#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s6y s LEU 5 N 0.00 3.68 -0.13 0.55 1.43 -0.96 -4.88 118.68 118.38 1s6y s LEU 5 Ca 0.00 0.15 -0.02 0.00 -1.03 0.00 0.00 54.13 53.23 1s6y s LEU 5 Cb 0.00 -1.87 -0.03 0.00 0.03 0.00 0.00 46.19 44.33 1s6y s LEU 5 CO 0.00 0.34 -0.06 -0.75 0.23 0.00 0.00 176.35 176.11 1s6y s LYS 6 N -0.62 3.39 -0.14 1.70 2.20 -1.26 -0.34 119.74 124.67 1s6y s LYS 6 Ca 0.10 -0.54 0.00 0.00 -0.36 0.00 0.00 55.97 55.17 1s6y s LYS 6 Cb -0.12 -2.79 0.02 0.00 -1.51 0.00 0.00 37.83 33.43 1s6y s LYS 6 CO 0.02 0.36 -0.14 0.42 -0.36 0.00 0.00 175.35 175.65 1s6y s ILE 7 N 0.03 1.52 -0.20 5.43 1.01 -0.58 -1.33 121.20 127.08 1s6y s ILE 7 Ca -0.01 -0.61 -0.10 0.00 0.00 0.00 0.00 60.65 59.93 1s6y s ILE 7 Cb -0.14 -1.43 -0.05 0.00 0.01 0.00 0.00 42.46 40.85 1s6y s ILE 7 CO 0.03 0.45 0.15 0.00 0.00 0.00 0.00 174.94 175.57 1s6y s ALA 8 N 1.44 3.67 -0.32 9.38 0.00 -0.64 -0.73 121.76 134.56 1s6y s ALA 8 Ca 0.04 -0.71 0.03 0.00 0.00 0.00 0.00 51.96 51.32 1s6y s ALA 8 Cb -0.13 -2.21 0.09 0.00 0.00 0.00 0.00 23.12 20.86 1s6y s ALA 8 CO -0.09 0.09 0.01 0.99 0.00 0.00 0.00 175.76 176.76 1s6y s THR 9 N 0.49 2.31 -0.22 0.00 2.01 -0.05 -0.13 115.64 120.05 1s6y s THR 9 Ca 0.09 -2.12 -0.27 0.00 0.31 0.00 0.00 61.69 59.70 1s6y s THR 9 Cb -0.12 -2.60 0.00 0.00 0.01 0.00 0.00 72.50 69.79 1s6y s THR 9 CO -0.00 -0.44 0.93 -0.63 -0.69 0.00 0.00 174.62 173.79 1s6y s ILE 10 N 0.97 4.77 0.00 1.82 1.09 -0.15 -1.76 121.20 127.95 1s6y s ILE 10 Ca 0.05 1.80 0.00 0.00 -1.10 0.00 0.00 60.65 61.40 1s6y s ILE 10 Cb -0.19 -4.21 0.00 0.00 -1.06 0.00 0.00 42.46 36.99 1s6y s ILE 10 CO -0.07 -0.11 0.00 0.61 -0.10 0.00 0.00 174.94 175.27 1s6y n GLY 11 N 3.50 1.75 0.38 6.18 0.00 -0.65 -0.41 105.19 115.96 1s6y n GLY 11 Ca 0.08 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.26 1s6y n GLY 11 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1s6y h GLY 12 N 0.00 1.18 -1.16 -0.02 0.00 -0.36 -2.69 103.07 100.03 1s6y h GLY 12 Ca 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 47.33 47.07 1s6y h GLY 12 CO 0.00 0.01 0.00 0.61 0.00 0.00 0.00 176.54 177.16 1s6y n GLY 13 N -1.45 1.11 3.85 4.60 0.00 -1.26 -4.80 105.19 107.25 1s6y n GLY 13 Ca 0.20 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 1s6y n GLY 13 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1s6y s SER 14 N -0.09 6.74 0.40 1.61 0.15 -1.01 -4.53 113.70 116.97 1s6y s SER 14 Ca 0.00 1.19 0.12 0.00 0.70 0.00 0.00 55.95 57.96 1s6y s SER 14 Cb 0.00 -2.34 0.94 0.00 -1.71 0.00 0.00 66.02 62.91 1s6y s SER 14 CO 0.00 -0.17 1.93 -1.28 1.20 0.00 0.00 173.24 174.92 1s6y h SER 15 N 2.35 0.49 0.07 5.45 0.87 -1.91 -2.66 113.55 118.22 1s6y h SER 15 Ca -0.48 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.10 1s6y h SER 15 Cb 1.17 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 63.05 1s6y h SER 15 CO 0.66 0.28 -0.03 -1.22 -0.53 0.00 0.00 176.83 175.99 1s6y n TYR 16 N -4.49 0.00 -0.24 2.24 4.02 -1.26 -4.27 117.16 113.15 1s6y n TYR 16 Ca 0.13 0.00 0.03 0.00 -0.01 0.00 0.00 57.90 58.05 1s6y n TYR 16 Cb 0.42 -0.04 0.15 0.00 -0.02 0.00 0.00 39.34 39.86 1s6y n TYR 16 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 176.86 177.00 1s6y h THR 17 N 1.12 0.74 -0.68 -0.72 2.02 -1.78 -0.93 112.91 112.67 1s6y h THR 17 Ca 0.00 -0.16 0.07 0.00 0.77 0.00 0.00 66.41 67.09 1s6y h THR 17 Cb 0.29 0.22 -0.04 0.00 -1.74 0.00 0.00 68.15 66.87 1s6y h THR 17 CO 0.00 0.09 0.45 -0.65 0.37 0.00 0.00 175.52 175.78 1s6y h PRO 18 N 0.48 0.65 -0.93 6.66 0.11 -1.83 -1.21 132.00 135.92 1s6y h PRO 18 Ca 0.37 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.44 1s6y h PRO 18 Cb 0.50 -0.15 -0.05 0.00 0.11 0.00 0.00 31.00 31.42 1s6y h PRO 18 CO -0.34 0.43 0.58 1.49 -0.21 0.00 0.00 178.00 179.94 1s6y h GLU 19 N 0.66 1.25 0.35 1.05 4.81 -1.47 0.58 114.58 121.82 1s6y h GLU 19 Ca 0.30 -0.10 -0.02 0.00 -0.13 0.00 0.00 59.36 59.41 1s6y h GLU 19 Cb 0.32 -0.27 0.00 0.00 0.63 0.00 0.00 28.75 29.43 1s6y h GLU 19 CO -0.10 0.87 -0.17 1.25 -0.73 0.00 0.00 179.01 180.13 1s6y h LEU 20 N 1.28 -0.40 -1.02 1.64 5.85 -1.04 -0.81 115.31 120.80 1s6y h LEU 20 Ca 0.34 -0.10 -0.05 0.00 0.84 0.00 0.00 57.88 58.91 1s6y h LEU 20 Cb -0.08 0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.03 1s6y h LEU 20 CO -0.07 -0.13 0.19 -0.37 -0.34 0.00 0.00 178.44 177.72 1s6y h VAL 21 N -0.68 1.23 -0.57 1.05 -1.51 -1.24 -0.02 116.25 114.51 1s6y h VAL 21 Ca -0.05 -0.78 0.06 0.00 -1.23 0.00 0.00 66.70 64.71 1s6y h VAL 21 Cb 0.48 0.57 -0.05 0.00 -2.13 0.00 0.00 31.29 30.16 1s6y h VAL 21 CO 0.08 0.30 0.27 -0.08 -1.23 0.00 0.00 177.57 176.90 1s6y h GLU 22 N 0.87 0.49 -0.35 5.19 4.81 -0.83 0.93 114.58 125.69 1s6y h GLU 22 Ca 0.20 -0.03 0.04 0.00 -0.13 0.00 0.00 59.36 59.43 1s6y h GLU 22 Cb 0.25 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.48 1s6y h GLU 22 CO -0.01 0.32 0.14 0.78 -0.73 0.00 0.00 179.01 179.51 1s6y h GLY 23 N 0.50 0.45 1.45 1.92 0.00 0.46 -0.23 103.07 107.62 1s6y h GLY 23 Ca 0.26 -0.08 -0.06 0.00 0.00 0.00 0.00 47.33 47.44 1s6y h GLY 23 CO -0.21 0.05 -0.01 1.41 0.00 0.00 0.00 176.54 177.78 1s6y h LEU 24 N 0.29 0.64 0.14 3.11 3.38 -0.51 -2.30 115.31 120.05 1s6y h LEU 24 Ca 0.15 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 1s6y h LEU 24 Cb 0.11 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.69 1s6y h LEU 24 CO -0.15 0.72 -0.07 0.40 0.09 0.00 0.00 178.44 179.44 1s6y h ILE 25 N 0.64 0.92 -1.01 1.22 2.04 -0.51 -0.95 117.51 119.85 1s6y h ILE 25 Ca 0.13 -0.22 0.24 0.00 1.00 0.00 0.00 64.86 66.00 1s6y h ILE 25 Cb 0.41 1.06 -0.10 0.00 -0.74 0.00 0.00 36.82 37.45 1s6y h ILE 25 CO 0.02 0.05 0.63 0.11 0.00 0.00 0.00 178.15 178.96 1s6y h LYS 26 N -0.29 0.53 -0.41 2.37 1.57 -0.74 -2.95 116.57 116.65 1s6y h LYS 26 Ca -0.02 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1s6y h LYS 26 Cb 0.23 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.42 1s6y h LYS 26 CO 0.03 0.35 0.00 0.54 -0.57 0.00 0.00 179.45 179.80 1s6y n ARG 27 N -4.73 2.93 -0.34 3.15 1.74 -0.89 -4.75 116.66 113.77 1s6y n ARG 27 Ca 0.25 -2.30 0.05 0.00 -0.77 0.00 0.00 57.85 55.08 1s6y n ARG 27 Cb 0.75 -1.43 0.23 0.00 -1.02 0.00 0.00 32.46 30.99 1s6y n ARG 27 CO 0.00 0.00 0.00 -0.92 -1.52 0.00 0.00 177.63 175.19 1s6y h TYR 28 N 2.44 1.10 -0.68 -1.55 3.20 -1.00 0.19 116.97 120.68 1s6y h TYR 28 Ca 0.00 0.03 0.11 0.00 3.14 0.00 0.00 58.73 62.01 1s6y h TYR 28 Cb 0.91 -0.36 -0.08 0.00 1.54 0.00 0.00 36.73 38.74 1s6y h TYR 28 CO 0.34 0.53 0.27 1.25 -1.64 0.00 0.00 178.16 178.91 1s6y h HIS 29 N 1.04 0.47 0.00 -3.82 2.76 -1.85 -2.10 115.15 111.64 1s6y h HIS 29 Ca 0.44 0.03 -0.18 0.00 -2.20 0.00 0.00 60.37 58.46 1s6y h HIS 29 Cb 0.31 -0.10 -0.02 0.00 1.55 0.00 0.00 27.41 29.14 1s6y h HIS 29 CO -0.00 0.10 -0.82 0.93 -1.30 0.00 0.00 177.93 176.83 1s6y h GLU 30 N 0.45 0.07 -3.39 5.26 5.08 -1.51 -3.42 114.58 117.11 1s6y h GLU 30 Ca 0.36 -0.08 -0.63 0.00 -1.00 0.00 0.00 59.36 58.01 1s6y h GLU 30 Cb 0.47 0.02 -0.41 0.00 0.50 0.00 0.00 28.75 29.34 1s6y h GLU 30 CO -0.34 0.85 -0.67 -0.51 -1.00 0.00 0.00 179.01 177.34 1s6y s LEU 31 N -7.28 3.87 -0.90 1.33 1.43 0.52 -4.89 118.68 112.77 1s6y s LEU 31 Ca -0.01 -2.81 -0.22 0.00 -1.03 0.00 0.00 54.13 50.06 1s6y s LEU 31 Cb 0.11 -1.46 -0.13 0.00 0.03 0.00 0.00 46.19 44.73 1s6y s LEU 31 CO 0.80 -0.26 1.93 -0.81 0.23 0.00 0.00 176.35 178.24 1s6y n PRO 32 N 3.36 1.57 -2.65 1.29 -0.04 -1.23 -4.44 135.00 132.87 1s6y n PRO 32 Ca 0.06 -2.05 -0.43 0.00 -0.04 0.00 0.00 63.50 61.04 1s6y n PRO 32 Cb 0.34 -3.15 -0.02 0.00 -0.04 0.00 0.00 33.50 30.62 1s6y n PRO 32 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1s6y s VAL 33 N 6.63 4.26 0.02 0.52 1.01 -1.26 -2.25 120.40 129.33 1s6y s VAL 33 Ca 0.60 1.13 -0.18 0.00 0.00 0.00 0.00 61.98 63.53 1s6y s VAL 33 Cb 0.10 -4.57 -0.27 0.00 0.00 0.00 0.00 36.38 31.64 1s6y s VAL 33 CO 0.12 -0.97 1.07 1.23 0.00 0.00 0.00 175.10 176.55 1s6y h GLY 34 N 11.08 0.57 -5.79 4.51 0.00 -0.99 -3.38 103.07 109.06 1s6y h GLY 34 Ca -0.23 -1.14 -0.21 0.00 0.00 0.00 0.00 47.33 45.75 1s6y h GLY 34 CO 1.11 1.00 -0.55 -1.83 0.00 0.00 0.00 176.54 176.27 1s6y s GLU 35 N -2.99 0.16 -0.29 4.80 -1.05 -1.12 -1.76 118.70 116.46 1s6y s GLU 35 Ca -0.11 0.32 0.01 0.00 -0.15 0.00 0.00 54.97 55.03 1s6y s GLU 35 Cb 0.04 -0.03 0.06 0.00 -0.44 0.00 0.00 34.13 33.76 1s6y s GLU 35 CO 0.88 -0.09 -0.04 -1.17 0.95 0.00 0.00 175.26 175.78 1s6y s LEU 36 N 0.63 3.76 -0.33 1.83 2.96 0.36 -1.53 118.68 126.36 1s6y s LEU 36 Ca -0.04 -1.38 -0.19 0.00 -0.22 0.00 0.00 54.13 52.30 1s6y s LEU 36 Cb -0.06 -1.64 -0.01 0.00 0.50 0.00 0.00 46.19 44.98 1s6y s LEU 36 CO -0.03 -0.24 0.55 0.26 -1.32 0.00 0.00 176.35 175.57 1s6y s TRP 37 N 1.17 3.19 -0.40 5.38 0.52 0.09 -0.76 118.94 128.13 1s6y s TRP 37 Ca -0.06 0.35 -0.15 0.00 0.02 0.00 0.00 56.10 56.25 1s6y s TRP 37 Cb -0.20 -2.94 0.01 0.00 -1.15 0.00 0.00 33.47 29.20 1s6y s TRP 37 CO -0.03 -0.50 0.33 -0.51 0.02 0.00 0.00 176.95 176.26 1s6y s LEU 38 N 2.47 4.95 0.15 2.99 1.43 0.18 -0.87 118.68 129.98 1s6y s LEU 38 Ca 0.21 -0.76 0.08 0.00 -1.03 0.00 0.00 54.13 52.63 1s6y s LEU 38 Cb -0.15 -2.23 -0.04 0.00 0.03 0.00 0.00 46.19 43.80 1s6y s LEU 38 CO 0.13 -0.46 -0.07 0.54 0.23 0.00 0.00 176.35 176.72 1s6y s VAL 39 N 1.82 3.41 0.00 -1.59 0.11 -0.72 -2.18 120.40 121.25 1s6y s VAL 39 Ca 0.07 -1.43 0.00 0.00 -2.93 0.00 0.00 61.98 57.69 1s6y s VAL 39 Cb -0.18 -2.66 0.00 0.00 -1.53 0.00 0.00 36.38 32.01 1s6y s VAL 39 CO 0.11 -0.02 0.00 -0.67 -3.33 0.00 0.00 175.10 171.19 1s6y n ASP 40 N 0.27 0.00 -4.34 3.54 2.03 -1.04 0.03 116.55 117.04 1s6y n ASP 40 Ca -0.12 -0.84 -0.22 0.00 0.52 0.00 0.00 54.79 54.14 1s6y n ASP 40 Cb 0.54 0.00 -0.11 0.00 -0.72 0.00 0.00 41.12 40.83 1s6y n ASP 40 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 1s6y s ILE 41 N -2.95 1.84 0.35 5.18 -4.36 -1.26 -4.39 121.20 115.60 1s6y s ILE 41 Ca 0.00 -1.94 0.17 0.00 -0.26 0.00 0.00 60.65 58.62 1s6y s ILE 41 Cb 0.00 -1.86 0.35 0.00 1.25 0.00 0.00 42.46 42.19 1s6y s ILE 41 CO 0.00 -0.32 1.51 -2.65 0.24 0.00 0.00 174.94 173.72 1s6y n PRO 42 N 0.25 -0.06 0.00 0.37 -0.02 -1.26 -0.10 135.00 134.18 1s6y n PRO 42 Ca -0.13 1.34 0.02 0.00 -2.02 0.00 0.00 63.50 62.71 1s6y n PRO 42 Cb 0.57 -2.36 0.11 0.00 -0.02 0.00 0.00 33.50 31.80 1s6y n PRO 42 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1s6y n GLU 43 N -5.21 0.72 -0.95 -0.52 0.28 -1.26 -3.08 120.64 110.62 1s6y n GLU 43 Ca 0.34 0.00 0.01 0.00 -0.16 0.00 0.00 57.16 57.35 1s6y n GLU 43 Cb 1.16 -1.08 -0.00 0.00 1.43 0.00 0.00 31.44 32.94 1s6y n GLU 43 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1s6y n GLY 44 N 0.25 0.75 0.21 -1.84 0.00 0.86 -4.93 105.19 100.50 1s6y n GLY 44 Ca 0.03 -0.33 0.13 0.00 0.00 0.00 0.00 46.02 45.85 1s6y n GLY 44 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1s6y h LYS 45 N 0.39 0.00 -0.02 1.61 2.10 -1.55 -2.09 116.57 117.01 1s6y h LYS 45 Ca -0.16 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.49 1s6y h LYS 45 Cb 1.55 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.88 1s6y h LYS 45 CO 0.00 0.00 0.00 0.93 -2.00 0.00 0.00 179.45 178.39 1s6y h GLU 46 N 0.00 0.03 -0.68 0.07 5.08 -1.92 -1.56 114.58 115.60 1s6y h GLU 46 Ca 0.00 -0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.38 1s6y h GLU 46 Cb 0.92 -0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.13 1s6y h GLU 46 CO 0.00 0.26 0.45 0.87 -1.00 0.00 0.00 179.01 179.58 1s6y h LYS 47 N -0.20 0.81 -0.22 2.33 1.57 -1.83 -0.79 116.57 118.24 1s6y h LYS 47 Ca 0.01 -0.05 -0.10 0.00 -1.87 0.00 0.00 60.65 58.64 1s6y h LYS 47 Cb 0.24 -0.18 -0.00 0.00 0.08 0.00 0.00 32.23 32.36 1s6y h LYS 47 CO 0.00 0.54 -0.25 1.25 -0.57 0.00 0.00 179.45 180.42 1s6y h LEU 48 N 0.83 0.60 -0.61 2.94 5.85 -1.28 -2.06 115.31 121.59 1s6y h LEU 48 Ca 0.26 -0.49 -0.15 0.00 0.84 0.00 0.00 57.88 58.35 1s6y h LEU 48 Cb 0.03 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 40.88 1s6y h LEU 48 CO -0.07 0.97 -0.54 -0.33 -0.34 0.00 0.00 178.44 178.13 1s6y h GLU 49 N 0.25 0.44 0.75 1.25 5.08 -1.04 0.64 114.58 121.95 1s6y h GLU 49 Ca 0.03 -0.27 -0.04 0.00 -1.00 0.00 0.00 59.36 58.08 1s6y h GLU 49 Cb 0.81 0.03 0.01 0.00 0.50 0.00 0.00 28.75 30.10 1s6y h GLU 49 CO 0.06 0.87 -0.36 0.82 -1.00 0.00 0.00 179.01 179.40 1s6y h ILE 50 N 0.34 0.00 -0.09 3.13 5.03 -1.14 -2.74 117.51 122.04 1s6y h ILE 50 Ca 0.01 -0.07 -0.10 0.00 -0.12 0.00 0.00 64.86 64.57 1s6y h ILE 50 Cb 1.06 0.00 -0.01 0.00 -3.03 0.00 0.00 36.82 34.83 1s6y h ILE 50 CO 0.09 0.00 -0.39 -0.37 -0.68 0.00 0.00 178.15 176.80 1s6y h VAL 51 N -1.08 1.30 -0.71 1.67 -1.51 -1.39 -2.70 116.25 111.84 1s6y h VAL 51 Ca -0.10 -1.45 0.04 0.00 -1.23 0.00 0.00 66.70 63.96 1s6y h VAL 51 Cb 0.77 1.67 -0.04 0.00 -2.13 0.00 0.00 31.29 31.55 1s6y h VAL 51 CO 0.17 0.43 0.47 1.23 -1.23 0.00 0.00 177.57 178.64 1s6y h GLY 52 N 1.19 0.97 0.86 5.19 0.00 0.25 -1.77 103.07 109.76 1s6y h GLY 52 Ca 0.02 -0.33 -0.16 0.00 0.00 0.00 0.00 47.33 46.86 1s6y h GLY 52 CO 0.06 0.27 -0.60 0.00 0.00 0.00 0.00 176.54 176.27 1s6y h ALA 53 N 1.59 0.13 -0.53 3.60 0.00 -1.16 -2.80 119.26 120.09 1s6y h ALA 53 Ca 0.29 -0.56 0.04 0.00 0.00 0.00 0.00 54.91 54.68 1s6y h ALA 53 Cb 0.11 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 1s6y h ALA 53 CO -0.09 0.39 0.29 1.25 0.00 0.00 0.00 179.25 181.10 1s6y h LEU 54 N 0.03 0.44 -1.33 0.00 7.12 -1.42 -1.78 115.31 118.36 1s6y h LEU 54 Ca -0.06 0.02 0.16 0.00 0.13 0.00 0.00 57.88 58.13 1s6y h LEU 54 Cb 1.29 -0.07 -0.07 0.00 -0.53 0.00 0.00 40.66 41.28 1s6y h LEU 54 CO 0.12 0.30 0.58 0.00 -0.13 0.00 0.00 178.44 179.31 1s6y h ALA 55 N 1.27 1.92 -0.14 1.25 0.00 -1.28 -1.51 119.26 120.77 1s6y h ALA 55 Ca 0.23 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.11 1s6y h ALA 55 Cb 0.10 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1s6y h ALA 55 CO -0.14 -0.18 -0.12 0.87 0.00 0.00 0.00 179.25 179.68 1s6y h LYS 56 N 0.62 0.33 -0.10 0.00 1.79 -1.09 -2.83 116.57 115.29 1s6y h LYS 56 Ca 0.46 -0.17 0.00 0.00 -2.18 0.00 0.00 60.65 58.76 1s6y h LYS 56 Cb 0.85 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.50 1s6y h LYS 56 CO -0.21 0.71 0.00 0.54 -1.08 0.00 0.00 179.45 179.41 1s6y n ARG 57 N -4.59 0.00 0.00 3.15 1.74 -0.57 -2.28 116.66 114.11 1s6y n ARG 57 Ca -0.06 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.02 1s6y n ARG 57 Cb 0.34 -0.92 0.00 0.00 -1.02 0.00 0.00 32.46 30.87 1s6y n ARG 57 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 1s6y n VAL 59 N 0.42 0.00 0.03 1.55 0.24 -1.07 0.10 118.33 119.61 1s6y n VAL 59 Ca 0.00 0.00 -0.10 0.00 -2.04 0.00 0.00 64.34 62.20 1s6y n VAL 59 Cb 0.00 0.00 0.03 0.00 -1.47 0.00 0.00 33.84 32.40 1s6y n VAL 59 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 1s6y h GLU 60 N 0.00 0.48 -0.86 7.34 4.81 -1.67 0.49 114.58 125.17 1s6y h GLU 60 Ca 0.00 -0.36 -0.03 0.00 -0.13 0.00 0.00 59.36 58.84 1s6y h GLU 60 Cb 0.00 0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.40 1s6y h GLU 60 CO 0.00 0.98 0.43 -0.22 -0.73 0.00 0.00 179.01 179.47 1s6y h LYS 61 N 0.34 1.23 0.00 1.92 3.11 -0.56 -2.08 116.57 120.53 1s6y h LYS 61 Ca -0.02 -0.17 0.00 0.00 -2.81 0.00 0.00 60.65 57.65 1s6y h LYS 61 Cb 1.24 -0.23 0.00 0.00 -1.00 0.00 0.00 32.23 32.24 1s6y h LYS 61 CO 0.12 0.93 0.00 0.00 -2.81 0.00 0.00 179.45 177.69 1s6y n ALA 62 N -2.41 2.50 -3.46 5.00 0.00 -1.16 -4.96 120.51 116.02 1s6y n ALA 62 Ca 0.09 -0.15 -0.18 0.00 0.00 0.00 0.00 53.44 53.20 1s6y n ALA 62 Cb 0.13 -1.49 0.08 0.00 0.00 0.00 0.00 19.45 18.17 1s6y n ALA 62 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1s6y n GLY 63 N 1.23 -0.35 3.02 0.00 0.00 -0.18 -5.02 105.19 103.89 1s6y n GLY 63 Ca 0.15 0.10 -0.28 0.00 0.00 0.00 0.00 46.02 46.00 1s6y n GLY 63 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1s6y s VAL 64 N -3.40 1.40 -0.28 1.61 1.01 -0.01 -5.02 120.40 115.71 1s6y s VAL 64 Ca 0.00 -0.56 -0.04 0.00 0.00 0.00 0.00 61.98 61.38 1s6y s VAL 64 Cb -0.00 -1.31 -0.01 0.00 0.00 0.00 0.00 36.38 35.06 1s6y s VAL 64 CO 0.74 0.43 2.85 -0.81 0.00 0.00 0.00 175.10 178.30 1s6y n PRO 65 N 4.45 2.11 -2.68 2.72 -0.04 -1.26 -4.43 135.00 135.87 1s6y n PRO 65 Ca -0.18 -1.71 -0.42 0.00 -0.04 0.00 0.00 63.50 61.15 1s6y n PRO 65 Cb 0.51 -1.95 -0.03 0.00 -0.04 0.00 0.00 33.50 31.99 1s6y n PRO 65 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1s6y s ILE 66 N -1.22 4.78 -0.26 0.52 1.01 -1.26 -4.80 121.20 119.98 1s6y s ILE 66 Ca 0.53 2.02 -0.28 0.00 0.00 0.00 0.00 60.65 62.93 1s6y s ILE 66 Cb 0.32 -4.30 0.01 0.00 0.01 0.00 0.00 42.46 38.50 1s6y s ILE 66 CO -0.11 0.06 1.00 -1.61 0.00 0.00 0.00 174.94 174.28 1s6y s GLU 67 N 1.65 4.19 -0.32 2.79 0.41 -0.72 -4.93 118.70 121.77 1s6y s GLU 67 Ca 0.50 1.19 -0.21 0.00 -0.41 0.00 0.00 54.97 56.04 1s6y s GLU 67 Cb -0.20 -3.67 -0.00 0.00 -1.78 0.00 0.00 34.13 28.48 1s6y s GLU 67 CO 0.22 -0.67 0.68 0.42 -0.49 0.00 0.00 175.26 175.42 1s6y s ILE 68 N 3.23 4.88 -0.12 -1.63 -1.09 -1.26 -0.49 121.20 124.72 1s6y s ILE 68 Ca 0.42 0.91 -0.01 0.00 -2.23 0.00 0.00 60.65 59.74 1s6y s ILE 68 Cb -0.14 -4.06 -0.03 0.00 -1.58 0.00 0.00 42.46 36.65 1s6y s ILE 68 CO 0.09 -0.21 -0.06 -1.00 -1.23 0.00 0.00 174.94 172.52 1s6y s HIS 69 N 2.75 2.96 -0.15 3.97 3.76 0.06 -4.97 115.29 123.67 1s6y s HIS 69 Ca 0.27 -0.22 -0.04 0.00 -0.15 0.00 0.00 55.06 54.92 1s6y s HIS 69 Cb -0.15 -1.85 -0.03 0.00 1.11 0.00 0.00 32.58 31.67 1s6y s HIS 69 CO 0.13 0.08 -0.01 -0.51 -0.85 0.00 0.00 174.74 173.58 1s6y s LEU 70 N -0.09 3.44 0.11 0.89 1.02 -1.26 0.48 118.68 123.26 1s6y s LEU 70 Ca 0.01 -0.04 -0.19 0.00 0.02 0.00 0.00 54.13 53.93 1s6y s LEU 70 Cb -0.13 -1.83 0.05 0.00 0.02 0.00 0.00 46.19 44.29 1s6y s LEU 70 CO 0.03 0.20 0.47 0.28 0.02 0.00 0.00 176.35 177.34 1s6y s THR 71 N 0.20 0.05 -1.85 5.49 -1.32 -0.92 -4.97 115.64 112.30 1s6y s THR 71 Ca -0.00 -0.38 0.18 0.00 -1.21 0.00 0.00 61.69 60.27 1s6y s THR 71 Cb -0.13 -1.08 0.33 0.00 -1.51 0.00 0.00 72.50 70.11 1s6y s THR 71 CO 0.02 -0.21 1.26 0.18 -2.21 0.00 0.00 174.62 173.66 1s6y n LEU 72 N -0.08 3.04 -4.13 9.08 4.77 -1.26 -2.50 117.00 125.92 1s6y n LEU 72 Ca -0.17 -1.54 -0.37 0.00 -0.03 0.00 0.00 56.01 53.90 1s6y n LEU 72 Cb 0.63 -0.20 -0.11 0.00 -2.33 0.00 0.00 43.42 41.41 1s6y n LEU 72 CO 0.17 0.67 -0.13 -0.62 -1.33 0.00 0.00 177.39 176.15 1s6y s ASP 73 N -1.23 5.32 0.28 -1.43 3.68 -1.26 -4.82 116.67 117.21 1s6y s ASP 73 Ca 0.30 -2.09 0.26 0.00 2.13 0.00 0.00 52.55 53.15 1s6y s ASP 73 Cb 0.17 -1.86 0.80 0.00 -1.45 0.00 0.00 42.92 40.59 1s6y s ASP 73 CO 0.24 -0.55 1.75 0.08 0.13 0.00 0.00 175.17 176.82 1s6y h ARG 74 N 8.01 0.00 0.00 4.34 0.11 -1.90 -2.89 114.38 122.06 1s6y h ARG 74 Ca -0.13 0.00 -0.05 0.00 0.10 0.00 0.00 59.98 59.90 1s6y h ARG 74 Cb 1.04 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.12 1s6y h ARG 74 CO 0.72 0.00 -0.24 0.00 0.10 0.00 0.00 179.97 180.55 1s6y h ARG 75 N 0.00 0.00 -0.08 0.08 3.08 -1.98 0.44 114.38 115.92 1s6y h ARG 75 Ca 0.00 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 59.88 1s6y h ARG 75 Cb 0.70 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.76 1s6y h ARG 75 CO 0.00 0.24 -0.62 -0.09 -1.07 0.00 0.00 179.97 178.44 1s6y h ARG 76 N 0.00 0.56 -0.32 0.04 2.43 -1.91 -2.02 114.38 113.16 1s6y h ARG 76 Ca -0.00 -0.49 -0.10 0.00 -0.81 0.00 0.00 59.98 58.57 1s6y h ARG 76 Cb 0.45 0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.10 1s6y h ARG 76 CO 0.03 1.12 -0.22 0.00 -1.51 0.00 0.00 179.97 179.39 1s6y h ALA 77 N 0.45 1.02 0.00 2.80 0.00 -1.55 -3.16 119.26 118.81 1s6y h ALA 77 Ca -0.05 -0.35 -0.09 0.00 0.00 0.00 0.00 54.91 54.42 1s6y h ALA 77 Cb 1.27 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 1s6y h ALA 77 CO 0.13 0.59 -0.44 -0.07 0.00 0.00 0.00 179.25 179.45 1s6y h LEU 78 N 0.55 0.00 -8.58 0.00 3.38 -0.93 -3.41 115.31 106.31 1s6y h LEU 78 Ca 0.08 0.00 -0.65 0.00 0.09 0.00 0.00 57.88 57.41 1s6y h LEU 78 Cb 0.67 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.41 1s6y h LEU 78 CO 0.05 0.44 1.45 -0.67 0.09 0.00 0.00 178.44 179.80 1s6y n ASP 79 N -3.24 2.23 -0.53 -0.43 -0.08 -0.76 -1.04 116.55 112.71 1s6y n ASP 79 Ca 0.02 0.33 -0.07 0.00 -1.51 0.00 0.00 54.79 53.56 1s6y n ASP 79 Cb 0.69 -1.31 -0.03 0.00 2.34 0.00 0.00 41.12 42.82 1s6y n ASP 79 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1s6y n GLY 80 N 6.43 0.85 3.76 0.27 0.00 -0.42 -4.99 105.19 111.09 1s6y n GLY 80 Ca 0.40 -0.32 -0.36 0.00 0.00 0.00 0.00 46.02 45.74 1s6y n GLY 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s6y s ALA 81 N -2.05 2.64 -0.19 4.61 0.00 -0.20 -4.75 121.76 121.82 1s6y s ALA 81 Ca 0.00 0.99 0.08 0.00 0.00 0.00 0.00 51.96 53.03 1s6y s ALA 81 Cb 0.00 -3.43 -0.22 0.00 0.00 0.00 0.00 23.12 19.47 1s6y s ALA 81 CO 0.00 -1.04 0.07 -0.25 0.00 0.00 0.00 175.76 174.54 1s6y n ASP 82 N -1.36 1.12 -4.05 0.00 9.92 -0.44 -4.39 116.55 117.35 1s6y n ASP 82 Ca 0.12 0.03 -0.17 0.00 -0.53 0.00 0.00 54.79 54.24 1s6y n ASP 82 Cb 0.49 0.10 -0.14 0.00 -0.64 0.00 0.00 41.12 40.93 1s6y n ASP 82 CO 0.00 0.00 0.00 -0.36 0.13 0.00 0.00 177.20 176.97 1s6y s PHE 83 N -2.52 0.82 -0.11 1.24 0.08 -1.15 -2.21 117.98 114.13 1s6y s PHE 83 Ca -0.20 -0.25 0.01 0.00 0.12 0.00 0.00 56.93 56.61 1s6y s PHE 83 Cb 0.07 -0.51 0.02 0.00 -0.57 0.00 0.00 43.02 42.03 1s6y s PHE 83 CO 0.74 -0.01 -0.13 0.08 -0.10 0.00 0.00 175.22 175.80 1s6y s VAL 84 N -0.55 1.34 -0.01 -0.44 1.01 0.11 -1.62 120.40 120.24 1s6y s VAL 84 Ca 0.00 -0.52 0.01 0.00 0.00 0.00 0.00 61.98 61.47 1s6y s VAL 84 Cb -0.05 -1.26 -0.04 0.00 0.00 0.00 0.00 36.38 35.03 1s6y s VAL 84 CO 0.00 0.41 0.02 0.42 0.00 0.00 0.00 175.10 175.96 1s6y s THR 85 N 1.25 4.33 -0.15 3.92 -4.23 0.81 0.31 115.64 121.88 1s6y s THR 85 Ca -0.02 -0.52 0.01 0.00 -1.18 0.00 0.00 61.69 59.98 1s6y s THR 85 Cb -0.14 -2.94 0.02 0.00 1.34 0.00 0.00 72.50 70.78 1s6y s THR 85 CO -0.05 0.39 -0.18 0.42 -0.54 0.00 0.00 174.62 174.66 1s6y s THR 86 N -1.10 1.83 -0.33 3.99 -4.23 -0.67 -0.97 115.64 114.16 1s6y s THR 86 Ca 0.20 -0.82 0.17 0.00 -1.18 0.00 0.00 61.69 60.06 1s6y s THR 86 Cb -0.12 -1.66 0.45 0.00 1.34 0.00 0.00 72.50 72.51 1s6y s THR 86 CO 0.11 0.50 1.03 0.00 -0.54 0.00 0.00 174.62 175.72 1s6y n GLN 87 N 4.45 1.18 -4.17 3.99 10.64 0.46 -0.49 117.38 133.44 1s6y n GLN 87 Ca -0.19 -3.01 -0.22 0.00 -1.83 0.00 0.00 57.00 51.75 1s6y n GLN 87 Cb 0.51 -1.04 -0.06 0.00 -0.86 0.00 0.00 30.24 28.79 1s6y n GLN 87 CO 0.00 0.00 0.00 -0.59 -1.83 0.00 0.00 177.06 174.64 1s6y s PHE 88 N -2.57 2.90 -0.19 2.61 -0.12 -1.21 -4.46 117.98 114.94 1s6y s PHE 88 Ca 0.26 -0.19 0.01 0.00 -0.05 0.00 0.00 56.93 56.95 1s6y s PHE 88 Cb 0.44 -1.37 0.04 0.00 -0.63 0.00 0.00 43.02 41.51 1s6y s PHE 88 CO 0.01 0.52 -0.10 1.03 -0.05 0.00 0.00 175.22 176.64 1s6y s ARG 89 N -3.79 1.96 -0.08 1.99 0.52 -1.26 -4.77 118.95 113.53 1s6y s ARG 89 Ca 0.33 -0.75 -0.26 0.00 -0.52 0.00 0.00 55.73 54.53 1s6y s ARG 89 Cb -0.07 -2.31 -0.03 0.00 0.52 0.00 0.00 34.95 33.07 1s6y s ARG 89 CO 0.23 -0.40 0.83 0.08 0.02 0.00 0.00 175.30 176.05 1s6y s VAL 90 N 1.45 4.94 0.00 3.52 1.01 -1.26 -3.22 120.40 126.84 1s6y s VAL 90 Ca -0.00 1.70 0.00 0.00 0.00 0.00 0.00 61.98 63.68 1s6y s VAL 90 Cb -0.16 -4.16 0.00 0.00 0.00 0.00 0.00 36.38 32.06 1s6y s VAL 90 CO -0.08 0.15 0.00 0.61 0.00 0.00 0.00 175.10 175.78 1s6y n GLY 91 N 3.14 1.93 7.00 4.51 0.00 -1.26 -4.84 105.19 115.67 1s6y n GLY 91 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1s6y n GLY 91 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1s6y n GLY 92 N -2.00 -1.64 0.23 -0.02 0.00 -1.20 -2.30 105.19 98.27 1s6y n GLY 92 Ca 0.00 -1.27 0.12 0.00 0.00 0.00 0.00 46.02 44.87 1s6y n GLY 92 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1s6y h LEU 93 N 0.00 0.00 -0.77 0.99 3.38 -1.92 -2.68 115.31 114.31 1s6y h LEU 93 Ca 0.00 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 1s6y h LEU 93 Cb 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1s6y h LEU 93 CO 0.00 0.17 -0.07 -0.08 0.09 0.00 0.00 178.44 178.55 1s6y h GLU 94 N 0.00 0.87 -0.56 1.13 4.57 -1.93 -0.83 114.58 117.83 1s6y h GLU 94 Ca -0.00 -0.28 -0.11 0.00 -1.18 0.00 0.00 59.36 57.79 1s6y h GLU 94 Cb 0.71 -0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 29.21 1s6y h GLU 94 CO 0.02 0.91 -0.07 0.00 -1.18 0.00 0.00 179.01 178.69 1s6y h ALA 95 N 1.13 0.76 -0.79 2.92 0.00 -1.14 -2.89 119.26 119.25 1s6y h ALA 95 Ca 0.14 -0.34 0.01 0.00 0.00 0.00 0.00 54.91 54.72 1s6y h ALA 95 Cb 0.57 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 1s6y h ALA 95 CO 0.03 0.65 0.52 -0.09 0.00 0.00 0.00 179.25 180.36 1s6y h ARG 96 N 0.91 1.02 -0.65 0.00 2.43 -1.33 -2.59 114.38 114.17 1s6y h ARG 96 Ca 0.15 -0.06 0.04 0.00 -0.81 0.00 0.00 59.98 59.30 1s6y h ARG 96 Cb 0.64 -0.23 -0.04 0.00 -0.42 0.00 0.00 29.97 29.92 1s6y h ARG 96 CO 0.04 0.68 0.43 0.00 -1.51 0.00 0.00 179.97 179.61 1s6y h ALA 97 N 1.30 1.69 -0.37 2.80 0.00 -0.95 -1.06 119.26 122.67 1s6y h ALA 97 Ca 0.29 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 55.05 1s6y h ALA 97 Cb -0.10 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 1s6y h ALA 97 CO -0.07 0.22 -0.26 0.87 0.00 0.00 0.00 179.25 180.01 1s6y h LYS 98 N 0.72 0.77 -0.68 0.00 1.79 -1.31 -0.70 116.57 117.17 1s6y h LYS 98 Ca 0.27 -0.33 -0.03 0.00 -2.18 0.00 0.00 60.65 58.38 1s6y h LYS 98 Cb 0.15 -0.02 -0.03 0.00 -1.58 0.00 0.00 32.23 30.75 1s6y h LYS 98 CO -0.08 0.95 0.30 -0.44 -1.08 0.00 0.00 179.45 179.10 1s6y h ASP 99 N 0.66 0.89 0.68 0.86 3.32 -0.85 -1.56 116.42 120.42 1s6y h ASP 99 Ca 0.08 -0.11 -0.26 0.00 0.02 0.00 0.00 57.03 56.76 1s6y h ASP 99 Cb 0.78 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 40.08 1s6y h ASP 99 CO 0.06 0.77 -1.36 -0.33 -1.72 0.00 0.00 179.24 176.66 1s6y h GLU 100 N 0.96 0.08 0.11 3.56 5.08 -1.21 -3.37 114.58 119.81 1s6y h GLU 100 Ca 0.23 -0.14 -0.25 0.00 -1.00 0.00 0.00 59.36 58.20 1s6y h GLU 100 Cb 0.14 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.45 1s6y h GLU 100 CO -0.03 0.90 -1.22 0.00 -1.00 0.00 0.00 179.01 177.66 1s6y h ARG 101 N 0.02 0.24 -0.11 2.33 3.08 -1.05 -3.39 114.38 115.51 1s6y h ARG 101 Ca -0.16 -0.41 0.02 0.00 0.07 0.00 0.00 59.98 59.50 1s6y h ARG 101 Cb 1.92 0.15 -0.02 0.00 0.08 0.00 0.00 29.97 32.10 1s6y h ARG 101 CO 0.13 1.20 -0.04 0.82 -1.07 0.00 0.00 179.97 181.00 1s6y h ILE 102 N -0.37 0.85 0.00 2.04 2.04 -1.48 -2.88 117.51 117.71 1s6y h ILE 102 Ca -0.26 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.54 1s6y h ILE 102 Cb 1.69 0.85 -0.01 0.00 -0.74 0.00 0.00 36.82 38.62 1s6y h ILE 102 CO 0.07 0.00 -0.31 -0.65 0.00 0.00 0.00 178.15 177.26 1s6y h PRO 103 N -0.03 0.00 -1.00 2.37 0.11 -1.80 -2.94 132.00 128.71 1s6y h PRO 103 Ca 0.06 0.00 0.18 0.00 0.11 0.00 0.00 66.00 66.35 1s6y h PRO 103 Cb 0.11 0.00 -0.10 0.00 0.11 0.00 0.00 31.00 31.12 1s6y h PRO 103 CO -0.13 0.31 0.62 -0.07 -0.21 0.00 0.00 178.00 178.52 1s6y h LEU 104 N 0.00 0.80 -1.54 2.35 4.07 -1.43 0.75 115.31 120.32 1s6y h LEU 104 Ca -0.00 0.09 0.17 0.00 0.08 0.00 0.00 57.88 58.22 1s6y h LEU 104 Cb 0.57 -0.06 -0.06 0.00 1.08 0.00 0.00 40.66 42.19 1s6y h LEU 104 CO 0.04 0.31 0.55 0.11 -1.08 0.00 0.00 178.44 178.37 1s6y h LYS 105 N 0.80 0.41 -0.09 1.13 1.57 -1.60 -1.56 116.57 117.23 1s6y h LYS 105 Ca 0.56 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.32 1s6y h LYS 105 Cb 0.84 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.06 1s6y h LYS 105 CO -0.36 0.27 0.00 0.66 -0.57 0.00 0.00 179.45 179.45 1s6y n TYR 106 N -4.49 0.09 -1.63 -1.35 4.01 0.21 -4.91 117.16 109.09 1s6y n TYR 106 Ca 0.16 -0.05 -0.03 0.00 -0.16 0.00 0.00 57.90 57.82 1s6y n TYR 106 Cb 0.60 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.62 1s6y n TYR 106 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1s6y n GLY 107 N 1.24 0.41 3.49 2.72 0.00 -0.59 -5.05 105.19 107.42 1s6y n GLY 107 Ca 0.17 -0.83 -0.31 0.00 0.00 0.00 0.00 46.02 45.06 1s6y n GLY 107 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1s6y s VAL 108 N -2.15 2.94 0.12 1.61 1.01 -0.88 -5.01 120.40 118.03 1s6y s VAL 108 Ca 0.00 -1.19 -0.35 0.00 0.00 0.00 0.00 61.98 60.44 1s6y s VAL 108 Cb 0.00 -2.27 -0.16 0.00 0.00 0.00 0.00 36.38 33.95 1s6y s VAL 108 CO 0.00 0.29 1.30 -0.38 0.00 0.00 0.00 175.10 176.32 1s6y n ILE 109 N 1.38 0.27 -4.02 2.22 2.08 -1.26 -3.06 119.36 116.97 1s6y n ILE 109 Ca -0.16 -0.07 -0.31 0.00 0.56 0.00 0.00 62.75 62.77 1s6y n ILE 109 Cb 0.52 -0.88 -0.15 0.00 -0.75 0.00 0.00 39.64 38.38 1s6y n ILE 109 CO 0.00 0.00 0.00 -0.83 0.56 0.00 0.00 176.55 176.28 1s6y s GLY 110 N 0.36 1.78 0.01 7.39 0.00 -1.26 -4.45 107.32 111.15 1s6y s GLY 110 Ca 0.81 -2.18 -0.17 0.00 0.00 0.00 0.00 44.72 43.17 1s6y s GLY 110 CO 0.48 0.85 0.37 1.62 0.00 0.00 0.00 173.10 176.42 1s6y s GLN 111 N 1.02 0.79 0.34 2.90 -0.44 -1.25 -4.58 119.66 118.43 1s6y s GLN 111 Ca 0.03 -0.24 0.07 0.00 -2.50 0.00 0.00 55.36 52.72 1s6y s GLN 111 Cb -0.19 0.35 0.62 0.00 -1.64 0.00 0.00 33.01 32.15 1s6y s GLN 111 CO -0.08 -0.24 1.83 1.05 0.50 0.00 0.00 175.29 178.35 1s6y h GLU 112 N 3.47 0.31 0.00 1.67 4.11 -1.91 -3.14 114.58 119.08 1s6y h GLU 112 Ca -0.30 -0.09 0.00 0.00 0.07 0.00 0.00 59.36 59.04 1s6y h GLU 112 Cb 1.18 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.40 1s6y h GLU 112 CO 0.42 0.51 0.00 0.25 0.07 0.00 0.00 179.01 180.25 1s6y n THR 113 N -4.19 0.00 -4.94 -1.06 -2.24 -1.26 -3.12 114.28 97.47 1s6y n THR 113 Ca -0.01 -0.48 -0.26 0.00 -2.27 0.00 0.00 64.05 61.02 1s6y n THR 113 Cb 0.34 1.03 -0.15 0.00 -2.10 0.00 0.00 70.33 69.44 1s6y n THR 113 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 1s6y s ASN 114 N -0.12 2.36 0.21 3.42 0.01 -1.24 -4.50 114.94 115.08 1s6y s ASN 114 Ca 0.00 -0.38 0.00 0.00 -0.71 0.00 0.00 52.86 51.77 1s6y s ASN 114 Cb 0.00 -0.26 0.00 0.00 0.41 0.00 0.00 41.25 41.40 1s6y s ASN 114 CO 0.00 0.24 0.00 0.61 -1.51 0.00 0.00 177.10 176.44 1s6y n GLY 115 N 2.52 -0.85 0.29 0.66 0.00 -1.26 -3.52 105.19 103.03 1s6y n GLY 115 Ca -0.15 -1.18 0.09 0.00 0.00 0.00 0.00 46.02 44.78 1s6y n GLY 115 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1s6y h PRO 116 N 0.00 0.20 -0.21 1.61 0.11 -1.89 -1.92 132.00 129.89 1s6y h PRO 116 Ca 0.00 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 66.03 1s6y h PRO 116 Cb 0.00 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 31.05 1s6y h PRO 116 CO 0.00 0.13 -0.15 0.78 -0.21 0.00 0.00 178.00 178.55 1s6y h GLY 117 N 0.20 0.38 1.85 -0.55 0.00 -1.69 -0.09 103.07 103.17 1s6y h GLY 117 Ca 0.49 -0.26 -0.13 0.00 0.00 0.00 0.00 47.33 47.43 1s6y h GLY 117 CO -0.62 0.24 -0.55 -1.33 0.00 0.00 0.00 176.54 174.28 1s6y h GLY 118 N 0.88 0.17 0.86 4.60 0.00 -1.35 -0.03 103.07 108.20 1s6y h GLY 118 Ca 0.06 -0.20 -0.02 0.00 0.00 0.00 0.00 47.33 47.17 1s6y h GLY 118 CO 0.03 0.18 -0.23 -2.00 0.00 0.00 0.00 176.54 174.51 1s6y h LEU 119 N 0.12 -0.54 -1.34 3.11 5.85 -0.47 -2.42 115.31 119.61 1s6y h LEU 119 Ca -0.00 -0.05 -0.07 0.00 0.84 0.00 0.00 57.88 58.60 1s6y h LEU 119 Cb 1.00 0.14 -0.01 0.00 0.37 0.00 0.00 40.66 42.16 1s6y h LEU 119 CO 0.08 -0.28 -0.33 -0.26 -0.34 0.00 0.00 178.44 177.31 1s6y h PHE 120 N -0.80 0.01 -0.44 1.25 -1.00 -1.05 -1.02 116.94 113.89 1s6y h PHE 120 Ca -0.07 -0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.69 1s6y h PHE 120 Cb 0.56 -0.00 -0.02 0.00 3.61 0.00 0.00 35.95 40.10 1s6y h PHE 120 CO -0.01 0.33 0.17 -0.22 -1.61 0.00 0.00 178.31 176.97 1s6y h LYS 121 N 0.01 0.67 0.27 1.51 3.64 -1.02 -1.36 116.57 120.29 1s6y h LYS 121 Ca -0.00 -0.13 0.00 0.00 -1.27 0.00 0.00 60.65 59.25 1s6y h LYS 121 Cb 0.58 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.27 1s6y h LYS 121 CO 0.04 0.62 -0.28 0.78 -2.27 0.00 0.00 179.45 178.34 1s6y h GLY 122 N 0.57 -0.64 -0.01 5.01 0.00 -0.86 -0.41 103.07 106.74 1s6y h GLY 122 Ca 0.15 0.33 0.22 0.00 0.00 0.00 0.00 47.33 48.02 1s6y h GLY 122 CO -0.01 -0.25 0.61 1.41 0.00 0.00 0.00 176.54 178.30 1s6y h LEU 123 N -0.59 0.70 -0.17 3.11 4.07 -1.15 -0.23 115.31 121.04 1s6y h LEU 123 Ca -0.01 0.11 -0.15 0.00 0.08 0.00 0.00 57.88 57.92 1s6y h LEU 123 Cb 0.55 -0.01 0.00 0.00 1.08 0.00 0.00 40.66 42.29 1s6y h LEU 123 CO -0.07 0.18 -0.47 0.03 -1.08 0.00 0.00 178.44 177.04 1s6y h ARG 124 N 0.64 0.62 0.07 1.13 3.08 -0.96 -3.40 114.38 115.56 1s6y h ARG 124 Ca 0.61 -0.44 -0.09 0.00 0.07 0.00 0.00 59.98 60.13 1s6y h ARG 124 Cb 1.10 0.07 0.01 0.00 0.08 0.00 0.00 29.97 31.23 1s6y h ARG 124 CO -0.41 1.06 -0.41 1.15 -1.07 0.00 0.00 179.97 180.29 1s6y h THR 125 N 0.28 1.65 -0.27 2.04 2.02 -0.14 -3.39 112.91 115.11 1s6y h THR 125 Ca -0.01 -2.43 -0.07 0.00 0.77 0.00 0.00 66.41 64.67 1s6y h THR 125 Cb 1.08 3.29 -0.02 0.00 -1.74 0.00 0.00 68.15 70.77 1s6y h THR 125 CO 0.10 0.66 -0.15 0.16 0.37 0.00 0.00 175.52 176.67 1s6y h ILE 126 N -0.67 1.23 -0.77 3.11 3.07 -1.29 -1.79 117.51 120.40 1s6y h ILE 126 Ca -0.07 -1.04 0.12 0.00 1.55 0.00 0.00 64.86 65.42 1s6y h ILE 126 Cb 1.32 1.19 -0.08 0.00 -0.27 0.00 0.00 36.82 38.98 1s6y h ILE 126 CO 0.08 0.33 0.38 -0.65 -1.05 0.00 0.00 178.15 177.24 1s6y h PRO 127 N 0.42 0.58 -0.45 0.16 0.11 -1.78 0.30 132.00 131.34 1s6y h PRO 127 Ca 0.08 -0.03 -0.11 0.00 0.11 0.00 0.00 66.00 66.04 1s6y h PRO 127 Cb 0.51 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 31.47 1s6y h PRO 127 CO 0.03 0.38 -0.16 0.28 -0.21 0.00 0.00 178.00 178.32 1s6y h VAL 128 N 0.59 1.27 -0.61 3.15 2.07 -1.56 -1.82 116.25 119.34 1s6y h VAL 128 Ca 0.40 -1.28 -0.09 0.00 0.82 0.00 0.00 66.70 66.55 1s6y h VAL 128 Cb 0.51 1.09 -0.02 0.00 -1.52 0.00 0.00 31.29 31.34 1s6y h VAL 128 CO -0.32 0.44 0.02 0.40 0.02 0.00 0.00 177.57 178.13 1s6y h ILE 129 N 0.77 1.26 -0.54 4.57 1.08 -0.44 -0.74 117.51 123.48 1s6y h ILE 129 Ca 0.12 -1.12 -0.02 0.00 -0.39 0.00 0.00 64.86 63.45 1s6y h ILE 129 Cb 0.69 0.77 -0.03 0.00 -3.07 0.00 0.00 36.82 35.18 1s6y h ILE 129 CO 0.05 0.41 0.26 -0.07 -0.69 0.00 0.00 178.15 178.11 1s6y h LEU 130 N 0.97 0.67 0.22 1.44 3.38 -0.24 -1.19 115.31 120.56 1s6y h LEU 130 Ca 0.18 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 1s6y h LEU 130 Cb 0.53 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.11 1s6y h LEU 130 CO 0.03 0.57 -0.10 0.44 0.09 0.00 0.00 178.44 179.46 1s6y h ASP 131 N 0.75 -0.25 -0.86 -0.43 3.45 -0.88 -2.09 116.42 116.11 1s6y h ASP 131 Ca 0.19 -0.12 0.12 0.00 0.43 0.00 0.00 57.03 57.65 1s6y h ASP 131 Cb 0.08 0.06 -0.08 0.00 -0.56 0.00 0.00 39.33 38.83 1s6y h ASP 131 CO -0.03 -0.03 0.48 0.40 -1.57 0.00 0.00 179.24 178.50 1s6y h ILE 132 N -0.46 0.84 -0.30 0.35 2.04 -0.91 -1.14 117.51 117.92 1s6y h ILE 132 Ca -0.03 -0.26 -0.08 0.00 1.00 0.00 0.00 64.86 65.49 1s6y h ILE 132 Cb 0.35 0.02 -0.02 0.00 -0.74 0.00 0.00 36.82 36.44 1s6y h ILE 132 CO 0.05 0.14 -0.15 0.40 0.00 0.00 0.00 178.15 178.59 1s6y h ILE 133 N 0.75 1.24 -0.21 -0.67 2.04 -1.15 -2.65 117.51 116.85 1s6y h ILE 133 Ca 0.44 -1.08 0.02 0.00 1.00 0.00 0.00 64.86 65.23 1s6y h ILE 133 Cb 0.50 1.17 -0.02 0.00 -0.74 0.00 0.00 36.82 37.73 1s6y h ILE 133 CO -0.30 0.35 0.07 -0.09 0.00 0.00 0.00 178.15 178.19 1s6y h ARG 134 N 0.48 0.16 -1.55 2.37 2.43 -0.51 -1.39 114.38 116.38 1s6y h ARG 134 Ca 0.09 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.25 1s6y h ARG 134 Cb 0.54 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.05 1s6y h ARG 134 CO 0.03 0.11 0.00 -0.25 -1.51 0.00 0.00 179.97 178.35 1s6y n ASP 135 N -5.05 0.20 -1.59 -3.80 10.43 -0.80 -4.35 116.55 111.58 1s6y n ASP 135 Ca -0.02 -0.15 -0.05 0.00 2.57 0.00 0.00 54.79 57.14 1s6y n ASP 135 Cb 0.08 -0.04 -0.01 0.00 1.84 0.00 0.00 41.12 42.99 1s6y n ASP 135 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 1s6y n GLU 137 N 0.86 -1.29 0.07 -1.24 1.02 -0.53 -1.36 120.64 118.17 1s6y n GLU 137 Ca 0.00 0.02 0.00 0.00 -0.02 0.00 0.00 57.16 57.16 1s6y n GLU 137 Cb 0.03 -1.28 0.00 0.00 -0.02 0.00 0.00 31.44 30.18 1s6y n GLU 137 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1s6y n GLU 138 N -1.02 0.00 0.19 3.49 2.13 -1.26 -4.86 120.64 119.31 1s6y n GLU 138 Ca 0.01 0.00 0.06 0.00 0.66 0.00 0.00 57.16 57.90 1s6y n GLU 138 Cb 0.13 0.00 0.35 0.00 0.27 0.00 0.00 31.44 32.19 1s6y n GLU 138 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 1s6y h LEU 139 N 0.00 0.00 -5.00 4.31 -0.00 -1.55 -3.40 115.31 109.67 1s6y h LEU 139 Ca 0.00 0.00 -0.16 0.00 -0.00 0.00 0.00 57.88 57.72 1s6y h LEU 139 Cb 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 40.66 40.52 1s6y h LEU 139 CO 0.00 0.35 -0.36 0.00 -0.00 0.00 0.00 178.44 178.43 1s6y n PRO 141 N 1.85 0.14 0.04 0.00 -0.04 -1.26 -2.51 135.00 133.22 1s6y n PRO 141 Ca 0.09 0.34 0.12 0.00 -0.04 0.00 0.00 63.50 64.01 1s6y n PRO 141 Cb 0.64 -1.75 0.21 0.00 -0.04 0.00 0.00 33.50 32.56 1s6y n PRO 141 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1s6y n ASP 142 N -2.02 0.59 -4.81 3.54 5.68 -1.26 -4.99 116.55 113.28 1s6y n ASP 142 Ca 0.03 0.00 -0.31 0.00 -0.50 0.00 0.00 54.79 54.02 1s6y n ASP 142 Cb 0.24 0.18 0.07 0.00 -1.14 0.00 0.00 41.12 40.47 1s6y n ASP 142 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1s6y s ALA 143 N -3.10 2.47 -0.13 2.12 0.00 -1.04 -5.03 121.76 117.04 1s6y s ALA 143 Ca 0.08 0.00 -0.11 0.00 0.00 0.00 0.00 51.96 51.94 1s6y s ALA 143 Cb 0.15 -3.16 -0.05 0.00 0.00 0.00 0.00 23.12 20.06 1s6y s ALA 143 CO 0.71 -1.47 0.21 -1.58 0.00 0.00 0.00 175.76 173.64 1s6y s TRP 144 N -3.07 3.54 -0.33 0.00 0.52 -0.94 -4.83 118.94 113.84 1s6y s TRP 144 Ca 0.59 0.57 -0.17 0.00 0.02 0.00 0.00 56.10 57.11 1s6y s TRP 144 Cb -0.15 -2.14 -0.01 0.00 -1.15 0.00 0.00 33.47 30.02 1s6y s TRP 144 CO 0.55 0.50 0.46 -1.17 0.02 0.00 0.00 176.95 177.31 1s6y s LEU 145 N -0.34 4.32 -0.42 2.99 0.20 -0.81 -0.72 118.68 123.90 1s6y s LEU 145 Ca 0.15 -0.01 -0.07 0.00 0.69 0.00 0.00 54.13 54.89 1s6y s LEU 145 Cb -0.13 -2.51 0.10 0.00 -0.43 0.00 0.00 46.19 43.22 1s6y s LEU 145 CO 0.04 -0.40 0.25 -0.63 -0.29 0.00 0.00 176.35 175.32 1s6y s ILE 146 N 2.26 3.85 -0.33 6.68 1.09 0.15 -1.74 121.20 133.16 1s6y s ILE 146 Ca 0.17 -1.71 -0.14 0.00 -1.10 0.00 0.00 60.65 57.86 1s6y s ILE 146 Cb -0.16 -3.48 -0.02 0.00 -1.06 0.00 0.00 42.46 37.74 1s6y s ILE 146 CO 0.12 -0.61 0.31 0.21 -0.10 0.00 0.00 174.94 174.87 1s6y s ASN 147 N 2.13 6.13 -0.04 3.58 2.47 -0.48 -1.66 114.94 127.07 1s6y s ASN 147 Ca 0.05 -0.23 0.11 0.00 0.42 0.00 0.00 52.86 53.21 1s6y s ASN 147 Cb -0.24 -2.17 -0.23 0.00 -1.45 0.00 0.00 41.25 37.16 1s6y s ASN 147 CO -0.01 -0.27 0.68 -0.26 -3.72 0.00 0.00 177.10 173.52 1s6y h PHE 148 N 8.44 0.03 -3.16 0.43 -1.00 -1.07 -1.87 116.94 118.74 1s6y h PHE 148 Ca -0.31 -0.02 -0.53 0.00 2.81 0.00 0.00 57.97 59.92 1s6y h PHE 148 Cb 1.15 -0.00 0.07 0.00 3.61 0.00 0.00 35.95 40.78 1s6y h PHE 148 CO 0.69 1.04 0.89 0.99 -1.61 0.00 0.00 178.31 180.31 1s6y s THR 149 N -2.60 2.23 0.12 -1.55 2.01 -0.80 -4.76 115.64 110.29 1s6y s THR 149 Ca -0.05 0.19 -0.02 0.00 0.31 0.00 0.00 61.69 62.12 1s6y s THR 149 Cb 0.08 -3.12 0.03 0.00 0.01 0.00 0.00 72.50 69.50 1s6y s THR 149 CO 0.82 0.03 0.16 0.59 -0.69 0.00 0.00 174.62 175.53 1s6y n ASN 150 N 2.74 0.05 0.00 3.53 3.02 -1.26 -3.60 115.26 119.74 1s6y n ASN 150 Ca 0.10 -1.08 0.00 0.00 -0.03 0.00 0.00 54.58 53.57 1s6y n ASN 150 Cb 0.38 -0.12 0.00 0.00 -0.61 0.00 0.00 39.78 39.43 1s6y n ASN 150 CO 0.00 0.00 0.00 -2.65 -2.62 0.00 0.00 177.26 171.99 1s6y n PRO 151 N -1.33 0.00 0.06 3.52 -0.01 -1.26 -4.62 135.00 131.36 1s6y n PRO 151 Ca 0.02 0.00 0.06 0.00 -0.01 0.00 0.00 63.50 63.58 1s6y n PRO 151 Cb 0.07 0.00 0.50 0.00 -0.01 0.00 0.00 33.50 34.06 1s6y n PRO 151 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 175.50 175.49 1s6y h ALA 152 N 0.00 1.85 0.00 3.55 0.00 -1.86 0.66 119.26 123.46 1s6y h ALA 152 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1s6y h ALA 152 Cb 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1s6y h ALA 152 CO 0.00 0.12 0.00 0.41 0.00 0.00 0.00 179.25 179.78 1s6y n GLY 153 N -1.50 0.23 2.49 0.00 0.00 -1.26 -1.03 105.19 104.11 1s6y n GLY 153 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1s6y n GLY 153 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1s6y n VAL 155 N -0.00 0.00 -0.33 1.61 0.31 0.23 -1.46 118.33 118.69 1s6y n VAL 155 Ca 0.00 0.00 0.10 0.00 -0.01 0.00 0.00 64.34 64.43 1s6y n VAL 155 Cb 0.06 0.00 0.27 0.00 -0.91 0.00 0.00 33.84 33.26 1s6y n VAL 155 CO 0.00 0.00 0.00 0.74 -1.32 0.00 0.00 176.83 176.25 1s6y h THR 156 N 0.00 0.74 -0.09 2.52 2.02 -1.32 -2.18 112.91 114.61 1s6y h THR 156 Ca 0.00 -0.25 0.00 0.00 0.77 0.00 0.00 66.41 66.93 1s6y h THR 156 Cb 0.00 -0.05 -0.01 0.00 -1.74 0.00 0.00 68.15 66.35 1s6y h THR 156 CO 0.00 0.13 0.04 -0.08 0.37 0.00 0.00 175.52 175.98 1s6y h GLU 157 N 0.73 0.09 -0.97 6.66 4.57 -1.51 -1.90 114.58 122.25 1s6y h GLU 157 Ca 0.52 -0.01 0.01 0.00 -1.18 0.00 0.00 59.36 58.71 1s6y h GLU 157 Cb 0.73 -0.02 -0.05 0.00 -0.16 0.00 0.00 28.75 29.25 1s6y h GLU 157 CO -0.36 0.06 0.64 0.00 -1.18 0.00 0.00 179.01 178.17 1s6y h ALA 158 N 1.04 1.24 -0.42 2.92 0.00 -1.70 -0.10 119.26 122.25 1s6y h ALA 158 Ca 0.03 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.78 1s6y h ALA 158 Cb 0.01 -0.39 -0.02 0.00 0.00 0.00 0.00 17.79 17.39 1s6y h ALA 158 CO -0.03 0.61 -0.16 0.28 0.00 0.00 0.00 179.25 179.95 1s6y h VAL 159 N 1.30 1.26 -0.30 0.00 2.07 -1.22 0.18 116.25 119.54 1s6y h VAL 159 Ca 0.36 -1.25 -0.09 0.00 0.82 0.00 0.00 66.70 66.55 1s6y h VAL 159 Cb -0.13 1.11 -0.01 0.00 -1.52 0.00 0.00 31.29 30.75 1s6y h VAL 159 CO -0.08 0.42 -0.15 -0.07 0.02 0.00 0.00 177.57 177.71 1s6y h LEU 160 N 0.70 0.66 0.11 2.57 3.38 -0.93 -3.15 115.31 118.66 1s6y h LEU 160 Ca 0.11 -0.41 -0.31 0.00 0.09 0.00 0.00 57.88 57.36 1s6y h LEU 160 Cb 0.66 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 1s6y h LEU 160 CO 0.05 0.92 -1.61 0.03 0.09 0.00 0.00 178.44 177.92 1s6y h ARG 161 N 0.40 0.24 -0.21 1.13 3.08 -0.88 -3.40 114.38 114.74 1s6y h ARG 161 Ca 0.07 -0.41 0.00 0.00 0.07 0.00 0.00 59.98 59.71 1s6y h ARG 161 Cb 0.68 0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.88 1s6y h ARG 161 CO 0.05 1.08 0.00 0.66 -1.07 0.00 0.00 179.97 180.69 1s6y n TYR 162 N -3.43 0.50 -3.87 3.04 4.01 0.61 -5.01 117.16 113.01 1s6y n TYR 162 Ca -0.19 -0.73 -0.09 0.00 -0.16 0.00 0.00 57.90 56.74 1s6y n TYR 162 Cb 1.05 -0.16 -0.08 0.00 -0.31 0.00 0.00 39.34 39.84 1s6y n TYR 162 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 1s6y s THR 163 N -2.01 0.14 -1.70 -0.72 2.01 -1.19 -4.99 115.64 107.19 1s6y s THR 163 Ca 0.29 -1.19 0.20 0.00 0.31 0.00 0.00 61.69 61.30 1s6y s THR 163 Cb 0.21 -1.28 0.59 0.00 0.01 0.00 0.00 72.50 72.03 1s6y s THR 163 CO 0.09 -0.65 1.50 0.29 -0.69 0.00 0.00 174.62 175.15 1s6y n LYS 164 N 0.07 2.84 -2.47 4.92 5.02 -1.26 -4.72 118.16 122.56 1s6y n LYS 164 Ca -0.16 -2.58 -0.39 0.00 -2.02 0.00 0.00 58.31 53.17 1s6y n LYS 164 Cb 0.62 -1.54 -0.03 0.00 -0.02 0.00 0.00 35.03 34.05 1s6y n LYS 164 CO 0.00 0.00 0.00 -1.14 -0.52 0.00 0.00 177.40 175.74 1s6y s GLN 165 N -1.08 3.36 0.22 1.97 2.00 -1.26 -4.81 119.66 120.05 1s6y s GLN 165 Ca 0.45 -0.83 0.10 0.00 -2.00 0.00 0.00 55.36 53.08 1s6y s GLN 165 Cb 0.24 -5.13 0.15 0.00 0.80 0.00 0.00 33.01 29.07 1s6y s GLN 165 CO 0.29 -2.38 1.49 0.93 -0.50 0.00 0.00 175.29 175.12 1s6y h GLU 166 N 10.19 0.00 -5.12 1.67 5.08 -1.90 -3.39 114.58 121.11 1s6y h GLU 166 Ca 0.11 0.00 -0.65 0.00 -1.00 0.00 0.00 59.36 57.81 1s6y h GLU 166 Cb 1.02 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.22 1s6y h GLU 166 CO 1.37 0.74 2.40 1.63 -1.00 0.00 0.00 179.01 184.15 1s6y n LYS 167 N -3.58 2.81 -4.60 2.33 5.02 -1.26 -4.91 118.16 113.97 1s6y n LYS 167 Ca -0.00 -2.88 -0.23 0.00 -2.02 0.00 0.00 58.31 53.18 1s6y n LYS 167 Cb 0.74 -3.42 -0.14 0.00 -0.02 0.00 0.00 35.03 32.19 1s6y n LYS 167 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1s6y s VAL 168 N 4.64 1.23 0.01 -0.18 1.01 -1.26 -1.92 120.40 123.94 1s6y s VAL 168 Ca 0.53 -0.82 0.00 0.00 0.00 0.00 0.00 61.98 61.69 1s6y s VAL 168 Cb 0.07 -1.06 -0.01 0.00 0.00 0.00 0.00 36.38 35.38 1s6y s VAL 168 CO 0.03 0.22 -0.02 -0.69 0.00 0.00 0.00 175.10 174.65 1s6y s VAL 169 N -0.56 0.10 -0.11 2.92 1.01 -0.71 -4.85 120.40 118.20 1s6y s VAL 169 Ca 0.05 -0.48 -0.01 0.00 0.00 0.00 0.00 61.98 61.55 1s6y s VAL 169 Cb -0.07 -0.17 -0.02 0.00 0.00 0.00 0.00 36.38 36.12 1s6y s VAL 169 CO 0.00 -0.24 -0.09 -0.83 0.00 0.00 0.00 175.10 173.94 1s6y s GLY 170 N -0.74 1.62 -0.00 4.51 0.00 -0.76 -1.39 107.32 110.56 1s6y s GLY 170 Ca -0.08 -0.88 -0.03 0.00 0.00 0.00 0.00 44.72 43.74 1s6y s GLY 170 CO -0.00 -0.32 0.20 1.08 0.00 0.00 0.00 173.10 174.05 1s6y s LEU 171 N -0.02 4.37 0.06 0.66 2.01 -0.70 -0.73 118.68 124.33 1s6y s LEU 171 Ca -0.02 0.37 0.04 0.00 0.01 0.00 0.00 54.13 54.54 1s6y s LEU 171 Cb -0.14 -2.65 -0.03 0.00 0.01 0.00 0.00 46.19 43.39 1s6y s LEU 171 CO 0.03 0.25 -0.13 0.00 1.01 0.00 0.00 176.35 177.52 1s6y n ASN 173 N 1.44 0.84 -0.10 0.00 6.94 -1.26 -4.55 115.26 118.57 1s6y n ASN 173 Ca -0.21 -0.76 -0.09 0.00 -0.02 0.00 0.00 54.58 53.50 1s6y n ASN 173 Cb 0.54 0.75 -0.01 0.00 -2.36 0.00 0.00 39.78 38.71 1s6y n ASN 173 CO 0.00 0.00 0.00 0.58 -1.03 0.00 0.00 177.26 176.81 1s6y h VAL 174 N 0.01 1.11 -0.83 3.53 2.07 -1.98 -2.86 116.25 117.31 1s6y h VAL 174 Ca 0.00 -0.26 0.03 0.00 0.82 0.00 0.00 66.70 67.29 1s6y h VAL 174 Cb 0.50 0.68 -0.05 0.00 -1.52 0.00 0.00 31.29 30.90 1s6y h VAL 174 CO 0.00 0.11 0.54 -0.65 0.02 0.00 0.00 177.57 177.59 1s6y h PRO 175 N 0.44 1.02 -0.59 1.57 0.11 -1.97 -2.55 132.00 130.03 1s6y h PRO 175 Ca 0.12 -0.06 -0.07 0.00 0.11 0.00 0.00 66.00 66.10 1s6y h PRO 175 Cb 0.00 -0.23 -0.02 0.00 0.11 0.00 0.00 31.00 30.86 1s6y h PRO 175 CO -0.02 0.67 0.09 0.97 -0.21 0.00 0.00 178.00 179.50 1s6y h ILE 176 N 1.05 1.26 0.00 4.15 6.09 -1.85 -1.13 117.51 127.08 1s6y h ILE 176 Ca 0.33 -1.00 0.00 0.00 -1.37 0.00 0.00 64.86 62.82 1s6y h ILE 176 Cb -0.01 0.76 0.00 0.00 0.47 0.00 0.00 36.82 38.04 1s6y h ILE 176 CO -0.11 0.37 0.00 0.61 -3.07 0.00 0.00 178.15 175.95 1s6y n GLY 177 N -0.54 0.00 0.43 8.18 0.00 -0.96 -4.59 105.19 107.71 1s6y n GLY 177 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1s6y n GLY 177 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1s6y n ARG 179 N 0.35 -0.43 0.00 1.61 0.63 -0.43 -4.67 116.66 113.72 1s6y n ARG 179 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 1s6y n ARG 179 Cb 0.00 -1.64 0.00 0.00 0.45 0.00 0.00 32.46 31.27 1s6y n ARG 179 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1s6y n GLY 181 N 0.00 0.00 0.27 5.14 0.00 -1.26 -2.04 105.19 107.29 1s6y n GLY 181 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.98 1s6y n GLY 181 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1s6y h VAL 182 N 0.00 1.25 -0.35 1.61 -1.51 -1.96 -1.52 116.25 113.76 1s6y h VAL 182 Ca 0.00 -1.09 -0.03 0.00 -1.23 0.00 0.00 66.70 64.35 1s6y h VAL 182 Cb 0.00 1.08 -0.02 0.00 -2.13 0.00 0.00 31.29 30.22 1s6y h VAL 182 CO 0.00 0.37 0.12 0.00 -1.23 0.00 0.00 177.57 176.83 1s6y h ALA 183 N 1.29 0.46 -0.70 5.19 0.00 -1.72 -0.17 119.26 123.61 1s6y h ALA 183 Ca 0.11 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1s6y h ALA 183 Cb 0.53 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 1s6y h ALA 183 CO 0.03 0.08 0.39 -0.22 0.00 0.00 0.00 179.25 179.54 1s6y h LYS 184 N 0.42 0.97 -0.44 0.00 3.11 -1.69 0.38 116.57 119.32 1s6y h LYS 184 Ca 0.11 -0.11 0.02 0.00 -2.81 0.00 0.00 60.65 57.86 1s6y h LYS 184 Cb 0.23 -0.19 -0.03 0.00 -1.00 0.00 0.00 32.23 31.24 1s6y h LYS 184 CO -0.01 0.72 0.27 1.25 -2.81 0.00 0.00 179.45 178.87 1s6y h LEU 185 N 0.96 0.44 -0.43 5.20 6.46 -1.10 -1.65 115.31 125.18 1s6y h LEU 185 Ca 0.25 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 58.01 1s6y h LEU 185 Cb 0.02 -0.09 0.00 0.00 -0.73 0.00 0.00 40.66 39.86 1s6y h LEU 185 CO -0.04 0.31 0.00 -0.07 -0.62 0.00 0.00 178.44 178.02 1s6y h LEU 186 N 0.54 0.00 -2.04 2.25 4.07 -0.51 -3.47 115.31 116.14 1s6y h LEU 186 Ca 0.17 0.00 -0.19 0.00 0.08 0.00 0.00 57.88 57.94 1s6y h LEU 186 Cb -0.01 0.00 0.11 0.00 1.08 0.00 0.00 40.66 41.84 1s6y h LEU 186 CO -0.07 0.00 -0.49 0.61 -1.08 0.00 0.00 178.44 177.41 1s6y n GLY 187 N 0.64 -0.14 3.14 0.83 0.00 0.12 -5.04 105.19 104.74 1s6y n GLY 187 Ca 0.04 -0.01 -0.09 0.00 0.00 0.00 0.00 46.02 45.95 1s6y n GLY 187 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1s6y s VAL 188 N -3.23 0.13 0.34 1.61 1.01 -0.58 -5.03 120.40 114.66 1s6y s VAL 188 Ca 0.08 -1.10 -0.28 0.00 0.00 0.00 0.00 61.98 60.69 1s6y s VAL 188 Cb -0.01 -0.97 -0.10 0.00 0.00 0.00 0.00 36.38 35.30 1s6y s VAL 188 CO 0.45 -0.60 1.21 -1.81 0.00 0.00 0.00 175.10 174.35 1s6y s ASP 189 N -2.23 6.82 0.61 3.32 1.01 -1.26 -4.38 116.67 120.56 1s6y s ASP 189 Ca -0.03 2.49 0.36 0.00 0.71 0.00 0.00 52.55 56.07 1s6y s ASP 189 Cb -0.00 -2.63 1.98 0.00 1.01 0.00 0.00 42.92 43.28 1s6y s ASP 189 CO -0.05 -0.48 2.25 0.00 0.21 0.00 0.00 175.17 177.10 1s6y h ALA 190 N 3.27 1.21 0.00 5.23 0.00 -1.92 -1.99 119.26 125.07 1s6y h ALA 190 Ca -0.48 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1s6y h ALA 190 Cb 1.23 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1s6y h ALA 190 CO 0.65 0.03 0.00 0.38 0.00 0.00 0.00 179.25 180.31 1s6y h ASP 191 N 0.00 0.00 0.32 0.00 2.03 -1.96 -2.21 116.42 114.60 1s6y h ASP 191 Ca -0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1s6y h ASP 191 Cb 0.11 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.61 1s6y h ASP 191 CO 0.00 0.00 -0.16 0.54 -1.03 0.00 0.00 179.24 178.59 1s6y n ARG 192 N -2.56 0.73 -3.95 4.15 1.74 -0.75 -4.84 116.66 111.19 1s6y n ARG 192 Ca 0.02 -0.33 -0.35 0.00 -0.77 0.00 0.00 57.85 56.42 1s6y n ARG 192 Cb 0.27 -1.49 -0.13 0.00 -1.02 0.00 0.00 32.46 30.09 1s6y n ARG 192 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1s6y s VAL 193 N -2.49 3.88 0.10 1.55 1.01 -0.83 -1.02 120.40 122.59 1s6y s VAL 193 Ca 0.27 -0.33 0.09 0.00 0.00 0.00 0.00 61.98 62.01 1s6y s VAL 193 Cb 0.20 -2.77 -0.04 0.00 0.00 0.00 0.00 36.38 33.77 1s6y s VAL 193 CO 0.49 0.40 -0.19 -1.00 0.00 0.00 0.00 175.10 174.81 1s6y s HIS 194 N 1.29 2.53 -0.03 5.22 3.76 -0.55 -4.99 115.29 122.52 1s6y s HIS 194 Ca 0.04 -0.27 0.01 0.00 -0.15 0.00 0.00 55.06 54.69 1s6y s HIS 194 Cb -0.15 -1.37 0.02 0.00 1.11 0.00 0.00 32.58 32.20 1s6y s HIS 194 CO 0.01 0.34 -0.01 0.42 -0.85 0.00 0.00 174.74 174.65 1s6y s ILE 195 N -1.08 0.28 -0.57 0.60 1.01 -1.26 -0.65 121.20 119.54 1s6y s ILE 195 Ca 0.17 0.01 -0.27 0.00 0.00 0.00 0.00 60.65 60.56 1s6y s ILE 195 Cb -0.11 -0.35 0.03 0.00 0.01 0.00 0.00 42.46 42.04 1s6y s ILE 195 CO 0.08 0.16 1.11 -1.81 0.00 0.00 0.00 174.94 174.49 1s6y s ASP 196 N 0.93 6.42 -0.03 3.58 1.01 -0.51 -4.96 116.67 123.11 1s6y s ASP 196 Ca -0.10 -0.01 -0.15 0.00 0.71 0.00 0.00 52.55 52.99 1s6y s ASP 196 Cb -0.13 -2.52 -0.05 0.00 1.01 0.00 0.00 42.92 41.22 1s6y s ASP 196 CO -0.01 -1.39 0.40 -0.36 0.21 0.00 0.00 175.17 174.02 1s6y s PHE 197 N 4.63 3.68 -0.12 4.23 0.40 -1.26 -1.47 117.98 128.08 1s6y s PHE 197 Ca 0.39 0.95 -0.22 0.00 -0.60 0.00 0.00 56.93 57.45 1s6y s PHE 197 Cb -0.09 -2.32 0.05 0.00 0.51 0.00 0.00 43.02 41.18 1s6y s PHE 197 CO 0.24 0.56 0.55 0.00 0.70 0.00 0.00 175.22 177.27 1s6y s ALA 198 N -0.78 -1.38 0.00 5.36 0.00 -0.47 -3.16 121.76 121.33 1s6y s ALA 198 Ca 0.23 1.23 0.00 0.00 0.00 0.00 0.00 51.96 53.42 1s6y s ALA 198 Cb -0.16 -0.41 0.00 0.00 0.00 0.00 0.00 23.12 22.55 1s6y s ALA 198 CO 0.12 -0.30 0.00 0.41 0.00 0.00 0.00 175.76 175.99 1s6y n GLY 199 N 1.84 0.22 3.59 0.00 0.00 -1.07 -0.80 105.19 108.97 1s6y n GLY 199 Ca -0.17 -0.97 -0.27 0.00 0.00 0.00 0.00 46.02 44.61 1s6y n GLY 199 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1s6y s LEU 200 N 0.00 2.29 0.26 0.99 1.43 -1.26 -1.89 118.68 120.49 1s6y s LEU 200 Ca 0.00 -1.54 -0.31 0.00 -1.03 0.00 0.00 54.13 51.25 1s6y s LEU 200 Cb 0.00 -0.50 -0.12 0.00 0.03 0.00 0.00 46.19 45.60 1s6y s LEU 200 CO 0.00 -0.75 1.64 -3.20 0.23 0.00 0.00 176.35 174.27 1s6y n ASN 201 N -1.09 3.85 -3.66 2.29 2.85 -1.26 -2.93 115.26 115.31 1s6y n ASN 201 Ca -0.09 1.11 -0.30 0.00 -0.11 0.00 0.00 54.58 55.19 1s6y n ASN 201 Cb 0.66 -1.58 0.04 0.00 1.24 0.00 0.00 39.78 40.15 1s6y n ASN 201 CO 0.00 0.00 0.00 1.41 -2.11 0.00 0.00 177.26 176.56 1s6y n HIS 202 N 2.82 -1.94 0.00 1.20 8.25 -1.26 -4.85 115.22 119.44 1s6y n HIS 202 Ca 0.12 0.49 0.00 0.00 -0.26 0.00 0.00 57.72 58.06 1s6y n HIS 202 Cb 0.36 -3.50 0.00 0.00 1.12 0.00 0.00 29.99 27.96 1s6y n HIS 202 CO 0.00 0.00 0.00 1.55 0.64 0.00 0.00 176.34 178.53 1s6y n VAL 204 N -4.13 0.00 -4.12 1.59 3.14 -1.15 -4.66 118.33 109.00 1s6y n VAL 204 Ca -0.10 0.00 -0.30 0.00 -2.96 0.00 0.00 64.34 60.98 1s6y n VAL 204 Cb 0.60 0.00 -0.08 0.00 -1.06 0.00 0.00 33.84 33.30 1s6y n VAL 204 CO 0.00 0.00 0.00 -0.36 -6.46 0.00 0.00 176.83 170.01 1s6y s PHE 205 N -0.63 3.01 -0.72 1.45 0.40 0.02 -2.96 117.98 118.56 1s6y s PHE 205 Ca 0.00 -0.02 -0.18 0.00 -0.60 0.00 0.00 56.93 56.13 1s6y s PHE 205 Cb 0.00 -1.54 0.14 0.00 0.51 0.00 0.00 43.02 42.13 1s6y s PHE 205 CO 0.00 0.49 0.81 0.20 0.70 0.00 0.00 175.22 177.42 1s6y s GLY 206 N -2.41 2.01 0.26 4.36 0.00 0.84 -1.37 107.32 111.02 1s6y s GLY 206 Ca 0.27 -2.60 0.07 0.00 0.00 0.00 0.00 44.72 42.46 1s6y s GLY 206 CO 0.19 1.60 1.60 1.41 0.00 0.00 0.00 173.10 177.91 1s6y h LEU 207 N 9.58 0.14 -7.22 0.66 3.38 -1.55 -1.16 115.31 119.15 1s6y h LEU 207 Ca -0.10 -0.08 -0.10 0.00 0.09 0.00 0.00 57.88 57.69 1s6y h LEU 207 Cb 1.06 -0.04 -0.24 0.00 0.09 0.00 0.00 40.66 41.53 1s6y h LEU 207 CO 1.03 0.70 -0.17 -1.00 0.09 0.00 0.00 178.44 179.08 1s6y s HIS 208 N -3.74 -0.59 -0.05 1.13 3.76 -1.25 -4.81 115.29 109.74 1s6y s HIS 208 Ca -0.03 1.35 0.06 0.00 -0.15 0.00 0.00 55.06 56.30 1s6y s HIS 208 Cb 0.12 0.23 -0.01 0.00 1.11 0.00 0.00 32.58 34.03 1s6y s HIS 208 CO 0.78 -0.30 -0.24 0.08 -0.85 0.00 0.00 174.74 174.21 1s6y s VAL 209 N 0.63 2.16 -0.00 -0.90 1.01 -1.26 -1.42 120.40 120.61 1s6y s VAL 209 Ca -0.03 -1.04 0.06 0.00 0.00 0.00 0.00 61.98 60.96 1s6y s VAL 209 Cb -0.05 -1.78 -0.02 0.00 0.00 0.00 0.00 36.38 34.54 1s6y s VAL 209 CO -0.04 0.57 -0.18 -0.31 0.00 0.00 0.00 175.10 175.15 1s6y s TYR 210 N -0.31 1.56 -0.20 5.22 2.02 0.17 -0.30 117.35 125.51 1s6y s TYR 210 Ca 0.01 -0.31 0.01 0.00 -0.37 0.00 0.00 57.07 56.41 1s6y s TYR 210 Cb -0.13 -0.99 0.03 0.00 -0.40 0.00 0.00 41.96 40.47 1s6y s TYR 210 CO 0.02 -0.00 -0.16 -1.17 -1.57 0.00 0.00 175.55 172.67 1s6y s LEU 211 N -0.59 2.52 -1.35 -1.29 0.20 0.36 -1.49 118.68 117.03 1s6y s LEU 211 Ca 0.06 -0.78 -0.06 0.00 0.69 0.00 0.00 54.13 54.04 1s6y s LEU 211 Cb -0.07 -1.53 0.04 0.00 -0.43 0.00 0.00 46.19 44.20 1s6y s LEU 211 CO -0.00 -0.05 0.46 0.47 -0.29 0.00 0.00 176.35 176.94 1s6y n ASP 212 N 4.60 -4.57 0.00 3.68 8.00 -0.19 -1.45 116.55 126.62 1s6y n ASP 212 Ca -0.19 -0.28 0.00 0.00 0.71 0.00 0.00 54.79 55.03 1s6y n ASP 212 Cb 0.48 -3.75 0.00 0.00 -0.02 0.00 0.00 41.12 37.83 1s6y n ASP 212 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1s6y n GLY 213 N -1.24 1.67 3.71 0.44 0.00 -1.26 -5.02 105.19 103.50 1s6y n GLY 213 Ca -0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.60 1s6y n GLY 213 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1s6y s VAL 214 N -3.49 5.13 0.13 1.61 1.01 -0.53 -4.97 120.40 119.28 1s6y s VAL 214 Ca 0.00 0.08 -0.31 0.00 0.00 0.00 0.00 61.98 61.75 1s6y s VAL 214 Cb 0.00 -3.31 -0.10 0.00 0.00 0.00 0.00 36.38 32.98 1s6y s VAL 214 CO 0.00 0.48 1.69 -0.70 0.00 0.00 0.00 175.10 176.57 1s6y s GLU 215 N 0.10 4.18 -0.08 2.72 2.12 -1.26 -0.49 118.70 125.98 1s6y s GLU 215 Ca 0.07 2.45 0.13 0.00 0.36 0.00 0.00 54.97 57.98 1s6y s GLU 215 Cb -0.12 -3.41 0.27 0.00 0.26 0.00 0.00 34.13 31.13 1s6y s GLU 215 CO -0.00 -0.73 1.13 1.33 -0.54 0.00 0.00 175.26 176.44 1s6y n VAL 216 N 4.44 1.00 0.14 3.70 0.24 0.59 -4.89 118.33 123.55 1s6y n VAL 216 Ca 0.16 -1.56 -0.12 0.00 -2.04 0.00 0.00 64.34 60.78 1s6y n VAL 216 Cb 0.39 0.25 -0.07 0.00 -1.47 0.00 0.00 33.84 32.93 1s6y n VAL 216 CO 0.00 0.00 0.00 0.74 -2.14 0.00 0.00 176.83 175.43 1s6y h THR 217 N 3.76 0.00 -0.78 3.34 2.02 -1.90 0.12 112.91 119.47 1s6y h THR 217 Ca -0.05 0.00 0.18 0.00 0.77 0.00 0.00 66.41 67.31 1s6y h THR 217 Cb 1.31 0.00 -0.12 0.00 -1.74 0.00 0.00 68.15 67.60 1s6y h THR 217 CO 0.02 0.00 0.14 -0.33 0.37 0.00 0.00 175.52 175.72 1s6y h GLU 218 N -0.62 0.20 0.00 6.66 5.08 -1.92 0.19 114.58 124.17 1s6y h GLU 218 Ca -0.02 -0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.34 1s6y h GLU 218 Cb 0.58 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.78 1s6y h GLU 218 CO -0.14 0.13 -0.05 -0.22 -1.00 0.00 0.00 179.01 177.73 1s6y h LYS 219 N 0.21 -0.09 -0.71 2.33 3.11 -1.80 -0.73 116.57 118.88 1s6y h LYS 219 Ca 0.45 0.01 -0.04 0.00 -2.81 0.00 0.00 60.65 58.26 1s6y h LYS 219 Cb 0.81 0.02 -0.03 0.00 -1.00 0.00 0.00 32.23 32.03 1s6y h LYS 219 CO -0.59 -0.06 0.30 0.28 -2.81 0.00 0.00 179.45 176.57 1s6y h VAL 220 N -0.10 1.24 -0.34 2.00 2.07 0.22 -1.98 116.25 119.37 1s6y h VAL 220 Ca 0.02 -0.74 -0.04 0.00 0.82 0.00 0.00 66.70 66.76 1s6y h VAL 220 Cb 0.12 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 30.28 1s6y h VAL 220 CO -0.06 0.30 0.06 0.40 0.02 0.00 0.00 177.57 178.29 1s6y h ILE 221 N 1.01 1.17 -0.45 4.57 2.04 -0.42 0.17 117.51 125.61 1s6y h ILE 221 Ca 0.24 -0.64 -0.10 0.00 1.00 0.00 0.00 64.86 65.37 1s6y h ILE 221 Cb 0.18 0.85 -0.01 0.00 -0.74 0.00 0.00 36.82 37.10 1s6y h ILE 221 CO -0.02 0.23 -0.11 -0.78 0.00 0.00 0.00 178.15 177.47 1s6y h ASP 222 N 0.50 0.87 0.70 1.72 -0.00 -0.71 -3.02 116.42 116.48 1s6y h ASP 222 Ca 0.11 -0.36 -0.03 0.00 -0.00 0.00 0.00 57.03 56.75 1s6y h ASP 222 Cb 0.23 -0.24 0.00 0.00 -0.00 0.00 0.00 39.33 39.33 1s6y h ASP 222 CO 0.00 1.03 -0.38 -0.07 -0.00 0.00 0.00 179.24 179.82 1s6y h LEU 223 N 0.71 -0.94 -0.59 2.28 -0.00 -0.79 -3.30 115.31 112.68 1s6y h LEU 223 Ca 0.11 0.04 0.11 0.00 -0.00 0.00 0.00 57.88 58.15 1s6y h LEU 223 Cb 0.65 0.26 -0.11 0.00 -0.00 0.00 0.00 40.66 41.45 1s6y h LEU 223 CO 0.04 -0.62 -0.23 0.58 -0.00 0.00 0.00 178.44 178.22 1s6y h VAL 224 N -1.00 0.29 -3.53 1.22 2.07 -0.65 -2.94 116.25 111.72 1s6y h VAL 224 Ca -0.09 0.00 -0.77 0.00 0.82 0.00 0.00 66.70 66.66 1s6y h VAL 224 Cb 0.79 0.29 -0.25 0.00 -1.52 0.00 0.00 31.29 30.61 1s6y h VAL 224 CO 0.12 0.00 0.13 0.00 0.02 0.00 0.00 177.57 177.84 1s6y s ALA 225 N -6.14 3.92 0.00 1.67 0.00 -1.15 -4.44 121.76 115.62 1s6y s ALA 225 Ca -0.14 -3.10 0.00 0.00 0.00 0.00 0.00 51.96 48.72 1s6y s ALA 225 Cb 0.18 -3.54 0.00 0.00 0.00 0.00 0.00 23.12 19.76 1s6y s ALA 225 CO 0.72 -2.31 0.00 0.72 0.00 0.00 0.00 175.76 174.88 1s6y n HIS 226 N 4.54 0.00 0.12 0.00 -0.00 -1.11 -4.79 115.22 113.98 1s6y n HIS 226 Ca 0.09 0.00 -0.07 0.00 -0.00 0.00 0.00 57.72 57.75 1s6y n HIS 226 Cb 0.46 0.00 -0.03 0.00 -0.00 0.00 0.00 29.99 30.42 1s6y n HIS 226 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 1s6y h PRO 227 N 0.00 -0.39 -2.55 -0.41 0.11 -1.77 -3.50 132.00 123.49 1s6y h PRO 227 Ca 0.00 0.03 0.14 0.00 0.11 0.00 0.00 66.00 66.27 1s6y h PRO 227 Cb 0.00 0.09 -0.05 0.00 0.11 0.00 0.00 31.00 31.15 1s6y h PRO 227 CO 0.00 -0.23 0.47 -0.48 -0.21 0.00 0.00 178.00 177.55 1s6y s LEU 240 N -8.99 -0.09 -1.56 2.35 -0.00 -1.26 -5.21 118.68 103.93 1s6y s LEU 240 Ca -0.07 -0.63 -0.02 0.00 -0.00 0.00 0.00 54.13 53.41 1s6y s LEU 240 Cb 0.01 2.28 0.00 0.00 -0.00 0.00 0.00 46.19 48.47 1s6y s LEU 240 CO 0.20 -1.09 0.26 0.61 -0.00 0.00 0.00 176.35 176.34 1s6y n GLY 241 N -0.56 -0.43 3.77 -3.48 0.00 -1.26 -4.97 105.19 98.25 1s6y n GLY 241 Ca -0.05 -0.01 -0.36 0.00 0.00 0.00 0.00 46.02 45.60 1s6y n GLY 241 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1s6y s TRP 242 N -3.04 2.67 -0.09 1.61 0.52 -1.26 -4.97 118.94 114.37 1s6y s TRP 242 Ca 0.13 1.53 -0.30 0.00 0.02 0.00 0.00 56.10 57.49 1s6y s TRP 242 Cb -0.06 -3.35 -0.05 0.00 -1.15 0.00 0.00 33.47 28.86 1s6y s TRP 242 CO 0.16 -1.68 1.60 -1.21 0.02 0.00 0.00 176.95 175.83 1s6y s GLU 243 N -3.14 4.14 0.27 4.98 0.41 -1.26 -4.91 118.70 119.19 1s6y s GLU 243 Ca 0.71 2.05 0.01 0.00 -0.41 0.00 0.00 54.97 57.33 1s6y s GLU 243 Cb -0.26 -3.96 0.61 0.00 -1.78 0.00 0.00 34.13 28.73 1s6y s GLU 243 CO 0.30 -0.89 1.75 -1.35 -0.49 0.00 0.00 175.26 174.58 1s6y h PRO 244 N 9.52 0.57 0.00 0.39 0.11 -1.93 -1.03 132.00 139.63 1s6y h PRO 244 Ca -0.37 -0.03 -0.13 0.00 0.11 0.00 0.00 66.00 65.58 1s6y h PRO 244 Cb 1.16 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 32.13 1s6y h PRO 244 CO 0.96 0.38 -0.60 -0.44 -0.21 0.00 0.00 178.00 178.09 1s6y h ASP 245 N 0.59 0.00 -0.22 -2.05 3.32 -1.97 0.17 116.42 116.26 1s6y h ASP 245 Ca 0.50 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.51 1s6y h ASP 245 Cb 0.78 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.33 1s6y h ASP 245 CO -0.40 0.60 -0.04 0.15 -1.72 0.00 0.00 179.24 177.83 1s6y h PHE 246 N 0.00 0.46 -0.44 4.55 3.57 -1.74 0.11 116.94 123.45 1s6y h PHE 246 Ca -0.01 -0.10 -0.08 0.00 3.53 0.00 0.00 57.97 61.32 1s6y h PHE 246 Cb 1.17 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 39.78 1s6y h PHE 246 CO 0.00 0.64 -0.04 1.25 -2.23 0.00 0.00 178.31 177.93 1s6y h LEU 247 N 0.15 0.80 -0.90 0.59 5.85 -0.93 0.14 115.31 121.01 1s6y h LEU 247 Ca 0.06 -0.33 -0.09 0.00 0.84 0.00 0.00 57.88 58.35 1s6y h LEU 247 Cb 0.49 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.28 1s6y h LEU 247 CO 0.02 0.94 -0.19 0.11 -0.34 0.00 0.00 178.44 178.98 1s6y h LYS 248 N 0.65 0.60 -0.55 1.25 1.57 -0.73 -1.97 116.57 117.39 1s6y h LYS 248 Ca 0.12 -0.21 -0.08 0.00 -1.87 0.00 0.00 60.65 58.61 1s6y h LYS 248 Cb 0.55 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.80 1s6y h LYS 248 CO 0.03 0.75 0.01 0.78 -0.57 0.00 0.00 179.45 180.46 1s6y h GLY 249 N 0.98 1.00 1.52 3.86 0.00 -0.45 -3.25 103.07 106.74 1s6y h GLY 249 Ca 0.09 -0.69 -0.14 0.00 0.00 0.00 0.00 47.33 46.58 1s6y h GLY 249 CO 0.04 0.64 -0.47 -2.00 0.00 0.00 0.00 176.54 174.75 1s6y h LEU 250 N 0.86 0.56 0.00 3.11 5.85 -0.41 -3.47 115.31 121.81 1s6y h LEU 250 Ca 0.16 -0.27 0.00 0.00 0.84 0.00 0.00 57.88 58.61 1s6y h LEU 250 Cb 0.49 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.36 1s6y h LEU 250 CO 0.02 0.95 0.00 0.29 -0.34 0.00 0.00 178.44 179.36 1s6y n LYS 251 N -3.99 -0.33 -4.30 1.25 5.02 -0.77 -4.95 118.16 110.09 1s6y n LYS 251 Ca -0.02 0.08 -0.16 0.00 -2.02 0.00 0.00 58.31 56.19 1s6y n LYS 251 Cb 0.55 -3.79 -0.10 0.00 -0.02 0.00 0.00 35.03 31.68 1s6y n LYS 251 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1s6y s VAL 252 N -2.04 0.81 -0.36 -0.18 -7.23 -1.26 -4.86 120.40 105.27 1s6y s VAL 252 Ca 0.00 -2.01 -0.13 0.00 -1.81 0.00 0.00 61.98 58.03 1s6y s VAL 252 Cb 0.00 -2.37 0.00 0.00 0.56 0.00 0.00 36.38 34.57 1s6y s VAL 252 CO 0.00 -0.28 0.25 -0.22 -0.31 0.00 0.00 175.10 174.54 1s6y s LEU 253 N -3.27 4.69 0.66 1.32 2.96 -0.44 -4.92 118.68 119.68 1s6y s LEU 253 Ca 0.30 -0.64 -0.14 0.00 -0.22 0.00 0.00 54.13 53.42 1s6y s LEU 253 Cb 0.06 -2.12 0.00 0.00 0.50 0.00 0.00 46.19 44.64 1s6y s LEU 253 CO 0.09 -0.31 1.09 -2.84 -1.32 0.00 0.00 176.35 173.06 1s6y s PRO 254 N 1.68 2.83 0.59 0.98 0.02 -1.26 -0.11 135.00 139.73 1s6y s PRO 254 Ca 0.05 1.30 -0.02 0.00 0.02 0.00 0.00 61.00 62.36 1s6y s PRO 254 Cb -0.18 -1.96 0.04 0.00 0.02 0.00 0.00 34.50 32.42 1s6y s PRO 254 CO 0.10 -1.21 0.85 0.00 -0.33 0.00 0.00 177.00 176.40 1s6y h PRO 256 N -0.13 0.19 0.00 0.00 0.11 -1.96 -2.30 132.00 127.91 1s6y h PRO 256 Ca -0.43 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1s6y h PRO 256 Cb 1.30 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1s6y h PRO 256 CO 0.56 0.13 0.00 1.88 -0.21 0.00 0.00 178.00 180.35 1s6y h TYR 257 N 0.20 0.00 0.00 0.65 -1.99 -1.95 -2.73 116.97 111.15 1s6y h TYR 257 Ca 0.10 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.83 1s6y h TYR 257 Cb 0.15 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.88 1s6y h TYR 257 CO -0.00 0.00 0.00 0.72 -0.00 0.00 0.00 178.16 178.88 1s6y n HIS 258 N -2.83 0.54 0.23 4.88 8.25 -0.86 -2.20 115.22 123.22 1s6y n HIS 258 Ca 0.01 0.23 0.10 0.00 -0.26 0.00 0.00 57.72 57.80 1s6y n HIS 258 Cb 0.26 -0.87 0.55 0.00 1.12 0.00 0.00 29.99 31.04 1s6y n HIS 258 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1s6y h ARG 259 N 0.00 0.00 -0.03 -0.41 3.08 -1.66 0.17 114.38 115.53 1s6y h ARG 259 Ca 0.00 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 59.99 1s6y h ARG 259 Cb 0.23 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.27 1s6y h ARG 259 CO 0.00 0.22 -0.26 1.88 -1.07 0.00 0.00 179.97 180.74 1s6y h TYR 260 N 0.00 0.05 0.00 3.04 0.05 -1.67 -0.07 116.97 118.37 1s6y h TYR 260 Ca -0.00 -0.01 -0.38 0.00 0.05 0.00 0.00 58.73 58.39 1s6y h TYR 260 Cb 0.59 -0.01 -0.07 0.00 1.01 0.00 0.00 36.73 38.24 1s6y h TYR 260 CO 0.00 0.30 -2.43 0.66 -1.05 0.00 0.00 178.16 175.65 1s6y n TYR 261 N -4.22 0.00 0.88 4.88 4.01 -0.96 -3.89 117.16 117.86 1s6y n TYR 261 Ca -0.02 0.00 0.09 0.00 -0.16 0.00 0.00 57.90 57.81 1s6y n TYR 261 Cb 0.32 -0.98 -0.09 0.00 -0.31 0.00 0.00 39.34 38.28 1s6y n TYR 261 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 1s6y n PHE 262 N -3.09 0.00 -2.86 -0.72 0.99 0.55 -4.49 117.46 107.84 1s6y n PHE 262 Ca -0.41 0.00 -0.13 0.00 -0.00 0.00 0.00 57.45 56.91 1s6y n PHE 262 Cb 1.03 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 39.52 1s6y n PHE 262 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.76 177.80 1s6y n GLN 263 N -1.21 1.18 -0.15 -1.08 6.02 -0.06 -4.99 117.38 117.10 1s6y n GLN 263 Ca 0.04 -3.37 -0.08 0.00 -0.01 0.00 0.00 57.00 53.58 1s6y n GLN 263 Cb 0.31 -1.47 0.06 0.00 1.02 0.00 0.00 30.24 30.16 1s6y n GLN 263 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 177.06 177.20 1s6y h THR 264 N 2.22 1.27 -0.89 5.09 2.02 -1.63 -2.76 112.91 118.22 1s6y h THR 264 Ca -0.01 -1.24 -0.01 0.00 0.77 0.00 0.00 66.41 65.92 1s6y h THR 264 Cb 1.08 1.00 -0.04 0.00 -1.74 0.00 0.00 68.15 68.45 1s6y h THR 264 CO 0.52 0.43 0.50 -2.24 0.37 0.00 0.00 175.52 175.10 1s6y h ASP 265 N 0.83 1.10 0.00 4.18 3.04 -1.89 -2.33 116.42 121.35 1s6y h ASP 265 Ca 0.13 -0.09 0.00 0.00 -3.24 0.00 0.00 57.03 53.83 1s6y h ASP 265 Cb 0.65 -0.28 0.00 0.00 -1.04 0.00 0.00 39.33 38.66 1s6y h ASP 265 CO 0.05 0.87 0.00 1.17 -2.04 0.00 0.00 179.24 179.29 1s6y n LYS 266 N -4.36 0.22 0.00 4.15 4.81 -1.04 -1.90 118.16 120.03 1s6y n LYS 266 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.53 1s6y n LYS 266 Cb 0.08 -1.16 0.00 0.00 0.02 0.00 0.00 35.03 33.97 1s6y n LYS 266 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 1s6y n LEU 268 N 0.49 0.00 -0.32 3.14 7.94 -0.88 -1.91 117.00 125.46 1s6y n LEU 268 Ca 0.00 0.00 -0.04 0.00 -1.11 0.00 0.00 56.01 54.86 1s6y n LEU 268 Cb 0.06 0.00 0.08 0.00 0.53 0.00 0.00 43.42 44.09 1s6y n LEU 268 CO 0.00 0.00 1.15 0.00 -1.11 0.00 0.00 177.39 177.43 1s6y h ALA 269 N 0.00 1.11 -0.30 1.96 0.00 -1.65 -1.54 119.26 118.84 1s6y h ALA 269 Ca 0.00 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 1s6y h ALA 269 Cb 0.00 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.43 1s6y h ALA 269 CO 0.00 0.64 0.11 0.93 0.00 0.00 0.00 179.25 180.92 1s6y h GLU 270 N 1.21 0.45 -0.10 0.00 5.08 -1.66 -1.97 114.58 117.59 1s6y h GLU 270 Ca 0.30 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 1s6y h GLU 270 Cb 0.06 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1s6y h GLU 270 CO -0.04 0.49 0.07 0.93 -1.00 0.00 0.00 179.01 179.45 1s6y h GLU 271 N 0.33 0.14 -0.60 2.33 5.08 -1.82 0.52 114.58 120.55 1s6y h GLU 271 Ca 0.10 -0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.48 1s6y h GLU 271 Cb 0.21 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.39 1s6y h GLU 271 CO -0.01 0.10 0.37 -0.07 -1.00 0.00 0.00 179.01 178.40 1s6y h LEU 272 N 0.13 0.59 0.22 1.33 3.38 -1.25 0.75 115.31 120.47 1s6y h LEU 272 Ca 0.04 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1s6y h LEU 272 Cb -0.01 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.63 1s6y h LEU 272 CO -0.01 0.41 -0.11 -0.08 0.09 0.00 0.00 178.44 178.75 1s6y h GLU 273 N 0.72 -0.29 -0.15 1.13 4.22 -1.17 -2.53 114.58 116.51 1s6y h GLU 273 Ca 0.24 0.02 0.01 0.00 0.08 0.00 0.00 59.36 59.71 1s6y h GLU 273 Cb 0.03 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 1s6y h GLU 273 CO -0.11 -0.16 0.08 0.00 -2.18 0.00 0.00 179.01 176.64 1s6y h ALA 274 N 0.42 0.18 -0.78 2.92 0.00 -0.58 -1.77 119.26 119.66 1s6y h ALA 274 Ca -0.03 0.00 0.21 0.00 0.00 0.00 0.00 54.91 55.09 1s6y h ALA 274 Cb 0.27 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 1s6y h ALA 274 CO 0.05 -0.35 0.55 0.00 0.00 0.00 0.00 179.25 179.50 1s6y h ALA 275 N 1.07 2.60 -0.02 0.00 0.00 -0.81 0.42 119.26 122.52 1s6y h ALA 275 Ca 0.06 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1s6y h ALA 275 Cb 0.00 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1s6y h ALA 275 CO -0.04 -0.83 -0.10 1.63 0.00 0.00 0.00 179.25 179.92 1s6y n LYS 276 N -4.35 1.85 0.00 0.00 5.02 -0.77 -4.56 118.16 115.34 1s6y n LYS 276 Ca 0.16 -1.59 0.00 0.00 -2.02 0.00 0.00 58.31 54.86 1s6y n LYS 276 Cb 0.79 -1.41 0.00 0.00 -0.02 0.00 0.00 35.03 34.39 1s6y n LYS 276 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1s6y n THR 277 N 0.92 0.00 -0.00 -0.18 -2.24 -0.74 -4.94 114.28 107.10 1s6y n THR 277 Ca 0.12 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.91 1s6y n THR 277 Cb 0.51 0.00 0.35 0.00 -2.10 0.00 0.00 70.33 69.09 1s6y n THR 277 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1s6y h LYS 278 N 0.00 0.54 0.00 -0.78 1.57 -1.76 -3.49 116.57 112.65 1s6y h LYS 278 Ca 0.00 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 1s6y h LYS 278 Cb 0.00 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.21 1s6y h LYS 278 CO 0.00 0.47 0.00 0.41 -0.57 0.00 0.00 179.45 179.76 1s6y n GLY 279 N -1.13 2.68 3.60 3.86 0.00 0.14 -4.64 105.19 109.70 1s6y n GLY 279 Ca 0.02 -2.07 -0.29 0.00 0.00 0.00 0.00 46.02 43.68 1s6y n GLY 279 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1s6y s THR 280 N -2.38 1.85 0.25 2.61 -4.23 -1.25 -3.93 115.64 108.55 1s6y s THR 280 Ca 0.00 0.00 -0.05 0.00 -1.18 0.00 0.00 61.69 60.46 1s6y s THR 280 Cb 0.00 -2.40 0.20 0.00 1.34 0.00 0.00 72.50 71.65 1s6y s THR 280 CO 0.00 0.00 1.86 -0.09 -0.54 0.00 0.00 174.62 175.85 1s6y h ARG 281 N -2.32 1.14 -0.24 3.99 9.65 -1.96 -1.10 114.38 123.54 1s6y h ARG 281 Ca -0.53 -0.15 -0.08 0.00 -1.10 0.00 0.00 59.98 58.12 1s6y h ARG 281 Cb 1.33 -0.22 -0.01 0.00 -1.39 0.00 0.00 29.97 29.68 1s6y h ARG 281 CO 0.49 0.86 -0.20 0.00 2.80 0.00 0.00 179.97 183.93 1s6y h ALA 282 N 1.31 1.22 -0.17 2.80 0.00 -1.91 0.36 119.26 122.87 1s6y h ALA 282 Ca 0.28 -0.30 -0.22 0.00 0.00 0.00 0.00 54.91 54.68 1s6y h ALA 282 Cb 0.08 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 17.76 1s6y h ALA 282 CO -0.04 0.51 -0.74 0.93 0.00 0.00 0.00 179.25 179.90 1s6y h GLU 283 N 0.39 0.77 -0.17 0.00 5.08 -1.72 -0.75 114.58 118.18 1s6y h GLU 283 Ca 0.07 -0.61 -0.02 0.00 -1.00 0.00 0.00 59.36 57.80 1s6y h GLU 283 Cb 0.57 0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.93 1s6y h GLU 283 CO 0.04 1.22 0.03 0.28 -1.00 0.00 0.00 179.01 179.58 1s6y h VAL 284 N 0.54 1.22 -0.49 3.13 2.07 -1.05 -2.70 116.25 118.96 1s6y h VAL 284 Ca -0.04 -0.70 0.07 0.00 0.82 0.00 0.00 66.70 66.85 1s6y h VAL 284 Cb 1.36 1.35 -0.03 0.00 -1.52 0.00 0.00 31.29 32.46 1s6y h VAL 284 CO 0.15 0.21 0.33 0.58 0.02 0.00 0.00 177.57 178.87 1s6y h VAL 285 N 0.07 0.95 0.03 2.57 2.07 -0.28 -1.96 116.25 119.70 1s6y h VAL 285 Ca 0.05 -0.13 -0.00 0.00 0.82 0.00 0.00 66.70 67.44 1s6y h VAL 285 Cb 0.30 0.53 0.00 0.00 -1.52 0.00 0.00 31.29 30.60 1s6y h VAL 285 CO 0.00 0.07 -0.02 -0.61 0.02 0.00 0.00 177.57 177.04 1s6y h GLN 286 N 0.38 -0.04 -0.42 1.57 4.15 -1.00 0.96 115.11 120.71 1s6y h GLN 286 Ca 0.22 0.00 0.07 0.00 0.77 0.00 0.00 58.65 59.71 1s6y h GLN 286 Cb 0.37 0.01 -0.06 0.00 0.21 0.00 0.00 27.48 28.01 1s6y h GLN 286 CO -0.05 0.22 0.05 1.96 -1.93 0.00 0.00 178.83 179.07 1s6y h GLN 287 N -0.30 0.16 -0.56 1.69 4.20 -1.20 -0.35 115.11 118.75 1s6y h GLN 287 Ca -0.00 -0.01 -0.05 0.00 0.06 0.00 0.00 58.65 58.65 1s6y h GLN 287 Cb 0.28 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.00 1s6y h GLN 287 CO 0.01 0.11 0.16 1.25 -0.67 0.00 0.00 178.83 179.69 1s6y h LEU 288 N 0.17 0.83 -0.75 1.46 5.85 -1.26 -2.25 115.31 119.36 1s6y h LEU 288 Ca 0.21 -0.21 -0.07 0.00 0.84 0.00 0.00 57.88 58.64 1s6y h LEU 288 Cb 0.28 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.06 1s6y h LEU 288 CO -0.30 0.83 0.11 -0.08 -0.34 0.00 0.00 178.44 178.65 1s6y h GLU 289 N 0.79 1.06 -0.46 1.25 4.81 -0.42 -3.05 114.58 118.56 1s6y h GLU 289 Ca 0.18 -0.27 -0.05 0.00 -0.13 0.00 0.00 59.36 59.08 1s6y h GLU 289 Cb 0.30 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.53 1s6y h GLU 289 CO -0.00 0.97 0.08 0.87 -0.73 0.00 0.00 179.01 180.19 1s6y h LYS 290 N 1.00 0.76 -2.38 1.92 1.57 -0.84 -2.82 116.57 115.79 1s6y h LYS 290 Ca 0.20 -0.20 -0.61 0.00 -1.87 0.00 0.00 60.65 58.17 1s6y h LYS 290 Cb 0.42 -0.09 -0.13 0.00 0.08 0.00 0.00 32.23 32.51 1s6y h LYS 290 CO 0.01 0.77 1.59 -0.85 -0.57 0.00 0.00 179.45 180.40 1s6y n GLU 291 N -4.46 3.57 0.00 3.15 0.28 -0.87 -3.32 120.64 118.99 1s6y n GLU 291 Ca 0.00 -2.81 0.00 0.00 -0.16 0.00 0.00 57.16 54.20 1s6y n GLU 291 Cb 0.24 -2.42 0.00 0.00 1.43 0.00 0.00 31.44 30.69 1s6y n GLU 291 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 177.13 176.86 1s6y n LEU 292 N 1.59 0.00 -0.01 -1.84 7.94 -1.20 -4.67 117.00 118.82 1s6y n LEU 292 Ca 0.57 0.00 -0.01 0.00 -1.11 0.00 0.00 56.01 55.47 1s6y n LEU 292 Cb 0.40 0.00 0.27 0.00 0.53 0.00 0.00 43.42 44.62 1s6y n LEU 292 CO 0.53 0.00 0.91 -0.26 -1.11 0.00 0.00 177.39 177.46 1s6y h PHE 293 N 0.00 0.57 0.00 1.96 0.04 -1.58 -1.55 116.94 116.38 1s6y h PHE 293 Ca 0.00 -0.06 -0.05 0.00 2.80 0.00 0.00 57.97 60.65 1s6y h PHE 293 Cb 0.00 -0.16 -0.01 0.00 2.20 0.00 0.00 35.95 37.98 1s6y h PHE 293 CO 0.00 0.57 -0.25 1.49 -0.60 0.00 0.00 178.31 179.52 1s6y h GLU 294 N 0.52 0.00 -0.06 1.51 4.57 -1.84 -2.41 114.58 116.88 1s6y h GLU 294 Ca 0.11 0.00 -0.20 0.00 -1.18 0.00 0.00 59.36 58.09 1s6y h GLU 294 Cb 0.38 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.96 1s6y h GLU 294 CO 0.02 0.25 -0.81 -0.07 -1.18 0.00 0.00 179.01 177.22 1s6y h LEU 295 N 0.00 0.53 0.00 1.64 4.07 -1.74 -3.21 115.31 116.60 1s6y h LEU 295 Ca -0.00 -0.37 0.00 0.00 0.08 0.00 0.00 57.88 57.59 1s6y h LEU 295 Cb 0.51 -0.16 0.00 0.00 1.08 0.00 0.00 40.66 42.10 1s6y h LEU 295 CO 0.03 1.14 0.00 -1.22 -1.08 0.00 0.00 178.44 177.31 1s6y n TYR 296 N -3.81 0.00 -0.21 1.13 0.53 -0.62 -3.85 117.16 110.34 1s6y n TYR 296 Ca -0.05 0.00 -0.05 0.00 -1.02 0.00 0.00 57.90 56.78 1s6y n TYR 296 Cb 0.75 -0.08 0.11 0.00 -1.03 0.00 0.00 39.34 39.09 1s6y n TYR 296 CO 0.00 0.00 0.00 0.87 -1.02 0.00 0.00 176.86 176.71 1s6y h LYS 297 N 0.00 1.02 -1.97 -0.72 6.56 -1.51 -3.43 116.57 116.52 1s6y h LYS 297 Ca 0.00 -0.22 -0.05 0.00 -1.06 0.00 0.00 60.65 59.32 1s6y h LYS 297 Cb 0.05 -0.15 -0.20 0.00 -0.57 0.00 0.00 32.23 31.37 1s6y h LYS 297 CO 0.00 0.89 0.20 -0.51 -2.06 0.00 0.00 179.45 177.97 1s6y s ASP 298 N -6.50 -0.66 0.00 0.86 1.01 -1.25 -5.07 116.67 105.06 1s6y s ASP 298 Ca -0.11 0.87 0.00 0.00 0.71 0.00 0.00 52.55 54.02 1s6y s ASP 298 Cb 0.15 0.74 0.00 0.00 1.01 0.00 0.00 42.92 44.83 1s6y s ASP 298 CO 0.83 -0.51 0.00 -2.65 0.21 0.00 0.00 175.17 173.05 1s6y n PRO 299 N 1.33 0.00 0.00 8.23 -0.02 -1.26 -5.04 135.00 138.24 1s6y n PRO 299 Ca -0.17 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.31 1s6y n PRO 299 Cb 0.57 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.05 1s6y n PRO 299 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1s6y n ARG 314 N 0.00 0.00 -4.02 -0.52 1.74 -1.26 -4.95 116.66 107.64 1s6y n ARG 314 Ca 0.00 0.00 -0.27 0.00 -0.77 0.00 0.00 57.85 56.81 1s6y n ARG 314 Cb 0.00 0.00 -0.05 0.00 -1.02 0.00 0.00 32.46 31.39 1s6y n ARG 314 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1s6y s GLY 315 N 0.00 1.79 0.00 -0.13 0.00 -1.26 -4.78 107.32 102.94 1s6y s GLY 315 Ca 0.00 -1.10 0.00 0.00 0.00 0.00 0.00 44.72 43.62 1s6y s GLY 315 CO 0.00 -1.10 0.00 0.61 0.00 0.00 0.00 173.10 172.61 1s6y n GLY 316 N -0.25 4.29 3.65 0.20 0.00 -1.26 -5.07 105.19 106.75 1s6y n GLY 316 Ca -0.08 -0.82 -0.00 0.00 0.00 0.00 0.00 46.02 45.12 1s6y n GLY 316 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s6y s ALA 317 N 0.00 -2.46 -0.62 4.61 0.00 -1.26 -5.02 121.76 117.01 1s6y s ALA 317 Ca 0.00 1.93 -0.00 0.00 0.00 0.00 0.00 51.96 53.89 1s6y s ALA 317 Cb 0.00 -1.86 0.44 0.00 0.00 0.00 0.00 23.12 21.70 1s6y s ALA 317 CO 0.00 -0.26 1.88 0.66 0.00 0.00 0.00 175.76 178.04 1s6y n TYR 318 N 2.75 3.14 0.08 0.00 4.02 -1.26 -4.81 117.16 121.08 1s6y n TYR 318 Ca -0.15 -2.84 -0.13 0.00 -0.01 0.00 0.00 57.90 54.77 1s6y n TYR 318 Cb 0.57 -1.22 -0.08 0.00 -0.02 0.00 0.00 39.34 38.58 1s6y n TYR 318 CO 0.00 0.00 0.00 1.88 -1.01 0.00 0.00 176.86 177.73 1s6y h TYR 319 N 2.14 -0.18 0.00 -0.72 0.05 -1.94 -3.09 116.97 113.22 1s6y h TYR 319 Ca 0.56 -0.00 -0.08 0.00 0.05 0.00 0.00 58.73 59.25 1s6y h TYR 319 Cb 0.85 0.06 -0.01 0.00 1.01 0.00 0.00 36.73 38.64 1s6y h TYR 319 CO 1.31 0.13 -0.40 0.77 -1.05 0.00 0.00 178.16 178.92 1s6y h SER 320 N -0.51 0.00 0.07 3.88 0.02 -1.91 -1.71 113.55 113.39 1s6y h SER 320 Ca -0.02 0.00 0.02 0.00 -0.84 0.00 0.00 61.79 60.95 1s6y h SER 320 Cb 0.40 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 62.90 1s6y h SER 320 CO 0.03 0.40 -0.29 -0.78 -1.14 0.00 0.00 176.83 175.05 1s6y h ASP 321 N 0.00 -0.83 0.23 3.07 -0.00 -1.83 -0.57 116.42 116.48 1s6y h ASP 321 Ca -0.00 0.10 -0.05 0.00 -0.00 0.00 0.00 57.03 57.08 1s6y h ASP 321 Cb 0.91 0.33 -0.01 0.00 -0.00 0.00 0.00 39.33 40.56 1s6y h ASP 321 CO 0.05 -0.37 -0.23 0.00 -0.00 0.00 0.00 179.24 178.69 1s6y h ALA 322 N 0.26 1.60 -0.22 -0.78 0.00 -1.38 -1.77 119.26 116.97 1s6y h ALA 322 Ca 0.04 -0.22 -0.09 0.00 0.00 0.00 0.00 54.91 54.65 1s6y h ALA 322 Cb 0.53 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 1s6y h ALA 322 CO -0.20 0.30 -0.22 0.00 0.00 0.00 0.00 179.25 179.13 1s6y h ALA 323 N 1.76 0.33 -0.69 0.00 0.00 -1.04 -2.06 119.26 117.55 1s6y h ALA 323 Ca 0.00 -0.37 -0.07 0.00 0.00 0.00 0.00 54.91 54.47 1s6y h ALA 323 Cb 0.42 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 1s6y h ALA 323 CO 0.03 0.28 0.16 0.00 0.00 0.00 0.00 179.25 179.72 1s6y h SER 325 N 1.06 0.54 -0.27 0.00 0.02 -1.29 -1.21 113.55 112.39 1s6y h SER 325 Ca 0.22 -0.11 -0.04 0.00 -0.84 0.00 0.00 61.79 61.03 1s6y h SER 325 Cb 0.38 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.78 1s6y h SER 325 CO 0.00 0.49 0.03 0.25 -1.14 0.00 0.00 176.83 176.46 1s6y h LEU 326 N 0.54 0.44 -0.15 5.07 5.85 -1.22 -0.85 115.31 124.98 1s6y h LEU 326 Ca 0.15 -0.28 -0.01 0.00 0.84 0.00 0.00 57.88 58.58 1s6y h LEU 326 Cb 0.08 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 40.99 1s6y h LEU 326 CO -0.02 0.60 0.07 0.40 -0.34 0.00 0.00 178.44 179.16 1s6y h ILE 327 N 0.25 1.12 -0.71 4.05 2.04 -1.09 -0.77 117.51 122.41 1s6y h ILE 327 Ca 0.08 -0.35 0.00 0.00 1.00 0.00 0.00 64.86 65.59 1s6y h ILE 327 Cb 0.36 1.08 -0.03 0.00 -0.74 0.00 0.00 36.82 37.49 1s6y h ILE 327 CO 0.01 0.11 0.45 -1.28 0.00 0.00 0.00 178.15 177.44 1s6y h SER 328 N 0.12 0.84 -0.50 1.72 0.87 -1.21 -0.03 113.55 115.35 1s6y h SER 328 Ca 0.05 -0.04 -0.07 0.00 -1.23 0.00 0.00 61.79 60.50 1s6y h SER 328 Cb 0.11 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 61.84 1s6y h SER 328 CO -0.01 0.63 0.04 0.28 -0.53 0.00 0.00 176.83 177.24 1s6y h SER 329 N 0.97 0.84 0.42 6.23 0.02 -0.95 -0.24 113.55 120.84 1s6y h SER 329 Ca 0.26 -0.29 -0.02 0.00 -0.84 0.00 0.00 61.79 60.91 1s6y h SER 329 Cb -0.08 -0.22 -0.00 0.00 0.14 0.00 0.00 62.40 62.24 1s6y h SER 329 CO -0.05 0.92 -0.23 0.40 -1.14 0.00 0.00 176.83 176.72 1s6y h ILE 330 N 0.73 0.52 -0.95 3.27 2.04 -0.93 -0.19 117.51 122.00 1s6y h ILE 330 Ca 0.15 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.08 1s6y h ILE 330 Cb 0.46 0.52 -0.07 0.00 -0.74 0.00 0.00 36.82 37.00 1s6y h ILE 330 CO 0.02 0.00 0.60 0.22 0.00 0.00 0.00 178.15 178.99 1s6y h TYR 331 N -0.61 1.11 -0.02 1.37 3.20 -0.87 -2.68 116.97 118.48 1s6y h TYR 331 Ca -0.05 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.85 1s6y h TYR 331 Cb 0.49 -0.36 0.00 0.00 1.54 0.00 0.00 36.73 38.40 1s6y h TYR 331 CO -0.07 0.55 -0.06 0.09 -1.64 0.00 0.00 178.16 177.03 1s6y n ASN 332 N -4.56 1.76 -3.13 -2.11 3.02 -0.11 -4.97 115.26 105.16 1s6y n ASN 332 Ca 0.15 -1.51 -0.22 0.00 -0.03 0.00 0.00 54.58 52.97 1s6y n ASN 332 Cb 0.20 0.04 0.02 0.00 -0.61 0.00 0.00 39.78 39.44 1s6y n ASN 332 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1s6y n ASP 333 N 0.28 -5.02 -0.14 6.41 2.03 -0.15 -4.88 116.55 115.08 1s6y n ASP 333 Ca 0.16 -0.30 0.08 0.00 0.52 0.00 0.00 54.79 55.25 1s6y n ASP 333 Cb 0.41 -4.10 0.40 0.00 -0.72 0.00 0.00 41.12 37.11 1s6y n ASP 333 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 1s6y h LYS 334 N -1.14 0.63 -2.03 -0.67 1.57 -1.49 -3.44 116.57 110.00 1s6y h LYS 334 Ca -0.48 -0.04 -0.42 0.00 -1.87 0.00 0.00 60.65 57.84 1s6y h LYS 334 Cb 1.33 -0.14 -0.09 0.00 0.08 0.00 0.00 32.23 33.40 1s6y h LYS 334 CO 0.54 0.42 -0.46 0.54 -0.57 0.00 0.00 179.45 179.92 1s6y n ARG 335 N -4.48 -1.58 -1.43 3.15 1.74 0.33 -5.01 116.66 109.38 1s6y n ARG 335 Ca 0.10 1.12 -0.30 0.00 -0.77 0.00 0.00 57.85 58.00 1s6y n ARG 335 Cb 0.24 -5.65 0.11 0.00 -1.02 0.00 0.00 32.46 26.14 1s6y n ARG 335 CO 0.00 0.00 0.00 0.16 -1.52 0.00 0.00 177.63 176.27 1s6y s ASP 336 N -2.40 4.05 -0.25 0.55 -4.77 -1.26 -4.58 116.67 108.02 1s6y s ASP 336 Ca 0.00 1.34 -0.14 0.00 -3.30 0.00 0.00 52.55 50.45 1s6y s ASP 336 Cb 0.00 -2.04 -0.04 0.00 -1.09 0.00 0.00 42.92 39.75 1s6y s ASP 336 CO 0.00 -2.25 0.31 -0.63 0.70 0.00 0.00 175.17 173.30 1s6y s ILE 337 N -3.09 5.24 -0.01 2.11 -1.09 -1.26 -1.53 121.20 121.57 1s6y s ILE 337 Ca 0.62 0.47 0.03 0.00 -2.23 0.00 0.00 60.65 59.53 1s6y s ILE 337 Cb -0.16 -3.64 -0.00 0.00 -1.58 0.00 0.00 42.46 37.08 1s6y s ILE 337 CO 0.55 0.24 -0.09 -1.10 -1.23 0.00 0.00 174.94 173.31 1s6y s GLN 338 N 1.60 0.77 -0.10 2.79 -0.21 -0.10 -4.91 119.66 119.51 1s6y s GLN 338 Ca 0.13 -0.32 -0.30 0.00 0.02 0.00 0.00 55.36 54.90 1s6y s GLN 338 Cb -0.15 -0.74 -0.02 0.00 1.00 0.00 0.00 33.01 33.09 1s6y s GLN 338 CO 0.08 0.18 1.18 -1.25 -2.12 0.00 0.00 175.29 173.36 1s6y s PRO 339 N -0.13 4.32 0.21 2.91 0.04 -1.26 -0.53 135.00 140.56 1s6y s PRO 339 Ca 0.02 1.62 -0.09 0.00 0.04 0.00 0.00 61.00 62.59 1s6y s PRO 339 Cb -0.05 -3.61 -0.01 0.00 0.04 0.00 0.00 34.50 30.87 1s6y s PRO 339 CO -0.00 -0.51 0.34 0.14 0.04 0.00 0.00 177.00 177.02 1s6y s VAL 340 N 2.57 0.02 -0.22 -0.36 -7.23 -1.00 -4.78 120.40 109.40 1s6y s VAL 340 Ca 0.54 -1.50 -0.18 0.00 -1.81 0.00 0.00 61.98 59.03 1s6y s VAL 340 Cb -0.23 -2.12 -0.03 0.00 0.56 0.00 0.00 36.38 34.57 1s6y s VAL 340 CO 0.19 -0.11 0.52 0.20 -0.31 0.00 0.00 175.10 175.59 1s6y s ASN 341 N -3.02 6.52 0.27 4.85 0.01 0.09 -2.31 114.94 121.34 1s6y s ASN 341 Ca 0.23 0.62 -0.14 0.00 -0.71 0.00 0.00 52.86 52.86 1s6y s ASN 341 Cb 0.02 -2.29 0.01 0.00 0.41 0.00 0.00 41.25 39.40 1s6y s ASN 341 CO 0.06 -0.22 0.55 -0.89 -1.51 0.00 0.00 177.10 175.09 1s6y s THR 342 N 1.90 0.00 -0.06 1.60 2.01 -0.62 -1.83 115.64 118.64 1s6y s THR 342 Ca 0.23 -1.31 -0.33 0.00 0.31 0.00 0.00 61.69 60.59 1s6y s THR 342 Cb -0.15 -2.23 -0.11 0.00 0.01 0.00 0.00 72.50 70.01 1s6y s THR 342 CO 0.09 0.00 1.88 -1.14 -0.69 0.00 0.00 174.62 174.77 1s6y n ARG 343 N -0.42 2.30 -0.02 4.92 0.63 -1.26 -1.09 116.66 121.72 1s6y n ARG 343 Ca -0.02 0.84 -0.10 0.00 -0.92 0.00 0.00 57.85 57.65 1s6y n ARG 343 Cb 0.61 -2.70 -0.03 0.00 0.45 0.00 0.00 32.46 30.79 1s6y n ARG 343 CO 0.00 0.00 0.00 -0.97 -2.51 0.00 0.00 177.63 174.15 1s6y h ASN 344 N 9.28 -0.92 -4.64 6.15 -1.24 -0.77 -3.46 115.58 119.97 1s6y h ASN 344 Ca -0.49 0.14 -0.29 0.00 0.71 0.00 0.00 56.30 56.38 1s6y h ASN 344 Cb 1.27 0.41 -0.04 0.00 0.73 0.00 0.00 38.32 40.68 1s6y h ASN 344 CO 0.94 -0.33 -0.41 -3.20 -1.29 0.00 0.00 177.43 173.14 1s6y n ASN 345 N -5.40 -3.71 0.00 1.15 5.15 -0.59 -1.75 115.26 110.11 1s6y n ASN 345 Ca -0.02 -0.06 0.00 0.00 -0.60 0.00 0.00 54.58 53.90 1s6y n ASN 345 Cb 0.31 -3.12 0.00 0.00 -0.53 0.00 0.00 39.78 36.45 1s6y n ASN 345 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1s6y n GLY 346 N -0.97 0.71 0.30 8.20 0.00 -1.26 -4.96 105.19 107.20 1s6y n GLY 346 Ca -0.08 0.00 0.03 0.00 0.00 0.00 0.00 46.02 45.98 1s6y n GLY 346 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s6y h ALA 347 N 0.00 1.66 -3.30 4.61 0.00 -1.69 -3.37 119.26 117.19 1s6y h ALA 347 Ca 0.00 -0.06 -0.65 0.00 0.00 0.00 0.00 54.91 54.20 1s6y h ALA 347 Cb 0.00 -0.16 -0.36 0.00 0.00 0.00 0.00 17.79 17.27 1s6y h ALA 347 CO 0.00 0.29 -0.84 0.42 0.00 0.00 0.00 179.25 179.12 1s6y s ILE 348 N -5.39 1.95 0.45 0.00 1.01 -1.26 -0.72 121.20 117.24 1s6y s ILE 348 Ca -0.08 -1.05 0.17 0.00 0.00 0.00 0.00 60.65 59.69 1s6y s ILE 348 Cb 0.17 -1.87 0.21 0.00 0.01 0.00 0.00 42.46 40.98 1s6y s ILE 348 CO 0.73 0.35 2.02 0.00 0.00 0.00 0.00 174.94 178.04 1s6y h ALA 349 N 7.93 1.63 0.00 9.38 0.00 -1.03 -2.42 119.26 134.74 1s6y h ALA 349 Ca -0.36 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1s6y h ALA 349 Cb 1.11 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1s6y h ALA 349 CO 0.56 0.20 -0.09 -1.13 0.00 0.00 0.00 179.25 178.79 1s6y n SER 350 N -4.19 0.24 -4.60 0.00 3.41 -1.26 -4.79 113.62 102.42 1s6y n SER 350 Ca -0.02 0.40 -0.34 0.00 -0.26 0.00 0.00 58.87 58.64 1s6y n SER 350 Cb 0.23 -0.43 -0.11 0.00 -0.26 0.00 0.00 64.21 63.65 1s6y n SER 350 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1s6y s ILE 351 N -3.02 4.04 0.38 -1.33 -1.09 -0.91 -5.02 121.20 114.25 1s6y s ILE 351 Ca 0.13 -0.33 -0.25 0.00 -2.23 0.00 0.00 60.65 57.96 1s6y s ILE 351 Cb 0.17 -2.71 -0.12 0.00 -1.58 0.00 0.00 42.46 38.22 1s6y s ILE 351 CO 0.57 0.56 0.98 -0.24 -1.23 0.00 0.00 174.94 175.59 1s6y n SER 352 N 2.64 1.15 0.28 3.58 2.88 -1.26 -4.71 113.62 118.17 1s6y n SER 352 Ca -0.18 1.07 0.12 0.00 -1.33 0.00 0.00 58.87 58.55 1s6y n SER 352 Cb 0.53 -1.32 0.79 0.00 -0.75 0.00 0.00 64.21 63.45 1s6y n SER 352 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1s6y h ALA 353 N 1.63 1.65 0.00 -1.46 0.00 -1.94 -2.01 119.26 117.13 1s6y h ALA 353 Ca -0.43 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1s6y h ALA 353 Cb 1.34 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1s6y h ALA 353 CO 0.57 0.03 -0.13 0.93 0.00 0.00 0.00 179.25 180.66 1s6y h GLU 354 N 0.00 0.00 -6.94 0.00 3.07 -1.97 -1.58 114.58 107.17 1s6y h GLU 354 Ca -0.00 0.00 -0.49 0.00 -0.50 0.00 0.00 59.36 58.37 1s6y h GLU 354 Cb 0.06 0.00 0.04 0.00 -0.84 0.00 0.00 28.75 28.01 1s6y h GLU 354 CO 0.00 0.00 0.11 -1.12 -1.40 0.00 0.00 179.01 176.60 1s6y s SER 355 N -4.79 6.15 0.14 1.42 0.01 -0.76 -4.77 113.70 111.10 1s6y s SER 355 Ca 0.09 0.86 -0.26 0.00 1.31 0.00 0.00 55.95 57.96 1s6y s SER 355 Cb 0.11 -2.14 -0.07 0.00 0.21 0.00 0.00 66.02 64.13 1s6y s SER 355 CO 0.63 -0.65 0.79 0.00 0.41 0.00 0.00 173.24 174.43 1s6y s ALA 356 N -2.76 3.41 0.12 1.44 0.00 -1.26 -0.35 121.76 122.36 1s6y s ALA 356 Ca 0.48 0.36 0.04 0.00 0.00 0.00 0.00 51.96 52.85 1s6y s ALA 356 Cb -0.10 -2.99 -0.04 0.00 0.00 0.00 0.00 23.12 19.98 1s6y s ALA 356 CO 0.44 0.22 -0.10 0.14 0.00 0.00 0.00 175.76 176.46 1s6y s VAL 357 N -0.82 1.06 -0.38 0.00 -7.23 -0.25 -4.85 120.40 107.94 1s6y s VAL 357 Ca 0.37 -1.88 -0.10 0.00 -1.81 0.00 0.00 61.98 58.56 1s6y s VAL 357 Cb -0.23 -1.65 0.04 0.00 0.56 0.00 0.00 36.38 35.11 1s6y s VAL 357 CO 0.26 -0.67 0.21 -0.70 -0.31 0.00 0.00 175.10 173.89 1s6y s GLU 358 N -3.35 2.73 0.07 4.82 2.12 -0.80 -1.59 118.70 122.70 1s6y s GLU 358 Ca 0.12 -1.20 -0.06 0.00 0.36 0.00 0.00 54.97 54.18 1s6y s GLU 358 Cb 0.00 -3.71 -0.01 0.00 0.26 0.00 0.00 34.13 30.67 1s6y s GLU 358 CO 0.00 -0.77 0.12 0.14 -0.54 0.00 0.00 175.26 174.21 1s6y s VAL 359 N 1.50 0.16 0.23 3.70 -7.23 -0.98 -2.61 120.40 115.18 1s6y s VAL 359 Ca 0.02 -1.34 -0.32 0.00 -1.81 0.00 0.00 61.98 58.53 1s6y s VAL 359 Cb -0.20 -1.34 -0.12 0.00 0.56 0.00 0.00 36.38 35.27 1s6y s VAL 359 CO 0.05 -0.74 1.63 0.59 -0.31 0.00 0.00 175.10 176.32 1s6y n ASN 360 N 0.07 3.70 -4.16 4.85 4.13 -1.19 -2.36 115.26 120.30 1s6y n ASN 360 Ca -0.15 1.10 -0.17 0.00 1.68 0.00 0.00 54.58 57.04 1s6y n ASN 360 Cb 0.62 -1.55 -0.12 0.00 -1.54 0.00 0.00 39.78 37.19 1s6y n ASN 360 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1s6y s VAL 362 N -1.58 4.93 -0.49 0.00 1.01 0.56 -0.92 120.40 123.90 1s6y s VAL 362 Ca -0.01 1.55 -0.19 0.00 0.00 0.00 0.00 61.98 63.33 1s6y s VAL 362 Cb -0.08 -4.10 0.05 0.00 0.00 0.00 0.00 36.38 32.25 1s6y s VAL 362 CO 0.02 0.09 0.62 -0.63 0.00 0.00 0.00 175.10 175.19 1s6y s ILE 363 N 1.82 4.88 0.48 2.22 -1.09 -0.58 0.12 121.20 129.04 1s6y s ILE 363 Ca 0.37 -0.41 0.06 0.00 -2.23 0.00 0.00 60.65 58.45 1s6y s ILE 363 Cb -0.17 -4.28 -0.00 0.00 -1.58 0.00 0.00 42.46 36.43 1s6y s ILE 363 CO 0.14 -0.76 0.33 0.42 -1.23 0.00 0.00 174.94 173.83 1s6y s THR 364 N 2.63 2.08 0.12 2.92 -4.23 -0.63 -0.51 115.64 118.02 1s6y s THR 364 Ca 0.16 -1.52 0.22 0.00 -1.18 0.00 0.00 61.69 59.37 1s6y s THR 364 Cb -0.18 -2.59 0.20 0.00 1.34 0.00 0.00 72.50 71.26 1s6y s THR 364 CO 0.13 0.00 1.78 0.50 -0.54 0.00 0.00 174.62 176.49 1s6y h LYS 365 N 1.01 0.00 -0.03 3.99 3.64 -1.80 -1.91 116.57 121.48 1s6y h LYS 365 Ca -0.40 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.98 1s6y h LYS 365 Cb 1.28 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.10 1s6y h LYS 365 CO 0.61 0.27 0.00 -3.47 -2.27 0.00 0.00 179.45 174.59 1s6y n ASP 366 N -3.42 0.49 0.00 4.20 2.03 -1.26 -4.92 116.55 113.66 1s6y n ASP 366 Ca 0.00 -1.36 0.00 0.00 0.52 0.00 0.00 54.79 53.95 1s6y n ASP 366 Cb 0.46 -0.02 0.00 0.00 -0.72 0.00 0.00 41.12 40.84 1s6y n ASP 366 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1s6y n GLY 367 N 0.96 -0.25 3.74 0.27 0.00 -0.72 -5.02 105.19 104.17 1s6y n GLY 367 Ca 0.18 -2.28 -0.41 0.00 0.00 0.00 0.00 46.02 43.51 1s6y n GLY 367 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1s6y s PRO 368 N -0.70 4.40 -0.43 1.61 0.02 -1.26 -1.61 135.00 137.03 1s6y s PRO 368 Ca 0.00 2.03 -0.00 0.00 0.02 0.00 0.00 61.00 63.05 1s6y s PRO 368 Cb 0.00 -3.20 0.12 0.00 0.02 0.00 0.00 34.50 31.44 1s6y s PRO 368 CO 0.00 -0.23 0.20 0.15 -0.33 0.00 0.00 177.00 176.79 1s6y s LYS 369 N -0.11 1.94 0.33 5.54 3.01 0.32 -4.90 119.74 125.87 1s6y s LYS 369 Ca 0.56 -2.03 -0.29 0.00 -1.01 0.00 0.00 55.97 53.21 1s6y s LYS 369 Cb -0.36 -3.48 -0.12 0.00 -1.01 0.00 0.00 37.83 32.86 1s6y s LYS 369 CO 0.38 -1.06 1.37 -0.35 0.51 0.00 0.00 175.35 176.20 1s6y n PRO 370 N 4.18 2.26 -3.05 -1.68 -0.04 -1.26 -0.32 135.00 135.08 1s6y n PRO 370 Ca 0.02 0.79 -0.40 0.00 -0.04 0.00 0.00 63.50 63.88 1s6y n PRO 370 Cb 0.40 -2.43 -0.05 0.00 -0.04 0.00 0.00 33.50 31.38 1s6y n PRO 370 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1s6y s ILE 371 N -0.82 5.04 0.04 0.52 1.01 -0.90 -4.89 121.20 121.20 1s6y s ILE 371 Ca 0.58 1.44 -0.36 0.00 0.00 0.00 0.00 60.65 62.31 1s6y s ILE 371 Cb -0.56 -4.04 -0.15 0.00 0.01 0.00 0.00 42.46 37.73 1s6y s ILE 371 CO 0.59 0.26 1.57 0.00 0.00 0.00 0.00 174.94 177.36 1s6y n ALA 372 N 3.71 0.27 -0.09 9.38 0.00 -1.26 -4.89 120.51 127.64 1s6y n ALA 372 Ca -0.02 0.44 -0.11 0.00 0.00 0.00 0.00 53.44 53.75 1s6y n ALA 372 Cb 0.51 -2.26 -0.15 0.00 0.00 0.00 0.00 19.45 17.55 1s6y n ALA 372 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1s6y n VAL 373 N 3.54 1.46 0.00 0.00 0.31 0.10 -5.05 118.33 118.70 1s6y n VAL 373 Ca 0.20 -0.80 0.00 0.00 -0.01 0.00 0.00 64.34 63.73 1s6y n VAL 373 Cb 0.23 -0.76 0.00 0.00 -0.91 0.00 0.00 33.84 32.40 1s6y n VAL 373 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1s6y n GLY 374 N 1.80 1.14 3.58 2.92 0.00 -0.89 -4.90 105.19 108.83 1s6y n GLY 374 Ca -0.32 -0.56 -0.09 0.00 0.00 0.00 0.00 46.02 45.05 1s6y n GLY 374 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1s6y s ASP 375 N -4.00 -0.40 0.57 1.61 -1.08 -1.26 -0.63 116.67 111.48 1s6y s ASP 375 Ca 0.00 -0.17 -0.19 0.00 -0.52 0.00 0.00 52.55 51.66 1s6y s ASP 375 Cb 0.00 0.55 -0.05 0.00 -1.46 0.00 0.00 42.92 41.96 1s6y s ASP 375 CO 0.00 -0.93 1.17 -0.76 0.52 0.00 0.00 175.17 175.17 1s6y s LEU 376 N -2.74 3.71 0.50 -1.34 2.01 -1.26 -4.98 118.68 114.58 1s6y s LEU 376 Ca 0.06 2.29 -0.23 0.00 0.01 0.00 0.00 54.13 56.26 1s6y s LEU 376 Cb -0.02 -4.59 -0.07 0.00 0.01 0.00 0.00 46.19 41.52 1s6y s LEU 376 CO -0.06 -1.42 1.21 -2.65 1.01 0.00 0.00 176.35 174.45 1s6y n PRO 377 N -1.45 1.58 -0.25 1.29 -0.02 -1.26 -4.73 135.00 130.15 1s6y n PRO 377 Ca 0.13 0.58 0.06 0.00 -2.02 0.00 0.00 63.50 62.24 1s6y n PRO 377 Cb 0.50 -2.38 0.19 0.00 -0.02 0.00 0.00 33.50 31.80 1s6y n PRO 377 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1s6y h VAL 378 N 1.47 0.55 -0.85 -1.45 2.07 -1.99 -1.05 116.25 115.00 1s6y h VAL 378 Ca -0.49 -0.11 0.21 0.00 0.82 0.00 0.00 66.70 67.14 1s6y h VAL 378 Cb 1.32 0.20 -0.15 0.00 -1.52 0.00 0.00 31.29 31.14 1s6y h VAL 378 CO 0.57 0.06 0.07 0.00 0.02 0.00 0.00 177.57 178.28 1s6y h ALA 379 N 1.60 1.01 -0.01 1.67 0.00 -1.96 -2.44 119.26 119.13 1s6y h ALA 379 Ca 0.42 0.26 0.00 0.00 0.00 0.00 0.00 54.91 55.60 1s6y h ALA 379 Cb 0.71 0.44 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1s6y h ALA 379 CO -0.48 -0.47 -0.27 1.33 0.00 0.00 0.00 179.25 179.36 1s6y n VAL 380 N -5.35 0.00 0.07 0.00 0.24 -0.49 -4.57 118.33 108.24 1s6y n VAL 380 Ca 0.18 -0.37 -0.05 0.00 -2.04 0.00 0.00 64.34 62.06 1s6y n VAL 380 Cb 0.60 1.24 0.13 0.00 -1.47 0.00 0.00 33.84 34.33 1s6y n VAL 380 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 1s6y h ARG 381 N 2.22 0.30 -0.23 7.34 2.43 -0.81 -2.69 114.38 122.95 1s6y h ARG 381 Ca 0.00 -0.19 -0.03 0.00 -0.81 0.00 0.00 59.98 58.95 1s6y h ARG 381 Cb 0.61 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.17 1s6y h ARG 381 CO 0.00 0.78 0.03 0.78 -1.51 0.00 0.00 179.97 180.05 1s6y h GLY 382 N 1.36 0.42 1.00 2.80 0.00 -1.81 -2.32 103.07 104.52 1s6y h GLY 382 Ca 0.00 -0.28 -0.00 0.00 0.00 0.00 0.00 47.33 47.05 1s6y h GLY 382 CO 0.09 0.26 -0.03 -2.00 0.00 0.00 0.00 176.54 174.86 1s6y h LEU 383 N 0.19 -0.06 -1.58 3.11 6.46 -1.81 -1.54 115.31 120.08 1s6y h LEU 383 Ca 0.07 0.00 -0.00 0.00 -0.12 0.00 0.00 57.88 57.83 1s6y h LEU 383 Cb 0.33 0.02 -0.02 0.00 -0.73 0.00 0.00 40.66 40.26 1s6y h LEU 383 CO 0.01 -0.04 0.24 -0.37 -0.62 0.00 0.00 178.44 177.65 1s6y h VAL 384 N -0.07 1.11 -0.15 1.05 -1.51 -1.52 -1.96 116.25 113.20 1s6y h VAL 384 Ca -0.01 -0.23 -0.14 0.00 -1.23 0.00 0.00 66.70 65.09 1s6y h VAL 384 Cb 0.05 0.55 -0.01 0.00 -2.13 0.00 0.00 31.29 29.76 1s6y h VAL 384 CO 0.01 0.11 -0.50 -0.61 -1.23 0.00 0.00 177.57 175.36 1s6y h GLN 385 N 0.53 0.40 -0.30 5.19 5.75 -0.95 -1.14 115.11 124.61 1s6y h GLN 385 Ca 0.14 -0.23 -0.02 0.00 -0.15 0.00 0.00 58.65 58.40 1s6y h GLN 385 Cb -0.03 0.02 -0.01 0.00 1.07 0.00 0.00 27.48 28.52 1s6y h GLN 385 CO -0.03 0.81 0.12 1.96 -2.65 0.00 0.00 178.83 179.04 1s6y h GLN 386 N 0.32 0.44 -0.60 1.69 1.08 -0.71 -0.88 115.11 116.45 1s6y h GLN 386 Ca 0.01 -0.08 -0.09 0.00 -1.45 0.00 0.00 58.65 57.05 1s6y h GLN 386 Cb 0.99 -0.07 -0.02 0.00 -0.05 0.00 0.00 27.48 28.32 1s6y h GLN 386 CO 0.09 0.45 0.02 0.82 -0.95 0.00 0.00 178.83 179.25 1s6y h ILE 387 N 0.33 1.26 0.38 2.54 5.03 -1.19 0.01 117.51 125.87 1s6y h ILE 387 Ca 0.10 -1.12 -0.02 0.00 -0.12 0.00 0.00 64.86 63.70 1s6y h ILE 387 Cb 0.17 0.81 -0.00 0.00 -3.03 0.00 0.00 36.82 34.77 1s6y h ILE 387 CO -0.01 0.41 -0.21 0.50 -0.68 0.00 0.00 178.15 178.16 1s6y h LYS 388 N 0.94 -0.53 -0.76 2.37 1.63 -1.19 0.39 116.57 119.43 1s6y h LYS 388 Ca 0.17 0.04 0.15 0.00 -0.85 0.00 0.00 60.65 60.16 1s6y h LYS 388 Cb 0.54 0.12 -0.14 0.00 -0.60 0.00 0.00 32.23 32.14 1s6y h LYS 388 CO 0.03 -0.35 -0.21 0.77 -3.45 0.00 0.00 179.45 176.24 1s6y h SER 389 N -0.55 -0.77 0.28 4.20 0.02 -1.02 0.72 113.55 116.44 1s6y h SER 389 Ca -0.05 0.23 -0.00 0.00 -0.84 0.00 0.00 61.79 61.14 1s6y h SER 389 Cb 0.44 0.49 -0.02 0.00 0.14 0.00 0.00 62.40 63.45 1s6y h SER 389 CO 0.06 -0.26 -0.25 0.15 -1.14 0.00 0.00 176.83 175.39 1s6y h PHE 390 N -0.01 -0.66 -0.84 3.45 3.57 -0.19 -2.10 116.94 120.15 1s6y h PHE 390 Ca 0.36 0.00 0.17 0.00 3.53 0.00 0.00 57.97 62.03 1s6y h PHE 390 Cb 0.56 0.26 -0.10 0.00 2.79 0.00 0.00 35.95 39.45 1s6y h PHE 390 CO -0.62 -0.37 0.39 0.93 -2.23 0.00 0.00 178.31 176.41 1s6y h GLU 391 N -0.55 0.50 -0.06 1.11 5.08 0.45 0.19 114.58 121.29 1s6y h GLU 391 Ca -0.01 -0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.26 1s6y h GLU 391 Cb 0.50 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.64 1s6y h GLU 391 CO -0.04 0.33 -0.17 0.00 -1.00 0.00 0.00 179.01 178.13 1s6y h ARG 392 N 0.51 0.22 -0.52 2.33 3.08 -0.67 0.11 114.38 119.44 1s6y h ARG 392 Ca 0.48 -0.16 -0.09 0.00 0.07 0.00 0.00 59.98 60.29 1s6y h ARG 392 Cb 0.78 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.84 1s6y h ARG 392 CO -0.43 0.77 -0.01 0.28 -1.07 0.00 0.00 179.97 179.51 1s6y h VAL 393 N -0.28 1.26 -0.61 2.04 2.07 -1.20 -1.82 116.25 117.71 1s6y h VAL 393 Ca -0.00 -1.11 -0.01 0.00 0.82 0.00 0.00 66.70 66.39 1s6y h VAL 393 Cb 0.78 0.94 -0.03 0.00 -1.52 0.00 0.00 31.29 31.46 1s6y h VAL 393 CO 0.04 0.39 0.32 0.00 0.02 0.00 0.00 177.57 178.34 1s6y h ALA 394 N 0.94 0.78 -0.26 1.67 0.00 -0.64 -1.52 119.26 120.23 1s6y h ALA 394 Ca 0.15 -0.11 -0.10 0.00 0.00 0.00 0.00 54.91 54.84 1s6y h ALA 394 Cb 0.54 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1s6y h ALA 394 CO 0.03 0.31 -0.28 0.00 0.00 0.00 0.00 179.25 179.30 1s6y h ALA 395 N 1.15 1.03 0.10 0.00 0.00 -0.91 -1.56 119.26 119.08 1s6y h ALA 395 Ca 0.21 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 1s6y h ALA 395 Cb 0.06 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1s6y h ALA 395 CO -0.03 0.58 -0.05 1.49 0.00 0.00 0.00 179.25 181.24 1s6y h GLU 396 N 0.45 -0.13 -0.72 0.00 4.81 -1.07 -2.69 114.58 115.23 1s6y h GLU 396 Ca 0.06 0.01 0.13 0.00 -0.13 0.00 0.00 59.36 59.43 1s6y h GLU 396 Cb 0.72 0.03 -0.05 0.00 0.63 0.00 0.00 28.75 30.09 1s6y h GLU 396 CO 0.06 0.03 0.48 0.00 -0.73 0.00 0.00 179.01 178.85 1s6y h ALA 397 N 0.61 2.07 -0.35 2.92 0.00 -1.17 -0.79 119.26 122.55 1s6y h ALA 397 Ca -0.01 -0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 1s6y h ALA 397 Cb 0.23 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1s6y h ALA 397 CO 0.02 -0.25 -0.16 0.00 0.00 0.00 0.00 179.25 178.86 1s6y h ALA 398 N 1.66 1.07 0.20 0.00 0.00 -1.09 0.16 119.26 121.25 1s6y h ALA 398 Ca 0.35 -0.32 -0.35 0.00 0.00 0.00 0.00 54.91 54.59 1s6y h ALA 398 Cb 0.74 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 18.40 1s6y h ALA 398 CO -0.11 0.57 -1.70 0.28 0.00 0.00 0.00 179.25 178.29 1s6y h VAL 399 N 0.57 1.00 0.00 0.00 2.07 -1.08 -3.39 116.25 115.42 1s6y h VAL 399 Ca 0.09 -2.56 -0.22 0.00 0.82 0.00 0.00 66.70 64.84 1s6y h VAL 399 Cb 0.60 2.81 -0.04 0.00 -1.52 0.00 0.00 31.29 33.15 1s6y h VAL 399 CO 0.04 0.85 -1.32 0.71 0.02 0.00 0.00 177.57 177.87 1s6y h THR 400 N 0.11 0.94 -0.65 2.57 1.35 -1.19 -3.48 112.91 112.55 1s6y h THR 400 Ca -0.33 -2.60 -0.26 0.00 -0.55 0.00 0.00 66.41 62.67 1s6y h THR 400 Cb 2.11 2.40 -0.10 0.00 -1.73 0.00 0.00 68.15 70.84 1s6y h THR 400 CO 0.20 0.53 -0.24 0.61 -0.25 0.00 0.00 175.52 176.37 1s6y n GLY 401 N 1.42 1.30 3.68 5.82 0.00 0.56 -4.94 105.19 113.03 1s6y n GLY 401 Ca -0.09 -0.43 -0.43 0.00 0.00 0.00 0.00 46.02 45.08 1s6y n GLY 401 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1s6y s ASP 402 N -2.85 7.07 0.08 1.61 -1.08 -1.26 -4.73 116.67 115.53 1s6y s ASP 402 Ca 0.00 1.69 -0.20 0.00 -0.52 0.00 0.00 52.55 53.53 1s6y s ASP 402 Cb 0.00 -2.55 -0.09 0.00 -1.46 0.00 0.00 42.92 38.82 1s6y s ASP 402 CO 0.00 -0.60 1.57 0.22 0.52 0.00 0.00 175.17 176.88 1s6y h TYR 403 N 7.53 0.35 -0.76 -5.34 3.20 -1.94 -1.05 116.97 118.97 1s6y h TYR 403 Ca -0.31 -0.04 0.05 0.00 3.14 0.00 0.00 58.73 61.58 1s6y h TYR 403 Cb 1.14 -0.10 -0.06 0.00 1.54 0.00 0.00 36.73 39.25 1s6y h TYR 403 CO 0.74 0.45 0.46 1.96 -1.64 0.00 0.00 178.16 180.13 1s6y h GLN 404 N 0.15 0.83 -0.19 1.82 4.20 -1.99 0.36 115.11 120.29 1s6y h GLN 404 Ca 0.07 -0.05 -0.00 0.00 0.06 0.00 0.00 58.65 58.72 1s6y h GLN 404 Cb 0.28 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.86 1s6y h GLN 404 CO 0.00 0.55 0.11 1.15 -0.67 0.00 0.00 178.83 179.97 1s6y h THR 405 N 0.86 1.10 -0.84 -0.54 2.02 -1.92 -0.82 112.91 112.77 1s6y h THR 405 Ca 0.33 -0.27 0.08 0.00 0.77 0.00 0.00 66.41 67.32 1s6y h THR 405 Cb 0.14 0.94 -0.07 0.00 -1.74 0.00 0.00 68.15 67.41 1s6y h THR 405 CO -0.16 0.10 0.50 0.00 0.37 0.00 0.00 175.52 176.33 1s6y h ALA 406 N 1.00 1.19 -0.35 6.16 0.00 -0.62 -2.10 119.26 124.54 1s6y h ALA 406 Ca 0.07 0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.90 1s6y h ALA 406 Cb 0.06 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1s6y h ALA 406 CO -0.01 0.18 -0.17 1.25 0.00 0.00 0.00 179.25 180.50 1s6y h LEU 407 N 0.88 0.64 -0.44 0.00 5.85 -0.33 -2.57 115.31 119.34 1s6y h LEU 407 Ca 0.39 -0.20 -0.03 0.00 0.84 0.00 0.00 57.88 58.88 1s6y h LEU 407 Cb 0.28 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.12 1s6y h LEU 407 CO -0.21 0.82 0.17 0.58 -0.34 0.00 0.00 178.44 179.46 1s6y h VAL 408 N 0.58 1.20 0.00 1.05 2.07 -0.85 -1.13 116.25 119.18 1s6y h VAL 408 Ca 0.09 -0.64 0.00 0.00 0.82 0.00 0.00 66.70 66.98 1s6y h VAL 408 Cb 0.62 0.80 0.00 0.00 -1.52 0.00 0.00 31.29 31.19 1s6y h VAL 408 CO 0.04 0.23 0.00 0.00 0.02 0.00 0.00 177.57 177.87 1s6y n ALA 409 N -2.32 0.99 0.00 1.67 0.00 -0.82 -1.06 120.51 118.97 1s6y n ALA 409 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 1s6y n ALA 409 Cb 0.15 -0.82 0.00 0.00 0.00 0.00 0.00 19.45 18.78 1s6y n ALA 409 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1s6y n THR 411 N 0.06 0.00 0.40 0.00 -1.04 -0.43 -2.44 114.28 110.83 1s6y n THR 411 Ca 0.00 0.00 0.12 0.00 -2.04 0.00 0.00 64.05 62.13 1s6y n THR 411 Cb 0.00 0.00 0.27 0.00 -1.82 0.00 0.00 70.33 68.78 1s6y n THR 411 CO 0.00 0.00 0.00 0.16 -0.64 0.00 0.00 175.07 174.59 1s6y h ILE 412 N 0.00 0.00 -2.31 12.58 3.07 -1.35 -3.46 117.51 126.04 1s6y h ILE 412 Ca 0.00 -0.77 -0.61 0.00 1.55 0.00 0.00 64.86 65.03 1s6y h ILE 412 Cb 0.00 1.77 0.07 0.00 -0.27 0.00 0.00 36.82 38.39 1s6y h ILE 412 CO 0.00 0.00 0.59 -3.20 -1.05 0.00 0.00 178.15 174.49 1s6y n ASN 413 N -2.74 2.48 0.25 2.16 2.85 -1.02 -4.84 115.26 114.41 1s6y n ASN 413 Ca 0.05 1.12 0.18 0.00 -0.11 0.00 0.00 54.58 55.82 1s6y n ASN 413 Cb 0.49 -1.36 0.90 0.00 1.24 0.00 0.00 39.78 41.05 1s6y n ASN 413 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1s6y h PRO 414 N 4.63 0.00 -0.01 1.20 0.11 -1.92 -2.56 132.00 133.45 1s6y h PRO 414 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1s6y h PRO 414 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1s6y h PRO 414 CO 0.79 0.00 -0.38 1.28 -0.21 0.00 0.00 178.00 179.48 1s6y n LEU 415 N -3.55 0.91 -4.58 2.35 4.77 -1.26 -4.81 117.00 110.83 1s6y n LEU 415 Ca 0.00 -0.22 -0.38 0.00 -0.03 0.00 0.00 56.01 55.39 1s6y n LEU 415 Cb 0.27 -0.15 -0.11 0.00 -2.33 0.00 0.00 43.42 41.10 1s6y n LEU 415 CO 0.24 0.18 -0.18 -0.69 -1.33 0.00 0.00 177.39 175.62 1s6y s VAL 416 N -2.68 5.23 0.27 4.08 1.01 -0.97 -4.55 120.40 122.79 1s6y s VAL 416 Ca 0.19 0.14 -0.03 0.00 0.00 0.00 0.00 61.98 62.28 1s6y s VAL 416 Cb 0.18 -3.49 0.20 0.00 0.00 0.00 0.00 36.38 33.27 1s6y s VAL 416 CO 0.60 0.26 1.87 -0.65 0.00 0.00 0.00 175.10 177.18 1s6y h PRO 417 N 8.31 1.04 -3.28 2.72 0.11 -1.87 -3.46 132.00 135.57 1s6y h PRO 417 Ca -0.35 -0.14 -0.03 0.00 0.11 0.00 0.00 66.00 65.58 1s6y h PRO 417 Cb 1.19 -0.19 -0.11 0.00 0.11 0.00 0.00 31.00 32.00 1s6y h PRO 417 CO 0.56 0.80 0.03 -1.54 -0.21 0.00 0.00 178.00 177.64 1s6y s SER 418 N -6.41 -0.29 0.21 -2.05 1.04 -1.26 -5.04 113.70 99.90 1s6y s SER 418 Ca -0.11 -0.38 -0.09 0.00 0.48 0.00 0.00 55.95 55.85 1s6y s SER 418 Cb 0.16 0.56 0.17 0.00 0.10 0.00 0.00 66.02 67.01 1s6y s SER 418 CO 0.81 -1.00 1.83 -2.24 0.98 0.00 0.00 173.24 173.62 1s6y h ASP 419 N 2.21 1.02 0.12 7.02 -0.00 -1.91 -0.20 116.42 124.67 1s6y h ASP 419 Ca -0.30 -0.10 0.01 0.00 -0.00 0.00 0.00 57.03 56.64 1s6y h ASP 419 Cb 1.27 -0.26 -0.03 0.00 -0.00 0.00 0.00 39.33 40.31 1s6y h ASP 419 CO 0.39 0.83 -0.22 0.74 -0.00 0.00 0.00 179.24 180.98 1s6y h THR 420 N 1.13 0.51 -0.67 1.15 2.02 -2.00 -1.27 112.91 113.78 1s6y h THR 420 Ca 0.28 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.40 1s6y h THR 420 Cb 0.04 0.51 -0.03 0.00 -1.74 0.00 0.00 68.15 66.93 1s6y h THR 420 CO -0.04 0.00 0.17 0.40 0.37 0.00 0.00 175.52 176.42 1s6y h ILE 421 N -0.41 1.25 -0.26 3.11 2.04 -1.96 -2.66 117.51 118.62 1s6y h ILE 421 Ca 0.03 -0.91 0.05 0.00 1.00 0.00 0.00 64.86 65.03 1s6y h ILE 421 Cb 0.43 0.55 -0.05 0.00 -0.74 0.00 0.00 36.82 37.02 1s6y h ILE 421 CO -0.12 0.35 -0.07 0.00 0.00 0.00 0.00 178.15 178.31 1s6y h ALA 422 N 1.19 0.16 -0.30 1.87 0.00 -0.72 -0.92 119.26 120.53 1s6y h ALA 422 Ca 0.21 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.22 1s6y h ALA 422 Cb 0.33 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1s6y h ALA 422 CO -0.00 -0.48 0.19 -0.22 0.00 0.00 0.00 179.25 178.74 1s6y h LYS 423 N -0.01 0.40 -0.04 0.00 3.64 -1.16 0.10 116.57 119.50 1s6y h LYS 423 Ca 0.13 -0.03 0.03 0.00 -1.27 0.00 0.00 60.65 59.51 1s6y h LYS 423 Cb 0.20 -0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 31.90 1s6y h LYS 423 CO -0.27 0.29 -0.18 1.96 -2.27 0.00 0.00 179.45 178.98 1s6y h GLN 424 N 0.39 -0.27 -0.22 1.90 4.20 -1.16 0.13 115.11 120.08 1s6y h GLN 424 Ca 0.11 0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.84 1s6y h GLN 424 Cb -0.02 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.81 1s6y h GLN 424 CO -0.02 -0.18 0.14 0.82 -0.67 0.00 0.00 178.83 178.92 1s6y h ILE 425 N -0.28 1.08 -0.14 2.54 2.04 -1.09 -1.90 117.51 119.76 1s6y h ILE 425 Ca 0.07 -0.19 0.05 0.00 1.00 0.00 0.00 64.86 65.78 1s6y h ILE 425 Cb 0.37 0.81 -0.05 0.00 -0.74 0.00 0.00 36.82 37.21 1s6y h ILE 425 CO -0.20 0.08 -0.19 0.25 0.00 0.00 0.00 178.15 178.10 1s6y h LEU 426 N 0.27 -0.58 -0.92 1.44 5.85 -0.61 -2.57 115.31 118.20 1s6y h LEU 426 Ca 0.08 0.10 -0.06 0.00 0.84 0.00 0.00 57.88 58.84 1s6y h LEU 426 Cb 0.01 0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.28 1s6y h LEU 426 CO -0.02 -0.23 0.14 0.44 -0.34 0.00 0.00 178.44 178.43 1s6y h ASP 427 N -0.23 0.87 0.00 1.25 3.45 -0.73 0.25 116.42 121.28 1s6y h ASP 427 Ca 0.10 -0.17 0.00 0.00 0.43 0.00 0.00 57.03 57.39 1s6y h ASP 427 Cb 0.38 -0.23 0.00 0.00 -0.56 0.00 0.00 39.33 38.92 1s6y h ASP 427 CO -0.28 0.85 0.00 1.21 -1.57 0.00 0.00 179.24 179.45 1s6y n GLU 428 N -4.25 0.49 0.00 3.56 2.13 -0.72 -2.77 120.64 119.08 1s6y n GLU 428 Ca 0.04 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.86 1s6y n GLU 428 Cb 0.24 -1.24 0.00 0.00 0.27 0.00 0.00 31.44 30.71 1s6y n GLU 428 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 1s6y n LEU 430 N 0.23 0.00 -0.17 4.31 4.77 0.07 -0.85 117.00 125.36 1s6y n LEU 430 Ca 0.00 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.89 1s6y n LEU 430 Cb 0.12 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.21 1s6y n LEU 430 CO 0.00 0.00 0.86 -0.08 -1.33 0.00 0.00 177.39 176.84 1s6y h GLU 431 N 0.00 0.81 -0.46 3.23 4.57 -1.77 -2.08 114.58 118.88 1s6y h GLU 431 Ca 0.00 -0.22 -0.00 0.00 -1.18 0.00 0.00 59.36 57.96 1s6y h GLU 431 Cb 0.00 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 28.47 1s6y h GLU 431 CO 0.00 0.81 0.27 0.00 -1.18 0.00 0.00 179.01 178.91 1s6y h ALA 432 N 0.97 1.62 -0.24 2.92 0.00 -1.27 -3.03 119.26 120.23 1s6y h ALA 432 Ca 0.15 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1s6y h ALA 432 Cb 0.39 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1s6y h ALA 432 CO 0.01 0.33 -0.00 0.72 0.00 0.00 0.00 179.25 180.31 1s6y n HIS 433 N -4.44 0.86 -0.26 0.00 8.25 -1.15 -4.79 115.22 113.69 1s6y n HIS 433 Ca 0.04 -0.95 -0.03 0.00 -0.26 0.00 0.00 57.72 56.51 1s6y n HIS 433 Cb 0.08 -0.31 -0.01 0.00 1.12 0.00 0.00 29.99 30.86 1s6y n HIS 433 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1s6y n LYS 434 N -0.67 -0.21 0.31 -0.41 5.02 -0.79 -0.83 118.16 120.59 1s6y n LYS 434 Ca 0.22 0.98 0.20 0.00 -2.02 0.00 0.00 58.31 57.69 1s6y n LYS 434 Cb 0.88 -1.45 1.07 0.00 -0.02 0.00 0.00 35.03 35.50 1s6y n LYS 434 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 1s6y h GLU 435 N 0.00 0.00 -0.16 1.97 5.08 -1.88 -2.76 114.58 116.83 1s6y h GLU 435 Ca 0.17 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.52 1s6y h GLU 435 Cb 0.33 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 1s6y h GLU 435 CO -0.62 0.00 -0.02 0.66 -1.00 0.00 0.00 179.01 178.02 1s6y n TYR 436 N -3.30 0.57 -3.14 4.33 4.02 -0.01 -4.82 117.16 114.80 1s6y n TYR 436 Ca -0.02 -1.01 -0.22 0.00 -0.01 0.00 0.00 57.90 56.64 1s6y n TYR 436 Cb 0.14 -0.27 -0.04 0.00 -0.02 0.00 0.00 39.34 39.15 1s6y n TYR 436 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 1s6y n LEU 437 N -0.93 1.84 0.25 7.72 4.32 -1.04 -4.47 117.00 124.69 1s6y n LEU 437 Ca 0.20 -5.16 0.13 0.00 -0.02 0.00 0.00 56.01 51.16 1s6y n LEU 437 Cb 0.80 0.30 0.58 0.00 -1.62 0.00 0.00 43.42 43.49 1s6y n LEU 437 CO 0.10 2.26 0.90 1.55 -1.22 0.00 0.00 177.39 180.98 1s6y h PRO 438 N 3.21 0.00 0.00 3.23 0.13 -1.82 0.40 132.00 137.16 1s6y h PRO 438 Ca 0.11 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.23 1s6y h PRO 438 Cb 0.82 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.95 1s6y h PRO 438 CO 0.60 0.12 -0.07 -0.56 -0.23 0.00 0.00 178.00 177.86 1s6y h GLN 439 N 0.00 0.00 0.00 0.86 -0.00 -1.92 -3.33 115.11 110.72 1s6y h GLN 439 Ca -0.00 0.00 -0.33 0.00 -0.00 0.00 0.00 58.65 58.32 1s6y h GLN 439 Cb 0.61 0.00 -0.06 0.00 -0.00 0.00 0.00 27.48 28.03 1s6y h GLN 439 CO 0.02 0.07 -2.23 1.19 -0.00 0.00 0.00 178.83 177.87 1s6y n PHE 440 N -3.15 0.00 -3.86 0.06 3.01 0.31 -4.38 117.46 109.46 1s6y n PHE 440 Ca 0.02 0.00 -0.30 0.00 1.01 0.00 0.00 57.45 58.18 1s6y n PHE 440 Cb 0.43 -0.85 -0.16 0.00 -0.01 0.00 0.00 39.48 38.90 1s6y n PHE 440 CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 1s6y s PHE 441 N -2.43 2.06 -2.00 1.38 0.40 0.12 -5.01 117.98 112.49 1s6y s PHE 441 Ca -0.22 -1.65 0.20 0.00 -0.60 0.00 0.00 56.93 54.66 1s6y s PHE 441 Cb 0.07 -1.59 1.20 0.00 0.51 0.00 0.00 43.02 43.21 1s6y s PHE 441 CO 0.58 -0.77 1.66 1.63 0.70 0.00 0.00 175.22 179.02 1s6y n LYS 442 N 4.76 0.82 -1.70 0.44 4.76 -1.25 -4.05 118.16 121.94 1s6y n LYS 442 Ca -0.08 0.00 -0.29 0.00 -2.87 0.00 0.00 58.31 55.07 1s6y n LYS 442 Cb 0.44 -1.39 0.12 0.00 -1.84 0.00 0.00 35.03 32.37 1s6y n LYS 442 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 1s6y s GLN 443 N -2.00 1.38 0.00 1.97 -0.21 -1.26 -4.84 119.66 114.70 1s6y s GLN 443 Ca 0.30 0.16 0.00 0.00 0.02 0.00 0.00 55.36 55.84 1s6y s GLN 443 Cb 0.14 -1.88 0.00 0.00 1.00 0.00 0.00 33.01 32.27 1s6y s GLN 443 CO 0.23 -2.01 0.00 0.00 -2.12 0.00 0.00 175.29 171.40 1s6y n ALA 444 N -3.61 -0.72 -0.92 6.09 0.00 -1.26 -5.07 120.51 115.02 1s6y n ALA 444 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.52 1s6y n ALA 444 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.05 1s6y n ALA 444 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86