.00 4.02 1.79 -1.92 -2.39 116.57 120.37 1b3e h LYS 88 Ca -0.28 -0.24 -0.13 0.00 -2.18 0.00 0.00 60.65 57.82 1b3e h LYS 88 Cb 1.25 0.07 -0.02 0.00 -1.58 0.00 0.00 32.23 31.95 1b3e h LYS 88 CO 0.36 0.98 -0.63 0.93 -1.08 0.00 0.00 179.45 180.01 1b3e h GLU 89 N 0.12 0.00 -2.39 3.15 3.07 -1.99 -3.38 114.58 113.16 1b3e h GLU 89 Ca -0.05 0.00 -0.54 0.00 -0.50 0.00 0.00 59.36 58.27 1b3e h GLU 89 Cb 1.53 0.00 -0.37 0.00 -0.84 0.00 0.00 28.75 29.07 1b3e h GLU 89 CO 0.14 0.63 -0.85 0.34 -1.40 0.00 0.00 179.01 177.86 1b3e s ASP 90 N -6.72 2.18 -0.16 1.42 2.15 -1.20 -5.12 116.67 109.22 1b3e s ASP 90 Ca -0.00 -2.33 -0.29 0.00 0.43 0.00 0.00 52.55 50.36 1b3e s ASP 90 Cb 0.12 -0.21 -0.01 0.00 -0.30 0.00 0.00 42.92 42.51 1b3e s ASP 90 CO 0.76 -0.26 1.13 -2.84 -0.17 0.00 0.00 175.17 173.78 1b3e s PRO 91 N 0.85 4.30 -0.23 4.34 0.02 -0.90 -1.90 135.00 141.47 1b3e s PRO 91 Ca 0.22 1.51 -0.08 0.00 0.02 0.00 0.00 61.00 62.67 1b3e s PRO 91 Cb -0.14 -3.65 -0.04 0.00 0.02 0.00 0.00 34.50 30.69 1b3e s PRO 91 CO -0.05 -0.57 0.10 -0.65 -0.33 0.00 0.00 177.00 175.50 1b3e s GLN 92 N 2.91 3.87 -0.58 5.54 -0.21 -0.14 -4.93 119.66 126.12 1b3e s GLN 92 Ca 0.50 -0.38 0.01 0.00 0.02 0.00 0.00 55.36 55.51 1b3e s GLN 92 Cb -0.19 -3.36 0.43 0.00 1.00 0.00 0.00 33.01 30.89 1b3e s GLN 92 CO 0.13 0.01 1.70 0.25 -2.12 0.00 0.00 175.29 175.26 1b3e n THR 93 N 4.37 3.18 -3.69 -0.19 -2.24 -1.26 -0.78 114.28 113.67 1b3e n THR 93 Ca -0.16 -3.78 -0.05 0.00 -2.27 0.00 0.00 64.05 57.79 1b3e n THR 93 Cb 0.52 -1.18 -0.02 0.00 -2.10 0.00 0.00 70.33 67.55 1b3e n THR 93 CO 0.00 0.00 0.00 0.72 -0.57 0.00 0.00 175.07 175.22 1b3e s PHE 94 N -3.78 -0.21 0.30 4.78 -0.71 -1.26 -2.78 117.98 114.32 1b3e s PHE 94 Ca 0.57 -0.07 -0.07 0.00 -1.04 0.00 0.00 56.93 56.32 1b3e s PHE 94 Cb 0.46 0.62 0.00 0.00 -1.21 0.00 0.00 43.02 42.89 1b3e s PHE 94 CO -0.10 -0.81 0.47 1.52 -1.34 0.00 0.00 175.22 174.96 1b3e s TYR 95 N -3.34 0.74 -0.11 3.49 1.13 -0.38 -4.83 117.35 114.05 1b3e s TYR 95 Ca 0.10 -1.05 -0.03 0.00 -1.41 0.00 0.00 57.07 54.67 1b3e s TYR 95 Cb -0.02 0.05 -0.03 0.00 -1.10 0.00 0.00 41.96 40.86 1b3e s TYR 95 CO -0.01 -1.08 0.01 0.71 -2.51 0.00 0.00 175.55 172.68 1b3e s TYR 96 N -3.44 3.17 -0.06 -3.49 2.02 -1.26 -0.57 117.35 113.72 1b3e s TYR 96 Ca 0.27 0.11 -0.18 0.00 -0.37 0.00 0.00 57.07 56.91 1b3e s TYR 96 Cb -0.00 -1.87 -0.05 0.00 -0.40 0.00 0.00 41.96 39.64 1b3e s TYR 96 CO 0.15 0.35 0.48 0.00 -1.57 0.00 0.00 175.55 174.96 1b3e s ALA 97 N -0.50 3.54 0.11 3.71 0.00 0.52 -1.18 121.76 127.96 1b3e s ALA 97 Ca 0.09 -0.15 0.01 0.00 0.00 0.00 0.00 51.96 51.90 1b3e s ALA 97 Cb -0.12 -2.59 -0.04 0.00 0.00 0.00 0.00 23.12 20.37 1b3e s ALA 97 CO 0.02 0.17 -0.01 0.14 0.00 0.00 0.00 175.76 176.08 1b3e s VAL 98 N -0.03 0.45 -0.31 0.00 -7.23 -0.04 -0.30 120.40 112.95 1b3e s VAL 98 Ca 0.26 -1.91 -0.05 0.00 -1.81 0.00 0.00 61.98 58.47 1b3e s VAL 98 Cb -0.16 -1.85 0.04 0.00 0.56 0.00 0.00 36.38 34.97 1b3e s VAL 98 CO 0.12 -0.70 0.05 0.00 -0.31 0.00 0.00 175.10 174.27 1b3e s ALA 99 N -3.79 2.94 -0.21 1.32 0.00 -1.26 -1.90 121.76 118.86 1b3e s ALA 99 Ca 0.17 -1.69 -0.08 0.00 0.00 0.00 0.00 51.96 50.35 1b3e s ALA 99 Cb 0.07 -2.10 -0.04 0.00 0.00 0.00 0.00 23.12 21.04 1b3e s ALA 99 CO -0.02 -1.23 0.09 0.08 0.00 0.00 0.00 175.76 174.69 1b3e s VAL 100 N 1.36 4.93 0.22 0.00 1.01 -0.28 -0.87 120.40 126.77 1b3e s VAL 100 Ca -0.02 0.02 0.06 0.00 0.00 0.00 0.00 61.98 62.04 1b3e s VAL 100 Cb -0.19 -3.26 -0.05 0.00 0.00 0.00 0.00 36.38 32.88 1b3e s VAL 100 CO 0.01 0.41 -0.08 0.68 0.00 0.00 0.00 175.10 176.12 1b3e s VAL 101 N 0.70 1.47 0.41 2.92 -7.23 -0.69 -0.73 120.40 117.24 1b3e s VAL 101 Ca 0.05 -2.12 -0.20 0.00 -1.81 0.00 0.00 61.98 57.90 1b3e s VAL 101 Cb -0.13 -2.18 -0.10 0.00 0.56 0.00 0.00 36.38 34.52 1b3e s VAL 101 CO 0.02 -0.49 0.90 -0.54 -0.31 0.00 0.00 175.10 174.68 1b3e s LYS 102 N -3.73 4.17 0.31 4.82 1.02 -1.26 -1.30 119.74 123.77 1b3e s LYS 102 Ca 0.25 1.02 -0.29 0.00 0.02 0.00 0.00 55.97 56.96 1b3e s LYS 102 Cb 0.02 -2.23 -0.10 0.00 -0.52 0.00 0.00 37.83 35.00 1b3e s LYS 102 CO 0.07 0.00 1.37 0.21 -0.92 0.00 0.00 175.35 176.09 1b3e s LYS 103 N -3.16 4.30 -0.85 1.68 2.20 0.16 -3.10 119.74 120.97 1b3e s LYS 103 Ca 0.60 2.29 0.00 0.00 -0.36 0.00 0.00 55.97 58.50 1b3e s LYS 103 Cb -0.09 -3.07 0.00 0.00 -1.51 0.00 0.00 37.83 33.16 1b3e s LYS 103 CO 0.14 -0.30 0.00 -0.25 -0.36 0.00 0.00 175.35 174.58 1b3e n ASP 104 N 1.20 -3.67 0.01 1.43 8.00 -1.26 -4.89 116.55 117.36 1b3e n ASP 104 Ca 0.02 0.13 0.13 0.00 0.71 0.00 0.00 54.79 55.78 1b3e n ASP 104 Cb 0.41 -2.30 0.39 0.00 -0.02 0.00 0.00 41.12 39.61 1b3e n ASP 104 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1b3e n SER 105 N 0.53 0.33 0.00 -2.24 3.41 -1.18 -4.98 113.62 109.49 1b3e n SER 105 Ca -0.09 0.09 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1b3e n SER 105 Cb 0.39 -0.08 0.00 0.00 -0.26 0.00 0.00 64.21 64.26 1b3e n SER 105 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1b3e n GLY 106 N 1.48 1.90 3.78 5.00 0.00 -1.26 -5.02 105.19 111.08 1b3e n GLY 106 Ca 0.06 -0.27 -0.34 0.00 0.00 0.00 0.00 46.02 45.47 1b3e n GLY 106 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1b3e s PHE 107 N -0.12 2.80 0.49 1.61 -0.71 -1.26 -5.08 117.98 115.71 1b3e s PHE 107 Ca 0.00 1.54 0.04 0.00 -1.04 0.00 0.00 56.93 57.47 1b3e s PHE 107 Cb 0.00 -3.14 0.04 0.00 -1.21 0.00 0.00 43.02 38.71 1b3e s PHE 107 CO 0.00 -1.36 0.34 1.04 -1.34 0.00 0.00 175.22 173.90 1b3e n GLN 108 N -1.76 0.78 -0.30 1.99 1.13 -1.26 -4.98 117.38 112.98 1b3e n GLN 108 Ca 0.10 -3.08 0.14 0.00 -1.94 0.00 0.00 57.00 52.23 1b3e n GLN 108 Cb 0.52 0.36 0.38 0.00 0.11 0.00 0.00 30.24 31.62 1b3e n GLN 108 CO 0.00 0.00 0.00 1.98 -1.44 0.00 0.00 177.06 177.60 1b3e h MET 109 N 0.00 0.64 0.00 -1.09 4.05 -1.88 -1.18 114.93 115.47 1b3e h MET 109 Ca -0.31 -0.04 0.00 0.00 -0.28 0.00 0.00 59.70 59.07 1b3e h MET 109 Cb 1.13 -0.15 0.00 0.00 -0.80 0.00 0.00 31.60 31.79 1b3e h MET 109 CO 0.50 0.43 0.00 0.27 0.23 0.00 0.00 176.91 178.33 1b3e n ASN 110 N -4.62 0.00 -2.19 1.39 0.23 -1.26 -3.59 115.26 105.22 1b3e n ASN 110 Ca 0.20 0.19 -0.29 0.00 -0.53 0.00 0.00 54.58 54.15 1b3e n ASN 110 Cb 0.57 -0.39 0.05 0.00 -2.08 0.00 0.00 39.78 37.92 1b3e n ASN 110 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1b3e n GLN 111 N -1.39 3.18 0.16 -3.83 6.02 -0.45 -4.68 117.38 116.39 1b3e n GLN 111 Ca 0.10 -3.77 0.05 0.00 -0.01 0.00 0.00 57.00 53.38 1b3e n GLN 111 Cb 0.28 -2.28 0.06 0.00 1.02 0.00 0.00 30.24 29.31 1b3e n GLN 111 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 1b3e h LEU 112 N 2.12 0.00 -9.95 1.08 3.38 -1.69 -3.44 115.31 106.80 1b3e h LEU 112 Ca 0.48 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.91 1b3e h LEU 112 Cb 1.17 0.00 0.11 0.00 0.09 0.00 0.00 40.66 42.02 1b3e h LEU 112 CO 1.16 0.35 0.75 -0.60 0.09 0.00 0.00 178.44 180.18 1b3e s ARG 113 N -3.04 4.03 0.00 1.13 3.52 -1.26 -1.97 118.95 121.35 1b3e s ARG 113 Ca 0.04 2.51 0.00 0.00 -0.13 0.00 0.00 55.73 58.15 1b3e s ARG 113 Cb 0.07 -2.90 0.00 0.00 -1.56 0.00 0.00 34.95 30.56 1b3e s ARG 113 CO 0.73 -0.58 0.00 0.41 -0.81 0.00 0.00 175.30 175.05 1b3e n GLY 114 N 0.51 1.93 3.91 8.12 0.00 0.53 -4.99 105.19 115.19 1b3e n GLY 114 Ca 0.02 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.76 1b3e n GLY 114 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b3e s LYS 115 N -0.33 1.90 -0.16 1.61 -0.14 -0.83 -3.80 119.74 117.99 1b3e s LYS 115 Ca 0.00 -0.05 -0.03 0.00 -1.36 0.00 0.00 55.97 54.53 1b3e s LYS 115 Cb 0.00 -2.00 -0.03 0.00 -1.68 0.00 0.00 37.83 34.12 1b3e s LYS 115 CO 0.00 -1.57 -0.04 0.15 -0.76 0.00 0.00 175.35 173.12 1b3e s LYS 116 N -5.51 3.64 0.18 1.68 1.02 -1.26 0.42 119.74 119.91 1b3e s LYS 116 Ca 0.63 -0.53 0.09 0.00 0.02 0.00 0.00 55.97 56.17 1b3e s LYS 116 Cb -0.10 -2.90 -0.04 0.00 -0.52 0.00 0.00 37.83 34.26 1b3e s LYS 116 CO 0.48 0.22 -0.08 -1.54 -0.92 0.00 0.00 175.35 173.51 1b3e s SER 117 N 0.41 4.33 -0.18 2.83 1.04 -0.88 -0.03 113.70 121.21 1b3e s SER 117 Ca -0.04 -0.55 0.01 0.00 0.48 0.00 0.00 55.95 55.85 1b3e s SER 117 Cb -0.14 -0.76 0.03 0.00 0.10 0.00 0.00 66.02 65.24 1b3e s SER 117 CO 0.03 0.10 -0.15 0.00 0.98 0.00 0.00 173.24 174.21 1b3e s HIS 119 N 1.36 2.67 0.14 0.00 3.76 -0.56 -0.92 115.29 121.74 1b3e s HIS 119 Ca 0.02 -0.19 -0.14 0.00 -0.15 0.00 0.00 55.06 54.59 1b3e s HIS 119 Cb -0.15 -1.44 0.02 0.00 1.11 0.00 0.00 32.58 32.12 1b3e s HIS 119 CO -0.10 0.37 1.67 1.79 -0.85 0.00 0.00 174.74 177.61 1b3e h THR 120 N 3.56 1.22 -1.09 1.30 1.35 -1.74 -3.40 112.91 114.11 1b3e h THR 120 Ca -0.49 -0.72 0.33 0.00 -0.55 0.00 0.00 66.41 64.98 1b3e h THR 120 Cb 1.16 0.83 -0.20 0.00 -1.73 0.00 0.00 68.15 68.21 1b3e h THR 120 CO 0.50 0.26 0.96 -0.83 -0.25 0.00 0.00 175.52 176.16 1b3e s GLY 121 N -3.07 -0.22 0.13 5.82 0.00 -1.26 -1.31 107.32 107.40 1b3e s GLY 121 Ca -0.13 1.84 -0.31 0.00 0.00 0.00 0.00 44.72 46.13 1b3e s GLY 121 CO 0.77 0.61 1.30 -2.27 0.00 0.00 0.00 173.10 173.51 1b3e s LEU 122 N -2.08 4.39 0.00 0.66 1.98 0.76 -3.25 118.68 121.15 1b3e s LEU 122 Ca 0.12 2.26 0.00 0.00 -2.89 0.00 0.00 54.13 53.61 1b3e s LEU 122 Cb -0.01 -3.59 0.00 0.00 0.66 0.00 0.00 46.19 43.25 1b3e s LEU 122 CO -0.03 -0.54 0.00 0.61 -1.89 0.00 0.00 176.35 174.51 1b3e n GLY 123 N 2.97 1.44 3.86 7.98 0.00 -1.26 -4.99 105.19 115.19 1b3e n GLY 123 Ca 0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.79 1b3e n GLY 123 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1b3e s ARG 124 N -0.30 3.86 0.00 1.61 0.52 -1.20 -3.77 118.95 119.67 1b3e s ARG 124 Ca 0.00 0.63 0.00 0.00 -0.52 0.00 0.00 55.73 55.84 1b3e s ARG 124 Cb 0.00 -2.33 0.00 0.00 0.52 0.00 0.00 34.95 33.14 1b3e s ARG 124 CO 0.00 -0.07 0.95 0.43 0.02 0.00 0.00 175.30 176.64 1b3e n SER 125 N -1.22 0.00 -0.11 0.23 7.64 -1.26 -0.75 113.62 118.15 1b3e n SER 125 Ca 0.04 0.95 -0.14 0.00 1.01 0.00 0.00 58.87 60.74 1b3e n SER 125 Cb 0.54 -0.45 -0.03 0.00 -1.01 0.00 0.00 64.21 63.26 1b3e n SER 125 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1b3e h ALA 126 N -1.65 0.54 0.00 -0.43 0.00 -1.91 0.60 119.26 116.41 1b3e h ALA 126 Ca 0.00 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1b3e h ALA 126 Cb 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1b3e h ALA 126 CO 0.00 0.67 0.00 0.78 0.00 0.00 0.00 179.25 180.70 1b3e h GLY 127 N 0.74 0.00 0.00 0.00 0.00 -1.68 -3.39 103.07 98.74 1b3e h GLY 127 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.38 1b3e h GLY 127 CO 0.10 0.00 0.00 1.87 0.00 0.00 0.00 176.54 178.51 1b3e n TRP 128 N -2.55 -2.07 0.09 5.60 -0.00 -0.79 -4.27 117.44 113.45 1b3e n TRP 128 Ca 0.04 0.43 -0.12 0.00 -0.00 0.00 0.00 57.50 57.85 1b3e n TRP 128 Cb 0.40 0.98 -0.06 0.00 -0.00 0.00 0.00 31.31 32.63 1b3e n TRP 128 CO 0.00 0.00 0.00 -0.91 -0.00 0.00 0.00 177.69 176.78 1b3e h ASN 129 N 0.00 -0.30 0.64 5.87 2.35 -0.75 -1.62 115.58 121.78 1b3e h ASN 129 Ca 0.00 0.03 -0.03 0.00 -0.55 0.00 0.00 56.30 55.75 1b3e h ASN 129 Cb 0.00 0.11 0.01 0.00 0.05 0.00 0.00 38.32 38.48 1b3e h ASN 129 CO 0.00 -0.17 -0.31 0.40 -1.65 0.00 0.00 177.43 175.70 1b3e h ILE 130 N -0.24 0.00 0.45 2.81 1.08 -1.11 -0.94 117.51 119.56 1b3e h ILE 130 Ca 0.01 -0.18 -0.01 0.00 -0.39 0.00 0.00 64.86 64.29 1b3e h ILE 130 Cb 0.24 0.00 -0.01 0.00 -3.07 0.00 0.00 36.82 33.98 1b3e h ILE 130 CO -0.04 0.00 -0.30 1.55 -0.69 0.00 0.00 178.15 178.67 1b3e h PRO 131 N -1.05 -0.70 -0.26 2.37 0.13 -1.75 -1.64 132.00 129.11 1b3e h PRO 131 Ca -0.09 0.05 -0.03 0.00 -0.87 0.00 0.00 66.00 65.05 1b3e h PRO 131 Cb 0.66 0.16 -0.01 0.00 0.13 0.00 0.00 31.00 31.94 1b3e h PRO 131 CO 0.15 -0.46 0.01 0.82 -0.23 0.00 0.00 178.00 178.28 1b3e h ILE 132 N -0.72 1.16 -0.64 -3.56 1.08 -1.43 -1.65 117.51 111.75 1b3e h ILE 132 Ca -0.05 -0.60 0.02 0.00 -0.39 0.00 0.00 64.86 63.84 1b3e h ILE 132 Cb 0.60 0.95 -0.04 0.00 -3.07 0.00 0.00 36.82 35.27 1b3e h ILE 132 CO 0.04 0.21 0.41 1.23 -0.69 0.00 0.00 178.15 179.34 1b3e h GLY 133 N 0.68 0.91 2.00 5.37 0.00 -0.78 -1.70 103.07 109.55 1b3e h GLY 133 Ca 0.09 -0.32 -0.01 0.00 0.00 0.00 0.00 47.33 47.09 1b3e h GLY 133 CO 0.00 0.29 -0.03 1.41 0.00 0.00 0.00 176.54 178.21 1b3e h LEU 134 N 0.82 0.00 -0.03 3.11 3.38 -0.34 -3.30 115.31 118.95 1b3e h LEU 134 Ca 0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.22 1b3e h LEU 134 Cb -0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.71 1b3e h LEU 134 CO -0.08 0.03 -0.16 0.00 0.09 0.00 0.00 178.44 178.32 1b3e n LEU 135 N -3.22 0.20 -0.02 1.67 -0.00 -0.90 -4.54 117.00 110.18 1b3e n LEU 135 Ca -0.01 -0.51 -0.12 0.00 -0.00 0.00 0.00 56.01 55.36 1b3e n LEU 135 Cb 0.21 0.00 -0.07 0.00 -0.00 0.00 0.00 43.42 43.56 1b3e n LEU 135 CO 0.25 0.05 0.76 0.10 -0.00 0.00 0.00 177.39 178.55 1b3e h TYR 136 N 0.02 0.17 0.00 1.47 -0.00 -1.41 -2.82 116.97 114.40 1b3e h TYR 136 Ca 0.00 -0.03 -0.06 0.00 -0.00 0.00 0.00 58.73 58.64 1b3e h TYR 136 Cb 0.09 -0.04 -0.01 0.00 -0.00 0.00 0.00 36.73 36.76 1b3e h TYR 136 CO 0.00 0.38 -0.29 0.00 -0.00 0.00 0.00 178.16 178.25 1b3e n ASP 138 N -4.14 0.00 -4.27 0.00 9.92 -1.07 -4.31 116.55 112.68 1b3e n ASP 138 Ca -0.02 -1.15 -0.42 0.00 -0.53 0.00 0.00 54.79 52.67 1b3e n ASP 138 Cb 0.34 0.00 -0.08 0.00 -0.64 0.00 0.00 41.12 40.74 1b3e n ASP 138 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 1b3e s LEU 139 N -1.25 5.57 0.11 0.64 1.43 -0.23 -4.92 118.68 120.02 1b3e s LEU 139 Ca 0.08 -1.69 0.09 0.00 -1.03 0.00 0.00 54.13 51.59 1b3e s LEU 139 Cb 0.04 -2.05 0.46 0.00 0.03 0.00 0.00 46.19 44.67 1b3e s LEU 139 CO 0.06 -0.66 1.28 -0.81 0.23 0.00 0.00 176.35 176.46 1b3e n PRO 140 N 4.99 0.05 -2.59 1.29 -0.04 -1.26 -4.44 135.00 133.01 1b3e n PRO 140 Ca -0.10 0.51 -0.43 0.00 -0.04 0.00 0.00 63.50 63.44 1b3e n PRO 140 Cb 0.42 -1.65 -0.02 0.00 -0.04 0.00 0.00 33.50 32.20 1b3e n PRO 140 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 1b3e s GLU 141 N -3.18 3.73 -1.41 0.54 -1.05 -1.26 -4.95 118.70 111.13 1b3e s GLU 141 Ca 0.00 0.62 -0.14 0.00 -0.15 0.00 0.00 54.97 55.30 1b3e s GLU 141 Cb 0.03 -3.91 -0.01 0.00 -0.44 0.00 0.00 34.13 29.81 1b3e s GLU 141 CO 0.11 -1.37 2.35 -0.35 0.95 0.00 0.00 175.26 176.95 1b3e n PRO 142 N 7.81 2.87 -0.69 -4.83 -0.04 -1.26 -4.15 135.00 134.71 1b3e n PRO 142 Ca 0.12 -2.42 0.01 0.00 -0.04 0.00 0.00 63.50 61.17 1b3e n PRO 142 Cb 0.49 -3.13 0.24 0.00 -0.04 0.00 0.00 33.50 31.06 1b3e n PRO 142 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1b3e n ARG 143 N 5.63 2.67 0.00 0.54 5.12 -1.26 -4.85 116.66 124.51 1b3e n ARG 143 Ca 0.57 -3.01 0.00 0.00 -1.93 0.00 0.00 57.85 53.48 1b3e n ARG 143 Cb 0.35 -1.91 0.00 0.00 -1.16 0.00 0.00 32.46 29.74 1b3e n ARG 143 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 1b3e n LYS 144 N -0.68 0.00 -0.83 5.56 4.01 -1.26 -3.30 118.16 121.66 1b3e n LYS 144 Ca 0.30 0.08 -0.13 0.00 -0.51 0.00 0.00 58.31 58.05 1b3e n LYS 144 Cb 1.06 -1.65 -0.12 0.00 -0.51 0.00 0.00 35.03 33.81 1b3e n LYS 144 CO 0.00 0.00 0.00 -0.35 -1.11 0.00 0.00 177.40 175.94 1b3e n PRO 145 N -0.89 1.80 0.00 1.97 -0.04 -1.26 -4.16 135.00 132.42 1b3e n PRO 145 Ca 0.00 -0.97 0.00 0.00 -0.04 0.00 0.00 63.50 62.49 1b3e n PRO 145 Cb 0.15 -2.02 0.00 0.00 -0.04 0.00 0.00 33.50 31.59 1b3e n PRO 145 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 1b3e n LEU 146 N 2.82 0.00 -0.30 1.53 7.94 -1.25 -3.40 117.00 124.33 1b3e n LEU 146 Ca 0.39 0.00 0.03 0.00 -1.11 0.00 0.00 56.01 55.31 1b3e n LEU 146 Cb 0.63 0.00 0.08 0.00 0.53 0.00 0.00 43.42 44.66 1b3e n LEU 146 CO 0.25 0.00 0.51 -0.62 -1.11 0.00 0.00 177.39 176.43 1b3e n GLU 147 N 0.00 -0.12 -0.05 1.96 4.71 -1.26 0.55 120.64 126.43 1b3e n GLU 147 Ca 0.00 1.27 -0.06 0.00 -0.01 0.00 0.00 57.16 58.35 1b3e n GLU 147 Cb 0.00 -1.89 0.12 0.00 -1.01 0.00 0.00 31.44 28.67 1b3e n GLU 147 CO 0.00 0.00 0.00 -0.22 0.09 0.00 0.00 177.13 177.00 1b3e h LYS 148 N 0.00 0.67 0.37 3.49 3.64 -1.84 0.40 116.57 123.30 1b3e h LYS 148 Ca 0.35 -0.27 -0.02 0.00 -1.27 0.00 0.00 60.65 59.44 1b3e h LYS 148 Cb 0.55 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.34 1b3e h LYS 148 CO -0.83 0.85 -0.18 0.00 -2.27 0.00 0.00 179.45 177.03 1b3e h ALA 149 N 1.15 -0.49 -0.50 5.00 0.00 0.12 -1.36 119.26 123.18 1b3e h ALA 149 Ca 0.08 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 54.85 1b3e h ALA 149 Cb 0.72 0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.67 1b3e h ALA 149 CO 0.06 -0.68 0.30 0.28 0.00 0.00 0.00 179.25 179.21 1b3e h VAL 150 N -0.69 1.06 -0.20 0.00 2.07 -0.61 -0.12 116.25 117.76 1b3e h VAL 150 Ca -0.05 -0.21 0.06 0.00 0.82 0.00 0.00 66.70 67.32 1b3e h VAL 150 Cb 0.49 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 30.65 1b3e h VAL 150 CO 0.08 0.11 0.18 0.00 0.02 0.00 0.00 177.57 177.97 1b3e h ALA 151 N 1.22 1.93 -0.01 1.67 0.00 -0.10 0.93 119.26 124.89 1b3e h ALA 151 Ca 0.20 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1b3e h ALA 151 Cb 0.01 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1b3e h ALA 151 CO -0.09 -0.29 -0.68 0.09 0.00 0.00 0.00 179.25 178.29 1b3e n ASN 152 N -4.01 1.64 -0.03 0.00 3.02 -0.52 -4.34 115.26 111.00 1b3e n ASN 152 Ca 0.02 -1.32 -0.19 0.00 -0.03 0.00 0.00 54.58 53.06 1b3e n ASN 152 Cb 0.32 0.68 -0.13 0.00 -0.61 0.00 0.00 39.78 40.03 1b3e n ASN 152 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 1b3e h PHE 153 N 1.50 0.23 -2.77 3.10 3.57 0.95 -3.47 116.94 120.05 1b3e h PHE 153 Ca 0.00 -0.17 -0.48 0.00 3.53 0.00 0.00 57.97 60.86 1b3e h PHE 153 Cb 0.66 -0.01 0.01 0.00 2.79 0.00 0.00 35.95 39.40 1b3e h PHE 153 CO 0.00 1.35 -0.21 -0.06 -2.23 0.00 0.00 178.31 177.17 1b3e s PHE 154 N -2.37 3.50 -0.72 0.41 0.08 -0.76 -0.35 117.98 117.76 1b3e s PHE 154 Ca -0.21 0.33 -0.02 0.00 0.12 0.00 0.00 56.93 57.15 1b3e s PHE 154 Cb 0.02 -1.88 0.41 0.00 -0.57 0.00 0.00 43.02 41.01 1b3e s PHE 154 CO 0.71 0.15 2.01 -1.13 -0.10 0.00 0.00 175.22 176.86 1b3e n SER 155 N -1.73 7.57 0.00 1.36 3.41 0.17 -4.77 113.62 119.63 1b3e n SER 155 Ca -0.05 -3.81 0.00 0.00 -0.26 0.00 0.00 58.87 54.75 1b3e n SER 155 Cb 0.56 -0.99 0.00 0.00 -0.26 0.00 0.00 64.21 63.52 1b3e n SER 155 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1b3e n GLY 156 N -0.78 3.96 3.43 5.00 0.00 -1.26 -4.78 105.19 110.76 1b3e n GLY 156 Ca 0.59 -1.26 -0.14 0.00 0.00 0.00 0.00 46.02 45.21 1b3e n GLY 156 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1b3e s SER 157 N 0.00 0.79 -0.31 1.61 0.01 -0.43 -2.08 113.70 113.30 1b3e s SER 157 Ca 0.00 -1.44 0.01 0.00 1.31 0.00 0.00 55.95 55.83 1b3e s SER 157 Cb 0.00 0.60 0.10 0.00 0.21 0.00 0.00 66.02 66.92 1b3e s SER 157 CO 0.00 -1.17 0.08 0.00 0.41 0.00 0.00 173.24 172.55 1b3e s ALA 159 N 1.39 3.90 0.27 0.00 0.00 -0.09 -1.50 121.76 125.73 1b3e s ALA 159 Ca 0.09 -3.75 -0.28 0.00 0.00 0.00 0.00 51.96 48.02 1b3e s ALA 159 Cb -0.18 -2.42 -0.14 0.00 0.00 0.00 0.00 23.12 20.38 1b3e s ALA 159 CO -0.19 -2.11 0.98 -2.30 0.00 0.00 0.00 175.76 172.14 1b3e n PRO 160 N 2.30 1.21 -0.72 0.00 -0.02 -1.26 -1.70 135.00 134.81 1b3e n PRO 160 Ca 0.18 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 62.09 1b3e n PRO 160 Cb 0.36 -1.77 0.00 0.00 -0.02 0.00 0.00 33.50 32.06 1b3e n PRO 160 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1b3e s ALA 162 N -3.63 2.51 -0.52 0.00 0.00 -0.69 -4.89 121.76 114.53 1b3e s ALA 162 Ca 0.00 -0.35 -0.21 0.00 0.00 0.00 0.00 51.96 51.40 1b3e s ALA 162 Cb 0.00 -3.05 0.05 0.00 0.00 0.00 0.00 23.12 20.12 1b3e s ALA 162 CO 0.00 -1.54 0.75 0.34 0.00 0.00 0.00 175.76 175.31 1b3e s ASP 163 N -4.18 6.27 0.20 0.00 -1.08 -1.26 -4.80 116.67 111.82 1b3e s ASP 163 Ca 0.60 -0.69 0.23 0.00 -0.52 0.00 0.00 52.55 52.18 1b3e s ASP 163 Cb -0.13 -2.35 0.91 0.00 -1.46 0.00 0.00 42.92 39.90 1b3e s ASP 163 CO 0.52 -1.02 1.71 0.61 0.52 0.00 0.00 175.17 177.51 1b3e n GLY 164 N 5.15 -1.36 0.17 2.66 0.00 -1.26 -1.16 105.19 109.39 1b3e n GLY 164 Ca -0.03 0.03 -0.18 0.00 0.00 0.00 0.00 46.02 45.84 1b3e n GLY 164 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1b3e h THR 165 N 0.00 1.35 0.12 2.61 2.02 -1.97 -2.54 112.91 114.50 1b3e h THR 165 Ca 0.00 -2.06 -0.31 0.00 0.77 0.00 0.00 66.41 64.81 1b3e h THR 165 Cb 0.45 2.36 -0.01 0.00 -1.74 0.00 0.00 68.15 69.21 1b3e h THR 165 CO 0.00 0.62 -1.59 0.44 0.37 0.00 0.00 175.52 175.36 1b3e h ASP 166 N 0.18 0.39 -2.18 4.18 3.32 -1.97 -3.41 116.42 116.93 1b3e h ASP 166 Ca -0.08 -0.57 -0.59 0.00 0.02 0.00 0.00 57.03 55.81 1b3e h ASP 166 Cb 1.41 -0.13 -0.42 0.00 0.22 0.00 0.00 39.33 40.41 1b3e h ASP 166 CO 0.15 1.48 -0.68 0.49 -1.72 0.00 0.00 179.24 178.96 1b3e n PHE 167 N -3.44 3.15 -0.25 4.55 3.72 -0.31 -4.93 117.46 119.95 1b3e n PHE 167 Ca -0.18 -4.05 0.28 0.00 -0.05 0.00 0.00 57.45 53.45 1b3e n PHE 167 Cb 1.05 -0.52 0.67 0.00 -0.94 0.00 0.00 39.48 39.74 1b3e n PHE 167 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1b3e h PRO 168 N 3.92 0.11 -0.54 -1.08 0.13 -1.67 0.22 132.00 133.09 1b3e h PRO 168 Ca 0.17 -0.01 0.03 0.00 -0.87 0.00 0.00 66.00 65.32 1b3e h PRO 168 Cb 0.67 -0.03 -0.03 0.00 0.13 0.00 0.00 31.00 31.74 1b3e h PRO 168 CO 0.78 0.08 0.36 1.96 -0.23 0.00 0.00 178.00 180.95 1b3e h GLN 169 N 0.12 0.61 0.00 0.86 7.50 -1.91 -1.65 115.11 120.64 1b3e h GLN 169 Ca 0.49 -0.04 0.00 0.00 0.50 0.00 0.00 58.65 59.61 1b3e h GLN 169 Cb 1.75 -0.14 0.00 0.00 0.05 0.00 0.00 27.48 29.14 1b3e h GLN 169 CO -0.08 0.40 0.00 -0.07 -1.50 0.00 0.00 178.83 177.59 1b3e h LEU 170 N 0.63 0.00 -3.02 1.46 3.38 -0.80 -1.09 115.31 115.87 1b3e h LEU 170 Ca 0.22 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.19 1b3e h LEU 170 Cb 0.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.84 1b3e h LEU 170 CO -0.06 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.47 1b3e h GLN 172 N 1.44 -0.22 0.00 0.00 4.15 -1.02 0.58 115.11 120.05 1b3e h GLN 172 Ca 0.00 0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.43 1b3e h GLN 172 Cb 0.91 0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.65 1b3e h GLN 172 CO 0.06 -0.14 0.00 1.28 -1.93 0.00 0.00 178.83 178.10 1b3e n LEU 173 N -5.29 0.42 -3.05 -2.39 4.32 -0.23 -4.10 117.00 106.68 1b3e n LEU 173 Ca -0.04 0.59 -0.16 0.00 -0.02 0.00 0.00 56.01 56.37 1b3e n LEU 173 Cb 0.20 -0.51 -0.03 0.00 -1.62 0.00 0.00 43.42 41.46 1b3e n LEU 173 CO 0.24 -0.36 -0.09 0.00 -1.22 0.00 0.00 177.39 175.96 1b3e n PRO 175 N 2.34 0.00 0.00 0.00 -0.02 0.12 -0.37 135.00 137.08 1b3e n PRO 175 Ca 0.21 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 1b3e n PRO 175 Cb 0.54 -1.45 0.00 0.00 -0.02 0.00 0.00 33.50 32.57 1b3e n PRO 175 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1b3e n GLY 176 N 4.65 3.12 4.05 -1.23 0.00 -1.26 -4.64 105.19 109.88 1b3e n GLY 176 Ca 0.35 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.06 1b3e n GLY 176 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b3e n GLY 178 N -1.63 0.41 2.64 0.00 0.00 -1.26 -0.12 105.19 105.22 1b3e n GLY 178 Ca -0.05 0.47 -0.34 0.00 0.00 0.00 0.00 46.02 46.10 1b3e n GLY 178 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b3e s SER 180 N -0.77 -0.04 0.00 0.00 1.04 -1.26 -4.56 113.70 108.11 1b3e s SER 180 Ca 0.54 -0.85 0.14 0.00 0.48 0.00 0.00 55.95 56.26 1b3e s SER 180 Cb 0.42 0.68 0.62 0.00 0.10 0.00 0.00 66.02 67.85 1b3e s SER 180 CO -0.27 -1.33 1.40 0.35 0.98 0.00 0.00 173.24 174.37 1b3e n THR 181 N -0.57 0.89 0.29 2.02 -2.24 -1.26 -1.60 114.28 111.81 1b3e n THR 181 Ca -0.06 0.22 0.18 0.00 -2.27 0.00 0.00 64.05 62.12 1b3e n THR 181 Cb 0.60 -0.99 0.82 0.00 -2.10 0.00 0.00 70.33 68.65 1b3e n THR 181 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1b3e h LEU 182 N 0.00 0.00 -8.74 3.22 4.07 -1.94 -3.36 115.31 108.56 1b3e h LEU 182 Ca 0.00 0.00 -0.61 0.00 0.08 0.00 0.00 57.88 57.35 1b3e h LEU 182 Cb 0.19 0.00 -0.11 0.00 1.08 0.00 0.00 40.66 41.82 1b3e h LEU 182 CO 0.00 0.03 0.46 0.21 -1.08 0.00 0.00 178.44 178.06 1b3e s ASN 183 N -5.66 6.53 0.62 -0.43 3.84 -0.62 -4.92 114.94 114.29 1b3e s ASN 183 Ca -0.01 0.24 0.32 0.00 0.21 0.00 0.00 52.86 53.61 1b3e s ASN 183 Cb 0.11 -2.42 1.80 0.00 -0.55 0.00 0.00 41.25 40.19 1b3e s ASN 183 CO 0.52 -0.87 2.12 0.06 -2.79 0.00 0.00 177.10 176.14 1b3e h GLN 184 N 8.73 0.00 -0.63 0.43 3.07 -1.86 -1.76 115.11 123.08 1b3e h GLN 184 Ca -0.24 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.50 1b3e h GLN 184 Cb 1.09 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.65 1b3e h GLN 184 CO 0.96 0.00 0.00 0.66 0.09 0.00 0.00 178.83 180.54 1b3e n TYR 185 N -3.51 1.67 -3.14 0.06 4.01 -1.26 -4.42 117.16 110.57 1b3e n TYR 185 Ca 0.00 -0.61 -0.35 0.00 -0.16 0.00 0.00 57.90 56.78 1b3e n TYR 185 Cb 0.29 -0.37 -0.06 0.00 -0.31 0.00 0.00 39.34 38.89 1b3e n TYR 185 CO 0.00 0.00 0.00 0.12 -0.46 0.00 0.00 176.86 176.52 1b3e s PHE 186 N -2.25 3.60 0.02 -0.72 5.36 -0.67 -3.05 117.98 120.27 1b3e s PHE 186 Ca 0.49 1.32 0.00 0.00 -0.96 0.00 0.00 56.93 57.77 1b3e s PHE 186 Cb 0.34 -2.57 0.00 0.00 -0.34 0.00 0.00 43.02 40.45 1b3e s PHE 186 CO 0.18 0.31 0.00 0.41 -1.46 0.00 0.00 175.22 174.66 1b3e n GLY 187 N 0.54 -1.92 0.12 13.12 0.00 -0.43 -1.89 105.19 114.73 1b3e n GLY 187 Ca -0.02 -1.36 -0.13 0.00 0.00 0.00 0.00 46.02 44.51 1b3e n GLY 187 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1b3e h TYR 188 N -0.08 -0.20 0.00 1.61 0.05 -1.93 0.42 116.97 116.84 1b3e h TYR 188 Ca 0.00 -0.00 -0.05 0.00 0.05 0.00 0.00 58.73 58.72 1b3e h TYR 188 Cb 0.08 0.07 -0.01 0.00 1.01 0.00 0.00 36.73 37.87 1b3e h TYR 188 CO 0.00 -0.10 -0.25 0.77 -1.05 0.00 0.00 178.16 177.53 1b3e h SER 189 N -0.24 0.00 -0.11 3.88 0.02 -1.94 -1.84 113.55 113.33 1b3e h SER 189 Ca -0.02 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 60.87 1b3e h SER 189 Cb 0.19 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.73 1b3e h SER 189 CO 0.04 0.25 -0.17 1.23 -1.14 0.00 0.00 176.83 177.04 1b3e h GLY 190 N 2.58 0.33 1.37 -3.77 0.00 -1.10 -1.08 103.07 101.41 1b3e h GLY 190 Ca -0.00 -0.37 -0.07 0.00 0.00 0.00 0.00 47.33 46.89 1b3e h GLY 190 CO 0.03 0.33 0.00 0.00 0.00 0.00 0.00 176.54 176.91 1b3e h ALA 191 N 0.54 1.13 -0.47 3.60 0.00 -0.79 -1.32 119.26 121.95 1b3e h ALA 191 Ca 0.01 -0.26 -0.12 0.00 0.00 0.00 0.00 54.91 54.54 1b3e h ALA 191 Cb 0.73 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1b3e h ALA 191 CO 0.04 0.56 -0.20 0.35 0.00 0.00 0.00 179.25 180.00 1b3e h PHE 192 N 0.72 1.06 -0.59 0.00 3.57 -1.29 -2.75 116.94 117.66 1b3e h PHE 192 Ca 0.14 -0.25 -0.02 0.00 3.53 0.00 0.00 57.97 61.37 1b3e h PHE 192 Cb 0.44 -0.25 -0.03 0.00 2.79 0.00 0.00 35.95 38.89 1b3e h PHE 192 CO 0.02 1.04 0.27 -0.22 -2.23 0.00 0.00 178.31 177.19 1b3e h LYS 193 N 0.81 0.84 -0.91 1.11 3.64 -0.70 0.11 116.57 121.47 1b3e h LYS 193 Ca 0.11 -0.11 0.07 0.00 -1.27 0.00 0.00 60.65 59.45 1b3e h LYS 193 Cb 0.75 -0.16 -0.06 0.00 -0.41 0.00 0.00 32.23 32.36 1b3e h LYS 193 CO 0.06 0.66 0.59 0.00 -2.27 0.00 0.00 179.45 178.49 1b3e h LEU 195 N 1.02 0.21 -0.18 0.00 5.85 -1.17 -0.55 115.31 120.49 1b3e h LEU 195 Ca 0.40 -0.87 0.05 0.00 0.84 0.00 0.00 57.88 58.30 1b3e h LEU 195 Cb 0.23 -0.06 -0.06 0.00 0.37 0.00 0.00 40.66 41.13 1b3e h LEU 195 CO -0.15 1.05 -0.22 0.50 -0.34 0.00 0.00 178.44 179.28 1b3e h LYS 196 N -0.62 -0.25 0.00 1.25 3.64 -0.30 0.33 116.57 120.61 1b3e h LYS 196 Ca -0.04 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1b3e h LYS 196 Cb 1.12 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 33.00 1b3e h LYS 196 CO 0.05 -0.17 0.00 -0.25 -2.27 0.00 0.00 179.45 176.82 1b3e n ASP 197 N -5.36 0.00 -0.32 4.20 9.92 0.11 -4.79 116.55 120.31 1b3e n ASP 197 Ca -0.02 0.27 -0.04 0.00 -0.53 0.00 0.00 54.79 54.47 1b3e n ASP 197 Cb 0.27 -0.27 -0.02 0.00 -0.64 0.00 0.00 41.12 40.46 1b3e n ASP 197 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1b3e n GLY 198 N -1.26 0.67 0.19 0.44 0.00 0.11 -4.87 105.19 100.47 1b3e n GLY 198 Ca 0.00 -0.36 0.08 0.00 0.00 0.00 0.00 46.02 45.74 1b3e n GLY 198 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b3e h ALA 199 N 0.00 0.87 -2.25 4.61 0.00 -1.30 -3.46 119.26 117.73 1b3e h ALA 199 Ca -0.08 -0.23 -0.29 0.00 0.00 0.00 0.00 54.91 54.31 1b3e h ALA 199 Cb 0.45 -0.04 -0.15 0.00 0.00 0.00 0.00 17.79 18.05 1b3e h ALA 199 CO 0.12 0.32 -0.68 0.20 0.00 0.00 0.00 179.25 179.20 1b3e s GLY 200 N -4.33 1.09 0.05 0.00 0.00 -0.83 -4.91 107.32 98.39 1b3e s GLY 200 Ca 0.04 -1.52 0.23 0.00 0.00 0.00 0.00 44.72 43.47 1b3e s GLY 200 CO 0.69 -1.54 0.91 1.22 0.00 0.00 0.00 173.10 174.38 1b3e n ASP 201 N -0.19 0.55 -3.71 1.64 8.00 0.95 -4.50 116.55 119.30 1b3e n ASP 201 Ca -0.09 -0.15 -0.12 0.00 0.71 0.00 0.00 54.79 55.14 1b3e n ASP 201 Cb 0.62 1.00 -0.10 0.00 -0.02 0.00 0.00 41.12 42.62 1b3e n ASP 201 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1b3e s VAL 202 N -3.27 -0.01 -0.13 2.53 0.11 -1.19 -4.48 120.40 113.97 1b3e s VAL 202 Ca 0.01 0.03 -0.01 0.00 -2.93 0.00 0.00 61.98 59.08 1b3e s VAL 202 Cb 0.14 -0.65 -0.02 0.00 -1.53 0.00 0.00 36.38 34.32 1b3e s VAL 202 CO 0.83 0.01 -0.12 0.00 -3.33 0.00 0.00 175.10 172.49 1b3e s ALA 203 N 0.68 2.68 -0.50 1.54 0.00 0.09 -0.68 121.76 125.57 1b3e s ALA 203 Ca -0.04 -0.88 -0.13 0.00 0.00 0.00 0.00 51.96 50.91 1b3e s ALA 203 Cb -0.05 -1.26 0.11 0.00 0.00 0.00 0.00 23.12 21.92 1b3e s ALA 203 CO -0.05 0.26 0.41 -0.06 0.00 0.00 0.00 175.76 176.32 1b3e s PHE 204 N 0.31 3.31 0.00 0.00 0.08 -0.10 -1.12 117.98 120.46 1b3e s PHE 204 Ca -0.09 -1.43 0.00 0.00 0.12 0.00 0.00 56.93 55.53 1b3e s PHE 204 Cb -0.15 -3.51 0.00 0.00 -0.57 0.00 0.00 43.02 38.78 1b3e s PHE 204 CO 0.05 -0.96 0.00 1.33 -0.10 0.00 0.00 175.22 175.55 1b3e n VAL 205 N 5.11 0.00 -4.05 -0.44 0.24 -0.80 -3.50 118.33 114.88 1b3e n VAL 205 Ca -0.12 0.00 -0.23 0.00 -2.04 0.00 0.00 64.34 61.96 1b3e n VAL 205 Cb 0.41 0.00 -0.06 0.00 -1.47 0.00 0.00 33.84 32.72 1b3e n VAL 205 CO 0.00 0.00 0.00 -1.59 -2.14 0.00 0.00 176.83 173.10 1b3e s LYS 206 N 1.13 2.48 0.53 7.34 -2.85 -1.26 -0.86 119.74 126.25 1b3e s LYS 206 Ca 0.00 -1.45 0.35 0.00 -1.00 0.00 0.00 55.97 53.88 1b3e s LYS 206 Cb 0.00 -2.27 1.91 0.00 -2.06 0.00 0.00 37.83 35.41 1b3e s LYS 206 CO 0.00 0.15 2.08 1.12 0.10 0.00 0.00 175.35 178.80 1b3e h HIS 207 N 1.51 0.00 -0.01 1.78 2.07 -1.49 -2.22 115.15 116.79 1b3e h HIS 207 Ca -0.44 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.08 1b3e h HIS 207 Cb 1.25 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.23 1b3e h HIS 207 CO 0.60 0.00 -0.59 -1.13 -3.07 0.00 0.00 177.93 173.74 1b3e n SER 208 N -2.74 1.76 0.01 3.10 3.41 -1.26 -4.67 113.62 113.22 1b3e n SER 208 Ca -0.02 -1.38 -0.11 0.00 -0.26 0.00 0.00 58.87 57.10 1b3e n SER 208 Cb 0.07 0.60 -0.04 0.00 -0.26 0.00 0.00 64.21 64.58 1b3e n SER 208 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 1b3e h THR 209 N 1.81 0.31 -0.53 6.66 2.02 -1.80 -0.71 112.91 120.66 1b3e h THR 209 Ca 0.00 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.16 1b3e h THR 209 Cb 0.68 0.31 -0.02 0.00 -1.74 0.00 0.00 68.15 67.37 1b3e h THR 209 CO 0.00 0.00 0.27 -0.29 0.37 0.00 0.00 175.52 175.87 1b3e h ILE 210 N -0.40 1.19 -0.67 3.11 2.10 -1.83 -1.88 117.51 119.13 1b3e h ILE 210 Ca 0.09 -0.51 0.06 0.00 1.08 0.00 0.00 64.86 65.58 1b3e h ILE 210 Cb 0.54 0.55 -0.04 0.00 -1.09 0.00 0.00 36.82 36.78 1b3e h ILE 210 CO -0.33 0.21 0.44 -0.26 -1.08 0.00 0.00 178.15 177.13 1b3e h PHE 211 N 0.71 0.70 0.00 2.19 0.04 -1.74 0.49 116.94 119.33 1b3e h PHE 211 Ca 0.18 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.97 1b3e h PHE 211 Cb 0.09 -0.23 0.00 0.00 2.20 0.00 0.00 35.95 38.00 1b3e h PHE 211 CO -0.01 0.38 0.00 0.93 -0.60 0.00 0.00 178.31 179.01 1b3e h GLU 212 N 0.70 0.00 0.00 1.51 5.08 -0.35 -3.35 114.58 118.18 1b3e h GLU 212 Ca 0.28 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.47 1b3e h GLU 212 Cb 0.23 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.45 1b3e h GLU 212 CO -0.09 0.00 -1.67 0.09 -1.00 0.00 0.00 179.01 176.34 1b3e n ASN 213 N -2.84 2.57 -4.13 1.42 3.02 0.73 -4.89 115.26 111.14 1b3e n ASN 213 Ca 0.02 0.00 -0.35 0.00 -0.03 0.00 0.00 54.58 54.22 1b3e n ASN 213 Cb 0.35 0.78 -0.13 0.00 -0.61 0.00 0.00 39.78 40.17 1b3e n ASN 213 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1b3e s LEU 214 N -4.68 4.73 0.09 3.41 1.43 0.14 -5.01 118.68 118.79 1b3e s LEU 214 Ca -0.05 -1.78 -0.35 0.00 -1.03 0.00 0.00 54.13 50.93 1b3e s LEU 214 Cb 0.03 -1.77 -0.16 0.00 0.03 0.00 0.00 46.19 44.33 1b3e s LEU 214 CO 0.41 -0.43 1.58 0.00 0.23 0.00 0.00 176.35 178.14 1b3e h ALA 215 N 7.98 -1.03 -2.70 4.21 0.00 -1.85 -3.43 119.26 122.44 1b3e h ALA 215 Ca -0.15 -0.17 -0.58 0.00 0.00 0.00 0.00 54.91 54.02 1b3e h ALA 215 Cb 1.05 0.68 -0.05 0.00 0.00 0.00 0.00 17.79 19.48 1b3e h ALA 215 CO 0.62 -1.12 -0.06 -0.80 0.00 0.00 0.00 179.25 177.89 1b3e s ASN 216 N -4.45 7.02 0.35 0.00 0.01 -1.26 -4.97 114.94 111.63 1b3e s ASN 216 Ca -0.18 1.21 0.11 0.00 -0.71 0.00 0.00 52.86 53.30 1b3e s ASN 216 Cb 0.05 -2.35 0.90 0.00 0.41 0.00 0.00 41.25 40.27 1b3e s ASN 216 CO 0.61 0.26 1.78 0.50 -1.51 0.00 0.00 177.10 178.75 1b3e h LYS 217 N 4.68 0.58 -0.91 -0.60 3.64 -2.00 -2.60 116.57 119.37 1b3e h LYS 217 Ca -0.49 -0.03 0.09 0.00 -1.27 0.00 0.00 60.65 58.94 1b3e h LYS 217 Cb 1.21 -0.13 -0.11 0.00 -0.41 0.00 0.00 32.23 32.79 1b3e h LYS 217 CO 0.64 0.38 -0.52 0.00 -2.27 0.00 0.00 179.45 177.68 1b3e n ALA 218 N -2.39 -0.53 -0.13 5.00 0.00 -1.26 -1.09 120.51 120.11 1b3e n ALA 218 Ca 0.24 0.79 -0.12 0.00 0.00 0.00 0.00 53.44 54.35 1b3e n ALA 218 Cb 0.69 -0.16 -0.02 0.00 0.00 0.00 0.00 19.45 19.96 1b3e n ALA 218 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1b3e h ASP 219 N 0.00 0.76 -0.10 0.00 3.32 -1.86 -2.66 116.42 115.89 1b3e h ASP 219 Ca 0.16 -0.38 0.03 0.00 0.02 0.00 0.00 57.03 56.86 1b3e h ASP 219 Cb 0.39 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 39.73 1b3e h ASP 219 CO -0.86 0.97 0.21 0.03 -1.72 0.00 0.00 179.24 177.87 1b3e h ARG 220 N 0.54 0.00 0.00 3.56 3.08 -1.10 0.25 114.38 120.72 1b3e h ARG 220 Ca 0.09 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.12 1b3e h ARG 220 Cb 0.66 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.71 1b3e h ARG 220 CO 0.05 0.00 -0.07 -0.44 -1.07 0.00 0.00 179.97 178.44 1b3e h ASP 221 N 0.00 0.00 0.00 7.04 3.32 -0.87 -2.09 116.42 123.82 1b3e h ASP 221 Ca 0.05 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.10 1b3e h ASP 221 Cb 0.46 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.01 1b3e h ASP 221 CO -0.00 0.07 0.00 0.59 -1.72 0.00 0.00 179.24 178.18 1b3e n ASN 222 N -3.23 0.01 -4.14 6.45 3.02 0.90 -4.75 115.26 113.51 1b3e n ASN 222 Ca -0.00 -1.62 -0.11 0.00 -0.03 0.00 0.00 54.58 52.82 1b3e n ASN 222 Cb 0.31 -0.00 -0.10 0.00 -0.61 0.00 0.00 39.78 39.37 1b3e n ASN 222 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1b3e s TYR 223 N -1.99 0.82 0.34 3.10 2.02 -0.79 0.39 117.35 121.25 1b3e s TYR 223 Ca 0.00 -0.83 -0.03 0.00 -0.37 0.00 0.00 57.07 55.84 1b3e s TYR 223 Cb 0.00 -0.48 0.00 0.00 -0.40 0.00 0.00 41.96 41.08 1b3e s TYR 223 CO 0.00 -0.15 0.48 -1.21 -1.57 0.00 0.00 175.55 173.11 1b3e s GLU 224 N -3.34 1.92 0.06 -0.62 2.02 -0.42 -4.42 118.70 113.90 1b3e s GLU 224 Ca 0.07 -1.74 0.09 0.00 0.02 0.00 0.00 54.97 53.40 1b3e s GLU 224 Cb 0.02 0.45 -0.03 0.00 0.10 0.00 0.00 34.13 34.67 1b3e s GLU 224 CO -0.04 -0.80 -0.23 -0.51 0.02 0.00 0.00 175.26 173.70 1b3e s LEU 225 N -3.23 2.37 -0.12 1.80 1.43 -0.37 -1.71 118.68 118.85 1b3e s LEU 225 Ca 0.30 -0.56 -0.20 0.00 -1.03 0.00 0.00 54.13 52.64 1b3e s LEU 225 Cb -0.01 -1.37 -0.04 0.00 0.03 0.00 0.00 46.19 44.81 1b3e s LEU 225 CO 0.20 0.24 0.56 -0.76 0.23 0.00 0.00 176.35 176.82 1b3e s LEU 226 N -1.48 4.26 0.29 1.79 1.43 -0.05 -2.08 118.68 122.85 1b3e s LEU 226 Ca 0.13 0.90 0.06 0.00 -1.03 0.00 0.00 54.13 54.20 1b3e s LEU 226 Cb -0.10 -2.82 -0.02 0.00 0.03 0.00 0.00 46.19 43.28 1b3e s LEU 226 CO 0.04 -0.08 0.35 0.00 0.23 0.00 0.00 176.35 176.89 1b3e h LEU 228 N 1.16 0.00 -0.43 0.00 3.38 -1.85 -2.67 115.31 114.90 1b3e h LEU 228 Ca -0.48 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.49 1b3e h LEU 228 Cb 1.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.00 1b3e h LEU 228 CO 0.58 0.27 0.00 -0.90 0.09 0.00 0.00 178.44 178.48 1b3e n ASP 229 N -3.92 0.64 -1.44 -0.43 5.75 -1.26 -4.89 116.55 111.00 1b3e n ASP 229 Ca -0.02 -1.61 -0.05 0.00 -0.01 0.00 0.00 54.79 53.10 1b3e n ASP 229 Cb 0.35 -0.05 0.02 0.00 -1.03 0.00 0.00 41.12 40.41 1b3e n ASP 229 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1b3e n ASN 230 N -0.33 -2.64 -4.14 -1.12 3.02 -1.01 -5.07 115.26 103.98 1b3e n ASN 230 Ca 0.13 -0.15 -0.15 0.00 -0.03 0.00 0.00 54.58 54.38 1b3e n ASN 230 Cb 0.15 -1.68 -0.11 0.00 -0.61 0.00 0.00 39.78 37.53 1b3e n ASN 230 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1b3e s THR 231 N -3.09 0.88 0.48 3.41 -4.23 -1.26 -4.83 115.64 107.01 1b3e s THR 231 Ca 0.08 -1.34 0.08 0.00 -1.18 0.00 0.00 61.69 59.33 1b3e s THR 231 Cb -0.04 -1.02 0.04 0.00 1.34 0.00 0.00 72.50 72.82 1b3e s THR 231 CO 0.19 -0.38 0.66 -0.13 -0.54 0.00 0.00 174.62 174.41 1b3e s ARG 232 N -2.03 2.63 0.11 3.99 0.52 -1.26 -1.12 118.95 121.80 1b3e s ARG 232 Ca -0.02 -1.36 -0.25 0.00 -0.52 0.00 0.00 55.73 53.58 1b3e s ARG 232 Cb -0.08 -2.71 0.08 0.00 0.52 0.00 0.00 34.95 32.76 1b3e s ARG 232 CO 0.01 -0.50 0.75 0.21 0.02 0.00 0.00 175.30 175.79 1b3e s LYS 233 N -4.48 1.16 0.56 3.54 2.20 -0.88 -4.90 119.74 116.94 1b3e s LYS 233 Ca 0.58 -0.48 -0.20 0.00 -0.36 0.00 0.00 55.97 55.50 1b3e s LYS 233 Cb -0.09 0.50 -0.05 0.00 -1.51 0.00 0.00 37.83 36.69 1b3e s LYS 233 CO 0.35 -0.51 1.22 -2.14 -0.36 0.00 0.00 175.35 173.91 1b3e s PRO 234 N -3.50 3.16 0.24 4.03 0.02 -1.26 -1.23 135.00 136.46 1b3e s PRO 234 Ca 0.05 1.86 0.14 0.00 0.02 0.00 0.00 61.00 63.07 1b3e s PRO 234 Cb -0.02 -2.07 0.78 0.00 0.02 0.00 0.00 34.50 33.22 1b3e s PRO 234 CO -0.08 -1.06 1.40 1.33 -0.33 0.00 0.00 177.00 178.25 1b3e n VAL 235 N -1.29 1.11 0.98 3.83 0.24 -1.26 -0.14 118.33 121.79 1b3e n VAL 235 Ca 0.12 0.68 0.12 0.00 -2.04 0.00 0.00 64.34 63.22 1b3e n VAL 235 Cb 0.49 -1.68 0.23 0.00 -1.47 0.00 0.00 33.84 31.41 1b3e n VAL 235 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1b3e n ASP 236 N -2.01 0.52 -1.52 -1.34 9.92 -1.26 -3.98 116.55 116.89 1b3e n ASP 236 Ca -0.01 -0.26 0.05 0.00 -0.53 0.00 0.00 54.79 54.04 1b3e n ASP 236 Cb 0.11 0.28 0.30 0.00 -0.64 0.00 0.00 41.12 41.17 1b3e n ASP 236 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1b3e n GLU 237 N -1.52 3.85 -0.04 -1.24 -0.58 0.80 -4.54 120.64 117.36 1b3e n GLU 237 Ca 0.05 -2.31 0.24 0.00 -0.42 0.00 0.00 57.16 54.72 1b3e n GLU 237 Cb 0.34 -2.06 0.72 0.00 -0.57 0.00 0.00 31.44 29.87 1b3e n GLU 237 CO 0.00 0.00 0.00 0.10 -0.48 0.00 0.00 177.13 176.75 1b3e h TYR 238 N 2.94 0.00 -0.31 -0.32 -0.00 -1.72 0.53 116.97 118.09 1b3e h TYR 238 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 58.73 58.65 1b3e h TYR 238 Cb 1.58 0.00 -0.02 0.00 0.00 0.00 0.00 36.73 38.29 1b3e h TYR 238 CO 0.80 0.00 -0.16 1.57 -0.00 0.00 0.00 178.16 180.38 1b3e h LYS 239 N 0.00 0.55 0.00 0.10 2.10 -1.94 -2.87 116.57 114.51 1b3e h LYS 239 Ca 0.31 -0.17 0.00 0.00 -2.00 0.00 0.00 60.65 58.78 1b3e h LYS 239 Cb 1.41 -0.05 0.00 0.00 -0.90 0.00 0.00 32.23 32.70 1b3e h LYS 239 CO -0.00 0.68 -1.37 -0.25 -2.00 0.00 0.00 179.45 176.52 1b3e n ASP 240 N -4.17 0.48 -3.58 7.07 8.00 0.15 -4.68 116.55 119.82 1b3e n ASP 240 Ca 0.00 -0.01 -0.27 0.00 0.71 0.00 0.00 54.79 55.22 1b3e n ASP 240 Cb 0.35 1.13 -0.11 0.00 -0.02 0.00 0.00 41.12 42.48 1b3e n ASP 240 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1b3e s HIS 242 N -0.68 0.35 0.10 0.00 -3.43 -1.17 -4.46 115.29 106.00 1b3e s HIS 242 Ca 0.30 -0.84 -0.02 0.00 -0.80 0.00 0.00 55.06 53.70 1b3e s HIS 242 Cb 0.02 -0.24 -0.21 0.00 -1.43 0.00 0.00 32.58 30.72 1b3e s HIS 242 CO -0.18 -0.45 1.22 -0.07 -2.00 0.00 0.00 174.74 173.26 1b3e h LEU 243 N 3.01 0.37 -7.06 5.38 3.38 -0.96 -3.44 115.31 116.00 1b3e h LEU 243 Ca -0.34 -0.37 0.38 0.00 0.09 0.00 0.00 57.88 57.64 1b3e h LEU 243 Cb 1.17 -0.12 -0.14 0.00 0.09 0.00 0.00 40.66 41.66 1b3e h LEU 243 CO 0.61 1.25 0.95 0.00 0.09 0.00 0.00 178.44 181.34 1b3e s ALA 244 N -2.84 -2.43 -0.17 1.53 0.00 -1.22 -4.98 121.76 111.65 1b3e s ALA 244 Ca -0.04 0.98 -0.04 0.00 0.00 0.00 0.00 51.96 52.86 1b3e s ALA 244 Cb 0.08 0.21 -0.03 0.00 0.00 0.00 0.00 23.12 23.39 1b3e s ALA 244 CO 0.87 -1.02 -0.03 -1.14 0.00 0.00 0.00 175.76 174.44 1b3e s GLN 245 N -2.11 3.63 0.18 0.00 0.74 -1.26 -0.36 119.66 120.48 1b3e s GLN 245 Ca 0.15 -0.53 0.10 0.00 0.05 0.00 0.00 55.36 55.12 1b3e s GLN 245 Cb 0.07 -2.96 -0.04 0.00 1.10 0.00 0.00 33.01 31.17 1b3e s GLN 245 CO -0.06 0.15 -0.21 0.14 -0.55 0.00 0.00 175.29 174.77 1b3e s VAL 246 N 0.60 2.08 0.77 1.34 -7.23 0.27 -4.94 120.40 113.28 1b3e s VAL 246 Ca -0.02 -1.98 -0.11 0.00 -1.81 0.00 0.00 61.98 58.06 1b3e s VAL 246 Cb -0.14 -1.98 0.05 0.00 0.56 0.00 0.00 36.38 34.88 1b3e s VAL 246 CO 0.02 -0.23 1.09 -2.16 -0.31 0.00 0.00 175.10 173.51 1b3e s PRO 247 N -2.75 2.29 0.81 4.82 0.04 -1.26 -1.25 135.00 137.70 1b3e s PRO 247 Ca 0.18 1.10 -0.13 0.00 0.04 0.00 0.00 61.00 62.19 1b3e s PRO 247 Cb -0.07 -1.91 0.08 0.00 0.04 0.00 0.00 34.50 32.65 1b3e s PRO 247 CO 0.08 -1.60 1.20 -1.12 0.04 0.00 0.00 177.00 175.60 1b3e s SER 248 N -3.47 3.60 0.45 6.66 0.01 -1.12 -4.46 113.70 115.37 1b3e s SER 248 Ca 0.61 2.33 -0.23 0.00 1.31 0.00 0.00 55.95 59.97 1b3e s SER 248 Cb -0.17 -2.58 -0.08 0.00 0.21 0.00 0.00 66.02 63.40 1b3e s SER 248 CO 0.56 -2.66 1.18 -1.00 0.41 0.00 0.00 173.24 171.73 1b3e s HIS 249 N -2.20 2.89 0.01 2.43 3.76 -1.26 -4.17 115.29 116.74 1b3e s HIS 249 Ca 0.72 1.53 0.02 0.00 -0.15 0.00 0.00 55.06 57.18 1b3e s HIS 249 Cb -0.28 -3.40 -0.01 0.00 1.11 0.00 0.00 32.58 30.00 1b3e s HIS 249 CO 0.51 -1.52 -0.06 -0.08 -0.85 0.00 0.00 174.74 172.74 1b3e s THR 250 N -1.51 0.44 0.05 1.30 -1.32 -0.45 -1.38 115.64 112.77 1b3e s THR 250 Ca 0.62 -0.46 -0.30 0.00 -1.21 0.00 0.00 61.69 60.34 1b3e s THR 250 Cb -0.29 -0.42 -0.05 0.00 -1.51 0.00 0.00 72.50 70.23 1b3e s THR 250 CO 0.36 -0.03 1.14 -0.69 -2.21 0.00 0.00 174.62 173.19 1b3e s VAL 251 N -0.48 4.23 0.26 5.08 1.01 0.17 -1.32 120.40 129.35 1b3e s VAL 251 Ca -0.01 1.61 0.09 0.00 0.00 0.00 0.00 61.98 63.67 1b3e s VAL 251 Cb -0.04 -4.03 -0.04 0.00 0.00 0.00 0.00 36.38 32.26 1b3e s VAL 251 CO -0.00 0.13 0.03 0.68 0.00 0.00 0.00 175.10 175.95 1b3e s VAL 252 N 0.98 3.65 0.27 2.92 -7.23 -0.28 -1.12 120.40 119.58 1b3e s VAL 252 Ca 0.57 -1.81 -0.09 0.00 -1.81 0.00 0.00 61.98 58.84 1b3e s VAL 252 Cb -0.27 -2.95 -0.00 0.00 0.56 0.00 0.00 36.38 33.71 1b3e s VAL 252 CO 0.29 -0.37 0.45 0.00 -0.31 0.00 0.00 175.10 175.17 1b3e s ALA 253 N -2.28 0.12 0.44 1.32 0.00 0.18 -3.59 121.76 117.95 1b3e s ALA 253 Ca 0.32 -1.11 -0.25 0.00 0.00 0.00 0.00 51.96 50.92 1b3e s ALA 253 Cb -0.07 1.11 -0.08 0.00 0.00 0.00 0.00 23.12 24.08 1b3e s ALA 253 CO 0.21 -0.82 1.26 1.03 0.00 0.00 0.00 175.76 177.44 1b3e s ARG 254 N -3.74 3.80 0.49 0.00 0.52 -1.26 0.03 118.95 118.79 1b3e s ARG 254 Ca 0.26 2.04 0.19 0.00 -0.52 0.00 0.00 55.73 57.70 1b3e s ARG 254 Cb 0.00 -2.59 1.24 0.00 0.52 0.00 0.00 34.95 34.12 1b3e s ARG 254 CO 0.12 -0.59 2.07 0.77 0.02 0.00 0.00 175.30 177.68 1b3e h SER 255 N 2.34 0.00 -3.38 0.23 0.02 -1.88 -3.26 113.55 107.62 1b3e h SER 255 Ca -0.50 0.00 -0.41 0.00 -0.84 0.00 0.00 61.79 60.04 1b3e h SER 255 Cb 1.25 0.00 -0.36 0.00 0.14 0.00 0.00 62.40 63.44 1b3e h SER 255 CO 0.61 0.12 -0.77 -0.04 -1.14 0.00 0.00 176.83 175.61 1b3e s MET 256 N -4.61 0.69 -0.76 3.45 -1.94 -1.26 -4.79 119.30 110.09 1b3e s MET 256 Ca -0.04 -0.00 -0.00 0.00 -1.71 0.00 0.00 55.69 53.93 1b3e s MET 256 Cb 0.15 -0.86 0.00 0.00 2.01 0.00 0.00 34.83 36.13 1b3e s MET 256 CO 0.65 -0.18 0.02 0.41 -0.01 0.00 0.00 175.02 175.91 1b3e n GLY 257 N 4.50 0.01 0.11 -0.03 0.00 -1.26 -4.93 105.19 103.59 1b3e n GLY 257 Ca -0.18 -0.50 0.15 0.00 0.00 0.00 0.00 46.02 45.48 1b3e n GLY 257 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b3e n GLY 258 N -1.01 -0.89 2.46 -0.02 0.00 -1.23 -4.88 105.19 99.62 1b3e n GLY 258 Ca -0.10 -0.25 -0.17 0.00 0.00 0.00 0.00 46.02 45.49 1b3e n GLY 258 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1b3e n LYS 259 N -0.87 -1.23 -0.21 1.61 5.02 -1.26 -4.51 118.16 116.71 1b3e n LYS 259 Ca 0.18 1.04 0.31 0.00 -2.02 0.00 0.00 58.31 57.82 1b3e n LYS 259 Cb 0.23 -5.32 0.71 0.00 -0.02 0.00 0.00 35.03 30.63 1b3e n LYS 259 CO 0.00 0.00 0.00 1.05 -0.52 0.00 0.00 177.40 177.93 1b3e h GLU 260 N 0.00 0.00 -0.07 1.97 4.11 -1.92 0.28 114.58 118.95 1b3e h GLU 260 Ca -0.36 0.00 -0.04 0.00 0.07 0.00 0.00 59.36 59.03 1b3e h GLU 260 Cb 1.16 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.41 1b3e h GLU 260 CO 0.51 0.00 -0.10 -0.44 0.07 0.00 0.00 179.01 179.04 1b3e h ASP 261 N 0.00 0.22 -0.62 3.06 3.32 -1.99 -1.31 116.42 119.10 1b3e h ASP 261 Ca 0.47 -0.52 -0.02 0.00 0.02 0.00 0.00 57.03 56.98 1b3e h ASP 261 Cb 2.10 -0.06 -0.03 0.00 0.22 0.00 0.00 39.33 41.56 1b3e h ASP 261 CO -0.00 0.69 0.32 -0.07 -1.72 0.00 0.00 179.24 178.46 1b3e h LEU 262 N -0.26 0.79 -0.08 1.55 4.07 -1.40 0.29 115.31 120.28 1b3e h LEU 262 Ca 0.01 -0.11 0.02 0.00 0.08 0.00 0.00 57.88 57.88 1b3e h LEU 262 Cb 0.65 -0.20 -0.02 0.00 1.08 0.00 0.00 40.66 42.16 1b3e h LEU 262 CO 0.02 0.68 -0.06 0.40 -1.08 0.00 0.00 178.44 178.41 1b3e h ILE 263 N 0.85 0.82 0.32 1.22 2.04 -1.14 -1.25 117.51 120.37 1b3e h ILE 263 Ca 0.22 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 66.06 1b3e h ILE 263 Cb 0.08 0.82 0.00 0.00 -0.74 0.00 0.00 36.82 36.98 1b3e h ILE 263 CO -0.03 0.00 -0.15 -0.25 0.00 0.00 0.00 178.15 177.72 1b3e h TRP 264 N -0.07 -0.40 -0.47 1.37 2.91 -0.77 -2.13 115.95 116.40 1b3e h TRP 264 Ca 0.05 -0.01 0.06 0.00 1.13 0.00 0.00 58.89 60.13 1b3e h TRP 264 Cb 0.15 0.13 -0.03 0.00 -0.51 0.00 0.00 29.16 28.90 1b3e h TRP 264 CO -0.17 -0.23 0.32 0.93 -1.03 0.00 0.00 178.44 178.26 1b3e h GLU 265 N -0.46 0.37 -0.26 2.65 4.39 -0.85 0.32 114.58 120.74 1b3e h GLU 265 Ca -0.04 -0.02 -0.12 0.00 0.34 0.00 0.00 59.36 59.52 1b3e h GLU 265 Cb 0.35 -0.08 -0.00 0.00 -0.10 0.00 0.00 28.75 28.91 1b3e h GLU 265 CO 0.07 0.24 -0.29 1.25 -1.16 0.00 0.00 179.01 179.13 1b3e h LEU 266 N 0.38 0.71 -0.14 1.33 5.85 -1.06 -1.21 115.31 121.16 1b3e h LEU 266 Ca 0.21 -0.48 -0.23 0.00 0.84 0.00 0.00 57.88 58.21 1b3e h LEU 266 Cb 0.34 -0.20 0.01 0.00 0.37 0.00 0.00 40.66 41.18 1b3e h LEU 266 CO -0.05 1.05 -0.92 -0.07 -0.34 0.00 0.00 178.44 178.11 1b3e h LEU 267 N 0.38 0.73 -0.30 2.25 3.38 -0.71 -0.94 115.31 120.10 1b3e h LEU 267 Ca 0.04 -0.55 -0.02 0.00 0.09 0.00 0.00 57.88 57.44 1b3e h LEU 267 Cb 0.86 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 1b3e h LEU 267 CO 0.07 1.34 0.11 -1.13 0.09 0.00 0.00 178.44 178.93 1b3e h ASN 268 N 0.35 0.42 -0.63 -0.43 -1.24 -0.42 0.58 115.58 114.21 1b3e h ASN 268 Ca -0.08 -0.18 -0.03 0.00 0.71 0.00 0.00 56.30 56.72 1b3e h ASN 268 Cb 1.55 -0.11 -0.03 0.00 0.73 0.00 0.00 38.32 40.46 1b3e h ASN 268 CO 0.17 0.48 0.28 -0.61 -1.29 0.00 0.00 177.43 176.46 1b3e h GLN 269 N 0.33 0.95 -0.20 6.67 5.75 -1.22 -1.58 115.11 125.81 1b3e h GLN 269 Ca 0.10 -0.15 -0.06 0.00 -0.15 0.00 0.00 58.65 58.39 1b3e h GLN 269 Cb 0.20 -0.17 -0.00 0.00 1.07 0.00 0.00 27.48 28.57 1b3e h GLN 269 CO -0.01 0.77 -0.12 0.00 -2.65 0.00 0.00 178.83 176.82 1b3e h ALA 270 N 1.36 0.29 -0.50 3.38 0.00 -0.60 -1.62 119.26 121.56 1b3e h ALA 270 Ca 0.22 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 1b3e h ALA 270 Cb 0.15 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1b3e h ALA 270 CO -0.02 0.14 0.07 -0.56 0.00 0.00 0.00 179.25 178.88 1b3e h GLN 271 N 0.13 0.79 -0.49 0.00 3.07 -0.75 0.95 115.11 118.82 1b3e h GLN 271 Ca 0.04 -0.18 -0.00 0.00 0.09 0.00 0.00 58.65 58.60 1b3e h GLN 271 Cb 0.62 -0.11 -0.02 0.00 0.08 0.00 0.00 27.48 28.04 1b3e h GLN 271 CO 0.03 0.75 0.30 1.49 0.09 0.00 0.00 178.83 181.49 1b3e h GLU 272 N 0.75 0.66 0.02 0.06 4.81 -1.21 0.17 114.58 119.84 1b3e h GLU 272 Ca 0.16 -0.06 -0.31 0.00 -0.13 0.00 0.00 59.36 59.02 1b3e h GLU 272 Cb 0.35 -0.14 -0.05 0.00 0.63 0.00 0.00 28.75 29.54 1b3e h GLU 272 CO 0.01 0.47 -1.82 0.72 -0.73 0.00 0.00 179.01 177.66 1b3e n HIS 273 N -4.71 0.92 -1.83 0.92 8.25 -0.62 -4.51 115.22 113.65 1b3e n HIS 273 Ca 0.02 0.31 0.04 0.00 -0.26 0.00 0.00 57.72 57.83 1b3e n HIS 273 Cb 0.05 -1.16 0.05 0.00 1.12 0.00 0.00 29.99 30.05 1b3e n HIS 273 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1b3e n PHE 274 N -3.07 0.00 -0.39 4.41 3.72 0.33 -3.77 117.46 118.69 1b3e n PHE 274 Ca -0.21 -0.44 0.00 0.00 -0.05 0.00 0.00 57.45 56.75 1b3e n PHE 274 Cb 1.06 -0.11 0.00 0.00 -0.94 0.00 0.00 39.48 39.49 1b3e n PHE 274 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1b3e n GLY 275 N -0.35 -2.48 3.65 1.37 0.00 0.60 -1.16 105.19 106.82 1b3e n GLY 275 Ca 0.06 -1.43 -0.42 0.00 0.00 0.00 0.00 46.02 44.24 1b3e n GLY 275 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1b3e s LYS 276 N -2.53 4.04 0.00 1.61 2.20 -1.26 -2.08 119.74 121.73 1b3e s LYS 276 Ca 0.00 2.55 0.00 0.00 -0.36 0.00 0.00 55.97 58.16 1b3e s LYS 276 Cb 0.00 -4.18 0.00 0.00 -1.51 0.00 0.00 37.83 32.14 1b3e s LYS 276 CO 0.00 -1.07 0.00 -0.25 -0.36 0.00 0.00 175.35 173.67 1b3e n ASP 277 N 7.94 0.00 -0.25 1.43 8.00 -1.26 -4.93 116.55 127.47 1b3e n ASP 277 Ca 0.21 0.00 -0.07 0.00 0.71 0.00 0.00 54.79 55.64 1b3e n ASP 277 Cb 0.41 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.49 1b3e n ASP 277 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1b3e h LYS 278 N 0.14 -0.16 -4.47 -1.24 1.79 -1.72 -3.44 116.57 107.47 1b3e h LYS 278 Ca 0.00 0.01 -0.33 0.00 -2.18 0.00 0.00 60.65 58.15 1b3e h LYS 278 Cb 0.00 0.04 -0.27 0.00 -1.58 0.00 0.00 32.23 30.42 1b3e h LYS 278 CO 0.00 -0.11 -0.76 0.45 -1.08 0.00 0.00 179.45 177.96 1b3e s SER 279 N -5.22 0.78 0.00 0.86 0.15 -1.25 -4.90 113.70 104.13 1b3e s SER 279 Ca -0.14 -0.21 0.27 0.00 0.70 0.00 0.00 55.95 56.57 1b3e s SER 279 Cb 0.15 -0.06 0.89 0.00 -1.71 0.00 0.00 66.02 65.29 1b3e s SER 279 CO 0.67 0.02 1.65 1.17 1.20 0.00 0.00 173.24 177.95 1b3e n LYS 280 N 2.60 0.74 0.07 5.44 4.81 -1.26 -3.79 118.16 126.78 1b3e n LYS 280 Ca -0.15 -0.38 -0.18 0.00 -0.87 0.00 0.00 58.31 56.73 1b3e n LYS 280 Cb 0.57 -1.49 -0.14 0.00 0.02 0.00 0.00 35.03 33.99 1b3e n LYS 280 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 1b3e h GLU 281 N 0.94 0.29 -1.69 1.64 4.39 -1.97 -3.47 114.58 114.71 1b3e h GLU 281 Ca 0.00 -0.49 0.09 0.00 0.34 0.00 0.00 59.36 59.30 1b3e h GLU 281 Cb 0.46 0.18 -0.23 0.00 -0.10 0.00 0.00 28.75 29.07 1b3e h GLU 281 CO 0.00 1.17 0.11 0.12 -1.16 0.00 0.00 179.01 179.25 1b3e s PHE 282 N -2.62 -0.94 -0.22 4.33 5.36 -1.25 -5.15 117.98 117.50 1b3e s PHE 282 Ca -0.09 1.76 -0.08 0.00 -0.96 0.00 0.00 56.93 57.55 1b3e s PHE 282 Cb 0.07 0.57 -0.04 0.00 -0.34 0.00 0.00 43.02 43.27 1b3e s PHE 282 CO 0.86 -0.47 0.10 -0.65 -1.46 0.00 0.00 175.22 173.60 1b3e s GLN 283 N 2.06 3.92 0.24 10.12 1.11 -1.26 -4.52 119.66 131.33 1b3e s GLN 283 Ca -0.07 -0.36 -0.02 0.00 0.01 0.00 0.00 55.36 54.92 1b3e s GLN 283 Cb -0.07 -3.35 0.29 0.00 -1.01 0.00 0.00 33.01 28.87 1b3e s GLN 283 CO -0.18 0.08 1.70 1.25 0.01 0.00 0.00 175.29 178.15 1b3e h LEU 284 N 7.37 0.72 -4.23 2.90 5.85 -1.42 -3.29 115.31 123.21 1b3e h LEU 284 Ca -0.37 -0.22 -0.66 0.00 0.84 0.00 0.00 57.88 57.47 1b3e h LEU 284 Cb 1.17 -0.19 -0.33 0.00 0.37 0.00 0.00 40.66 41.68 1b3e h LEU 284 CO 0.65 0.87 0.37 0.49 -0.34 0.00 0.00 178.44 180.49 1b3e n PHE 285 N -4.16 3.09 -3.62 1.25 3.72 -1.26 -4.83 117.46 111.66 1b3e n PHE 285 Ca 0.01 -2.71 -0.02 0.00 -0.05 0.00 0.00 57.45 54.68 1b3e n PHE 285 Cb 0.37 -1.00 -0.01 0.00 -0.94 0.00 0.00 39.48 37.90 1b3e n PHE 285 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1b3e s SER 286 N -2.24 -0.13 -0.28 4.37 1.04 -1.24 -4.44 113.70 110.78 1b3e s SER 286 Ca 0.57 -0.13 -0.22 0.00 0.48 0.00 0.00 55.95 56.65 1b3e s SER 286 Cb 0.46 0.23 0.12 0.00 0.10 0.00 0.00 66.02 66.93 1b3e s SER 286 CO -0.11 -0.41 0.96 -0.55 0.98 0.00 0.00 173.24 174.11 1b3e s SER 287 N -2.69 -0.54 0.24 7.02 0.15 -1.25 -4.70 113.70 111.94 1b3e s SER 287 Ca 0.12 0.97 0.20 0.00 0.70 0.00 0.00 55.95 57.93 1b3e s SER 287 Cb 0.02 1.06 0.94 0.00 -1.71 0.00 0.00 66.02 66.33 1b3e s SER 287 CO -0.04 -0.16 1.60 -0.81 1.20 0.00 0.00 173.24 175.03 1b3e n PRO 288 N 2.79 0.14 0.00 5.44 -0.04 -1.26 -1.63 135.00 140.44 1b3e n PRO 288 Ca -0.15 0.51 0.14 0.00 -0.04 0.00 0.00 63.50 63.96 1b3e n PRO 288 Cb 0.56 -1.84 0.45 0.00 -0.04 0.00 0.00 33.50 32.63 1b3e n PRO 288 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1b3e n HIS 289 N -2.12 0.00 0.00 0.54 8.25 -1.26 -5.03 115.22 115.60 1b3e n HIS 289 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1b3e n HIS 289 Cb 0.12 -0.02 0.00 0.00 1.12 0.00 0.00 29.99 31.20 1b3e n HIS 289 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1b3e n GLY 290 N 1.23 1.31 3.85 -1.41 0.00 -0.65 -4.91 105.19 104.61 1b3e n GLY 290 Ca 0.17 -1.70 -0.33 0.00 0.00 0.00 0.00 46.02 44.16 1b3e n GLY 290 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b3e s LYS 291 N -1.53 3.28 -1.52 1.61 1.02 -1.26 -3.80 119.74 117.54 1b3e s LYS 291 Ca 0.00 -0.38 -0.12 0.00 0.02 0.00 0.00 55.97 55.49 1b3e s LYS 291 Cb 0.00 -3.00 0.08 0.00 -0.52 0.00 0.00 37.83 34.39 1b3e s LYS 291 CO 0.00 0.67 0.93 -0.25 -0.92 0.00 0.00 175.35 175.78 1b3e n ASP 292 N 1.13 -4.24 -4.60 2.83 8.00 -1.26 -4.93 116.55 113.47 1b3e n ASP 292 Ca -0.12 -0.80 -0.42 0.00 0.71 0.00 0.00 54.79 54.16 1b3e n ASP 292 Cb 0.53 -3.82 -0.06 0.00 -0.02 0.00 0.00 41.12 37.76 1b3e n ASP 292 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1b3e s LEU 293 N -7.22 4.13 0.00 0.64 1.43 -1.26 -4.17 118.68 112.23 1b3e s LEU 293 Ca 0.59 0.47 0.00 0.00 -1.03 0.00 0.00 54.13 54.15 1b3e s LEU 293 Cb -0.29 -2.95 0.00 0.00 0.03 0.00 0.00 46.19 42.98 1b3e s LEU 293 CO 0.84 -0.59 0.00 0.18 0.23 0.00 0.00 176.35 177.00 1b3e n LEU 294 N 6.12 0.00 -4.13 1.79 4.77 -1.26 -4.82 117.00 119.47 1b3e n LEU 294 Ca 0.01 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.91 1b3e n LEU 294 Cb 0.48 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.47 1b3e n LEU 294 CO 0.49 0.00 -0.33 -0.36 -1.33 0.00 0.00 177.39 175.87 1b3e s PHE 295 N -0.05 0.75 0.07 -1.77 0.08 -1.26 -4.41 117.98 111.38 1b3e s PHE 295 Ca 0.00 -1.15 -0.30 0.00 0.12 0.00 0.00 56.93 55.60 1b3e s PHE 295 Cb 0.00 -0.46 -0.05 0.00 -0.57 0.00 0.00 43.02 41.94 1b3e s PHE 295 CO 0.00 -0.43 1.08 0.15 -0.10 0.00 0.00 175.22 175.92 1b3e s LYS 296 N -3.98 4.54 0.52 0.44 1.02 -1.26 -4.20 119.74 116.81 1b3e s LYS 296 Ca 0.17 1.61 0.23 0.00 0.02 0.00 0.00 55.97 57.99 1b3e s LYS 296 Cb 0.08 -3.37 1.33 0.00 -0.52 0.00 0.00 37.83 35.34 1b3e s LYS 296 CO -0.03 -0.07 2.01 -0.44 -0.92 0.00 0.00 175.35 175.90 1b3e h ASP 297 N 6.32 0.05 0.00 2.83 5.19 -1.89 -0.65 116.42 128.28 1b3e h ASP 297 Ca -0.42 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.99 1b3e h ASP 297 Cb 1.22 -0.01 0.00 0.00 0.18 0.00 0.00 39.33 40.72 1b3e h ASP 297 CO 0.76 0.03 0.00 -1.54 -3.12 0.00 0.00 179.24 175.37 1b3e n SER 298 N -4.41 0.00 -4.86 6.45 3.41 -1.26 -4.84 113.62 108.11 1b3e n SER 298 Ca 0.09 -0.82 -0.32 0.00 -0.26 0.00 0.00 58.87 57.56 1b3e n SER 298 Cb 0.52 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.45 1b3e n SER 298 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1b3e s ALA 299 N -2.00 3.10 -0.13 7.33 0.00 -0.25 -4.38 121.76 125.43 1b3e s ALA 299 Ca 0.36 0.05 0.04 0.00 0.00 0.00 0.00 51.96 52.41 1b3e s ALA 299 Cb 0.17 -3.07 -0.05 0.00 0.00 0.00 0.00 23.12 20.16 1b3e s ALA 299 CO 0.28 -0.39 0.15 0.72 0.00 0.00 0.00 175.76 176.52 1b3e n HIS 300 N -2.00 0.00 -3.39 0.00 8.25 0.62 -4.88 115.22 113.83 1b3e n HIS 300 Ca 0.06 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.52 1b3e n HIS 300 Cb 0.54 -0.04 0.00 0.00 1.12 0.00 0.00 29.99 31.61 1b3e n HIS 300 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1b3e n GLY 301 N 1.51 -1.31 3.33 -1.41 0.00 -1.22 -4.27 105.19 101.82 1b3e n GLY 301 Ca 0.00 -0.99 -0.24 0.00 0.00 0.00 0.00 46.02 44.80 1b3e n GLY 301 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1b3e s PHE 302 N -2.99 1.89 0.02 1.61 0.08 -1.26 -1.25 117.98 116.08 1b3e s PHE 302 Ca 0.00 -0.43 0.03 0.00 0.12 0.00 0.00 56.93 56.65 1b3e s PHE 302 Cb 0.00 -0.99 -0.01 0.00 -0.57 0.00 0.00 43.02 41.44 1b3e s PHE 302 CO 0.00 0.29 -0.10 -0.51 -0.10 0.00 0.00 175.22 174.80 1b3e s LEU 303 N -2.28 2.11 0.11 -0.37 1.43 0.41 -4.92 118.68 115.16 1b3e s LEU 303 Ca 0.12 -0.31 -0.30 0.00 -1.03 0.00 0.00 54.13 52.60 1b3e s LEU 303 Cb -0.08 -0.44 -0.06 0.00 0.03 0.00 0.00 46.19 45.64 1b3e s LEU 303 CO 0.06 0.03 1.01 -0.75 0.23 0.00 0.00 176.35 176.93 1b3e s LYS 304 N -0.73 4.64 0.20 1.70 2.20 -1.26 0.14 119.74 126.63 1b3e s LYS 304 Ca 0.00 1.53 -0.30 0.00 -0.36 0.00 0.00 55.97 56.84 1b3e s LYS 304 Cb -0.06 -3.36 -0.08 0.00 -1.51 0.00 0.00 37.83 32.82 1b3e s LYS 304 CO 0.00 0.12 0.94 0.08 -0.36 0.00 0.00 175.35 176.13 1b3e s VAL 305 N 0.15 4.21 0.25 4.02 1.01 -0.33 -4.84 120.40 124.88 1b3e s VAL 305 Ca 0.49 2.06 -0.31 0.00 0.00 0.00 0.00 61.98 64.22 1b3e s VAL 305 Cb -0.25 -4.32 -0.13 0.00 0.00 0.00 0.00 36.38 31.69 1b3e s VAL 305 CO 0.31 0.45 1.54 -2.65 0.00 0.00 0.00 175.10 174.74 1b3e n PRO 306 N 1.88 2.41 -0.30 2.72 -0.02 -1.26 -4.89 135.00 135.54 1b3e n PRO 306 Ca -0.01 0.86 0.11 0.00 -2.02 0.00 0.00 63.50 62.45 1b3e n PRO 306 Cb 0.48 -2.60 0.28 0.00 -0.02 0.00 0.00 33.50 31.64 1b3e n PRO 306 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 1b3e h PRO 307 N 4.89 0.44 0.00 0.52 0.13 -1.96 0.12 132.00 136.13 1b3e h PRO 307 Ca -0.46 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1b3e h PRO 307 Cb 1.24 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.27 1b3e h PRO 307 CO 0.81 0.29 0.00 0.54 -0.23 0.00 0.00 178.00 179.41 1b3e n ARG 308 N -5.00 0.18 -2.89 0.86 1.74 -1.26 -4.74 116.66 105.55 1b3e n ARG 308 Ca 0.21 0.14 -0.42 0.00 -0.77 0.00 0.00 57.85 57.00 1b3e n ARG 308 Cb 0.59 -1.50 -0.04 0.00 -1.02 0.00 0.00 32.46 30.49 1b3e n ARG 308 CO 0.00 0.00 0.00 1.41 -1.52 0.00 0.00 177.63 177.52 1b3e s MET 309 N -2.70 3.91 0.60 5.56 1.75 0.03 -5.05 119.30 123.39 1b3e s MET 309 Ca 0.15 0.59 0.07 0.00 -1.25 0.00 0.00 55.69 55.24 1b3e s MET 309 Cb 0.12 -3.76 0.09 0.00 2.84 0.00 0.00 34.83 34.12 1b3e s MET 309 CO 0.29 -0.79 0.82 0.16 -0.65 0.00 0.00 175.02 174.86 1b3e s ASP 310 N 1.71 4.97 0.19 1.11 -4.77 -1.26 -4.78 116.67 113.85 1b3e s ASP 310 Ca 0.35 -0.68 -0.12 0.00 -3.30 0.00 0.00 52.55 48.80 1b3e s ASP 310 Cb -0.13 0.12 0.23 0.00 -1.09 0.00 0.00 42.92 42.04 1b3e s ASP 310 CO 0.15 -1.42 1.72 0.00 0.70 0.00 0.00 175.17 176.32 1b3e h ALA 311 N 0.04 0.63 -0.29 2.11 0.00 -1.94 0.51 119.26 120.32 1b3e h ALA 311 Ca -0.32 0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.65 1b3e h ALA 311 Cb 1.28 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 19.18 1b3e h ALA 311 CO 0.41 -0.28 0.03 0.87 0.00 0.00 0.00 179.25 180.28 1b3e h LYS 312 N 0.28 0.44 0.01 0.00 1.57 -1.95 -0.08 116.57 116.84 1b3e h LYS 312 Ca 0.27 -0.08 -0.23 0.00 -1.87 0.00 0.00 60.65 58.75 1b3e h LYS 312 Cb 0.36 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.60 1b3e h LYS 312 CO -0.33 0.44 -0.95 0.52 -0.57 0.00 0.00 179.45 178.56 1b3e h MET 313 N 0.43 0.38 -0.33 3.15 2.86 -1.66 -1.52 114.93 118.24 1b3e h MET 313 Ca 0.10 -0.42 -0.07 0.00 -2.06 0.00 0.00 59.70 57.24 1b3e h MET 313 Cb 0.24 0.12 -0.01 0.00 0.06 0.00 0.00 31.60 32.01 1b3e h MET 313 CO 0.00 1.10 -0.08 -0.92 1.06 0.00 0.00 176.91 178.07 1b3e h TYR 314 N 0.21 0.71 0.17 -0.22 3.20 -0.42 -3.29 116.97 117.33 1b3e h TYR 314 Ca -0.08 -0.15 -0.31 0.00 3.14 0.00 0.00 58.73 61.32 1b3e h TYR 314 Cb 1.59 -0.17 0.03 0.00 1.54 0.00 0.00 36.73 39.72 1b3e h TYR 314 CO 0.06 0.81 -1.33 -0.07 -1.64 0.00 0.00 178.16 175.98 1b3e h LEU 315 N 0.41 0.84 0.00 2.82 3.38 -1.08 -3.49 115.31 118.19 1b3e h LEU 315 Ca 0.08 -0.82 0.00 0.00 0.09 0.00 0.00 57.88 57.23 1b3e h LEU 315 Cb 0.58 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1b3e h LEU 315 CO 0.03 1.63 0.00 0.61 0.09 0.00 0.00 178.44 180.80 1b3e n GLY 316 N 1.50 2.57 0.24 0.83 0.00 -0.57 -4.49 105.19 105.27 1b3e n GLY 316 Ca -0.14 -1.90 -0.10 0.00 0.00 0.00 0.00 46.02 43.88 1b3e n GLY 316 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1b3e h TYR 317 N 0.00 0.85 -0.73 1.61 3.20 -1.91 -2.80 116.97 117.19 1b3e h TYR 317 Ca 0.00 -0.13 -0.06 0.00 3.14 0.00 0.00 58.73 61.69 1b3e h TYR 317 Cb 0.00 -0.23 -0.03 0.00 1.54 0.00 0.00 36.73 38.01 1b3e h TYR 317 CO 0.00 0.80 0.23 0.93 -1.64 0.00 0.00 178.16 178.48 1b3e h GLU 318 N 0.66 1.13 0.14 1.82 4.39 -1.96 -2.54 114.58 118.21 1b3e h GLU 318 Ca 0.14 -0.24 -0.01 0.00 0.34 0.00 0.00 59.36 59.59 1b3e h GLU 318 Cb 0.42 -0.16 0.00 0.00 -0.10 0.00 0.00 28.75 28.91 1b3e h GLU 318 CO 0.01 0.96 -0.07 -0.92 -1.16 0.00 0.00 179.01 177.84 1b3e h TYR 319 N 1.08 -0.17 -0.67 4.33 3.20 -1.78 -1.30 116.97 121.66 1b3e h TYR 319 Ca 0.23 -0.00 0.10 0.00 3.14 0.00 0.00 58.73 62.20 1b3e h TYR 319 Cb 0.30 0.06 -0.07 0.00 1.54 0.00 0.00 36.73 38.56 1b3e h TYR 319 CO 0.02 0.29 0.29 0.28 -1.64 0.00 0.00 178.16 177.41 1b3e h VAL 320 N -0.80 0.79 -0.55 1.81 2.07 -1.58 0.38 116.25 118.37 1b3e h VAL 320 Ca -0.02 -0.17 -0.02 0.00 0.82 0.00 0.00 66.70 67.31 1b3e h VAL 320 Cb 0.54 0.25 -0.03 0.00 -1.52 0.00 0.00 31.29 30.54 1b3e h VAL 320 CO 0.03 0.09 0.27 0.74 0.02 0.00 0.00 177.57 178.72 1b3e h THR 321 N 0.49 1.20 -0.66 2.57 2.02 -1.51 0.17 112.91 117.19 1b3e h THR 321 Ca 0.34 -0.56 -0.01 0.00 0.77 0.00 0.00 66.41 66.95 1b3e h THR 321 Cb 0.40 0.56 -0.03 0.00 -1.74 0.00 0.00 68.15 67.34 1b3e h THR 321 CO -0.30 0.22 0.39 0.00 0.37 0.00 0.00 175.52 176.21 1b3e h ALA 322 N 1.10 0.85 -0.35 6.16 0.00 0.13 0.13 119.26 127.28 1b3e h ALA 322 Ca 0.19 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.94 1b3e h ALA 322 Cb 0.11 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1b3e h ALA 322 CO -0.02 0.33 -0.06 0.82 0.00 0.00 0.00 179.25 180.32 1b3e h ILE 323 N 0.90 1.27 -0.34 0.00 2.04 0.05 0.32 117.51 121.76 1b3e h ILE 323 Ca 0.24 -1.09 -0.01 0.00 1.00 0.00 0.00 64.86 65.00 1b3e h ILE 323 Cb -0.01 1.27 -0.02 0.00 -0.74 0.00 0.00 36.82 37.33 1b3e h ILE 323 CO -0.04 0.36 0.18 -0.09 0.00 0.00 0.00 178.15 178.56 1b3e h ARG 324 N 0.45 0.48 -0.40 2.37 2.43 -0.33 -1.90 114.38 117.48 1b3e h ARG 324 Ca 0.09 -0.06 -0.12 0.00 -0.81 0.00 0.00 59.98 59.08 1b3e h ARG 324 Cb 0.54 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.99 1b3e h ARG 324 CO 0.03 0.40 -0.25 -0.91 -1.51 0.00 0.00 179.97 177.73 1b3e h ASN 325 N 0.43 0.85 -0.08 -3.80 2.35 -0.65 -3.06 115.58 111.63 1b3e h ASN 325 Ca 0.12 -0.32 0.03 0.00 -0.55 0.00 0.00 56.30 55.57 1b3e h ASN 325 Cb 0.07 -0.24 -0.03 0.00 0.05 0.00 0.00 38.32 38.17 1b3e h ASN 325 CO -0.02 1.06 -0.08 0.25 -1.65 0.00 0.00 177.43 176.99 1b3e h LEU 326 N 0.72 -0.25 0.00 1.61 5.85 0.05 -0.66 115.31 122.62 1b3e h LEU 326 Ca 0.09 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.86 1b3e h LEU 326 Cb 0.79 0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.94 1b3e h LEU 326 CO 0.06 -0.11 0.00 0.54 -0.34 0.00 0.00 178.44 178.59 1b3e n ARG 327 N -5.21 0.52 -0.00 1.25 1.74 -0.75 -1.11 116.66 113.10 1b3e n ARG 327 Ca -0.04 0.00 0.02 0.00 -0.77 0.00 0.00 57.85 57.06 1b3e n ARG 327 Cb 0.14 -1.49 0.02 0.00 -1.02 0.00 0.00 32.46 30.10 1b3e n ARG 327 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1b3e n GLU 328 N -0.99 -0.42 -0.72 5.56 1.02 -0.38 -4.96 120.64 119.75 1b3e n GLU 328 Ca 0.12 -0.74 0.00 0.00 -0.02 0.00 0.00 57.16 56.52 1b3e n GLU 328 Cb 0.06 -1.07 0.00 0.00 -0.02 0.00 0.00 31.44 30.40 1b3e n GLU 328 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1b3e n GLY 329 N 0.21 0.19 3.68 0.62 0.00 -0.27 -4.89 105.19 104.73 1b3e n GLY 329 Ca 0.02 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.59 1b3e n GLY 329 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1b3e n THR 330 N -2.06 0.30 -3.73 2.61 -1.04 -0.91 -4.95 114.28 104.49 1b3e n THR 330 Ca 0.00 -0.05 -0.15 0.00 -2.04 0.00 0.00 64.05 61.80 1b3e n THR 330 Cb 0.11 -1.84 -0.16 0.00 -1.82 0.00 0.00 70.33 66.62 1b3e n THR 330 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1b3e n PRO 332 N 4.50 0.00 0.00 0.00 -0.02 -1.26 -5.15 135.00 133.07 1b3e n PRO 332 Ca -0.21 0.00 0.14 0.00 -2.02 0.00 0.00 63.50 61.41 1b3e n PRO 332 Cb 0.51 -0.95 0.80 0.00 -0.02 0.00 0.00 33.50 33.84 1b3e n PRO 332 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63