#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a8e n LYS 4 N 0.00 0.00 -3.44 -0.67 5.02 -1.26 -4.88 118.16 112.93 1a8e n LYS 4 Ca 0.00 0.00 -0.38 0.00 -2.02 0.00 0.00 58.31 55.91 1a8e n LYS 4 Cb 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 34.95 1a8e n LYS 4 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1a8e s THR 5 N -1.48 5.11 -0.22 -0.18 2.01 -1.26 -1.90 115.64 117.72 1a8e s THR 5 Ca 0.00 0.84 -0.05 0.00 0.31 0.00 0.00 61.69 62.79 1a8e s THR 5 Cb 0.00 -3.74 -0.02 0.00 0.01 0.00 0.00 72.50 68.76 1a8e s THR 5 CO 0.00 0.47 -0.00 -0.69 -0.69 0.00 0.00 174.62 173.71 1a8e s VAL 6 N -0.33 3.78 -0.60 3.82 1.01 0.72 -4.95 120.40 123.84 1a8e s VAL 6 Ca 0.23 -0.36 -0.22 0.00 0.00 0.00 0.00 61.98 61.64 1a8e s VAL 6 Cb -0.16 -2.73 0.07 0.00 0.00 0.00 0.00 36.38 33.56 1a8e s VAL 6 CO 0.11 0.40 0.88 -0.13 0.00 0.00 0.00 175.10 176.36 1a8e s ARG 7 N 1.41 3.15 0.10 2.72 0.52 -1.26 -0.96 118.95 124.63 1a8e s ARG 7 Ca 0.05 -0.77 -0.26 0.00 -0.52 0.00 0.00 55.73 54.22 1a8e s ARG 7 Cb -0.15 -4.17 -0.06 0.00 0.52 0.00 0.00 34.95 31.09 1a8e s ARG 7 CO 0.00 -1.62 0.82 -0.46 0.02 0.00 0.00 175.30 174.06 1a8e s TRP 8 N 3.66 3.81 -0.38 -0.53 -0.11 0.18 -0.56 118.94 125.01 1a8e s TRP 8 Ca 0.22 1.60 -0.18 0.00 1.22 0.00 0.00 56.10 58.95 1a8e s TRP 8 Cb -0.17 -2.86 0.01 0.00 -1.50 0.00 0.00 33.47 28.95 1a8e s TRP 8 CO 0.12 0.33 0.52 0.00 -4.62 0.00 0.00 176.95 173.31 1a8e s ALA 10 N 2.43 3.71 -0.49 0.00 0.00 0.10 -4.80 121.76 122.71 1a8e s ALA 10 Ca 0.18 -0.53 -0.17 0.00 0.00 0.00 0.00 51.96 51.44 1a8e s ALA 10 Cb -0.15 -2.22 0.07 0.00 0.00 0.00 0.00 23.12 20.82 1a8e s ALA 10 CO 0.15 0.31 0.48 0.08 0.00 0.00 0.00 175.76 176.77 1a8e s VAL 11 N -0.18 5.12 0.11 0.00 1.01 -1.26 -0.61 120.40 124.58 1a8e s VAL 11 Ca 0.15 -0.92 0.00 0.00 0.00 0.00 0.00 61.98 61.21 1a8e s VAL 11 Cb -0.13 -4.20 0.00 0.00 0.00 0.00 0.00 36.38 32.05 1a8e s VAL 11 CO 0.04 -0.68 0.00 -0.24 0.00 0.00 0.00 175.10 174.22 1a8e n SER 12 N 5.52 -3.23 -0.15 3.32 2.88 0.63 -4.16 113.62 118.43 1a8e n SER 12 Ca -0.11 0.50 -0.04 0.00 -1.33 0.00 0.00 58.87 57.89 1a8e n SER 12 Cb 0.44 -1.41 0.05 0.00 -0.75 0.00 0.00 64.21 62.54 1a8e n SER 12 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 1a8e h GLU 13 N 0.00 0.34 -0.30 -1.46 4.39 -1.93 -1.19 114.58 114.42 1a8e h GLU 13 Ca 0.01 -0.02 -0.07 0.00 0.34 0.00 0.00 59.36 59.62 1a8e h GLU 13 Cb 0.42 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.99 1a8e h GLU 13 CO 0.00 0.22 -0.08 0.45 -1.16 0.00 0.00 179.01 178.45 1a8e h HIS 14 N 0.35 0.66 -0.36 4.33 3.86 -1.91 -0.03 115.15 122.05 1a8e h HIS 14 Ca 0.22 -0.14 -0.08 0.00 -1.16 0.00 0.00 60.37 59.21 1a8e h HIS 14 Cb 0.21 -0.16 -0.02 0.00 1.06 0.00 0.00 27.41 28.50 1a8e h HIS 14 CO -0.15 0.78 -0.11 0.93 0.86 0.00 0.00 177.93 180.24 1a8e h GLU 15 N 0.36 0.62 -0.83 2.45 5.08 -1.70 -1.84 114.58 118.72 1a8e h GLU 15 Ca 0.08 -0.19 -0.04 0.00 -1.00 0.00 0.00 59.36 58.21 1a8e h GLU 15 Cb 0.56 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.72 1a8e h GLU 15 CO 0.03 0.72 0.37 0.00 -1.00 0.00 0.00 179.01 179.12 1a8e h ALA 16 N 1.32 1.07 -0.33 3.43 0.00 -0.96 0.23 119.26 124.03 1a8e h ALA 16 Ca 0.10 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 1a8e h ALA 16 Cb 0.52 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1a8e h ALA 16 CO 0.03 0.66 -0.02 1.15 0.00 0.00 0.00 179.25 181.07 1a8e h THR 17 N 1.19 1.27 -0.36 0.00 2.02 -0.49 -1.58 112.91 114.96 1a8e h THR 17 Ca 0.28 -1.01 -0.09 0.00 0.77 0.00 0.00 66.41 66.36 1a8e h THR 17 Cb 0.17 1.27 -0.02 0.00 -1.74 0.00 0.00 68.15 67.83 1a8e h THR 17 CO -0.03 0.33 -0.13 0.50 0.37 0.00 0.00 175.52 176.56 1a8e h LYS 18 N 0.39 0.64 -0.54 6.66 3.64 -0.92 -2.52 116.57 123.91 1a8e h LYS 18 Ca 0.09 -0.20 -0.00 0.00 -1.27 0.00 0.00 60.65 59.26 1a8e h LYS 18 Cb 0.48 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 32.22 1a8e h LYS 18 CO 0.02 0.75 0.32 0.00 -2.27 0.00 0.00 179.45 178.27 1a8e h GLN 20 N 0.72 0.77 -0.17 0.00 3.07 -1.04 0.17 115.11 118.64 1a8e h GLN 20 Ca 0.19 -0.20 -0.12 0.00 0.09 0.00 0.00 58.65 58.61 1a8e h GLN 20 Cb -0.01 -0.10 -0.01 0.00 0.08 0.00 0.00 27.48 27.44 1a8e h GLN 20 CO -0.04 0.77 -0.44 0.77 0.09 0.00 0.00 178.83 179.99 1a8e h SER 21 N 0.72 0.42 -0.53 0.06 0.02 -1.10 -0.58 113.55 112.57 1a8e h SER 21 Ca 0.15 -0.19 -0.05 0.00 -0.84 0.00 0.00 61.79 60.86 1a8e h SER 21 Cb 0.42 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 62.82 1a8e h SER 21 CO 0.02 0.81 0.13 0.15 -1.14 0.00 0.00 176.83 176.80 1a8e h PHE 22 N 0.33 0.88 -0.20 3.45 3.57 0.11 -0.62 116.94 124.45 1a8e h PHE 22 Ca 0.02 -0.10 -0.00 0.00 3.53 0.00 0.00 57.97 61.42 1a8e h PHE 22 Cb 0.90 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 39.38 1a8e h PHE 22 CO 0.03 0.77 0.11 -0.09 -2.23 0.00 0.00 178.31 176.89 1a8e h ARG 23 N 0.73 0.28 -0.53 1.11 2.43 -0.17 -2.31 114.38 115.93 1a8e h ARG 23 Ca 0.17 -0.03 -0.08 0.00 -0.81 0.00 0.00 59.98 59.23 1a8e h ARG 23 Cb 0.33 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.80 1a8e h ARG 23 CO 0.00 0.27 0.04 -0.44 -1.51 0.00 0.00 179.97 178.33 1a8e h ASP 24 N 0.22 0.89 -0.15 -3.80 3.32 -0.88 -2.48 116.42 113.55 1a8e h ASP 24 Ca 0.07 -0.29 -0.12 0.00 0.02 0.00 0.00 57.03 56.71 1a8e h ASP 24 Cb 0.07 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.37 1a8e h ASP 24 CO -0.01 0.96 -0.33 0.45 -1.72 0.00 0.00 179.24 178.59 1a8e h HIS 25 N 0.79 0.75 -0.04 4.55 3.86 -1.03 -2.67 115.15 121.36 1a8e h HIS 25 Ca 0.16 -0.20 -0.08 0.00 -1.16 0.00 0.00 60.37 59.09 1a8e h HIS 25 Cb 0.48 -0.17 -0.01 0.00 1.06 0.00 0.00 27.41 28.77 1a8e h HIS 25 CO 0.04 0.89 -0.36 0.52 0.86 0.00 0.00 177.93 179.87 1a8e h MET 26 N 0.55 0.09 -0.54 2.45 2.86 -1.35 -2.60 114.93 116.39 1a8e h MET 26 Ca 0.06 -0.03 -0.07 0.00 -2.06 0.00 0.00 59.70 57.60 1a8e h MET 26 Cb 0.83 -0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.46 1a8e h MET 26 CO 0.07 0.44 0.06 0.87 1.06 0.00 0.00 176.91 179.41 1a8e h LYS 27 N 0.08 0.87 0.00 1.72 1.57 -1.10 0.35 116.57 120.05 1a8e h LYS 27 Ca 0.01 -0.22 0.00 0.00 -1.87 0.00 0.00 60.65 58.57 1a8e h LYS 27 Cb 0.68 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.88 1a8e h LYS 27 CO 0.05 0.83 0.00 0.66 -0.57 0.00 0.00 179.45 180.42 1a8e h SER 28 N 0.82 0.00 0.00 0.86 4.64 -1.27 -3.30 113.55 115.30 1a8e h SER 28 Ca 0.17 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.42 1a8e h SER 28 Cb 0.40 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.48 1a8e h SER 28 CO 0.01 0.00 -1.25 1.33 -0.87 0.00 0.00 176.83 176.05 1a8e n VAL 29 N -2.41 0.25 -2.87 0.95 0.24 -0.95 -4.99 118.33 108.55 1a8e n VAL 29 Ca 0.03 -0.16 -0.36 0.00 -2.04 0.00 0.00 64.34 61.81 1a8e n VAL 29 Cb 0.32 -0.85 -0.06 0.00 -1.47 0.00 0.00 33.84 31.77 1a8e n VAL 29 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 1a8e s ILE 30 N -2.10 4.33 0.83 1.34 -1.09 0.12 -5.04 121.20 119.60 1a8e s ILE 30 Ca -0.02 1.62 -0.12 0.00 -2.23 0.00 0.00 60.65 59.91 1a8e s ILE 30 Cb 0.01 -3.91 0.09 0.00 -1.58 0.00 0.00 42.46 37.07 1a8e s ILE 30 CO 0.15 0.09 1.12 -2.16 -1.23 0.00 0.00 174.94 172.91 1a8e s PRO 31 N -2.22 1.82 0.55 2.79 0.04 -1.26 -4.79 135.00 131.93 1a8e s PRO 31 Ca 0.50 0.41 0.25 0.00 0.04 0.00 0.00 61.00 62.21 1a8e s PRO 31 Cb -0.17 -1.91 1.44 0.00 0.04 0.00 0.00 34.50 33.91 1a8e s PRO 31 CO 0.21 -1.75 2.02 0.66 0.04 0.00 0.00 177.00 178.18 1a8e h SER 32 N -1.18 0.00 -0.38 6.66 4.64 -1.96 0.11 113.55 121.44 1a8e h SER 32 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1a8e h SER 32 Cb 1.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 1a8e h SER 32 CO 0.62 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.68 1a8e n ASP 33 N -4.22 2.23 -5.00 4.97 5.68 -1.26 -4.94 116.55 114.02 1a8e n ASP 33 Ca 0.07 -1.95 -0.19 0.00 -0.50 0.00 0.00 54.79 52.22 1a8e n ASP 33 Cb 0.50 -0.25 0.02 0.00 -1.14 0.00 0.00 41.12 40.25 1a8e n ASP 33 CO 0.00 0.00 0.00 -0.83 -1.33 0.00 0.00 177.20 175.04 1a8e s GLY 34 N -1.11 1.90 0.52 6.12 0.00 0.40 -3.39 107.32 111.75 1a8e s GLY 34 Ca 0.30 -1.53 -0.20 0.00 0.00 0.00 0.00 44.72 43.28 1a8e s GLY 34 CO 0.21 -1.32 1.12 2.56 0.00 0.00 0.00 173.10 175.67 1a8e s PRO 35 N -4.51 3.49 0.24 2.90 0.04 -1.26 -4.09 135.00 131.82 1a8e s PRO 35 Ca 0.56 1.60 0.04 0.00 0.04 0.00 0.00 61.00 63.23 1a8e s PRO 35 Cb -0.10 -2.08 -0.05 0.00 0.04 0.00 0.00 34.50 32.30 1a8e s PRO 35 CO 0.35 -0.73 0.00 -1.54 0.04 0.00 0.00 177.00 175.12 1a8e s SER 36 N -1.74 1.87 -0.00 6.66 1.04 -0.80 -4.91 113.70 115.82 1a8e s SER 36 Ca 0.70 -1.24 0.06 0.00 0.48 0.00 0.00 55.95 55.95 1a8e s SER 36 Cb -0.23 0.00 -0.03 0.00 0.10 0.00 0.00 66.02 65.86 1a8e s SER 36 CO 0.27 -0.53 -0.16 -0.69 0.98 0.00 0.00 173.24 173.11 1a8e s VAL 37 N -3.41 2.89 0.08 5.02 1.01 -1.26 -0.20 120.40 124.53 1a8e s VAL 37 Ca 0.30 -0.97 0.06 0.00 0.00 0.00 0.00 61.98 61.36 1a8e s VAL 37 Cb 0.06 -2.17 -0.03 0.00 0.00 0.00 0.00 36.38 34.23 1a8e s VAL 37 CO 0.10 0.46 -0.16 0.00 0.00 0.00 0.00 175.10 175.49 1a8e s ALA 38 N -0.83 1.38 -0.15 5.51 0.00 -0.14 -4.82 121.76 122.71 1a8e s ALA 38 Ca 0.13 -1.09 -0.02 0.00 0.00 0.00 0.00 51.96 50.98 1a8e s ALA 38 Cb -0.11 -0.14 -0.02 0.00 0.00 0.00 0.00 23.12 22.85 1a8e s ALA 38 CO 0.03 0.23 -0.08 0.00 0.00 0.00 0.00 175.76 175.94 1a8e s VAL 40 N 0.48 2.57 -0.12 0.00 1.01 0.53 -4.95 120.40 119.92 1a8e s VAL 40 Ca -0.06 -1.07 -0.19 0.00 0.00 0.00 0.00 61.98 60.66 1a8e s VAL 40 Cb -0.15 -2.27 -0.04 0.00 0.00 0.00 0.00 36.38 33.92 1a8e s VAL 40 CO 0.04 0.27 0.50 -0.75 0.00 0.00 0.00 175.10 175.15 1a8e s LYS 41 N 1.29 4.34 0.32 2.72 2.20 -1.26 0.02 119.74 129.37 1a8e s LYS 41 Ca 0.00 0.49 0.03 0.00 -0.36 0.00 0.00 55.97 56.14 1a8e s LYS 41 Cb -0.16 -3.44 -0.06 0.00 -1.51 0.00 0.00 37.83 32.66 1a8e s LYS 41 CO -0.07 0.13 0.06 0.15 -0.36 0.00 0.00 175.35 175.27 1a8e s LYS 42 N 0.69 1.64 0.22 4.03 -0.14 0.22 -4.95 119.74 121.45 1a8e s LYS 42 Ca 0.27 -1.91 0.20 0.00 -1.36 0.00 0.00 55.97 53.17 1a8e s LYS 42 Cb -0.15 -0.80 0.04 0.00 -1.68 0.00 0.00 37.83 35.23 1a8e s LYS 42 CO 0.11 -0.21 1.16 0.00 -0.76 0.00 0.00 175.35 175.65 1a8e h ALA 43 N 2.13 0.67 -2.79 5.17 0.00 -1.95 0.18 119.26 122.67 1a8e h ALA 43 Ca -0.40 -0.32 -0.06 0.00 0.00 0.00 0.00 54.91 54.13 1a8e h ALA 43 Cb 1.25 0.06 -0.10 0.00 0.00 0.00 0.00 17.79 19.00 1a8e h ALA 43 CO 0.68 0.37 -0.13 0.45 0.00 0.00 0.00 179.25 180.62 1a8e s SER 44 N -5.84 -0.10 0.35 0.00 0.15 -1.26 -4.60 113.70 102.41 1a8e s SER 44 Ca 0.01 -0.80 0.08 0.00 0.70 0.00 0.00 55.95 55.93 1a8e s SER 44 Cb 0.08 0.54 0.67 0.00 -1.71 0.00 0.00 66.02 65.60 1a8e s SER 44 CO 0.77 -1.05 1.86 0.10 1.20 0.00 0.00 173.24 176.11 1a8e h TYR 45 N 2.32 0.33 -0.23 3.44 -0.00 -1.93 -2.42 116.97 118.48 1a8e h TYR 45 Ca -0.28 -0.05 -0.07 0.00 -0.00 0.00 0.00 58.73 58.33 1a8e h TYR 45 Cb 1.25 -0.09 -0.01 0.00 -0.00 0.00 0.00 36.73 37.87 1a8e h TYR 45 CO 0.39 0.46 -0.17 1.25 -0.00 0.00 0.00 178.16 180.09 1a8e h LEU 46 N 0.29 0.39 -0.79 0.10 5.85 -1.96 0.25 115.31 119.45 1a8e h LEU 46 Ca 0.06 -0.11 -0.13 0.00 0.84 0.00 0.00 57.88 58.54 1a8e h LEU 46 Cb 0.45 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.36 1a8e h LEU 46 CO 0.03 0.58 -0.61 0.44 -0.34 0.00 0.00 178.44 178.55 1a8e h ASP 47 N 0.37 0.00 -0.14 1.25 3.32 -1.85 -2.27 116.42 117.10 1a8e h ASP 47 Ca 0.07 0.00 -0.17 0.00 0.02 0.00 0.00 57.03 56.94 1a8e h ASP 47 Cb 0.52 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.07 1a8e h ASP 47 CO 0.03 0.61 -0.54 0.00 -1.72 0.00 0.00 179.24 177.62 1a8e h ILE 49 N 0.56 1.22 -0.35 0.00 2.04 -0.70 -1.69 117.51 118.59 1a8e h ILE 49 Ca 0.01 -0.65 -0.11 0.00 1.00 0.00 0.00 64.86 65.11 1a8e h ILE 49 Cb 1.11 0.53 -0.01 0.00 -0.74 0.00 0.00 36.82 37.71 1a8e h ILE 49 CO 0.11 0.26 -0.21 0.03 0.00 0.00 0.00 178.15 178.34 1a8e h ARG 50 N 0.84 0.76 -0.73 2.37 2.47 -1.35 -2.45 114.38 116.29 1a8e h ARG 50 Ca 0.21 -0.35 0.02 0.00 -1.26 0.00 0.00 59.98 58.59 1a8e h ARG 50 Cb 0.16 -0.01 -0.04 0.00 -1.65 0.00 0.00 29.97 28.43 1a8e h ARG 50 CO -0.02 0.97 0.48 0.00 0.56 0.00 0.00 179.97 181.96 1a8e h ALA 51 N 0.77 1.52 -0.22 0.04 0.00 -0.98 0.10 119.26 120.49 1a8e h ALA 51 Ca 0.07 -0.04 -0.19 0.00 0.00 0.00 0.00 54.91 54.75 1a8e h ALA 51 Cb 0.77 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1a8e h ALA 51 CO 0.06 0.43 -0.58 0.82 0.00 0.00 0.00 179.25 179.98 1a8e h ILE 52 N 0.95 1.29 -0.35 0.00 2.04 -1.17 0.65 117.51 120.92 1a8e h ILE 52 Ca 0.28 -1.79 -0.05 0.00 1.00 0.00 0.00 64.86 64.30 1a8e h ILE 52 Cb -0.05 1.81 -0.02 0.00 -0.74 0.00 0.00 36.82 37.83 1a8e h ILE 52 CO -0.07 0.57 -0.01 0.00 0.00 0.00 0.00 178.15 178.64 1a8e h ALA 53 N 0.61 1.32 -0.21 1.87 0.00 -0.91 -2.29 119.26 119.66 1a8e h ALA 53 Ca -0.01 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1a8e h ALA 53 Cb 1.20 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1a8e h ALA 53 CO 0.13 0.46 0.00 0.00 0.00 0.00 0.00 179.25 179.84 1a8e n ALA 54 N -2.48 2.50 -2.35 0.00 0.00 0.30 -4.90 120.51 113.59 1a8e n ALA 54 Ca 0.02 -0.49 -0.12 0.00 0.00 0.00 0.00 53.44 52.85 1a8e n ALA 54 Cb 0.26 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 18.65 1a8e n ALA 54 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1a8e n ASN 55 N 0.25 -3.93 -0.01 0.00 5.15 -0.86 -4.90 115.26 110.96 1a8e n ASN 55 Ca 0.13 -0.05 0.11 0.00 -0.60 0.00 0.00 54.58 54.17 1a8e n ASN 55 Cb 0.27 -3.06 -0.16 0.00 -0.53 0.00 0.00 39.78 36.30 1a8e n ASN 55 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1a8e n GLU 56 N -2.28 0.57 -4.03 1.20 -0.58 0.22 -5.00 120.64 110.74 1a8e n GLU 56 Ca -0.12 -0.17 -0.11 0.00 -0.42 0.00 0.00 57.16 56.33 1a8e n GLU 56 Cb 0.60 -1.52 -0.05 0.00 -0.57 0.00 0.00 31.44 29.91 1a8e n GLU 56 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1a8e s ALA 57 N -3.45 0.20 -0.00 0.62 0.00 -1.00 -4.94 121.76 113.20 1a8e s ALA 57 Ca -0.06 -1.17 0.00 0.00 0.00 0.00 0.00 51.96 50.74 1a8e s ALA 57 Cb 0.14 1.10 -0.00 0.00 0.00 0.00 0.00 23.12 24.36 1a8e s ALA 57 CO 0.90 -0.82 0.00 -0.25 0.00 0.00 0.00 175.76 175.59 1a8e n ASP 58 N -0.84 4.82 -3.78 0.00 8.00 0.28 -4.20 116.55 120.84 1a8e n ASP 58 Ca -0.01 -0.00 -0.12 0.00 0.71 0.00 0.00 54.79 55.38 1a8e n ASP 58 Cb 0.62 0.44 -0.08 0.00 -0.02 0.00 0.00 41.12 42.08 1a8e n ASP 58 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1a8e s ALA 59 N -2.01 -0.61 -0.16 2.24 0.00 -1.03 -4.48 121.76 115.72 1a8e s ALA 59 Ca -0.00 -0.01 -0.29 0.00 0.00 0.00 0.00 51.96 51.66 1a8e s ALA 59 Cb 0.00 0.26 0.09 0.00 0.00 0.00 0.00 23.12 23.47 1a8e s ALA 59 CO 0.01 -0.37 0.78 0.54 0.00 0.00 0.00 175.76 176.73 1a8e s VAL 60 N -2.29 0.00 -0.14 0.00 0.11 -1.23 -0.84 120.40 116.01 1a8e s VAL 60 Ca -0.07 0.00 -0.13 0.00 -2.93 0.00 0.00 61.98 58.85 1a8e s VAL 60 Cb -0.02 -1.00 -0.05 0.00 -1.53 0.00 0.00 36.38 33.78 1a8e s VAL 60 CO -0.02 0.00 0.28 -0.89 -3.33 0.00 0.00 175.10 171.14 1a8e s THR 61 N -0.58 5.30 0.12 5.04 2.01 -1.26 -1.32 115.64 124.95 1a8e s THR 61 Ca -0.05 0.53 0.06 0.00 0.31 0.00 0.00 61.69 62.54 1a8e s THR 61 Cb -0.02 -3.61 -0.04 0.00 0.01 0.00 0.00 72.50 68.85 1a8e s THR 61 CO 0.04 0.44 -0.15 -0.76 -0.69 0.00 0.00 174.62 173.51 1a8e s LEU 62 N 0.10 2.40 0.47 4.42 1.43 0.53 -4.92 118.68 123.11 1a8e s LEU 62 Ca 0.17 -0.80 -0.22 0.00 -1.03 0.00 0.00 54.13 52.24 1a8e s LEU 62 Cb -0.13 -0.59 -0.07 0.00 0.03 0.00 0.00 46.19 45.42 1a8e s LEU 62 CO 0.05 -0.12 1.13 -0.62 0.23 0.00 0.00 176.35 177.01 1a8e s ASP 63 N -2.42 6.20 0.40 2.29 2.15 -1.26 -0.61 116.67 123.42 1a8e s ASP 63 Ca 0.09 2.21 0.13 0.00 0.43 0.00 0.00 52.55 55.41 1a8e s ASP 63 Cb -0.05 -2.59 0.96 0.00 -0.30 0.00 0.00 42.92 40.94 1a8e s ASP 63 CO 0.03 -0.89 1.91 0.00 -0.17 0.00 0.00 175.17 176.05 1a8e h ALA 64 N 1.92 2.00 -0.17 3.66 0.00 -1.80 0.16 119.26 125.05 1a8e h ALA 64 Ca -0.49 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.37 1a8e h ALA 64 Cb 1.24 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 1a8e h ALA 64 CO 0.60 -0.20 -0.11 0.78 0.00 0.00 0.00 179.25 180.31 1a8e h GLY 65 N 0.52 0.28 1.86 0.00 0.00 -1.92 -1.77 103.07 102.04 1a8e h GLY 65 Ca 0.38 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.54 1a8e h GLY 65 CO -0.14 0.16 -0.14 1.41 0.00 0.00 0.00 176.54 177.83 1a8e h LEU 66 N 0.25 0.00 -1.39 3.11 3.38 -1.09 -3.08 115.31 116.49 1a8e h LEU 66 Ca 0.05 -0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 1a8e h LEU 66 Cb 0.35 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 1a8e h LEU 66 CO 0.02 0.00 -0.02 0.58 0.09 0.00 0.00 178.44 179.11 1a8e h VAL 67 N 0.00 1.17 -0.10 1.22 2.07 -0.40 -1.20 116.25 119.00 1a8e h VAL 67 Ca 0.00 -0.66 -0.01 0.00 0.82 0.00 0.00 66.70 66.85 1a8e h VAL 67 Cb 0.98 1.00 -0.00 0.00 -1.52 0.00 0.00 31.29 31.75 1a8e h VAL 67 CO 0.00 0.22 0.02 0.22 0.02 0.00 0.00 177.57 178.05 1a8e h TYR 68 N 0.37 0.18 -0.80 1.57 3.20 -1.43 -2.27 116.97 117.78 1a8e h TYR 68 Ca 0.08 -0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.91 1a8e h TYR 68 Cb 0.28 -0.05 -0.04 0.00 1.54 0.00 0.00 36.73 38.46 1a8e h TYR 68 CO 0.01 0.35 0.44 -0.44 -1.64 0.00 0.00 178.16 176.87 1a8e h ASP 69 N -0.04 1.00 0.44 -2.11 3.32 -1.55 -2.30 116.42 115.17 1a8e h ASP 69 Ca 0.03 -0.08 -0.05 0.00 0.02 0.00 0.00 57.03 56.95 1a8e h ASP 69 Cb 0.26 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.55 1a8e h ASP 69 CO 0.00 0.80 -0.25 0.00 -1.72 0.00 0.00 179.24 178.08 1a8e h ALA 70 N 1.36 1.32 -0.08 3.45 0.00 -1.01 -2.39 119.26 121.91 1a8e h ALA 70 Ca 0.28 -0.22 -0.17 0.00 0.00 0.00 0.00 54.91 54.80 1a8e h ALA 70 Cb 0.03 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1a8e h ALA 70 CO -0.05 0.31 -0.69 -0.92 0.00 0.00 0.00 179.25 177.90 1a8e h TYR 71 N 0.00 0.46 -4.11 0.00 5.03 -0.83 -0.82 116.97 116.71 1a8e h TYR 71 Ca -0.00 -0.20 -0.56 0.00 2.58 0.00 0.00 58.73 60.55 1a8e h TYR 71 Cb 0.53 -0.07 0.16 0.00 1.55 0.00 0.00 36.73 38.90 1a8e h TYR 71 CO 0.00 0.93 0.47 1.28 -1.32 0.00 0.00 178.16 179.52 1a8e n LEU 72 N -3.84 5.73 -4.79 2.82 4.77 -0.90 -2.90 117.00 117.90 1a8e n LEU 72 Ca -0.04 0.79 -0.35 0.00 -0.03 0.00 0.00 56.01 56.38 1a8e n LEU 72 Cb 0.68 -1.55 -0.02 0.00 -2.33 0.00 0.00 43.42 40.20 1a8e n LEU 72 CO 0.47 -1.13 0.75 0.00 -1.33 0.00 0.00 177.39 176.14 1a8e s ALA 73 N -1.51 2.87 -0.46 -1.18 0.00 -1.26 -0.84 121.76 119.38 1a8e s ALA 73 Ca 0.81 0.71 0.09 0.00 0.00 0.00 0.00 51.96 53.58 1a8e s ALA 73 Cb -0.37 -3.30 0.57 0.00 0.00 0.00 0.00 23.12 20.02 1a8e s ALA 73 CO 0.42 -0.45 1.39 -0.35 0.00 0.00 0.00 175.76 176.77 1a8e n PRO 74 N -0.86 3.61 -0.06 0.00 -0.04 -1.26 -4.89 135.00 131.50 1a8e n PRO 74 Ca 0.09 -2.20 -0.18 0.00 -0.04 0.00 0.00 63.50 61.18 1a8e n PRO 74 Cb 0.51 -2.02 -0.13 0.00 -0.04 0.00 0.00 33.50 31.82 1a8e n PRO 74 CO 0.00 0.00 0.00 -0.91 -0.04 0.00 0.00 175.50 174.55 1a8e h ASN 75 N 2.65 0.10 -6.55 3.54 4.21 -1.25 -3.49 115.58 114.79 1a8e h ASN 75 Ca 0.03 -0.85 -0.51 0.00 1.21 0.00 0.00 56.30 56.18 1a8e h ASN 75 Cb 1.59 -0.03 -0.08 0.00 -1.12 0.00 0.00 38.32 38.68 1a8e h ASN 75 CO 0.38 1.25 -0.88 0.59 -1.29 0.00 0.00 177.43 177.47 1a8e n ASN 76 N -4.43 -0.72 -4.88 5.81 4.13 -0.67 -4.81 115.26 109.69 1a8e n ASN 76 Ca -0.18 -1.01 -0.29 0.00 1.68 0.00 0.00 54.58 54.77 1a8e n ASN 76 Cb 0.62 -2.98 -0.01 0.00 -1.54 0.00 0.00 39.78 35.88 1a8e n ASN 76 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1a8e s LEU 77 N -7.03 3.61 0.13 3.41 1.43 -0.33 -3.88 118.68 116.02 1a8e s LEU 77 Ca 0.11 1.14 0.06 0.00 -1.03 0.00 0.00 54.13 54.41 1a8e s LEU 77 Cb -0.06 -4.09 -0.04 0.00 0.03 0.00 0.00 46.19 42.03 1a8e s LEU 77 CO 0.90 -0.58 -0.14 -1.59 0.23 0.00 0.00 176.35 175.16 1a8e s LYS 78 N -4.51 1.05 0.10 1.70 -2.85 0.64 -4.06 119.74 111.82 1a8e s LYS 78 Ca 0.51 -1.28 -0.30 0.00 -1.00 0.00 0.00 55.97 53.90 1a8e s LYS 78 Cb -0.10 -0.92 -0.06 0.00 -2.06 0.00 0.00 37.83 34.69 1a8e s LYS 78 CO 0.42 0.17 1.01 -1.25 0.10 0.00 0.00 175.35 175.80 1a8e s PRO 79 N -2.79 4.64 0.00 1.78 0.04 -1.26 -0.82 135.00 136.58 1a8e s PRO 79 Ca 0.10 1.52 0.00 0.00 0.04 0.00 0.00 61.00 62.66 1a8e s PRO 79 Cb -0.04 -3.37 0.00 0.00 0.04 0.00 0.00 34.50 31.13 1a8e s PRO 79 CO 0.03 0.11 0.00 1.33 0.04 0.00 0.00 177.00 178.51 1a8e n VAL 80 N 2.98 0.00 -3.99 -0.36 0.24 0.40 -4.80 118.33 112.80 1a8e n VAL 80 Ca 0.03 0.00 -0.15 0.00 -2.04 0.00 0.00 64.34 62.18 1a8e n VAL 80 Cb 0.49 -0.90 -0.15 0.00 -1.47 0.00 0.00 33.84 31.81 1a8e n VAL 80 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1a8e s VAL 81 N -1.96 0.20 0.06 3.34 1.01 -1.21 -1.12 120.40 120.72 1a8e s VAL 81 Ca 0.00 -0.04 0.05 0.00 0.00 0.00 0.00 61.98 61.99 1a8e s VAL 81 Cb 0.00 -0.21 -0.04 0.00 0.00 0.00 0.00 36.38 36.13 1a8e s VAL 81 CO 0.00 0.09 -0.06 0.00 0.00 0.00 0.00 175.10 175.13 1a8e s ALA 82 N 0.32 3.06 0.58 5.51 0.00 0.66 -0.19 121.76 131.71 1a8e s ALA 82 Ca -0.03 -1.12 -0.13 0.00 0.00 0.00 0.00 51.96 50.68 1a8e s ALA 82 Cb -0.06 -1.07 -0.05 0.00 0.00 0.00 0.00 23.12 21.94 1a8e s ALA 82 CO -0.01 0.64 1.02 -1.21 0.00 0.00 0.00 175.76 176.20 1a8e s GLU 83 N -1.89 3.67 0.07 0.00 2.02 -0.68 -0.85 118.70 121.04 1a8e s GLU 83 Ca 0.21 0.87 0.04 0.00 0.02 0.00 0.00 54.97 56.11 1a8e s GLU 83 Cb -0.11 -2.09 -0.03 0.00 0.10 0.00 0.00 34.13 32.00 1a8e s GLU 83 CO 0.12 -0.50 -0.12 -0.59 0.02 0.00 0.00 175.26 174.19 1a8e s PHE 84 N -2.91 1.07 0.30 1.61 -0.12 -0.55 -4.72 117.98 112.66 1a8e s PHE 84 Ca 0.57 -0.52 0.00 0.00 -0.05 0.00 0.00 56.93 56.94 1a8e s PHE 84 Cb -0.11 -0.60 -0.00 0.00 -0.63 0.00 0.00 43.02 41.68 1a8e s PHE 84 CO 0.44 0.02 0.01 0.66 -0.05 0.00 0.00 175.22 176.30 1a8e n TYR 85 N 1.11 0.64 0.00 3.49 4.01 -0.40 -0.11 117.16 125.91 1a8e n TYR 85 Ca -0.20 -1.49 0.00 0.00 -0.16 0.00 0.00 57.90 56.05 1a8e n TYR 85 Cb 0.55 -0.18 0.00 0.00 -0.31 0.00 0.00 39.34 39.40 1a8e n TYR 85 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1a8e n GLY 86 N 1.32 1.37 3.64 2.72 0.00 -1.26 -0.90 105.19 112.08 1a8e n GLY 86 Ca -0.12 -0.37 -0.07 0.00 0.00 0.00 0.00 46.02 45.46 1a8e n GLY 86 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1a8e s SER 87 N -4.00 -0.32 0.42 1.61 1.04 -1.25 -5.00 113.70 106.20 1a8e s SER 87 Ca 0.00 -0.26 0.23 0.00 0.48 0.00 0.00 55.95 56.40 1a8e s SER 87 Cb 0.00 0.53 0.74 0.00 0.10 0.00 0.00 66.02 67.39 1a8e s SER 87 CO 0.00 -0.93 1.75 0.11 0.98 0.00 0.00 173.24 175.15 1a8e h LYS 88 N 2.00 0.00 -0.40 4.02 1.57 -1.91 -2.71 116.57 119.13 1a8e h LYS 88 Ca -0.24 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.39 1a8e h LYS 88 Cb 1.25 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.55 1a8e h LYS 88 CO 0.29 0.24 -0.31 0.93 -0.57 0.00 0.00 179.45 180.02 1a8e h GLU 89 N 0.00 0.92 -2.28 3.15 3.07 -1.97 -3.38 114.58 114.09 1a8e h GLU 89 Ca -0.00 -0.46 -0.55 0.00 -0.50 0.00 0.00 59.36 57.85 1a8e h GLU 89 Cb 0.87 0.00 -0.36 0.00 -0.84 0.00 0.00 28.75 28.42 1a8e h GLU 89 CO 0.03 1.11 -0.93 0.34 -1.40 0.00 0.00 179.01 178.17 1a8e s ASP 90 N -6.75 1.36 0.23 1.42 2.15 -1.14 -5.11 116.67 108.83 1a8e s ASP 90 Ca -0.11 -2.85 -0.30 0.00 0.43 0.00 0.00 52.55 49.72 1a8e s ASP 90 Cb 0.11 -0.24 -0.10 0.00 -0.30 0.00 0.00 42.92 42.39 1a8e s ASP 90 CO 0.87 -0.18 1.47 -2.16 -0.17 0.00 0.00 175.17 175.01 1a8e s PRO 91 N 0.26 4.25 -0.16 4.34 0.04 -1.04 -3.76 135.00 138.94 1a8e s PRO 91 Ca 0.31 2.33 -0.01 0.00 0.04 0.00 0.00 61.00 63.67 1a8e s PRO 91 Cb 0.00 -3.11 -0.01 0.00 0.04 0.00 0.00 34.50 31.42 1a8e s PRO 91 CO -0.16 -0.47 -0.12 -0.65 0.04 0.00 0.00 177.00 175.64 1a8e s GLN 92 N -0.06 3.34 -0.59 4.56 -0.21 -0.07 -4.91 119.66 121.72 1a8e s GLN 92 Ca 0.62 -0.69 0.00 0.00 0.02 0.00 0.00 55.36 55.31 1a8e s GLN 92 Cb -0.43 -2.71 0.50 0.00 1.00 0.00 0.00 33.01 31.37 1a8e s GLN 92 CO 0.41 0.07 1.94 0.25 -2.12 0.00 0.00 175.29 175.85 1a8e n THR 93 N 3.94 3.44 -3.89 -0.19 -2.24 -1.26 -1.27 114.28 112.81 1a8e n THR 93 Ca -0.18 -2.79 -0.08 0.00 -2.27 0.00 0.00 64.05 58.73 1a8e n THR 93 Cb 0.52 -0.98 -0.02 0.00 -2.10 0.00 0.00 70.33 67.75 1a8e n THR 93 CO 0.00 0.00 0.00 0.72 -0.57 0.00 0.00 175.07 175.22 1a8e s PHE 94 N -3.68 0.02 0.27 4.78 -0.71 -1.26 -2.38 117.98 115.02 1a8e s PHE 94 Ca 0.62 -0.49 -0.10 0.00 -1.04 0.00 0.00 56.93 55.92 1a8e s PHE 94 Cb 0.49 0.60 -0.00 0.00 -1.21 0.00 0.00 43.02 42.90 1a8e s PHE 94 CO 0.02 -1.25 0.47 1.52 -1.34 0.00 0.00 175.22 174.64 1a8e s TYR 95 N -3.62 0.56 -0.18 3.49 1.13 0.37 -4.83 117.35 114.28 1a8e s TYR 95 Ca 0.15 -0.90 -0.08 0.00 -1.41 0.00 0.00 57.07 54.83 1a8e s TYR 95 Cb -0.05 0.11 -0.04 0.00 -1.10 0.00 0.00 41.96 40.88 1a8e s TYR 95 CO 0.09 -1.03 0.08 0.71 -2.51 0.00 0.00 175.55 172.89 1a8e s TYR 96 N -3.73 3.31 -0.17 -3.49 2.02 -1.26 -0.39 117.35 113.63 1a8e s TYR 96 Ca 0.25 0.17 -0.23 0.00 -0.37 0.00 0.00 57.07 56.88 1a8e s TYR 96 Cb -0.00 -2.07 -0.02 0.00 -0.40 0.00 0.00 41.96 39.46 1a8e s TYR 96 CO 0.12 0.24 0.74 0.00 -1.57 0.00 0.00 175.55 175.08 1a8e s ALA 97 N 0.21 3.50 0.31 3.71 0.00 -0.23 -1.35 121.76 127.92 1a8e s ALA 97 Ca 0.05 -0.07 0.06 0.00 0.00 0.00 0.00 51.96 52.00 1a8e s ALA 97 Cb -0.12 -3.10 -0.06 0.00 0.00 0.00 0.00 23.12 19.84 1a8e s ALA 97 CO -0.00 -0.54 -0.01 0.14 0.00 0.00 0.00 175.76 175.35 1a8e s VAL 98 N 1.89 1.53 -0.25 0.00 -7.23 -0.05 -0.49 120.40 115.79 1a8e s VAL 98 Ca 0.35 -2.06 0.02 0.00 -1.81 0.00 0.00 61.98 58.47 1a8e s VAL 98 Cb -0.16 -2.65 0.06 0.00 0.56 0.00 0.00 36.38 34.19 1a8e s VAL 98 CO 0.12 -0.15 -0.08 0.00 -0.31 0.00 0.00 175.10 174.68 1a8e s ALA 99 N -3.07 2.33 -0.08 1.32 0.00 -1.26 -2.33 121.76 118.66 1a8e s ALA 99 Ca 0.33 -1.64 -0.11 0.00 0.00 0.00 0.00 51.96 50.54 1a8e s ALA 99 Cb 0.06 -1.54 -0.05 0.00 0.00 0.00 0.00 23.12 21.59 1a8e s ALA 99 CO 0.14 -1.22 0.26 0.08 0.00 0.00 0.00 175.76 175.01 1a8e s VAL 100 N 1.22 5.31 0.20 0.00 1.01 -0.24 -1.56 120.40 126.33 1a8e s VAL 100 Ca -0.07 0.48 -0.03 0.00 0.00 0.00 0.00 61.98 62.37 1a8e s VAL 100 Cb -0.19 -3.54 -0.03 0.00 0.00 0.00 0.00 36.38 32.61 1a8e s VAL 100 CO -0.06 0.57 0.18 0.68 0.00 0.00 0.00 175.10 176.47 1a8e s VAL 101 N -0.82 0.01 0.30 2.92 -7.23 -0.15 -1.15 120.40 114.29 1a8e s VAL 101 Ca 0.18 -1.89 -0.12 0.00 -1.81 0.00 0.00 61.98 58.34 1a8e s VAL 101 Cb -0.14 -2.40 -0.08 0.00 0.56 0.00 0.00 36.38 34.32 1a8e s VAL 101 CO 0.07 -0.05 0.68 -0.54 -0.31 0.00 0.00 175.10 174.95 1a8e s LYS 102 N -4.12 3.90 0.27 4.82 1.02 -1.26 -1.12 119.74 123.24 1a8e s LYS 102 Ca 0.35 0.50 -0.30 0.00 0.02 0.00 0.00 55.97 56.53 1a8e s LYS 102 Cb 0.06 -2.50 -0.12 0.00 -0.52 0.00 0.00 37.83 34.75 1a8e s LYS 102 CO 0.10 0.18 1.59 1.17 -0.92 0.00 0.00 175.35 177.47 1a8e n LYS 103 N -0.45 2.62 -2.01 1.68 4.81 0.12 -2.76 118.16 122.17 1a8e n LYS 103 Ca 0.02 0.93 -0.18 0.00 -0.87 0.00 0.00 58.31 58.22 1a8e n LYS 103 Cb 0.53 -2.71 -0.04 0.00 0.02 0.00 0.00 35.03 32.83 1a8e n LYS 103 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1a8e n ASP 104 N 2.39 -5.17 0.06 3.14 8.00 -1.26 -4.85 116.55 118.86 1a8e n ASP 104 Ca 0.10 0.16 0.13 0.00 0.71 0.00 0.00 54.79 55.89 1a8e n ASP 104 Cb 0.36 -4.24 0.49 0.00 -0.02 0.00 0.00 41.12 37.71 1a8e n ASP 104 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1a8e n SER 105 N -1.19 0.44 -2.67 -2.24 3.41 -1.11 -4.96 113.62 105.30 1a8e n SER 105 Ca -0.20 0.55 -0.11 0.00 -0.26 0.00 0.00 58.87 58.85 1a8e n SER 105 Cb 0.63 -0.66 0.05 0.00 -0.26 0.00 0.00 64.21 63.97 1a8e n SER 105 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1a8e n GLY 106 N 1.21 -0.30 3.48 5.00 0.00 -1.26 -5.06 105.19 108.25 1a8e n GLY 106 Ca 0.06 0.11 -0.17 0.00 0.00 0.00 0.00 46.02 46.03 1a8e n GLY 106 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1a8e s PHE 107 N -3.25 -0.59 0.57 1.61 -0.71 -1.26 -5.13 117.98 109.21 1a8e s PHE 107 Ca 0.16 1.08 0.07 0.00 -1.04 0.00 0.00 56.93 57.20 1a8e s PHE 107 Cb -0.02 0.33 0.06 0.00 -1.21 0.00 0.00 43.02 42.18 1a8e s PHE 107 CO 0.50 -0.53 0.56 -0.65 -1.34 0.00 0.00 175.22 173.76 1a8e s GLN 108 N -0.97 2.25 0.58 1.99 -1.52 -1.26 -4.98 119.66 115.74 1a8e s GLN 108 Ca -0.10 -1.92 0.28 0.00 -1.95 0.00 0.00 55.36 51.68 1a8e s GLN 108 Cb -0.02 -2.29 1.76 0.00 -0.22 0.00 0.00 33.01 32.24 1a8e s GLN 108 CO 0.08 -0.75 2.24 1.98 -0.25 0.00 0.00 175.29 178.58 1a8e h MET 109 N 0.50 0.00 -0.17 2.91 4.05 -1.89 0.79 114.93 121.11 1a8e h MET 109 Ca -0.34 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.08 1a8e h MET 109 Cb 1.30 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.10 1a8e h MET 109 CO 0.51 0.01 0.00 0.27 0.23 0.00 0.00 176.91 177.92 1a8e n ASN 110 N -3.90 1.51 -1.54 1.39 6.94 -1.26 -3.75 115.26 114.64 1a8e n ASN 110 Ca -0.03 -1.72 -0.07 0.00 -0.02 0.00 0.00 54.58 52.74 1a8e n ASN 110 Cb 0.09 -0.11 0.09 0.00 -2.36 0.00 0.00 39.78 37.49 1a8e n ASN 110 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1a8e n GLN 111 N 0.23 2.26 0.13 -3.83 6.02 0.27 -4.80 117.38 117.65 1a8e n GLN 111 Ca 0.15 -3.54 0.03 0.00 -0.01 0.00 0.00 57.00 53.63 1a8e n GLN 111 Cb 0.29 -1.71 0.02 0.00 1.02 0.00 0.00 30.24 29.86 1a8e n GLN 111 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 1a8e h LEU 112 N 1.67 0.00 -9.36 1.08 3.38 -1.65 -3.45 115.31 106.99 1a8e h LEU 112 Ca 0.11 0.00 -0.63 0.00 0.09 0.00 0.00 57.88 57.45 1a8e h LEU 112 Cb 1.35 0.00 0.04 0.00 0.09 0.00 0.00 40.66 42.14 1a8e h LEU 112 CO 0.34 0.49 0.80 -1.14 0.09 0.00 0.00 178.44 179.01 1a8e n ARG 113 N -3.18 1.80 -0.34 1.13 0.63 -1.26 -0.99 116.66 114.45 1a8e n ARG 113 Ca 0.01 0.65 0.00 0.00 -0.92 0.00 0.00 57.85 57.59 1a8e n ARG 113 Cb 0.74 -2.40 0.00 0.00 0.45 0.00 0.00 32.46 31.25 1a8e n ARG 113 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1a8e n GLY 114 N 3.51 1.23 3.95 5.14 0.00 0.83 -4.98 105.19 114.86 1a8e n GLY 114 Ca 0.20 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.97 1a8e n GLY 114 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1a8e s LYS 115 N -0.40 2.03 -0.16 1.61 -0.14 -0.16 -3.78 119.74 118.73 1a8e s LYS 115 Ca 0.00 -0.51 -0.06 0.00 -1.36 0.00 0.00 55.97 54.04 1a8e s LYS 115 Cb 0.00 -2.23 -0.04 0.00 -1.68 0.00 0.00 37.83 33.89 1a8e s LYS 115 CO 0.00 -1.29 0.04 0.15 -0.76 0.00 0.00 175.35 173.49 1a8e s LYS 116 N -5.20 3.74 0.00 1.68 1.02 -1.26 -0.61 119.74 119.11 1a8e s LYS 116 Ca 0.62 -0.37 0.04 0.00 0.02 0.00 0.00 55.97 56.28 1a8e s LYS 116 Cb -0.09 -3.09 -0.03 0.00 -0.52 0.00 0.00 37.83 34.10 1a8e s LYS 116 CO 0.44 0.36 -0.11 -1.54 -0.92 0.00 0.00 175.35 173.58 1a8e s SER 117 N 0.09 4.29 -0.21 2.83 1.04 -1.00 0.51 113.70 121.25 1a8e s SER 117 Ca 0.04 -0.23 -0.01 0.00 0.48 0.00 0.00 55.95 56.23 1a8e s SER 117 Cb -0.12 -0.91 0.01 0.00 0.10 0.00 0.00 66.02 65.09 1a8e s SER 117 CO 0.01 0.29 -0.11 0.00 0.98 0.00 0.00 173.24 174.41 1a8e s HIS 119 N 1.37 2.73 0.19 0.00 3.76 -0.55 -1.10 115.29 121.70 1a8e s HIS 119 Ca 0.04 -0.17 -0.04 0.00 -0.15 0.00 0.00 55.06 54.74 1a8e s HIS 119 Cb -0.14 -1.40 0.13 0.00 1.11 0.00 0.00 32.58 32.28 1a8e s HIS 119 CO -0.07 0.45 1.54 1.79 -0.85 0.00 0.00 174.74 177.60 1a8e h THR 120 N 3.07 1.30 0.00 1.30 1.35 -1.73 -3.40 112.91 114.80 1a8e h THR 120 Ca -0.48 -1.64 0.00 0.00 -0.55 0.00 0.00 66.41 63.74 1a8e h THR 120 Cb 1.18 1.58 0.00 0.00 -1.73 0.00 0.00 68.15 69.18 1a8e h THR 120 CO 0.53 0.52 0.00 0.61 -0.25 0.00 0.00 175.52 176.93 1a8e n GLY 121 N 0.10 2.58 3.70 5.82 0.00 -1.26 -1.38 105.19 114.75 1a8e n GLY 121 Ca -0.02 -0.39 -0.44 0.00 0.00 0.00 0.00 46.02 45.17 1a8e n GLY 121 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1a8e n LEU 122 N 0.00 3.59 0.00 0.99 7.94 0.49 -2.49 117.00 127.52 1a8e n LEU 122 Ca 0.00 1.11 0.00 0.00 -1.11 0.00 0.00 56.01 56.01 1a8e n LEU 122 Cb 0.00 -1.50 0.00 0.00 0.53 0.00 0.00 43.42 42.45 1a8e n LEU 122 CO 0.00 -0.13 0.00 0.61 -1.11 0.00 0.00 177.39 176.76 1a8e n GLY 123 N 2.95 1.26 3.84 -3.96 0.00 -1.26 -4.99 105.19 103.03 1a8e n GLY 123 Ca 0.13 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.82 1a8e n GLY 123 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1a8e s ARG 124 N -0.04 4.09 0.01 1.61 0.52 -1.04 -3.76 118.95 120.34 1a8e s ARG 124 Ca 0.00 0.79 -0.03 0.00 -0.52 0.00 0.00 55.73 55.97 1a8e s ARG 124 Cb 0.00 -2.48 -0.01 0.00 0.52 0.00 0.00 34.95 32.98 1a8e s ARG 124 CO 0.00 0.17 1.04 0.77 0.02 0.00 0.00 175.30 177.30 1a8e h SER 125 N 2.41 -0.12 -0.22 0.23 0.02 -1.92 0.31 113.55 114.26 1a8e h SER 125 Ca -0.48 0.01 -0.20 0.00 -0.84 0.00 0.00 61.79 60.29 1a8e h SER 125 Cb 1.18 0.05 0.01 0.00 0.14 0.00 0.00 62.40 63.77 1a8e h SER 125 CO 0.65 -0.04 -0.63 0.00 -1.14 0.00 0.00 176.83 175.66 1a8e h ALA 126 N -1.43 0.37 0.00 3.77 0.00 -1.91 -0.54 119.26 119.52 1a8e h ALA 126 Ca 0.00 -0.55 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1a8e h ALA 126 Cb 0.05 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1a8e h ALA 126 CO -0.03 0.65 0.00 0.78 0.00 0.00 0.00 179.25 180.65 1a8e h GLY 127 N 0.57 0.00 0.00 0.00 0.00 -1.64 -3.40 103.07 98.60 1a8e h GLY 127 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.31 1a8e h GLY 127 CO 0.14 0.00 0.00 1.87 0.00 0.00 0.00 176.54 178.55 1a8e n TRP 128 N -2.85 -1.98 -0.14 5.60 -0.00 -0.18 -4.18 117.44 113.71 1a8e n TRP 128 Ca 0.04 0.38 -0.03 0.00 -0.00 0.00 0.00 57.50 57.88 1a8e n TRP 128 Cb 0.44 0.73 0.05 0.00 -0.00 0.00 0.00 31.31 32.53 1a8e n TRP 128 CO 0.00 0.00 0.00 -0.91 -0.00 0.00 0.00 177.69 176.78 1a8e h ASN 129 N 0.00 -0.14 0.27 5.87 2.35 -0.88 -1.24 115.58 121.81 1a8e h ASN 129 Ca 0.00 0.10 -0.01 0.00 -0.55 0.00 0.00 56.30 55.84 1a8e h ASN 129 Cb 0.00 0.17 0.00 0.00 0.05 0.00 0.00 38.32 38.54 1a8e h ASN 129 CO 0.00 -0.04 -0.13 0.40 -1.65 0.00 0.00 177.43 176.01 1a8e h ILE 130 N 0.14 0.73 -0.53 2.81 1.08 -1.33 -0.87 117.51 119.54 1a8e h ILE 130 Ca 0.23 -0.71 -0.08 0.00 -0.39 0.00 0.00 64.86 63.91 1a8e h ILE 130 Cb 0.33 1.09 -0.02 0.00 -3.07 0.00 0.00 36.82 35.15 1a8e h ILE 130 CO -0.36 0.14 0.01 1.55 -0.69 0.00 0.00 178.15 178.80 1a8e h PRO 131 N -0.77 0.93 -0.14 2.37 0.13 -1.77 -0.19 132.00 132.56 1a8e h PRO 131 Ca -0.04 -0.29 -0.12 0.00 -0.87 0.00 0.00 66.00 64.68 1a8e h PRO 131 Cb 0.50 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 31.54 1a8e h PRO 131 CO 0.06 0.94 -0.45 0.82 -0.23 0.00 0.00 178.00 179.14 1a8e h ILE 132 N 0.80 1.32 -0.69 -3.56 1.08 -1.33 -0.70 117.51 114.43 1a8e h ILE 132 Ca 0.15 -1.63 -0.05 0.00 -0.39 0.00 0.00 64.86 62.94 1a8e h ILE 132 Cb 0.52 1.71 -0.03 0.00 -3.07 0.00 0.00 36.82 35.95 1a8e h ILE 132 CO 0.03 0.49 0.23 1.23 -0.69 0.00 0.00 178.15 179.44 1a8e h GLY 133 N 1.22 1.13 2.00 5.37 0.00 -0.82 -0.71 103.07 111.27 1a8e h GLY 133 Ca 0.02 -0.64 -0.10 0.00 0.00 0.00 0.00 47.33 46.60 1a8e h GLY 133 CO 0.07 0.60 -0.50 1.41 0.00 0.00 0.00 176.54 178.13 1a8e h LEU 134 N 1.02 0.00 -0.24 3.11 3.38 -0.31 -3.23 115.31 119.03 1a8e h LEU 134 Ca 0.23 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.20 1a8e h LEU 134 Cb 0.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.02 1a8e h LEU 134 CO -0.01 0.50 -0.65 0.18 0.09 0.00 0.00 178.44 178.54 1a8e n LEU 135 N -3.51 1.03 -0.31 1.67 4.77 -0.34 -4.69 117.00 115.63 1a8e n LEU 135 Ca 0.00 -0.36 0.13 0.00 -0.03 0.00 0.00 56.01 55.75 1a8e n LEU 135 Cb 0.61 -0.09 0.25 0.00 -2.33 0.00 0.00 43.42 41.86 1a8e n LEU 135 CO 0.39 0.23 0.70 0.00 -1.33 0.00 0.00 177.39 177.38 1a8e n TYR 136 N -1.12 0.55 0.84 -1.77 9.36 -0.32 -0.06 117.16 124.64 1a8e n TYR 136 Ca 0.07 1.08 0.13 0.00 3.32 0.00 0.00 57.90 62.50 1a8e n TYR 136 Cb 0.36 -1.16 0.45 0.00 -0.63 0.00 0.00 39.34 38.36 1a8e n TYR 136 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1a8e n ASP 138 N -1.81 0.32 -4.80 0.00 9.92 0.91 -4.77 116.55 116.32 1a8e n ASP 138 Ca 0.06 0.38 -0.34 0.00 -0.53 0.00 0.00 54.79 54.36 1a8e n ASP 138 Cb 0.38 -0.41 -0.03 0.00 -0.64 0.00 0.00 41.12 40.42 1a8e n ASP 138 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 1a8e s LEU 139 N -3.45 3.77 0.39 0.64 1.43 -1.02 -5.02 118.68 115.41 1a8e s LEU 139 Ca 0.12 1.86 -0.14 0.00 -1.03 0.00 0.00 54.13 54.95 1a8e s LEU 139 Cb 0.17 -4.55 -0.08 0.00 0.03 0.00 0.00 46.19 41.76 1a8e s LEU 139 CO 0.58 -0.81 0.80 -2.16 0.23 0.00 0.00 176.35 174.99 1a8e s PRO 140 N -3.45 3.93 0.30 1.29 0.04 -1.26 -4.97 135.00 130.87 1a8e s PRO 140 Ca 0.66 0.66 -0.17 0.00 0.04 0.00 0.00 61.00 62.19 1a8e s PRO 140 Cb -0.15 -2.36 -0.09 0.00 0.04 0.00 0.00 34.50 31.94 1a8e s PRO 140 CO 0.23 0.01 0.75 -1.21 0.04 0.00 0.00 177.00 176.82 1a8e s GLU 141 N -3.48 4.09 0.21 4.56 2.02 -1.26 -3.59 118.70 121.25 1a8e s GLU 141 Ca 0.54 0.75 -0.24 0.00 0.02 0.00 0.00 54.97 56.04 1a8e s GLU 141 Cb -0.10 -2.54 -0.08 0.00 0.10 0.00 0.00 34.13 31.51 1a8e s GLU 141 CO 0.24 0.21 0.80 -1.25 0.02 0.00 0.00 175.26 175.28 1a8e s PRO 142 N -2.73 4.51 0.00 0.39 0.04 -1.26 -5.09 135.00 130.86 1a8e s PRO 142 Ca 0.52 1.14 0.18 0.00 0.04 0.00 0.00 61.00 62.88 1a8e s PRO 142 Cb -0.12 -3.09 0.70 0.00 0.04 0.00 0.00 34.50 32.03 1a8e s PRO 142 CO 0.18 0.48 1.50 0.54 0.04 0.00 0.00 177.00 179.74 1a8e n ARG 143 N 1.19 1.63 -4.59 4.56 1.74 -1.24 -4.37 116.66 115.59 1a8e n ARG 143 Ca -0.03 -0.96 -0.29 0.00 -0.77 0.00 0.00 57.85 55.80 1a8e n ARG 143 Cb 0.49 -1.35 -0.17 0.00 -1.02 0.00 0.00 32.46 30.42 1a8e n ARG 143 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 1a8e s LYS 144 N -1.78 2.32 0.45 5.56 2.20 -1.26 -2.39 119.74 124.84 1a8e s LYS 144 Ca 0.29 -0.61 -0.15 0.00 -0.36 0.00 0.00 55.97 55.15 1a8e s LYS 144 Cb 0.15 -1.92 -0.08 0.00 -1.51 0.00 0.00 37.83 34.48 1a8e s LYS 144 CO 0.23 -0.02 0.89 -1.25 -0.36 0.00 0.00 175.35 174.84 1a8e s PRO 145 N 0.85 3.93 0.24 4.03 0.04 -1.26 -4.95 135.00 137.88 1a8e s PRO 145 Ca -0.09 0.79 -0.05 0.00 0.04 0.00 0.00 61.00 61.69 1a8e s PRO 145 Cb -0.15 -2.25 0.45 0.00 0.04 0.00 0.00 34.50 32.59 1a8e s PRO 145 CO 0.00 -0.13 1.71 1.25 0.04 0.00 0.00 177.00 179.88 1a8e h LEU 146 N 1.27 0.15 -1.09 -3.56 5.85 -1.84 -1.31 115.31 114.79 1a8e h LEU 146 Ca -0.47 0.12 0.14 0.00 0.84 0.00 0.00 57.88 58.51 1a8e h LEU 146 Cb 1.18 0.14 -0.08 0.00 0.37 0.00 0.00 40.66 42.27 1a8e h LEU 146 CO 0.63 0.04 0.62 -0.33 -0.34 0.00 0.00 178.44 179.05 1a8e h GLU 147 N 0.36 0.85 -0.14 1.25 3.07 -1.98 -0.48 114.58 117.50 1a8e h GLU 147 Ca 0.41 -0.05 -0.21 0.00 -0.50 0.00 0.00 59.36 59.01 1a8e h GLU 147 Cb 0.66 -0.19 0.01 0.00 -0.84 0.00 0.00 28.75 28.38 1a8e h GLU 147 CO -0.45 0.56 -0.75 -0.22 -1.40 0.00 0.00 179.01 176.75 1a8e h LYS 148 N 0.87 0.69 -0.27 2.33 3.11 -1.61 -1.13 116.57 120.56 1a8e h LYS 148 Ca 0.50 -0.56 -0.12 0.00 -2.81 0.00 0.00 60.65 57.66 1a8e h LYS 148 Cb 0.63 0.11 -0.01 0.00 -1.00 0.00 0.00 32.23 31.96 1a8e h LYS 148 CO -0.27 1.17 -0.34 0.00 -2.81 0.00 0.00 179.45 177.20 1a8e h ALA 149 N 0.67 0.91 -0.35 5.00 0.00 -0.94 -1.63 119.26 122.91 1a8e h ALA 149 Ca -0.04 -0.41 -0.12 0.00 0.00 0.00 0.00 54.91 54.34 1a8e h ALA 149 Cb 1.37 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 1a8e h ALA 149 CO 0.15 0.62 -0.23 0.28 0.00 0.00 0.00 179.25 180.07 1a8e h VAL 150 N 0.49 1.29 0.00 0.00 2.07 -1.08 -1.24 116.25 117.77 1a8e h VAL 150 Ca 0.05 -1.38 -0.03 0.00 0.82 0.00 0.00 66.70 66.17 1a8e h VAL 150 Cb 0.83 1.41 -0.00 0.00 -1.52 0.00 0.00 31.29 32.00 1a8e h VAL 150 CO 0.07 0.45 -0.12 0.00 0.02 0.00 0.00 177.57 177.99 1a8e h ALA 151 N 0.77 1.70 0.00 1.67 0.00 -1.00 -1.96 119.26 120.45 1a8e h ALA 151 Ca 0.07 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1a8e h ALA 151 Cb 0.79 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1a8e h ALA 151 CO 0.06 0.16 -0.72 -0.91 0.00 0.00 0.00 179.25 177.84 1a8e h ASN 152 N 0.00 0.00 0.03 0.00 2.35 -0.82 -3.38 115.58 113.77 1a8e h ASN 152 Ca -0.00 -0.14 -0.06 0.00 -0.55 0.00 0.00 56.30 55.55 1a8e h ASN 152 Cb 0.23 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.61 1a8e h ASN 152 CO 0.02 0.07 -0.30 0.15 -1.65 0.00 0.00 177.43 175.71 1a8e h PHE 153 N 0.00 0.13 -3.43 1.19 3.57 -0.47 -3.46 116.94 114.47 1a8e h PHE 153 Ca 0.00 -0.10 -0.47 0.00 3.53 0.00 0.00 57.97 60.93 1a8e h PHE 153 Cb 0.84 -0.01 0.05 0.00 2.79 0.00 0.00 35.95 39.62 1a8e h PHE 153 CO 0.00 1.12 0.11 -0.06 -2.23 0.00 0.00 178.31 177.25 1a8e s PHE 154 N -2.28 3.23 -0.59 0.41 0.08 -1.04 -0.12 117.98 117.66 1a8e s PHE 154 Ca -0.18 0.53 0.00 0.00 0.12 0.00 0.00 56.93 57.40 1a8e s PHE 154 Cb -0.01 -2.66 0.50 0.00 -0.57 0.00 0.00 43.02 40.27 1a8e s PHE 154 CO 0.72 -0.74 1.94 -1.13 -0.10 0.00 0.00 175.22 175.91 1a8e n SER 155 N -2.48 6.56 0.00 1.36 3.41 0.22 -4.72 113.62 117.97 1a8e n SER 155 Ca 0.04 -3.75 0.00 0.00 -0.26 0.00 0.00 58.87 54.90 1a8e n SER 155 Cb 0.58 -0.90 0.00 0.00 -0.26 0.00 0.00 64.21 63.63 1a8e n SER 155 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1a8e n GLY 156 N -0.96 4.25 3.41 5.00 0.00 -1.26 -4.83 105.19 110.79 1a8e n GLY 156 Ca 0.60 -1.25 -0.15 0.00 0.00 0.00 0.00 46.02 45.23 1a8e n GLY 156 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1a8e s SER 157 N 0.00 0.87 -0.25 1.61 0.01 0.05 -2.37 113.70 113.62 1a8e s SER 157 Ca 0.00 -1.47 0.00 0.00 1.31 0.00 0.00 55.95 55.79 1a8e s SER 157 Cb 0.00 0.58 0.07 0.00 0.21 0.00 0.00 66.02 66.88 1a8e s SER 157 CO 0.00 -1.15 -0.01 0.00 0.41 0.00 0.00 173.24 172.49 1a8e s ALA 159 N 1.46 2.47 0.40 0.00 0.00 -0.07 -1.48 121.76 124.55 1a8e s ALA 159 Ca -0.01 -2.78 -0.26 0.00 0.00 0.00 0.00 51.96 48.90 1a8e s ALA 159 Cb -0.18 -1.96 -0.10 0.00 0.00 0.00 0.00 23.12 20.87 1a8e s ALA 159 CO -0.09 -2.05 1.30 -2.30 0.00 0.00 0.00 175.76 172.61 1a8e n PRO 160 N 3.42 2.04 -0.43 0.00 -0.02 -1.26 -2.09 135.00 136.66 1a8e n PRO 160 Ca 0.08 0.72 0.00 0.00 -2.02 0.00 0.00 63.50 62.28 1a8e n PRO 160 Cb 0.34 -2.40 0.00 0.00 -0.02 0.00 0.00 33.50 31.42 1a8e n PRO 160 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1a8e s ALA 162 N -3.28 2.98 -0.56 0.00 0.00 -0.89 -4.91 121.76 115.10 1a8e s ALA 162 Ca 0.00 -0.12 -0.25 0.00 0.00 0.00 0.00 51.96 51.59 1a8e s ALA 162 Cb 0.00 -3.08 0.04 0.00 0.00 0.00 0.00 23.12 20.07 1a8e s ALA 162 CO 0.00 -0.87 1.01 0.34 0.00 0.00 0.00 175.76 176.24 1a8e s ASP 163 N -4.16 6.37 0.50 0.00 -1.08 -1.26 -4.75 116.67 112.29 1a8e s ASP 163 Ca 0.56 -0.22 0.29 0.00 -0.52 0.00 0.00 52.55 52.67 1a8e s ASP 163 Cb -0.11 -2.47 1.10 0.00 -1.46 0.00 0.00 42.92 39.98 1a8e s ASP 163 CO 0.54 -1.30 1.89 1.23 0.52 0.00 0.00 175.17 178.05 1a8e h GLY 164 N 11.25 0.00 0.49 2.66 0.00 -1.84 0.48 103.07 116.10 1a8e h GLY 164 Ca -0.26 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.07 1a8e h GLY 164 CO 1.12 0.00 -0.00 -0.84 0.00 0.00 0.00 176.54 176.81 1a8e h THR 165 N 0.00 1.39 0.05 4.70 2.02 -1.95 -2.43 112.91 116.68 1a8e h THR 165 Ca -0.00 -1.19 -0.25 0.00 0.77 0.00 0.00 66.41 65.73 1a8e h THR 165 Cb 0.65 2.19 0.01 0.00 -1.74 0.00 0.00 68.15 69.26 1a8e h THR 165 CO 0.01 0.31 -1.07 0.44 0.37 0.00 0.00 175.52 175.58 1a8e h ASP 166 N -0.52 0.59 -2.39 4.18 5.19 -1.93 -3.39 116.42 118.14 1a8e h ASP 166 Ca -0.00 -0.51 -0.59 0.00 -0.62 0.00 0.00 57.03 55.30 1a8e h ASP 166 Cb 0.51 -0.18 -0.40 0.00 0.18 0.00 0.00 39.33 39.44 1a8e h ASP 166 CO 0.00 1.34 -0.83 0.49 -3.12 0.00 0.00 179.24 177.12 1a8e n PHE 167 N -3.71 1.24 -0.11 4.55 3.72 0.17 -4.98 117.46 118.34 1a8e n PHE 167 Ca -0.08 -3.80 0.15 0.00 -0.05 0.00 0.00 57.45 53.66 1a8e n PHE 167 Cb 0.91 -0.29 0.53 0.00 -0.94 0.00 0.00 39.48 39.68 1a8e n PHE 167 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1a8e h PRO 168 N 4.80 0.35 0.00 -1.08 0.13 -1.63 -2.06 132.00 132.50 1a8e h PRO 168 Ca 0.17 -0.02 -0.03 0.00 -0.87 0.00 0.00 66.00 65.25 1a8e h PRO 168 Cb 0.81 -0.08 -0.00 0.00 0.13 0.00 0.00 31.00 31.86 1a8e h PRO 168 CO 0.58 0.23 -0.13 1.96 -0.23 0.00 0.00 178.00 180.42 1a8e h GLN 169 N 0.36 0.00 0.00 0.86 7.50 -1.92 -1.75 115.11 120.15 1a8e h GLN 169 Ca 0.32 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.47 1a8e h GLN 169 Cb 0.74 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.27 1a8e h GLN 169 CO -0.09 0.13 0.00 1.28 -1.50 0.00 0.00 178.83 178.65 1a8e n LEU 170 N -3.53 0.60 -0.08 1.46 4.77 -0.78 -0.77 117.00 118.67 1a8e n LEU 170 Ca -0.01 0.63 0.08 0.00 -0.03 0.00 0.00 56.01 56.67 1a8e n LEU 170 Cb 0.27 -0.52 0.11 0.00 -2.33 0.00 0.00 43.42 40.94 1a8e n LEU 170 CO 0.30 -0.45 0.53 0.00 -1.33 0.00 0.00 177.39 176.44 1a8e h GLN 172 N 0.00 0.25 0.00 0.00 4.15 -1.01 -1.10 115.11 117.40 1a8e h GLN 172 Ca 0.00 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.38 1a8e h GLN 172 Cb 0.94 -0.04 0.00 0.00 0.21 0.00 0.00 27.48 28.58 1a8e h GLN 172 CO 0.00 0.31 -0.72 1.28 -1.93 0.00 0.00 178.83 177.77 1a8e n LEU 173 N -4.36 0.63 -3.06 -2.39 4.32 -0.28 -4.48 117.00 107.39 1a8e n LEU 173 Ca -0.00 -0.07 -0.16 0.00 -0.02 0.00 0.00 56.01 55.75 1a8e n LEU 173 Cb 0.20 -0.16 -0.04 0.00 -1.62 0.00 0.00 43.42 41.80 1a8e n LEU 173 CO 0.37 0.11 -0.10 0.00 -1.22 0.00 0.00 177.39 176.55 1a8e n PRO 175 N 2.39 0.65 0.00 0.00 -0.02 -0.47 -1.07 135.00 136.48 1a8e n PRO 175 Ca 0.21 0.24 0.00 0.00 -2.02 0.00 0.00 63.50 61.93 1a8e n PRO 175 Cb 0.54 -1.84 0.00 0.00 -0.02 0.00 0.00 33.50 32.18 1a8e n PRO 175 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1a8e n GLY 176 N 3.76 2.59 3.76 -1.23 0.00 -1.26 -4.62 105.19 108.19 1a8e n GLY 176 Ca 0.27 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.03 1a8e n GLY 176 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a8e n GLY 178 N -1.69 0.75 2.70 0.00 0.00 -1.26 -0.73 105.19 104.95 1a8e n GLY 178 Ca -0.07 0.54 -0.38 0.00 0.00 0.00 0.00 46.02 46.11 1a8e n GLY 178 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a8e s SER 180 N -1.41 -0.04 0.00 0.00 1.04 -1.26 -4.45 113.70 107.58 1a8e s SER 180 Ca 0.57 -0.65 0.12 0.00 0.48 0.00 0.00 55.95 56.46 1a8e s SER 180 Cb 0.46 0.53 0.63 0.00 0.10 0.00 0.00 66.02 67.74 1a8e s SER 180 CO -0.27 -1.03 1.25 0.35 0.98 0.00 0.00 173.24 174.52 1a8e n THR 181 N -0.63 0.54 0.25 2.02 -2.24 -1.26 -1.58 114.28 111.39 1a8e n THR 181 Ca -0.04 0.14 0.14 0.00 -2.27 0.00 0.00 64.05 62.01 1a8e n THR 181 Cb 0.60 -0.94 0.59 0.00 -2.10 0.00 0.00 70.33 68.47 1a8e n THR 181 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1a8e h LEU 182 N 0.00 0.00 -8.93 3.22 3.38 -1.94 -3.37 115.31 107.68 1a8e h LEU 182 Ca 0.00 0.00 -0.62 0.00 0.09 0.00 0.00 57.88 57.35 1a8e h LEU 182 Cb 0.09 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 40.71 1a8e h LEU 182 CO 0.00 0.10 0.11 0.21 0.09 0.00 0.00 178.44 178.94 1a8e s ASN 183 N -5.93 6.49 0.14 -0.43 2.47 -0.61 -4.93 114.94 112.15 1a8e s ASN 183 Ca 0.01 0.50 0.19 0.00 0.42 0.00 0.00 52.86 53.97 1a8e s ASN 183 Cb 0.10 -2.32 0.81 0.00 -1.45 0.00 0.00 41.25 38.39 1a8e s ASN 183 CO 0.59 -0.41 1.59 0.00 -3.72 0.00 0.00 177.10 175.14 1a8e n GLN 184 N 5.76 0.11 -0.47 0.43 10.64 -1.26 -1.55 117.38 131.04 1a8e n GLN 184 Ca -0.02 0.36 0.08 0.00 -1.83 0.00 0.00 57.00 55.59 1a8e n GLN 184 Cb 0.49 -1.71 0.28 0.00 -0.86 0.00 0.00 30.24 28.44 1a8e n GLN 184 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 1a8e n TYR 185 N -1.91 1.08 -2.92 2.61 4.01 -1.26 -4.38 117.16 114.40 1a8e n TYR 185 Ca 0.03 -0.68 -0.35 0.00 -0.16 0.00 0.00 57.90 56.74 1a8e n TYR 185 Cb 0.19 -0.23 -0.06 0.00 -0.31 0.00 0.00 39.34 38.93 1a8e n TYR 185 CO 0.00 0.00 0.00 0.12 -0.46 0.00 0.00 176.86 176.52 1a8e s PHE 186 N -2.01 3.55 0.01 -0.72 5.36 -0.60 -3.33 117.98 120.24 1a8e s PHE 186 Ca 0.41 1.57 0.00 0.00 -0.96 0.00 0.00 56.93 57.95 1a8e s PHE 186 Cb 0.29 -2.78 0.00 0.00 -0.34 0.00 0.00 43.02 40.19 1a8e s PHE 186 CO 0.17 0.15 0.00 0.41 -1.46 0.00 0.00 175.22 174.49 1a8e n GLY 187 N 0.20 -2.12 0.28 13.12 0.00 -0.48 -2.46 105.19 113.74 1a8e n GLY 187 Ca 0.02 -1.45 -0.15 0.00 0.00 0.00 0.00 46.02 44.44 1a8e n GLY 187 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1a8e h TYR 188 N -0.03 -0.64 0.00 1.61 0.05 -1.93 0.95 116.97 116.99 1a8e h TYR 188 Ca 0.00 -0.01 -0.07 0.00 0.05 0.00 0.00 58.73 58.70 1a8e h TYR 188 Cb 0.03 0.23 -0.01 0.00 1.01 0.00 0.00 36.73 37.98 1a8e h TYR 188 CO 0.00 -0.38 -0.34 0.77 -1.05 0.00 0.00 178.16 177.17 1a8e h SER 189 N -0.62 0.00 0.19 3.88 0.02 -1.94 -1.61 113.55 113.48 1a8e h SER 189 Ca -0.04 0.00 -0.23 0.00 -0.84 0.00 0.00 61.79 60.67 1a8e h SER 189 Cb 0.50 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.05 1a8e h SER 189 CO 0.05 0.34 -0.93 1.23 -1.14 0.00 0.00 176.83 176.38 1a8e h GLY 190 N 1.75 0.58 1.68 -3.77 0.00 -1.32 -0.94 103.07 101.06 1a8e h GLY 190 Ca -0.00 -0.97 -0.12 0.00 0.00 0.00 0.00 47.33 46.23 1a8e h GLY 190 CO 0.04 0.86 -0.44 0.00 0.00 0.00 0.00 176.54 177.00 1a8e h ALA 191 N 0.66 0.98 -0.40 3.60 0.00 -0.48 -1.32 119.26 122.30 1a8e h ALA 191 Ca -0.08 -0.44 -0.15 0.00 0.00 0.00 0.00 54.91 54.24 1a8e h ALA 191 Cb 1.56 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.24 1a8e h ALA 191 CO 0.17 0.63 -0.33 0.35 0.00 0.00 0.00 179.25 180.07 1a8e h PHE 192 N 0.29 1.08 -0.35 0.00 3.57 -1.16 -2.96 116.94 117.42 1a8e h PHE 192 Ca 0.02 -0.30 -0.03 0.00 3.53 0.00 0.00 57.97 61.19 1a8e h PHE 192 Cb 0.89 -0.24 -0.02 0.00 2.79 0.00 0.00 35.95 39.38 1a8e h PHE 192 CO 0.02 1.12 0.10 -0.22 -2.23 0.00 0.00 178.31 177.10 1a8e h LYS 193 N 0.77 0.50 -0.42 1.11 3.64 -0.63 -0.45 116.57 121.08 1a8e h LYS 193 Ca 0.08 -0.07 -0.02 0.00 -1.27 0.00 0.00 60.65 59.36 1a8e h LYS 193 Cb 0.91 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.62 1a8e h LYS 193 CO 0.08 0.45 0.18 0.00 -2.27 0.00 0.00 179.45 177.90 1a8e h LEU 195 N 0.59 -0.02 -1.17 0.00 5.85 -1.20 -1.37 115.31 117.99 1a8e h LEU 195 Ca 0.15 -0.70 0.09 0.00 0.84 0.00 0.00 57.88 58.25 1a8e h LEU 195 Cb 0.10 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.07 1a8e h LEU 195 CO -0.02 0.81 0.58 0.50 -0.34 0.00 0.00 178.44 179.98 1a8e h LYS 196 N -0.96 0.91 0.00 1.25 3.64 -0.91 -0.01 116.57 120.48 1a8e h LYS 196 Ca -0.00 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 1a8e h LYS 196 Cb 0.72 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.34 1a8e h LYS 196 CO 0.00 0.60 0.00 -0.44 -2.27 0.00 0.00 179.45 177.34 1a8e h ASP 197 N 0.93 0.00 0.00 4.20 3.32 -0.78 -3.46 116.42 120.63 1a8e h ASP 197 Ca 0.41 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.46 1a8e h ASP 197 Cb 0.36 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.91 1a8e h ASP 197 CO -0.18 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 177.95 1a8e n GLY 198 N 0.27 0.85 0.18 2.75 0.00 -0.02 -4.96 105.19 104.27 1a8e n GLY 198 Ca 0.02 -0.08 -0.18 0.00 0.00 0.00 0.00 46.02 45.78 1a8e n GLY 198 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a8e h ALA 199 N 0.00 0.17 -1.81 4.61 0.00 -1.47 -3.47 119.26 117.29 1a8e h ALA 199 Ca 0.00 -0.60 -0.61 0.00 0.00 0.00 0.00 54.91 53.70 1a8e h ALA 199 Cb 0.00 0.02 -0.12 0.00 0.00 0.00 0.00 17.79 17.69 1a8e h ALA 199 CO 0.00 0.52 -0.62 0.20 0.00 0.00 0.00 179.25 179.35 1a8e s GLY 200 N -4.11 2.28 -0.04 0.00 0.00 -0.79 -4.94 107.32 99.72 1a8e s GLY 200 Ca -0.12 -2.13 0.20 0.00 0.00 0.00 0.00 44.72 42.68 1a8e s GLY 200 CO 0.87 -2.01 0.48 1.22 0.00 0.00 0.00 173.10 173.66 1a8e n ASP 201 N -0.94 0.20 -3.90 1.64 8.00 0.18 -4.58 116.55 117.16 1a8e n ASP 201 Ca -0.04 0.08 -0.11 0.00 0.71 0.00 0.00 54.79 55.43 1a8e n ASP 201 Cb 0.64 1.33 -0.12 0.00 -0.02 0.00 0.00 41.12 42.95 1a8e n ASP 201 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1a8e s VAL 202 N -3.15 0.05 -0.12 2.53 0.11 -1.00 -4.35 120.40 114.47 1a8e s VAL 202 Ca -0.07 -0.40 0.02 0.00 -2.93 0.00 0.00 61.98 58.60 1a8e s VAL 202 Cb 0.11 -0.19 0.01 0.00 -1.53 0.00 0.00 36.38 34.78 1a8e s VAL 202 CO 0.86 -0.22 -0.17 0.00 -3.33 0.00 0.00 175.10 172.24 1a8e s ALA 203 N -0.67 1.83 -0.63 1.54 0.00 -0.30 -0.59 121.76 122.95 1a8e s ALA 203 Ca -0.07 -0.82 -0.18 0.00 0.00 0.00 0.00 51.96 50.88 1a8e s ALA 203 Cb -0.05 -0.87 0.12 0.00 0.00 0.00 0.00 23.12 22.32 1a8e s ALA 203 CO -0.00 -0.05 0.72 -0.06 0.00 0.00 0.00 175.76 176.36 1a8e s PHE 204 N 0.93 3.09 0.00 0.00 0.08 -0.25 -1.08 117.98 120.74 1a8e s PHE 204 Ca -0.07 -1.11 0.00 0.00 0.12 0.00 0.00 56.93 55.87 1a8e s PHE 204 Cb -0.15 -4.00 0.00 0.00 -0.57 0.00 0.00 43.02 38.30 1a8e s PHE 204 CO -0.01 -1.26 0.00 1.33 -0.10 0.00 0.00 175.22 175.18 1a8e n VAL 205 N 5.39 0.00 -3.68 -0.44 0.24 -0.99 -3.71 118.33 115.15 1a8e n VAL 205 Ca -0.06 0.00 -0.21 0.00 -2.04 0.00 0.00 64.34 62.03 1a8e n VAL 205 Cb 0.43 0.00 -0.03 0.00 -1.47 0.00 0.00 33.84 32.77 1a8e n VAL 205 CO 0.00 0.00 0.00 -1.59 -2.14 0.00 0.00 176.83 173.10 1a8e s LYS 206 N 0.17 2.67 0.54 7.34 -2.85 -1.26 -0.88 119.74 125.48 1a8e s LYS 206 Ca 0.00 -1.37 0.22 0.00 -1.00 0.00 0.00 55.97 53.83 1a8e s LYS 206 Cb 0.00 -2.47 1.47 0.00 -2.06 0.00 0.00 37.83 34.77 1a8e s LYS 206 CO 0.00 -0.02 2.16 1.12 0.10 0.00 0.00 175.35 178.71 1a8e h HIS 207 N 1.13 0.00 0.00 1.78 2.07 -1.57 -2.27 115.15 116.29 1a8e h HIS 207 Ca -0.43 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.09 1a8e h HIS 207 Cb 1.26 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.24 1a8e h HIS 207 CO 0.52 0.04 -0.51 -1.13 -3.07 0.00 0.00 177.93 173.77 1a8e n SER 208 N -4.14 0.66 -0.20 3.10 3.41 -1.26 -4.45 113.62 110.74 1a8e n SER 208 Ca -0.03 0.15 0.01 0.00 -0.26 0.00 0.00 58.87 58.74 1a8e n SER 208 Cb 0.12 0.03 0.09 0.00 -0.26 0.00 0.00 64.21 64.19 1a8e n SER 208 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 1a8e h THR 209 N 0.00 0.45 -0.25 6.66 2.02 -1.81 -1.53 112.91 118.45 1a8e h THR 209 Ca 0.00 -0.03 -0.07 0.00 0.77 0.00 0.00 66.41 67.08 1a8e h THR 209 Cb 0.71 0.37 -0.01 0.00 -1.74 0.00 0.00 68.15 67.47 1a8e h THR 209 CO 0.00 0.01 -0.15 -0.29 0.37 0.00 0.00 175.52 175.46 1a8e h ILE 210 N 0.08 1.23 0.00 3.11 2.10 -1.79 -1.98 117.51 120.26 1a8e h ILE 210 Ca 0.32 -1.02 -0.07 0.00 1.08 0.00 0.00 64.86 65.17 1a8e h ILE 210 Cb 0.51 1.21 -0.01 0.00 -1.09 0.00 0.00 36.82 37.43 1a8e h ILE 210 CO -0.56 0.33 -0.34 -0.26 -1.08 0.00 0.00 178.15 176.24 1a8e h PHE 211 N 0.39 0.00 0.00 2.19 0.04 -1.58 0.38 116.94 118.37 1a8e h PHE 211 Ca 0.07 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.84 1a8e h PHE 211 Cb 0.50 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.65 1a8e h PHE 211 CO 0.01 0.34 -0.01 0.93 -0.60 0.00 0.00 178.31 178.98 1a8e h GLU 212 N 0.00 0.00 0.00 1.51 5.08 -0.60 -3.36 114.58 117.21 1a8e h GLU 212 Ca -0.00 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.17 1a8e h GLU 212 Cb 0.92 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.13 1a8e h GLU 212 CO 0.04 0.00 -1.73 0.09 -1.00 0.00 0.00 179.01 176.42 1a8e n ASN 213 N -2.63 2.34 -4.06 1.42 3.02 -0.66 -4.93 115.26 109.76 1a8e n ASN 213 Ca 0.05 0.00 -0.32 0.00 -0.03 0.00 0.00 54.58 54.28 1a8e n ASN 213 Cb 0.47 0.82 -0.15 0.00 -0.61 0.00 0.00 39.78 40.31 1a8e n ASN 213 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1a8e s LEU 214 N -4.73 3.04 0.25 3.41 1.43 0.12 -4.98 118.68 117.22 1a8e s LEU 214 Ca -0.05 -1.20 0.12 0.00 -1.03 0.00 0.00 54.13 51.97 1a8e s LEU 214 Cb 0.03 -1.48 0.23 0.00 0.03 0.00 0.00 46.19 45.00 1a8e s LEU 214 CO 0.44 -0.15 1.52 0.00 0.23 0.00 0.00 176.35 178.39 1a8e h ALA 215 N 7.83 0.77 -2.90 4.21 0.00 -1.85 -3.42 119.26 123.89 1a8e h ALA 215 Ca -0.25 -0.60 -0.59 0.00 0.00 0.00 0.00 54.91 53.47 1a8e h ALA 215 Cb 1.07 -0.11 -0.08 0.00 0.00 0.00 0.00 17.79 18.67 1a8e h ALA 215 CO 0.49 0.82 -0.23 -0.80 0.00 0.00 0.00 179.25 179.54 1a8e s ASN 216 N -6.67 6.63 0.45 0.00 0.01 -1.26 -4.95 114.94 109.15 1a8e s ASN 216 Ca 0.00 0.75 0.11 0.00 -0.71 0.00 0.00 52.86 53.01 1a8e s ASN 216 Cb 0.11 -2.24 1.02 0.00 0.41 0.00 0.00 41.25 40.55 1a8e s ASN 216 CO 0.76 0.13 2.09 0.50 -1.51 0.00 0.00 177.10 179.07 1a8e h LYS 217 N 6.10 0.31 0.00 -0.60 3.11 -1.99 -0.93 116.57 122.58 1a8e h LYS 217 Ca -0.44 -0.02 -0.09 0.00 -2.81 0.00 0.00 60.65 57.28 1a8e h LYS 217 Cb 1.19 -0.07 -0.01 0.00 -1.00 0.00 0.00 32.23 32.33 1a8e h LYS 217 CO 0.71 0.21 -0.44 0.00 -2.81 0.00 0.00 179.45 177.13 1a8e h ALA 218 N 1.84 1.00 0.06 5.00 0.00 -1.98 -0.11 119.26 125.08 1a8e h ALA 218 Ca 0.09 -0.40 -0.25 0.00 0.00 0.00 0.00 54.91 54.34 1a8e h ALA 218 Cb -0.02 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 17.70 1a8e h ALA 218 CO -0.02 0.55 -1.09 -0.44 0.00 0.00 0.00 179.25 178.25 1a8e h ASP 219 N 0.00 0.55 0.87 0.00 3.32 -1.61 -3.22 116.42 116.33 1a8e h ASP 219 Ca -0.00 -0.50 -0.05 0.00 0.02 0.00 0.00 57.03 56.49 1a8e h ASP 219 Cb 0.94 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 40.31 1a8e h ASP 219 CO 0.06 1.33 -0.25 0.03 -1.72 0.00 0.00 179.24 178.68 1a8e h ARG 220 N 0.18 0.00 0.00 3.56 3.08 -0.90 -2.77 114.38 117.54 1a8e h ARG 220 Ca -0.12 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.93 1a8e h ARG 220 Cb 1.76 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.81 1a8e h ARG 220 CO 0.19 0.25 0.00 -0.25 -1.07 0.00 0.00 179.97 179.09 1a8e n ASP 221 N -3.44 0.10 -0.14 7.04 8.00 -0.09 -1.54 116.55 126.47 1a8e n ASP 221 Ca -0.00 0.53 0.15 0.00 0.71 0.00 0.00 54.79 56.18 1a8e n ASP 221 Cb 0.44 -0.55 0.76 0.00 -0.02 0.00 0.00 41.12 41.75 1a8e n ASP 221 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1a8e n GLN 222 N -1.61 1.05 -4.39 -1.24 1.13 -1.04 -4.86 117.38 106.41 1a8e n GLN 222 Ca 0.03 -0.28 -0.20 0.00 -1.94 0.00 0.00 57.00 54.60 1a8e n GLN 222 Cb 0.16 -1.49 -0.10 0.00 0.11 0.00 0.00 30.24 28.92 1a8e n GLN 222 CO 0.00 0.00 0.00 0.71 -1.44 0.00 0.00 177.06 176.33 1a8e s TYR 223 N -2.15 1.88 0.29 1.08 1.51 -0.59 0.14 117.35 119.52 1a8e s TYR 223 Ca 0.40 -0.55 -0.01 0.00 -1.01 0.00 0.00 57.07 55.89 1a8e s TYR 223 Cb 0.21 -0.91 -0.02 0.00 -0.11 0.00 0.00 41.96 41.14 1a8e s TYR 223 CO 0.39 0.41 0.35 -1.21 -1.11 0.00 0.00 175.55 174.39 1a8e s GLU 224 N -3.64 1.66 0.05 -0.62 2.02 -0.28 -4.40 118.70 113.49 1a8e s GLU 224 Ca 0.26 -1.72 0.08 0.00 0.02 0.00 0.00 54.97 53.60 1a8e s GLU 224 Cb -0.00 0.38 -0.03 0.00 0.10 0.00 0.00 34.13 34.57 1a8e s GLU 224 CO 0.10 -0.65 -0.19 -0.51 0.02 0.00 0.00 175.26 174.03 1a8e s LEU 225 N -3.22 2.57 -0.19 1.80 1.43 0.74 -0.97 118.68 120.84 1a8e s LEU 225 Ca 0.34 -0.46 -0.17 0.00 -1.03 0.00 0.00 54.13 52.80 1a8e s LEU 225 Cb 0.02 -1.49 -0.04 0.00 0.03 0.00 0.00 46.19 44.71 1a8e s LEU 225 CO 0.19 0.25 0.45 -0.76 0.23 0.00 0.00 176.35 176.70 1a8e s LEU 226 N -1.52 4.17 0.20 1.79 1.43 -0.60 -1.77 118.68 122.39 1a8e s LEU 226 Ca 0.15 0.62 0.02 0.00 -1.03 0.00 0.00 54.13 53.89 1a8e s LEU 226 Cb -0.10 -2.61 -0.04 0.00 0.03 0.00 0.00 46.19 43.47 1a8e s LEU 226 CO 0.06 -0.10 0.35 0.00 0.23 0.00 0.00 176.35 176.89 1a8e n LEU 228 N -0.91 0.14 -1.32 0.00 4.77 -1.26 -2.16 117.00 116.25 1a8e n LEU 228 Ca -0.07 0.55 0.07 0.00 -0.03 0.00 0.00 56.01 56.53 1a8e n LEU 228 Cb 0.55 -0.54 0.28 0.00 -2.33 0.00 0.00 43.42 41.38 1a8e n LEU 228 CO 0.48 -0.44 0.72 -0.90 -1.33 0.00 0.00 177.39 175.91 1a8e n ASP 229 N -1.67 3.87 -2.98 -1.43 5.75 -1.26 -4.90 116.55 113.93 1a8e n ASP 229 Ca 0.02 -2.39 -0.19 0.00 -0.01 0.00 0.00 54.79 52.22 1a8e n ASP 229 Cb 0.11 -0.52 0.07 0.00 -1.03 0.00 0.00 41.12 39.74 1a8e n ASP 229 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1a8e n ASN 230 N 0.77 -5.09 -4.23 -1.12 3.02 -0.92 -5.02 115.26 102.68 1a8e n ASN 230 Ca 0.20 -0.44 -0.24 0.00 -0.03 0.00 0.00 54.58 54.07 1a8e n ASN 230 Cb 0.74 -4.15 -0.09 0.00 -0.61 0.00 0.00 39.78 35.67 1a8e n ASN 230 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1a8e s THR 231 N -3.26 0.75 0.05 3.41 -4.23 -1.24 -4.88 115.64 106.24 1a8e s THR 231 Ca 0.41 -2.00 0.07 0.00 -1.18 0.00 0.00 61.69 58.99 1a8e s THR 231 Cb -0.18 -2.48 -0.03 0.00 1.34 0.00 0.00 72.50 71.15 1a8e s THR 231 CO 0.59 0.00 -0.19 -0.13 -0.54 0.00 0.00 174.62 174.34 1a8e s ARG 232 N -3.78 1.24 0.20 3.99 0.52 -1.26 -1.03 118.95 118.83 1a8e s ARG 232 Ca 0.28 -0.93 0.03 0.00 -0.52 0.00 0.00 55.73 54.58 1a8e s ARG 232 Cb 0.04 -1.35 -0.05 0.00 0.52 0.00 0.00 34.95 34.12 1a8e s ARG 232 CO 0.15 0.34 0.00 0.15 0.02 0.00 0.00 175.30 175.96 1a8e s LYS 233 N -1.28 1.22 0.81 3.54 1.02 -0.73 -4.94 119.74 119.38 1a8e s LYS 233 Ca 0.06 -1.60 -0.11 0.00 0.02 0.00 0.00 55.97 54.34 1a8e s LYS 233 Cb -0.09 -0.41 0.08 0.00 -0.52 0.00 0.00 37.83 36.89 1a8e s LYS 233 CO 0.02 -0.12 1.09 -2.14 -0.92 0.00 0.00 175.35 173.28 1a8e s PRO 234 N -3.90 1.98 0.27 -1.68 0.02 -1.26 -0.19 135.00 130.24 1a8e s PRO 234 Ca 0.26 0.99 0.22 0.00 0.02 0.00 0.00 61.00 62.49 1a8e s PRO 234 Cb 0.06 -1.88 1.01 0.00 0.02 0.00 0.00 34.50 33.71 1a8e s PRO 234 CO 0.06 -1.79 1.67 1.33 -0.33 0.00 0.00 177.00 177.95 1a8e n VAL 235 N -3.60 0.94 0.36 3.83 0.24 -1.26 -1.53 118.33 117.31 1a8e n VAL 235 Ca 0.08 0.42 0.12 0.00 -2.04 0.00 0.00 64.34 62.92 1a8e n VAL 235 Cb 0.54 -1.37 0.23 0.00 -1.47 0.00 0.00 33.84 31.77 1a8e n VAL 235 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 1a8e h ASP 236 N 0.00 0.00 -0.62 -1.34 5.19 -1.97 -3.30 116.42 114.38 1a8e h ASP 236 Ca 0.00 -0.01 -0.30 0.00 -0.62 0.00 0.00 57.03 56.10 1a8e h ASP 236 Cb 0.22 0.00 -0.18 0.00 0.18 0.00 0.00 39.33 39.56 1a8e h ASP 236 CO 0.00 0.01 0.38 -0.62 -3.12 0.00 0.00 179.24 175.88 1a8e n GLU 237 N -2.75 2.07 0.20 3.56 1.02 -0.58 -4.57 120.64 119.59 1a8e n GLU 237 Ca 0.04 -2.00 0.12 0.00 -0.02 0.00 0.00 57.16 55.29 1a8e n GLU 237 Cb 0.49 -1.81 0.67 0.00 -0.02 0.00 0.00 31.44 30.77 1a8e n GLU 237 CO 0.00 0.00 0.00 0.10 1.18 0.00 0.00 177.13 178.41 1a8e h TYR 238 N 0.93 0.00 0.00 -0.32 -0.00 -1.74 -1.62 116.97 114.23 1a8e h TYR 238 Ca 0.37 0.00 -0.01 0.00 0.00 0.00 0.00 58.73 59.08 1a8e h TYR 238 Cb 2.14 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 38.87 1a8e h TYR 238 CO 1.01 0.00 -0.06 0.87 -0.00 0.00 0.00 178.16 179.98 1a8e h LYS 239 N 0.00 0.00 -0.21 0.10 1.57 -1.93 -1.42 116.57 114.67 1a8e h LYS 239 Ca 0.07 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1a8e h LYS 239 Cb 0.27 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.58 1a8e h LYS 239 CO -0.00 0.06 0.00 -0.25 -0.57 0.00 0.00 179.45 178.69 1a8e n ASP 240 N -3.57 2.86 -2.93 0.86 8.00 -0.64 -4.73 116.55 116.41 1a8e n ASP 240 Ca -0.02 -2.33 -0.13 0.00 0.71 0.00 0.00 54.79 53.02 1a8e n ASP 240 Cb 0.18 -0.27 -0.00 0.00 -0.02 0.00 0.00 41.12 41.00 1a8e n ASP 240 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1a8e s HIS 242 N 0.26 0.83 -0.06 0.00 -3.43 -1.19 -4.58 115.29 107.12 1a8e s HIS 242 Ca 0.32 -1.17 -0.01 0.00 -0.80 0.00 0.00 55.06 53.40 1a8e s HIS 242 Cb 0.14 -0.49 -0.26 0.00 -1.43 0.00 0.00 32.58 30.54 1a8e s HIS 242 CO -0.16 -0.44 0.61 -0.07 -2.00 0.00 0.00 174.74 172.67 1a8e h LEU 243 N 2.91 0.33 -7.24 5.38 3.38 -1.11 -3.42 115.31 115.53 1a8e h LEU 243 Ca -0.35 -0.60 0.29 0.00 0.09 0.00 0.00 57.88 57.30 1a8e h LEU 243 Cb 1.19 -0.11 -0.13 0.00 0.09 0.00 0.00 40.66 41.70 1a8e h LEU 243 CO 0.61 1.53 0.77 0.00 0.09 0.00 0.00 178.44 181.43 1a8e s ALA 244 N -2.59 -2.11 -0.09 1.53 0.00 -1.22 -5.01 121.76 112.27 1a8e s ALA 244 Ca -0.14 0.77 -0.02 0.00 0.00 0.00 0.00 51.96 52.57 1a8e s ALA 244 Cb 0.07 0.33 -0.03 0.00 0.00 0.00 0.00 23.12 23.48 1a8e s ALA 244 CO 0.81 -0.97 0.01 -0.65 0.00 0.00 0.00 175.76 174.96 1a8e s GLN 245 N -2.57 3.05 0.09 0.00 -0.21 -1.26 -1.06 119.66 117.69 1a8e s GLN 245 Ca 0.13 -0.40 0.03 0.00 0.02 0.00 0.00 55.36 55.14 1a8e s GLN 245 Cb 0.03 -2.82 -0.04 0.00 1.00 0.00 0.00 33.01 31.18 1a8e s GLN 245 CO -0.03 0.68 -0.09 0.14 -2.12 0.00 0.00 175.29 173.87 1a8e s VAL 246 N -0.81 0.81 0.59 1.09 -7.23 0.47 -4.95 120.40 110.37 1a8e s VAL 246 Ca 0.12 -1.62 -0.17 0.00 -1.81 0.00 0.00 61.98 58.50 1a8e s VAL 246 Cb -0.11 -1.32 -0.03 0.00 0.56 0.00 0.00 36.38 35.47 1a8e s VAL 246 CO 0.02 -0.61 1.11 -2.84 -0.31 0.00 0.00 175.10 172.47 1a8e s PRO 247 N -2.86 3.16 0.87 4.82 0.02 -1.26 -0.48 135.00 139.27 1a8e s PRO 247 Ca 0.04 1.47 -0.11 0.00 0.02 0.00 0.00 61.00 62.42 1a8e s PRO 247 Cb -0.02 -1.99 0.12 0.00 0.02 0.00 0.00 34.50 32.62 1a8e s PRO 247 CO -0.01 -0.98 1.11 -1.12 -0.33 0.00 0.00 177.00 175.67 1a8e s SER 248 N -2.21 3.54 0.65 2.53 0.01 -1.00 -4.53 113.70 112.69 1a8e s SER 248 Ca 0.69 1.86 -0.16 0.00 1.31 0.00 0.00 55.95 59.65 1a8e s SER 248 Cb -0.21 -2.46 -0.00 0.00 0.21 0.00 0.00 66.02 63.55 1a8e s SER 248 CO 0.33 -2.65 1.15 -1.00 0.41 0.00 0.00 173.24 171.48 1a8e s HIS 249 N -2.79 2.47 0.01 2.43 3.76 -1.26 -4.38 115.29 115.52 1a8e s HIS 249 Ca 0.64 1.56 -0.07 0.00 -0.15 0.00 0.00 55.06 57.04 1a8e s HIS 249 Cb -0.20 -3.30 -0.00 0.00 1.11 0.00 0.00 32.58 30.20 1a8e s HIS 249 CO 0.57 -1.95 0.12 0.95 -0.85 0.00 0.00 174.74 173.59 1a8e s THR 250 N -2.08 0.09 0.07 1.30 -4.23 0.22 -1.69 115.64 109.33 1a8e s THR 250 Ca 0.71 -0.74 -0.27 0.00 -1.18 0.00 0.00 61.69 60.20 1a8e s THR 250 Cb -0.24 -0.46 -0.06 0.00 1.34 0.00 0.00 72.50 73.09 1a8e s THR 250 CO 0.39 -0.41 0.85 -0.69 -0.54 0.00 0.00 174.62 174.22 1a8e s VAL 251 N -1.50 4.63 0.27 2.29 1.01 0.74 -0.35 120.40 127.50 1a8e s VAL 251 Ca -0.14 1.82 0.10 0.00 0.00 0.00 0.00 61.98 63.76 1a8e s VAL 251 Cb -0.07 -4.20 -0.05 0.00 0.00 0.00 0.00 36.38 32.06 1a8e s VAL 251 CO 0.01 0.34 -0.06 0.68 0.00 0.00 0.00 175.10 176.07 1a8e s VAL 252 N -0.03 3.15 0.26 2.92 -7.23 -0.43 -0.45 120.40 118.58 1a8e s VAL 252 Ca 0.42 -2.07 -0.11 0.00 -1.81 0.00 0.00 61.98 58.41 1a8e s VAL 252 Cb -0.22 -2.68 -0.01 0.00 0.56 0.00 0.00 36.38 34.04 1a8e s VAL 252 CO 0.26 -0.38 0.46 0.00 -0.31 0.00 0.00 175.10 175.13 1a8e s ALA 253 N -2.38 -0.05 0.61 1.32 0.00 -0.00 -3.57 121.76 117.69 1a8e s ALA 253 Ca 0.31 -1.00 -0.18 0.00 0.00 0.00 0.00 51.96 51.09 1a8e s ALA 253 Cb -0.06 1.09 -0.02 0.00 0.00 0.00 0.00 23.12 24.13 1a8e s ALA 253 CO 0.18 -0.83 1.19 1.03 0.00 0.00 0.00 175.76 177.33 1a8e s ARG 254 N -3.90 2.88 0.40 0.00 0.52 -1.26 -0.26 118.95 117.33 1a8e s ARG 254 Ca 0.24 1.74 0.22 0.00 -0.52 0.00 0.00 55.73 57.42 1a8e s ARG 254 Cb -0.00 -1.93 0.55 0.00 0.52 0.00 0.00 34.95 34.09 1a8e s ARG 254 CO 0.10 -1.26 1.67 0.66 0.02 0.00 0.00 175.30 176.50 1a8e h SER 255 N 0.67 0.00 -3.53 0.23 4.64 -1.91 -3.34 113.55 110.30 1a8e h SER 255 Ca -0.50 0.00 -0.46 0.00 -0.47 0.00 0.00 61.79 60.36 1a8e h SER 255 Cb 1.29 0.00 -0.33 0.00 -0.31 0.00 0.00 62.40 63.05 1a8e h SER 255 CO 0.54 0.23 -0.80 -0.32 -0.87 0.00 0.00 176.83 175.62 1a8e s MET 256 N -3.32 1.25 -1.50 4.77 -2.45 -1.26 -4.74 119.30 112.05 1a8e s MET 256 Ca 0.03 -0.29 -0.06 0.00 -1.25 0.00 0.00 55.69 54.12 1a8e s MET 256 Cb 0.08 -1.11 0.02 0.00 1.25 0.00 0.00 34.83 35.07 1a8e s MET 256 CO 0.67 0.02 0.73 0.41 1.05 0.00 0.00 175.02 177.90 1a8e n GLY 257 N 3.75 -0.52 0.02 2.11 0.00 -1.26 -4.90 105.19 104.38 1a8e n GLY 257 Ca -0.23 0.16 0.14 0.00 0.00 0.00 0.00 46.02 46.09 1a8e n GLY 257 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1a8e n GLY 258 N -1.60 -1.32 2.45 -0.02 0.00 -1.26 -4.93 105.19 98.52 1a8e n GLY 258 Ca -0.07 -0.17 -0.18 0.00 0.00 0.00 0.00 46.02 45.60 1a8e n GLY 258 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1a8e n LYS 259 N -1.36 -2.04 0.06 1.61 5.02 -1.26 -4.49 118.16 115.70 1a8e n LYS 259 Ca 0.10 0.84 0.14 0.00 -2.02 0.00 0.00 58.31 57.37 1a8e n LYS 259 Cb 0.31 -5.49 0.62 0.00 -0.02 0.00 0.00 35.03 30.45 1a8e n LYS 259 CO 0.00 0.00 0.00 1.05 -0.52 0.00 0.00 177.40 177.93 1a8e h GLU 260 N -0.07 0.10 -0.17 1.97 9.09 -1.92 -0.55 114.58 123.04 1a8e h GLU 260 Ca -0.42 -0.01 -0.02 0.00 0.05 0.00 0.00 59.36 58.96 1a8e h GLU 260 Cb 1.31 -0.02 -0.01 0.00 -1.65 0.00 0.00 28.75 28.38 1a8e h GLU 260 CO 0.49 0.07 0.02 0.38 0.05 0.00 0.00 179.01 180.02 1a8e h ASP 261 N 0.11 0.27 0.10 3.06 2.03 -2.00 -2.00 116.42 118.00 1a8e h ASP 261 Ca 0.18 -0.27 -0.11 0.00 -0.73 0.00 0.00 57.03 56.10 1a8e h ASP 261 Cb 0.56 -0.07 -0.01 0.00 -0.83 0.00 0.00 39.33 38.98 1a8e h ASP 261 CO -0.02 0.47 -0.36 -0.07 -1.03 0.00 0.00 179.24 178.23 1a8e h LEU 262 N 0.06 0.37 -0.33 0.15 3.38 -1.68 -1.31 115.31 115.95 1a8e h LEU 262 Ca 0.05 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 1a8e h LEU 262 Cb 0.32 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 1a8e h LEU 262 CO 0.00 0.71 0.18 0.40 0.09 0.00 0.00 178.44 179.83 1a8e h ILE 263 N 0.31 1.13 -0.58 1.22 2.04 -0.93 0.21 117.51 120.91 1a8e h ILE 263 Ca 0.03 -0.33 -0.07 0.00 1.00 0.00 0.00 64.86 65.49 1a8e h ILE 263 Cb 0.78 0.76 -0.02 0.00 -0.74 0.00 0.00 36.82 37.60 1a8e h ILE 263 CO 0.06 0.13 0.09 -0.25 0.00 0.00 0.00 178.15 178.18 1a8e h TRP 264 N 0.41 1.03 -0.29 1.37 2.91 -1.17 -0.58 115.95 119.63 1a8e h TRP 264 Ca 0.12 -0.15 -0.00 0.00 1.13 0.00 0.00 58.89 59.99 1a8e h TRP 264 Cb 0.05 -0.28 -0.01 0.00 -0.51 0.00 0.00 29.16 28.41 1a8e h TRP 264 CO -0.03 0.90 0.17 1.49 -1.03 0.00 0.00 178.44 179.94 1a8e h GLU 265 N 0.86 0.40 -0.18 2.65 4.81 -0.92 0.26 114.58 122.46 1a8e h GLU 265 Ca 0.18 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.36 1a8e h GLU 265 Cb 0.43 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.72 1a8e h GLU 265 CO 0.01 0.33 0.09 1.25 -0.73 0.00 0.00 179.01 179.96 1a8e h LEU 266 N 0.37 0.24 -0.79 1.64 5.85 -0.41 -2.20 115.31 120.01 1a8e h LEU 266 Ca 0.10 -0.12 -0.13 0.00 0.84 0.00 0.00 57.88 58.58 1a8e h LEU 266 Cb 0.03 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 40.99 1a8e h LEU 266 CO -0.02 0.29 -0.49 -0.07 -0.34 0.00 0.00 178.44 177.81 1a8e h LEU 267 N 0.17 0.29 -0.71 2.25 3.38 -0.90 0.10 115.31 119.89 1a8e h LEU 267 Ca 0.06 -0.14 -0.13 0.00 0.09 0.00 0.00 57.88 57.76 1a8e h LEU 267 Cb 0.12 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1a8e h LEU 267 CO -0.01 0.74 -0.39 -1.13 0.09 0.00 0.00 178.44 177.74 1a8e h ASN 268 N 0.22 0.57 0.46 -0.43 -1.24 -0.36 -1.18 115.58 113.61 1a8e h ASN 268 Ca 0.01 -0.25 -0.21 0.00 0.71 0.00 0.00 56.30 56.57 1a8e h ASN 268 Cb 0.95 -0.16 -0.01 0.00 0.73 0.00 0.00 38.32 39.83 1a8e h ASN 268 CO 0.08 0.90 -0.89 1.56 -1.29 0.00 0.00 177.43 177.80 1a8e h GLN 269 N 0.45 0.30 -0.77 6.67 4.20 -1.21 -2.86 115.11 121.89 1a8e h GLN 269 Ca 0.04 -0.31 -0.05 0.00 0.06 0.00 0.00 58.65 58.39 1a8e h GLN 269 Cb 0.88 0.09 -0.03 0.00 0.30 0.00 0.00 27.48 28.71 1a8e h GLN 269 CO 0.08 1.01 0.28 0.00 -0.67 0.00 0.00 178.83 179.52 1a8e h ALA 270 N 0.88 1.00 0.00 3.87 0.00 -0.49 -1.32 119.26 123.20 1a8e h ALA 270 Ca -0.06 -0.21 -0.11 0.00 0.00 0.00 0.00 54.91 54.53 1a8e h ALA 270 Cb 1.51 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 1a8e h ALA 270 CO 0.14 0.65 -0.55 -0.56 0.00 0.00 0.00 179.25 178.94 1a8e h GLN 271 N 1.13 0.00 -0.24 0.00 3.07 -1.19 0.70 115.11 118.58 1a8e h GLN 271 Ca 0.25 0.00 -0.13 0.00 0.09 0.00 0.00 58.65 58.87 1a8e h GLN 271 Cb 0.26 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 27.81 1a8e h GLN 271 CO -0.02 0.55 -0.35 0.93 0.09 0.00 0.00 178.83 180.03 1a8e h GLU 272 N 0.00 0.65 0.16 0.06 5.08 -1.23 -0.45 114.58 118.86 1a8e h GLU 272 Ca -0.01 -0.39 -0.33 0.00 -1.00 0.00 0.00 59.36 57.63 1a8e h GLU 272 Cb 1.11 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.39 1a8e h GLU 272 CO 0.07 1.00 -1.65 0.45 -1.00 0.00 0.00 179.01 177.88 1a8e h HIS 273 N 0.36 0.62 0.00 4.33 3.86 -1.03 -3.40 115.15 119.90 1a8e h HIS 273 Ca 0.02 -0.45 -0.00 0.00 -1.16 0.00 0.00 60.37 58.78 1a8e h HIS 273 Cb 0.93 -0.02 -0.01 0.00 1.06 0.00 0.00 27.41 29.37 1a8e h HIS 273 CO 0.08 1.55 -0.13 1.19 0.86 0.00 0.00 177.93 181.48 1a8e n PHE 274 N -3.54 0.00 -0.47 2.45 3.72 0.24 -4.03 117.46 115.84 1a8e n PHE 274 Ca -0.21 -0.93 0.00 0.00 -0.05 0.00 0.00 57.45 56.26 1a8e n PHE 274 Cb 1.07 -0.15 0.00 0.00 -0.94 0.00 0.00 39.48 39.46 1a8e n PHE 274 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1a8e n GLY 275 N -1.21 -1.93 3.66 1.37 0.00 -0.18 -1.91 105.19 104.99 1a8e n GLY 275 Ca 0.14 -1.51 -0.46 0.00 0.00 0.00 0.00 46.02 44.20 1a8e n GLY 275 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1a8e n LYS 276 N -0.96 2.42 -1.38 1.61 4.76 -1.26 -1.75 118.16 121.60 1a8e n LYS 276 Ca 0.00 0.87 -0.13 0.00 -2.87 0.00 0.00 58.31 56.19 1a8e n LYS 276 Cb 0.00 -2.82 -0.06 0.00 -1.84 0.00 0.00 35.03 30.32 1a8e n LYS 276 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1a8e n ASP 277 N 7.36 -5.23 0.09 4.39 8.00 -1.26 -4.88 116.55 125.02 1a8e n ASP 277 Ca 0.22 0.32 -0.23 0.00 0.71 0.00 0.00 54.79 55.81 1a8e n ASP 277 Cb 0.35 -3.87 -0.15 0.00 -0.02 0.00 0.00 41.12 37.42 1a8e n ASP 277 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1a8e h LYS 278 N 0.04 0.43 -4.83 -1.24 1.79 -1.63 -3.48 116.57 107.65 1a8e h LYS 278 Ca -0.26 -0.73 -0.38 0.00 -2.18 0.00 0.00 60.65 57.10 1a8e h LYS 278 Cb 1.07 0.27 -0.26 0.00 -1.58 0.00 0.00 32.23 31.73 1a8e h LYS 278 CO 0.39 1.35 -0.77 0.45 -1.08 0.00 0.00 179.45 179.78 1a8e s SER 279 N -7.33 1.15 0.14 0.86 0.15 -1.26 -4.93 113.70 102.48 1a8e s SER 279 Ca -0.13 -0.32 0.25 0.00 0.70 0.00 0.00 55.95 56.44 1a8e s SER 279 Cb 0.04 -0.08 0.45 0.00 -1.71 0.00 0.00 66.02 64.72 1a8e s SER 279 CO 0.88 0.02 1.43 0.29 1.20 0.00 0.00 173.24 177.06 1a8e n LYS 280 N 2.29 0.29 0.02 5.44 4.76 -1.26 -4.15 118.16 125.55 1a8e n LYS 280 Ca -0.17 0.12 -0.20 0.00 -2.87 0.00 0.00 58.31 55.19 1a8e n LYS 280 Cb 0.56 -1.72 -0.14 0.00 -1.84 0.00 0.00 35.03 31.89 1a8e n LYS 280 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 1a8e h GLU 281 N 0.00 0.27 -2.89 1.97 3.07 -1.98 -3.48 114.58 111.54 1a8e h GLU 281 Ca 0.00 -0.46 -0.12 0.00 -0.50 0.00 0.00 59.36 58.28 1a8e h GLU 281 Cb 0.74 0.17 -0.21 0.00 -0.84 0.00 0.00 28.75 28.61 1a8e h GLU 281 CO 0.00 1.16 -0.24 0.12 -1.40 0.00 0.00 179.01 178.65 1a8e s PHE 282 N -2.57 -0.29 -0.08 4.33 5.36 -1.26 -5.13 117.98 118.33 1a8e s PHE 282 Ca -0.18 0.58 0.01 0.00 -0.96 0.00 0.00 56.93 56.38 1a8e s PHE 282 Cb 0.06 0.13 0.02 0.00 -0.34 0.00 0.00 43.02 42.90 1a8e s PHE 282 CO 0.80 -0.34 -0.09 -0.65 -1.46 0.00 0.00 175.22 173.48 1a8e s GLN 283 N -0.81 1.44 0.17 10.12 1.11 -1.26 -4.40 119.66 126.03 1a8e s GLN 283 Ca -0.09 -0.28 -0.08 0.00 0.01 0.00 0.00 55.36 54.92 1a8e s GLN 283 Cb -0.04 -1.34 0.04 0.00 -1.01 0.00 0.00 33.01 30.66 1a8e s GLN 283 CO 0.03 -0.10 1.52 1.25 0.01 0.00 0.00 175.29 178.00 1a8e h LEU 284 N 7.45 0.87 -3.87 2.90 5.85 -1.69 -3.28 115.31 123.54 1a8e h LEU 284 Ca -0.31 -0.39 -0.41 0.00 0.84 0.00 0.00 57.88 57.61 1a8e h LEU 284 Cb 1.16 -0.25 -0.24 0.00 0.37 0.00 0.00 40.66 41.70 1a8e h LEU 284 CO 0.44 1.15 0.49 0.49 -0.34 0.00 0.00 178.44 180.68 1a8e n PHE 285 N -4.05 2.74 -3.78 1.25 3.72 -1.26 -4.73 117.46 111.36 1a8e n PHE 285 Ca -0.02 -1.64 -0.03 0.00 -0.05 0.00 0.00 57.45 55.70 1a8e n PHE 285 Cb 0.53 -0.84 -0.01 0.00 -0.94 0.00 0.00 39.48 38.23 1a8e n PHE 285 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1a8e s SER 286 N -1.33 -0.14 -0.18 4.37 1.04 -1.24 -4.25 113.70 111.98 1a8e s SER 286 Ca 0.55 -0.47 -0.29 0.00 0.48 0.00 0.00 55.95 56.23 1a8e s SER 286 Cb 0.46 0.49 0.13 0.00 0.10 0.00 0.00 66.02 67.20 1a8e s SER 286 CO 0.11 -0.93 1.00 -0.55 0.98 0.00 0.00 173.24 173.85 1a8e s SER 287 N -3.02 -0.38 0.36 7.02 0.15 -1.26 -4.58 113.70 111.98 1a8e s SER 287 Ca 0.14 0.48 0.27 0.00 0.70 0.00 0.00 55.95 57.54 1a8e s SER 287 Cb -0.02 0.40 1.04 0.00 -1.71 0.00 0.00 66.02 65.73 1a8e s SER 287 CO 0.03 -0.31 1.80 1.55 1.20 0.00 0.00 173.24 177.51 1a8e h PRO 288 N 2.83 0.00 0.00 5.44 0.13 -2.02 -3.10 132.00 135.28 1a8e h PRO 288 Ca -0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.93 1a8e h PRO 288 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1a8e h PRO 288 CO 0.28 0.00 -0.27 0.72 -0.23 0.00 0.00 178.00 178.50 1a8e n HIS 289 N -2.57 0.17 0.00 1.56 8.25 -1.26 -5.02 115.22 116.35 1a8e n HIS 289 Ca 0.02 0.05 0.00 0.00 -0.26 0.00 0.00 57.72 57.53 1a8e n HIS 289 Cb 0.30 -0.47 0.00 0.00 1.12 0.00 0.00 29.99 30.94 1a8e n HIS 289 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1a8e n GLY 290 N 1.46 1.01 3.86 -1.41 0.00 -1.17 -4.92 105.19 104.02 1a8e n GLY 290 Ca 0.06 -1.25 -0.33 0.00 0.00 0.00 0.00 46.02 44.50 1a8e n GLY 290 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1a8e s LYS 291 N -1.96 3.31 -1.46 1.61 1.02 -1.26 -4.02 119.74 116.98 1a8e s LYS 291 Ca 0.00 -0.37 -0.07 0.00 0.02 0.00 0.00 55.97 55.55 1a8e s LYS 291 Cb 0.00 -3.02 0.03 0.00 -0.52 0.00 0.00 37.83 34.32 1a8e s LYS 291 CO 0.00 0.67 0.61 -0.25 -0.92 0.00 0.00 175.35 175.46 1a8e n ASP 292 N 1.06 -5.27 -4.68 2.83 8.00 -1.26 -4.95 116.55 112.28 1a8e n ASP 292 Ca -0.12 -0.35 -0.41 0.00 0.71 0.00 0.00 54.79 54.62 1a8e n ASP 292 Cb 0.53 -4.28 -0.04 0.00 -0.02 0.00 0.00 41.12 37.31 1a8e n ASP 292 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1a8e s LEU 293 N -6.67 4.21 0.00 0.64 1.43 -1.26 -4.25 118.68 112.78 1a8e s LEU 293 Ca 0.36 1.21 0.00 0.00 -1.03 0.00 0.00 54.13 54.67 1a8e s LEU 293 Cb -0.17 -3.23 0.00 0.00 0.03 0.00 0.00 46.19 42.82 1a8e s LEU 293 CO 0.45 -0.34 0.00 0.18 0.23 0.00 0.00 176.35 176.86 1a8e n LEU 294 N 4.91 0.00 -4.14 1.79 4.77 -1.26 -4.75 117.00 118.32 1a8e n LEU 294 Ca 0.04 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.93 1a8e n LEU 294 Cb 0.49 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.48 1a8e n LEU 294 CO 0.48 0.00 -0.36 -0.36 -1.33 0.00 0.00 177.39 175.82 1a8e s PHE 295 N 0.00 0.74 0.32 -1.77 0.08 -1.26 -4.44 117.98 111.66 1a8e s PHE 295 Ca 0.00 -1.02 -0.27 0.00 0.12 0.00 0.00 56.93 55.76 1a8e s PHE 295 Cb 0.00 -0.47 -0.09 0.00 -0.57 0.00 0.00 43.02 41.89 1a8e s PHE 295 CO 0.00 -0.29 1.03 0.15 -0.10 0.00 0.00 175.22 176.01 1a8e s LYS 296 N -3.90 4.49 0.51 0.44 1.02 -1.26 -4.18 119.74 116.86 1a8e s LYS 296 Ca 0.11 1.57 0.25 0.00 0.02 0.00 0.00 55.97 57.93 1a8e s LYS 296 Cb 0.07 -2.90 1.37 0.00 -0.52 0.00 0.00 37.83 35.84 1a8e s LYS 296 CO -0.06 0.14 2.05 -0.44 -0.92 0.00 0.00 175.35 176.12 1a8e h ASP 297 N 3.28 0.00 0.80 2.83 5.19 -1.89 -2.05 116.42 124.58 1a8e h ASP 297 Ca -0.47 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.94 1a8e h ASP 297 Cb 1.21 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.72 1a8e h ASP 297 CO 0.65 0.14 0.00 -1.54 -3.12 0.00 0.00 179.24 175.37 1a8e n SER 298 N -3.72 0.00 -4.79 6.45 3.41 -1.26 -4.83 113.62 108.88 1a8e n SER 298 Ca -0.02 0.25 -0.33 0.00 -0.26 0.00 0.00 58.87 58.51 1a8e n SER 298 Cb 0.25 -0.41 0.01 0.00 -0.26 0.00 0.00 64.21 63.80 1a8e n SER 298 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1a8e s ALA 299 N -2.83 2.69 -0.12 7.33 0.00 -0.77 -4.42 121.76 123.65 1a8e s ALA 299 Ca 0.19 0.50 0.03 0.00 0.00 0.00 0.00 51.96 52.67 1a8e s ALA 299 Cb 0.19 -3.27 -0.03 0.00 0.00 0.00 0.00 23.12 20.02 1a8e s ALA 299 CO 0.49 -0.84 0.11 0.72 0.00 0.00 0.00 175.76 176.23 1a8e n HIS 300 N -1.91 0.00 -3.34 0.00 8.25 0.85 -4.92 115.22 114.15 1a8e n HIS 300 Ca 0.09 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.55 1a8e n HIS 300 Cb 0.52 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.63 1a8e n HIS 300 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1a8e n GLY 301 N 1.09 -1.06 3.26 -1.41 0.00 -1.19 -4.62 105.19 101.26 1a8e n GLY 301 Ca 0.00 -0.89 -0.21 0.00 0.00 0.00 0.00 46.02 44.92 1a8e n GLY 301 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1a8e s PHE 302 N -3.00 1.58 -0.01 1.61 0.08 -1.26 -1.49 117.98 115.49 1a8e s PHE 302 Ca 0.00 -0.48 0.04 0.00 0.12 0.00 0.00 56.93 56.61 1a8e s PHE 302 Cb 0.00 -0.84 -0.01 0.00 -0.57 0.00 0.00 43.02 41.60 1a8e s PHE 302 CO 0.00 0.19 -0.13 -0.51 -0.10 0.00 0.00 175.22 174.67 1a8e s LEU 303 N -2.21 2.03 0.19 -0.37 1.43 -0.03 -4.93 118.68 114.79 1a8e s LEU 303 Ca 0.08 -0.23 -0.30 0.00 -1.03 0.00 0.00 54.13 52.64 1a8e s LEU 303 Cb -0.08 -0.66 -0.08 0.00 0.03 0.00 0.00 46.19 45.41 1a8e s LEU 303 CO 0.04 0.16 1.06 -0.75 0.23 0.00 0.00 176.35 177.09 1a8e s LYS 304 N -0.31 4.65 0.37 1.70 2.20 -1.26 -0.25 119.74 126.84 1a8e s LYS 304 Ca 0.05 1.66 -0.24 0.00 -0.36 0.00 0.00 55.97 57.08 1a8e s LYS 304 Cb -0.05 -3.28 -0.10 0.00 -1.51 0.00 0.00 37.83 32.89 1a8e s LYS 304 CO -0.00 0.17 0.96 0.08 -0.36 0.00 0.00 175.35 176.19 1a8e s VAL 305 N -0.44 4.20 0.73 4.02 1.01 -0.28 -4.85 120.40 124.79 1a8e s VAL 305 Ca 0.47 1.65 -0.15 0.00 0.00 0.00 0.00 61.98 63.96 1a8e s VAL 305 Cb -0.28 -3.84 0.04 0.00 0.00 0.00 0.00 36.38 32.30 1a8e s VAL 305 CO 0.35 -0.02 1.18 -2.84 0.00 0.00 0.00 175.10 173.76 1a8e s PRO 306 N -2.47 2.22 0.05 2.72 0.02 -1.26 -4.86 135.00 131.42 1a8e s PRO 306 Ca 0.55 1.66 -0.36 0.00 0.02 0.00 0.00 61.00 62.87 1a8e s PRO 306 Cb -0.16 -1.85 -0.15 0.00 0.02 0.00 0.00 34.50 32.36 1a8e s PRO 306 CO 0.21 -1.75 1.55 -2.30 -0.33 0.00 0.00 177.00 174.38 1a8e n PRO 307 N -2.75 1.68 -2.56 5.54 -0.02 -1.26 -2.82 135.00 132.80 1a8e n PRO 307 Ca 0.13 0.61 -0.18 0.00 -2.02 0.00 0.00 63.50 62.04 1a8e n PRO 307 Cb 0.51 -2.33 -0.00 0.00 -0.02 0.00 0.00 33.50 31.65 1a8e n PRO 307 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1a8e n ARG 308 N 3.75 -2.42 -2.75 -0.52 1.74 -1.26 -4.94 116.66 110.26 1a8e n ARG 308 Ca 0.19 0.79 -0.41 0.00 -0.77 0.00 0.00 57.85 57.65 1a8e n ARG 308 Cb 0.24 -5.46 -0.05 0.00 -1.02 0.00 0.00 32.46 26.17 1a8e n ARG 308 CO 0.00 0.00 0.00 1.41 -1.52 0.00 0.00 177.63 177.52 1a8e s MET 309 N -5.19 4.70 0.56 5.56 1.75 -1.13 -5.03 119.30 120.52 1a8e s MET 309 Ca 0.07 1.43 -0.01 0.00 -1.25 0.00 0.00 55.69 55.93 1a8e s MET 309 Cb -0.03 -3.37 0.03 0.00 2.84 0.00 0.00 34.83 34.30 1a8e s MET 309 CO 0.08 0.25 0.80 0.16 -0.65 0.00 0.00 175.02 175.66 1a8e s ASP 310 N -0.14 5.36 0.29 1.11 -4.77 -1.26 -4.44 116.67 112.83 1a8e s ASP 310 Ca 0.46 0.20 0.01 0.00 -3.30 0.00 0.00 52.55 49.92 1a8e s ASP 310 Cb -0.23 -1.15 0.53 0.00 -1.09 0.00 0.00 42.92 40.98 1a8e s ASP 310 CO 0.30 -1.10 1.88 0.00 0.70 0.00 0.00 175.17 176.95 1a8e h ALA 311 N 0.02 1.51 -0.51 2.11 0.00 -1.92 -0.81 119.26 119.67 1a8e h ALA 311 Ca -0.44 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.43 1a8e h ALA 311 Cb 1.29 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 1a8e h ALA 311 CO 0.55 0.32 0.19 0.87 0.00 0.00 0.00 179.25 181.18 1a8e h LYS 312 N 1.04 0.77 -0.33 0.00 1.57 -1.95 0.27 116.57 117.93 1a8e h LYS 312 Ca 0.43 -0.15 -0.15 0.00 -1.87 0.00 0.00 60.65 58.91 1a8e h LYS 312 Cb 0.30 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 1a8e h LYS 312 CO -0.18 0.69 -0.39 1.98 -0.57 0.00 0.00 179.45 180.98 1a8e h MET 313 N 0.68 0.80 -0.10 3.15 4.05 -1.81 -0.55 114.93 121.15 1a8e h MET 313 Ca 0.17 -0.41 -0.00 0.00 -0.28 0.00 0.00 59.70 59.17 1a8e h MET 313 Cb 0.22 0.01 -0.00 0.00 -0.80 0.00 0.00 31.60 31.03 1a8e h MET 313 CO -0.01 1.05 0.04 -0.92 0.23 0.00 0.00 176.91 177.30 1a8e h TYR 314 N 0.65 0.14 -0.11 1.39 3.20 -0.84 -2.80 116.97 118.60 1a8e h TYR 314 Ca 0.05 -0.01 -0.11 0.00 3.14 0.00 0.00 58.73 61.81 1a8e h TYR 314 Cb 0.95 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 39.17 1a8e h TYR 314 CO 0.05 0.21 -0.43 -0.07 -1.64 0.00 0.00 178.16 176.28 1a8e h LEU 315 N 0.03 0.27 0.00 2.82 3.38 -0.38 -3.50 115.31 117.93 1a8e h LEU 315 Ca 0.03 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1a8e h LEU 315 Cb 0.13 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.80 1a8e h LEU 315 CO -0.00 0.67 0.00 0.61 0.09 0.00 0.00 178.44 179.80 1a8e n GLY 316 N -0.13 0.18 0.24 0.83 0.00 -0.22 -4.48 105.19 101.59 1a8e n GLY 316 Ca -0.02 -1.50 0.01 0.00 0.00 0.00 0.00 46.02 44.51 1a8e n GLY 316 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1a8e h TYR 317 N 0.00 0.15 0.06 1.61 3.20 -1.88 -1.85 116.97 118.26 1a8e h TYR 317 Ca 0.00 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.91 1a8e h TYR 317 Cb 0.00 0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.29 1a8e h TYR 317 CO 0.00 -0.07 -0.12 0.93 -1.64 0.00 0.00 178.16 177.26 1a8e h GLU 318 N 0.22 -0.18 -0.91 1.82 5.08 -1.97 0.28 114.58 118.92 1a8e h GLU 318 Ca 0.33 0.01 0.13 0.00 -1.00 0.00 0.00 59.36 58.83 1a8e h GLU 318 Cb 0.51 0.04 -0.07 0.00 0.50 0.00 0.00 28.75 29.73 1a8e h GLU 318 CO -0.45 -0.12 0.58 -0.92 -1.00 0.00 0.00 179.01 177.11 1a8e h TYR 319 N -0.19 0.90 -0.36 4.33 3.20 -1.76 0.13 116.97 123.22 1a8e h TYR 319 Ca -0.01 0.03 -0.13 0.00 3.14 0.00 0.00 58.73 61.76 1a8e h TYR 319 Cb 0.18 -0.29 -0.01 0.00 1.54 0.00 0.00 36.73 38.15 1a8e h TYR 319 CO -0.24 0.35 -0.29 0.28 -1.64 0.00 0.00 178.16 176.61 1a8e h VAL 320 N 0.78 1.28 -0.53 1.81 2.07 -1.14 -2.25 116.25 118.27 1a8e h VAL 320 Ca 0.45 -1.43 -0.02 0.00 0.82 0.00 0.00 66.70 66.52 1a8e h VAL 320 Cb 0.63 1.31 -0.02 0.00 -1.52 0.00 0.00 31.29 31.68 1a8e h VAL 320 CO -0.21 0.47 0.24 0.74 0.02 0.00 0.00 177.57 178.83 1a8e h THR 321 N 0.66 1.21 -0.68 2.57 2.02 0.21 -1.92 112.91 116.98 1a8e h THR 321 Ca 0.08 -0.60 0.02 0.00 0.77 0.00 0.00 66.41 66.67 1a8e h THR 321 Cb 0.82 0.63 -0.04 0.00 -1.74 0.00 0.00 68.15 67.82 1a8e h THR 321 CO 0.07 0.24 0.44 0.00 0.37 0.00 0.00 175.52 176.63 1a8e h ALA 322 N 1.08 0.88 -0.51 6.16 0.00 -0.96 0.62 119.26 126.53 1a8e h ALA 322 Ca 0.18 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.98 1a8e h ALA 322 Cb 0.15 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1a8e h ALA 322 CO -0.02 0.24 0.01 0.82 0.00 0.00 0.00 179.25 180.31 1a8e h ILE 323 N 0.88 1.26 -0.04 0.00 2.04 -1.17 -2.90 117.51 117.58 1a8e h ILE 323 Ca 0.26 -1.06 -0.00 0.00 1.00 0.00 0.00 64.86 65.06 1a8e h ILE 323 Cb -0.04 0.94 -0.00 0.00 -0.74 0.00 0.00 36.82 36.98 1a8e h ILE 323 CO -0.08 0.37 0.02 0.03 0.00 0.00 0.00 178.15 178.49 1a8e h ARG 324 N 0.75 0.06 0.00 2.37 3.08 -0.89 -2.60 114.38 117.15 1a8e h ARG 324 Ca 0.15 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.19 1a8e h ARG 324 Cb 0.50 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.54 1a8e h ARG 324 CO 0.02 0.18 0.00 0.09 -1.07 0.00 0.00 179.97 179.19 1a8e n ASN 325 N -4.99 0.00 -0.11 7.04 5.03 0.17 -0.72 115.26 121.68 1a8e n ASN 325 Ca -0.07 -0.04 -0.19 0.00 0.87 0.00 0.00 54.58 55.15 1a8e n ASN 325 Cb 0.09 -0.18 -0.12 0.00 -1.02 0.00 0.00 39.78 38.55 1a8e n ASN 325 CO 0.00 0.00 0.00 -0.11 -1.83 0.00 0.00 177.26 175.32 1a8e n LEU 326 N -1.18 2.91 -0.02 3.41 7.94 -1.04 -3.52 117.00 125.49 1a8e n LEU 326 Ca 0.06 -0.08 -0.13 0.00 -1.11 0.00 0.00 56.01 54.76 1a8e n LEU 326 Cb 0.07 -0.94 -0.09 0.00 0.53 0.00 0.00 43.42 42.99 1a8e n LEU 326 CO 0.08 0.92 0.66 0.03 -1.11 0.00 0.00 177.39 177.97 1a8e h ARG 327 N -0.01 0.09 0.00 1.96 3.08 -0.56 -3.40 114.38 115.54 1a8e h ARG 327 Ca -0.56 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.45 1a8e h ARG 327 Cb 1.91 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.96 1a8e h ARG 327 CO -0.07 0.49 0.00 0.39 -1.07 0.00 0.00 179.97 179.71 1a8e n GLU 328 N -4.82 0.00 -1.99 0.04 1.02 -0.37 -5.03 120.64 109.49 1a8e n GLU 328 Ca -0.08 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.06 1a8e n GLU 328 Cb 0.24 -0.19 0.00 0.00 -0.02 0.00 0.00 31.44 31.48 1a8e n GLU 328 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1a8e n GLY 329 N 2.21 -5.15 3.19 0.62 0.00 -1.23 -4.98 105.19 99.86 1a8e n GLY 329 Ca 0.00 -0.34 -0.27 0.00 0.00 0.00 0.00 46.02 45.40 1a8e n GLY 329 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1a8e s THR 330 N -1.62 1.61 -2.00 2.61 2.01 -1.26 -4.97 115.64 112.02 1a8e s THR 330 Ca 0.00 -0.84 0.19 0.00 0.31 0.00 0.00 61.69 61.35 1a8e s THR 330 Cb 0.00 -1.36 0.55 0.00 0.01 0.00 0.00 72.50 71.71 1a8e s THR 330 CO 0.00 0.46 1.55 0.00 -0.69 0.00 0.00 174.62 175.94