#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1g6n s ASP 8 N 0.00 1.03 0.26 1.09 -4.77 -1.26 -5.05 116.67 107.97 1g6n s ASP 8 Ca 0.00 -1.56 -0.03 0.00 -3.30 0.00 0.00 52.55 47.66 1g6n s ASP 8 Cb 0.00 0.44 0.39 0.00 -1.09 0.00 0.00 42.92 42.66 1g6n s ASP 8 CO 0.00 -0.93 1.88 -0.65 0.70 0.00 0.00 175.17 176.18 1g6n h PRO 9 N 2.35 1.14 -0.48 2.11 0.11 -2.05 -1.06 132.00 134.12 1g6n h PRO 9 Ca -0.32 -0.07 -0.04 0.00 0.11 0.00 0.00 66.00 65.69 1g6n h PRO 9 Cb 1.24 -0.26 -0.02 0.00 0.11 0.00 0.00 31.00 32.08 1g6n h PRO 9 CO 0.47 0.76 0.15 1.15 -0.21 0.00 0.00 178.00 180.32 1g6n h THR 10 N 1.18 1.23 0.06 -1.15 2.02 -1.98 0.15 112.91 114.40 1g6n h THR 10 Ca 0.42 -0.75 -0.00 0.00 0.77 0.00 0.00 66.41 66.85 1g6n h THR 10 Cb 0.14 0.80 0.00 0.00 -1.74 0.00 0.00 68.15 67.36 1g6n h THR 10 CO -0.17 0.27 -0.03 0.25 0.37 0.00 0.00 175.52 176.22 1g6n h LEU 11 N 0.65 -0.07 -2.06 2.58 5.85 -1.90 -1.33 115.31 119.03 1g6n h LEU 11 Ca 0.16 -0.14 0.01 0.00 0.84 0.00 0.00 57.88 58.75 1g6n h LEU 11 Cb 0.27 0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.31 1g6n h LEU 11 CO -0.01 0.10 0.02 -0.33 -0.34 0.00 0.00 178.44 177.89 1g6n h GLU 12 N -0.23 0.00 -0.09 1.25 4.39 -1.05 0.82 114.58 119.66 1g6n h GLU 12 Ca -0.01 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.66 1g6n h GLU 12 Cb 0.20 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.85 1g6n h GLU 12 CO 0.01 0.00 -0.06 2.35 -1.16 0.00 0.00 179.01 180.15 1g6n h TRP 13 N 0.00 0.24 -0.05 4.33 7.01 -0.24 -2.39 115.95 124.86 1g6n h TRP 13 Ca 0.02 -0.06 0.01 0.00 2.11 0.00 0.00 58.89 60.96 1g6n h TRP 13 Cb 0.06 -0.05 -0.01 0.00 -2.10 0.00 0.00 29.16 27.06 1g6n h TRP 13 CO 0.00 0.59 -0.02 0.35 -2.79 0.00 0.00 178.44 176.57 1g6n h PHE 14 N -0.18 -0.04 -0.14 2.65 3.04 -0.10 -2.70 116.94 119.46 1g6n h PHE 14 Ca 0.02 0.00 0.04 0.00 3.98 0.00 0.00 57.97 62.01 1g6n h PHE 14 Cb 0.54 0.03 -0.01 0.00 2.56 0.00 0.00 35.95 39.07 1g6n h PHE 14 CO 0.08 -0.03 0.11 -0.07 -2.02 0.00 0.00 178.31 176.38 1g6n h LEU 15 N -0.01 0.00 -0.83 0.59 3.38 -0.88 -1.31 115.31 116.25 1g6n h LEU 15 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1g6n h LEU 15 Cb 0.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.80 1g6n h LEU 15 CO -0.05 0.00 0.00 0.77 0.09 0.00 0.00 178.44 179.25 1g6n h SER 16 N 0.00 0.00 -0.25 -0.43 4.64 -1.08 -2.12 113.55 114.31 1g6n h SER 16 Ca 0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 1g6n h SER 16 Cb 0.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.38 1g6n h SER 16 CO -0.00 0.00 0.00 1.41 -0.87 0.00 0.00 176.83 177.37 1g6n n HIS 17 N -2.32 0.30 -4.01 4.77 8.25 -0.49 -4.97 115.22 116.75 1g6n n HIS 17 Ca 0.02 -0.15 -0.22 0.00 -0.26 0.00 0.00 57.72 57.10 1g6n n HIS 17 Cb 0.22 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.28 1g6n n HIS 17 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1g6n s HIS 19 N -2.34 3.34 -0.24 0.00 3.76 -0.76 -4.90 115.29 114.15 1g6n s HIS 19 Ca 0.38 0.24 -0.09 0.00 -0.15 0.00 0.00 55.06 55.44 1g6n s HIS 19 Cb -0.05 -1.98 -0.04 0.00 1.11 0.00 0.00 32.58 31.62 1g6n s HIS 19 CO 0.24 0.39 0.11 0.42 -0.85 0.00 0.00 174.74 175.05 1g6n s ILE 20 N -0.28 4.83 0.14 0.60 1.01 -1.26 -1.26 121.20 124.98 1g6n s ILE 20 Ca 0.09 -0.00 0.10 0.00 0.00 0.00 0.00 60.65 60.83 1g6n s ILE 20 Cb -0.12 -3.25 -0.04 0.00 0.01 0.00 0.00 42.46 39.06 1g6n s ILE 20 CO 0.01 0.35 -0.20 -1.00 0.00 0.00 0.00 174.94 174.11 1g6n s HIS 21 N 1.21 2.46 -0.11 3.97 3.76 -0.40 -4.96 115.29 121.23 1g6n s HIS 21 Ca 0.06 -0.30 -0.04 0.00 -0.15 0.00 0.00 55.06 54.63 1g6n s HIS 21 Cb -0.14 -1.29 -0.04 0.00 1.11 0.00 0.00 32.58 32.22 1g6n s HIS 21 CO 0.05 0.40 0.05 0.21 -0.85 0.00 0.00 174.74 174.60 1g6n s LYS 22 N -2.27 3.28 -0.04 1.40 2.47 -1.26 -0.79 119.74 122.54 1g6n s LYS 22 Ca 0.18 -0.32 0.02 0.00 -1.56 0.00 0.00 55.97 54.29 1g6n s LYS 22 Cb -0.10 -2.97 0.01 0.00 -1.46 0.00 0.00 37.83 33.31 1g6n s LYS 22 CO 0.10 0.65 -0.09 0.71 0.16 0.00 0.00 175.35 176.87 1g6n s TYR 23 N -0.70 1.05 0.71 4.03 2.02 -0.18 -5.01 117.35 119.27 1g6n s TYR 23 Ca 0.12 -0.31 -0.10 0.00 -0.37 0.00 0.00 57.07 56.41 1g6n s TYR 23 Cb -0.12 -0.78 0.03 0.00 -0.40 0.00 0.00 41.96 40.69 1g6n s TYR 23 CO 0.02 -0.16 1.07 -1.25 -1.57 0.00 0.00 175.55 173.66 1g6n s PRO 24 N 0.47 2.58 0.54 -1.71 0.04 -1.26 -0.61 135.00 135.05 1g6n s PRO 24 Ca -0.08 0.20 -0.21 0.00 0.04 0.00 0.00 61.00 60.95 1g6n s PRO 24 Cb -0.12 -2.07 -0.06 0.00 0.04 0.00 0.00 34.50 32.29 1g6n s PRO 24 CO 0.01 -1.12 1.12 0.43 0.04 0.00 0.00 177.00 177.48 1g6n n SER 25 N -2.99 1.60 0.00 6.66 7.64 -1.25 -2.43 113.62 122.85 1g6n n SER 25 Ca 0.07 0.92 0.00 0.00 1.01 0.00 0.00 58.87 60.87 1g6n n SER 25 Cb 0.59 -1.45 0.00 0.00 -1.01 0.00 0.00 64.21 62.33 1g6n n SER 25 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1g6n n LYS 26 N -0.73 0.00 -2.89 1.43 5.02 -0.04 -4.98 118.16 115.97 1g6n n LYS 26 Ca 0.11 0.00 -0.35 0.00 -2.02 0.00 0.00 58.31 56.05 1g6n n LYS 26 Cb 0.44 -3.40 -0.07 0.00 -0.02 0.00 0.00 35.03 31.99 1g6n n LYS 26 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1g6n s SER 27 N -2.57 7.10 -0.13 4.39 1.04 -1.02 -4.74 113.70 117.77 1g6n s SER 27 Ca 0.00 1.65 -0.22 0.00 0.48 0.00 0.00 55.95 57.87 1g6n s SER 27 Cb 0.00 -2.51 -0.03 0.00 0.10 0.00 0.00 66.02 63.57 1g6n s SER 27 CO 0.00 -0.16 0.65 -0.89 0.98 0.00 0.00 173.24 173.82 1g6n s THR 28 N -1.82 5.05 -0.14 2.02 2.01 -1.26 -1.16 115.64 120.33 1g6n s THR 28 Ca 0.53 1.29 -0.02 0.00 0.31 0.00 0.00 61.69 63.80 1g6n s THR 28 Cb -0.14 -3.98 -0.24 0.00 0.01 0.00 0.00 72.50 68.15 1g6n s THR 28 CO 0.19 0.19 0.28 0.18 -0.69 0.00 0.00 174.62 174.77 1g6n n LEU 29 N 4.35 2.40 -3.94 4.42 4.32 -0.15 -4.94 117.00 123.47 1g6n n LEU 29 Ca -0.02 0.16 -0.19 0.00 -0.02 0.00 0.00 56.01 55.94 1g6n n LEU 29 Cb 0.51 -0.87 -0.16 0.00 -1.62 0.00 0.00 43.42 41.28 1g6n n LEU 29 CO 0.45 0.80 -0.42 -0.63 -1.22 0.00 0.00 177.39 176.38 1g6n s ILE 30 N -2.55 0.61 -0.13 -0.08 1.01 -1.06 -4.98 121.20 114.01 1g6n s ILE 30 Ca -0.22 -0.22 -0.02 0.00 0.00 0.00 0.00 60.65 60.18 1g6n s ILE 30 Cb 0.07 -0.58 -0.03 0.00 0.01 0.00 0.00 42.46 41.93 1g6n s ILE 30 CO 0.75 0.22 -0.04 -1.00 0.00 0.00 0.00 174.94 174.86 1g6n s HIS 31 N 0.50 3.01 0.36 3.97 3.76 -1.26 -1.13 115.29 124.50 1g6n s HIS 31 Ca -0.07 -0.19 -0.28 0.00 -0.15 0.00 0.00 55.06 54.37 1g6n s HIS 31 Cb -0.11 -1.88 -0.12 0.00 1.11 0.00 0.00 32.58 31.59 1g6n s HIS 31 CO 0.00 0.09 1.43 0.94 -0.85 0.00 0.00 174.74 176.36 1g6n n GLN 32 N 3.10 2.49 0.00 1.40 7.27 -1.17 -2.30 117.38 128.17 1g6n n GLN 32 Ca -0.18 0.88 0.00 0.00 0.07 0.00 0.00 57.00 57.77 1g6n n GLN 32 Cb 0.53 -2.56 0.00 0.00 2.41 0.00 0.00 30.24 30.62 1g6n n GLN 32 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1g6n n GLY 33 N 0.72 3.32 3.71 1.69 0.00 -0.99 -4.93 105.19 108.72 1g6n n GLY 33 Ca 0.03 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.72 1g6n n GLY 33 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1g6n s GLU 34 N -0.68 1.77 -0.05 1.61 2.02 -0.97 -4.62 118.70 117.79 1g6n s GLU 34 Ca 0.00 1.60 -0.30 0.00 0.02 0.00 0.00 54.97 56.29 1g6n s GLU 34 Cb 0.00 -1.81 -0.03 0.00 0.10 0.00 0.00 34.13 32.39 1g6n s GLU 34 CO 0.00 -2.08 1.20 0.21 0.02 0.00 0.00 175.26 174.62 1g6n s LYS 35 N -4.31 4.35 -0.50 1.61 2.20 -1.26 -1.17 119.74 120.66 1g6n s LYS 35 Ca 0.70 1.68 -0.29 0.00 -0.36 0.00 0.00 55.97 57.70 1g6n s LYS 35 Cb -0.25 -3.56 0.03 0.00 -1.51 0.00 0.00 37.83 32.54 1g6n s LYS 35 CO 0.51 -0.45 1.18 0.00 -0.36 0.00 0.00 175.35 176.23 1g6n s ALA 36 N 2.22 3.10 0.00 3.13 0.00 0.24 -4.78 121.76 125.67 1g6n s ALA 36 Ca 0.56 -0.53 0.00 0.00 0.00 0.00 0.00 51.96 51.99 1g6n s ALA 36 Cb -0.25 -3.94 0.00 0.00 0.00 0.00 0.00 23.12 18.93 1g6n s ALA 36 CO 0.22 -2.38 0.03 0.39 0.00 0.00 0.00 175.76 174.02 1g6n n GLU 37 N 8.02 1.98 -4.42 0.00 1.02 -1.26 -4.71 120.64 121.26 1g6n n GLU 37 Ca 0.12 -0.03 -0.24 0.00 -0.02 0.00 0.00 57.16 56.98 1g6n n GLU 37 Cb 0.49 -0.27 -0.13 0.00 -0.02 0.00 0.00 31.44 31.51 1g6n n GLU 37 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1g6n s THR 38 N -0.29 1.64 0.02 2.62 2.01 -1.26 -1.08 115.64 119.29 1g6n s THR 38 Ca 0.00 -1.37 0.04 0.00 0.31 0.00 0.00 61.69 60.67 1g6n s THR 38 Cb 0.00 -1.47 -0.03 0.00 0.01 0.00 0.00 72.50 71.01 1g6n s THR 38 CO 0.00 0.04 -0.08 -0.22 -0.69 0.00 0.00 174.62 173.67 1g6n s LEU 39 N -1.57 3.10 0.20 4.42 2.96 0.32 -4.78 118.68 123.34 1g6n s LEU 39 Ca 0.06 -0.20 0.09 0.00 -0.22 0.00 0.00 54.13 53.86 1g6n s LEU 39 Cb -0.09 -1.80 -0.04 0.00 0.50 0.00 0.00 46.19 44.75 1g6n s LEU 39 CO 0.03 0.27 -0.18 -0.31 -1.32 0.00 0.00 176.35 174.84 1g6n s TYR 40 N -1.02 1.88 -0.05 5.38 2.02 0.02 -1.66 117.35 123.92 1g6n s TYR 40 Ca 0.18 -0.47 -0.02 0.00 -0.37 0.00 0.00 57.07 56.38 1g6n s TYR 40 Cb -0.11 -0.90 0.04 0.00 -0.40 0.00 0.00 41.96 40.59 1g6n s TYR 40 CO 0.08 0.41 0.09 -0.47 -1.57 0.00 0.00 175.55 174.09 1g6n s TYR 41 N -2.40 -0.04 -0.55 2.71 5.04 0.11 -0.62 117.35 121.60 1g6n s TYR 41 Ca 0.20 0.34 -0.28 0.00 -2.44 0.00 0.00 57.07 54.89 1g6n s TYR 41 Cb -0.04 -0.30 0.03 0.00 0.35 0.00 0.00 41.96 41.99 1g6n s TYR 41 CO 0.08 -0.18 1.25 0.42 -1.34 0.00 0.00 175.55 175.78 1g6n s ILE 42 N 1.75 3.98 0.06 3.14 1.01 -0.20 -0.73 121.20 130.21 1g6n s ILE 42 Ca -0.01 0.90 -0.11 0.00 0.00 0.00 0.00 60.65 61.42 1g6n s ILE 42 Cb -0.12 -4.62 -0.29 0.00 0.01 0.00 0.00 42.46 37.44 1g6n s ILE 42 CO -0.04 -1.23 1.12 0.58 0.00 0.00 0.00 174.94 175.37 1g6n h VAL 43 N 6.24 1.35 -2.23 2.92 2.07 -1.32 0.27 116.25 125.54 1g6n h VAL 43 Ca -0.25 -2.66 -0.07 0.00 0.82 0.00 0.00 66.70 64.54 1g6n h VAL 43 Cb 1.07 2.80 -0.22 0.00 -1.52 0.00 0.00 31.29 33.42 1g6n h VAL 43 CO 1.17 0.80 0.02 -0.75 0.02 0.00 0.00 177.57 178.83 1g6n s LYS 44 N -2.85 0.74 0.00 1.57 2.20 -0.90 -4.68 119.74 115.81 1g6n s LYS 44 Ca -0.07 0.82 0.00 0.00 -0.36 0.00 0.00 55.97 56.36 1g6n s LYS 44 Cb 0.06 0.36 0.00 0.00 -1.51 0.00 0.00 37.83 36.74 1g6n s LYS 44 CO 0.92 -0.10 0.00 0.41 -0.36 0.00 0.00 175.35 176.22 1g6n n GLY 45 N 2.64 -1.23 3.04 5.54 0.00 -1.26 -0.72 105.19 113.20 1g6n n GLY 45 Ca -0.14 -2.17 -0.10 0.00 0.00 0.00 0.00 46.02 43.61 1g6n n GLY 45 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1g6n s SER 46 N -3.10 0.18 0.18 1.61 0.15 -1.26 -2.37 113.70 109.09 1g6n s SER 46 Ca 0.00 -0.44 0.01 0.00 0.70 0.00 0.00 55.95 56.21 1g6n s SER 46 Cb 0.00 0.15 -0.04 0.00 -1.71 0.00 0.00 66.02 64.42 1g6n s SER 46 CO 0.00 -0.37 0.05 0.68 1.20 0.00 0.00 173.24 174.80 1g6n s VAL 47 N -1.73 0.43 0.01 4.45 -7.23 -0.01 -0.34 120.40 115.98 1g6n s VAL 47 Ca -0.13 -1.97 0.07 0.00 -1.81 0.00 0.00 61.98 58.15 1g6n s VAL 47 Cb -0.07 -2.24 -0.02 0.00 0.56 0.00 0.00 36.38 34.60 1g6n s VAL 47 CO -0.01 -0.33 -0.23 0.00 -0.31 0.00 0.00 175.10 174.22 1g6n s ALA 48 N -3.83 1.89 -0.25 1.32 0.00 0.35 -0.93 121.76 120.31 1g6n s ALA 48 Ca 0.28 -1.05 -0.08 0.00 0.00 0.00 0.00 51.96 51.12 1g6n s ALA 48 Cb 0.07 -0.43 -0.03 0.00 0.00 0.00 0.00 23.12 22.73 1g6n s ALA 48 CO 0.06 0.45 0.08 0.08 0.00 0.00 0.00 175.76 176.43 1g6n s VAL 49 N -0.66 4.44 0.13 0.00 1.01 0.14 -1.28 120.40 124.17 1g6n s VAL 49 Ca 0.09 -0.13 0.10 0.00 0.00 0.00 0.00 61.98 62.04 1g6n s VAL 49 Cb -0.09 -3.07 -0.04 0.00 0.00 0.00 0.00 36.38 33.18 1g6n s VAL 49 CO 0.00 0.34 -0.24 -0.76 0.00 0.00 0.00 175.10 174.45 1g6n s LEU 50 N 1.54 2.34 0.20 3.92 2.01 0.54 0.32 118.68 129.55 1g6n s LEU 50 Ca 0.06 -0.75 0.00 0.00 0.01 0.00 0.00 54.13 53.45 1g6n s LEU 50 Cb -0.15 -1.06 -0.04 0.00 0.01 0.00 0.00 46.19 44.94 1g6n s LEU 50 CO 0.04 0.11 0.09 0.27 1.01 0.00 0.00 176.35 177.87 1g6n s ILE 51 N -1.25 0.27 0.18 -0.59 -4.36 -0.81 -0.99 121.20 113.65 1g6n s ILE 51 Ca 0.12 -1.98 -0.14 0.00 -0.26 0.00 0.00 60.65 58.39 1g6n s ILE 51 Cb -0.09 -2.39 0.02 0.00 1.25 0.00 0.00 42.46 41.24 1g6n s ILE 51 CO 0.06 -0.16 0.43 -1.59 0.24 0.00 0.00 174.94 173.91 1g6n s LYS 52 N -4.07 1.27 0.33 0.37 -2.85 -1.26 -0.69 119.74 112.84 1g6n s LYS 52 Ca 0.33 -0.96 0.06 0.00 -1.00 0.00 0.00 55.97 54.40 1g6n s LYS 52 Cb 0.07 0.47 -0.01 0.00 -2.06 0.00 0.00 37.83 36.30 1g6n s LYS 52 CO 0.09 -0.51 0.47 0.16 0.10 0.00 0.00 175.35 175.66 1g6n s ASP 53 N -2.90 6.02 -1.06 0.03 -4.77 -1.08 -4.96 116.67 107.95 1g6n s ASP 53 Ca 0.11 -0.11 -0.26 0.00 -3.30 0.00 0.00 52.55 49.00 1g6n s ASP 53 Cb 0.01 -1.35 -0.18 0.00 -1.09 0.00 0.00 42.92 40.31 1g6n s ASP 53 CO -0.03 -0.40 2.10 -1.83 0.70 0.00 0.00 175.17 175.72 1g6n s GLU 54 N -4.17 1.56 0.00 2.11 1.03 -1.26 -0.64 118.70 117.33 1g6n s GLU 54 Ca 0.44 -0.48 0.00 0.00 0.03 0.00 0.00 54.97 54.96 1g6n s GLU 54 Cb -0.09 -5.02 0.00 0.00 -0.80 0.00 0.00 34.13 28.22 1g6n s GLU 54 CO 0.31 -4.97 0.00 -1.91 -1.33 0.00 0.00 175.26 167.36 1g6n n GLU 55 N 8.30 0.00 0.00 -4.83 2.13 -1.26 -4.98 120.64 120.00 1g6n n GLU 55 Ca 0.43 0.00 0.00 0.00 0.66 0.00 0.00 57.16 58.25 1g6n n GLU 55 Cb 0.46 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.17 1g6n n GLU 55 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1g6n n GLY 56 N 0.00 1.25 3.67 8.31 0.00 0.19 -5.08 105.19 113.52 1g6n n GLY 56 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1g6n n GLY 56 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1g6n s LYS 57 N -0.50 4.27 0.26 1.61 1.02 -1.25 -4.89 119.74 120.26 1g6n s LYS 57 Ca 0.00 1.54 -0.24 0.00 0.02 0.00 0.00 55.97 57.29 1g6n s LYS 57 Cb 0.00 -3.68 -0.09 0.00 -0.52 0.00 0.00 37.83 33.54 1g6n s LYS 57 CO 0.00 -0.62 0.84 -1.21 -0.92 0.00 0.00 175.35 173.43 1g6n s GLU 58 N 3.13 4.46 -0.07 1.68 2.02 -1.26 -2.64 118.70 126.02 1g6n s GLU 58 Ca 0.51 1.13 -0.00 0.00 0.02 0.00 0.00 54.97 56.63 1g6n s GLU 58 Cb -0.19 -2.91 0.02 0.00 0.10 0.00 0.00 34.13 31.15 1g6n s GLU 58 CO 0.13 0.37 -0.04 1.41 0.02 0.00 0.00 175.26 177.15 1g6n s MET 59 N -1.87 0.98 -0.47 1.61 -2.45 0.13 -4.72 119.30 112.51 1g6n s MET 59 Ca 0.45 -0.09 -0.29 0.00 -1.25 0.00 0.00 55.69 54.51 1g6n s MET 59 Cb -0.19 -1.10 0.02 0.00 1.25 0.00 0.00 34.83 34.81 1g6n s MET 59 CO 0.23 -0.19 1.22 0.42 1.05 0.00 0.00 175.02 177.75 1g6n s ILE 60 N 1.46 4.10 0.08 10.11 1.01 -0.69 -1.93 121.20 135.34 1g6n s ILE 60 Ca -0.02 1.11 -0.13 0.00 0.00 0.00 0.00 60.65 61.61 1g6n s ILE 60 Cb -0.13 -4.51 -0.24 0.00 0.01 0.00 0.00 42.46 37.59 1g6n s ILE 60 CO -0.03 -0.97 1.19 0.25 0.00 0.00 0.00 174.94 175.37 1g6n h LEU 61 N 11.57 0.87 -7.11 2.97 6.46 -0.46 -3.41 115.31 126.19 1g6n h LEU 61 Ca -0.24 -0.71 0.20 0.00 -0.12 0.00 0.00 57.88 57.01 1g6n h LEU 61 Cb 1.07 -0.27 -0.15 0.00 -0.73 0.00 0.00 40.66 40.58 1g6n h LEU 61 CO 1.12 1.51 0.66 -0.55 -0.62 0.00 0.00 178.44 180.56 1g6n s SER 62 N -7.29 -0.21 -0.06 1.25 0.15 -1.13 -4.99 113.70 101.41 1g6n s SER 62 Ca -0.09 -0.07 0.03 0.00 0.70 0.00 0.00 55.95 56.52 1g6n s SER 62 Cb 0.07 0.28 -0.02 0.00 -1.71 0.00 0.00 66.02 64.63 1g6n s SER 62 CO 0.92 -0.47 -0.16 -0.31 1.20 0.00 0.00 173.24 174.42 1g6n s TYR 63 N -2.78 2.67 0.09 3.44 2.02 -1.26 0.24 117.35 121.77 1g6n s TYR 63 Ca 0.09 -0.33 0.08 0.00 -0.37 0.00 0.00 57.07 56.54 1g6n s TYR 63 Cb -0.00 -1.66 -0.03 0.00 -0.40 0.00 0.00 41.96 39.86 1g6n s TYR 63 CO -0.05 0.05 -0.21 -0.51 -1.57 0.00 0.00 175.55 173.26 1g6n s LEU 64 N -0.45 2.26 0.00 -1.29 1.43 -0.11 -4.97 118.68 115.54 1g6n s LEU 64 Ca 0.05 -0.64 0.01 0.00 -1.03 0.00 0.00 54.13 52.52 1g6n s LEU 64 Cb -0.12 -0.95 -0.00 0.00 0.03 0.00 0.00 46.19 45.15 1g6n s LEU 64 CO 0.02 0.10 0.04 0.59 0.23 0.00 0.00 176.35 177.33 1g6n n ASN 65 N 1.31 1.42 -4.62 2.29 3.02 -1.26 -0.83 115.26 116.59 1g6n n ASN 65 Ca -0.19 -1.72 -0.48 0.00 -0.03 0.00 0.00 54.58 52.16 1g6n n ASN 65 Cb 0.53 0.28 -0.04 0.00 -0.61 0.00 0.00 39.78 39.95 1g6n n ASN 65 CO 0.00 0.00 0.00 1.67 -2.62 0.00 0.00 177.26 176.31 1g6n n GLN 66 N -0.34 1.58 0.00 3.52 7.27 -1.00 -1.54 117.38 126.87 1g6n n GLN 66 Ca -0.03 0.56 0.00 0.00 0.07 0.00 0.00 57.00 57.60 1g6n n GLN 66 Cb 0.21 -2.17 0.00 0.00 2.41 0.00 0.00 30.24 30.69 1g6n n GLN 66 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1g6n n GLY 67 N 2.30 1.30 3.84 1.69 0.00 0.94 -5.01 105.19 110.25 1g6n n GLY 67 Ca 0.15 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.81 1g6n n GLY 67 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1g6n s ASP 68 N -2.14 6.86 0.40 1.61 1.01 -0.59 -4.84 116.67 118.97 1g6n s ASP 68 Ca 0.00 1.11 -0.09 0.00 0.71 0.00 0.00 52.55 54.28 1g6n s ASP 68 Cb 0.00 -2.30 -0.06 0.00 1.01 0.00 0.00 42.92 41.57 1g6n s ASP 68 CO 0.00 0.13 0.73 -0.36 0.21 0.00 0.00 175.17 175.88 1g6n s PHE 69 N -1.41 3.49 0.03 4.23 0.08 -1.26 -1.03 117.98 122.10 1g6n s PHE 69 Ca 0.36 0.94 -0.02 0.00 0.12 0.00 0.00 56.93 58.33 1g6n s PHE 69 Cb -0.16 -2.36 -0.02 0.00 -0.57 0.00 0.00 43.02 39.91 1g6n s PHE 69 CO 0.19 -0.08 0.02 0.42 -0.10 0.00 0.00 175.22 175.67 1g6n s ILE 70 N -2.38 0.15 -0.74 0.64 1.01 0.21 -4.86 121.20 115.22 1g6n s ILE 70 Ca 0.49 -1.20 0.00 0.00 0.00 0.00 0.00 60.65 59.94 1g6n s ILE 70 Cb -0.10 -0.81 0.00 0.00 0.01 0.00 0.00 42.46 41.56 1g6n s ILE 70 CO 0.33 -0.66 0.00 0.61 0.00 0.00 0.00 174.94 175.22 1g6n n GLY 71 N 0.93 0.30 0.13 6.18 0.00 -1.26 -0.80 105.19 110.66 1g6n n GLY 71 Ca -0.20 -0.58 0.04 0.00 0.00 0.00 0.00 46.02 45.28 1g6n n GLY 71 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1g6n h GLU 72 N 0.00 0.00 -0.26 1.61 9.09 -1.89 -3.39 114.58 119.75 1g6n h GLU 72 Ca -0.19 0.00 0.02 0.00 0.05 0.00 0.00 59.36 59.25 1g6n h GLU 72 Cb 0.97 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.06 1g6n h GLU 72 CO 0.23 0.29 0.17 -0.07 0.05 0.00 0.00 179.01 179.68 1g6n h LEU 73 N 0.00 0.21 -0.72 3.06 3.38 -1.97 -2.31 115.31 116.97 1g6n h LEU 73 Ca -0.06 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1g6n h LEU 73 Cb 1.36 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 42.06 1g6n h LEU 73 CO 0.04 0.15 0.00 0.61 0.09 0.00 0.00 178.44 179.33 1g6n n GLY 74 N -1.52 -0.22 0.22 0.83 0.00 -1.26 -4.28 105.19 98.96 1g6n n GLY 74 Ca 0.02 -0.36 -0.04 0.00 0.00 0.00 0.00 46.02 45.65 1g6n n GLY 74 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1g6n h LEU 75 N 1.61 0.41 -0.55 0.99 5.85 -1.67 -3.30 115.31 118.66 1g6n h LEU 75 Ca 0.00 -0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.56 1g6n h LEU 75 Cb 0.35 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.26 1g6n h LEU 75 CO 0.00 0.73 -0.00 0.49 -0.34 0.00 0.00 178.44 179.32 1g6n n PHE 76 N -4.07 0.00 -3.65 1.25 3.72 -1.26 -4.79 117.46 108.67 1g6n n PHE 76 Ca -0.01 0.00 -0.06 0.00 -0.05 0.00 0.00 57.45 57.33 1g6n n PHE 76 Cb 0.45 -0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 38.92 1g6n n PHE 76 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 176.76 174.71 1g6n s GLU 77 N -2.01 0.65 0.63 -1.08 2.12 -1.24 -5.16 118.70 112.60 1g6n s GLU 77 Ca 0.42 1.23 -0.16 0.00 0.36 0.00 0.00 54.97 56.82 1g6n s GLU 77 Cb 0.21 0.27 -0.01 0.00 0.26 0.00 0.00 34.13 34.86 1g6n s GLU 77 CO 0.35 -0.16 1.11 -1.21 -0.54 0.00 0.00 175.26 174.81 1g6n s GLU 78 N 1.88 2.94 -0.45 4.30 2.02 -1.26 -4.14 118.70 123.99 1g6n s GLU 78 Ca -0.09 1.43 -0.02 0.00 0.02 0.00 0.00 54.97 56.30 1g6n s GLU 78 Cb -0.07 -1.97 0.00 0.00 0.10 0.00 0.00 34.13 32.20 1g6n s GLU 78 CO -0.19 -1.14 0.39 0.41 0.02 0.00 0.00 175.26 174.74 1g6n n GLY 79 N -0.41 0.39 3.51 -1.39 0.00 -1.26 -5.05 105.19 100.98 1g6n n GLY 79 Ca 0.11 -0.35 -0.30 0.00 0.00 0.00 0.00 46.02 45.48 1g6n n GLY 79 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1g6n s GLN 80 N -5.25 1.89 0.13 1.61 -0.21 -1.26 -5.03 119.66 111.54 1g6n s GLN 80 Ca 0.16 -1.13 -0.02 0.00 0.02 0.00 0.00 55.36 54.39 1g6n s GLN 80 Cb -0.07 -2.17 -0.05 0.00 1.00 0.00 0.00 33.01 31.73 1g6n s GLN 80 CO 0.25 0.49 0.32 -1.21 -2.12 0.00 0.00 175.29 173.02 1g6n s GLU 81 N -2.12 3.53 0.28 2.91 2.02 -1.26 -0.59 118.70 123.46 1g6n s GLU 81 Ca 0.19 -0.30 -0.30 0.00 0.02 0.00 0.00 54.97 54.58 1g6n s GLU 81 Cb -0.11 -2.91 -0.12 0.00 0.10 0.00 0.00 34.13 31.09 1g6n s GLU 81 CO 0.11 0.50 1.56 0.54 0.02 0.00 0.00 175.26 177.99 1g6n n ARG 82 N -0.08 2.56 0.00 1.61 5.12 -0.32 -4.80 116.66 120.76 1g6n n ARG 82 Ca -0.04 0.91 0.14 0.00 -1.93 0.00 0.00 57.85 56.93 1g6n n ARG 82 Cb 0.52 -2.67 0.66 0.00 -1.16 0.00 0.00 32.46 29.81 1g6n n ARG 82 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 1g6n n SER 83 N 2.18 0.00 -3.33 0.55 3.41 -1.26 -2.34 113.62 112.84 1g6n n SER 83 Ca 0.09 0.28 -0.05 0.00 -0.26 0.00 0.00 58.87 58.93 1g6n n SER 83 Cb 0.36 -0.43 0.01 0.00 -0.26 0.00 0.00 64.21 63.89 1g6n n SER 83 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1g6n s ALA 84 N -2.85 -1.32 -0.02 7.33 0.00 -1.26 -4.97 121.76 118.67 1g6n s ALA 84 Ca 0.19 -0.38 -0.14 0.00 0.00 0.00 0.00 51.96 51.63 1g6n s ALA 84 Cb 0.19 0.72 -0.05 0.00 0.00 0.00 0.00 23.12 23.98 1g6n s ALA 84 CO 0.50 -1.04 0.37 -1.58 0.00 0.00 0.00 175.76 174.01 1g6n s TRP 85 N -2.52 3.70 -0.14 0.00 0.51 -0.16 -3.04 118.94 117.29 1g6n s TRP 85 Ca 0.17 0.92 0.00 0.00 -2.12 0.00 0.00 56.10 55.07 1g6n s TRP 85 Cb -0.03 -2.24 0.02 0.00 -0.81 0.00 0.00 33.47 30.41 1g6n s TRP 85 CO 0.07 0.65 -0.13 0.08 -0.51 0.00 0.00 176.95 177.10 1g6n s VAL 86 N -1.02 1.49 -0.01 4.03 1.01 -0.28 -0.34 120.40 125.28 1g6n s VAL 86 Ca 0.22 -0.59 0.06 0.00 0.00 0.00 0.00 61.98 61.68 1g6n s VAL 86 Cb -0.16 -1.40 -0.02 0.00 0.00 0.00 0.00 36.38 34.80 1g6n s VAL 86 CO 0.12 0.44 -0.20 -0.60 0.00 0.00 0.00 175.10 174.86 1g6n s ARG 87 N 1.44 1.64 0.05 2.72 3.52 -0.41 -0.97 118.95 126.94 1g6n s ARG 87 Ca 0.03 -0.74 -0.31 0.00 -0.13 0.00 0.00 55.73 54.59 1g6n s ARG 87 Cb -0.13 -1.59 -0.07 0.00 -1.56 0.00 0.00 34.95 31.60 1g6n s ARG 87 CO -0.09 0.44 1.47 0.00 -0.81 0.00 0.00 175.30 176.31 1g6n s ALA 88 N -0.49 3.62 -0.05 6.12 0.00 -0.31 -0.49 121.76 130.16 1g6n s ALA 88 Ca 0.08 1.04 -0.21 0.00 0.00 0.00 0.00 51.96 52.87 1g6n s ALA 88 Cb -0.08 -3.61 -0.31 0.00 0.00 0.00 0.00 23.12 19.12 1g6n s ALA 88 CO -0.01 -0.89 0.87 0.87 0.00 0.00 0.00 175.76 176.61 1g6n h LYS 89 N 7.68 0.32 0.00 0.00 1.57 -0.98 -0.07 116.57 125.08 1g6n h LYS 89 Ca -0.40 -0.55 -0.17 0.00 -1.87 0.00 0.00 60.65 57.66 1g6n h LYS 89 Cb 1.19 0.20 -0.03 0.00 0.08 0.00 0.00 32.23 33.67 1g6n h LYS 89 CO 0.90 1.26 -0.13 0.25 -0.57 0.00 0.00 179.45 181.17 1g6n n THR 90 N -4.06 0.00 -2.22 -0.16 -2.24 -1.11 -4.49 114.28 100.00 1g6n n THR 90 Ca -0.15 -0.64 -0.41 0.00 -2.27 0.00 0.00 64.05 60.57 1g6n n THR 90 Cb 0.86 0.16 -0.03 0.00 -2.10 0.00 0.00 70.33 69.22 1g6n n THR 90 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1g6n s ALA 91 N -2.25 3.52 0.19 6.98 0.00 -1.26 -3.89 121.76 125.05 1g6n s ALA 91 Ca 0.02 1.11 0.10 0.00 0.00 0.00 0.00 51.96 53.19 1g6n s ALA 91 Cb 0.00 -3.48 -0.04 0.00 0.00 0.00 0.00 23.12 19.60 1g6n s ALA 91 CO 0.01 -0.54 -0.20 0.00 0.00 0.00 0.00 175.76 175.03 1g6n s GLU 93 N -2.84 1.22 -0.12 0.00 2.12 0.10 -1.01 118.70 118.17 1g6n s GLU 93 Ca 0.19 -1.19 0.03 0.00 0.36 0.00 0.00 54.97 54.36 1g6n s GLU 93 Cb -0.06 -2.50 0.00 0.00 0.26 0.00 0.00 34.13 31.83 1g6n s GLU 93 CO 0.09 -0.81 -0.21 0.08 -0.54 0.00 0.00 175.26 173.86 1g6n s VAL 94 N 1.38 2.25 0.17 3.70 1.01 0.03 -0.83 120.40 128.13 1g6n s VAL 94 Ca 0.04 -0.93 -0.17 0.00 0.00 0.00 0.00 61.98 60.91 1g6n s VAL 94 Cb -0.18 -1.90 -0.07 0.00 0.00 0.00 0.00 36.38 34.23 1g6n s VAL 94 CO -0.13 0.55 0.63 0.00 0.00 0.00 0.00 175.10 176.14 1g6n s ALA 95 N 0.55 3.51 0.03 5.51 0.00 0.09 -1.27 121.76 130.18 1g6n s ALA 95 Ca -0.13 0.02 0.01 0.00 0.00 0.00 0.00 51.96 51.86 1g6n s ALA 95 Cb -0.17 -2.67 -0.02 0.00 0.00 0.00 0.00 23.12 20.27 1g6n s ALA 95 CO 0.04 0.39 -0.05 -1.83 0.00 0.00 0.00 175.76 174.31 1g6n s GLU 96 N -1.89 0.43 -0.08 0.00 -1.05 -0.39 -0.71 118.70 115.00 1g6n s GLU 96 Ca 0.39 -0.72 -0.19 0.00 -0.15 0.00 0.00 54.97 54.31 1g6n s GLU 96 Cb -0.16 -0.07 0.04 0.00 -0.44 0.00 0.00 34.13 33.50 1g6n s GLU 96 CO 0.20 -0.01 0.45 -1.50 0.95 0.00 0.00 175.26 175.35 1g6n s ILE 97 N -1.57 0.02 0.55 1.83 2.07 -0.66 -1.83 121.20 121.61 1g6n s ILE 97 Ca -0.12 -0.19 -0.19 0.00 -1.41 0.00 0.00 60.65 58.73 1g6n s ILE 97 Cb -0.09 -0.71 -0.06 0.00 0.13 0.00 0.00 42.46 41.73 1g6n s ILE 97 CO -0.01 -0.11 1.13 -0.94 -1.91 0.00 0.00 174.94 173.10 1g6n s SER 98 N -0.69 5.72 0.22 4.50 1.04 -1.26 -0.52 113.70 122.71 1g6n s SER 98 Ca -0.08 2.17 -0.08 0.00 0.48 0.00 0.00 55.95 58.44 1g6n s SER 98 Cb -0.03 -2.58 0.26 0.00 0.10 0.00 0.00 66.02 63.77 1g6n s SER 98 CO 0.04 -1.22 1.84 1.88 0.98 0.00 0.00 173.24 176.76 1g6n h TYR 99 N 1.17 0.86 -0.29 5.02 0.99 -1.44 -0.11 116.97 123.19 1g6n h TYR 99 Ca -0.50 0.03 0.06 0.00 2.00 0.00 0.00 58.73 60.32 1g6n h TYR 99 Cb 1.26 -0.28 -0.06 0.00 1.00 0.00 0.00 36.73 38.65 1g6n h TYR 99 CO 0.51 0.46 -0.10 -0.22 -0.00 0.00 0.00 178.16 178.81 1g6n h LYS 100 N 0.87 -0.05 -0.28 4.88 3.64 -1.92 0.12 116.57 123.84 1g6n h LYS 100 Ca 0.32 0.00 -0.14 0.00 -1.27 0.00 0.00 60.65 59.57 1g6n h LYS 100 Cb 0.12 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 1g6n h LYS 100 CO -0.15 -0.03 -0.39 -0.22 -2.27 0.00 0.00 179.45 176.38 1g6n h LYS 101 N -0.05 0.66 -0.65 1.90 3.64 -1.86 -3.04 116.57 117.18 1g6n h LYS 101 Ca 0.14 -0.34 -0.02 0.00 -1.27 0.00 0.00 60.65 59.17 1g6n h LYS 101 Cb 0.27 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.06 1g6n h LYS 101 CO -0.32 0.94 0.33 0.35 -2.27 0.00 0.00 179.45 178.48 1g6n h PHE 102 N 0.54 0.91 0.00 1.91 3.57 -0.26 -1.66 116.94 121.96 1g6n h PHE 102 Ca 0.05 -0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.49 1g6n h PHE 102 Cb 0.92 -0.29 -0.00 0.00 2.79 0.00 0.00 35.95 39.37 1g6n h PHE 102 CO 0.04 0.67 -0.11 0.00 -2.23 0.00 0.00 178.31 176.69 1g6n h ARG 103 N 0.89 0.00 -0.23 1.11 3.08 -0.75 -1.79 114.38 116.68 1g6n h ARG 103 Ca 0.23 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 60.18 1g6n h ARG 103 Cb 0.08 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.13 1g6n h ARG 103 CO -0.03 0.11 -0.24 1.96 -1.07 0.00 0.00 179.97 180.70 1g6n h GLN 104 N 0.00 0.57 -0.35 0.04 4.20 -1.22 -2.98 115.11 115.37 1g6n h GLN 104 Ca -0.00 -0.30 -0.02 0.00 0.06 0.00 0.00 58.65 58.39 1g6n h GLN 104 Cb 0.20 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.97 1g6n h GLN 104 CO 0.01 0.89 0.14 -0.07 -0.67 0.00 0.00 178.83 179.14 1g6n h LEU 105 N 0.26 0.44 -0.89 1.46 3.38 -0.61 -1.22 115.31 118.12 1g6n h LEU 105 Ca 0.03 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1g6n h LEU 105 Cb 0.80 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 41.39 1g6n h LEU 105 CO 0.06 0.40 0.58 0.40 0.09 0.00 0.00 178.44 179.96 1g6n h ILE 106 N 0.49 1.24 -0.43 1.22 2.04 -1.22 -0.07 117.51 120.79 1g6n h ILE 106 Ca 0.12 -0.46 -0.03 0.00 1.00 0.00 0.00 64.86 65.50 1g6n h ILE 106 Cb 0.10 -0.06 -0.02 0.00 -0.74 0.00 0.00 36.82 36.10 1g6n h ILE 106 CO -0.01 0.23 0.14 1.56 0.00 0.00 0.00 178.15 180.07 1g6n h GLN 107 N 1.22 0.61 0.01 2.37 1.08 -1.08 -2.18 115.11 117.14 1g6n h GLN 107 Ca 0.32 -0.09 -0.00 0.00 -1.45 0.00 0.00 58.65 57.43 1g6n h GLN 107 Cb -0.11 -0.11 0.00 0.00 -0.05 0.00 0.00 27.48 27.21 1g6n h GLN 107 CO -0.07 0.53 -0.01 0.28 -0.95 0.00 0.00 178.83 178.62 1g6n h VAL 108 N 0.61 1.52 -2.56 -0.54 2.07 -1.16 -3.43 116.25 112.75 1g6n h VAL 108 Ca 0.15 -1.67 -0.50 0.00 0.82 0.00 0.00 66.70 65.50 1g6n h VAL 108 Cb 0.17 2.63 -0.38 0.00 -1.52 0.00 0.00 31.29 32.19 1g6n h VAL 108 CO -0.01 0.43 -0.77 0.21 0.02 0.00 0.00 177.57 177.45 1g6n s ASN 109 N -5.91 2.89 0.62 0.57 3.84 -0.11 -5.00 114.94 111.84 1g6n s ASN 109 Ca -0.17 -1.44 0.35 0.00 0.21 0.00 0.00 52.86 51.81 1g6n s ASN 109 Cb -0.01 -0.14 1.91 0.00 -0.55 0.00 0.00 41.25 42.46 1g6n s ASN 109 CO 0.66 -0.38 2.07 -0.65 -2.79 0.00 0.00 177.10 176.00 1g6n h PRO 110 N 7.93 0.00 -0.54 0.43 0.11 -1.63 -2.42 132.00 135.88 1g6n h PRO 110 Ca -0.10 0.00 0.14 0.00 0.11 0.00 0.00 66.00 66.14 1g6n h PRO 110 Cb 1.01 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.10 1g6n h PRO 110 CO 0.36 0.00 0.38 0.22 -0.21 0.00 0.00 178.00 178.75 1g6n h ASP 111 N 0.00 0.10 -0.27 -2.05 3.58 -1.94 0.93 116.42 116.77 1g6n h ASP 111 Ca 0.00 0.00 -0.04 0.00 0.42 0.00 0.00 57.03 57.41 1g6n h ASP 111 Cb 0.31 -0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.32 1g6n h ASP 111 CO 0.00 0.06 0.04 -0.29 -2.88 0.00 0.00 179.24 176.17 1g6n h ILE 112 N 0.11 1.19 -0.06 2.25 6.09 -1.80 -1.69 117.51 123.60 1g6n h ILE 112 Ca 0.26 -0.72 -0.18 0.00 -1.37 0.00 0.00 64.86 62.85 1g6n h ILE 112 Cb 0.88 0.87 -0.01 0.00 0.47 0.00 0.00 36.82 39.03 1g6n h ILE 112 CO -0.03 0.25 -0.73 0.25 -3.07 0.00 0.00 178.15 174.82 1g6n h LEU 113 N 0.54 0.39 -0.45 2.19 5.85 -1.05 -2.87 115.31 119.91 1g6n h LEU 113 Ca 0.12 -0.26 -0.01 0.00 0.84 0.00 0.00 57.88 58.57 1g6n h LEU 113 Cb 0.28 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.18 1g6n h LEU 113 CO 0.00 0.99 0.25 0.24 -0.34 0.00 0.00 178.44 179.59 1g6n h MET 114 N 0.22 0.64 -0.55 1.25 2.86 -0.77 0.70 114.93 119.27 1g6n h MET 114 Ca -0.03 -0.08 0.02 0.00 -2.06 0.00 0.00 59.70 57.55 1g6n h MET 114 Cb 1.30 -0.12 -0.03 0.00 0.06 0.00 0.00 31.60 32.81 1g6n h MET 114 CO 0.12 0.51 0.35 0.00 1.06 0.00 0.00 176.91 178.95 1g6n h ARG 115 N 0.60 0.69 -0.26 1.72 2.47 -1.32 -0.89 114.38 117.39 1g6n h ARG 115 Ca 0.16 -0.04 -0.01 0.00 -1.26 0.00 0.00 59.98 58.83 1g6n h ARG 115 Cb 0.06 -0.15 -0.01 0.00 -1.65 0.00 0.00 29.97 28.21 1g6n h ARG 115 CO -0.03 0.45 0.12 1.25 0.56 0.00 0.00 179.97 182.33 1g6n h LEU 116 N 0.71 0.34 -1.25 3.04 5.85 -1.25 -2.86 115.31 119.89 1g6n h LEU 116 Ca 0.21 -0.13 -0.04 0.00 0.84 0.00 0.00 57.88 58.76 1g6n h LEU 116 Cb -0.03 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 40.89 1g6n h LEU 116 CO -0.07 0.37 0.04 0.28 -0.34 0.00 0.00 178.44 178.72 1g6n h SER 117 N 0.28 0.51 -0.90 1.25 0.02 -0.53 -2.00 113.55 112.17 1g6n h SER 117 Ca 0.09 -0.09 -0.02 0.00 -0.84 0.00 0.00 61.79 60.93 1g6n h SER 117 Cb 0.13 -0.13 -0.04 0.00 0.14 0.00 0.00 62.40 62.49 1g6n h SER 117 CO -0.01 0.55 0.50 0.00 -1.14 0.00 0.00 176.83 176.73 1g6n h ALA 118 N 1.52 1.17 -0.39 3.77 0.00 -0.99 -0.50 119.26 123.83 1g6n h ALA 118 Ca 0.12 -0.13 -0.16 0.00 0.00 0.00 0.00 54.91 54.74 1g6n h ALA 118 Cb 0.28 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1g6n h ALA 118 CO 0.00 0.67 -0.38 1.96 0.00 0.00 0.00 179.25 181.50 1g6n h GLN 119 N 1.27 0.94 -0.81 0.00 4.20 -1.19 -2.11 115.11 117.41 1g6n h GLN 119 Ca 0.32 -0.49 -0.04 0.00 0.06 0.00 0.00 58.65 58.49 1g6n h GLN 119 Cb 0.02 0.01 -0.04 0.00 0.30 0.00 0.00 27.48 27.78 1g6n h GLN 119 CO -0.05 1.15 0.34 0.52 -0.67 0.00 0.00 178.83 180.12 1g6n h MET 120 N 0.77 1.19 -0.45 1.46 2.86 -0.94 -0.63 114.93 119.19 1g6n h MET 120 Ca 0.06 -0.21 -0.02 0.00 -2.06 0.00 0.00 59.70 57.48 1g6n h MET 120 Cb 0.97 -0.20 -0.02 0.00 0.06 0.00 0.00 31.60 32.41 1g6n h MET 120 CO 0.09 0.95 0.19 0.00 1.06 0.00 0.00 176.91 179.21 1g6n h ALA 121 N 1.20 0.58 -0.46 6.32 0.00 -0.96 -1.15 119.26 124.79 1g6n h ALA 121 Ca 0.27 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 55.05 1g6n h ALA 121 Cb 0.19 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1g6n h ALA 121 CO -0.03 0.17 0.30 -0.09 0.00 0.00 0.00 179.25 179.61 1g6n h ARG 122 N 0.58 0.60 -0.69 0.00 9.65 -1.08 -2.01 114.38 121.43 1g6n h ARG 122 Ca 0.15 -0.04 -0.00 0.00 -1.10 0.00 0.00 59.98 58.99 1g6n h ARG 122 Cb 0.17 -0.13 -0.03 0.00 -1.39 0.00 0.00 29.97 28.58 1g6n h ARG 122 CO -0.01 0.39 0.42 0.00 2.80 0.00 0.00 179.97 183.56 1g6n h ARG 123 N 0.61 0.93 -0.45 0.20 3.08 -0.78 -1.01 114.38 116.97 1g6n h ARG 123 Ca 0.17 -0.08 -0.06 0.00 0.07 0.00 0.00 59.98 60.08 1g6n h ARG 123 Cb -0.06 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 29.77 1g6n h ARG 123 CO -0.04 0.65 0.04 1.25 -1.07 0.00 0.00 179.97 180.80 1g6n h LEU 124 N 0.95 0.74 0.42 3.04 6.46 -0.78 0.34 115.31 126.49 1g6n h LEU 124 Ca 0.25 -0.28 -0.02 0.00 -0.12 0.00 0.00 57.88 57.71 1g6n h LEU 124 Cb -0.04 -0.20 0.00 0.00 -0.73 0.00 0.00 40.66 39.69 1g6n h LEU 124 CO -0.05 0.84 -0.22 1.56 -0.62 0.00 0.00 178.44 179.95 1g6n h GLN 125 N 0.61 -0.58 -0.98 1.25 4.20 -0.69 -0.04 115.11 118.88 1g6n h GLN 125 Ca 0.13 0.04 0.01 0.00 0.06 0.00 0.00 58.65 58.89 1g6n h GLN 125 Cb 0.43 0.13 -0.05 0.00 0.30 0.00 0.00 27.48 28.30 1g6n h GLN 125 CO 0.02 -0.39 0.64 0.28 -0.67 0.00 0.00 178.83 178.71 1g6n h VAL 126 N -0.60 1.26 -0.13 -0.54 2.07 -1.14 -1.07 116.25 116.10 1g6n h VAL 126 Ca -0.05 -0.50 -0.15 0.00 0.82 0.00 0.00 66.70 66.82 1g6n h VAL 126 Cb 0.47 -0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 30.06 1g6n h VAL 126 CO 0.08 0.26 -0.56 0.74 0.02 0.00 0.00 177.57 178.11 1g6n h THR 127 N 1.34 1.35 -0.35 2.57 2.02 -0.78 -1.60 112.91 117.45 1g6n h THR 127 Ca 0.36 -1.84 -0.12 0.00 0.77 0.00 0.00 66.41 65.57 1g6n h THR 127 Cb -0.13 1.86 -0.01 0.00 -1.74 0.00 0.00 68.15 68.13 1g6n h THR 127 CO -0.07 0.56 -0.28 0.28 0.37 0.00 0.00 175.52 176.37 1g6n h SER 128 N 0.29 0.76 -0.55 4.18 0.02 -0.48 -1.42 113.55 116.36 1g6n h SER 128 Ca 0.00 -0.29 -0.06 0.00 -0.84 0.00 0.00 61.79 60.60 1g6n h SER 128 Cb 1.06 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 63.37 1g6n h SER 128 CO 0.09 1.00 0.12 -0.08 -1.14 0.00 0.00 176.83 176.82 1g6n h GLU 129 N 0.63 0.93 -0.58 3.45 4.81 -0.97 -1.44 114.58 121.42 1g6n h GLU 129 Ca 0.08 -0.21 -0.05 0.00 -0.13 0.00 0.00 59.36 59.04 1g6n h GLU 129 Cb 0.79 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 30.02 1g6n h GLU 129 CO 0.07 0.85 0.14 -0.22 -0.73 0.00 0.00 179.01 179.12 1g6n h LYS 130 N 0.89 0.90 -0.74 1.92 3.64 -0.82 -1.01 116.57 121.35 1g6n h LYS 130 Ca 0.19 -0.19 -0.05 0.00 -1.27 0.00 0.00 60.65 59.33 1g6n h LYS 130 Cb 0.35 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 32.01 1g6n h LYS 130 CO 0.00 0.80 0.26 0.28 -2.27 0.00 0.00 179.45 178.53 1g6n h VAL 131 N 0.86 1.26 -0.22 2.00 2.07 -0.31 -1.43 116.25 120.49 1g6n h VAL 131 Ca 0.19 -0.85 -0.02 0.00 0.82 0.00 0.00 66.70 66.84 1g6n h VAL 131 Cb 0.31 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 30.48 1g6n h VAL 131 CO -0.00 0.34 0.06 1.23 0.02 0.00 0.00 177.57 179.22 1g6n h GLY 132 N 1.12 0.37 0.75 2.17 0.00 -0.59 -1.64 103.07 105.25 1g6n h GLY 132 Ca 0.24 -0.22 0.03 0.00 0.00 0.00 0.00 47.33 47.38 1g6n h GLY 132 CO -0.01 0.21 0.08 3.43 0.00 0.00 0.00 176.54 180.25 1g6n h ASN 133 N 0.17 0.08 -0.34 0.19 -0.26 -0.87 0.96 115.58 115.52 1g6n h ASN 133 Ca 0.07 0.03 -0.07 0.00 -0.56 0.00 0.00 56.30 55.77 1g6n h ASN 133 Cb 0.25 0.03 -0.02 0.00 -1.06 0.00 0.00 38.32 37.52 1g6n h ASN 133 CO -0.00 0.08 -0.02 -0.07 -1.06 0.00 0.00 177.43 176.36 1g6n h LEU 134 N 0.20 0.69 0.06 1.61 4.07 -1.22 0.12 115.31 120.84 1g6n h LEU 134 Ca 0.12 -0.16 -0.28 0.00 0.08 0.00 0.00 57.88 57.64 1g6n h LEU 134 Cb 0.10 -0.18 0.02 0.00 1.08 0.00 0.00 40.66 41.68 1g6n h LEU 134 CO -0.14 0.77 -1.19 0.00 -1.08 0.00 0.00 178.44 176.80 1g6n h ALA 135 N 1.31 0.08 0.00 1.53 0.00 -0.78 -3.38 119.26 118.02 1g6n h ALA 135 Ca 0.13 -0.78 0.00 0.00 0.00 0.00 0.00 54.91 54.26 1g6n h ALA 135 Cb 0.44 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1g6n h ALA 135 CO 0.02 0.76 -0.96 1.19 0.00 0.00 0.00 179.25 180.26 1g6n n PHE 136 N -3.74 0.00 -4.44 0.00 3.72 0.29 -4.99 117.46 108.30 1g6n n PHE 136 Ca -0.11 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 56.97 1g6n n PHE 136 Cb 0.97 -0.03 -0.11 0.00 -0.94 0.00 0.00 39.48 39.37 1g6n n PHE 136 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1g6n s LEU 137 N -2.99 3.08 0.77 4.37 1.43 0.03 -5.04 118.68 120.32 1g6n s LEU 137 Ca 0.06 -0.23 -0.12 0.00 -1.03 0.00 0.00 54.13 52.82 1g6n s LEU 137 Cb 0.14 -1.79 0.05 0.00 0.03 0.00 0.00 46.19 44.62 1g6n s LEU 137 CO 0.77 0.26 1.12 1.51 0.23 0.00 0.00 176.35 180.24 1g6n s ASP 138 N -1.58 4.81 0.38 2.29 -4.77 -1.26 -4.75 116.67 111.79 1g6n s ASP 138 Ca 0.18 1.07 0.14 0.00 -3.30 0.00 0.00 52.55 50.63 1g6n s ASP 138 Cb -0.11 -1.75 0.97 0.00 -1.09 0.00 0.00 42.92 40.94 1g6n s ASP 138 CO 0.09 -1.74 1.83 0.58 0.70 0.00 0.00 175.17 176.63 1g6n h VAL 139 N -0.93 0.69 -0.30 2.11 2.07 -1.97 0.43 116.25 118.36 1g6n h VAL 139 Ca -0.46 -0.18 -0.06 0.00 0.82 0.00 0.00 66.70 66.82 1g6n h VAL 139 Cb 1.28 0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 31.15 1g6n h VAL 139 CO 0.63 0.10 -0.04 0.74 0.02 0.00 0.00 177.57 179.02 1g6n h THR 140 N 0.53 1.27 -0.77 2.57 2.02 -2.00 -2.30 112.91 114.24 1g6n h THR 140 Ca 0.51 -1.03 0.02 0.00 0.77 0.00 0.00 66.41 66.68 1g6n h THR 140 Cb 1.08 1.35 -0.04 0.00 -1.74 0.00 0.00 68.15 68.80 1g6n h THR 140 CO -0.24 0.33 0.50 1.23 0.37 0.00 0.00 175.52 177.71 1g6n h GLY 141 N 0.33 1.10 0.85 2.16 0.00 -1.31 -2.48 103.07 103.71 1g6n h GLY 141 Ca 0.08 -0.38 0.02 0.00 0.00 0.00 0.00 47.33 47.04 1g6n h GLY 141 CO 0.02 0.35 0.03 3.21 0.00 0.00 0.00 176.54 180.15 1g6n h ARG 142 N 0.99 0.09 -0.61 4.80 3.08 -1.05 -2.41 114.38 119.26 1g6n h ARG 142 Ca 0.30 -0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.36 1g6n h ARG 142 Cb -0.04 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 29.95 1g6n h ARG 142 CO -0.09 0.06 0.38 0.82 -1.07 0.00 0.00 179.97 180.07 1g6n h ILE 143 N 0.09 1.09 -0.85 2.04 2.04 -1.16 0.72 117.51 121.49 1g6n h ILE 143 Ca 0.06 -0.26 0.00 0.00 1.00 0.00 0.00 64.86 65.67 1g6n h ILE 143 Cb 0.05 0.27 -0.04 0.00 -0.74 0.00 0.00 36.82 36.36 1g6n h ILE 143 CO -0.08 0.14 0.54 0.00 0.00 0.00 0.00 178.15 178.74 1g6n h ALA 144 N 1.26 1.07 0.11 1.87 0.00 -1.28 -1.46 119.26 120.83 1g6n h ALA 144 Ca 0.24 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 1g6n h ALA 144 Cb -0.01 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.44 1g6n h ALA 144 CO -0.09 0.50 -0.05 1.96 0.00 0.00 0.00 179.25 181.57 1g6n h GLN 145 N 1.15 -0.14 -0.99 0.00 1.08 -0.92 -3.14 115.11 112.16 1g6n h GLN 145 Ca 0.31 0.01 0.18 0.00 -1.45 0.00 0.00 58.65 57.69 1g6n h GLN 145 Cb -0.10 0.03 -0.09 0.00 -0.05 0.00 0.00 27.48 27.27 1g6n h GLN 145 CO -0.06 0.16 0.61 1.15 -0.95 0.00 0.00 178.83 179.74 1g6n h THR 146 N -0.45 0.75 -0.47 -0.54 2.02 -0.60 0.10 112.91 113.72 1g6n h THR 146 Ca -0.01 -0.26 -0.02 0.00 0.77 0.00 0.00 66.41 66.88 1g6n h THR 146 Cb 0.37 -0.07 -0.02 0.00 -1.74 0.00 0.00 68.15 66.69 1g6n h THR 146 CO 0.02 0.14 0.19 -0.07 0.37 0.00 0.00 175.52 176.17 1g6n h LEU 147 N 0.75 0.60 -0.13 2.58 3.38 -1.22 0.17 115.31 121.44 1g6n h LEU 147 Ca 0.54 -0.07 -0.17 0.00 0.09 0.00 0.00 57.88 58.28 1g6n h LEU 147 Cb 0.86 -0.15 0.01 0.00 0.09 0.00 0.00 40.66 41.46 1g6n h LEU 147 CO -0.32 0.55 -0.57 -0.07 0.09 0.00 0.00 178.44 178.12 1g6n h LEU 148 N 0.67 0.73 -1.16 1.67 3.38 -0.83 -1.38 115.31 118.38 1g6n h LEU 148 Ca 0.16 -0.63 0.00 0.00 0.09 0.00 0.00 57.88 57.51 1g6n h LEU 148 Cb 0.13 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.62 1g6n h LEU 148 CO -0.02 1.23 0.54 0.78 0.09 0.00 0.00 178.44 181.06 1g6n h ASN 149 N 0.26 0.96 0.86 -0.43 -0.26 -0.64 -1.08 115.58 115.25 1g6n h ASN 149 Ca -0.04 -0.03 -0.10 0.00 -0.56 0.00 0.00 56.30 55.57 1g6n h ASN 149 Cb 1.21 -0.24 -0.01 0.00 -1.06 0.00 0.00 38.32 38.21 1g6n h ASN 149 CO 0.12 0.71 -0.47 -0.07 -1.06 0.00 0.00 177.43 176.65 1g6n h LEU 150 N 1.13 0.00 0.00 1.61 3.38 -0.92 -2.66 115.31 117.85 1g6n h LEU 150 Ca 0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.27 1g6n h LEU 150 Cb -0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.64 1g6n h LEU 150 CO -0.06 0.47 0.00 0.00 0.09 0.00 0.00 178.44 178.94 1g6n n ALA 151 N -2.32 1.97 0.96 1.53 0.00 -0.44 -2.46 120.51 119.75 1g6n n ALA 151 Ca -0.00 -0.08 0.11 0.00 0.00 0.00 0.00 53.44 53.47 1g6n n ALA 151 Cb 0.57 -1.33 -0.02 0.00 0.00 0.00 0.00 19.45 18.67 1g6n n ALA 151 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1g6n n LYS 152 N -1.44 0.02 -1.72 0.00 5.02 -1.01 -4.92 118.16 114.11 1g6n n LYS 152 Ca 0.06 -0.00 -0.36 0.00 -2.02 0.00 0.00 58.31 55.99 1g6n n LYS 152 Cb 0.22 -1.50 0.07 0.00 -0.02 0.00 0.00 35.03 33.79 1g6n n LYS 152 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1g6n s GLN 153 N -3.02 2.55 0.52 1.97 -1.52 -1.03 -4.93 119.66 114.21 1g6n s GLN 153 Ca 0.08 1.86 0.29 0.00 -1.95 0.00 0.00 55.36 55.65 1g6n s GLN 153 Cb 0.16 -1.87 1.42 0.00 -0.22 0.00 0.00 33.01 32.51 1g6n s GLN 153 CO 0.83 -1.55 2.04 -1.00 -0.25 0.00 0.00 175.29 175.36 1g6n h PRO 154 N 0.35 0.00 -0.00 2.91 0.13 -1.94 -2.77 132.00 130.68 1g6n h PRO 154 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1g6n h PRO 154 Cb 1.31 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.44 1g6n h PRO 154 CO 0.53 0.11 -0.24 -0.40 -0.23 0.00 0.00 178.00 177.77 1g6n n ASP 155 N -3.46 0.49 -4.77 1.44 3.85 -1.26 -4.92 116.55 107.93 1g6n n ASP 155 Ca -0.01 -0.33 -0.39 0.00 -0.71 0.00 0.00 54.79 53.34 1g6n n ASP 155 Cb 0.27 -0.02 -0.01 0.00 -1.35 0.00 0.00 41.12 40.02 1g6n n ASP 155 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1g6n s ALA 156 N -2.74 3.25 0.14 2.12 0.00 -1.05 -5.00 121.76 118.49 1g6n s ALA 156 Ca 0.20 1.20 0.03 0.00 0.00 0.00 0.00 51.96 53.39 1g6n s ALA 156 Cb 0.19 -3.47 -0.04 0.00 0.00 0.00 0.00 23.12 19.80 1g6n s ALA 156 CO 0.56 -0.78 0.22 -1.64 0.00 0.00 0.00 175.76 174.12 1g6n s MET 157 N -2.23 3.23 0.98 0.00 -1.94 -1.10 -4.99 119.30 113.26 1g6n s MET 157 Ca 0.57 -0.68 -0.16 0.00 -1.71 0.00 0.00 55.69 53.70 1g6n s MET 157 Cb -0.37 -2.85 0.22 0.00 2.01 0.00 0.00 34.83 33.83 1g6n s MET 157 CO 0.48 0.52 1.34 -0.08 -0.01 0.00 0.00 175.02 177.27 1g6n s THR 158 N -1.70 2.00 -0.18 2.05 -1.32 -1.26 -1.18 115.64 114.05 1g6n s THR 158 Ca 0.33 -0.01 -0.29 0.00 -1.21 0.00 0.00 61.69 60.51 1g6n s THR 158 Cb -0.11 -2.99 0.13 0.00 -1.51 0.00 0.00 72.50 68.02 1g6n s THR 158 CO 0.26 0.00 1.01 -2.28 -2.21 0.00 0.00 174.62 171.40 1g6n s HIS 159 N -3.93 -0.38 -1.69 9.09 5.04 -1.14 -4.39 115.29 117.89 1g6n s HIS 159 Ca 0.76 0.70 0.07 0.00 -1.54 0.00 0.00 55.06 55.04 1g6n s HIS 159 Cb -0.03 0.44 0.39 0.00 0.04 0.00 0.00 32.58 33.42 1g6n s HIS 159 CO 0.53 -0.32 0.99 -0.35 -2.34 0.00 0.00 174.74 173.25 1g6n n PRO 160 N 0.94 0.16 -3.33 2.88 -0.04 -1.26 -3.55 135.00 130.80 1g6n n PRO 160 Ca -0.11 0.12 -0.23 0.00 -0.04 0.00 0.00 63.50 63.24 1g6n n PRO 160 Cb 0.58 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.45 1g6n n PRO 160 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1g6n s ASP 161 N -2.31 1.34 1.02 3.54 1.11 -1.26 -5.08 116.67 115.02 1g6n s ASP 161 Ca 0.09 -2.51 0.00 0.00 0.18 0.00 0.00 52.55 50.30 1g6n s ASP 161 Cb 0.05 -0.00 0.00 0.00 1.07 0.00 0.00 42.92 44.04 1g6n s ASP 161 CO 0.10 -0.20 0.00 0.61 1.18 0.00 0.00 175.17 176.86 1g6n n GLY 162 N 3.31 0.69 2.52 0.21 0.00 -1.23 -4.66 105.19 106.02 1g6n n GLY 162 Ca 0.22 -0.65 -0.12 0.00 0.00 0.00 0.00 46.02 45.47 1g6n n GLY 162 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1g6n n MET 163 N 12.03 0.47 -4.05 1.61 2.81 -1.09 -2.89 117.12 126.03 1g6n n MET 163 Ca 0.00 -2.22 -0.09 0.00 -1.81 0.00 0.00 57.70 53.58 1g6n n MET 163 Cb 0.00 2.05 -0.11 0.00 -0.71 0.00 0.00 33.22 34.45 1g6n n MET 163 CO 0.00 0.00 0.00 1.14 1.51 0.00 0.00 175.97 178.62 1g6n s GLN 164 N -2.71 0.49 0.16 0.03 -2.07 -0.32 -1.95 119.66 113.29 1g6n s GLN 164 Ca 0.24 -0.93 0.05 0.00 -1.82 0.00 0.00 55.36 52.90 1g6n s GLN 164 Cb -0.00 0.10 -0.04 0.00 -1.09 0.00 0.00 33.01 31.97 1g6n s GLN 164 CO 0.17 -0.07 -0.12 0.42 -1.32 0.00 0.00 175.29 174.38 1g6n s ILE 165 N -2.66 1.33 -0.46 3.63 1.01 -0.10 -2.69 121.20 121.26 1g6n s ILE 165 Ca -0.04 -2.08 0.07 0.00 0.00 0.00 0.00 60.65 58.60 1g6n s ILE 165 Cb -0.01 -1.88 0.40 0.00 0.01 0.00 0.00 42.46 40.98 1g6n s ILE 165 CO -0.05 -0.69 1.03 0.29 0.00 0.00 0.00 174.94 175.52 1g6n n LYS 166 N -0.20 2.95 -3.29 2.79 5.02 -1.26 -1.34 118.16 122.83 1g6n n LYS 166 Ca -0.10 -4.37 -0.24 0.00 -2.02 0.00 0.00 58.31 51.58 1g6n n LYS 166 Cb 0.60 -2.09 -0.01 0.00 -0.02 0.00 0.00 35.03 33.52 1g6n n LYS 166 CO 0.00 0.00 0.00 -1.50 -0.52 0.00 0.00 177.40 175.38 1g6n s ILE 167 N -4.78 5.06 0.38 -0.18 1.10 -1.22 -4.94 121.20 116.63 1g6n s ILE 167 Ca 0.45 -0.39 0.08 0.00 -0.51 0.00 0.00 60.65 60.27 1g6n s ILE 167 Cb 0.37 -3.86 -0.03 0.00 0.15 0.00 0.00 42.46 39.10 1g6n s ILE 167 CO -0.14 -0.59 0.29 0.42 -2.11 0.00 0.00 174.94 172.82 1g6n s THR 168 N -2.37 2.94 0.31 4.00 -4.23 -1.26 -4.67 115.64 110.36 1g6n s THR 168 Ca 0.41 -1.44 0.21 0.00 -1.18 0.00 0.00 61.69 59.68 1g6n s THR 168 Cb -0.10 -3.05 0.19 0.00 1.34 0.00 0.00 72.50 70.89 1g6n s THR 168 CO 0.37 -0.08 1.90 0.03 -0.54 0.00 0.00 174.62 176.30 1g6n h ARG 169 N 1.22 0.00 -0.06 3.99 3.08 -1.96 -2.26 114.38 118.38 1g6n h ARG 169 Ca -0.43 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 59.54 1g6n h ARG 169 Cb 1.26 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.31 1g6n h ARG 169 CO 0.60 0.26 -0.26 0.37 -1.07 0.00 0.00 179.97 179.86 1g6n h GLN 170 N 0.00 0.29 0.21 0.04 4.15 -1.95 -2.27 115.11 115.57 1g6n h GLN 170 Ca -0.00 -0.23 0.01 0.00 0.77 0.00 0.00 58.65 59.20 1g6n h GLN 170 Cb 0.60 0.04 -0.03 0.00 0.21 0.00 0.00 27.48 28.30 1g6n h GLN 170 CO 0.03 0.87 -0.36 0.93 -1.93 0.00 0.00 178.83 178.37 1g6n h GLU 171 N -0.22 -0.62 -0.82 1.69 3.07 -1.92 -0.01 114.58 115.75 1g6n h GLU 171 Ca -0.01 0.04 0.12 0.00 -0.50 0.00 0.00 59.36 59.01 1g6n h GLU 171 Cb 0.91 0.14 -0.08 0.00 -0.84 0.00 0.00 28.75 28.88 1g6n h GLU 171 CO 0.06 -0.42 0.44 0.82 -1.40 0.00 0.00 179.01 178.51 1g6n h ILE 172 N -0.65 0.82 0.00 3.13 2.04 -1.49 0.11 117.51 121.47 1g6n h ILE 172 Ca 0.01 -0.24 -0.03 0.00 1.00 0.00 0.00 64.86 65.60 1g6n h ILE 172 Cb 0.64 0.07 -0.00 0.00 -0.74 0.00 0.00 36.82 36.78 1g6n h ILE 172 CO -0.16 0.13 -0.16 1.23 0.00 0.00 0.00 178.15 179.19 1g6n h GLY 173 N 0.69 0.00 1.97 5.37 0.00 -0.74 -1.28 103.07 109.08 1g6n h GLY 173 Ca 0.42 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.56 1g6n h GLY 173 CO -0.30 0.00 -0.93 1.46 0.00 0.00 0.00 176.54 176.76 1g6n h GLN 174 N 0.00 0.00 0.10 4.80 4.20 0.11 -0.64 115.11 123.68 1g6n h GLN 174 Ca -0.00 0.00 -0.13 0.00 0.06 0.00 0.00 58.65 58.58 1g6n h GLN 174 Cb 0.34 0.00 0.02 0.00 0.30 0.00 0.00 27.48 28.14 1g6n h GLN 174 CO 0.02 0.90 -0.58 0.82 -0.67 0.00 0.00 178.83 179.32 1g6n h ILE 175 N 0.00 1.60 0.05 2.54 2.04 -0.98 -1.84 117.51 120.92 1g6n h ILE 175 Ca -0.02 -2.48 -0.23 0.00 1.00 0.00 0.00 64.86 63.13 1g6n h ILE 175 Cb 1.71 3.26 -0.01 0.00 -0.74 0.00 0.00 36.82 41.04 1g6n h ILE 175 CO 0.12 0.69 -1.06 0.58 0.00 0.00 0.00 178.15 178.47 1g6n h VAL 176 N -0.56 1.58 -1.28 1.67 2.07 -1.36 -3.45 116.25 114.93 1g6n h VAL 176 Ca -0.10 -3.10 0.00 0.00 0.82 0.00 0.00 66.70 64.32 1g6n h VAL 176 Cb 1.46 2.80 0.00 0.00 -1.52 0.00 0.00 31.29 34.02 1g6n h VAL 176 CO 0.11 0.90 0.00 0.61 0.02 0.00 0.00 177.57 179.20 1g6n n GLY 177 N 1.31 0.79 3.68 2.17 0.00 -0.33 -5.04 105.19 107.77 1g6n n GLY 177 Ca -0.04 -0.47 -0.11 0.00 0.00 0.00 0.00 46.02 45.40 1g6n n GLY 177 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1g6n s SER 179 N -3.12 6.32 0.17 0.00 1.04 -1.26 -4.54 113.70 112.31 1g6n s SER 179 Ca 0.21 1.20 -0.14 0.00 0.48 0.00 0.00 55.95 57.70 1g6n s SER 179 Cb -0.03 -2.37 0.08 0.00 0.10 0.00 0.00 66.02 63.80 1g6n s SER 179 CO 0.14 -0.66 1.80 0.03 0.98 0.00 0.00 173.24 175.53 1g6n h ARG 180 N 0.22 0.50 -0.11 4.02 3.08 -1.94 -1.05 114.38 119.11 1g6n h ARG 180 Ca -0.46 -0.03 0.04 0.00 0.07 0.00 0.00 59.98 59.60 1g6n h ARG 180 Cb 1.19 -0.11 -0.05 0.00 0.08 0.00 0.00 29.97 31.08 1g6n h ARG 180 CO 0.62 0.33 -0.18 0.93 -1.07 0.00 0.00 179.97 180.60 1g6n h GLU 181 N 0.52 -0.23 -0.82 0.04 3.07 -1.93 -1.78 114.58 113.44 1g6n h GLU 181 Ca 0.19 0.02 0.05 0.00 -0.50 0.00 0.00 59.36 59.12 1g6n h GLU 181 Cb 0.04 0.05 -0.06 0.00 -0.84 0.00 0.00 28.75 27.95 1g6n h GLU 181 CO -0.10 -0.15 0.51 1.15 -1.40 0.00 0.00 179.01 179.02 1g6n h THR 182 N -0.24 1.06 -0.21 1.13 2.02 -1.81 -1.16 112.91 113.70 1g6n h THR 182 Ca 0.09 -0.33 0.03 0.00 0.77 0.00 0.00 66.41 66.98 1g6n h THR 182 Cb 0.37 0.02 -0.03 0.00 -1.74 0.00 0.00 68.15 66.78 1g6n h THR 182 CO -0.25 0.17 0.02 0.58 0.37 0.00 0.00 175.52 176.41 1g6n h VAL 183 N 0.96 0.87 -0.07 3.16 2.07 -0.53 0.48 116.25 123.19 1g6n h VAL 183 Ca 0.35 -0.03 0.03 0.00 0.82 0.00 0.00 66.70 67.87 1g6n h VAL 183 Cb 0.12 0.78 -0.03 0.00 -1.52 0.00 0.00 31.29 30.63 1g6n h VAL 183 CO -0.15 0.02 -0.13 1.23 0.02 0.00 0.00 177.57 178.56 1g6n h GLY 184 N 0.09 -0.10 0.16 2.17 0.00 -0.60 0.40 103.07 105.19 1g6n h GLY 184 Ca 0.10 0.15 0.11 0.00 0.00 0.00 0.00 47.33 47.69 1g6n h GLY 184 CO -0.15 -0.13 0.05 3.21 0.00 0.00 0.00 176.54 179.52 1g6n h ARG 185 N -0.18 0.17 -0.10 4.80 3.08 -0.67 -0.12 114.38 121.36 1g6n h ARG 185 Ca 0.07 -0.01 -0.17 0.00 0.07 0.00 0.00 59.98 59.93 1g6n h ARG 185 Cb 0.28 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.28 1g6n h ARG 185 CO -0.17 0.11 -0.68 0.82 -1.07 0.00 0.00 179.97 178.98 1g6n h ILE 186 N 0.17 1.37 -0.60 2.04 2.04 -0.30 -2.80 117.51 119.44 1g6n h ILE 186 Ca 0.28 -2.05 -0.06 0.00 1.00 0.00 0.00 64.86 64.03 1g6n h ILE 186 Cb 0.43 2.03 -0.03 0.00 -0.74 0.00 0.00 36.82 38.51 1g6n h ILE 186 CO -0.42 0.62 0.13 -0.07 0.00 0.00 0.00 178.15 178.41 1g6n h LEU 187 N 0.29 0.88 -0.06 1.44 4.07 0.58 -1.85 115.31 120.66 1g6n h LEU 187 Ca -0.02 -0.17 0.00 0.00 0.08 0.00 0.00 57.88 57.77 1g6n h LEU 187 Cb 1.24 -0.23 -0.00 0.00 1.08 0.00 0.00 40.66 42.74 1g6n h LEU 187 CO 0.12 0.86 0.03 0.50 -1.08 0.00 0.00 178.44 178.87 1g6n h LYS 188 N 0.90 0.07 0.00 1.13 1.63 -0.87 -2.32 116.57 117.11 1g6n h LYS 188 Ca 0.19 -0.00 0.02 0.00 -0.85 0.00 0.00 60.65 60.01 1g6n h LYS 188 Cb 0.34 -0.02 -0.03 0.00 -0.60 0.00 0.00 32.23 31.92 1g6n h LYS 188 CO 0.00 0.04 -0.14 0.52 -3.45 0.00 0.00 179.45 176.42 1g6n h MET 189 N 0.07 -0.23 -0.11 1.90 2.86 -1.21 -1.44 114.93 116.77 1g6n h MET 189 Ca 0.02 0.02 0.03 0.00 -2.06 0.00 0.00 59.70 57.71 1g6n h MET 189 Cb -0.00 0.05 -0.00 0.00 0.06 0.00 0.00 31.60 31.71 1g6n h MET 189 CO -0.01 -0.16 0.23 -0.07 1.06 0.00 0.00 176.91 177.96 1g6n h LEU 190 N -0.24 0.00 0.16 1.22 3.38 -1.17 -1.03 115.31 117.63 1g6n h LEU 190 Ca 0.05 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.78 1g6n h LEU 190 Cb 0.30 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.08 1g6n h LEU 190 CO -0.14 0.00 -1.02 -0.08 0.09 0.00 0.00 178.44 177.29 1g6n h GLU 191 N 0.00 0.41 -0.68 1.13 4.81 -0.71 -0.92 114.58 118.62 1g6n h GLU 191 Ca 0.05 -0.65 0.02 0.00 -0.13 0.00 0.00 59.36 58.65 1g6n h GLU 191 Cb 0.50 0.24 -0.04 0.00 0.63 0.00 0.00 28.75 30.08 1g6n h GLU 191 CO -0.00 1.30 0.44 -0.44 -0.73 0.00 0.00 179.01 179.58 1g6n h ASP 192 N -0.15 0.74 0.00 1.04 3.32 -0.77 -1.51 116.42 119.08 1g6n h ASP 192 Ca -0.17 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.87 1g6n h ASP 192 Cb 1.79 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 41.17 1g6n h ASP 192 CO 0.19 0.52 0.00 0.00 -1.72 0.00 0.00 179.24 178.23 1g6n n GLN 193 N -4.65 0.81 -2.25 3.56 6.02 -0.75 -4.84 117.38 115.28 1g6n n GLN 193 Ca 0.06 0.00 -0.07 0.00 -0.01 0.00 0.00 57.00 56.99 1g6n n GLN 193 Cb 0.05 -1.34 -0.01 0.00 1.02 0.00 0.00 30.24 29.97 1g6n n GLN 193 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 1g6n n ASN 194 N 0.21 -2.43 0.01 1.08 6.94 -0.57 -4.82 115.26 115.67 1g6n n ASN 194 Ca 0.00 0.31 -0.13 0.00 -0.02 0.00 0.00 54.58 54.74 1g6n n ASN 194 Cb 0.25 -2.20 -0.14 0.00 -2.36 0.00 0.00 39.78 35.33 1g6n n ASN 194 CO 0.00 0.00 0.00 -0.07 -1.03 0.00 0.00 177.26 176.16 1g6n h LEU 195 N 0.00 0.17 -8.55 -4.53 -0.00 -1.36 -3.48 115.31 97.56 1g6n h LEU 195 Ca -0.16 -0.30 -0.26 0.00 -0.00 0.00 0.00 57.88 57.17 1g6n h LEU 195 Cb 1.00 -0.05 -0.11 0.00 -0.00 0.00 0.00 40.66 41.50 1g6n h LEU 195 CO 0.19 1.27 -0.34 0.27 -0.00 0.00 0.00 178.44 179.83 1g6n s ILE 196 N -2.61 0.00 -0.14 1.22 -4.36 -1.13 -2.49 121.20 111.69 1g6n s ILE 196 Ca -0.08 -1.73 -0.05 0.00 -0.26 0.00 0.00 60.65 58.52 1g6n s ILE 196 Cb 0.08 -2.49 0.07 0.00 1.25 0.00 0.00 42.46 41.36 1g6n s ILE 196 CO 0.82 0.00 0.29 -0.55 0.24 0.00 0.00 174.94 175.74 1g6n s SER 197 N -3.20 0.15 -0.20 4.36 0.15 -0.86 -4.36 113.70 109.74 1g6n s SER 197 Ca 0.33 0.66 -0.06 0.00 0.70 0.00 0.00 55.95 57.58 1g6n s SER 197 Cb 0.02 0.77 -0.03 0.00 -1.71 0.00 0.00 66.02 65.07 1g6n s SER 197 CO 0.17 -0.23 0.03 0.00 1.20 0.00 0.00 173.24 174.41 1g6n s ALA 198 N 2.27 3.17 -0.42 5.45 0.00 -1.26 -0.47 121.76 130.49 1g6n s ALA 198 Ca -0.01 -0.92 0.03 0.00 0.00 0.00 0.00 51.96 51.07 1g6n s ALA 198 Cb -0.12 -1.84 0.12 0.00 0.00 0.00 0.00 23.12 21.27 1g6n s ALA 198 CO -0.09 -0.06 0.16 -1.58 0.00 0.00 0.00 175.76 174.19 1g6n s HIS 199 N 0.83 3.19 0.00 0.00 2.46 0.87 -5.00 115.29 117.64 1g6n s HIS 199 Ca 0.02 -2.93 0.00 0.00 0.47 0.00 0.00 55.06 52.62 1g6n s HIS 199 Cb -0.14 -2.69 0.00 0.00 -0.13 0.00 0.00 32.58 29.62 1g6n s HIS 199 CO 0.02 -0.84 0.00 0.41 -2.47 0.00 0.00 174.74 171.86 1g6n n GLY 200 N 3.73 2.23 0.57 1.59 0.00 -1.26 -1.79 105.19 110.26 1g6n n GLY 200 Ca 0.04 -0.36 0.12 0.00 0.00 0.00 0.00 46.02 45.82 1g6n n GLY 200 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1g6n n LYS 201 N 12.78 1.76 -3.84 1.61 5.02 -1.26 -4.85 118.16 129.38 1g6n n LYS 201 Ca 0.00 -1.13 -0.36 0.00 -2.02 0.00 0.00 58.31 54.81 1g6n n LYS 201 Cb 0.00 -1.44 -0.10 0.00 -0.02 0.00 0.00 35.03 33.47 1g6n n LYS 201 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1g6n s THR 202 N -1.88 4.93 -0.13 -0.18 2.01 -0.74 -3.38 115.64 116.28 1g6n s THR 202 Ca 0.35 0.03 -0.00 0.00 0.31 0.00 0.00 61.69 62.37 1g6n s THR 202 Cb 0.19 -3.27 -0.01 0.00 0.01 0.00 0.00 72.50 69.42 1g6n s THR 202 CO 0.30 0.40 -0.13 -0.63 -0.69 0.00 0.00 174.62 173.87 1g6n s ILE 203 N 0.82 3.06 -0.41 1.82 1.01 -0.45 -0.09 121.20 126.96 1g6n s ILE 203 Ca 0.05 -0.66 -0.13 0.00 0.00 0.00 0.00 60.65 59.91 1g6n s ILE 203 Cb -0.13 -2.28 0.04 0.00 0.01 0.00 0.00 42.46 40.09 1g6n s ILE 203 CO 0.02 0.52 0.29 -0.69 0.00 0.00 0.00 174.94 175.08 1g6n s VAL 204 N 0.35 4.95 -0.21 2.92 1.01 0.38 -0.92 120.40 128.88 1g6n s VAL 204 Ca -0.11 -0.87 -0.22 0.00 0.00 0.00 0.00 61.98 60.79 1g6n s VAL 204 Cb -0.16 -3.82 -0.02 0.00 0.00 0.00 0.00 36.38 32.38 1g6n s VAL 204 CO 0.06 -0.36 0.68 -0.69 0.00 0.00 0.00 175.10 174.79 1g6n s VAL 205 N 1.61 4.97 -2.00 2.92 1.01 -0.82 -2.03 120.40 126.06 1g6n s VAL 205 Ca 0.04 1.28 0.30 0.00 0.00 0.00 0.00 61.98 63.60 1g6n s VAL 205 Cb -0.20 -3.99 0.86 0.00 0.00 0.00 0.00 36.38 33.05 1g6n s VAL 205 CO 0.08 0.06 2.13 -1.22 0.00 0.00 0.00 175.10 176.15