#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jhg n THR 2 N 0.00 0.00 -1.69 2.46 -2.24 -1.26 -4.95 114.28 106.60 2jhg n THR 2 Ca 0.00 -0.24 -0.45 0.00 -2.27 0.00 0.00 64.05 61.10 2jhg n THR 2 Cb 0.00 0.63 -0.04 0.00 -2.10 0.00 0.00 70.33 68.83 2jhg n THR 2 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2jhg n ALA 3 N -1.48 1.87 -0.67 6.98 0.00 -1.26 -1.48 120.51 124.47 2jhg n ALA 3 Ca -0.00 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.87 2jhg n ALA 3 Cb 0.14 -2.41 0.00 0.00 0.00 0.00 0.00 19.45 17.19 2jhg n ALA 3 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jhg n GLY 4 N 3.55 1.58 3.65 0.00 0.00 -1.26 -5.01 105.19 107.70 2jhg n GLY 4 Ca 0.16 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.91 2jhg n GLY 4 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jhg s LYS 5 N -0.03 2.35 0.22 1.61 1.02 -0.55 -4.84 119.74 119.52 2jhg s LYS 5 Ca 0.00 -1.11 -0.31 0.00 0.02 0.00 0.00 55.97 54.57 2jhg s LYS 5 Cb 0.00 -2.34 -0.10 0.00 -0.52 0.00 0.00 37.83 34.87 2jhg s LYS 5 CO 0.00 0.46 1.49 0.08 -0.92 0.00 0.00 175.35 176.46 2jhg s VAL 6 N -1.67 2.62 -0.17 3.17 1.01 -1.26 -4.07 120.40 120.02 2jhg s VAL 6 Ca 0.27 0.49 -0.09 0.00 0.00 0.00 0.00 61.98 62.65 2jhg s VAL 6 Cb -0.09 -3.32 -0.05 0.00 0.00 0.00 0.00 36.38 32.92 2jhg s VAL 6 CO 0.18 0.06 0.11 -0.63 0.00 0.00 0.00 175.10 174.83 2jhg s ILE 7 N 0.41 5.28 -0.22 2.22 1.01 -0.28 -4.93 121.20 124.69 2jhg s ILE 7 Ca 0.63 0.14 -0.11 0.00 0.00 0.00 0.00 60.65 61.31 2jhg s ILE 7 Cb -0.43 -3.37 -0.05 0.00 0.01 0.00 0.00 42.46 38.62 2jhg s ILE 7 CO 0.39 0.49 0.17 -0.54 0.00 0.00 0.00 174.94 175.45 2jhg s LYS 8 N 0.01 4.13 0.32 2.79 1.02 -1.26 0.02 119.74 126.77 2jhg s LYS 8 Ca 0.09 -0.21 -0.12 0.00 0.02 0.00 0.00 55.97 55.75 2jhg s LYS 8 Cb -0.11 -3.49 0.02 0.00 -0.52 0.00 0.00 37.83 33.73 2jhg s LYS 8 CO -0.00 0.16 0.60 0.00 -0.92 0.00 0.00 175.35 175.19 2jhg s LYS 10 N -3.27 4.05 0.18 0.00 2.20 -1.26 -0.26 119.74 121.37 2jhg s LYS 10 Ca 0.21 0.57 -0.04 0.00 -0.36 0.00 0.00 55.97 56.35 2jhg s LYS 10 Cb -0.03 -3.21 -0.03 0.00 -1.51 0.00 0.00 37.83 33.05 2jhg s LYS 10 CO 0.12 0.66 0.17 0.00 -0.36 0.00 0.00 175.35 175.94 2jhg s ALA 11 N -1.12 0.74 -0.41 3.13 0.00 -0.58 -1.06 121.76 122.46 2jhg s ALA 11 Ca 0.27 -1.41 -0.09 0.00 0.00 0.00 0.00 51.96 50.73 2jhg s ALA 11 Cb -0.18 1.11 0.07 0.00 0.00 0.00 0.00 23.12 24.12 2jhg s ALA 11 CO 0.16 -0.60 0.24 0.00 0.00 0.00 0.00 175.76 175.57 2jhg s ALA 12 N -4.08 3.26 -0.09 0.00 0.00 -0.16 -1.30 121.76 119.40 2jhg s ALA 12 Ca 0.29 -2.10 -0.15 0.00 0.00 0.00 0.00 51.96 50.00 2jhg s ALA 12 Cb 0.06 -2.61 -0.05 0.00 0.00 0.00 0.00 23.12 20.52 2jhg s ALA 12 CO 0.07 -1.61 0.37 0.08 0.00 0.00 0.00 175.76 174.67 2jhg s VAL 13 N 1.42 5.18 -0.40 0.00 1.01 -0.01 -4.41 120.40 123.19 2jhg s VAL 13 Ca 0.03 0.74 -0.09 0.00 0.00 0.00 0.00 61.98 62.65 2jhg s VAL 13 Cb -0.22 -3.70 0.06 0.00 0.00 0.00 0.00 36.38 32.52 2jhg s VAL 13 CO 0.02 0.45 0.23 -0.22 0.00 0.00 0.00 175.10 175.59 2jhg s LEU 14 N -0.14 4.97 0.10 3.92 2.96 -0.36 -0.65 118.68 129.48 2jhg s LEU 14 Ca 0.22 -1.34 0.01 0.00 -0.22 0.00 0.00 54.13 52.80 2jhg s LEU 14 Cb -0.15 -1.99 -0.22 0.00 0.50 0.00 0.00 46.19 44.33 2jhg s LEU 14 CO 0.09 -0.48 1.23 -0.50 -1.32 0.00 0.00 176.35 175.37 2jhg h TRP 15 N 8.40 0.26 -3.24 5.38 4.06 -1.87 -1.40 115.95 127.53 2jhg h TRP 15 Ca -0.24 -0.18 -0.01 0.00 2.06 0.00 0.00 58.89 60.52 2jhg h TRP 15 Cb 1.09 -0.01 -0.09 0.00 -1.00 0.00 0.00 29.16 29.14 2jhg h TRP 15 CO 0.60 1.12 0.07 -1.83 -3.56 0.00 0.00 178.44 174.85 2jhg s GLU 16 N -2.74 1.44 0.77 0.49 -1.05 -1.26 -4.30 118.70 112.05 2jhg s GLU 16 Ca -0.02 -0.86 -0.14 0.00 -0.15 0.00 0.00 54.97 53.80 2jhg s GLU 16 Cb 0.09 0.54 0.06 0.00 -0.44 0.00 0.00 34.13 34.38 2jhg s GLU 16 CO 0.85 -0.62 1.19 -1.21 0.95 0.00 0.00 175.26 176.42 2jhg s GLU 17 N -3.87 1.94 -1.41 -4.83 2.02 -1.26 -3.73 118.70 107.55 2jhg s GLU 17 Ca 0.09 1.68 -0.04 0.00 0.02 0.00 0.00 54.97 56.72 2jhg s GLU 17 Cb -0.02 -1.82 0.00 0.00 0.10 0.00 0.00 34.13 32.40 2jhg s GLU 17 CO -0.02 -1.97 0.59 1.63 0.02 0.00 0.00 175.26 175.51 2jhg n LYS 18 N -3.05 -4.68 -4.25 1.61 5.02 0.73 -4.99 118.16 108.54 2jhg n LYS 18 Ca 0.13 0.83 -0.20 0.00 -2.02 0.00 0.00 58.31 57.05 2jhg n LYS 18 Cb 0.51 -5.53 -0.12 0.00 -0.02 0.00 0.00 35.03 29.87 2jhg n LYS 18 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2jhg s LYS 19 N -5.64 1.03 0.76 1.97 -0.14 -1.24 -5.11 119.74 111.36 2jhg s LYS 19 Ca 0.29 -1.18 -0.15 0.00 -1.36 0.00 0.00 55.97 53.57 2jhg s LYS 19 Cb -0.13 -1.04 0.04 0.00 -1.68 0.00 0.00 37.83 35.01 2jhg s LYS 19 CO 0.36 0.22 1.09 -2.30 -0.76 0.00 0.00 175.35 173.96 2jhg n PRO 20 N 0.78 0.43 -2.00 -1.68 -0.02 -1.26 -4.96 135.00 126.28 2jhg n PRO 20 Ca -0.17 0.21 -0.38 0.00 -2.02 0.00 0.00 63.50 61.14 2jhg n PRO 20 Cb 0.56 -2.34 0.01 0.00 -0.02 0.00 0.00 33.50 31.71 2jhg n PRO 20 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 2jhg s PHE 21 N -1.90 2.61 -0.34 6.00 0.08 -1.26 -4.80 117.98 118.36 2jhg s PHE 21 Ca 0.74 1.43 -0.09 0.00 0.12 0.00 0.00 56.93 59.13 2jhg s PHE 21 Cb -0.32 -3.64 0.02 0.00 -0.57 0.00 0.00 43.02 38.51 2jhg s PHE 21 CO 0.50 -2.26 0.16 0.45 -0.10 0.00 0.00 175.22 173.96 2jhg s SER 22 N -1.01 5.52 -0.38 1.36 0.15 0.18 -4.89 113.70 114.62 2jhg s SER 22 Ca 0.65 -0.89 -0.21 0.00 0.70 0.00 0.00 55.95 56.20 2jhg s SER 22 Cb -0.36 -1.97 0.01 0.00 -1.71 0.00 0.00 66.02 61.99 2jhg s SER 22 CO 0.44 -0.31 0.69 -0.63 1.20 0.00 0.00 173.24 174.64 2jhg s ILE 23 N 1.53 4.81 0.31 6.45 1.01 -1.26 -0.83 121.20 133.22 2jhg s ILE 23 Ca 0.02 0.56 -0.19 0.00 0.00 0.00 0.00 60.65 61.03 2jhg s ILE 23 Cb -0.18 -4.16 0.03 0.00 0.01 0.00 0.00 42.46 38.16 2jhg s ILE 23 CO 0.05 -0.44 0.75 -1.83 0.00 0.00 0.00 174.94 173.47 2jhg s GLU 24 N 2.90 1.92 0.16 2.79 -1.05 -0.42 -4.96 118.70 120.04 2jhg s GLU 24 Ca 0.26 -1.13 -0.30 0.00 -0.15 0.00 0.00 54.97 53.65 2jhg s GLU 24 Cb -0.14 0.61 -0.07 0.00 -0.44 0.00 0.00 34.13 34.09 2jhg s GLU 24 CO 0.17 -0.89 1.18 -2.00 0.95 0.00 0.00 175.26 174.67 2jhg s GLU 25 N -3.35 4.49 0.26 -4.83 2.12 -1.26 -1.53 118.70 114.60 2jhg s GLU 25 Ca 0.13 1.83 0.07 0.00 0.36 0.00 0.00 54.97 57.35 2jhg s GLU 25 Cb -0.06 -3.27 -0.05 0.00 0.26 0.00 0.00 34.13 31.01 2jhg s GLU 25 CO 0.08 -0.10 -0.09 0.14 -0.54 0.00 0.00 175.26 174.76 2jhg s VAL 26 N 0.16 1.69 -0.17 3.70 -7.23 0.64 -4.52 120.40 114.67 2jhg s VAL 26 Ca 0.54 -2.16 -0.04 0.00 -1.81 0.00 0.00 61.98 58.50 2jhg s VAL 26 Cb -0.31 -2.33 -0.03 0.00 0.56 0.00 0.00 36.38 34.27 2jhg s VAL 26 CO 0.35 -0.39 -0.02 -1.61 -0.31 0.00 0.00 175.10 173.12 2jhg s GLU 27 N -3.70 3.69 -0.25 4.82 2.02 0.02 -1.30 118.70 124.01 2jhg s GLU 27 Ca 0.28 -0.50 -0.01 0.00 0.02 0.00 0.00 54.97 54.75 2jhg s GLU 27 Cb 0.02 -2.99 0.03 0.00 0.10 0.00 0.00 34.13 31.29 2jhg s GLU 27 CO 0.11 0.18 -0.06 0.08 0.02 0.00 0.00 175.26 175.59 2jhg s VAL 28 N 0.54 2.85 0.72 2.63 1.01 0.10 -1.60 120.40 126.65 2jhg s VAL 28 Ca -0.02 -1.05 -0.14 0.00 0.00 0.00 0.00 61.98 60.77 2jhg s VAL 28 Cb -0.14 -2.46 0.03 0.00 0.00 0.00 0.00 36.38 33.82 2jhg s VAL 28 CO 0.02 0.19 1.13 0.00 0.00 0.00 0.00 175.10 176.44 2jhg s ALA 29 N 1.32 2.25 0.74 5.51 0.00 0.05 -1.13 121.76 130.49 2jhg s ALA 29 Ca -0.00 0.57 -0.12 0.00 0.00 0.00 0.00 51.96 52.41 2jhg s ALA 29 Cb -0.17 -3.36 0.04 0.00 0.00 0.00 0.00 23.12 19.64 2jhg s ALA 29 CO -0.04 -1.66 1.10 -1.25 0.00 0.00 0.00 175.76 173.91 2jhg s PRO 30 N -4.27 2.38 0.26 0.00 0.04 -1.26 -4.85 135.00 127.31 2jhg s PRO 30 Ca 0.67 1.28 -0.29 0.00 0.04 0.00 0.00 61.00 62.70 2jhg s PRO 30 Cb -0.22 -1.91 -0.09 0.00 0.04 0.00 0.00 34.50 32.32 2jhg s PRO 30 CO 0.47 -1.56 1.23 -1.25 0.04 0.00 0.00 177.00 175.93 2jhg s PRO 31 N -4.59 4.47 0.11 0.56 0.04 -1.26 -5.04 135.00 129.28 2jhg s PRO 31 Ca 0.64 2.01 -0.01 0.00 0.04 0.00 0.00 61.00 63.67 2jhg s PRO 31 Cb -0.19 -3.16 0.02 0.00 0.04 0.00 0.00 34.50 31.21 2jhg s PRO 31 CO 0.51 -0.07 0.14 1.63 0.04 0.00 0.00 177.00 179.25 2jhg n LYS 32 N 1.62 0.11 -1.68 4.56 5.02 -1.26 -4.43 118.16 122.10 2jhg n LYS 32 Ca 0.02 -0.28 -0.44 0.00 -2.02 0.00 0.00 58.31 55.59 2jhg n LYS 32 Cb 0.43 -0.13 -0.03 0.00 -0.02 0.00 0.00 35.03 35.28 2jhg n LYS 32 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2jhg n ALA 33 N -3.06 1.39 -2.37 7.82 0.00 -1.26 -1.81 120.51 121.22 2jhg n ALA 33 Ca -0.02 0.41 -0.19 0.00 0.00 0.00 0.00 53.44 53.64 2jhg n ALA 33 Cb 0.07 -2.32 -0.01 0.00 0.00 0.00 0.00 19.45 17.19 2jhg n ALA 33 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2jhg n HIS 34 N 2.24 -0.92 -4.48 0.00 8.25 0.56 -4.88 115.22 115.99 2jhg n HIS 34 Ca 0.12 0.00 -0.24 0.00 -0.26 0.00 0.00 57.72 57.34 2jhg n HIS 34 Cb 0.32 -3.75 -0.10 0.00 1.12 0.00 0.00 29.99 27.58 2jhg n HIS 34 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 2jhg s GLU 35 N -4.96 1.68 -0.04 -0.41 2.02 -0.75 -1.25 118.70 114.99 2jhg s GLU 35 Ca 0.00 -1.79 -0.01 0.00 0.02 0.00 0.00 54.97 53.19 2jhg s GLU 35 Cb -0.00 -1.69 0.03 0.00 0.10 0.00 0.00 34.13 32.57 2jhg s GLU 35 CO 0.00 0.27 0.02 0.08 0.02 0.00 0.00 175.26 175.65 2jhg s VAL 36 N -2.58 0.13 -0.22 2.63 1.01 0.42 -0.53 120.40 121.27 2jhg s VAL 36 Ca 0.30 0.19 -0.10 0.00 0.00 0.00 0.00 61.98 62.37 2jhg s VAL 36 Cb -0.03 -0.28 -0.05 0.00 0.00 0.00 0.00 36.38 36.03 2jhg s VAL 36 CO 0.15 0.17 0.14 -0.60 0.00 0.00 0.00 175.10 174.95 2jhg s ARG 37 N 1.48 4.12 -0.08 2.72 3.52 -0.22 -0.82 118.95 129.66 2jhg s ARG 37 Ca -0.03 -0.25 0.05 0.00 -0.13 0.00 0.00 55.73 55.36 2jhg s ARG 37 Cb -0.13 -3.45 -0.00 0.00 -1.56 0.00 0.00 34.95 29.80 2jhg s ARG 37 CO -0.03 0.20 -0.24 0.42 -0.81 0.00 0.00 175.30 174.84 2jhg s ILE 38 N 0.65 2.08 -0.34 4.11 1.01 0.10 -0.47 121.20 128.33 2jhg s ILE 38 Ca 0.07 -1.03 -0.23 0.00 0.00 0.00 0.00 60.65 59.46 2jhg s ILE 38 Cb -0.12 -1.77 0.00 0.00 0.01 0.00 0.00 42.46 40.58 2jhg s ILE 38 CO 0.01 0.56 0.76 -0.75 0.00 0.00 0.00 174.94 175.52 2jhg s LYS 39 N 0.14 3.82 0.32 2.79 2.20 0.38 -1.42 119.74 127.96 2jhg s LYS 39 Ca -0.13 0.37 -0.29 0.00 -0.36 0.00 0.00 55.97 55.56 2jhg s LYS 39 Cb -0.16 -3.78 -0.10 0.00 -1.51 0.00 0.00 37.83 32.28 2jhg s LYS 39 CO 0.07 -0.77 1.24 -1.64 -0.36 0.00 0.00 175.35 173.89 2jhg s MET 40 N 2.99 4.42 -0.09 4.03 -1.94 0.06 -0.69 119.30 128.08 2jhg s MET 40 Ca 0.31 2.08 -0.00 0.00 -1.71 0.00 0.00 55.69 56.36 2jhg s MET 40 Cb -0.14 -3.09 -0.06 0.00 2.01 0.00 0.00 34.83 33.56 2jhg s MET 40 CO 0.15 -0.08 -0.09 0.28 -0.01 0.00 0.00 175.02 175.27 2jhg n VAL 41 N 0.88 0.53 -3.70 -6.03 0.31 -0.48 -4.70 118.33 105.14 2jhg n VAL 41 Ca -0.00 -0.19 -0.14 0.00 -0.01 0.00 0.00 64.34 64.00 2jhg n VAL 41 Cb 0.43 -0.95 -0.09 0.00 -0.91 0.00 0.00 33.84 32.32 2jhg n VAL 41 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2jhg s ALA 42 N -2.18 -1.13 -0.05 3.52 0.00 -0.93 -2.16 121.76 118.83 2jhg s ALA 42 Ca -0.13 0.95 -0.04 0.00 0.00 0.00 0.00 51.96 52.74 2jhg s ALA 42 Cb 0.03 -0.31 0.02 0.00 0.00 0.00 0.00 23.12 22.86 2jhg s ALA 42 CO 0.20 -0.26 0.12 -0.08 0.00 0.00 0.00 175.76 175.74 2jhg s THR 43 N -0.61 -0.01 0.35 0.00 -1.32 -0.32 -1.14 115.64 112.59 2jhg s THR 43 Ca -0.07 0.05 -0.06 0.00 -1.21 0.00 0.00 61.69 60.39 2jhg s THR 43 Cb -0.03 -0.18 -0.05 0.00 -1.51 0.00 0.00 72.50 70.73 2jhg s THR 43 CO 0.04 0.02 0.65 -0.83 -2.21 0.00 0.00 174.62 172.29 2jhg s GLY 44 N 0.33 1.81 -0.49 6.08 0.00 0.30 -0.40 107.32 114.95 2jhg s GLY 44 Ca -0.02 -0.46 -0.17 0.00 0.00 0.00 0.00 44.72 44.06 2jhg s GLY 44 CO -0.01 -0.32 0.52 -0.42 0.00 0.00 0.00 173.10 172.86 2jhg s ILE 45 N -2.27 5.04 0.07 0.90 1.01 -0.77 -4.56 121.20 120.62 2jhg s ILE 45 Ca 0.46 -0.73 -0.06 0.00 0.00 0.00 0.00 60.65 60.32 2jhg s ILE 45 Cb -0.10 -4.21 -0.05 0.00 0.01 0.00 0.00 42.46 38.10 2jhg s ILE 45 CO 0.32 -0.69 0.33 0.00 0.00 0.00 0.00 174.94 174.91 2jhg h ARG 47 N 3.51 0.07 -0.13 0.00 9.65 -1.97 -0.73 114.38 124.79 2jhg h ARG 47 Ca -0.48 -0.00 -0.02 0.00 -1.10 0.00 0.00 59.98 58.38 2jhg h ARG 47 Cb 1.18 -0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 29.74 2jhg h ARG 47 CO 0.69 0.05 0.01 0.77 2.80 0.00 0.00 179.97 184.28 2jhg h SER 48 N 0.08 0.16 -0.54 -3.80 0.02 -1.99 0.68 113.55 108.16 2jhg h SER 48 Ca 0.31 -0.01 -0.09 0.00 -0.84 0.00 0.00 61.79 61.15 2jhg h SER 48 Cb 1.12 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 63.60 2jhg h SER 48 CO -0.03 0.19 -0.01 0.44 -1.14 0.00 0.00 176.83 176.28 2jhg h ASP 49 N 0.18 0.96 -0.19 3.07 3.32 -1.53 -2.40 116.42 119.83 2jhg h ASP 49 Ca 0.04 -0.27 -0.05 0.00 0.02 0.00 0.00 57.03 56.77 2jhg h ASP 49 Cb 0.12 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.39 2jhg h ASP 49 CO 0.00 1.03 -0.03 -0.78 -1.72 0.00 0.00 179.24 177.74 2jhg h ASP 50 N 0.90 0.46 0.01 6.45 3.58 -1.21 -2.64 116.42 123.98 2jhg h ASP 50 Ca 0.16 -0.09 -0.01 0.00 0.42 0.00 0.00 57.03 57.51 2jhg h ASP 50 Cb 0.54 -0.12 -0.00 0.00 1.72 0.00 0.00 39.33 41.47 2jhg h ASP 50 CO 0.03 0.55 -0.02 0.45 -2.88 0.00 0.00 179.24 177.37 2jhg h HIS 51 N 0.47 0.04 -0.28 0.28 3.86 -0.42 -0.45 115.15 118.66 2jhg h HIS 51 Ca 0.10 -0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.27 2jhg h HIS 51 Cb 0.35 -0.01 -0.01 0.00 1.06 0.00 0.00 27.41 28.80 2jhg h HIS 51 CO 0.01 0.07 0.03 0.28 0.86 0.00 0.00 177.93 179.18 2jhg h VAL 52 N 0.05 1.24 -0.72 2.45 2.07 -1.19 -0.87 116.25 119.27 2jhg h VAL 52 Ca 0.01 -0.84 0.01 0.00 0.82 0.00 0.00 66.70 66.69 2jhg h VAL 52 Cb 0.07 1.25 -0.04 0.00 -1.52 0.00 0.00 31.29 31.06 2jhg h VAL 52 CO 0.00 0.27 0.47 0.58 0.02 0.00 0.00 177.57 178.92 2jhg h VAL 53 N 0.28 1.19 -0.00 2.57 2.07 -1.23 -3.01 116.25 118.12 2jhg h VAL 53 Ca 0.08 -0.36 0.00 0.00 0.82 0.00 0.00 66.70 67.24 2jhg h VAL 53 Cb 0.37 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 30.28 2jhg h VAL 53 CO 0.01 0.19 -0.18 -1.54 0.02 0.00 0.00 177.57 176.07 2jhg n SER 54 N -4.57 0.28 0.00 0.57 3.41 -0.28 -0.19 113.62 112.83 2jhg n SER 54 Ca 0.07 -0.04 0.00 0.00 -0.26 0.00 0.00 58.87 58.64 2jhg n SER 54 Cb 0.02 -0.16 0.00 0.00 -0.26 0.00 0.00 64.21 63.82 2jhg n SER 54 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2jhg n GLY 55 N 1.43 0.53 0.17 5.00 0.00 -0.74 -4.90 105.19 106.69 2jhg n GLY 55 Ca 0.09 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.01 2jhg n GLY 55 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2jhg h THR 56 N 0.00 1.18 -3.51 2.61 2.02 -1.48 -3.41 112.91 110.33 2jhg h THR 56 Ca 0.00 -0.55 -0.67 0.00 0.77 0.00 0.00 66.41 65.97 2jhg h THR 56 Cb 0.03 0.90 -0.27 0.00 -1.74 0.00 0.00 68.15 67.07 2jhg h THR 56 CO 0.00 0.19 -0.69 -0.22 0.37 0.00 0.00 175.52 175.18 2jhg s LEU 57 N -9.83 3.30 -0.10 2.58 2.96 -0.71 -1.14 118.68 115.73 2jhg s LEU 57 Ca -0.13 -0.56 -0.24 0.00 -0.22 0.00 0.00 54.13 52.98 2jhg s LEU 57 Cb 0.09 -1.79 -0.03 0.00 0.50 0.00 0.00 46.19 44.97 2jhg s LEU 57 CO 0.74 -0.09 0.74 -0.69 -1.32 0.00 0.00 176.35 175.73 2jhg s VAL 58 N 1.47 4.99 0.02 1.68 1.01 -1.26 -4.10 120.40 124.21 2jhg s VAL 58 Ca 0.04 1.50 -0.17 0.00 0.00 0.00 0.00 61.98 63.36 2jhg s VAL 58 Cb -0.16 -4.07 0.03 0.00 0.00 0.00 0.00 36.38 32.18 2jhg s VAL 58 CO -0.01 0.18 0.36 0.28 0.00 0.00 0.00 175.10 175.91 2jhg s THR 59 N 1.25 0.06 0.30 3.92 -1.32 -1.26 -4.78 115.64 113.81 2jhg s THR 59 Ca 0.38 -0.50 -0.30 0.00 -1.21 0.00 0.00 61.69 60.06 2jhg s THR 59 Cb -0.17 -0.83 -0.11 0.00 -1.51 0.00 0.00 72.50 69.87 2jhg s THR 59 CO 0.17 -0.27 1.58 -2.84 -2.21 0.00 0.00 174.62 171.04 2jhg s PRO 60 N -2.01 4.12 0.18 7.08 0.02 -1.26 -5.02 135.00 138.11 2jhg s PRO 60 Ca -0.08 2.57 0.08 0.00 0.02 0.00 0.00 61.00 63.59 2jhg s PRO 60 Cb -0.02 -3.02 -0.04 0.00 0.02 0.00 0.00 34.50 31.44 2jhg s PRO 60 CO 0.01 -0.62 -0.04 -0.51 -0.33 0.00 0.00 177.00 175.50 2jhg s LEU 61 N -0.64 3.16 0.71 -5.54 1.02 -1.26 -4.36 118.68 111.76 2jhg s LEU 61 Ca 0.62 -0.49 -0.13 0.00 0.02 0.00 0.00 54.13 54.15 2jhg s LEU 61 Cb -0.48 -1.82 0.02 0.00 0.02 0.00 0.00 46.19 43.94 2jhg s LEU 61 CO 0.49 0.09 1.10 -2.16 0.02 0.00 0.00 176.35 175.89 2jhg s PRO 62 N -2.95 2.58 0.01 1.29 0.04 -1.26 -4.93 135.00 129.79 2jhg s PRO 62 Ca 0.27 1.28 -0.10 0.00 0.04 0.00 0.00 61.00 62.48 2jhg s PRO 62 Cb -0.09 -1.93 0.01 0.00 0.04 0.00 0.00 34.50 32.53 2jhg s PRO 62 CO 0.17 -1.40 0.20 0.54 0.04 0.00 0.00 177.00 176.55 2jhg s VAL 63 N -2.61 0.08 -0.49 -0.36 0.11 -0.53 -0.82 120.40 115.79 2jhg s VAL 63 Ca 0.64 -0.70 -0.16 0.00 -2.93 0.00 0.00 61.98 58.83 2jhg s VAL 63 Cb -0.19 -0.63 0.07 0.00 -1.53 0.00 0.00 36.38 34.10 2jhg s VAL 63 CO 0.48 -0.38 0.45 -0.63 -3.33 0.00 0.00 175.10 171.68 2jhg s ILE 64 N -1.75 5.17 0.00 7.04 1.01 -0.60 -1.23 121.20 130.84 2jhg s ILE 64 Ca -0.11 -1.00 0.00 0.00 0.00 0.00 0.00 60.65 59.54 2jhg s ILE 64 Cb -0.05 -4.18 0.00 0.00 0.01 0.00 0.00 42.46 38.24 2jhg s ILE 64 CO 0.01 -0.65 0.00 0.00 0.00 0.00 0.00 174.94 174.30 2jhg n ALA 65 N 5.39 0.00 -0.03 9.38 0.00 -1.26 -3.67 120.51 130.32 2jhg n ALA 65 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.32 2jhg n ALA 65 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.89 2jhg n ALA 65 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jhg n GLY 66 N 5.00 0.41 0.00 0.00 0.00 -1.26 -1.56 105.19 107.77 2jhg n GLY 66 Ca 0.00 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 44.77 2jhg n GLY 66 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2jhg n HIS 67 N 2.16 0.00 -3.79 1.61 1.44 -1.26 -1.16 115.22 114.22 2jhg n HIS 67 Ca 0.00 0.00 -0.35 0.00 -2.01 0.00 0.00 57.72 55.36 2jhg n HIS 67 Cb 0.00 0.01 -0.12 0.00 0.12 0.00 0.00 29.99 30.00 2jhg n HIS 67 CO 0.00 0.00 0.00 -2.00 -2.81 0.00 0.00 176.34 171.53 2jhg s GLU 68 N 0.00 2.07 0.27 -1.40 2.12 -1.26 -4.60 118.70 115.90 2jhg s GLU 68 Ca 0.00 -2.02 -0.21 0.00 0.36 0.00 0.00 54.97 53.10 2jhg s GLU 68 Cb 0.00 -3.57 0.02 0.00 0.26 0.00 0.00 34.13 30.85 2jhg s GLU 68 CO 0.00 -1.09 0.70 0.00 -0.54 0.00 0.00 175.26 174.33 2jhg s ALA 69 N 0.78 -1.22 -0.02 6.30 0.00 -1.21 -0.54 121.76 125.86 2jhg s ALA 69 Ca 0.11 -0.25 -0.08 0.00 0.00 0.00 0.00 51.96 51.73 2jhg s ALA 69 Cb -0.22 0.86 0.01 0.00 0.00 0.00 0.00 23.12 23.77 2jhg s ALA 69 CO -0.04 -1.00 0.17 0.00 0.00 0.00 0.00 175.76 174.89 2jhg s ALA 70 N -3.91 -0.43 0.00 0.00 0.00 -0.29 -4.12 121.76 113.01 2jhg s ALA 70 Ca 0.10 0.09 0.00 0.00 0.00 0.00 0.00 51.96 52.15 2jhg s ALA 70 Cb -0.05 0.00 0.00 0.00 0.00 0.00 0.00 23.12 23.07 2jhg s ALA 70 CO 0.05 -0.19 0.00 0.41 0.00 0.00 0.00 175.76 176.03 2jhg n GLY 71 N 1.79 2.87 2.98 0.00 0.00 -0.33 -1.38 105.19 111.12 2jhg n GLY 71 Ca -0.20 -0.92 -0.23 0.00 0.00 0.00 0.00 46.02 44.67 2jhg n GLY 71 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jhg s ILE 72 N -2.82 0.92 0.08 -0.61 1.01 0.13 -1.09 121.20 118.82 2jhg s ILE 72 Ca 0.00 -0.36 -0.31 0.00 0.00 0.00 0.00 60.65 59.98 2jhg s ILE 72 Cb 0.00 -0.86 -0.09 0.00 0.01 0.00 0.00 42.46 41.52 2jhg s ILE 72 CO 0.00 0.31 1.66 -0.69 0.00 0.00 0.00 174.94 176.21 2jhg s VAL 73 N 0.67 2.97 -0.09 2.92 1.01 -0.18 -0.47 120.40 127.23 2jhg s VAL 73 Ca -0.12 0.45 -0.08 0.00 0.00 0.00 0.00 61.98 62.23 2jhg s VAL 73 Cb -0.15 -3.29 -0.28 0.00 0.00 0.00 0.00 36.38 32.66 2jhg s VAL 73 CO 0.02 0.00 0.47 -0.08 0.00 0.00 0.00 175.10 175.52 2jhg h GLU 74 N 8.21 0.31 -2.72 2.72 4.22 -1.10 0.99 114.58 127.21 2jhg h GLU 74 Ca -0.43 -0.53 0.03 0.00 0.08 0.00 0.00 59.36 58.51 2jhg h GLU 74 Cb 1.20 0.20 -0.13 0.00 0.50 0.00 0.00 28.75 30.52 2jhg h GLU 74 CO 0.93 1.26 0.32 -1.54 -2.18 0.00 0.00 179.01 177.79 2jhg s SER 75 N -7.13 -0.49 0.06 1.04 1.04 -1.05 -4.81 113.70 102.35 2jhg s SER 75 Ca -0.20 0.01 0.07 0.00 0.48 0.00 0.00 55.95 56.30 2jhg s SER 75 Cb 0.06 0.52 -0.03 0.00 0.10 0.00 0.00 66.02 66.67 2jhg s SER 75 CO 0.80 -0.84 -0.19 0.27 0.98 0.00 0.00 173.24 174.27 2jhg s ILE 76 N -3.49 1.50 0.86 -1.02 -4.36 -1.26 -1.06 121.20 112.37 2jhg s ILE 76 Ca 0.02 -1.28 -0.12 0.00 -0.26 0.00 0.00 60.65 59.01 2jhg s ILE 76 Cb -0.01 -1.35 0.14 0.00 1.25 0.00 0.00 42.46 42.49 2jhg s ILE 76 CO -0.11 0.03 1.21 -0.83 0.24 0.00 0.00 174.94 175.48 2jhg s GLY 77 N -1.46 1.71 0.16 6.27 0.00 0.31 -4.95 107.32 109.35 2jhg s GLY 77 Ca 0.05 -1.03 -0.34 0.00 0.00 0.00 0.00 44.72 43.40 2jhg s GLY 77 CO 0.02 -0.42 1.34 -2.21 0.00 0.00 0.00 173.10 171.84 2jhg n GLU 78 N -3.43 1.52 -0.08 2.90 2.13 -1.26 -2.74 120.64 119.68 2jhg n GLU 78 Ca 0.12 0.54 0.00 0.00 0.66 0.00 0.00 57.16 58.48 2jhg n GLU 78 Cb 0.60 -2.17 0.00 0.00 0.27 0.00 0.00 31.44 30.14 2jhg n GLU 78 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2jhg n GLY 79 N 2.46 1.03 3.73 8.31 0.00 -1.26 -0.33 105.19 119.13 2jhg n GLY 79 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 2jhg n GLY 79 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jhg s VAL 80 N -2.45 3.71 0.00 1.61 1.01 -1.11 -4.83 120.40 118.34 2jhg s VAL 80 Ca 0.00 1.35 0.00 0.00 0.00 0.00 0.00 61.98 63.33 2jhg s VAL 80 Cb 0.00 -3.86 0.00 0.00 0.00 0.00 0.00 36.38 32.52 2jhg s VAL 80 CO 0.00 0.17 0.00 0.35 0.00 0.00 0.00 175.10 175.62 2jhg n THR 81 N 3.06 0.00 0.71 3.92 -2.24 -1.26 -4.84 114.28 113.63 2jhg n THR 81 Ca 0.06 -0.33 0.07 0.00 -2.27 0.00 0.00 64.05 61.58 2jhg n THR 81 Cb 0.45 0.97 -0.07 0.00 -2.10 0.00 0.00 70.33 69.58 2jhg n THR 81 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2jhg n THR 82 N -0.71 0.00 -3.99 4.28 -2.24 -1.26 -4.97 114.28 105.39 2jhg n THR 82 Ca 0.00 -0.17 -0.09 0.00 -2.27 0.00 0.00 64.05 61.52 2jhg n THR 82 Cb 0.00 1.03 -0.08 0.00 -2.10 0.00 0.00 70.33 69.17 2jhg n THR 82 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 2jhg s VAL 83 N -2.35 0.13 0.05 2.28 -7.23 -1.26 -4.64 120.40 107.38 2jhg s VAL 83 Ca 0.07 -1.50 -0.00 0.00 -1.81 0.00 0.00 61.98 58.74 2jhg s VAL 83 Cb 0.12 -1.65 -0.04 0.00 0.56 0.00 0.00 36.38 35.37 2jhg s VAL 83 CO 0.59 -0.59 -0.04 0.00 -0.31 0.00 0.00 175.10 174.75 2jhg s ARG 84 N -3.94 0.59 0.23 4.82 1.70 -1.26 -5.00 118.95 116.09 2jhg s ARG 84 Ca 0.12 -1.11 -0.31 0.00 -0.47 0.00 0.00 55.73 53.96 2jhg s ARG 84 Cb 0.06 0.09 -0.14 0.00 -0.57 0.00 0.00 34.95 34.38 2jhg s ARG 84 CO -0.05 -0.07 1.23 -2.30 -1.08 0.00 0.00 175.30 173.02 2jhg n PRO 85 N 0.42 1.55 0.00 3.89 -0.02 -1.26 -1.62 135.00 137.96 2jhg n PRO 85 Ca -0.16 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 61.87 2jhg n PRO 85 Cb 0.60 -2.09 0.00 0.00 -0.02 0.00 0.00 33.50 31.99 2jhg n PRO 85 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jhg n GLY 86 N 1.86 1.83 3.77 -1.23 0.00 0.34 -4.96 105.19 106.80 2jhg n GLY 86 Ca 0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.76 2jhg n GLY 86 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2jhg s ASP 87 N -2.02 6.69 0.20 1.61 1.01 -0.64 -4.67 116.67 118.84 2jhg s ASP 87 Ca 0.00 2.35 -0.30 0.00 0.71 0.00 0.00 52.55 55.32 2jhg s ASP 87 Cb 0.00 -2.62 -0.08 0.00 1.01 0.00 0.00 42.92 41.23 2jhg s ASP 87 CO 0.00 -0.56 1.04 -0.54 0.21 0.00 0.00 175.17 175.32 2jhg s LYS 88 N -2.11 4.68 0.04 8.23 1.02 -1.26 -1.01 119.74 129.32 2jhg s LYS 88 Ca 0.54 1.64 -0.05 0.00 0.02 0.00 0.00 55.97 58.12 2jhg s LYS 88 Cb -0.31 -3.28 -0.01 0.00 -0.52 0.00 0.00 37.83 33.70 2jhg s LYS 88 CO 0.40 0.22 0.08 0.14 -0.92 0.00 0.00 175.35 175.26 2jhg s VAL 89 N -0.56 0.14 -0.16 3.17 -7.23 -0.25 -1.30 120.40 114.22 2jhg s VAL 89 Ca 0.46 -1.13 0.01 0.00 -1.81 0.00 0.00 61.98 59.51 2jhg s VAL 89 Cb -0.28 -0.89 0.01 0.00 0.56 0.00 0.00 36.38 35.77 2jhg s VAL 89 CO 0.34 -0.62 -0.18 -0.63 -0.31 0.00 0.00 175.10 173.70 2jhg s ILE 90 N -2.62 2.35 0.45 -0.62 1.01 -0.54 -1.18 121.20 120.05 2jhg s ILE 90 Ca -0.05 -0.87 -0.24 0.00 0.00 0.00 0.00 60.65 59.49 2jhg s ILE 90 Cb -0.01 -1.98 -0.07 0.00 0.01 0.00 0.00 42.46 40.41 2jhg s ILE 90 CO -0.05 0.53 1.26 -2.84 0.00 0.00 0.00 174.94 173.84 2jhg s PRO 91 N 0.95 3.73 -0.34 2.79 0.02 -1.26 -1.71 135.00 139.19 2jhg s PRO 91 Ca -0.03 2.04 -0.04 0.00 0.02 0.00 0.00 61.00 62.99 2jhg s PRO 91 Cb -0.15 -2.54 0.06 0.00 0.02 0.00 0.00 34.50 31.89 2jhg s PRO 91 CO -0.04 -0.65 0.08 -0.51 -0.33 0.00 0.00 177.00 175.55 2jhg s LEU 92 N -2.85 4.31 0.53 -5.54 1.43 0.53 -4.79 118.68 112.31 2jhg s LEU 92 Ca 0.62 -1.38 0.32 0.00 -1.03 0.00 0.00 54.13 52.66 2jhg s LEU 92 Cb -0.35 -1.79 1.34 0.00 0.03 0.00 0.00 46.19 45.42 2jhg s LEU 92 CO 0.44 -0.34 1.98 2.19 0.23 0.00 0.00 176.35 180.84 2jhg h PHE 93 N 8.09 0.00 -3.61 0.29 -5.15 -1.81 -3.35 116.94 111.39 2jhg h PHE 93 Ca -0.20 0.00 -0.67 0.00 -0.20 0.00 0.00 57.97 56.90 2jhg h PHE 93 Cb 1.07 0.00 -0.25 0.00 0.22 0.00 0.00 35.95 36.99 2jhg h PHE 93 CO 0.60 0.06 -0.61 0.99 -2.00 0.00 0.00 178.31 177.35 2jhg s THR 94 N -3.73 4.16 1.11 0.88 2.01 -1.26 -4.72 115.64 114.09 2jhg s THR 94 Ca 0.00 -0.54 -0.15 0.00 0.31 0.00 0.00 61.69 61.31 2jhg s THR 94 Cb 0.10 -3.10 0.25 0.00 0.01 0.00 0.00 72.50 69.75 2jhg s THR 94 CO 0.56 0.13 1.08 -2.16 -0.69 0.00 0.00 174.62 173.53 2jhg s PRO 95 N 1.55 -0.51 -0.35 4.92 0.05 -1.26 -4.65 135.00 134.75 2jhg s PRO 95 Ca 0.04 0.34 -0.00 0.00 0.05 0.00 0.00 61.00 61.42 2jhg s PRO 95 Cb -0.17 -1.64 0.13 0.00 0.05 0.00 0.00 34.50 32.87 2jhg s PRO 95 CO 0.03 -3.32 0.20 -1.14 0.05 0.00 0.00 177.00 172.82 2jhg s GLN 96 N -5.04 0.58 0.39 4.56 0.74 -0.37 -4.35 119.66 116.16 2jhg s GLN 96 Ca 0.68 -1.29 0.20 0.00 0.05 0.00 0.00 55.36 54.99 2jhg s GLN 96 Cb -0.17 -1.39 0.71 0.00 1.10 0.00 0.00 33.01 33.26 2jhg s GLN 96 CO 0.58 -1.18 1.74 0.00 -0.55 0.00 0.00 175.29 175.89 2jhg n GLY 98 N 0.24 1.96 0.00 0.00 0.00 -1.26 -4.82 105.19 101.30 2jhg n GLY 98 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2jhg n GLY 98 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2jhg n LYS 99 N -2.00 0.83 -2.19 1.61 5.02 -1.26 -4.67 118.16 115.50 2jhg n LYS 99 Ca 0.00 0.00 -0.27 0.00 -2.02 0.00 0.00 58.31 56.02 2jhg n LYS 99 Cb 0.00 -0.93 0.05 0.00 -0.02 0.00 0.00 35.03 34.13 2jhg n LYS 99 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2jhg h ARG 101 N -0.50 0.38 -0.09 0.00 0.11 -1.98 -1.60 114.38 110.69 2jhg h ARG 101 Ca -0.45 -0.03 -0.05 0.00 0.10 0.00 0.00 59.98 59.55 2jhg h ARG 101 Cb 1.29 -0.08 -0.00 0.00 1.11 0.00 0.00 29.97 32.28 2jhg h ARG 101 CO 0.62 0.26 -0.14 0.28 0.10 0.00 0.00 179.97 181.09 2jhg h VAL 102 N 0.39 1.39 -0.26 0.08 2.07 -1.93 -2.34 116.25 115.65 2jhg h VAL 102 Ca 0.10 -1.38 -0.01 0.00 0.82 0.00 0.00 66.70 66.23 2jhg h VAL 102 Cb -0.02 2.08 -0.01 0.00 -1.52 0.00 0.00 31.29 31.81 2jhg h VAL 102 CO -0.02 0.39 0.11 0.00 0.02 0.00 0.00 177.57 178.08 2jhg n LYS 104 N -4.44 0.26 -2.73 0.00 5.02 -0.65 -4.83 118.16 110.80 2jhg n LYS 104 Ca 0.01 0.23 -0.41 0.00 -2.02 0.00 0.00 58.31 56.11 2jhg n LYS 104 Cb 0.12 -1.81 -0.04 0.00 -0.02 0.00 0.00 35.03 33.27 2jhg n LYS 104 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 2jhg s HIS 105 N -3.11 3.78 0.53 2.13 2.46 -0.70 -4.95 115.29 115.42 2jhg s HIS 105 Ca 0.10 1.77 0.18 0.00 0.47 0.00 0.00 55.06 57.58 2jhg s HIS 105 Cb 0.12 -3.06 1.35 0.00 -0.13 0.00 0.00 32.58 30.86 2jhg s HIS 105 CO 0.59 0.16 2.16 -1.35 -2.47 0.00 0.00 174.74 173.83 2jhg h PRO 106 N 5.86 0.00 0.07 2.88 0.11 -1.88 -3.05 132.00 135.99 2jhg h PRO 106 Ca -0.42 0.00 -0.33 0.00 0.11 0.00 0.00 66.00 65.35 2jhg h PRO 106 Cb 1.21 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.29 2jhg h PRO 106 CO 0.72 0.00 -1.89 0.39 -0.21 0.00 0.00 178.00 177.02 2jhg n GLU 107 N -4.42 0.70 -2.10 1.05 1.02 -1.26 -4.96 120.64 110.66 2jhg n GLU 107 Ca -0.03 0.27 -0.38 0.00 -0.02 0.00 0.00 57.16 57.00 2jhg n GLU 107 Cb 0.09 -1.74 0.00 0.00 -0.02 0.00 0.00 31.44 29.77 2jhg n GLU 107 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2jhg s GLY 108 N -5.39 2.86 0.00 0.62 0.00 -1.15 -4.89 107.32 99.36 2jhg s GLY 108 Ca -0.15 1.11 0.00 0.00 0.00 0.00 0.00 44.72 45.69 2jhg s GLY 108 CO 0.79 1.63 0.00 1.16 0.00 0.00 0.00 173.10 176.68 2jhg n ASN 109 N -0.33 0.11 -4.12 1.64 6.94 -1.26 -4.68 115.26 113.56 2jhg n ASN 109 Ca 0.06 -0.15 -0.43 0.00 -0.02 0.00 0.00 54.58 54.05 2jhg n ASN 109 Cb 0.46 0.31 0.00 0.00 -2.36 0.00 0.00 39.78 38.20 2jhg n ASN 109 CO 0.00 0.00 0.00 0.33 -1.03 0.00 0.00 177.26 176.56 2jhg n PHE 110 N -0.33 3.84 -1.58 -2.53 7.35 -1.26 -4.74 117.46 118.20 2jhg n PHE 110 Ca 0.00 -3.01 -0.45 0.00 -0.76 0.00 0.00 57.45 53.23 2jhg n PHE 110 Cb 0.00 -2.15 -0.02 0.00 0.35 0.00 0.00 39.48 37.66 2jhg n PHE 110 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2jhg n LEU 112 N 1.39 0.44 -0.23 0.00 4.77 -1.26 -1.58 117.00 120.52 2jhg n LEU 112 Ca 0.11 0.64 0.09 0.00 -0.03 0.00 0.00 56.01 56.82 2jhg n LEU 112 Cb 0.31 -0.63 0.41 0.00 -2.33 0.00 0.00 43.42 41.18 2jhg n LEU 112 CO 0.60 -0.61 0.78 0.29 -1.33 0.00 0.00 177.39 177.11 2jhg n LYS 113 N -2.02 1.30 -1.42 3.23 4.76 -1.26 -4.94 118.16 117.81 2jhg n LYS 113 Ca 0.01 -0.45 -0.34 0.00 -2.87 0.00 0.00 58.31 54.66 2jhg n LYS 113 Cb 0.13 -1.30 0.09 0.00 -1.84 0.00 0.00 35.03 32.12 2jhg n LYS 113 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2jhg s ASN 114 N -1.48 4.25 -0.20 4.39 2.20 -0.62 -4.89 114.94 118.59 2jhg s ASN 114 Ca 0.26 2.27 0.16 0.00 -0.94 0.00 0.00 52.86 54.61 2jhg s ASN 114 Cb 0.13 -2.58 0.57 0.00 -2.00 0.00 0.00 41.25 37.37 2jhg s ASN 114 CO 0.21 -2.22 1.48 -0.67 -2.94 0.00 0.00 177.10 172.96 2jhg n ASP 115 N -2.80 4.04 -0.06 3.54 2.03 -1.26 -4.62 116.55 117.42 2jhg n ASP 115 Ca 0.13 -3.08 -0.22 0.00 0.52 0.00 0.00 54.79 52.14 2jhg n ASP 115 Cb 0.51 -0.58 -0.13 0.00 -0.72 0.00 0.00 41.12 40.20 2jhg n ASP 115 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 2jhg n LEU 116 N -0.42 2.47 -0.19 -2.67 7.94 -1.26 -3.76 117.00 119.11 2jhg n LEU 116 Ca 0.24 0.20 -0.07 0.00 -1.11 0.00 0.00 56.01 55.27 2jhg n LEU 116 Cb 0.97 -1.02 0.03 0.00 0.53 0.00 0.00 43.42 43.93 2jhg n LEU 116 CO 0.19 0.72 1.11 0.28 -1.11 0.00 0.00 177.39 178.57 2jhg h SER 117 N -0.29 0.64 -2.22 1.96 0.02 -1.99 -3.35 113.55 108.32 2jhg h SER 117 Ca -0.47 -0.02 -0.58 0.00 -0.84 0.00 0.00 61.79 59.89 2jhg h SER 117 Cb 1.81 -0.16 -0.38 0.00 0.14 0.00 0.00 62.40 63.80 2jhg h SER 117 CO -0.07 0.46 -1.03 0.23 -1.14 0.00 0.00 176.83 175.29 2jhg n MET 118 N -4.70 0.39 -1.83 3.45 2.81 -1.26 -5.11 117.12 110.86 2jhg n MET 118 Ca 0.03 -3.19 -0.42 0.00 -1.81 0.00 0.00 57.70 52.32 2jhg n MET 118 Cb 0.02 -1.49 -0.03 0.00 -0.71 0.00 0.00 33.22 31.01 2jhg n MET 118 CO 0.00 0.00 0.00 -2.14 1.51 0.00 0.00 175.97 175.34 2jhg s PRO 119 N -0.43 4.17 -0.14 0.03 0.02 -1.25 -4.89 135.00 132.52 2jhg s PRO 119 Ca 0.34 2.48 0.16 0.00 0.02 0.00 0.00 61.00 64.00 2jhg s PRO 119 Cb 0.09 -3.16 -0.23 0.00 0.02 0.00 0.00 34.50 31.22 2jhg s PRO 119 CO -0.16 -0.69 0.13 0.54 -0.33 0.00 0.00 177.00 176.49 2jhg n ARG 120 N 4.15 1.05 -3.00 5.54 1.74 -1.26 -4.61 116.66 120.27 2jhg n ARG 120 Ca 0.15 -0.04 -0.11 0.00 -0.77 0.00 0.00 57.85 57.07 2jhg n ARG 120 Cb 0.37 -1.44 0.04 0.00 -1.02 0.00 0.00 32.46 30.41 2jhg n ARG 120 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2jhg n GLY 121 N 1.83 0.20 3.42 -0.13 0.00 -1.26 -4.77 105.19 104.49 2jhg n GLY 121 Ca -0.23 -0.22 -0.23 0.00 0.00 0.00 0.00 46.02 45.35 2jhg n GLY 121 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2jhg s THR 122 N -3.16 0.42 1.02 2.61 -4.23 -1.26 -0.86 115.64 110.18 2jhg s THR 122 Ca 0.26 -2.00 -0.12 0.00 -1.18 0.00 0.00 61.69 58.65 2jhg s THR 122 Cb -0.11 -2.42 0.20 0.00 1.34 0.00 0.00 72.50 71.50 2jhg s THR 122 CO 0.36 0.00 1.08 -0.04 -0.54 0.00 0.00 174.62 175.47 2jhg s MET 123 N -3.68 0.24 0.43 3.99 -1.94 -0.07 -4.53 119.30 113.73 2jhg s MET 123 Ca 0.30 0.80 0.16 0.00 -1.71 0.00 0.00 55.69 55.24 2jhg s MET 123 Cb 0.03 -1.69 1.05 0.00 2.01 0.00 0.00 34.83 36.23 2jhg s MET 123 CO 0.18 -2.93 1.93 1.96 -0.01 0.00 0.00 175.02 176.15 2jhg h GLN 124 N -2.05 0.40 0.00 2.03 1.08 -1.97 -0.73 115.11 113.87 2jhg h GLN 124 Ca -0.55 -0.02 0.00 0.00 -1.45 0.00 0.00 58.65 56.63 2jhg h GLN 124 Cb 1.31 -0.09 0.00 0.00 -0.05 0.00 0.00 27.48 28.65 2jhg h GLN 124 CO 0.53 0.26 0.00 -0.40 -0.95 0.00 0.00 178.83 178.27 2jhg n ASP 125 N -4.47 0.00 0.00 1.46 3.85 -1.26 -4.87 116.55 111.25 2jhg n ASP 125 Ca 0.14 -1.29 0.00 0.00 -0.71 0.00 0.00 54.79 52.92 2jhg n ASP 125 Cb 0.51 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.28 2jhg n ASP 125 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2jhg n GLY 126 N 0.60 0.63 3.61 6.12 0.00 -0.28 -5.04 105.19 110.83 2jhg n GLY 126 Ca 0.12 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.86 2jhg n GLY 126 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2jhg s THR 127 N -2.13 1.98 0.03 2.61 -4.23 -1.26 -4.86 115.64 107.78 2jhg s THR 127 Ca 0.00 -2.01 0.06 0.00 -1.18 0.00 0.00 61.69 58.56 2jhg s THR 127 Cb 0.00 -2.98 -0.03 0.00 1.34 0.00 0.00 72.50 70.83 2jhg s THR 127 CO 0.00 -0.01 -0.14 -0.55 -0.54 0.00 0.00 174.62 173.38 2jhg s SER 128 N -3.70 4.07 0.00 3.99 0.15 -1.26 -0.89 113.70 116.05 2jhg s SER 128 Ca 0.35 -0.33 0.24 0.00 0.70 0.00 0.00 55.95 56.91 2jhg s SER 128 Cb 0.10 -0.77 0.62 0.00 -1.71 0.00 0.00 66.02 64.26 2jhg s SER 128 CO 0.18 0.27 1.50 0.54 1.20 0.00 0.00 173.24 176.92 2jhg n ARG 129 N 1.57 2.03 -4.98 5.44 5.12 -1.26 -4.95 116.66 119.64 2jhg n ARG 129 Ca -0.16 -1.53 -0.32 0.00 -1.93 0.00 0.00 57.85 53.91 2jhg n ARG 129 Cb 0.52 -1.46 -0.14 0.00 -1.16 0.00 0.00 32.46 30.23 2jhg n ARG 129 CO 0.00 0.00 0.00 -0.06 -1.93 0.00 0.00 177.63 175.64 2jhg s PHE 130 N -1.84 2.61 0.03 -1.55 0.08 -1.26 -0.77 117.98 115.28 2jhg s PHE 130 Ca 0.34 -0.23 0.02 0.00 0.12 0.00 0.00 56.93 57.18 2jhg s PHE 130 Cb 0.20 -1.59 -0.02 0.00 -0.57 0.00 0.00 43.02 41.04 2jhg s PHE 130 CO 0.30 0.14 -0.07 0.99 -0.10 0.00 0.00 175.22 176.48 2jhg s THR 131 N -0.71 0.48 -0.10 0.64 2.01 -0.63 -1.45 115.64 115.87 2jhg s THR 131 Ca 0.11 -0.88 -0.04 0.00 0.31 0.00 0.00 61.69 61.19 2jhg s THR 131 Cb -0.10 -0.52 0.05 0.00 0.01 0.00 0.00 72.50 71.93 2jhg s THR 131 CO 0.00 -0.28 0.23 0.00 -0.69 0.00 0.00 174.62 173.88 2jhg n ARG 133 N 4.76 -4.25 -0.96 0.00 1.74 -1.26 -1.24 116.66 115.45 2jhg n ARG 133 Ca -0.16 0.48 0.00 0.00 -0.77 0.00 0.00 57.85 57.40 2jhg n ARG 133 Cb 0.51 -5.26 0.00 0.00 -1.02 0.00 0.00 32.46 26.69 2jhg n ARG 133 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2jhg n GLY 134 N -1.55 0.71 3.44 -0.13 0.00 -1.26 -5.02 105.19 101.37 2jhg n GLY 134 Ca 0.04 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 2jhg n GLY 134 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jhg s LYS 135 N -0.17 3.54 0.27 1.61 -0.14 -0.37 -5.09 119.74 119.38 2jhg s LYS 135 Ca 0.00 -0.60 -0.30 0.00 -1.36 0.00 0.00 55.97 53.71 2jhg s LYS 135 Cb 0.00 -2.79 -0.11 0.00 -1.68 0.00 0.00 37.83 33.25 2jhg s LYS 135 CO 0.00 0.22 1.52 -2.14 -0.76 0.00 0.00 175.35 174.19 2jhg s PRO 136 N 0.38 4.19 -0.06 -1.68 0.02 -1.26 -0.29 135.00 136.30 2jhg s PRO 136 Ca -0.07 2.44 0.02 0.00 0.02 0.00 0.00 61.00 63.41 2jhg s PRO 136 Cb -0.15 -3.07 -0.03 0.00 0.02 0.00 0.00 34.50 31.28 2jhg s PRO 136 CO 0.04 -0.53 -0.09 0.42 -0.33 0.00 0.00 177.00 176.51 2jhg s ILE 137 N 0.02 3.50 0.56 2.83 -1.09 -0.53 -4.86 121.20 121.63 2jhg s ILE 137 Ca 0.62 -0.56 -0.18 0.00 -2.23 0.00 0.00 60.65 58.30 2jhg s ILE 137 Cb -0.45 -2.41 -0.05 0.00 -1.58 0.00 0.00 42.46 37.97 2jhg s ILE 137 CO 0.45 0.60 1.07 -1.00 -1.23 0.00 0.00 174.94 174.83 2jhg s HIS 138 N -0.77 2.88 0.71 3.97 3.76 -0.00 -4.40 115.29 121.43 2jhg s HIS 138 Ca 0.12 1.54 -0.07 0.00 -0.15 0.00 0.00 55.06 56.50 2jhg s HIS 138 Cb -0.11 -3.11 0.06 0.00 1.11 0.00 0.00 32.58 30.54 2jhg s HIS 138 CO 0.01 -1.20 1.02 -1.01 -0.85 0.00 0.00 174.74 172.72 2jhg s HIS 139 N -2.15 2.92 -0.13 1.40 3.76 -0.04 -1.55 115.29 119.50 2jhg s HIS 139 Ca 0.67 0.45 -0.02 0.00 -0.15 0.00 0.00 55.06 56.02 2jhg s HIS 139 Cb -0.18 -3.21 0.04 0.00 1.11 0.00 0.00 32.58 30.34 2jhg s HIS 139 CO 0.30 -1.43 -0.00 0.12 -0.85 0.00 0.00 174.74 172.88 2jhg s PHE 140 N -3.26 0.98 -1.24 1.40 5.36 -1.24 -4.30 117.98 115.67 2jhg s PHE 140 Ca 0.60 -0.55 -0.00 0.00 -0.96 0.00 0.00 56.93 56.02 2jhg s PHE 140 Cb -0.11 -0.97 0.00 0.00 -0.34 0.00 0.00 43.02 41.60 2jhg s PHE 140 CO 0.45 -0.47 0.03 1.28 -1.46 0.00 0.00 175.22 175.05 2jhg n LEU 141 N 5.07 -1.38 -1.68 6.12 4.77 -1.26 -0.70 117.00 127.93 2jhg n LEU 141 Ca -0.09 0.11 -0.19 0.00 -0.03 0.00 0.00 56.01 55.82 2jhg n LEU 141 Cb 0.49 -2.35 -0.06 0.00 -2.33 0.00 0.00 43.42 39.17 2jhg n LEU 141 CO 0.13 -0.13 -0.20 0.61 -1.33 0.00 0.00 177.39 176.46 2jhg n GLY 142 N -0.88 1.12 0.70 -0.72 0.00 -1.26 -4.47 105.19 99.67 2jhg n GLY 142 Ca -0.16 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.75 2jhg n GLY 142 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2jhg n THR 143 N -2.95 0.00 -2.86 2.61 -2.24 0.12 -4.59 114.28 104.37 2jhg n THR 143 Ca -0.20 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.56 2jhg n THR 143 Cb 0.64 -0.57 0.00 0.00 -2.10 0.00 0.00 70.33 68.31 2jhg n THR 143 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2jhg n SER 144 N -1.82 -7.31 -0.43 3.42 7.64 -0.87 -4.68 113.62 109.57 2jhg n SER 144 Ca 0.00 0.10 0.11 0.00 1.01 0.00 0.00 58.87 60.08 2jhg n SER 144 Cb 0.00 -4.94 -0.02 0.00 -1.01 0.00 0.00 64.21 58.24 2jhg n SER 144 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2jhg n THR 145 N -1.30 0.00 -1.54 0.44 -2.24 -0.31 -4.45 114.28 104.88 2jhg n THR 145 Ca 0.03 -0.23 -0.35 0.00 -2.27 0.00 0.00 64.05 61.23 2jhg n THR 145 Cb 0.48 1.23 -0.04 0.00 -2.10 0.00 0.00 70.33 69.89 2jhg n THR 145 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 2jhg n PHE 146 N -0.21 2.12 -3.58 4.78 3.72 -0.60 -4.80 117.46 118.88 2jhg n PHE 146 Ca 0.08 -2.69 -0.15 0.00 -0.05 0.00 0.00 57.45 54.64 2jhg n PHE 146 Cb 0.45 -2.04 -0.07 0.00 -0.94 0.00 0.00 39.48 36.89 2jhg n PHE 146 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2jhg s SER 147 N 1.31 -0.69 0.46 4.37 0.15 -1.26 -0.98 113.70 117.05 2jhg s SER 147 Ca 0.63 1.08 0.11 0.00 0.70 0.00 0.00 55.95 58.47 2jhg s SER 147 Cb 0.22 1.02 1.03 0.00 -1.71 0.00 0.00 66.02 66.58 2jhg s SER 147 CO -0.08 -0.40 2.09 1.56 1.20 0.00 0.00 173.24 177.60 2jhg h GLN 148 N 4.04 0.28 -4.94 5.44 1.08 -1.40 -3.41 115.11 116.21 2jhg h GLN 148 Ca -0.28 -0.02 -0.40 0.00 -1.45 0.00 0.00 58.65 56.50 2jhg h GLN 148 Cb 1.15 -0.06 -0.27 0.00 -0.05 0.00 0.00 27.48 28.25 2jhg h GLN 148 CO 0.21 0.20 -0.78 0.71 -0.95 0.00 0.00 178.83 178.22 2jhg s TYR 149 N -5.25 0.96 0.23 2.96 2.02 -1.26 -0.76 117.35 116.25 2jhg s TYR 149 Ca -0.07 -0.26 0.02 0.00 -0.37 0.00 0.00 57.07 56.39 2jhg s TYR 149 Cb 0.17 -0.59 -0.05 0.00 -0.40 0.00 0.00 41.96 41.09 2jhg s TYR 149 CO 0.70 -0.01 0.05 -0.08 -1.57 0.00 0.00 175.55 174.65 2jhg s THR 150 N -0.55 0.66 -0.07 -0.71 -1.32 -0.51 -4.98 115.64 108.16 2jhg s THR 150 Ca 0.02 -2.00 0.03 0.00 -1.21 0.00 0.00 61.69 58.53 2jhg s THR 150 Cb -0.06 -2.45 0.01 0.00 -1.51 0.00 0.00 72.50 68.49 2jhg s THR 150 CO 0.00 -0.18 -0.17 -0.69 -2.21 0.00 0.00 174.62 171.37 2jhg s VAL 151 N -3.68 1.51 0.13 5.08 1.01 -1.26 -0.72 120.40 122.46 2jhg s VAL 151 Ca 0.32 -0.71 0.06 0.00 0.00 0.00 0.00 61.98 61.65 2jhg s VAL 151 Cb 0.07 -1.33 -0.04 0.00 0.00 0.00 0.00 36.38 35.08 2jhg s VAL 151 CO 0.10 0.44 -0.13 0.68 0.00 0.00 0.00 175.10 176.19 2jhg s VAL 152 N 0.44 1.30 0.50 2.92 -7.23 -0.00 -4.84 120.40 113.48 2jhg s VAL 152 Ca -0.14 -1.81 -0.21 0.00 -1.81 0.00 0.00 61.98 58.01 2jhg s VAL 152 Cb -0.16 -1.61 -0.07 0.00 0.56 0.00 0.00 36.38 35.11 2jhg s VAL 152 CO 0.05 -0.50 1.16 -1.81 -0.31 0.00 0.00 175.10 173.69 2jhg s ASP 153 N -2.64 5.95 0.35 4.85 1.01 -1.26 -0.43 116.67 124.49 2jhg s ASP 153 Ca 0.11 2.27 0.06 0.00 0.71 0.00 0.00 52.55 55.70 2jhg s ASP 153 Cb -0.03 -2.59 0.74 0.00 1.01 0.00 0.00 42.92 42.04 2jhg s ASP 153 CO 0.03 -1.07 1.92 -0.08 0.21 0.00 0.00 175.17 176.18 2jhg h GLU 154 N 1.67 0.75 0.00 8.23 4.81 -1.51 0.82 114.58 129.35 2jhg h GLU 154 Ca -0.50 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.69 2jhg h GLU 154 Cb 1.26 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 30.47 2jhg h GLU 154 CO 0.59 0.50 0.00 0.44 -0.73 0.00 0.00 179.01 179.80 2jhg n ILE 155 N -4.51 0.81 -1.41 2.32 -5.35 -1.26 -2.51 119.36 107.45 2jhg n ILE 155 Ca 0.14 0.20 0.01 0.00 -0.27 0.00 0.00 62.75 62.83 2jhg n ILE 155 Cb 0.31 -1.00 0.20 0.00 -1.74 0.00 0.00 39.64 37.42 2jhg n ILE 155 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 2jhg n SER 156 N -1.34 2.42 -3.84 7.28 7.64 0.28 -1.24 113.62 124.83 2jhg n SER 156 Ca 0.05 -3.67 -0.12 0.00 1.01 0.00 0.00 58.87 56.14 2jhg n SER 156 Cb 0.11 -0.58 -0.12 0.00 -1.01 0.00 0.00 64.21 62.60 2jhg n SER 156 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2jhg s VAL 157 N -3.17 0.01 -0.05 0.44 0.11 -1.04 -0.35 120.40 116.35 2jhg s VAL 157 Ca 0.42 -0.12 0.05 0.00 -2.93 0.00 0.00 61.98 59.40 2jhg s VAL 157 Cb 0.38 -0.22 -0.01 0.00 -1.53 0.00 0.00 36.38 35.01 2jhg s VAL 157 CO -0.01 -0.07 -0.21 0.00 -3.33 0.00 0.00 175.10 171.49 2jhg s ALA 158 N -0.17 1.83 0.19 1.54 0.00 -0.70 -4.93 121.76 119.53 2jhg s ALA 158 Ca -0.02 -0.85 -0.30 0.00 0.00 0.00 0.00 51.96 50.78 2jhg s ALA 158 Cb -0.02 -0.60 -0.08 0.00 0.00 0.00 0.00 23.12 22.42 2jhg s ALA 158 CO 0.00 0.33 1.11 0.21 0.00 0.00 0.00 175.76 177.41 2jhg s LYS 159 N -0.01 4.60 0.33 0.00 2.20 -1.26 -1.46 119.74 124.13 2jhg s LYS 159 Ca -0.05 1.74 0.04 0.00 -0.36 0.00 0.00 55.97 57.34 2jhg s LYS 159 Cb -0.13 -3.26 -0.07 0.00 -1.51 0.00 0.00 37.83 32.86 2jhg s LYS 159 CO 0.03 0.09 0.04 0.96 -0.36 0.00 0.00 175.35 176.11 2jhg s ILE 160 N -0.37 1.35 0.14 5.43 -4.36 -0.42 -4.58 121.20 118.40 2jhg s ILE 160 Ca 0.49 -2.01 -0.35 0.00 -0.26 0.00 0.00 60.65 58.52 2jhg s ILE 160 Cb -0.30 -2.79 -0.15 0.00 1.25 0.00 0.00 42.46 40.46 2jhg s ILE 160 CO 0.36 -0.03 1.36 -0.67 0.24 0.00 0.00 174.94 176.20 2jhg n ASP 161 N -0.72 2.02 0.33 4.36 -0.08 -1.26 -4.45 116.55 116.74 2jhg n ASP 161 Ca -0.03 1.12 0.21 0.00 -1.51 0.00 0.00 54.79 54.58 2jhg n ASP 161 Cb 0.66 -1.28 1.13 0.00 2.34 0.00 0.00 41.12 43.98 2jhg n ASP 161 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2jhg h ALA 162 N 4.53 1.14 -0.43 -1.67 0.00 -1.99 -1.71 119.26 119.14 2jhg h ALA 162 Ca -0.46 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.45 2jhg h ALA 162 Cb 1.31 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.10 2jhg h ALA 162 CO 0.78 0.00 0.00 0.00 0.00 0.00 0.00 179.25 180.03 2jhg n ALA 163 N -2.15 2.44 -1.80 0.00 0.00 -1.26 -4.94 120.51 112.80 2jhg n ALA 163 Ca -0.03 -0.87 -0.35 0.00 0.00 0.00 0.00 53.44 52.19 2jhg n ALA 163 Cb 0.08 -0.97 -0.06 0.00 0.00 0.00 0.00 19.45 18.50 2jhg n ALA 163 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2jhg s SER 164 N -1.23 7.10 -0.60 0.00 1.04 -0.64 -4.95 113.70 114.41 2jhg s SER 164 Ca 0.36 1.79 -0.26 0.00 0.48 0.00 0.00 55.95 58.31 2jhg s SER 164 Cb 0.19 -2.56 0.04 0.00 0.10 0.00 0.00 66.02 63.79 2jhg s SER 164 CO 0.27 -0.24 1.10 -2.16 0.98 0.00 0.00 173.24 173.19 2jhg s PRO 165 N -2.61 3.36 0.49 4.02 0.04 -1.26 -4.90 135.00 134.14 2jhg s PRO 165 Ca 0.56 -0.10 0.25 0.00 0.04 0.00 0.00 61.00 61.75 2jhg s PRO 165 Cb -0.14 -4.07 1.27 0.00 0.04 0.00 0.00 34.50 31.59 2jhg s PRO 165 CO 0.19 -1.71 2.00 -0.07 0.04 0.00 0.00 177.00 177.46 2jhg h LEU 166 N 11.74 0.00 -0.00 -3.56 3.38 -1.97 -0.94 115.31 123.97 2jhg h LEU 166 Ca -0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.71 2jhg h LEU 166 Cb 1.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.81 2jhg h LEU 166 CO 1.17 0.16 0.00 -0.62 0.09 0.00 0.00 178.44 179.24 2jhg n GLU 167 N -3.66 0.00 -0.08 1.13 4.71 -1.26 -2.47 120.64 119.01 2jhg n GLU 167 Ca -0.01 0.22 -0.17 0.00 -0.01 0.00 0.00 57.16 57.18 2jhg n GLU 167 Cb 0.29 -1.50 -0.06 0.00 -1.01 0.00 0.00 31.44 29.16 2jhg n GLU 167 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 2jhg n LYS 168 N -1.50 0.34 0.04 3.49 5.02 -0.56 -4.75 118.16 120.25 2jhg n LYS 168 Ca 0.04 0.15 0.10 0.00 -2.02 0.00 0.00 58.31 56.57 2jhg n LYS 168 Cb 0.19 -1.07 0.40 0.00 -0.02 0.00 0.00 35.03 34.54 2jhg n LYS 168 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 2jhg n VAL 169 N -3.73 0.81 -0.26 -0.18 0.24 -0.47 -2.24 118.33 112.50 2jhg n VAL 169 Ca -0.31 0.18 0.29 0.00 -2.04 0.00 0.00 64.34 62.46 2jhg n VAL 169 Cb 0.71 -0.96 0.67 0.00 -1.47 0.00 0.00 33.84 32.79 2jhg n VAL 169 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2jhg h LEU 171 N 0.12 0.00 -1.94 0.00 3.38 -1.77 -0.53 115.31 114.57 2jhg h LEU 171 Ca 0.51 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.47 2jhg h LEU 171 Cb 1.81 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.56 2jhg h LEU 171 CO -0.08 0.07 -0.05 0.40 0.09 0.00 0.00 178.44 178.86 2jhg h ILE 172 N 0.00 0.21 0.00 1.22 2.04 -1.17 -1.91 117.51 117.90 2jhg h ILE 172 Ca -0.00 -0.44 0.00 0.00 1.00 0.00 0.00 64.86 65.42 2jhg h ILE 172 Cb 0.37 1.36 0.00 0.00 -0.74 0.00 0.00 36.82 37.81 2jhg h ILE 172 CO 0.01 0.05 0.00 1.23 0.00 0.00 0.00 178.15 179.44 2jhg h GLY 173 N 1.20 0.00 0.00 5.37 0.00 -1.19 -3.39 103.07 105.06 2jhg h GLY 173 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2jhg h GLY 173 CO 0.01 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.55 2jhg h GLY 175 N 0.00 0.79 0.81 0.00 0.00 -1.81 -0.96 103.07 101.90 2jhg h GLY 175 Ca 0.00 -0.67 -0.01 0.00 0.00 0.00 0.00 47.33 46.66 2jhg h GLY 175 CO 0.00 0.61 -0.07 -2.75 0.00 0.00 0.00 176.54 174.33 2jhg h PHE 176 N 0.52 -0.17 -0.77 5.60 3.57 -1.65 -2.24 116.94 121.81 2jhg h PHE 176 Ca 0.09 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.56 2jhg h PHE 176 Cb 0.64 0.06 -0.04 0.00 2.79 0.00 0.00 35.95 39.40 2jhg h PHE 176 CO 0.05 0.05 0.38 0.77 -2.23 0.00 0.00 178.31 177.33 2jhg h SER 177 N -0.38 1.00 0.33 0.41 0.02 -1.67 0.01 113.55 113.27 2jhg h SER 177 Ca -0.02 -0.13 -0.00 0.00 -0.84 0.00 0.00 61.79 60.80 2jhg h SER 177 Cb 0.30 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.57 2jhg h SER 177 CO 0.03 0.85 -0.29 0.74 -1.14 0.00 0.00 176.83 177.02 2jhg h THR 178 N 1.08 0.39 -0.22 -2.27 2.02 -1.16 -0.11 112.91 112.64 2jhg h THR 178 Ca 0.26 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.38 2jhg h THR 178 Cb 0.11 0.39 -0.01 0.00 -1.74 0.00 0.00 68.15 66.90 2jhg h THR 178 CO -0.03 0.00 -0.10 1.23 0.37 0.00 0.00 175.52 176.99 2jhg h GLY 179 N -0.64 0.49 0.96 2.16 0.00 -0.99 -0.96 103.07 104.08 2jhg h GLY 179 Ca -0.02 -0.44 -0.00 0.00 0.00 0.00 0.00 47.33 46.87 2jhg h GLY 179 CO -0.03 0.40 0.02 -1.82 0.00 0.00 0.00 176.54 175.10 2jhg h TYR 180 N 0.16 0.05 -0.44 5.60 3.20 -0.93 -2.59 116.97 122.02 2jhg h TYR 180 Ca 0.05 -0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.86 2jhg h TYR 180 Cb 0.59 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.82 2jhg h TYR 180 CO 0.06 0.08 0.02 0.78 -1.64 0.00 0.00 178.16 177.46 2jhg h GLY 181 N 0.01 0.75 0.58 1.82 0.00 -1.04 -0.87 103.07 104.32 2jhg h GLY 181 Ca 0.01 -0.47 0.12 0.00 0.00 0.00 0.00 47.33 46.99 2jhg h GLY 181 CO -0.00 0.44 0.60 1.76 0.00 0.00 0.00 176.54 179.34 2jhg h SER 182 N 0.66 0.83 0.13 0.19 0.02 -0.79 0.14 113.55 114.74 2jhg h SER 182 Ca 0.14 0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 61.12 2jhg h SER 182 Cb 0.38 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.79 2jhg h SER 182 CO 0.01 0.46 -0.06 0.00 -1.14 0.00 0.00 176.83 176.10 2jhg h ALA 183 N 1.55 -0.18 0.00 3.77 0.00 -1.16 -0.29 119.26 122.96 2jhg h ALA 183 Ca 0.46 -0.23 -0.10 0.00 0.00 0.00 0.00 54.91 55.04 2jhg h ALA 183 Cb 0.50 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 2jhg h ALA 183 CO -0.22 -0.23 -0.81 0.28 0.00 0.00 0.00 179.25 178.27 2jhg h VAL 184 N -0.91 0.52 0.00 0.00 2.07 -0.99 -1.54 116.25 115.40 2jhg h VAL 184 Ca -0.02 -1.83 -0.20 0.00 0.82 0.00 0.00 66.70 65.47 2jhg h VAL 184 Cb 0.51 2.11 -0.03 0.00 -1.52 0.00 0.00 31.29 32.36 2jhg h VAL 184 CO 0.03 0.30 -1.70 1.17 0.02 0.00 0.00 177.57 177.39 2jhg n LYS 185 N -3.02 0.28 -0.06 1.57 4.81 0.37 -4.11 118.16 118.01 2jhg n LYS 185 Ca -0.02 0.10 -0.04 0.00 -0.87 0.00 0.00 58.31 57.48 2jhg n LYS 185 Cb 0.72 -1.09 -0.02 0.00 0.02 0.00 0.00 35.03 34.66 2jhg n LYS 185 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 2jhg h VAL 186 N -0.24 0.26 -0.05 3.15 2.07 -1.26 -3.37 116.25 116.81 2jhg h VAL 186 Ca -0.30 -1.21 -0.16 0.00 0.82 0.00 0.00 66.70 65.85 2jhg h VAL 186 Cb 1.35 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 31.61 2jhg h VAL 186 CO -0.12 0.09 -0.69 0.00 0.02 0.00 0.00 177.57 176.86 2jhg h ALA 187 N -0.86 0.74 -5.84 1.67 0.00 -1.15 -3.48 119.26 110.34 2jhg h ALA 187 Ca -0.01 -0.60 -0.35 0.00 0.00 0.00 0.00 54.91 53.95 2jhg h ALA 187 Cb 0.28 -0.08 0.13 0.00 0.00 0.00 0.00 17.79 18.12 2jhg h ALA 187 CO -0.01 0.78 -0.88 1.63 0.00 0.00 0.00 179.25 180.77 2jhg n LYS 188 N -3.81 -2.54 -1.63 0.00 5.02 -0.64 -4.90 118.16 109.66 2jhg n LYS 188 Ca -0.03 0.68 -0.45 0.00 -2.02 0.00 0.00 58.31 56.49 2jhg n LYS 188 Cb 0.68 -5.11 -0.02 0.00 -0.02 0.00 0.00 35.03 30.55 2jhg n LYS 188 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2jhg n VAL 189 N -3.79 1.40 -4.03 -0.18 0.31 -0.81 -4.96 118.33 106.27 2jhg n VAL 189 Ca -0.13 -0.35 -0.25 0.00 -0.01 0.00 0.00 64.34 63.60 2jhg n VAL 189 Cb 0.62 -1.19 -0.04 0.00 -0.91 0.00 0.00 33.84 32.32 2jhg n VAL 189 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 2jhg s THR 190 N -0.54 4.83 0.23 2.52 -4.23 -1.26 -4.85 115.64 112.34 2jhg s THR 190 Ca 0.65 -0.99 -0.31 0.00 -1.18 0.00 0.00 61.69 59.86 2jhg s THR 190 Cb -0.70 -3.51 -0.12 0.00 1.34 0.00 0.00 72.50 69.51 2jhg s THR 190 CO 0.55 -0.16 1.67 -1.10 -0.54 0.00 0.00 174.62 175.05 2jhg s GLN 191 N -3.33 4.13 0.00 3.99 -0.21 -1.18 -2.37 119.66 120.68 2jhg s GLN 191 Ca 0.33 2.59 0.00 0.00 0.02 0.00 0.00 55.36 58.29 2jhg s GLN 191 Cb -0.10 -3.06 0.00 0.00 1.00 0.00 0.00 33.01 30.85 2jhg s GLN 191 CO 0.26 -0.71 0.00 0.41 -2.12 0.00 0.00 175.29 173.13 2jhg n GLY 192 N 3.38 0.91 3.88 3.09 0.00 0.42 -4.91 105.19 111.95 2jhg n GLY 192 Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 2jhg n GLY 192 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2jhg s SER 193 N -3.02 4.54 -0.19 1.61 1.04 -1.00 -4.06 113.70 112.62 2jhg s SER 193 Ca 0.00 0.90 -0.04 0.00 0.48 0.00 0.00 55.95 57.28 2jhg s SER 193 Cb 0.00 -1.47 -0.02 0.00 0.10 0.00 0.00 66.02 64.63 2jhg s SER 193 CO 0.00 -1.90 -0.02 -0.89 0.98 0.00 0.00 173.24 171.42 2jhg s THR 194 N -3.48 3.86 0.11 2.02 2.01 -1.26 -0.46 115.64 118.44 2jhg s THR 194 Ca 0.61 -0.35 0.09 0.00 0.31 0.00 0.00 61.69 62.35 2jhg s THR 194 Cb -0.12 -2.73 -0.04 0.00 0.01 0.00 0.00 72.50 69.63 2jhg s THR 194 CO 0.50 0.45 -0.19 0.00 -0.69 0.00 0.00 174.62 174.69 2jhg s ALA 196 N -1.10 1.61 -0.25 0.00 0.00 -0.18 -0.33 121.76 121.50 2jhg s ALA 196 Ca 0.17 -0.65 0.02 0.00 0.00 0.00 0.00 51.96 51.50 2jhg s ALA 196 Cb -0.11 -0.72 0.05 0.00 0.00 0.00 0.00 23.12 22.34 2jhg s ALA 196 CO 0.09 0.07 -0.10 0.08 0.00 0.00 0.00 175.76 175.89 2jhg s VAL 197 N 0.74 2.35 -0.35 0.00 1.01 0.21 -1.13 120.40 123.23 2jhg s VAL 197 Ca -0.12 -1.44 -0.19 0.00 0.00 0.00 0.00 61.98 60.23 2jhg s VAL 197 Cb -0.16 -2.30 -0.00 0.00 0.00 0.00 0.00 36.38 33.92 2jhg s VAL 197 CO 0.03 0.06 0.57 -0.36 0.00 0.00 0.00 175.10 175.40 2jhg s PHE 198 N 1.17 3.17 0.00 5.22 0.40 0.02 -0.57 117.98 127.39 2jhg s PHE 198 Ca -0.05 0.25 0.00 0.00 -0.60 0.00 0.00 56.93 56.52 2jhg s PHE 198 Cb -0.19 -3.02 0.00 0.00 0.51 0.00 0.00 43.02 40.33 2jhg s PHE 198 CO -0.05 -0.58 0.00 0.41 0.70 0.00 0.00 175.22 175.70 2jhg n GLY 199 N 4.74 1.27 1.81 4.36 0.00 0.04 0.01 105.19 117.42 2jhg n GLY 199 Ca -0.03 -1.18 -0.20 0.00 0.00 0.00 0.00 46.02 44.60 2jhg n GLY 199 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2jhg n LEU 200 N 0.00 4.91 0.00 0.99 4.77 -1.26 -4.01 117.00 122.40 2jhg n LEU 200 Ca 0.00 -4.51 0.00 0.00 -0.03 0.00 0.00 56.01 51.47 2jhg n LEU 200 Cb 0.00 -0.46 0.00 0.00 -2.33 0.00 0.00 43.42 40.63 2jhg n LEU 200 CO 0.00 1.88 0.00 0.61 -1.33 0.00 0.00 177.39 178.55 2jhg n GLY 201 N -0.82 -0.63 0.30 -0.72 0.00 -1.26 -4.60 105.19 97.45 2jhg n GLY 201 Ca 0.42 -1.70 -0.00 0.00 0.00 0.00 0.00 46.02 44.75 2jhg n GLY 201 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2jhg h GLY 202 N 0.00 1.18 0.76 -0.02 0.00 -1.92 0.15 103.07 103.22 2jhg h GLY 202 Ca 0.00 -0.34 -0.05 0.00 0.00 0.00 0.00 47.33 46.93 2jhg h GLY 202 CO 0.00 0.23 -0.11 -2.08 0.00 0.00 0.00 176.54 174.58 2jhg h VAL 203 N 0.87 1.33 -0.68 4.60 2.07 -1.93 -2.57 116.25 119.94 2jhg h VAL 203 Ca 0.35 -1.22 -0.04 0.00 0.82 0.00 0.00 66.70 66.61 2jhg h VAL 203 Cb 0.17 1.78 -0.03 0.00 -1.52 0.00 0.00 31.29 31.69 2jhg h VAL 203 CO -0.17 0.36 0.27 1.23 0.02 0.00 0.00 177.57 179.27 2jhg h GLY 204 N 0.01 1.08 1.50 2.17 0.00 -1.57 -0.39 103.07 105.86 2jhg h GLY 204 Ca 0.03 -0.57 -0.03 0.00 0.00 0.00 0.00 47.33 46.77 2jhg h GLY 204 CO 0.03 0.54 0.18 1.41 0.00 0.00 0.00 176.54 178.69 2jhg h LEU 205 N 0.98 0.59 -0.74 3.11 3.38 -0.73 -0.85 115.31 121.05 2jhg h LEU 205 Ca 0.23 -0.07 -0.13 0.00 0.09 0.00 0.00 57.88 58.00 2jhg h LEU 205 Cb 0.19 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 2jhg h LEU 205 CO -0.02 0.54 -0.51 0.28 0.09 0.00 0.00 178.44 178.82 2jhg h SER 206 N 0.64 0.34 -0.24 -0.43 0.02 -0.92 -0.76 113.55 112.21 2jhg h SER 206 Ca 0.16 -0.17 -0.00 0.00 -0.84 0.00 0.00 61.79 60.94 2jhg h SER 206 Cb 0.14 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.57 2jhg h SER 206 CO -0.01 0.79 0.15 0.58 -1.14 0.00 0.00 176.83 177.19 2jhg h VAL 207 N 0.25 1.08 -0.53 2.27 2.07 -0.57 -1.35 116.25 119.47 2jhg h VAL 207 Ca 0.01 -0.18 0.04 0.00 0.82 0.00 0.00 66.70 67.39 2jhg h VAL 207 Cb 0.98 0.78 -0.04 0.00 -1.52 0.00 0.00 31.29 31.49 2jhg h VAL 207 CO 0.08 0.08 0.28 0.40 0.02 0.00 0.00 177.57 178.43 2jhg h ILE 208 N 0.30 0.97 -0.85 4.57 2.04 -0.87 0.59 117.51 124.25 2jhg h ILE 208 Ca 0.09 -0.18 0.07 0.00 1.00 0.00 0.00 64.86 65.84 2jhg h ILE 208 Cb 0.00 0.39 -0.07 0.00 -0.74 0.00 0.00 36.82 36.40 2jhg h ILE 208 CO -0.02 0.10 0.51 0.24 0.00 0.00 0.00 178.15 178.99 2jhg h MET 209 N 0.54 0.88 -0.50 2.37 2.86 -0.78 -0.42 114.93 119.87 2jhg h MET 209 Ca 0.23 -0.05 -0.08 0.00 -2.06 0.00 0.00 59.70 57.74 2jhg h MET 209 Cb 0.13 -0.20 -0.02 0.00 0.06 0.00 0.00 31.60 31.57 2jhg h MET 209 CO -0.15 0.58 0.02 0.78 1.06 0.00 0.00 176.91 179.20 2jhg h GLY 210 N 0.91 0.95 1.02 8.32 0.00 -0.36 -0.71 103.07 113.20 2jhg h GLY 210 Ca 0.39 -0.68 -0.03 0.00 0.00 0.00 0.00 47.33 47.01 2jhg h GLY 210 CO -0.20 0.63 0.40 0.00 0.00 0.00 0.00 176.54 177.37 2jhg h LYS 212 N 1.13 0.54 -0.46 0.00 3.64 -0.95 -1.62 116.57 118.86 2jhg h LYS 212 Ca 0.28 -0.13 0.04 0.00 -1.27 0.00 0.00 60.65 59.56 2jhg h LYS 212 Cb 0.09 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.82 2jhg h LYS 212 CO -0.04 0.60 0.30 0.00 -2.27 0.00 0.00 179.45 178.05 2jhg h ALA 213 N 0.92 1.83 -0.00 5.00 0.00 -0.77 -0.82 119.26 125.42 2jhg h ALA 213 Ca 0.11 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2jhg h ALA 213 Cb 0.30 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2jhg h ALA 213 CO 0.00 0.11 -0.00 0.00 0.00 0.00 0.00 179.25 179.36 2jhg n ALA 214 N -2.49 2.49 -0.79 0.00 0.00 -0.38 -4.92 120.51 114.42 2jhg n ALA 214 Ca 0.05 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.35 2jhg n ALA 214 Cb 0.17 -1.49 0.00 0.00 0.00 0.00 0.00 19.45 18.13 2jhg n ALA 214 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jhg n GLY 215 N 1.28 0.69 3.71 0.00 0.00 -0.31 -3.11 105.19 107.46 2jhg n GLY 215 Ca 0.14 -0.67 -0.40 0.00 0.00 0.00 0.00 46.02 45.09 2jhg n GLY 215 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jhg n ALA 216 N -0.31 1.45 0.09 4.61 0.00 -0.64 -0.43 120.51 125.28 2jhg n ALA 216 Ca 0.00 0.25 -0.16 0.00 0.00 0.00 0.00 53.44 53.53 2jhg n ALA 216 Cb 0.08 -2.30 -0.14 0.00 0.00 0.00 0.00 19.45 17.09 2jhg n ALA 216 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jhg h ALA 217 N 2.06 0.15 -3.70 0.00 0.00 -0.91 -3.44 119.26 113.42 2jhg h ALA 217 Ca -0.49 -0.94 -0.35 0.00 0.00 0.00 0.00 54.91 53.13 2jhg h ALA 217 Cb 1.29 0.06 -0.31 0.00 0.00 0.00 0.00 17.79 18.83 2jhg h ALA 217 CO 0.60 1.03 -0.76 1.03 0.00 0.00 0.00 179.25 181.14 2jhg s ARG 218 N -2.65 0.53 -0.23 0.00 0.52 -0.96 -4.97 118.95 111.18 2jhg s ARG 218 Ca -0.05 -0.12 -0.03 0.00 -0.52 0.00 0.00 55.73 55.02 2jhg s ARG 218 Cb 0.07 -0.55 0.07 0.00 0.52 0.00 0.00 34.95 35.06 2jhg s ARG 218 CO 0.87 0.01 0.07 0.42 0.02 0.00 0.00 175.30 176.70 2jhg s ILE 219 N 0.39 0.46 -0.38 1.52 1.01 -1.26 -0.77 121.20 122.17 2jhg s ILE 219 Ca -0.04 -0.74 -0.15 0.00 0.00 0.00 0.00 60.65 59.72 2jhg s ILE 219 Cb -0.08 -1.13 0.00 0.00 0.01 0.00 0.00 42.46 41.27 2jhg s ILE 219 CO -0.00 -0.40 0.32 -0.63 0.00 0.00 0.00 174.94 174.23 2jhg s ILE 220 N 1.86 5.22 0.21 2.92 1.01 0.55 -0.56 121.20 132.42 2jhg s ILE 220 Ca 0.03 -0.31 -0.22 0.00 0.00 0.00 0.00 60.65 60.14 2jhg s ILE 220 Cb -0.17 -3.86 -0.08 0.00 0.01 0.00 0.00 42.46 38.36 2jhg s ILE 220 CO -0.16 -0.19 0.76 -0.83 0.00 0.00 0.00 174.94 174.52 2jhg s GLY 221 N 1.73 2.74 -0.12 6.18 0.00 -0.19 -0.62 107.32 117.04 2jhg s GLY 221 Ca 0.08 0.27 -0.00 0.00 0.00 0.00 0.00 44.72 45.07 2jhg s GLY 221 CO 0.11 0.69 -0.08 0.14 0.00 0.00 0.00 173.10 173.96 2jhg s VAL 222 N -1.39 1.07 -0.07 1.40 1.01 0.26 -0.71 120.40 121.97 2jhg s VAL 222 Ca 0.41 -0.32 -0.24 0.00 0.00 0.00 0.00 61.98 61.83 2jhg s VAL 222 Cb -0.19 -1.08 0.05 0.00 0.00 0.00 0.00 36.38 35.16 2jhg s VAL 222 CO 0.23 0.37 0.54 -0.62 0.00 0.00 0.00 175.10 175.63 2jhg s ASP 223 N 1.69 -0.50 0.00 3.32 -1.08 -0.93 -0.78 116.67 118.39 2jhg s ASP 223 Ca 0.05 0.60 0.29 0.00 -0.52 0.00 0.00 52.55 52.96 2jhg s ASP 223 Cb -0.13 0.58 1.21 0.00 -1.46 0.00 0.00 42.92 43.13 2jhg s ASP 223 CO -0.08 -0.48 1.87 2.30 0.52 0.00 0.00 175.17 179.29 2jhg n ILE 224 N 1.38 0.00 -3.60 4.11 -5.35 -1.26 -4.03 119.36 110.61 2jhg n ILE 224 Ca -0.19 -0.02 -0.40 0.00 -0.27 0.00 0.00 62.75 61.87 2jhg n ILE 224 Cb 0.56 -0.24 -0.09 0.00 -1.74 0.00 0.00 39.64 38.13 2jhg n ILE 224 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 2jhg s ASN 225 N -2.69 5.61 0.35 7.28 3.84 -1.26 -4.94 114.94 123.13 2jhg s ASN 225 Ca 0.23 -1.87 0.26 0.00 0.21 0.00 0.00 52.86 51.69 2jhg s ASN 225 Cb 0.20 -1.98 1.21 0.00 -0.55 0.00 0.00 41.25 40.13 2jhg s ASN 225 CO 0.51 -0.64 1.78 0.07 -2.79 0.00 0.00 177.10 176.03 2jhg h LYS 226 N 8.38 0.00 0.00 0.43 2.10 -1.99 -1.37 116.57 124.12 2jhg h LYS 226 Ca -0.20 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.45 2jhg h LYS 226 Cb 1.07 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.40 2jhg h LYS 226 CO 0.82 0.00 0.00 -0.44 -2.00 0.00 0.00 179.45 177.83 2jhg h ASP 227 N 0.00 0.00 1.22 7.07 3.32 -1.97 -2.20 116.42 123.86 2jhg h ASP 227 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2jhg h ASP 227 Cb 0.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.78 2jhg h ASP 227 CO 0.00 0.00 -0.10 0.29 -1.72 0.00 0.00 179.24 177.71 2jhg n LYS 228 N -2.42 0.18 -0.12 3.56 4.76 -0.52 -4.26 118.16 119.34 2jhg n LYS 228 Ca -0.00 0.13 -0.12 0.00 -2.87 0.00 0.00 58.31 55.45 2jhg n LYS 228 Cb 0.13 -1.69 0.01 0.00 -1.84 0.00 0.00 35.03 31.64 2jhg n LYS 228 CO 0.00 0.00 0.00 0.74 -1.37 0.00 0.00 177.40 176.77 2jhg h PHE 229 N 0.00 1.07 -0.21 2.13 0.04 -1.58 -2.79 116.94 115.59 2jhg h PHE 229 Ca 0.00 -0.30 -0.00 0.00 2.80 0.00 0.00 57.97 60.47 2jhg h PHE 229 Cb 0.66 -0.23 -0.01 0.00 2.20 0.00 0.00 35.95 38.56 2jhg h PHE 229 CO 0.00 1.10 0.12 0.00 -0.60 0.00 0.00 178.31 178.94 2jhg h ALA 230 N 0.86 0.27 -0.42 2.45 0.00 -1.78 -0.62 119.26 120.02 2jhg h ALA 230 Ca 0.08 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 2jhg h ALA 230 Cb 0.90 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 2jhg h ALA 230 CO 0.08 -0.22 -0.10 -0.22 0.00 0.00 0.00 179.25 178.79 2jhg h LYS 231 N 0.25 0.74 -0.60 0.00 1.63 -1.83 -1.35 116.57 115.41 2jhg h LYS 231 Ca 0.07 -0.24 0.02 0.00 -0.85 0.00 0.00 60.65 59.66 2jhg h LYS 231 Cb 0.03 -0.07 -0.04 0.00 -0.60 0.00 0.00 32.23 31.56 2jhg h LYS 231 CO -0.01 0.82 0.38 0.00 -3.45 0.00 0.00 179.45 177.19 2jhg h ALA 232 N 1.21 0.78 -0.67 5.00 0.00 -1.14 -1.76 119.26 122.68 2jhg h ALA 232 Ca 0.12 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 2jhg h ALA 232 Cb 0.56 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 2jhg h ALA 232 CO 0.03 0.15 0.29 0.87 0.00 0.00 0.00 179.25 180.59 2jhg h LYS 233 N 0.77 0.99 -0.78 0.00 1.57 -0.84 -0.18 116.57 118.09 2jhg h LYS 233 Ca 0.23 -0.17 0.09 0.00 -1.87 0.00 0.00 60.65 58.94 2jhg h LYS 233 Cb -0.03 -0.17 -0.05 0.00 0.08 0.00 0.00 32.23 32.06 2jhg h LYS 233 CO -0.08 0.81 0.51 1.49 -0.57 0.00 0.00 179.45 181.61 2jhg h GLU 234 N 0.94 0.70 -0.02 3.15 4.81 -0.50 -2.31 114.58 121.35 2jhg h GLU 234 Ca 0.23 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.41 2jhg h GLU 234 Cb 0.17 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.39 2jhg h GLU 234 CO -0.02 0.46 -0.02 1.33 -0.73 0.00 0.00 179.01 180.03 2jhg n VAL 235 N -4.50 0.00 0.00 0.32 0.24 -0.73 -4.92 118.33 108.73 2jhg n VAL 235 Ca 0.13 -0.33 0.00 0.00 -2.04 0.00 0.00 64.34 62.10 2jhg n VAL 235 Cb 0.32 0.84 0.00 0.00 -1.47 0.00 0.00 33.84 33.53 2jhg n VAL 235 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2jhg n GLY 236 N 1.25 0.17 3.76 7.63 0.00 -0.87 -4.32 105.19 112.80 2jhg n GLY 236 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 2jhg n GLY 236 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jhg s ALA 237 N -0.08 3.61 -0.38 4.61 0.00 -0.13 -4.65 121.76 124.74 2jhg s ALA 237 Ca 0.00 1.43 0.23 0.00 0.00 0.00 0.00 51.96 53.62 2jhg s ALA 237 Cb 0.00 -3.57 -0.01 0.00 0.00 0.00 0.00 23.12 19.54 2jhg s ALA 237 CO 0.00 -0.85 0.97 0.25 0.00 0.00 0.00 175.76 176.12 2jhg n THR 238 N 1.45 0.33 -3.54 0.00 -2.24 0.28 -4.38 114.28 106.18 2jhg n THR 238 Ca 0.04 -0.40 -0.18 0.00 -2.27 0.00 0.00 64.05 61.24 2jhg n THR 238 Cb 0.40 -0.06 -0.06 0.00 -2.10 0.00 0.00 70.33 68.51 2jhg n THR 238 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2jhg s GLU 239 N -3.31 1.03 0.02 -0.78 2.02 -1.20 -4.99 118.70 111.49 2jhg s GLU 239 Ca 0.00 0.24 0.03 0.00 0.02 0.00 0.00 54.97 55.26 2jhg s GLU 239 Cb 0.12 0.49 -0.01 0.00 0.10 0.00 0.00 34.13 34.83 2jhg s GLU 239 CO 0.81 -0.32 -0.10 0.00 0.02 0.00 0.00 175.26 175.67 2jhg s VAL 241 N -0.59 0.87 -0.31 0.00 -7.23 0.11 -4.95 120.40 108.30 2jhg s VAL 241 Ca 0.00 -0.51 -0.07 0.00 -1.81 0.00 0.00 61.98 59.59 2jhg s VAL 241 Cb -0.06 -0.74 0.02 0.00 0.56 0.00 0.00 36.38 36.16 2jhg s VAL 241 CO 0.00 0.22 0.10 0.21 -0.31 0.00 0.00 175.10 175.32 2jhg s ASN 242 N -0.34 5.27 0.55 4.85 3.84 -1.26 -2.19 114.94 125.66 2jhg s ASN 242 Ca 0.04 -0.82 0.29 0.00 0.21 0.00 0.00 52.86 52.58 2jhg s ASN 242 Cb -0.05 -1.90 1.46 0.00 -0.55 0.00 0.00 41.25 40.21 2jhg s ASN 242 CO -0.00 -0.24 1.93 -0.65 -2.79 0.00 0.00 177.10 175.34 2jhg h PRO 243 N 8.26 0.00 0.00 0.43 0.11 -1.95 -0.00 132.00 138.85 2jhg h PRO 243 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 2jhg h PRO 243 Cb 1.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.23 2jhg h PRO 243 CO 0.61 0.00 0.00 1.04 -0.21 0.00 0.00 178.00 179.44 2jhg n GLN 244 N -4.20 0.14 0.00 1.05 6.02 -1.26 -2.36 117.38 116.77 2jhg n GLN 244 Ca 0.14 0.36 0.14 0.00 -0.01 0.00 0.00 57.00 57.63 2jhg n GLN 244 Cb 0.80 -1.76 0.60 0.00 1.02 0.00 0.00 30.24 30.89 2jhg n GLN 244 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 2jhg n ASP 245 N -2.02 0.20 -4.52 1.08 8.00 -0.02 -4.90 116.55 114.38 2jhg n ASP 245 Ca 0.03 -0.05 -0.31 0.00 0.71 0.00 0.00 54.79 55.16 2jhg n ASP 245 Cb 0.22 -0.22 -0.12 0.00 -0.02 0.00 0.00 41.12 40.98 2jhg n ASP 245 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2jhg s TYR 246 N -2.76 2.69 -0.09 1.24 1.51 -0.99 -5.02 117.35 113.92 2jhg s TYR 246 Ca 0.21 -0.17 0.14 0.00 -1.01 0.00 0.00 57.07 56.23 2jhg s TYR 246 Cb 0.19 -1.50 0.04 0.00 -0.11 0.00 0.00 41.96 40.58 2jhg s TYR 246 CO 0.52 0.31 1.43 0.87 -1.11 0.00 0.00 175.55 177.57 2jhg h LYS 247 N 4.41 0.00 -6.22 -0.62 1.57 -1.90 -3.46 116.57 110.34 2jhg h LYS 247 Ca -0.48 0.00 -0.47 0.00 -1.87 0.00 0.00 60.65 57.83 2jhg h LYS 247 Cb 1.16 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.45 2jhg h LYS 247 CO 0.50 0.59 -0.43 -1.59 -0.57 0.00 0.00 179.45 177.95 2jhg s LYS 248 N -2.94 3.21 0.48 3.15 -2.85 -1.26 -5.06 119.74 114.47 2jhg s LYS 248 Ca 0.03 -0.92 -0.24 0.00 -1.00 0.00 0.00 55.97 53.85 2jhg s LYS 248 Cb 0.08 -2.78 -0.07 0.00 -2.06 0.00 0.00 37.83 33.00 2jhg s LYS 248 CO 0.76 0.32 1.40 -2.30 0.10 0.00 0.00 175.35 175.62 2jhg n PRO 249 N -1.41 2.04 0.26 1.78 -0.02 -1.26 -4.83 135.00 131.56 2jhg n PRO 249 Ca -0.06 0.73 0.13 0.00 -2.02 0.00 0.00 63.50 62.28 2jhg n PRO 249 Cb 0.58 -2.60 0.66 0.00 -0.02 0.00 0.00 33.50 32.12 2jhg n PRO 249 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 2jhg h ILE 250 N 1.99 0.45 -0.50 4.25 6.09 -1.96 -1.25 117.51 126.59 2jhg h ILE 250 Ca -0.51 -0.71 -0.03 0.00 -1.37 0.00 0.00 64.86 62.25 2jhg h ILE 250 Cb 1.28 1.49 -0.02 0.00 0.47 0.00 0.00 36.82 40.04 2jhg h ILE 250 CO 0.60 0.13 0.19 0.06 -3.07 0.00 0.00 178.15 176.05 2jhg h GLN 251 N 0.00 0.72 -0.28 2.19 3.07 -1.90 0.49 115.11 119.41 2jhg h GLN 251 Ca -0.00 -0.11 -0.09 0.00 0.09 0.00 0.00 58.65 58.54 2jhg h GLN 251 Cb 0.48 -0.13 -0.01 0.00 0.08 0.00 0.00 27.48 27.91 2jhg h GLN 251 CO 0.02 0.61 -0.17 1.49 0.09 0.00 0.00 178.83 180.86 2jhg h GLU 252 N 0.72 0.61 -0.17 0.06 4.81 -1.60 -1.44 114.58 117.56 2jhg h GLU 252 Ca 0.17 -0.28 0.04 0.00 -0.13 0.00 0.00 59.36 59.15 2jhg h GLU 252 Cb 0.16 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.50 2jhg h GLU 252 CO -0.01 0.87 -0.05 0.28 -0.73 0.00 0.00 179.01 179.37 2jhg h VAL 253 N 0.35 0.82 -0.25 0.32 2.07 -1.08 -0.95 116.25 117.52 2jhg h VAL 253 Ca 0.06 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.49 2jhg h VAL 253 Cb 0.71 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 31.28 2jhg h VAL 253 CO 0.05 0.00 -0.20 -0.07 0.02 0.00 0.00 177.57 177.37 2jhg h LEU 254 N -0.01 0.45 -0.44 2.57 3.38 -0.89 -0.15 115.31 120.23 2jhg h LEU 254 Ca 0.09 -0.14 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 2jhg h LEU 254 Cb 0.14 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 2jhg h LEU 254 CO -0.18 0.67 0.14 0.74 0.09 0.00 0.00 178.44 179.89 2jhg h THR 255 N 0.41 1.22 -0.34 0.22 2.02 -0.96 -1.93 112.91 113.56 2jhg h THR 255 Ca 0.07 -0.72 -0.02 0.00 0.77 0.00 0.00 66.41 66.51 2jhg h THR 255 Cb 0.58 0.86 -0.02 0.00 -1.74 0.00 0.00 68.15 67.84 2jhg h THR 255 CO 0.04 0.26 0.14 1.05 0.37 0.00 0.00 175.52 177.38 2jhg h GLU 256 N 0.58 0.50 -0.41 6.66 -0.00 -0.79 0.52 114.58 121.64 2jhg h GLU 256 Ca 0.14 -0.08 0.00 0.00 -0.00 0.00 0.00 59.36 59.42 2jhg h GLU 256 Cb 0.26 -0.08 -0.02 0.00 -0.00 0.00 0.00 28.75 28.90 2jhg h GLU 256 CO -0.01 0.48 0.26 0.52 -0.00 0.00 0.00 179.01 180.27 2jhg h MET 257 N 0.40 0.54 -0.64 1.06 2.86 -0.85 -1.96 114.93 116.34 2jhg h MET 257 Ca 0.11 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.72 2jhg h MET 257 Cb 0.16 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 31.70 2jhg h MET 257 CO -0.01 0.36 0.00 -1.13 1.06 0.00 0.00 176.91 177.19 2jhg n SER 258 N -4.47 4.54 -3.90 1.22 3.41 -0.74 -4.95 113.62 108.73 2jhg n SER 258 Ca 0.03 -2.48 -0.28 0.00 -0.26 0.00 0.00 58.87 55.88 2jhg n SER 258 Cb 0.06 -0.57 0.02 0.00 -0.26 0.00 0.00 64.21 63.46 2jhg n SER 258 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2jhg n ASN 259 N 0.94 -3.44 0.00 4.04 3.02 -0.74 -3.78 115.26 115.31 2jhg n ASN 259 Ca 0.24 -0.83 0.00 0.00 -0.03 0.00 0.00 54.58 53.96 2jhg n ASN 259 Cb 0.87 -3.75 0.00 0.00 -0.61 0.00 0.00 39.78 36.29 2jhg n ASN 259 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2jhg n GLY 260 N -1.66 1.40 0.00 7.41 0.00 0.13 -5.04 105.19 107.42 2jhg n GLY 260 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 2jhg n GLY 260 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jhg n GLY 261 N 0.00 3.53 3.89 -0.02 0.00 -1.16 -4.52 105.19 106.92 2jhg n GLY 261 Ca 0.00 -1.71 -0.29 0.00 0.00 0.00 0.00 46.02 44.02 2jhg n GLY 261 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2jhg s VAL 262 N -2.08 4.69 0.07 1.61 -7.23 -0.20 -4.26 120.40 113.00 2jhg s VAL 262 Ca 0.00 0.47 -0.16 0.00 -1.81 0.00 0.00 61.98 60.48 2jhg s VAL 262 Cb 0.00 -3.83 -0.13 0.00 0.56 0.00 0.00 36.38 32.99 2jhg s VAL 262 CO 0.00 -0.94 1.34 0.44 -0.31 0.00 0.00 175.10 175.63 2jhg h ASP 263 N -0.06 0.68 -3.58 4.85 3.32 -1.42 0.76 116.42 120.98 2jhg h ASP 263 Ca -0.46 -0.54 -0.32 0.00 0.02 0.00 0.00 57.03 55.73 2jhg h ASP 263 Cb 1.20 -0.20 -0.32 0.00 0.22 0.00 0.00 39.33 40.23 2jhg h ASP 263 CO 0.62 1.10 -0.74 -0.36 -1.72 0.00 0.00 179.24 178.13 2jhg s PHE 264 N -4.07 0.24 0.13 4.55 0.08 -0.97 -1.56 117.98 116.38 2jhg s PHE 264 Ca -0.13 0.01 0.07 0.00 0.12 0.00 0.00 56.93 57.01 2jhg s PHE 264 Cb 0.07 -0.31 -0.04 0.00 -0.57 0.00 0.00 43.02 42.17 2jhg s PHE 264 CO 0.83 -0.09 -0.17 -1.54 -0.10 0.00 0.00 175.22 174.15 2jhg s SER 265 N 0.75 2.34 -0.05 1.36 1.04 -0.06 -1.01 113.70 118.07 2jhg s SER 265 Ca -0.07 -0.79 0.01 0.00 0.48 0.00 0.00 55.95 55.57 2jhg s SER 265 Cb -0.10 -0.11 0.02 0.00 0.10 0.00 0.00 66.02 65.93 2jhg s SER 265 CO -0.01 -0.06 -0.03 -0.36 0.98 0.00 0.00 173.24 173.75 2jhg s PHE 266 N -1.86 0.69 -0.36 5.02 0.40 -0.28 -0.71 117.98 120.88 2jhg s PHE 266 Ca 0.10 -0.18 -0.16 0.00 -0.60 0.00 0.00 56.93 56.09 2jhg s PHE 266 Cb -0.06 -0.66 -0.00 0.00 0.51 0.00 0.00 43.02 42.80 2jhg s PHE 266 CO 0.05 -0.21 0.38 -2.00 0.70 0.00 0.00 175.22 174.14 2jhg s GLU 267 N 1.11 3.46 -0.31 0.44 -6.30 -0.12 -0.80 118.70 116.18 2jhg s GLU 267 Ca -0.08 -0.48 0.13 0.00 -2.50 0.00 0.00 54.97 52.04 2jhg s GLU 267 Cb -0.14 -3.84 0.47 0.00 0.00 0.00 0.00 34.13 30.62 2jhg s GLU 267 CO -0.01 -0.60 1.11 0.28 0.02 0.00 0.00 175.26 176.06 2jhg n VAL 268 N 5.28 1.84 0.07 3.70 0.31 0.10 -0.46 118.33 129.18 2jhg n VAL 268 Ca -0.09 -3.75 0.00 0.00 -0.01 0.00 0.00 64.34 60.50 2jhg n VAL 268 Cb 0.49 -0.09 0.00 0.00 -0.91 0.00 0.00 33.84 33.33 2jhg n VAL 268 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 2jhg n ILE 269 N -0.52 0.80 0.00 2.52 5.41 -1.24 -4.48 119.36 121.85 2jhg n ILE 269 Ca 0.26 0.26 0.00 0.00 1.00 0.00 0.00 62.75 64.27 2jhg n ILE 269 Cb 0.83 -1.23 0.00 0.00 -0.71 0.00 0.00 39.64 38.53 2jhg n ILE 269 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2jhg n GLY 270 N 2.97 0.95 3.15 7.39 0.00 -1.26 -4.45 105.19 113.93 2jhg n GLY 270 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 2jhg n GLY 270 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jhg s ARG 271 N 0.11 1.25 0.23 1.61 0.52 -1.26 -4.36 118.95 117.05 2jhg s ARG 271 Ca 0.00 -0.61 -0.06 0.00 -0.52 0.00 0.00 55.73 54.53 2jhg s ARG 271 Cb 0.00 -1.23 0.22 0.00 0.52 0.00 0.00 34.95 34.46 2jhg s ARG 271 CO 0.00 0.33 1.82 -0.07 0.02 0.00 0.00 175.30 177.41 2jhg h LEU 272 N 5.60 1.08 -0.72 2.53 3.38 -1.98 -1.69 115.31 123.52 2jhg h LEU 272 Ca -0.36 -0.13 -0.07 0.00 0.09 0.00 0.00 57.88 57.40 2jhg h LEU 272 Cb 1.16 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.60 2jhg h LEU 272 CO 0.48 0.92 0.16 -2.24 0.09 0.00 0.00 178.44 177.85 2jhg h ASP 273 N 1.17 1.09 0.83 -0.43 2.03 -1.99 -2.35 116.42 116.78 2jhg h ASP 273 Ca 0.28 -0.24 -0.11 0.00 -0.73 0.00 0.00 57.03 56.23 2jhg h ASP 273 Cb 0.13 -0.29 -0.02 0.00 -0.83 0.00 0.00 39.33 38.33 2jhg h ASP 273 CO -0.03 1.04 -0.52 0.71 -1.03 0.00 0.00 179.24 179.41 2jhg h THR 274 N 1.08 1.14 -0.47 1.15 1.35 -1.93 -0.68 112.91 114.55 2jhg h THR 274 Ca 0.22 -1.93 -0.00 0.00 -0.55 0.00 0.00 66.41 64.15 2jhg h THR 274 Cb 0.39 2.11 -0.02 0.00 -1.73 0.00 0.00 68.15 68.90 2jhg h THR 274 CO 0.00 0.51 0.28 0.24 -0.25 0.00 0.00 175.52 176.30 2jhg h MET 275 N 0.00 0.64 -0.33 4.72 2.86 -0.80 0.58 114.93 122.60 2jhg h MET 275 Ca -0.01 -0.06 -0.16 0.00 -2.06 0.00 0.00 59.70 57.42 2jhg h MET 275 Cb 1.07 -0.13 -0.00 0.00 0.06 0.00 0.00 31.60 32.60 2jhg h MET 275 CO 0.07 0.48 -0.41 0.28 1.06 0.00 0.00 176.91 178.39 2jhg h VAL 276 N 0.63 1.28 -0.45 -2.22 2.07 -1.19 -1.78 116.25 114.58 2jhg h VAL 276 Ca 0.17 -1.58 0.02 0.00 0.82 0.00 0.00 66.70 66.13 2jhg h VAL 276 Cb 0.00 1.52 -0.03 0.00 -1.52 0.00 0.00 31.29 31.26 2jhg h VAL 276 CO -0.03 0.52 0.27 0.74 0.02 0.00 0.00 177.57 179.09 2jhg h THR 277 N 0.65 1.04 -0.78 2.57 2.02 -1.07 -0.77 112.91 116.57 2jhg h THR 277 Ca 0.04 -0.18 -0.05 0.00 0.77 0.00 0.00 66.41 66.99 2jhg h THR 277 Cb 1.00 0.46 -0.03 0.00 -1.74 0.00 0.00 68.15 67.84 2jhg h THR 277 CO 0.10 0.10 0.31 0.00 0.37 0.00 0.00 175.52 176.39 2jhg h ALA 278 N 1.20 1.01 -0.28 6.16 0.00 -0.78 -1.09 119.26 125.48 2jhg h ALA 278 Ca 0.18 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2jhg h ALA 278 Cb 0.02 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 2jhg h ALA 278 CO -0.08 0.64 0.14 1.25 0.00 0.00 0.00 179.25 181.20 2jhg h LEU 279 N 1.13 0.35 -1.59 0.00 5.85 -0.97 -3.08 115.31 117.00 2jhg h LEU 279 Ca 0.26 -0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.86 2jhg h LEU 279 Cb 0.22 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 2jhg h LEU 279 CO -0.02 0.35 0.09 -1.28 -0.34 0.00 0.00 178.44 177.24 2jhg h SER 280 N 0.32 0.32 1.11 1.25 0.87 -0.66 -2.69 113.55 114.07 2jhg h SER 280 Ca 0.10 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.63 2jhg h SER 280 Cb 0.09 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 61.97 2jhg h SER 280 CO -0.01 0.31 0.00 0.00 -0.53 0.00 0.00 176.83 176.59 2jhg n GLN 283 N -0.45 2.38 0.25 0.00 0.00 0.26 -4.63 117.38 115.19 2jhg n GLN 283 Ca 0.07 0.85 0.13 0.00 -0.00 0.00 0.00 57.00 58.04 2jhg n GLN 283 Cb 0.49 -2.55 0.65 0.00 0.00 0.00 0.00 30.24 28.83 2jhg n GLN 283 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.06 178.11 2jhg h GLU 284 N 4.22 0.00 0.00 3.69 4.11 -1.90 0.81 114.58 125.51 2jhg h GLU 284 Ca -0.46 0.00 -0.31 0.00 0.07 0.00 0.00 59.36 58.66 2jhg h GLU 284 Cb 1.25 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.44 2jhg h GLU 284 CO 0.75 0.14 -2.06 0.00 0.07 0.00 0.00 179.01 177.91 2jhg n ALA 285 N -2.24 1.60 -1.15 1.06 0.00 -1.26 -2.42 120.51 116.10 2jhg n ALA 285 Ca -0.01 -1.04 0.00 0.00 0.00 0.00 0.00 53.44 52.39 2jhg n ALA 285 Cb 0.30 -0.50 0.00 0.00 0.00 0.00 0.00 19.45 19.26 2jhg n ALA 285 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 2jhg n TYR 286 N -2.84 0.00 -1.63 0.00 0.18 -1.18 -4.31 117.16 107.39 2jhg n TYR 286 Ca -0.24 0.00 -0.33 0.00 1.88 0.00 0.00 57.90 59.21 2jhg n TYR 286 Cb 1.07 0.01 0.06 0.00 -0.38 0.00 0.00 39.34 40.10 2jhg n TYR 286 CO 0.00 0.00 0.00 0.20 -2.08 0.00 0.00 176.86 174.98 2jhg s GLY 287 N 0.00 2.14 -0.04 -7.48 0.00 0.27 -4.86 107.32 97.34 2jhg s GLY 287 Ca 0.00 0.58 0.03 0.00 0.00 0.00 0.00 44.72 45.33 2jhg s GLY 287 CO 0.00 0.95 -0.12 0.14 0.00 0.00 0.00 173.10 174.06 2jhg s VAL 288 N -2.33 1.09 -0.06 1.40 1.01 -0.60 -1.52 120.40 119.37 2jhg s VAL 288 Ca 0.68 -0.50 0.04 0.00 0.00 0.00 0.00 61.98 62.20 2jhg s VAL 288 Cb -0.22 -0.97 0.00 0.00 0.00 0.00 0.00 36.38 35.20 2jhg s VAL 288 CO 0.44 0.33 -0.18 -0.55 0.00 0.00 0.00 175.10 175.14 2jhg s SER 289 N 0.32 2.31 -0.15 3.32 0.15 0.01 -0.88 113.70 118.79 2jhg s SER 289 Ca -0.07 -0.39 0.00 0.00 0.70 0.00 0.00 55.95 56.19 2jhg s SER 289 Cb -0.12 -0.84 -0.00 0.00 -1.71 0.00 0.00 66.02 63.35 2jhg s SER 289 CO 0.02 0.13 -0.15 -0.69 1.20 0.00 0.00 173.24 173.75 2jhg s VAL 290 N 0.25 2.74 -0.17 4.45 1.01 0.11 -1.13 120.40 127.65 2jhg s VAL 290 Ca -0.10 -0.75 -0.23 0.00 0.00 0.00 0.00 61.98 60.90 2jhg s VAL 290 Cb -0.14 -2.15 -0.02 0.00 0.00 0.00 0.00 36.38 34.07 2jhg s VAL 290 CO 0.04 0.52 0.71 -0.63 0.00 0.00 0.00 175.10 175.74 2jhg s ILE 291 N 0.70 4.98 -0.05 2.22 1.01 0.45 -0.95 121.20 129.55 2jhg s ILE 291 Ca -0.07 1.37 0.01 0.00 0.00 0.00 0.00 60.65 61.96 2jhg s ILE 291 Cb -0.16 -4.02 -0.04 0.00 0.01 0.00 0.00 42.46 38.25 2jhg s ILE 291 CO 0.02 0.10 -0.04 0.52 0.00 0.00 0.00 174.94 175.53 2jhg n VAL 292 N 4.59 0.30 -1.19 2.92 0.31 0.40 -2.89 118.33 122.76 2jhg n VAL 292 Ca 0.01 -0.12 -0.32 0.00 -0.01 0.00 0.00 64.34 63.89 2jhg n VAL 292 Cb 0.50 -0.70 0.11 0.00 -0.91 0.00 0.00 33.84 32.83 2jhg n VAL 292 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 2jhg s GLY 293 N -4.42 1.94 -0.17 2.92 0.00 -0.53 -4.94 107.32 102.12 2jhg s GLY 293 Ca -0.07 0.59 -0.06 0.00 0.00 0.00 0.00 44.72 45.18 2jhg s GLY 293 CO 0.13 0.98 0.03 0.14 0.00 0.00 0.00 173.10 174.37 2jhg s VAL 294 N -2.48 4.51 0.74 1.40 1.01 -1.26 -4.60 120.40 119.72 2jhg s VAL 294 Ca 0.68 -0.14 -0.06 0.00 0.00 0.00 0.00 61.98 62.46 2jhg s VAL 294 Cb -0.23 -3.01 0.10 0.00 0.00 0.00 0.00 36.38 33.25 2jhg s VAL 294 CO 0.52 0.48 1.04 -2.16 0.00 0.00 0.00 175.10 174.97 2jhg s PRO 295 N 0.30 1.78 0.41 2.72 0.04 -1.26 -4.44 135.00 134.54 2jhg s PRO 295 Ca 0.01 -0.61 -0.15 0.00 0.04 0.00 0.00 61.00 60.29 2jhg s PRO 295 Cb -0.13 -2.19 -0.08 0.00 0.04 0.00 0.00 34.50 32.13 2jhg s PRO 295 CO 0.01 -1.46 0.84 -1.25 0.04 0.00 0.00 177.00 175.18 2jhg s PRO 296 N -5.28 3.97 0.26 0.56 0.05 -1.26 -4.73 135.00 128.57 2jhg s PRO 296 Ca 0.64 0.76 -0.31 0.00 0.05 0.00 0.00 61.00 62.15 2jhg s PRO 296 Cb -0.08 -2.31 -0.13 0.00 0.05 0.00 0.00 34.50 32.04 2jhg s PRO 296 CO 0.45 -0.02 1.45 -3.47 0.05 0.00 0.00 177.00 175.46 2jhg n ASP 297 N -0.93 3.06 -0.27 6.66 2.03 -0.29 -2.82 116.55 123.98 2jhg n ASP 297 Ca 0.05 1.15 -0.04 0.00 0.52 0.00 0.00 54.79 56.47 2jhg n ASP 297 Cb 0.54 -1.48 -0.02 0.00 -0.72 0.00 0.00 41.12 39.44 2jhg n ASP 297 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 2jhg n SER 298 N 2.04 -4.53 -4.66 1.67 7.64 -1.26 -4.99 113.62 109.53 2jhg n SER 298 Ca 0.10 0.09 -0.35 0.00 1.01 0.00 0.00 58.87 59.72 2jhg n SER 298 Cb 0.33 -2.34 -0.09 0.00 -1.01 0.00 0.00 64.21 61.10 2jhg n SER 298 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 2jhg s GLN 299 N -1.67 3.72 0.03 1.43 -1.52 -1.13 -5.09 119.66 115.44 2jhg s GLN 299 Ca 0.00 -0.34 -0.04 0.00 -1.95 0.00 0.00 55.36 53.03 2jhg s GLN 299 Cb 0.00 -3.11 -0.05 0.00 -0.22 0.00 0.00 33.01 29.63 2jhg s GLN 299 CO 0.00 0.41 0.25 -0.80 -0.25 0.00 0.00 175.29 174.90 2jhg s ASN 300 N -0.02 6.44 0.44 5.90 0.02 -1.26 -4.91 114.94 121.55 2jhg s ASN 300 Ca 0.06 0.46 -0.01 0.00 -1.02 0.00 0.00 52.86 52.34 2jhg s ASN 300 Cb -0.12 -2.04 -0.02 0.00 0.02 0.00 0.00 41.25 39.09 2jhg s ASN 300 CO 0.01 0.21 0.68 -1.48 0.02 0.00 0.00 177.10 176.55 2jhg s LEU 301 N -2.05 3.71 -0.09 0.60 0.05 -1.26 -5.08 118.68 114.55 2jhg s LEU 301 Ca 0.30 0.52 0.03 0.00 0.05 0.00 0.00 54.13 55.03 2jhg s LEU 301 Cb -0.13 -3.40 -0.01 0.00 -2.05 0.00 0.00 46.19 40.60 2jhg s LEU 301 CO 0.20 -0.59 -0.20 -0.55 -0.55 0.00 0.00 176.35 174.66 2jhg s SER 302 N -4.15 3.46 0.08 1.48 0.15 -1.26 -5.13 113.70 108.34 2jhg s SER 302 Ca 0.46 -0.44 -0.16 0.00 0.70 0.00 0.00 55.95 56.52 2jhg s SER 302 Cb -0.10 -1.25 0.03 0.00 -1.71 0.00 0.00 66.02 62.99 2jhg s SER 302 CO 0.40 0.21 0.37 0.00 1.20 0.00 0.00 173.24 175.41 2jhg s MET 303 N 0.09 0.97 -0.34 5.44 0.23 -1.26 -4.98 119.30 119.44 2jhg s MET 303 Ca -0.09 -0.60 -0.20 0.00 -1.03 0.00 0.00 55.69 53.77 2jhg s MET 303 Cb -0.15 0.42 -0.00 0.00 -1.53 0.00 0.00 34.83 33.57 2jhg s MET 303 CO 0.06 -0.35 0.63 1.21 -2.03 0.00 0.00 175.02 174.54 2jhg s ASN 304 N -2.46 6.45 0.00 -1.18 3.84 -1.26 -4.96 114.94 115.38 2jhg s ASN 304 Ca -0.01 0.24 0.09 0.00 0.21 0.00 0.00 52.86 53.39 2jhg s ASN 304 Cb 0.01 -2.33 0.40 0.00 -0.55 0.00 0.00 41.25 38.78 2jhg s ASN 304 CO -0.08 -0.56 1.24 -0.81 -2.79 0.00 0.00 177.10 174.11 2jhg n PRO 305 N 5.99 0.04 0.16 0.43 -0.04 -1.26 -1.35 135.00 138.97 2jhg n PRO 305 Ca -0.01 0.30 0.18 0.00 -0.04 0.00 0.00 63.50 63.93 2jhg n PRO 305 Cb 0.49 -1.50 0.79 0.00 -0.04 0.00 0.00 33.50 33.23 2jhg n PRO 305 CO 0.00 0.00 0.00 0.52 -0.04 0.00 0.00 175.50 175.98 2jhg h MET 306 N 0.00 0.00 -0.36 0.54 2.86 -1.99 -0.42 114.93 115.56 2jhg h MET 306 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2jhg h MET 306 Cb 0.13 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.77 2jhg h MET 306 CO 0.00 0.00 0.23 -0.07 1.06 0.00 0.00 176.91 178.13 2jhg h LEU 307 N 0.00 0.42 0.16 1.22 3.38 -1.63 -2.93 115.31 115.93 2jhg h LEU 307 Ca 0.12 -0.01 -0.34 0.00 0.09 0.00 0.00 57.88 57.74 2jhg h LEU 307 Cb 0.64 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.29 2jhg h LEU 307 CO -0.00 0.31 -1.74 -0.07 0.09 0.00 0.00 178.44 177.03 2jhg h LEU 308 N 0.49 0.54 -1.64 1.67 3.38 -1.33 -3.33 115.31 115.08 2jhg h LEU 308 Ca 0.13 -0.83 0.04 0.00 0.09 0.00 0.00 57.88 57.31 2jhg h LEU 308 Cb -0.05 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.50 2jhg h LEU 308 CO -0.03 1.71 0.30 -0.07 0.09 0.00 0.00 178.44 180.44 2jhg h LEU 309 N 0.09 0.40 -2.05 1.67 3.38 -1.10 0.13 115.31 117.85 2jhg h LEU 309 Ca -0.33 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.62 2jhg h LEU 309 Cb 2.08 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 42.73 2jhg h LEU 309 CO 0.16 0.28 -0.05 0.77 0.09 0.00 0.00 178.44 179.69 2jhg h SER 310 N 0.47 0.00 0.00 -0.43 4.64 -1.71 -3.46 113.55 113.06 2jhg h SER 310 Ca 0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 2jhg h SER 310 Cb 0.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 2jhg h SER 310 CO -0.05 0.05 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 2jhg n GLY 311 N -0.52 0.06 3.72 -0.77 0.00 0.03 -4.15 105.19 103.55 2jhg n GLY 311 Ca -0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.66 2jhg n GLY 311 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jhg s ARG 312 N 0.00 2.25 -0.10 1.61 0.52 -1.02 -4.28 118.95 117.94 2jhg s ARG 312 Ca 0.00 1.87 0.02 0.00 -0.52 0.00 0.00 55.73 57.11 2jhg s ARG 312 Cb 0.00 -1.83 -0.01 0.00 0.52 0.00 0.00 34.95 33.62 2jhg s ARG 312 CO 0.00 -1.77 -0.18 0.99 0.02 0.00 0.00 175.30 174.36 2jhg s THR 313 N -1.77 2.65 -0.10 0.02 2.01 -0.58 -4.76 115.64 113.11 2jhg s THR 313 Ca 0.77 -0.82 0.03 0.00 0.31 0.00 0.00 61.69 61.98 2jhg s THR 313 Cb -0.32 -2.06 0.01 0.00 0.01 0.00 0.00 72.50 70.14 2jhg s THR 313 CO 0.43 0.55 -0.18 0.86 -0.69 0.00 0.00 174.62 175.59 2jhg s TRP 314 N 0.14 2.18 0.13 4.92 -0.00 -1.26 -0.81 118.94 124.24 2jhg s TRP 314 Ca -0.09 -0.97 -0.03 0.00 -0.00 0.00 0.00 56.10 55.01 2jhg s TRP 314 Cb -0.16 -1.51 -0.03 0.00 -0.00 0.00 0.00 33.47 31.77 2jhg s TRP 314 CO 0.06 -0.45 0.12 0.15 -0.00 0.00 0.00 176.95 176.83 2jhg s LYS 315 N 0.71 0.97 0.33 5.86 1.02 -0.29 -4.99 119.74 123.35 2jhg s LYS 315 Ca -0.12 -1.34 0.04 0.00 0.02 0.00 0.00 55.97 54.57 2jhg s LYS 315 Cb -0.16 0.28 -0.03 0.00 -0.52 0.00 0.00 37.83 37.40 2jhg s LYS 315 CO 0.02 -0.30 0.18 0.20 -0.92 0.00 0.00 175.35 174.54 2jhg s GLY 316 N -3.02 2.21 0.03 -3.33 0.00 -1.26 -0.41 107.32 101.54 2jhg s GLY 316 Ca 0.21 -1.74 -0.27 0.00 0.00 0.00 0.00 44.72 42.92 2jhg s GLY 316 CO 0.00 -1.59 0.74 0.00 0.00 0.00 0.00 173.10 172.25 2jhg s ALA 317 N -3.52 -1.74 -0.13 3.20 0.00 -1.14 -4.92 121.76 113.51 2jhg s ALA 317 Ca 0.35 0.94 -0.06 0.00 0.00 0.00 0.00 51.96 53.19 2jhg s ALA 317 Cb 0.04 0.38 -0.04 0.00 0.00 0.00 0.00 23.12 23.50 2jhg s ALA 317 CO 0.19 -0.61 0.07 0.42 0.00 0.00 0.00 175.76 175.84 2jhg s ILE 318 N -2.72 4.91 -1.46 0.00 -1.09 -1.26 -4.61 121.20 114.96 2jhg s ILE 318 Ca -0.01 -0.01 -0.08 0.00 -2.23 0.00 0.00 60.65 58.32 2jhg s ILE 318 Cb -0.01 -3.15 0.03 0.00 -1.58 0.00 0.00 42.46 37.75 2jhg s ILE 318 CO -0.05 0.56 0.83 0.33 -1.23 0.00 0.00 174.94 175.38 2jhg n PHE 319 N 2.61 -2.29 -1.24 3.97 7.35 -1.26 -1.97 117.46 124.62 2jhg n PHE 319 Ca -0.18 0.73 -0.08 0.00 -0.76 0.00 0.00 57.45 57.16 2jhg n PHE 319 Cb 0.54 -4.41 -0.04 0.00 0.35 0.00 0.00 39.48 35.92 2jhg n PHE 319 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2jhg n GLY 320 N -1.66 0.90 3.12 7.13 0.00 -1.24 -1.95 105.19 111.48 2jhg n GLY 320 Ca -0.04 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.82 2jhg n GLY 320 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jhg n GLY 321 N -0.62 1.22 3.72 -0.02 0.00 -0.83 -3.70 105.19 104.95 2jhg n GLY 321 Ca -0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 2jhg n GLY 321 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2jhg s PHE 322 N -3.53 3.54 -0.07 1.61 0.08 -0.82 -4.56 117.98 114.23 2jhg s PHE 322 Ca 0.00 1.49 -0.30 0.00 0.12 0.00 0.00 56.93 58.24 2jhg s PHE 322 Cb 0.00 -3.30 -0.06 0.00 -0.57 0.00 0.00 43.02 39.10 2jhg s PHE 322 CO 0.00 -0.75 1.72 0.15 -0.10 0.00 0.00 175.22 176.24 2jhg s LYS 323 N 0.72 4.08 0.02 0.44 1.02 -1.26 -4.84 119.74 119.91 2jhg s LYS 323 Ca 0.55 2.18 -0.25 0.00 0.02 0.00 0.00 55.97 58.46 2jhg s LYS 323 Cb -0.27 -4.04 -0.18 0.00 -0.52 0.00 0.00 37.83 32.82 2jhg s LYS 323 CO 0.30 -0.98 1.38 0.66 -0.92 0.00 0.00 175.35 175.79 2jhg h SER 324 N 10.10 -0.12 0.22 2.83 4.64 -1.82 -0.34 113.55 129.05 2jhg h SER 324 Ca -0.40 -0.27 -0.16 0.00 -0.47 0.00 0.00 61.79 60.49 2jhg h SER 324 Cb 1.19 0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 63.30 2jhg h SER 324 CO 0.96 0.21 -0.62 0.50 -0.87 0.00 0.00 176.83 177.02 2jhg h LYS 325 N -0.46 0.39 -0.39 4.77 3.64 -1.88 -1.06 116.57 121.57 2jhg h LYS 325 Ca -0.01 -0.27 -0.13 0.00 -1.27 0.00 0.00 60.65 58.97 2jhg h LYS 325 Cb 0.38 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.23 2jhg h LYS 325 CO 0.02 0.88 -0.24 -0.44 -2.27 0.00 0.00 179.45 177.40 2jhg h ASP 326 N 0.29 0.90 0.30 4.20 3.32 -1.96 -3.37 116.42 120.08 2jhg h ASP 326 Ca -0.01 -0.42 -0.33 0.00 0.02 0.00 0.00 57.03 56.29 2jhg h ASP 326 Cb 1.15 -0.25 0.01 0.00 0.22 0.00 0.00 39.33 40.46 2jhg h ASP 326 CO 0.10 1.13 -1.61 0.28 -1.72 0.00 0.00 179.24 177.42 2jhg h SER 327 N 0.67 0.61 -0.35 6.45 0.02 -0.86 -3.36 113.55 116.73 2jhg h SER 327 Ca 0.08 -0.81 0.05 0.00 -0.84 0.00 0.00 61.79 60.27 2jhg h SER 327 Cb 0.81 -0.20 -0.04 0.00 0.14 0.00 0.00 62.40 63.11 2jhg h SER 327 CO 0.07 1.66 0.09 0.58 -1.14 0.00 0.00 176.83 178.10 2jhg h VAL 328 N 0.11 0.86 -0.34 2.27 2.07 -1.36 -0.00 116.25 119.86 2jhg h VAL 328 Ca -0.29 -0.08 -0.05 0.00 0.82 0.00 0.00 66.70 67.10 2jhg h VAL 328 Cb 2.09 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 32.46 2jhg h VAL 328 CO 0.20 0.04 -0.00 -0.65 0.02 0.00 0.00 177.57 177.18 2jhg h PRO 329 N 0.23 0.52 -0.47 1.57 0.11 -1.76 -1.31 132.00 130.89 2jhg h PRO 329 Ca 0.16 -0.11 -0.13 0.00 0.11 0.00 0.00 66.00 66.03 2jhg h PRO 329 Cb 0.16 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 31.18 2jhg h PRO 329 CO -0.19 0.55 -0.23 0.87 -0.21 0.00 0.00 178.00 178.79 2jhg h LYS 330 N 0.50 0.97 -0.64 1.05 1.57 -1.53 -0.73 116.57 117.76 2jhg h LYS 330 Ca 0.11 -0.42 -0.06 0.00 -1.87 0.00 0.00 60.65 58.41 2jhg h LYS 330 Cb 0.33 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.58 2jhg h LYS 330 CO 0.01 1.08 0.16 -0.07 -0.57 0.00 0.00 179.45 180.07 2jhg h LEU 331 N 0.83 0.97 -0.45 2.94 3.38 -0.65 0.14 115.31 122.48 2jhg h LEU 331 Ca 0.11 -0.23 -0.00 0.00 0.09 0.00 0.00 57.88 57.84 2jhg h LEU 331 Cb 0.80 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 2jhg h LEU 331 CO 0.07 0.95 0.27 0.58 0.09 0.00 0.00 178.44 180.39 2jhg h VAL 332 N 0.95 1.14 -0.87 1.22 2.07 -1.09 -0.23 116.25 119.45 2jhg h VAL 332 Ca 0.20 -0.32 -0.02 0.00 0.82 0.00 0.00 66.70 67.38 2jhg h VAL 332 Cb 0.35 0.55 -0.04 0.00 -1.52 0.00 0.00 31.29 30.63 2jhg h VAL 332 CO 0.00 0.14 0.47 0.00 0.02 0.00 0.00 177.57 178.20 2jhg h ALA 333 N 1.12 1.11 -0.81 1.67 0.00 -0.74 -0.67 119.26 120.95 2jhg h ALA 333 Ca 0.16 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 2jhg h ALA 333 Cb -0.00 -0.35 -0.04 0.00 0.00 0.00 0.00 17.79 17.41 2jhg h ALA 333 CO -0.03 0.63 0.39 -0.44 0.00 0.00 0.00 179.25 179.80 2jhg h ASP 334 N 1.21 1.05 -0.53 0.00 3.32 -0.29 -1.06 116.42 120.13 2jhg h ASP 334 Ca 0.30 -0.13 0.00 0.00 0.02 0.00 0.00 57.03 57.22 2jhg h ASP 334 Cb 0.04 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.30 2jhg h ASP 334 CO -0.05 0.88 0.33 0.15 -1.72 0.00 0.00 179.24 178.84 2jhg h PHE 335 N 1.14 0.69 0.00 4.55 3.57 -0.40 -1.17 116.94 125.31 2jhg h PHE 335 Ca 0.28 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.75 2jhg h PHE 335 Cb 0.11 -0.23 -0.00 0.00 2.79 0.00 0.00 35.95 38.61 2jhg h PHE 335 CO 0.01 0.46 -0.15 0.52 -2.23 0.00 0.00 178.31 176.92 2jhg h MET 336 N 0.71 0.00 -0.39 1.11 2.86 -0.68 -0.84 114.93 117.70 2jhg h MET 336 Ca 0.19 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.83 2jhg h MET 336 Cb -0.04 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.62 2jhg h MET 336 CO -0.04 0.15 0.00 0.00 1.06 0.00 0.00 176.91 178.08 2jhg n ALA 337 N -2.30 2.44 -2.49 6.32 0.00 -0.44 -4.94 120.51 119.10 2jhg n ALA 337 Ca -0.02 -0.69 -0.15 0.00 0.00 0.00 0.00 53.44 52.58 2jhg n ALA 337 Cb 0.27 -0.97 0.01 0.00 0.00 0.00 0.00 19.45 18.75 2jhg n ALA 337 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2jhg n LYS 338 N 0.66 -2.10 0.18 0.00 4.01 -0.32 -4.92 118.16 115.67 2jhg n LYS 338 Ca 0.13 0.69 0.08 0.00 -0.51 0.00 0.00 58.31 58.71 2jhg n LYS 338 Cb 0.34 -5.01 0.10 0.00 -0.51 0.00 0.00 35.03 29.94 2jhg n LYS 338 CO 0.00 0.00 0.00 0.87 -1.11 0.00 0.00 177.40 177.16 2jhg h LYS 339 N -0.39 0.00 -3.62 1.97 1.57 -1.42 -3.46 116.57 111.21 2jhg h LYS 339 Ca -0.36 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.36 2jhg h LYS 339 Cb 1.26 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 33.48 2jhg h LYS 339 CO 0.41 0.19 -0.11 -0.59 -0.57 0.00 0.00 179.45 178.78 2jhg s PHE 340 N -3.12 0.30 -0.02 -1.35 -0.12 -1.26 -5.03 117.98 107.38 2jhg s PHE 340 Ca 0.05 -0.66 0.05 0.00 -0.05 0.00 0.00 56.93 56.32 2jhg s PHE 340 Cb 0.06 0.20 -0.03 0.00 -0.63 0.00 0.00 43.02 42.62 2jhg s PHE 340 CO 0.71 -0.96 -0.17 0.00 -0.05 0.00 0.00 175.22 174.75 2jhg s ALA 341 N -4.00 2.59 -0.09 1.99 0.00 -1.26 -4.79 121.76 116.20 2jhg s ALA 341 Ca 0.20 -1.06 0.10 0.00 0.00 0.00 0.00 51.96 51.20 2jhg s ALA 341 Cb -0.00 -0.85 -0.14 0.00 0.00 0.00 0.00 23.12 22.13 2jhg s ALA 341 CO 0.07 0.56 0.07 1.28 0.00 0.00 0.00 175.76 177.73 2jhg n LEU 342 N 2.07 0.00 -0.31 0.00 4.77 -1.26 -4.63 117.00 117.64 2jhg n LEU 342 Ca -0.17 0.00 0.13 0.00 -0.03 0.00 0.00 56.01 55.95 2jhg n LEU 342 Cb 0.52 0.23 0.37 0.00 -2.33 0.00 0.00 43.42 42.21 2jhg n LEU 342 CO 0.26 0.23 1.21 0.44 -1.33 0.00 0.00 177.39 178.20 2jhg h ASP 343 N 0.00 0.68 -0.01 -1.43 3.32 -1.95 -0.82 116.42 116.21 2jhg h ASP 343 Ca -0.25 0.06 0.00 0.00 0.02 0.00 0.00 57.03 56.86 2jhg h ASP 343 Cb 1.50 -0.07 -0.00 0.00 0.22 0.00 0.00 39.33 40.99 2jhg h ASP 343 CO 0.01 0.29 0.03 -0.65 -1.72 0.00 0.00 179.24 177.20 2jhg h PRO 344 N 0.69 0.00 0.00 3.56 0.11 -2.03 -1.69 132.00 132.65 2jhg h PRO 344 Ca 0.51 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.62 2jhg h PRO 344 Cb 0.87 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.98 2jhg h PRO 344 CO -0.27 0.00 -0.27 -0.07 -0.21 0.00 0.00 178.00 177.18 2jhg h LEU 345 N 0.00 0.00 -8.50 2.35 3.38 -1.46 -3.45 115.31 107.63 2jhg h LEU 345 Ca 0.00 0.00 -0.72 0.00 0.09 0.00 0.00 57.88 57.26 2jhg h LEU 345 Cb 0.06 0.00 -0.21 0.00 0.09 0.00 0.00 40.66 40.60 2jhg h LEU 345 CO -0.00 0.02 -0.40 -0.63 0.09 0.00 0.00 178.44 177.52 2jhg s ILE 346 N -3.24 5.24 -0.04 1.22 1.01 -0.64 -0.91 121.20 123.85 2jhg s ILE 346 Ca 0.05 -0.63 0.20 0.00 0.00 0.00 0.00 60.65 60.28 2jhg s ILE 346 Cb 0.06 -3.94 -0.31 0.00 0.01 0.00 0.00 42.46 38.27 2jhg s ILE 346 CO 0.70 -0.33 0.43 0.35 0.00 0.00 0.00 174.94 176.10 2jhg n THR 347 N 5.19 0.06 -3.79 2.92 -2.24 -0.53 -4.94 114.28 110.95 2jhg n THR 347 Ca -0.11 -0.48 -0.13 0.00 -2.27 0.00 0.00 64.05 61.07 2jhg n THR 347 Cb 0.47 0.01 -0.10 0.00 -2.10 0.00 0.00 70.33 68.61 2jhg n THR 347 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2jhg s HIS 348 N -3.37 -0.20 -0.08 4.78 3.76 -1.17 -5.00 115.29 114.00 2jhg s HIS 348 Ca -0.08 0.44 -0.01 0.00 -0.15 0.00 0.00 55.06 55.27 2jhg s HIS 348 Cb 0.13 0.07 0.03 0.00 1.11 0.00 0.00 32.58 33.92 2jhg s HIS 348 CO 0.84 -0.24 -0.04 0.08 -0.85 0.00 0.00 174.74 174.53 2jhg s VAL 349 N -0.55 0.69 0.09 -0.90 1.01 -1.26 -1.25 120.40 118.22 2jhg s VAL 349 Ca -0.07 -0.10 0.04 0.00 0.00 0.00 0.00 61.98 61.86 2jhg s VAL 349 Cb -0.04 -0.76 -0.03 0.00 0.00 0.00 0.00 36.38 35.55 2jhg s VAL 349 CO 0.02 0.30 -0.12 -0.76 0.00 0.00 0.00 175.10 174.54 2jhg s LEU 350 N 1.67 2.36 0.68 3.92 1.43 -0.37 -4.97 118.68 123.41 2jhg s LEU 350 Ca 0.02 -0.74 -0.16 0.00 -1.03 0.00 0.00 54.13 52.22 2jhg s LEU 350 Cb -0.13 -0.40 0.01 0.00 0.03 0.00 0.00 46.19 45.71 2jhg s LEU 350 CO -0.05 -0.18 1.20 -2.16 0.23 0.00 0.00 176.35 175.38 2jhg s PRO 351 N -2.38 2.45 0.43 1.29 0.04 -1.26 -0.97 135.00 134.60 2jhg s PRO 351 Ca 0.03 1.73 0.15 0.00 0.04 0.00 0.00 61.00 62.95 2jhg s PRO 351 Cb -0.06 -1.87 1.06 0.00 0.04 0.00 0.00 34.50 33.66 2jhg s PRO 351 CO 0.01 -1.59 1.95 0.35 0.04 0.00 0.00 177.00 177.76 2jhg h PHE 352 N 0.06 0.44 -0.02 0.56 3.57 -1.19 0.46 116.94 120.83 2jhg h PHE 352 Ca -0.48 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.03 2jhg h PHE 352 Cb 1.29 -0.14 -0.00 0.00 2.79 0.00 0.00 35.95 39.89 2jhg h PHE 352 CO 0.48 0.19 0.06 1.49 -2.23 0.00 0.00 178.31 178.29 2jhg h GLU 353 N 0.40 0.00 -0.93 1.11 4.57 -1.90 -1.36 114.58 116.47 2jhg h GLU 353 Ca 0.33 0.00 -0.30 0.00 -1.18 0.00 0.00 59.36 58.21 2jhg h GLU 353 Cb 0.72 0.00 -0.18 0.00 -0.16 0.00 0.00 28.75 29.14 2jhg h GLU 353 CO -0.10 0.00 0.38 1.63 -1.18 0.00 0.00 179.01 179.74 2jhg n LYS 354 N -3.30 2.41 -0.21 1.92 5.02 0.15 -4.64 118.16 119.52 2jhg n LYS 354 Ca -0.02 -2.29 0.01 0.00 -2.02 0.00 0.00 58.31 53.99 2jhg n LYS 354 Cb 0.13 -1.93 0.12 0.00 -0.02 0.00 0.00 35.03 33.33 2jhg n LYS 354 CO 0.00 0.00 0.00 0.97 -0.52 0.00 0.00 177.40 177.85 2jhg h ILE 355 N 1.28 0.75 -0.80 -0.18 2.10 -1.40 -1.28 117.51 117.99 2jhg h ILE 355 Ca 0.37 -0.14 -0.04 0.00 1.08 0.00 0.00 64.86 66.12 2jhg h ILE 355 Cb 2.22 0.31 -0.04 0.00 -1.09 0.00 0.00 36.82 38.23 2jhg h ILE 355 CO 0.72 0.07 0.33 0.78 -1.08 0.00 0.00 178.15 178.98 2jhg h ASN 356 N 0.41 1.09 -0.97 2.19 2.35 -1.87 -0.92 115.58 117.85 2jhg h ASN 356 Ca 0.32 -0.16 0.01 0.00 -0.55 0.00 0.00 56.30 55.91 2jhg h ASN 356 Cb 0.41 -0.28 -0.05 0.00 0.05 0.00 0.00 38.32 38.45 2jhg h ASN 356 CO -0.32 0.96 0.63 -0.08 -1.65 0.00 0.00 177.43 176.97 2jhg h GLU 357 N 1.16 1.29 -0.77 0.81 4.81 -1.69 0.02 114.58 120.21 2jhg h GLU 357 Ca 0.27 -0.09 0.01 0.00 -0.13 0.00 0.00 59.36 59.42 2jhg h GLU 357 Cb 0.20 -0.29 -0.04 0.00 0.63 0.00 0.00 28.75 29.25 2jhg h GLU 357 CO -0.02 0.86 0.50 0.78 -0.73 0.00 0.00 179.01 180.40 2jhg h GLY 358 N 1.32 1.08 1.07 1.92 0.00 -0.37 -0.84 103.07 107.26 2jhg h GLY 358 Ca 0.35 -0.40 -0.07 0.00 0.00 0.00 0.00 47.33 47.22 2jhg h GLY 358 CO -0.07 0.38 0.17 0.74 0.00 0.00 0.00 176.54 177.76 2jhg h PHE 359 N 1.03 1.20 -0.78 5.60 -1.00 -0.71 -2.46 116.94 119.81 2jhg h PHE 359 Ca 0.28 -0.14 -0.00 0.00 2.81 0.00 0.00 57.97 60.91 2jhg h PHE 359 Cb -0.10 -0.34 -0.04 0.00 3.61 0.00 0.00 35.95 39.08 2jhg h PHE 359 CO -0.02 0.97 0.47 -0.44 -1.61 0.00 0.00 178.31 177.68 2jhg h ASP 360 N 1.08 0.94 -0.70 2.17 3.32 -0.66 -0.22 116.42 122.35 2jhg h ASP 360 Ca 0.22 -0.05 -0.04 0.00 0.02 0.00 0.00 57.03 57.18 2jhg h ASP 360 Cb 0.38 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.66 2jhg h ASP 360 CO 0.00 0.72 0.27 -0.07 -1.72 0.00 0.00 179.24 178.45 2jhg h LEU 361 N 1.08 0.97 0.19 1.55 3.38 -0.91 -0.67 115.31 120.89 2jhg h LEU 361 Ca 0.28 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 2jhg h LEU 361 Cb -0.04 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.46 2jhg h LEU 361 CO -0.05 0.88 -0.09 0.25 0.09 0.00 0.00 178.44 179.52 2jhg h LEU 362 N 1.00 -0.22 -1.52 1.67 5.85 -0.94 -2.24 115.31 118.92 2jhg h LEU 362 Ca 0.23 -0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.83 2jhg h LEU 362 Cb 0.22 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.30 2jhg h LEU 362 CO -0.02 -0.04 -0.03 0.03 -0.34 0.00 0.00 178.44 178.04 2jhg h ARG 363 N -0.38 0.27 0.00 1.25 3.08 -0.87 -2.08 114.38 115.65 2jhg h ARG 363 Ca -0.03 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.98 2jhg h ARG 363 Cb 0.30 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.30 2jhg h ARG 363 CO 0.04 0.32 0.00 -1.13 -1.07 0.00 0.00 179.97 178.13 2jhg n SER 364 N -4.35 0.00 0.00 7.04 3.41 -0.28 -4.90 113.62 114.54 2jhg n SER 364 Ca -0.00 0.39 0.00 0.00 -0.26 0.00 0.00 58.87 59.00 2jhg n SER 364 Cb 0.20 -0.46 0.00 0.00 -0.26 0.00 0.00 64.21 63.69 2jhg n SER 364 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2jhg n GLY 365 N 1.04 0.89 0.07 5.00 0.00 -0.78 -4.97 105.19 106.44 2jhg n GLY 365 Ca 0.07 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.02 2jhg n GLY 365 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2jhg h GLU 366 N 3.69 0.02 -6.18 1.61 4.81 -1.63 -3.47 114.58 113.44 2jhg h GLU 366 Ca 0.00 -0.03 -0.51 0.00 -0.13 0.00 0.00 59.36 58.69 2jhg h GLU 366 Cb 0.00 0.01 -0.05 0.00 0.63 0.00 0.00 28.75 29.34 2jhg h GLU 366 CO 0.00 0.99 -0.49 -1.54 -0.73 0.00 0.00 179.01 177.24 2jhg s SER 367 N -6.74 5.19 0.00 1.04 1.04 -1.07 -5.02 113.70 108.14 2jhg s SER 367 Ca 0.01 -0.50 0.00 0.00 0.48 0.00 0.00 55.95 55.94 2jhg s SER 367 Cb 0.10 -1.02 0.00 0.00 0.10 0.00 0.00 66.02 65.20 2jhg s SER 367 CO 0.82 -0.25 0.00 -0.38 0.98 0.00 0.00 173.24 174.41 2jhg n ILE 368 N -1.26 0.00 -4.24 -1.02 2.08 -1.26 -4.80 119.36 108.86 2jhg n ILE 368 Ca -0.04 0.00 -0.34 0.00 0.56 0.00 0.00 62.75 62.93 2jhg n ILE 368 Cb 0.59 -0.48 -0.12 0.00 -0.75 0.00 0.00 39.64 38.88 2jhg n ILE 368 CO 0.00 0.00 0.00 -0.13 0.56 0.00 0.00 176.55 176.98 2jhg s ARG 369 N 0.00 3.67 -0.11 0.38 1.81 -0.09 -4.64 118.95 119.97 2jhg s ARG 369 Ca 0.00 -0.51 -0.18 0.00 -1.72 0.00 0.00 55.73 53.32 2jhg s ARG 369 Cb 0.00 -3.00 -0.04 0.00 -0.45 0.00 0.00 34.95 31.46 2jhg s ARG 369 CO 0.00 0.15 0.49 0.99 -0.68 0.00 0.00 175.30 176.25 2jhg s THR 370 N 0.62 5.17 -0.23 0.02 2.01 -1.26 -1.45 115.64 120.51 2jhg s THR 370 Ca -0.01 0.99 -0.09 0.00 0.31 0.00 0.00 61.69 62.88 2jhg s THR 370 Cb -0.14 -3.83 -0.04 0.00 0.01 0.00 0.00 72.50 68.49 2jhg s THR 370 CO 0.02 0.33 0.12 -0.63 -0.69 0.00 0.00 174.62 173.77 2jhg s ILE 371 N 0.58 5.01 -0.16 1.82 -1.09 -0.38 -1.85 121.20 125.13 2jhg s ILE 371 Ca 0.27 0.06 -0.15 0.00 -2.23 0.00 0.00 60.65 58.60 2jhg s ILE 371 Cb -0.15 -3.33 -0.04 0.00 -1.58 0.00 0.00 42.46 37.35 2jhg s ILE 371 CO 0.11 0.36 0.33 -0.76 -1.23 0.00 0.00 174.94 173.75 2jhg s LEU 372 N 1.11 4.24 -0.09 2.97 1.43 0.47 -1.23 118.68 127.58 2jhg s LEU 372 Ca 0.06 0.55 0.00 0.00 -1.03 0.00 0.00 54.13 53.71 2jhg s LEU 372 Cb -0.14 -2.44 -0.03 0.00 0.03 0.00 0.00 46.19 43.62 2jhg s LEU 372 CO 0.04 0.06 -0.08 0.42 0.23 0.00 0.00 176.35 177.03 2jhg s THR 373 N 0.59 3.60 -2.40 5.49 -4.23 -0.15 -1.17 115.64 117.38 2jhg s THR 373 Ca 0.18 -0.50 0.29 0.00 -1.18 0.00 0.00 61.69 60.48 2jhg s THR 373 Cb -0.13 -2.49 0.62 0.00 1.34 0.00 0.00 72.50 71.84 2jhg s THR 373 CO 0.05 0.57 1.84 0.49 -0.54 0.00 0.00 174.62 177.04