#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h4g h ALA 2 N 0.00 0.19 -2.48 3.17 0.00 -1.72 -3.47 119.26 114.95 3h4g h ALA 2 Ca 0.00 -1.02 -0.48 0.00 0.00 0.00 0.00 54.91 53.40 3h4g h ALA 2 Cb 0.00 0.53 0.04 0.00 0.00 0.00 0.00 17.79 18.35 3h4g h ALA 2 CO 0.00 0.54 0.42 0.00 0.00 0.00 0.00 179.25 180.21 3h4g s ALA 3 N -2.34 2.93 0.79 0.00 0.00 -1.26 -5.04 121.76 116.83 3h4g s ALA 3 Ca -0.25 0.72 -0.11 0.00 0.00 0.00 0.00 51.96 52.32 3h4g s ALA 3 Cb 0.03 -3.29 0.06 0.00 0.00 0.00 0.00 23.12 19.92 3h4g s ALA 3 CO 0.64 -0.40 1.09 -1.12 0.00 0.00 0.00 175.76 175.96 3h4g s SER 4 N -1.73 4.47 0.30 0.00 0.01 -1.26 -4.83 113.70 110.67 3h4g s SER 4 Ca 0.65 1.62 0.09 0.00 1.31 0.00 0.00 55.95 59.62 3h4g s SER 4 Cb -0.21 -2.36 -0.06 0.00 0.21 0.00 0.00 66.02 63.60 3h4g s SER 4 CO 0.25 -2.02 -0.11 0.00 0.41 0.00 0.00 173.24 171.77 3h4g s VAL 6 N -2.72 2.91 -0.26 0.00 0.11 0.18 -4.85 120.40 115.76 3h4g s VAL 6 Ca 0.30 -1.20 -0.22 0.00 -2.93 0.00 0.00 61.98 57.93 3h4g s VAL 6 Cb 0.01 -2.25 -0.01 0.00 -1.53 0.00 0.00 36.38 32.60 3h4g s VAL 6 CO 0.14 0.30 0.73 -0.22 -3.33 0.00 0.00 175.10 172.72 3h4g s LEU 7 N -1.58 4.08 0.69 2.54 2.96 -1.26 -0.37 118.68 125.74 3h4g s LEU 7 Ca 0.16 0.83 -0.11 0.00 -0.22 0.00 0.00 54.13 54.79 3h4g s LEU 7 Cb -0.11 -3.02 0.01 0.00 0.50 0.00 0.00 46.19 43.57 3h4g s LEU 7 CO 0.07 -0.47 1.06 -0.76 -1.32 0.00 0.00 176.35 174.93 3h4g s LEU 8 N 2.71 3.06 0.35 -0.68 1.43 0.21 -4.94 118.68 120.82 3h4g s LEU 8 Ca 0.31 1.48 0.26 0.00 -1.03 0.00 0.00 54.13 55.15 3h4g s LEU 8 Cb -0.15 -4.36 1.24 0.00 0.03 0.00 0.00 46.19 42.95 3h4g s LEU 8 CO 0.09 -1.37 1.78 1.12 0.23 0.00 0.00 176.35 178.20 3h4g h HIS 9 N -0.67 0.00 0.00 0.29 2.07 -1.86 -1.21 115.15 113.78 3h4g h HIS 9 Ca -0.44 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.08 3h4g h HIS 9 Cb 1.22 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.20 3h4g h HIS 9 CO 0.60 0.00 0.00 1.79 -3.07 0.00 0.00 177.93 177.25 3h4g h THR 10 N 0.00 0.00 0.00 6.12 1.35 -1.95 -3.46 112.91 114.96 3h4g h THR 10 Ca 0.00 -0.47 0.00 0.00 -0.55 0.00 0.00 66.41 65.39 3h4g h THR 10 Cb 0.19 1.38 0.00 0.00 -1.73 0.00 0.00 68.15 67.99 3h4g h THR 10 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 3h4g n GLY 11 N 0.72 0.20 3.76 5.82 0.00 -0.46 -5.07 105.19 110.18 3h4g n GLY 11 Ca 0.04 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.66 3h4g n GLY 11 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3h4g s GLN 12 N -0.97 4.48 -0.23 1.61 -0.21 -1.26 -4.83 119.66 118.25 3h4g s GLN 12 Ca 0.00 1.79 -0.14 0.00 0.02 0.00 0.00 55.36 57.03 3h4g s GLN 12 Cb 0.00 -3.02 -0.04 0.00 1.00 0.00 0.00 33.01 30.95 3h4g s GLN 12 CO 0.00 0.07 0.31 0.15 -2.12 0.00 0.00 175.29 173.70 3h4g s LYS 13 N -1.74 4.11 -0.24 2.91 1.02 -1.26 -0.62 119.74 123.92 3h4g s LYS 13 Ca 0.48 0.01 -0.05 0.00 0.02 0.00 0.00 55.97 56.44 3h4g s LYS 13 Cb -0.31 -3.56 -0.01 0.00 -0.52 0.00 0.00 37.83 33.44 3h4g s LYS 13 CO 0.39 -0.04 -0.01 1.41 -0.92 0.00 0.00 175.35 176.18 3h4g s MET 14 N 1.34 3.33 0.31 1.68 1.75 0.50 -4.91 119.30 123.30 3h4g s MET 14 Ca 0.14 -0.67 -0.30 0.00 -1.25 0.00 0.00 55.69 53.62 3h4g s MET 14 Cb -0.14 -3.10 -0.12 0.00 2.84 0.00 0.00 34.83 34.30 3h4g s MET 14 CO 0.07 -0.25 1.51 -2.30 -0.65 0.00 0.00 175.02 173.40 3h4g n PRO 15 N 4.81 2.54 0.18 4.11 -0.02 -1.26 -0.65 135.00 144.71 3h4g n PRO 15 Ca -0.17 0.90 0.14 0.00 -2.02 0.00 0.00 63.50 62.34 3h4g n PRO 15 Cb 0.50 -2.63 0.56 0.00 -0.02 0.00 0.00 33.50 31.91 3h4g n PRO 15 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 3h4g h LEU 16 N 4.04 0.00 -8.15 2.45 3.38 -1.12 -3.40 115.31 112.50 3h4g h LEU 16 Ca -0.47 0.00 -0.61 0.00 0.09 0.00 0.00 57.88 56.89 3h4g h LEU 16 Cb 1.24 0.00 -0.33 0.00 0.09 0.00 0.00 40.66 41.66 3h4g h LEU 16 CO 0.73 0.00 -0.85 -0.63 0.09 0.00 0.00 178.44 177.78 3h4g s ILE 17 N -3.44 1.64 0.23 1.22 -1.09 -1.26 -0.34 121.20 118.17 3h4g s ILE 17 Ca 0.03 -0.77 0.05 0.00 -2.23 0.00 0.00 60.65 57.74 3h4g s ILE 17 Cb 0.09 -1.45 -0.05 0.00 -1.58 0.00 0.00 42.46 39.47 3h4g s ILE 17 CO 0.44 0.47 -0.05 -0.83 -1.23 0.00 0.00 174.94 173.74 3h4g s GLY 18 N 0.58 1.56 -0.33 6.18 0.00 -0.14 -4.58 107.32 110.59 3h4g s GLY 18 Ca -0.15 -1.76 -0.22 0.00 0.00 0.00 0.00 44.72 42.59 3h4g s GLY 18 CO 0.05 -1.72 0.71 -2.27 0.00 0.00 0.00 173.10 169.87 3h4g s LEU 19 N -3.33 4.15 0.47 0.66 2.96 0.04 -3.28 118.68 120.34 3h4g s LEU 19 Ca 0.27 0.41 -0.21 0.00 -0.22 0.00 0.00 54.13 54.37 3h4g s LEU 19 Cb 0.04 -2.93 -0.08 0.00 0.50 0.00 0.00 46.19 43.72 3h4g s LEU 19 CO 0.08 -0.60 1.05 -0.83 -1.32 0.00 0.00 176.35 174.74 3h4g s GLY 20 N 1.72 2.59 0.00 7.98 0.00 -0.53 -1.09 107.32 117.98 3h4g s GLY 20 Ca 0.28 0.66 0.00 0.00 0.00 0.00 0.00 44.72 45.66 3h4g s GLY 20 CO 0.14 1.02 0.50 -1.30 0.00 0.00 0.00 173.10 173.45 3h4g n THR 21 N -0.74 0.24 -2.02 0.90 -2.24 -1.17 -4.24 114.28 105.01 3h4g n THR 21 Ca 0.08 -0.35 -0.42 0.00 -2.27 0.00 0.00 64.05 61.09 3h4g n THR 21 Cb 0.51 1.13 -0.03 0.00 -2.10 0.00 0.00 70.33 69.85 3h4g n THR 21 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 3h4g s TRP 22 N -0.24 2.64 0.00 4.78 -0.00 -1.26 -2.09 118.94 122.76 3h4g s TRP 22 Ca 0.00 0.52 0.00 0.00 -0.00 0.00 0.00 56.10 56.62 3h4g s TRP 22 Cb 0.00 -3.86 0.00 0.00 -0.00 0.00 0.00 33.47 29.61 3h4g s TRP 22 CO 0.00 -3.36 0.00 1.63 -0.00 0.00 0.00 176.95 175.22 3h4g n LYS 23 N 5.32 -0.07 -2.75 5.86 5.02 -1.26 -4.99 118.16 125.28 3h4g n LYS 23 Ca 0.15 0.02 -0.42 0.00 -2.02 0.00 0.00 58.31 56.03 3h4g n LYS 23 Cb 0.41 -2.88 -0.04 0.00 -0.02 0.00 0.00 35.03 32.51 3h4g n LYS 23 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 3h4g s SER 24 N -2.47 6.30 0.47 4.39 0.01 -0.89 -5.01 113.70 116.50 3h4g s SER 24 Ca 0.00 -0.40 -0.19 0.00 1.31 0.00 0.00 55.95 56.67 3h4g s SER 24 Cb 0.00 -2.47 -0.10 0.00 0.21 0.00 0.00 66.02 63.66 3h4g s SER 24 CO 0.00 -1.40 0.97 -1.61 0.41 0.00 0.00 173.24 171.61 3h4g s GLU 25 N 4.40 4.07 0.22 12.44 2.02 -1.26 -4.64 118.70 135.96 3h4g s GLU 25 Ca 0.32 1.09 -0.32 0.00 0.02 0.00 0.00 54.97 56.07 3h4g s GLU 25 Cb -0.12 -2.15 -0.13 0.00 0.10 0.00 0.00 34.13 31.83 3h4g s GLU 25 CO 0.18 -0.17 1.48 -2.30 0.02 0.00 0.00 175.26 174.47 3h4g n PRO 26 N -1.03 2.14 0.00 0.39 -0.02 -1.26 -1.08 135.00 134.14 3h4g n PRO 26 Ca 0.07 0.77 0.00 0.00 -2.02 0.00 0.00 63.50 62.32 3h4g n PRO 26 Cb 0.54 -2.47 0.00 0.00 -0.02 0.00 0.00 33.50 31.55 3h4g n PRO 26 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3h4g n GLY 27 N 2.53 1.79 0.00 -1.23 0.00 -1.26 -4.82 105.19 102.19 3h4g n GLY 27 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 3h4g n GLY 27 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h4g n GLN 28 N -1.54 4.16 0.06 1.61 10.64 -0.24 -4.93 117.38 127.13 3h4g n GLN 28 Ca 0.00 0.00 -0.08 0.00 -1.83 0.00 0.00 57.00 55.09 3h4g n GLN 28 Cb 0.00 -0.62 0.05 0.00 -0.86 0.00 0.00 30.24 28.81 3h4g n GLN 28 CO 0.00 0.00 0.00 -0.24 -1.83 0.00 0.00 177.06 174.99 3h4g h VAL 29 N 0.00 1.40 -0.50 -0.39 3.04 -1.43 -2.59 116.25 115.78 3h4g h VAL 29 Ca 0.00 -2.15 0.05 0.00 -1.01 0.00 0.00 66.70 63.59 3h4g h VAL 29 Cb 0.03 2.12 -0.05 0.00 -2.01 0.00 0.00 31.29 31.38 3h4g h VAL 29 CO 0.00 0.64 0.24 0.50 -1.01 0.00 0.00 177.57 177.94 3h4g h LYS 30 N 0.23 0.45 -0.69 4.17 3.64 -1.85 -0.35 116.57 122.16 3h4g h LYS 30 Ca -0.02 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.29 3h4g h LYS 30 Cb 1.26 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 32.95 3h4g h LYS 30 CO 0.12 0.30 0.27 0.00 -2.27 0.00 0.00 179.45 177.87 3h4g h ALA 31 N 1.28 0.90 -0.35 5.00 0.00 -1.89 -1.34 119.26 122.86 3h4g h ALA 31 Ca 0.22 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 3h4g h ALA 31 Cb 0.16 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 3h4g h ALA 31 CO -0.17 0.52 0.16 0.00 0.00 0.00 0.00 179.25 179.76 3h4g h ALA 32 N 1.12 0.46 0.07 0.00 0.00 -1.02 -0.46 119.26 119.44 3h4g h ALA 32 Ca 0.23 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 3h4g h ALA 32 Cb 0.22 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3h4g h ALA 32 CO -0.02 0.04 -0.04 0.82 0.00 0.00 0.00 179.25 180.05 3h4g h ILE 33 N 0.43 0.95 -0.70 0.00 1.08 -0.94 -0.73 117.51 117.60 3h4g h ILE 33 Ca 0.12 -0.09 0.02 0.00 -0.39 0.00 0.00 64.86 64.52 3h4g h ILE 33 Cb 0.15 1.01 -0.04 0.00 -3.07 0.00 0.00 36.82 34.87 3h4g h ILE 33 CO -0.01 0.02 0.45 0.11 -0.69 0.00 0.00 178.15 178.03 3h4g h LYS 34 N -0.14 0.87 0.03 2.37 1.57 -1.14 -0.66 116.57 119.48 3h4g h LYS 34 Ca -0.01 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.72 3h4g h LYS 34 Cb 0.11 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.23 3h4g h LYS 34 CO 0.02 0.58 -0.02 -0.92 -0.57 0.00 0.00 179.45 178.54 3h4g h TYR 35 N 0.90 -0.04 -0.32 -1.35 5.03 -0.94 -1.94 116.97 118.30 3h4g h TYR 35 Ca 0.27 -0.00 0.05 0.00 2.58 0.00 0.00 58.73 61.63 3h4g h TYR 35 Cb -0.04 0.01 -0.04 0.00 1.55 0.00 0.00 36.73 38.21 3h4g h TYR 35 CO -0.03 0.15 0.06 0.00 -1.32 0.00 0.00 178.16 177.01 3h4g h ALA 36 N 0.73 0.34 -0.74 1.82 0.00 -0.95 -1.31 119.26 119.14 3h4g h ALA 36 Ca -0.00 0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.99 3h4g h ALA 36 Cb 0.21 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 3h4g h ALA 36 CO 0.01 -0.35 0.49 -0.07 0.00 0.00 0.00 179.25 179.33 3h4g h LEU 37 N 0.17 0.83 -0.91 0.00 3.38 -1.10 0.61 115.31 118.29 3h4g h LEU 37 Ca 0.15 -0.02 -0.10 0.00 0.09 0.00 0.00 57.88 58.00 3h4g h LEU 37 Cb 0.17 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 3h4g h LEU 37 CO -0.21 0.59 -0.31 0.71 0.09 0.00 0.00 178.44 179.32 3h4g h THR 38 N 0.98 1.28 -0.04 0.22 1.35 -0.88 -2.62 112.91 113.20 3h4g h THR 38 Ca 0.28 -1.36 0.00 0.00 -0.55 0.00 0.00 66.41 64.78 3h4g h THR 38 Cb -0.08 1.45 0.00 0.00 -1.73 0.00 0.00 68.15 67.79 3h4g h THR 38 CO -0.07 0.42 0.00 1.33 -0.25 0.00 0.00 175.52 176.95 3h4g n VAL 39 N -4.09 0.04 0.00 6.82 0.24 -0.54 -4.92 118.33 115.89 3h4g n VAL 39 Ca -0.01 -0.19 0.00 0.00 -2.04 0.00 0.00 64.34 62.10 3h4g n VAL 39 Cb 0.44 0.18 0.00 0.00 -1.47 0.00 0.00 33.84 32.99 3h4g n VAL 39 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3h4g n GLY 40 N 1.10 1.35 3.76 7.63 0.00 -0.89 -4.80 105.19 113.34 3h4g n GLY 40 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 3h4g n GLY 40 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3h4g s TYR 41 N -2.00 3.08 -0.06 1.61 2.02 0.15 -2.04 117.35 120.12 3h4g s TYR 41 Ca 0.00 1.36 0.13 0.00 -0.37 0.00 0.00 57.07 58.19 3h4g s TYR 41 Cb 0.00 -3.68 0.25 0.00 -0.40 0.00 0.00 41.96 38.13 3h4g s TYR 41 CO 0.00 -1.91 1.11 0.54 -1.57 0.00 0.00 175.55 173.72 3h4g n ARG 42 N 1.19 0.49 -3.63 -0.62 5.12 -1.26 -4.38 116.66 113.56 3h4g n ARG 42 Ca 0.01 -1.96 -0.11 0.00 -1.93 0.00 0.00 57.85 53.87 3h4g n ARG 42 Cb 0.42 -0.71 -0.11 0.00 -1.16 0.00 0.00 32.46 30.90 3h4g n ARG 42 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 3h4g s HIS 43 N -1.04 -0.64 -0.05 -1.55 2.46 -1.26 -0.24 115.29 112.97 3h4g s HIS 43 Ca 0.22 1.22 0.06 0.00 0.47 0.00 0.00 55.06 57.04 3h4g s HIS 43 Cb 0.23 0.13 -0.01 0.00 -0.13 0.00 0.00 32.58 32.80 3h4g s HIS 43 CO -0.06 -0.45 -0.24 0.96 -2.47 0.00 0.00 174.74 172.48 3h4g s ILE 44 N 2.53 1.96 -0.32 0.89 -4.36 -0.29 -0.78 121.20 120.82 3h4g s ILE 44 Ca 0.01 -1.02 -0.10 0.00 -0.26 0.00 0.00 60.65 59.29 3h4g s ILE 44 Cb -0.12 -1.66 0.00 0.00 1.25 0.00 0.00 42.46 41.93 3h4g s ILE 44 CO -0.11 0.55 0.16 -0.62 0.24 0.00 0.00 174.94 175.15 3h4g s ASP 45 N -0.16 5.56 0.44 4.36 -1.08 -0.25 -1.59 116.67 123.95 3h4g s ASP 45 Ca -0.03 -0.63 0.06 0.00 -0.52 0.00 0.00 52.55 51.42 3h4g s ASP 45 Cb -0.13 -2.00 -0.05 0.00 -1.46 0.00 0.00 42.92 39.28 3h4g s ASP 45 CO 0.03 -0.23 0.07 0.00 0.52 0.00 0.00 175.17 175.56 3h4g s ALA 47 N -2.73 -1.86 0.30 0.00 0.00 -1.26 -3.74 121.76 112.46 3h4g s ALA 47 Ca 0.29 1.84 0.02 0.00 0.00 0.00 0.00 51.96 54.11 3h4g s ALA 47 Cb 0.06 -1.08 0.57 0.00 0.00 0.00 0.00 23.12 22.66 3h4g s ALA 47 CO 0.16 -0.30 1.87 0.00 0.00 0.00 0.00 175.76 177.49 3h4g h ALA 48 N 4.22 1.55 0.00 0.00 0.00 -1.97 -2.33 119.26 120.74 3h4g h ALA 48 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.64 3h4g h ALA 48 Cb 1.16 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.73 3h4g h ALA 48 CO 0.14 0.25 0.00 0.97 0.00 0.00 0.00 179.25 180.61 3h4g h ILE 49 N 0.98 0.00 0.00 0.00 6.09 -1.96 -2.71 117.51 119.91 3h4g h ILE 49 Ca 0.45 -0.30 0.00 0.00 -1.37 0.00 0.00 64.86 63.63 3h4g h ILE 49 Cb 0.39 1.27 0.00 0.00 0.47 0.00 0.00 36.82 38.95 3h4g h ILE 49 CO -0.20 0.00 0.00 -1.22 -3.07 0.00 0.00 178.15 173.66 3h4g n TYR 50 N -3.00 0.48 -1.77 2.19 4.01 -0.88 -4.89 117.16 113.30 3h4g n TYR 50 Ca -0.01 0.18 -0.13 0.00 -0.16 0.00 0.00 57.90 57.78 3h4g n TYR 50 Cb 0.21 -0.78 -0.03 0.00 -0.31 0.00 0.00 39.34 38.43 3h4g n TYR 50 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3h4g n GLY 51 N 0.30 0.66 0.00 2.72 0.00 -1.02 -4.76 105.19 103.10 3h4g n GLY 51 Ca 0.03 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.65 3h4g n GLY 51 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3h4g n ASN 52 N -0.20 0.56 0.10 1.61 2.04 -1.26 -4.75 115.26 113.36 3h4g n ASN 52 Ca -0.14 -1.18 0.02 0.00 -0.44 0.00 0.00 54.58 52.84 3h4g n ASN 52 Cb 0.51 0.00 0.37 0.00 -2.53 0.00 0.00 39.78 38.13 3h4g n ASN 52 CO 0.00 0.00 0.00 -0.33 -0.44 0.00 0.00 177.26 176.49 3h4g h GLU 53 N 0.00 0.27 -0.79 -3.83 5.08 -1.89 -1.32 114.58 112.10 3h4g h GLU 53 Ca 0.00 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 3h4g h GLU 53 Cb 0.54 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.72 3h4g h GLU 53 CO 0.00 0.40 0.45 1.25 -1.00 0.00 0.00 179.01 180.11 3h4g h LEU 54 N 0.26 0.97 -0.10 1.33 5.85 -1.89 0.43 115.31 122.15 3h4g h LEU 54 Ca 0.05 -0.08 -0.14 0.00 0.84 0.00 0.00 57.88 58.55 3h4g h LEU 54 Cb 0.38 -0.25 0.01 0.00 0.37 0.00 0.00 40.66 41.17 3h4g h LEU 54 CO 0.02 0.77 -0.48 -0.33 -0.34 0.00 0.00 178.44 178.08 3h4g h GLU 55 N 1.08 0.50 -0.97 1.25 4.39 -1.68 -2.84 114.58 116.31 3h4g h GLU 55 Ca 0.28 -0.41 0.15 0.00 0.34 0.00 0.00 59.36 59.73 3h4g h GLU 55 Cb 0.00 0.08 -0.09 0.00 -0.10 0.00 0.00 28.75 28.64 3h4g h GLU 55 CO -0.05 1.04 0.58 0.82 -1.16 0.00 0.00 179.01 180.24 3h4g h ILE 56 N 0.09 0.80 -0.95 3.13 2.04 -1.13 -1.61 117.51 119.88 3h4g h ILE 56 Ca -0.03 -0.28 0.03 0.00 1.00 0.00 0.00 64.86 65.57 3h4g h ILE 56 Cb 1.13 -0.10 -0.05 0.00 -0.74 0.00 0.00 36.82 37.05 3h4g h ILE 56 CO 0.10 0.15 0.62 1.23 0.00 0.00 0.00 178.15 180.25 3h4g h GLY 57 N 0.82 1.36 0.98 5.37 0.00 -0.80 0.31 103.07 111.10 3h4g h GLY 57 Ca 0.52 -0.48 -0.04 0.00 0.00 0.00 0.00 47.33 47.33 3h4g h GLY 57 CO -0.33 0.42 0.15 0.83 0.00 0.00 0.00 176.54 177.61 3h4g h GLU 58 N 1.21 0.80 -0.49 4.80 5.08 -1.07 -0.94 114.58 123.96 3h4g h GLU 58 Ca 0.37 -0.18 0.00 0.00 -1.00 0.00 0.00 59.36 58.55 3h4g h GLU 58 Cb -0.03 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.09 3h4g h GLU 58 CO -0.11 0.75 0.32 0.00 -1.00 0.00 0.00 179.01 178.98 3h4g h ALA 59 N 1.01 0.63 -0.63 3.43 0.00 -0.80 -2.63 119.26 120.28 3h4g h ALA 59 Ca 0.16 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 3h4g h ALA 59 Cb 0.30 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 3h4g h ALA 59 CO -0.00 0.08 0.16 -0.07 0.00 0.00 0.00 179.25 179.42 3h4g h LEU 60 N 0.67 0.94 -1.28 0.00 3.38 -0.82 -2.35 115.31 115.85 3h4g h LEU 60 Ca 0.18 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 3h4g h LEU 60 Cb -0.06 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.41 3h4g h LEU 60 CO -0.04 0.92 0.29 -0.61 0.09 0.00 0.00 178.44 179.09 3h4g h GLN 61 N 0.91 0.79 0.00 1.13 -0.00 -1.03 0.27 115.11 117.17 3h4g h GLN 61 Ca 0.20 -0.09 -0.05 0.00 -0.00 0.00 0.00 58.65 58.71 3h4g h GLN 61 Cb 0.34 -0.16 -0.01 0.00 0.00 0.00 0.00 27.48 27.66 3h4g h GLN 61 CO -0.00 0.59 -0.28 0.93 0.00 0.00 0.00 178.83 180.08 3h4g h GLU 62 N 0.79 0.00 0.00 1.69 5.08 -1.28 -3.39 114.58 117.48 3h4g h GLU 62 Ca 0.20 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.55 3h4g h GLU 62 Cb 0.05 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.30 3h4g h GLU 62 CO -0.03 0.21 -1.13 2.41 -1.00 0.00 0.00 179.01 179.48 3h4g n THR 63 N -3.13 0.05 -4.93 1.13 -1.04 -0.90 -4.69 114.28 100.76 3h4g n THR 63 Ca 0.03 -0.07 -0.28 0.00 -2.04 0.00 0.00 64.05 61.68 3h4g n THR 63 Cb 0.62 0.00 -0.17 0.00 -1.82 0.00 0.00 70.33 68.97 3h4g n THR 63 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 3h4g s VAL 64 N -2.13 1.63 -1.99 12.58 1.01 0.91 -0.85 120.40 131.56 3h4g s VAL 64 Ca -0.01 -0.77 0.00 0.00 0.00 0.00 0.00 61.98 61.20 3h4g s VAL 64 Cb 0.01 -1.43 0.00 0.00 0.00 0.00 0.00 36.38 34.96 3h4g s VAL 64 CO 0.10 0.46 0.00 0.61 0.00 0.00 0.00 175.10 176.27 3h4g n GLY 65 N 3.60 0.89 3.69 4.51 0.00 0.61 -4.60 105.19 113.89 3h4g n GLY 65 Ca -0.21 -2.18 -0.44 0.00 0.00 0.00 0.00 46.02 43.20 3h4g n GLY 65 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3h4g n PRO 66 N -1.24 2.38 -0.98 1.61 -0.02 -1.26 -1.50 135.00 134.00 3h4g n PRO 66 Ca 0.00 0.86 0.00 0.00 -2.02 0.00 0.00 63.50 62.34 3h4g n PRO 66 Cb 0.00 -2.63 0.00 0.00 -0.02 0.00 0.00 33.50 30.85 3h4g n PRO 66 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3h4g n GLY 67 N 3.25 0.50 3.81 -1.23 0.00 -1.26 -5.02 105.19 105.24 3h4g n GLY 67 Ca 0.15 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.90 3h4g n GLY 67 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h4g s LYS 68 N -0.35 2.23 0.40 1.61 -0.14 -0.56 -5.05 119.74 117.88 3h4g s LYS 68 Ca 0.00 -2.03 0.14 0.00 -1.36 0.00 0.00 55.97 52.72 3h4g s LYS 68 Cb 0.00 -1.93 0.84 0.00 -1.68 0.00 0.00 37.83 35.07 3h4g s LYS 68 CO 0.00 -0.36 1.88 0.00 -0.76 0.00 0.00 175.35 176.12 3h4g h ALA 69 N 1.15 1.45 -3.32 5.17 0.00 -1.74 -3.42 119.26 118.55 3h4g h ALA 69 Ca -0.41 -0.28 -0.58 0.00 0.00 0.00 0.00 54.91 53.65 3h4g h ALA 69 Cb 1.29 -0.05 -0.34 0.00 0.00 0.00 0.00 17.79 18.69 3h4g h ALA 69 CO 0.66 0.38 -0.84 0.08 0.00 0.00 0.00 179.25 179.53 3h4g s VAL 70 N -4.29 1.47 0.36 0.00 1.01 -0.03 -5.03 120.40 113.88 3h4g s VAL 70 Ca -0.03 -0.65 -0.27 0.00 0.00 0.00 0.00 61.98 61.03 3h4g s VAL 70 Cb 0.15 -1.33 -0.09 0.00 0.00 0.00 0.00 36.38 35.10 3h4g s VAL 70 CO 0.71 0.43 1.24 -2.84 0.00 0.00 0.00 175.10 174.64 3h4g s PRO 71 N 0.80 4.24 0.25 2.72 0.02 -1.26 -0.28 135.00 141.48 3h4g s PRO 71 Ca -0.11 2.04 -0.04 0.00 0.02 0.00 0.00 61.00 62.91 3h4g s PRO 71 Cb -0.16 -2.92 0.41 0.00 0.02 0.00 0.00 34.50 31.85 3h4g s PRO 71 CO 0.02 -0.22 1.81 -0.09 -0.33 0.00 0.00 177.00 178.18 3h4g h ARG 72 N 3.11 0.75 0.00 5.54 9.65 -1.88 -2.06 114.38 129.49 3h4g h ARG 72 Ca -0.49 -0.05 -0.01 0.00 -1.10 0.00 0.00 59.98 58.34 3h4g h ARG 72 Cb 1.23 -0.17 -0.00 0.00 -1.39 0.00 0.00 29.97 29.64 3h4g h ARG 72 CO 0.64 0.50 -0.03 1.05 2.80 0.00 0.00 179.97 184.93 3h4g h GLU 73 N 0.78 0.00 -0.00 0.20 4.11 -2.00 -1.81 114.58 115.85 3h4g h GLU 73 Ca 0.40 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.83 3h4g h GLU 73 Cb 0.39 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.64 3h4g h GLU 73 CO -0.26 0.03 -0.25 0.39 0.07 0.00 0.00 179.01 178.99 3h4g n GLU 74 N -3.40 0.45 -3.88 1.06 1.02 -0.78 -4.88 120.64 110.24 3h4g n GLU 74 Ca -0.02 -0.21 -0.36 0.00 -0.02 0.00 0.00 57.16 56.55 3h4g n GLU 74 Cb 0.14 -1.50 -0.07 0.00 -0.02 0.00 0.00 31.44 29.99 3h4g n GLU 74 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 3h4g s LEU 75 N -2.69 4.20 -0.30 -4.62 2.96 -0.68 -4.82 118.68 112.72 3h4g s LEU 75 Ca 0.21 0.32 -0.08 0.00 -0.22 0.00 0.00 54.13 54.35 3h4g s LEU 75 Cb 0.19 -2.04 -0.00 0.00 0.50 0.00 0.00 46.19 44.83 3h4g s LEU 75 CO 0.56 0.30 0.11 0.12 -1.32 0.00 0.00 176.35 176.12 3h4g s PHE 76 N -0.38 3.15 -0.17 5.38 5.36 0.66 -4.94 117.98 127.05 3h4g s PHE 76 Ca 0.11 -0.75 0.00 0.00 -0.96 0.00 0.00 56.93 55.33 3h4g s PHE 76 Cb -0.12 -2.29 0.00 0.00 -0.34 0.00 0.00 43.02 40.27 3h4g s PHE 76 CO 0.01 -0.51 -0.16 0.08 -1.46 0.00 0.00 175.22 173.19 3h4g s VAL 77 N 1.56 2.56 -0.13 3.12 1.01 -1.26 -1.13 120.40 126.13 3h4g s VAL 77 Ca 0.04 -0.79 -0.03 0.00 0.00 0.00 0.00 61.98 61.19 3h4g s VAL 77 Cb -0.17 -2.09 -0.03 0.00 0.00 0.00 0.00 36.38 34.09 3h4g s VAL 77 CO 0.04 0.51 0.00 -0.89 0.00 0.00 0.00 175.10 174.76 3h4g s THR 78 N 1.01 4.27 0.37 3.92 2.01 -0.62 -1.67 115.64 124.92 3h4g s THR 78 Ca -0.02 -0.24 0.04 0.00 0.31 0.00 0.00 61.69 61.78 3h4g s THR 78 Cb -0.15 -2.84 -0.01 0.00 0.01 0.00 0.00 72.50 69.51 3h4g s THR 78 CO -0.04 0.54 0.13 -0.24 -0.69 0.00 0.00 174.62 174.33 3h4g n SER 79 N 2.86 1.18 -3.88 3.53 2.88 -0.74 -0.46 113.62 118.99 3h4g n SER 79 Ca -0.18 -2.97 -0.12 0.00 -1.33 0.00 0.00 58.87 54.28 3h4g n SER 79 Cb 0.53 0.95 -0.13 0.00 -0.75 0.00 0.00 64.21 64.81 3h4g n SER 79 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 3h4g s LYS 80 N -3.41 0.14 -0.20 -1.46 1.02 -1.25 -1.47 119.74 113.11 3h4g s LYS 80 Ca 0.19 -0.08 -0.26 0.00 0.02 0.00 0.00 55.97 55.83 3h4g s LYS 80 Cb 0.01 0.06 -0.00 0.00 -0.52 0.00 0.00 37.83 37.37 3h4g s LYS 80 CO 0.13 -0.02 0.90 -1.17 -0.92 0.00 0.00 175.35 174.27 3h4g s LEU 81 N -0.34 4.13 0.62 3.17 2.96 0.97 -3.77 118.68 126.42 3h4g s LEU 81 Ca -0.04 1.22 -0.13 0.00 -0.22 0.00 0.00 54.13 54.96 3h4g s LEU 81 Cb -0.03 -3.33 -0.03 0.00 0.50 0.00 0.00 46.19 43.30 3h4g s LEU 81 CO 0.00 -0.51 1.04 0.86 -1.32 0.00 0.00 176.35 176.41 3h4g s TRP 82 N 2.64 3.31 0.50 5.38 -0.11 -1.26 -2.05 118.94 127.36 3h4g s TRP 82 Ca 0.40 1.40 0.20 0.00 1.22 0.00 0.00 56.10 59.32 3h4g s TRP 82 Cb -0.16 -2.84 1.27 0.00 -1.50 0.00 0.00 33.47 30.24 3h4g s TRP 82 CO 0.10 -0.89 2.03 -0.91 -4.62 0.00 0.00 176.95 172.66 3h4g h ASN 83 N -0.11 0.10 0.20 5.86 2.35 -1.91 -0.02 115.58 122.05 3h4g h ASN 83 Ca -0.45 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.30 3h4g h ASN 83 Cb 1.20 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 39.55 3h4g h ASN 83 CO 0.59 0.06 0.00 0.35 -1.65 0.00 0.00 177.43 176.78 3h4g n THR 84 N -4.44 0.08 -1.24 2.81 -2.24 -1.26 -1.02 114.28 106.97 3h4g n THR 84 Ca 0.07 0.02 0.05 0.00 -2.27 0.00 0.00 64.05 61.92 3h4g n THR 84 Cb 0.42 -0.61 0.20 0.00 -2.10 0.00 0.00 70.33 68.24 3h4g n THR 84 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3h4g n LYS 85 N -1.12 1.90 0.21 -0.78 4.76 -0.02 -4.34 118.16 118.77 3h4g n LYS 85 Ca 0.16 -2.93 0.10 0.00 -2.87 0.00 0.00 58.31 52.77 3h4g n LYS 85 Cb 0.14 -1.69 0.29 0.00 -1.84 0.00 0.00 35.03 31.93 3h4g n LYS 85 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 3h4g h HIS 86 N 0.90 0.00 -2.92 2.13 3.86 -1.70 -3.34 115.15 114.08 3h4g h HIS 86 Ca 0.06 0.00 -0.52 0.00 -1.16 0.00 0.00 60.37 58.74 3h4g h HIS 86 Cb 1.28 0.00 0.05 0.00 1.06 0.00 0.00 27.41 29.80 3h4g h HIS 86 CO 0.53 0.19 0.89 -1.58 0.86 0.00 0.00 177.93 178.82 3h4g s HIS 87 N -3.34 3.00 0.36 2.45 5.04 -1.26 -4.35 115.29 117.19 3h4g s HIS 87 Ca 0.04 0.64 0.18 0.00 -1.54 0.00 0.00 55.06 54.38 3h4g s HIS 87 Cb 0.08 -3.97 1.17 0.00 0.04 0.00 0.00 32.58 29.90 3h4g s HIS 87 CO 0.66 -3.51 1.66 -1.35 -2.34 0.00 0.00 174.74 169.86 3h4g h PRO 88 N 6.36 0.25 0.00 2.88 0.11 -1.86 0.16 132.00 139.90 3h4g h PRO 88 Ca -0.44 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3h4g h PRO 88 Cb 1.21 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.26 3h4g h PRO 88 CO 0.89 0.17 0.00 1.05 -0.21 0.00 0.00 178.00 179.90 3h4g h GLU 89 N 0.26 0.00 0.00 1.05 4.11 -1.94 -3.06 114.58 115.00 3h4g h GLU 89 Ca 0.75 0.00 0.00 0.00 0.07 0.00 0.00 59.36 60.18 3h4g h GLU 89 Cb 1.86 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.11 3h4g h GLU 89 CO -0.57 0.00 -0.89 -0.25 0.07 0.00 0.00 179.01 177.37 3h4g n ASP 90 N -2.71 0.64 0.14 3.06 8.00 0.56 -4.53 116.55 121.70 3h4g n ASP 90 Ca 0.02 -0.30 -0.14 0.00 0.71 0.00 0.00 54.79 55.09 3h4g n ASP 90 Cb 0.33 0.67 -0.08 0.00 -0.02 0.00 0.00 41.12 42.02 3h4g n ASP 90 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 3h4g h VAL 91 N 0.00 0.81 -0.34 2.53 2.07 -1.41 -1.89 116.25 118.03 3h4g h VAL 91 Ca 0.00 -0.48 -0.00 0.00 0.82 0.00 0.00 66.70 67.04 3h4g h VAL 91 Cb 0.65 1.08 -0.02 0.00 -1.52 0.00 0.00 31.29 31.48 3h4g h VAL 91 CO 0.00 0.10 0.21 -0.08 0.02 0.00 0.00 177.57 177.82 3h4g h GLU 92 N -0.59 0.46 -0.94 1.57 4.81 -1.80 -1.61 114.58 116.49 3h4g h GLU 92 Ca -0.03 -0.04 0.07 0.00 -0.13 0.00 0.00 59.36 59.23 3h4g h GLU 92 Cb 0.43 -0.10 -0.06 0.00 0.63 0.00 0.00 28.75 29.64 3h4g h GLU 92 CO 0.06 0.34 0.61 -1.35 -0.73 0.00 0.00 179.01 177.94 3h4g h PRO 93 N 0.45 1.03 -0.15 0.92 0.11 -1.79 0.03 132.00 132.59 3h4g h PRO 93 Ca 0.12 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 66.16 3h4g h PRO 93 Cb -0.00 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 30.87 3h4g h PRO 93 CO -0.02 0.68 0.07 0.00 -0.21 0.00 0.00 178.00 178.52 3h4g h ALA 94 N 1.50 0.19 -0.45 -0.75 0.00 -0.98 -1.33 119.26 117.44 3h4g h ALA 94 Ca 0.41 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.21 3h4g h ALA 94 Cb 0.22 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 3h4g h ALA 94 CO -0.16 -0.23 0.20 1.25 0.00 0.00 0.00 179.25 180.30 3h4g h LEU 95 N 0.10 0.60 -1.40 0.00 5.85 -0.95 -2.29 115.31 117.23 3h4g h LEU 95 Ca 0.05 -0.15 -0.02 0.00 0.84 0.00 0.00 57.88 58.60 3h4g h LEU 95 Cb 0.14 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 3h4g h LEU 95 CO -0.01 0.59 0.20 0.03 -0.34 0.00 0.00 178.44 178.91 3h4g h ARG 96 N 0.58 0.60 -0.28 1.25 3.08 -0.88 0.19 114.38 118.92 3h4g h ARG 96 Ca 0.15 -0.07 -0.04 0.00 0.07 0.00 0.00 59.98 60.09 3h4g h ARG 96 Cb 0.16 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 3h4g h ARG 96 CO -0.02 0.48 0.02 -0.22 -1.07 0.00 0.00 179.97 179.17 3h4g h LYS 97 N 0.60 0.48 -0.28 0.04 3.64 -1.11 -1.20 116.57 118.75 3h4g h LYS 97 Ca 0.15 -0.14 0.03 0.00 -1.27 0.00 0.00 60.65 59.42 3h4g h LYS 97 Cb 0.08 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 31.82 3h4g h LYS 97 CO -0.02 0.61 0.08 1.15 -2.27 0.00 0.00 179.45 179.01 3h4g h THR 98 N 0.28 0.91 -0.81 1.00 2.02 -0.73 0.54 112.91 116.12 3h4g h THR 98 Ca 0.08 -0.07 -0.01 0.00 0.77 0.00 0.00 66.41 67.19 3h4g h THR 98 Cb 0.38 0.69 -0.04 0.00 -1.74 0.00 0.00 68.15 67.44 3h4g h THR 98 CO 0.01 0.04 0.48 -0.07 0.37 0.00 0.00 175.52 176.34 3h4g h LEU 99 N 0.20 0.98 -0.29 2.58 3.38 -0.58 0.64 115.31 122.22 3h4g h LEU 99 Ca 0.12 -0.06 -0.10 0.00 0.09 0.00 0.00 57.88 57.93 3h4g h LEU 99 Cb 0.10 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 3h4g h LEU 99 CO -0.14 0.76 -0.20 0.00 0.09 0.00 0.00 178.44 178.95 3h4g h ALA 100 N 1.40 0.42 -0.36 1.53 0.00 -0.83 0.93 119.26 122.35 3h4g h ALA 100 Ca 0.29 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 3h4g h ALA 100 Cb -0.03 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 3h4g h ALA 100 CO -0.05 0.36 0.20 -0.44 0.00 0.00 0.00 179.25 179.32 3h4g h ASP 101 N 0.40 0.45 0.76 0.00 3.45 -0.61 -2.49 116.42 118.37 3h4g h ASP 101 Ca 0.06 -0.08 0.00 0.00 0.43 0.00 0.00 57.03 57.44 3h4g h ASP 101 Cb 0.74 -0.11 0.00 0.00 -0.56 0.00 0.00 39.33 39.40 3h4g h ASP 101 CO 0.05 0.40 0.00 0.18 -1.57 0.00 0.00 179.24 178.30 3h4g n LEU 102 N -4.77 0.00 -3.72 1.55 4.77 0.19 -3.78 117.00 111.25 3h4g n LEU 102 Ca -0.00 0.45 -0.26 0.00 -0.03 0.00 0.00 56.01 56.17 3h4g n LEU 102 Cb 0.07 -0.45 0.06 0.00 -2.33 0.00 0.00 43.42 40.77 3h4g n LEU 102 CO 0.35 -0.07 0.17 0.00 -1.33 0.00 0.00 177.39 176.51 3h4g n GLN 103 N -1.45 -6.79 -4.44 3.23 6.02 0.16 -4.32 117.38 109.78 3h4g n GLN 103 Ca 0.07 0.73 -0.25 0.00 -0.01 0.00 0.00 57.00 57.54 3h4g n GLN 103 Cb 0.27 -5.69 -0.09 0.00 1.02 0.00 0.00 30.24 25.74 3h4g n GLN 103 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3h4g s LEU 104 N -7.21 2.84 -0.11 1.08 1.43 -0.23 -4.85 118.68 111.63 3h4g s LEU 104 Ca 0.55 -1.07 -0.01 0.00 -1.03 0.00 0.00 54.13 52.57 3h4g s LEU 104 Cb -0.26 -1.19 -0.25 0.00 0.03 0.00 0.00 46.19 44.52 3h4g s LEU 104 CO 0.77 -0.18 0.39 -0.62 0.23 0.00 0.00 176.35 176.95 3h4g n GLU 105 N -0.85 0.72 -3.84 1.70 4.71 -1.26 -4.56 120.64 117.26 3h4g n GLU 105 Ca -0.05 0.26 -0.09 0.00 -0.01 0.00 0.00 57.16 57.27 3h4g n GLU 105 Cb 0.62 -1.71 -0.07 0.00 -1.01 0.00 0.00 31.44 29.27 3h4g n GLU 105 CO 0.00 0.00 0.00 1.52 0.09 0.00 0.00 177.13 178.74 3h4g s TYR 106 N -2.56 0.11 0.06 -0.32 -0.85 -1.26 -4.73 117.35 107.81 3h4g s TYR 106 Ca -0.18 -0.51 0.03 0.00 -0.52 0.00 0.00 57.07 55.88 3h4g s TYR 106 Cb 0.07 -0.03 -0.04 0.00 0.38 0.00 0.00 41.96 42.34 3h4g s TYR 106 CO 0.77 -0.54 0.05 -0.51 -1.52 0.00 0.00 175.55 173.80 3h4g s LEU 107 N -2.78 3.68 0.18 -3.49 1.43 0.04 -4.96 118.68 112.78 3h4g s LEU 107 Ca 0.04 -0.04 0.02 0.00 -1.03 0.00 0.00 54.13 53.12 3h4g s LEU 107 Cb 0.04 -2.32 0.05 0.00 0.03 0.00 0.00 46.19 43.98 3h4g s LEU 107 CO -0.10 0.20 1.42 0.44 0.23 0.00 0.00 176.35 178.53 3h4g h ASP 108 N 3.56 0.28 -3.51 2.29 5.19 -1.66 0.01 116.42 122.58 3h4g h ASP 108 Ca -0.47 -0.21 -0.14 0.00 -0.62 0.00 0.00 57.03 55.58 3h4g h ASP 108 Cb 1.17 -0.09 -0.26 0.00 0.18 0.00 0.00 39.33 40.33 3h4g h ASP 108 CO 0.63 0.98 -0.34 -0.22 -3.12 0.00 0.00 179.24 177.17 3h4g s LEU 109 N -7.58 0.32 -0.10 1.55 2.96 -1.00 -1.84 118.68 112.99 3h4g s LEU 109 Ca -0.03 0.74 0.00 0.00 -0.22 0.00 0.00 54.13 54.62 3h4g s LEU 109 Cb 0.10 1.16 0.02 0.00 0.50 0.00 0.00 46.19 47.98 3h4g s LEU 109 CO 0.82 -0.16 -0.09 -0.47 -1.32 0.00 0.00 176.35 175.13 3h4g s TYR 110 N 0.87 1.52 -0.02 5.38 6.04 -0.50 -1.79 117.35 128.85 3h4g s TYR 110 Ca -0.06 -0.73 0.00 0.00 0.04 0.00 0.00 57.07 56.33 3h4g s TYR 110 Cb -0.06 -1.22 -0.04 0.00 -1.04 0.00 0.00 41.96 39.60 3h4g s TYR 110 CO -0.06 -0.47 0.02 -0.51 -1.54 0.00 0.00 175.55 172.98 3h4g s LEU 111 N 1.45 3.61 -0.20 6.97 1.43 -0.54 -1.35 118.68 130.05 3h4g s LEU 111 Ca 0.00 0.06 -0.29 0.00 -1.03 0.00 0.00 54.13 52.88 3h4g s LEU 111 Cb -0.13 -2.02 -0.00 0.00 0.03 0.00 0.00 46.19 44.07 3h4g s LEU 111 CO -0.06 0.30 1.19 -0.32 0.23 0.00 0.00 176.35 177.70 3h4g s MET 112 N -1.42 4.21 0.16 1.70 -2.45 -0.89 -0.02 119.30 120.59 3h4g s MET 112 Ca 0.19 1.52 -0.12 0.00 -1.25 0.00 0.00 55.69 56.02 3h4g s MET 112 Cb -0.12 -3.74 0.04 0.00 1.25 0.00 0.00 34.83 32.27 3h4g s MET 112 CO 0.09 -0.73 1.65 1.25 1.05 0.00 0.00 175.02 178.33 3h4g h HIS 113 N 8.07 0.93 -3.97 4.11 2.76 -1.68 -1.73 115.15 123.65 3h4g h HIS 113 Ca -0.24 -0.13 -0.15 0.00 -2.20 0.00 0.00 60.37 57.65 3h4g h HIS 113 Cb 1.09 -0.26 -0.19 0.00 1.55 0.00 0.00 27.41 29.60 3h4g h HIS 113 CO 0.79 0.83 -0.65 -1.58 -1.30 0.00 0.00 177.93 176.02 3h4g s TRP 114 N -5.21 0.29 -0.34 5.26 0.52 -1.25 -4.28 118.94 113.91 3h4g s TRP 114 Ca -0.13 -0.60 0.27 0.00 0.02 0.00 0.00 56.10 55.66 3h4g s TRP 114 Cb 0.12 -0.21 0.98 0.00 -1.15 0.00 0.00 33.47 33.21 3h4g s TRP 114 CO 0.81 -0.26 1.79 -1.00 0.02 0.00 0.00 176.95 178.31 3h4g h PRO 115 N 4.16 0.00 -6.25 4.98 0.13 -1.77 -3.46 132.00 129.80 3h4g h PRO 115 Ca -0.32 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.19 3h4g h PRO 115 Cb 1.19 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.23 3h4g h PRO 115 CO 0.47 0.00 -0.61 1.52 -0.23 0.00 0.00 178.00 179.15 3h4g s TYR 116 N -3.37 3.09 0.06 1.56 -0.85 -1.26 -4.36 117.35 112.22 3h4g s TYR 116 Ca 0.05 -0.00 0.01 0.00 -0.52 0.00 0.00 57.07 56.61 3h4g s TYR 116 Cb 0.09 -1.54 -0.04 0.00 0.38 0.00 0.00 41.96 40.85 3h4g s TYR 116 CO 0.51 0.51 0.13 0.00 -1.52 0.00 0.00 175.55 175.18 3h4g s ALA 117 N -1.51 3.75 0.22 9.51 0.00 -1.26 -4.77 121.76 127.70 3h4g s ALA 117 Ca 0.29 -0.92 0.06 0.00 0.00 0.00 0.00 51.96 51.39 3h4g s ALA 117 Cb -0.11 -1.62 -0.04 0.00 0.00 0.00 0.00 23.12 21.36 3h4g s ALA 117 CO 0.21 0.77 0.19 -0.06 0.00 0.00 0.00 175.76 176.87 3h4g s PHE 118 N -1.41 3.15 0.16 0.00 2.99 -0.19 -1.37 117.98 121.31 3h4g s PHE 118 Ca 0.31 -0.07 -0.33 0.00 0.00 0.00 0.00 56.93 56.83 3h4g s PHE 118 Cb -0.12 -1.45 -0.16 0.00 0.00 0.00 0.00 43.02 41.28 3h4g s PHE 118 CO 0.23 0.52 1.13 -1.91 -0.00 0.00 0.00 175.22 175.18 3h4g n GLU 119 N -0.91 1.02 -1.85 0.44 2.13 -0.18 -4.25 120.64 117.04 3h4g n GLU 119 Ca -0.08 0.36 -0.38 0.00 0.66 0.00 0.00 57.16 57.73 3h4g n GLU 119 Cb 0.57 -1.84 0.04 0.00 0.27 0.00 0.00 31.44 30.48 3h4g n GLU 119 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 3h4g s ARG 120 N -0.37 3.08 0.00 5.31 0.52 -1.26 -4.70 118.95 121.53 3h4g s ARG 120 Ca 0.74 2.11 0.00 0.00 -0.52 0.00 0.00 55.73 58.07 3h4g s ARG 120 Cb -0.89 -2.16 0.00 0.00 0.52 0.00 0.00 34.95 32.42 3h4g s ARG 120 CO 0.53 -1.20 0.00 0.41 0.02 0.00 0.00 175.30 175.06 3h4g n GLY 121 N 0.71 0.55 1.12 -3.53 0.00 -1.26 -4.92 105.19 97.85 3h4g n GLY 121 Ca 0.11 -1.76 0.10 0.00 0.00 0.00 0.00 46.02 44.47 3h4g n GLY 121 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3h4g n ASP 122 N 2.35 3.55 -4.53 1.61 9.92 -1.26 -4.82 116.55 123.36 3h4g n ASP 122 Ca 0.00 -1.98 -0.41 0.00 -0.53 0.00 0.00 54.79 51.87 3h4g n ASP 122 Cb 0.00 -0.36 -0.09 0.00 -0.64 0.00 0.00 41.12 40.03 3h4g n ASP 122 CO 0.00 0.00 0.00 0.21 0.13 0.00 0.00 177.20 177.54 3h4g s ASN 123 N -1.10 6.22 0.54 -2.24 3.84 -1.26 -4.96 114.94 115.98 3h4g s ASN 123 Ca 0.40 -0.27 0.28 0.00 0.21 0.00 0.00 52.86 53.47 3h4g s ASN 123 Cb 0.21 -2.23 1.54 0.00 -0.55 0.00 0.00 41.25 40.23 3h4g s ASN 123 CO 0.28 -0.44 2.11 1.55 -2.79 0.00 0.00 177.10 177.81 3h4g h PRO 124 N 8.53 0.00 -2.45 0.43 0.13 -1.95 -3.25 132.00 133.44 3h4g h PRO 124 Ca -0.28 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.25 3h4g h PRO 124 Cb 1.13 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.86 3h4g h PRO 124 CO 0.74 0.09 -0.79 1.19 -0.23 0.00 0.00 178.00 179.00 3h4g n PHE 125 N -3.66 1.54 -2.20 1.56 3.72 -1.26 -4.74 117.46 112.42 3h4g n PHE 125 Ca -0.02 -3.86 -0.42 0.00 -0.05 0.00 0.00 57.45 53.10 3h4g n PHE 125 Cb 0.20 -0.33 -0.03 0.00 -0.94 0.00 0.00 39.48 38.39 3h4g n PHE 125 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 3h4g s PRO 126 N -1.29 4.31 0.16 -1.08 0.04 -1.23 -4.97 135.00 130.94 3h4g s PRO 126 Ca 0.33 2.03 -0.05 0.00 0.04 0.00 0.00 61.00 63.34 3h4g s PRO 126 Cb 0.07 -3.39 -0.02 0.00 0.04 0.00 0.00 34.50 31.20 3h4g s PRO 126 CO -0.12 -0.49 0.18 -1.59 0.04 0.00 0.00 177.00 175.02 3h4g s LYS 127 N 1.63 1.08 0.61 4.56 -2.85 -1.26 -0.31 119.74 123.20 3h4g s LYS 127 Ca 0.64 -1.33 -0.00 0.00 -1.00 0.00 0.00 55.97 54.28 3h4g s LYS 127 Cb -0.34 0.32 0.06 0.00 -2.06 0.00 0.00 37.83 35.80 3h4g s LYS 127 CO 0.29 -0.36 0.85 -0.80 0.10 0.00 0.00 175.35 175.43 3h4g s ASN 128 N -3.02 5.02 0.21 0.03 0.01 0.55 -4.81 114.94 112.92 3h4g s ASN 128 Ca 0.22 -0.03 0.16 0.00 -0.71 0.00 0.00 52.86 52.51 3h4g s ASN 128 Cb 0.05 -0.72 0.82 0.00 0.41 0.00 0.00 41.25 41.81 3h4g s ASN 128 CO 0.02 -1.36 1.50 0.00 -1.51 0.00 0.00 177.10 175.76 3h4g n ALA 129 N -2.52 1.21 0.26 0.60 0.00 -1.26 -0.63 120.51 118.16 3h4g n ALA 129 Ca 0.09 0.11 0.12 0.00 0.00 0.00 0.00 53.44 53.76 3h4g n ALA 129 Cb 0.60 -1.25 0.03 0.00 0.00 0.00 0.00 19.45 18.83 3h4g n ALA 129 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3h4g n ASP 130 N -2.01 0.75 0.00 0.00 9.92 -1.26 -4.95 116.55 119.00 3h4g n ASP 130 Ca 0.00 0.20 0.00 0.00 -0.53 0.00 0.00 54.79 54.46 3h4g n ASP 130 Cb 0.08 0.51 0.00 0.00 -0.64 0.00 0.00 41.12 41.07 3h4g n ASP 130 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3h4g n GLY 131 N 1.24 0.48 3.78 0.44 0.00 0.19 -5.05 105.19 106.28 3h4g n GLY 131 Ca 0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.68 3h4g n GLY 131 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3h4g s THR 132 N -2.00 3.38 0.31 2.61 -4.23 -1.26 -4.70 115.64 109.76 3h4g s THR 132 Ca 0.00 0.85 -0.27 0.00 -1.18 0.00 0.00 61.69 61.08 3h4g s THR 132 Cb 0.00 -3.34 -0.09 0.00 1.34 0.00 0.00 72.50 70.41 3h4g s THR 132 CO 0.00 -0.20 1.00 -0.63 -0.54 0.00 0.00 174.62 174.25 3h4g s ILE 133 N -1.88 3.91 -0.57 2.99 -1.09 -1.26 -0.33 121.20 122.97 3h4g s ILE 133 Ca 0.71 1.70 -0.26 0.00 -2.23 0.00 0.00 60.65 60.57 3h4g s ILE 133 Cb -0.21 -3.99 0.04 0.00 -1.58 0.00 0.00 42.46 36.71 3h4g s ILE 133 CO 0.25 0.24 1.03 -0.13 -1.23 0.00 0.00 174.94 175.11 3h4g s ARG 134 N -1.82 3.39 0.63 2.79 0.52 0.58 -4.81 118.95 120.21 3h4g s ARG 134 Ca 0.49 -0.10 -0.07 0.00 -0.52 0.00 0.00 55.73 55.53 3h4g s ARG 134 Cb -0.24 -4.05 0.02 0.00 0.52 0.00 0.00 34.95 31.20 3h4g s ARG 134 CO 0.30 -1.57 0.95 0.71 0.02 0.00 0.00 175.30 175.71 3h4g s TYR 135 N 4.32 3.20 0.06 -0.53 2.02 -1.26 -1.01 117.35 124.16 3h4g s TYR 135 Ca 0.35 0.66 0.06 0.00 -0.37 0.00 0.00 57.07 57.77 3h4g s TYR 135 Cb -0.11 -2.87 -0.03 0.00 -0.40 0.00 0.00 41.96 38.56 3h4g s TYR 135 CO 0.21 -0.98 -0.18 0.34 -1.57 0.00 0.00 175.55 173.37 3h4g s ASP 136 N -4.35 2.10 -0.08 2.29 2.15 -0.47 -4.19 116.67 114.11 3h4g s ASP 136 Ca 0.56 -0.56 0.17 0.00 0.43 0.00 0.00 52.55 53.15 3h4g s ASP 136 Cb -0.11 -0.13 0.63 0.00 -0.30 0.00 0.00 42.92 43.02 3h4g s ASP 136 CO 0.46 0.06 1.53 0.00 -0.17 0.00 0.00 175.17 177.04 3h4g n ALA 137 N 1.59 2.91 -1.67 3.66 0.00 -1.26 -3.99 120.51 121.74 3h4g n ALA 137 Ca -0.19 -1.35 -0.47 0.00 0.00 0.00 0.00 53.44 51.43 3h4g n ALA 137 Cb 0.54 -1.01 -0.04 0.00 0.00 0.00 0.00 19.45 18.93 3h4g n ALA 137 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 3h4g n THR 138 N 1.08 0.20 -2.80 0.00 -1.04 -1.26 -4.93 114.28 105.52 3h4g n THR 138 Ca 0.23 -0.04 -0.36 0.00 -2.04 0.00 0.00 64.05 61.84 3h4g n THR 138 Cb 0.76 -1.65 -0.07 0.00 -1.82 0.00 0.00 70.33 67.55 3h4g n THR 138 CO 0.00 0.00 0.00 -2.28 -0.64 0.00 0.00 175.07 172.15 3h4g s HIS 139 N 1.96 3.62 0.44 -1.42 2.46 -1.26 -4.54 115.29 116.56 3h4g s HIS 139 Ca 0.83 1.74 0.31 0.00 0.47 0.00 0.00 55.06 58.41 3h4g s HIS 139 Cb -0.68 -2.90 1.66 0.00 -0.13 0.00 0.00 32.58 30.53 3h4g s HIS 139 CO 0.42 0.16 2.14 0.10 -2.47 0.00 0.00 174.74 175.09 3h4g h TYR 140 N 2.95 0.00 -0.24 3.88 -0.00 -1.92 -1.86 116.97 119.79 3h4g h TYR 140 Ca -0.47 0.00 -0.11 0.00 -0.00 0.00 0.00 58.73 58.15 3h4g h TYR 140 Cb 1.19 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 37.91 3h4g h TYR 140 CO 0.62 0.07 -0.30 0.87 -0.00 0.00 0.00 178.16 179.42 3h4g h LYS 141 N 0.00 0.48 -0.38 0.10 1.57 -1.95 0.31 116.57 116.72 3h4g h LYS 141 Ca -0.00 -0.20 -0.11 0.00 -1.87 0.00 0.00 60.65 58.46 3h4g h LYS 141 Cb 0.26 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 3h4g h LYS 141 CO 0.01 0.74 -0.21 -0.44 -0.57 0.00 0.00 179.45 178.97 3h4g h ASP 142 N 0.42 0.83 -0.67 0.86 3.45 -1.74 -2.91 116.42 116.66 3h4g h ASP 142 Ca 0.05 -0.42 -0.06 0.00 0.43 0.00 0.00 57.03 57.03 3h4g h ASP 142 Cb 0.74 -0.23 -0.03 0.00 -0.56 0.00 0.00 39.33 39.25 3h4g h ASP 142 CO 0.06 1.07 0.17 0.74 -1.57 0.00 0.00 179.24 179.70 3h4g h THR 143 N 0.60 1.26 -0.52 0.35 2.02 -1.28 -2.97 112.91 112.37 3h4g h THR 143 Ca 0.08 -0.95 0.05 0.00 0.77 0.00 0.00 66.41 66.37 3h4g h THR 143 Cb 0.77 0.59 -0.05 0.00 -1.74 0.00 0.00 68.15 67.72 3h4g h THR 143 CO 0.06 0.36 0.25 -0.25 0.37 0.00 0.00 175.52 176.31 3h4g h TRP 144 N 1.00 0.45 -0.17 3.16 2.91 -0.86 -0.03 115.95 122.41 3h4g h TRP 144 Ca 0.21 0.02 -0.07 0.00 1.13 0.00 0.00 58.89 60.19 3h4g h TRP 144 Cb 0.36 -0.13 -0.01 0.00 -0.51 0.00 0.00 29.16 28.87 3h4g h TRP 144 CO 0.03 0.21 -0.19 0.87 -1.03 0.00 0.00 178.44 178.32 3h4g h LYS 145 N 0.48 0.29 -0.40 2.65 1.79 -1.44 -0.57 116.57 119.38 3h4g h LYS 145 Ca 0.24 -0.09 -0.04 0.00 -2.18 0.00 0.00 60.65 58.58 3h4g h LYS 145 Cb 0.18 -0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 30.78 3h4g h LYS 145 CO -0.18 0.48 0.09 0.00 -1.08 0.00 0.00 179.45 178.76 3h4g h ALA 146 N 1.53 0.53 -0.55 3.86 0.00 -1.22 -2.93 119.26 120.48 3h4g h ALA 146 Ca 0.05 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 3h4g h ALA 146 Cb 0.50 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 3h4g h ALA 146 CO 0.03 0.22 0.34 -0.07 0.00 0.00 0.00 179.25 179.77 3h4g h LEU 147 N 0.51 0.64 -1.33 0.00 3.38 -0.25 -2.64 115.31 115.63 3h4g h LEU 147 Ca 0.12 -0.03 -0.04 0.00 0.09 0.00 0.00 57.88 58.03 3h4g h LEU 147 Cb 0.33 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 3h4g h LEU 147 CO 0.00 0.49 0.04 -0.33 0.09 0.00 0.00 178.44 178.73 3h4g h GLU 148 N 0.75 0.49 0.00 1.13 5.08 -0.95 -1.87 114.58 119.21 3h4g h GLU 148 Ca 0.20 -0.09 -0.01 0.00 -1.00 0.00 0.00 59.36 58.46 3h4g h GLU 148 Cb -0.04 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.13 3h4g h GLU 148 CO -0.04 0.49 -0.07 0.00 -1.00 0.00 0.00 179.01 178.39 3h4g h ALA 149 N 1.57 1.46 -0.08 3.43 0.00 -1.37 -2.38 119.26 121.88 3h4g h ALA 149 Ca 0.11 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.84 3h4g h ALA 149 Cb 0.25 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 3h4g h ALA 149 CO 0.00 0.08 -0.46 -0.07 0.00 0.00 0.00 179.25 178.81 3h4g h LEU 150 N 0.00 0.22 -0.33 0.00 3.38 -1.39 -2.38 115.31 114.80 3h4g h LEU 150 Ca -0.00 -0.10 -0.11 0.00 0.09 0.00 0.00 57.88 57.76 3h4g h LEU 150 Cb 0.17 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 3h4g h LEU 150 CO 0.01 0.65 -0.22 0.58 0.09 0.00 0.00 178.44 179.55 3h4g h VAL 151 N 0.17 1.29 0.00 1.22 2.07 -1.49 -1.90 116.25 117.61 3h4g h VAL 151 Ca 0.01 -1.36 -0.02 0.00 0.82 0.00 0.00 66.70 66.15 3h4g h VAL 151 Cb 0.88 1.45 -0.00 0.00 -1.52 0.00 0.00 31.29 32.10 3h4g h VAL 151 CO 0.07 0.44 -0.08 0.00 0.02 0.00 0.00 177.57 178.03 3h4g h ALA 152 N 0.76 1.56 -0.01 1.67 0.00 -1.41 -1.78 119.26 120.05 3h4g h ALA 152 Ca 0.07 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3h4g h ALA 152 Cb 0.78 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.56 3h4g h ALA 152 CO 0.06 0.10 -0.00 1.63 0.00 0.00 0.00 179.25 181.04 3h4g n LYS 153 N -4.00 1.45 -1.34 0.00 5.02 -0.91 -4.93 118.16 113.46 3h4g n LYS 153 Ca -0.03 -0.66 -0.09 0.00 -2.02 0.00 0.00 58.31 55.51 3h4g n LYS 153 Cb 0.17 -1.49 -0.04 0.00 -0.02 0.00 0.00 35.03 33.65 3h4g n LYS 153 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3h4g n GLY 154 N 1.12 0.98 0.09 0.72 0.00 -0.67 -4.91 105.19 102.52 3h4g n GLY 154 Ca 0.20 -0.62 0.03 0.00 0.00 0.00 0.00 46.02 45.64 3h4g n GLY 154 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3h4g n LEU 155 N -1.05 0.62 -3.81 0.99 4.77 -0.73 -4.73 117.00 113.05 3h4g n LEU 155 Ca -0.09 0.26 -0.13 0.00 -0.03 0.00 0.00 56.01 56.03 3h4g n LEU 155 Cb 0.32 0.08 -0.13 0.00 -2.33 0.00 0.00 43.42 41.37 3h4g n LEU 155 CO 0.14 0.09 -0.20 0.68 -1.33 0.00 0.00 177.39 176.77 3h4g s VAL 156 N -3.06 -0.01 -0.01 4.08 -7.23 -1.21 -0.78 120.40 112.18 3h4g s VAL 156 Ca -0.04 0.02 -0.12 0.00 -1.81 0.00 0.00 61.98 60.03 3h4g s VAL 156 Cb 0.09 -0.22 -0.33 0.00 0.56 0.00 0.00 36.38 36.49 3h4g s VAL 156 CO 0.83 0.01 0.83 0.03 -0.31 0.00 0.00 175.10 176.48 3h4g h ARG 157 N 6.07 0.44 -3.94 4.82 2.47 -1.10 -3.37 114.38 119.76 3h4g h ARG 157 Ca -0.27 -0.76 -0.15 0.00 -1.26 0.00 0.00 59.98 57.54 3h4g h ARG 157 Cb 1.19 0.28 -0.20 0.00 -1.65 0.00 0.00 29.97 29.60 3h4g h ARG 157 CO 0.42 1.35 -0.65 0.00 0.56 0.00 0.00 179.97 181.65 3h4g s ALA 158 N -2.59 0.11 0.21 0.04 0.00 -0.77 -5.01 121.76 113.75 3h4g s ALA 158 Ca -0.12 -0.62 0.10 0.00 0.00 0.00 0.00 51.96 51.31 3h4g s ALA 158 Cb 0.05 0.17 -0.04 0.00 0.00 0.00 0.00 23.12 23.30 3h4g s ALA 158 CO 0.89 -0.21 -0.10 -0.51 0.00 0.00 0.00 175.76 175.83 3h4g s LEU 159 N -1.74 2.94 0.00 0.00 1.43 -1.26 -1.40 118.68 118.65 3h4g s LEU 159 Ca -0.11 -0.67 -0.05 0.00 -1.03 0.00 0.00 54.13 52.27 3h4g s LEU 159 Cb -0.06 -1.57 0.02 0.00 0.03 0.00 0.00 46.19 44.61 3h4g s LEU 159 CO -0.02 0.07 0.30 0.61 0.23 0.00 0.00 176.35 177.54 3h4g n GLY 160 N -0.25 1.85 3.20 -3.19 0.00 -0.46 -0.39 105.19 105.95 3h4g n GLY 160 Ca -0.09 -1.21 -0.23 0.00 0.00 0.00 0.00 46.02 44.49 3h4g n GLY 160 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h4g s LEU 161 N 0.00 2.17 -0.05 0.99 1.43 -0.35 -2.09 118.68 120.78 3h4g s LEU 161 Ca 0.08 -0.50 0.02 0.00 -1.03 0.00 0.00 54.13 52.71 3h4g s LEU 161 Cb -0.02 -0.79 0.01 0.00 0.03 0.00 0.00 46.19 45.43 3h4g s LEU 161 CO 0.06 0.09 -0.11 -0.55 0.23 0.00 0.00 176.35 176.07 3h4g s SER 162 N -1.18 1.61 -1.31 2.29 0.15 -0.65 -0.49 113.70 114.12 3h4g s SER 162 Ca 0.05 -0.26 -0.05 0.00 0.70 0.00 0.00 55.95 56.39 3h4g s SER 162 Cb -0.08 -0.69 0.01 0.00 -1.71 0.00 0.00 66.02 63.54 3h4g s SER 162 CO 0.02 0.04 0.60 0.59 1.20 0.00 0.00 173.24 175.68 3h4g n ASN 163 N 3.72 -5.52 -4.87 5.45 3.02 -0.51 -3.92 115.26 112.62 3h4g n ASN 163 Ca -0.22 -0.28 -0.34 0.00 -0.03 0.00 0.00 54.58 53.71 3h4g n ASN 163 Cb 0.52 -4.32 -0.05 0.00 -0.61 0.00 0.00 39.78 35.31 3h4g n ASN 163 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3h4g s PHE 164 N -3.12 3.49 0.74 3.10 2.99 -1.26 -4.40 117.98 119.52 3h4g s PHE 164 Ca 0.30 0.34 -0.08 0.00 0.00 0.00 0.00 56.93 57.49 3h4g s PHE 164 Cb -0.13 -1.82 0.07 0.00 0.00 0.00 0.00 43.02 41.14 3h4g s PHE 164 CO 0.37 0.63 1.06 -1.54 -0.00 0.00 0.00 175.22 175.74 3h4g s SER 165 N -1.80 4.67 0.24 1.36 1.04 -1.26 -4.86 113.70 113.09 3h4g s SER 165 Ca 0.25 0.50 -0.06 0.00 0.48 0.00 0.00 55.95 57.11 3h4g s SER 165 Cb -0.12 -1.08 0.24 0.00 0.10 0.00 0.00 66.02 65.15 3h4g s SER 165 CO 0.16 -1.72 1.89 0.77 0.98 0.00 0.00 173.24 175.33 3h4g h SER 166 N -0.74 1.15 -0.57 7.02 4.64 -1.94 -0.10 113.55 123.01 3h4g h SER 166 Ca -0.45 -0.06 -0.01 0.00 -0.47 0.00 0.00 61.79 60.80 3h4g h SER 166 Cb 1.31 -0.29 -0.03 0.00 -0.31 0.00 0.00 62.40 63.09 3h4g h SER 166 CO 0.60 0.87 0.30 0.03 -0.87 0.00 0.00 176.83 177.76 3h4g h ARG 167 N 1.32 0.80 -0.53 4.77 3.08 -1.98 -1.30 114.38 120.54 3h4g h ARG 167 Ca 0.34 -0.10 -0.12 0.00 0.07 0.00 0.00 59.98 60.17 3h4g h ARG 167 Cb -0.07 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 29.81 3h4g h ARG 167 CO -0.07 0.63 -0.14 1.96 -1.07 0.00 0.00 179.97 181.28 3h4g h GLN 168 N 0.76 1.03 -0.20 0.04 4.20 -1.82 -0.85 115.11 118.27 3h4g h GLN 168 Ca 0.20 -0.40 0.02 0.00 0.06 0.00 0.00 58.65 58.53 3h4g h GLN 168 Cb 0.07 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.77 3h4g h GLN 168 CO -0.03 1.09 0.05 0.82 -0.67 0.00 0.00 178.83 180.09 3h4g h ILE 169 N 0.90 0.93 -0.75 2.54 2.04 -0.92 -0.45 117.51 121.80 3h4g h ILE 169 Ca 0.13 -0.05 0.01 0.00 1.00 0.00 0.00 64.86 65.96 3h4g h ILE 169 Cb 0.72 0.77 -0.04 0.00 -0.74 0.00 0.00 36.82 37.54 3h4g h ILE 169 CO 0.06 0.03 0.49 0.44 0.00 0.00 0.00 178.15 179.17 3h4g h ASP 170 N 0.14 0.84 -0.14 1.72 5.19 -1.05 -0.40 116.42 122.73 3h4g h ASP 170 Ca 0.09 -0.02 -0.01 0.00 -0.62 0.00 0.00 57.03 56.47 3h4g h ASP 170 Cb 0.07 -0.21 -0.01 0.00 0.18 0.00 0.00 39.33 39.37 3h4g h ASP 170 CO -0.11 0.60 0.05 -0.78 -3.12 0.00 0.00 179.24 175.89 3h4g h ASP 171 N 0.99 0.20 -0.52 6.45 3.58 -0.67 -2.13 116.42 124.32 3h4g h ASP 171 Ca 0.28 -0.18 0.05 0.00 0.42 0.00 0.00 57.03 57.60 3h4g h ASP 171 Cb -0.08 -0.05 -0.05 0.00 1.72 0.00 0.00 39.33 40.87 3h4g h ASP 171 CO -0.07 0.32 0.26 0.58 -2.88 0.00 0.00 179.24 177.46 3h4g h VAL 172 N 0.06 0.95 0.00 2.25 2.07 -0.57 -2.63 116.25 118.37 3h4g h VAL 172 Ca 0.05 -0.17 -0.02 0.00 0.82 0.00 0.00 66.70 67.37 3h4g h VAL 172 Cb 0.19 0.40 -0.00 0.00 -1.52 0.00 0.00 31.29 30.36 3h4g h VAL 172 CO -0.00 0.09 -0.08 -0.07 0.02 0.00 0.00 177.57 177.53 3h4g h LEU 173 N 0.51 0.00 -1.71 2.57 3.38 -0.87 -1.13 115.31 118.06 3h4g h LEU 173 Ca 0.23 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.20 3h4g h LEU 173 Cb 0.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.89 3h4g h LEU 173 CO -0.16 0.08 0.00 0.77 0.09 0.00 0.00 178.44 179.22 3h4g h SER 174 N 0.00 0.00 0.00 -0.43 4.64 -1.00 -3.18 113.55 113.59 3h4g h SER 174 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3h4g h SER 174 Cb 0.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 3h4g h SER 174 CO 0.01 0.00 0.00 1.33 -0.87 0.00 0.00 176.83 177.30 3h4g n VAL 175 N -2.93 0.00 -2.41 0.95 0.24 -0.70 -5.06 118.33 108.42 3h4g n VAL 175 Ca -0.00 -0.46 -0.43 0.00 -2.04 0.00 0.00 64.34 61.41 3h4g n VAL 175 Cb 0.23 1.06 -0.02 0.00 -1.47 0.00 0.00 33.84 33.64 3h4g n VAL 175 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3h4g s ALA 176 N -0.23 3.59 -0.03 2.33 0.00 -0.51 -4.88 121.76 122.03 3h4g s ALA 176 Ca 0.00 0.39 0.02 0.00 0.00 0.00 0.00 51.96 52.37 3h4g s ALA 176 Cb 0.00 -3.66 -0.25 0.00 0.00 0.00 0.00 23.12 19.20 3h4g s ALA 176 CO 0.00 -1.33 0.73 0.77 0.00 0.00 0.00 175.76 175.93 3h4g h SER 177 N 8.53 0.24 -3.58 0.00 0.02 -1.92 -3.42 113.55 113.42 3h4g h SER 177 Ca -0.27 -0.41 -0.66 0.00 -0.84 0.00 0.00 61.79 59.61 3h4g h SER 177 Cb 1.10 -0.08 -0.25 0.00 0.14 0.00 0.00 62.40 63.32 3h4g h SER 177 CO 0.98 1.36 -0.64 -0.69 -1.14 0.00 0.00 176.83 176.70 3h4g s VAL 178 N -2.61 4.00 0.24 2.27 1.01 -1.26 -5.10 120.40 118.96 3h4g s VAL 178 Ca -0.10 -0.44 -0.30 0.00 0.00 0.00 0.00 61.98 61.15 3h4g s VAL 178 Cb 0.07 -2.94 -0.09 0.00 0.00 0.00 0.00 36.38 33.43 3h4g s VAL 178 CO 0.82 0.25 1.08 -0.13 0.00 0.00 0.00 175.10 177.12 3h4g s ARG 179 N 1.54 4.66 0.32 2.72 1.81 -1.26 -4.99 118.95 123.75 3h4g s ARG 179 Ca 0.05 1.73 -0.29 0.00 -1.72 0.00 0.00 55.73 55.50 3h4g s ARG 179 Cb -0.16 -3.23 -0.11 0.00 -0.45 0.00 0.00 34.95 31.01 3h4g s ARG 179 CO 0.02 0.21 1.46 -1.25 -0.68 0.00 0.00 175.30 175.06 3h4g s PRO 180 N -1.07 4.21 0.03 3.54 0.04 -1.26 -4.67 135.00 135.83 3h4g s PRO 180 Ca 0.45 2.43 0.20 0.00 0.04 0.00 0.00 61.00 64.12 3h4g s PRO 180 Cb -0.30 -3.04 -0.19 0.00 0.04 0.00 0.00 34.50 31.01 3h4g s PRO 180 CO 0.38 -0.45 0.66 0.00 0.04 0.00 0.00 177.00 177.63 3h4g n ALA 181 N 1.37 2.32 -3.01 8.56 0.00 0.48 -4.61 120.51 125.61 3h4g n ALA 181 Ca 0.04 -0.56 -0.12 0.00 0.00 0.00 0.00 53.44 52.79 3h4g n ALA 181 Cb 0.40 -0.82 -0.13 0.00 0.00 0.00 0.00 19.45 18.90 3h4g n ALA 181 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3h4g s VAL 182 N -3.18 0.01 -0.16 0.00 1.01 -1.26 -1.21 120.40 115.61 3h4g s VAL 182 Ca -0.05 -0.05 -0.02 0.00 0.00 0.00 0.00 61.98 61.87 3h4g s VAL 182 Cb 0.10 -0.20 -0.01 0.00 0.00 0.00 0.00 36.38 36.27 3h4g s VAL 182 CO 0.84 -0.03 -0.10 -0.22 0.00 0.00 0.00 175.10 175.60 3h4g s LEU 183 N -0.03 2.79 -0.25 3.92 2.96 0.21 -1.21 118.68 127.08 3h4g s LEU 183 Ca -0.01 -0.35 -0.05 0.00 -0.22 0.00 0.00 54.13 53.50 3h4g s LEU 183 Cb -0.01 -1.66 -0.01 0.00 0.50 0.00 0.00 46.19 45.01 3h4g s LEU 183 CO 0.00 0.10 0.02 -1.58 -1.32 0.00 0.00 176.35 173.57 3h4g s GLN 184 N 0.74 3.39 0.05 1.98 0.74 0.36 -0.73 119.66 126.19 3h4g s GLN 184 Ca -0.04 -0.64 -0.04 0.00 0.05 0.00 0.00 55.36 54.69 3h4g s GLN 184 Cb -0.15 -3.18 -0.02 0.00 1.10 0.00 0.00 33.01 30.76 3h4g s GLN 184 CO 0.02 -0.25 0.05 0.14 -0.55 0.00 0.00 175.29 174.70 3h4g s VAL 185 N 1.52 0.17 0.20 1.34 -7.23 -0.71 -1.42 120.40 114.26 3h4g s VAL 185 Ca 0.05 -1.38 -0.32 0.00 -1.81 0.00 0.00 61.98 58.51 3h4g s VAL 185 Cb -0.15 -1.18 -0.13 0.00 0.56 0.00 0.00 36.38 35.48 3h4g s VAL 185 CO -0.00 -0.76 1.65 1.21 -0.31 0.00 0.00 175.10 176.89 3h4g n GLU 186 N 0.41 2.54 -3.64 4.82 2.13 -1.26 -0.77 120.64 124.87 3h4g n GLU 186 Ca -0.17 0.92 -0.08 0.00 0.66 0.00 0.00 57.16 58.49 3h4g n GLU 186 Cb 0.60 -2.72 -0.07 0.00 0.27 0.00 0.00 31.44 29.52 3h4g n GLU 186 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3h4g s HIS 188 N 1.35 -0.04 0.59 0.00 -3.43 -1.05 -4.14 115.29 108.58 3h4g s HIS 188 Ca -0.08 -0.10 0.29 0.00 -0.80 0.00 0.00 55.06 54.37 3h4g s HIS 188 Cb -0.05 0.56 1.48 0.00 -1.43 0.00 0.00 32.58 33.14 3h4g s HIS 188 CO -0.15 -0.36 1.89 -1.35 -2.00 0.00 0.00 174.74 172.77 3h4g h PRO 189 N 2.00 0.00 0.00 -0.38 0.11 -1.89 -0.35 132.00 131.49 3h4g h PRO 189 Ca -0.29 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.71 3h4g h PRO 189 Cb 1.20 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.30 3h4g h PRO 189 CO 0.29 0.00 -0.54 1.88 -0.21 0.00 0.00 178.00 179.42 3h4g h TYR 190 N 0.00 0.00 -2.47 0.65 0.05 -1.90 -2.01 116.97 111.29 3h4g h TYR 190 Ca 0.21 0.00 -0.59 0.00 0.05 0.00 0.00 58.73 58.39 3h4g h TYR 190 Cb 1.17 0.00 -0.40 0.00 1.01 0.00 0.00 36.73 38.51 3h4g h TYR 190 CO 0.00 0.54 -0.86 -0.11 -1.05 0.00 0.00 178.16 176.68 3h4g n LEU 191 N -3.23 0.97 0.27 3.88 7.94 -0.17 -1.20 117.00 125.45 3h4g n LEU 191 Ca 0.02 -4.76 0.16 0.00 -1.11 0.00 0.00 56.01 50.32 3h4g n LEU 191 Cb 0.75 0.10 0.66 0.00 0.53 0.00 0.00 43.42 45.46 3h4g n LEU 191 CO 0.41 1.89 0.96 0.00 -1.11 0.00 0.00 177.39 179.54 3h4g h ALA 192 N 5.14 1.02 -4.32 1.96 0.00 -1.67 -2.79 119.26 118.60 3h4g h ALA 192 Ca 0.20 -0.04 -0.37 0.00 0.00 0.00 0.00 54.91 54.69 3h4g h ALA 192 Cb 0.84 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 3h4g h ALA 192 CO 0.52 0.06 -0.53 1.04 0.00 0.00 0.00 179.25 180.35 3h4g n GLN 193 N -3.18 -3.48 -0.23 0.00 1.13 -1.26 -4.82 117.38 105.55 3h4g n GLN 193 Ca 0.00 0.77 -0.02 0.00 -1.94 0.00 0.00 57.00 55.82 3h4g n GLN 193 Cb 0.32 -5.51 0.10 0.00 0.11 0.00 0.00 30.24 25.25 3h4g n GLN 193 CO 0.00 0.00 0.00 -0.91 -1.44 0.00 0.00 177.06 174.71 3h4g h ASN 194 N -0.79 0.53 -0.11 1.08 2.35 -2.00 -0.20 115.58 116.46 3h4g h ASN 194 Ca -0.46 0.03 -0.18 0.00 -0.55 0.00 0.00 56.30 55.14 3h4g h ASN 194 Cb 1.32 -0.07 0.01 0.00 0.05 0.00 0.00 38.32 39.63 3h4g h ASN 194 CO 0.52 0.34 -0.65 -0.33 -1.65 0.00 0.00 177.43 175.66 3h4g h GLU 195 N 0.66 0.63 -0.72 0.81 4.39 -1.99 -1.88 114.58 116.48 3h4g h GLU 195 Ca 0.30 -0.53 -0.01 0.00 0.34 0.00 0.00 59.36 59.45 3h4g h GLU 195 Cb 0.19 0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 28.92 3h4g h GLU 195 CO -0.19 1.15 0.41 1.25 -1.16 0.00 0.00 179.01 180.48 3h4g h LEU 196 N 0.28 0.88 -0.02 1.33 5.85 -1.90 -0.90 115.31 120.81 3h4g h LEU 196 Ca -0.05 -0.08 -0.00 0.00 0.84 0.00 0.00 57.88 58.59 3h4g h LEU 196 Cb 1.30 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 42.10 3h4g h LEU 196 CO 0.13 0.71 0.01 0.40 -0.34 0.00 0.00 178.44 179.36 3h4g h ILE 197 N 0.98 1.04 -0.95 4.05 2.04 -0.94 -0.42 117.51 123.30 3h4g h ILE 197 Ca 0.25 -0.10 0.10 0.00 1.00 0.00 0.00 64.86 66.11 3h4g h ILE 197 Cb 0.01 1.06 -0.07 0.00 -0.74 0.00 0.00 36.82 37.08 3h4g h ILE 197 CO -0.04 0.03 0.61 0.00 0.00 0.00 0.00 178.15 178.75 3h4g h ALA 198 N 0.97 1.55 -0.11 1.87 0.00 -1.14 0.24 119.26 122.64 3h4g h ALA 198 Ca 0.01 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 3h4g h ALA 198 Cb 0.04 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 3h4g h ALA 198 CO -0.00 0.25 0.05 1.25 0.00 0.00 0.00 179.25 180.80 3h4g h HIS 199 N 0.98 0.16 -0.76 0.00 -0.00 -0.65 -1.94 115.15 112.94 3h4g h HIS 199 Ca 0.45 -0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.81 3h4g h HIS 199 Cb 0.39 -0.05 -0.04 0.00 -0.00 0.00 0.00 27.41 27.71 3h4g h HIS 199 CO -0.00 0.22 0.49 0.00 -0.00 0.00 0.00 177.93 178.64 3h4g h GLN 201 N 1.04 0.69 0.00 0.00 4.20 -0.79 0.38 115.11 120.62 3h4g h GLN 201 Ca 0.28 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.93 3h4g h GLN 201 Cb -0.10 -0.16 -0.00 0.00 0.30 0.00 0.00 27.48 27.53 3h4g h GLN 201 CO -0.06 0.46 -0.06 0.00 -0.67 0.00 0.00 178.83 178.50 3h4g h ALA 202 N 1.34 1.77 -0.27 3.87 0.00 -1.10 -3.00 119.26 121.88 3h4g h ALA 202 Ca 0.30 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.15 3h4g h ALA 202 Cb 0.16 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3h4g h ALA 202 CO -0.17 0.07 0.00 0.54 0.00 0.00 0.00 179.25 179.69 3h4g n ARG 203 N -4.28 2.06 -0.80 0.00 1.74 -0.60 -4.98 116.66 109.81 3h4g n ARG 203 Ca -0.03 -1.87 0.00 0.00 -0.77 0.00 0.00 57.85 55.18 3h4g n ARG 203 Cb 0.14 -1.33 0.00 0.00 -1.02 0.00 0.00 32.46 30.25 3h4g n ARG 203 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3h4g n GLY 204 N 0.86 0.55 3.77 -0.13 0.00 -0.04 -5.04 105.19 105.15 3h4g n GLY 204 Ca 0.13 -0.44 -0.38 0.00 0.00 0.00 0.00 46.02 45.33 3h4g n GLY 204 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h4g s LEU 205 N 0.00 4.35 0.45 0.99 1.02 -0.24 -4.53 118.68 120.71 3h4g s LEU 205 Ca 0.00 0.79 -0.11 0.00 0.02 0.00 0.00 54.13 54.83 3h4g s LEU 205 Cb 0.00 -2.56 -0.06 0.00 0.02 0.00 0.00 46.19 43.58 3h4g s LEU 205 CO 0.00 0.16 0.83 -1.61 0.02 0.00 0.00 176.35 175.75 3h4g s GLU 206 N -0.09 3.79 -0.12 1.70 0.41 -0.35 -3.93 118.70 120.10 3h4g s GLU 206 Ca 0.23 0.57 -0.00 0.00 -0.41 0.00 0.00 54.97 55.35 3h4g s GLU 206 Cb -0.15 -2.32 -0.02 0.00 -1.78 0.00 0.00 34.13 29.86 3h4g s GLU 206 CO 0.10 -0.13 -0.12 0.08 -0.49 0.00 0.00 175.26 174.70 3h4g s VAL 207 N -2.50 3.19 -0.18 2.63 1.01 -1.26 -0.62 120.40 122.67 3h4g s VAL 207 Ca 0.53 -0.62 -0.05 0.00 0.00 0.00 0.00 61.98 61.84 3h4g s VAL 207 Cb -0.10 -2.34 -0.03 0.00 0.00 0.00 0.00 36.38 33.91 3h4g s VAL 207 CO 0.34 0.53 0.00 -0.89 0.00 0.00 0.00 175.10 175.08 3h4g s THR 208 N 0.16 4.10 -0.36 3.92 2.01 0.09 -1.58 115.64 123.98 3h4g s THR 208 Ca -0.06 -0.27 -0.25 0.00 0.31 0.00 0.00 61.69 61.41 3h4g s THR 208 Cb -0.15 -2.83 0.01 0.00 0.01 0.00 0.00 72.50 69.54 3h4g s THR 208 CO 0.04 0.45 0.89 0.00 -0.69 0.00 0.00 174.62 175.32 3h4g s ALA 209 N 0.69 3.43 0.49 7.40 0.00 0.28 -1.75 121.76 132.30 3h4g s ALA 209 Ca -0.00 -0.46 -0.02 0.00 0.00 0.00 0.00 51.96 51.48 3h4g s ALA 209 Cb -0.14 -3.48 -0.00 0.00 0.00 0.00 0.00 23.12 19.49 3h4g s ALA 209 CO 0.02 -1.52 0.74 1.52 0.00 0.00 0.00 175.76 176.52 3h4g s TYR 210 N 3.34 3.27 -1.55 0.00 -0.85 0.05 -2.77 117.35 118.84 3h4g s TYR 210 Ca 0.36 0.40 -0.04 0.00 -0.52 0.00 0.00 57.07 57.27 3h4g s TYR 210 Cb -0.12 -2.42 0.03 0.00 0.38 0.00 0.00 41.96 39.83 3h4g s TYR 210 CO 0.17 -0.47 0.25 0.43 -1.52 0.00 0.00 175.55 174.41 3h4g n SER 211 N -2.23 -0.01 0.12 -0.18 7.64 -1.26 -2.31 113.62 115.38 3h4g n SER 211 Ca 0.02 -1.17 0.12 0.00 1.01 0.00 0.00 58.87 58.85 3h4g n SER 211 Cb 0.57 -2.14 0.47 0.00 -1.01 0.00 0.00 64.21 62.10 3h4g n SER 211 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 3h4g n PRO 212 N -4.47 0.19 -0.47 1.43 -0.04 -1.26 -1.53 135.00 128.86 3h4g n PRO 212 Ca -0.25 0.38 0.09 0.00 -0.04 0.00 0.00 63.50 63.67 3h4g n PRO 212 Cb 0.66 -1.83 0.29 0.00 -0.04 0.00 0.00 33.50 32.58 3h4g n PRO 212 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3h4g n LEU 213 N -2.18 4.14 0.00 1.53 4.77 -1.26 -4.77 117.00 119.22 3h4g n LEU 213 Ca 0.03 -2.40 0.00 0.00 -0.03 0.00 0.00 56.01 53.61 3h4g n LEU 213 Cb 0.26 -0.49 0.00 0.00 -2.33 0.00 0.00 43.42 40.86 3h4g n LEU 213 CO 0.21 0.79 0.00 0.61 -1.33 0.00 0.00 177.39 177.67 3h4g n GLY 214 N 0.77 0.60 3.91 -0.72 0.00 -0.58 -4.32 105.19 104.85 3h4g n GLY 214 Ca 0.22 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.93 3h4g n GLY 214 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3h4g n SER 215 N 0.00 -2.33 0.01 1.61 2.88 -1.26 -4.78 113.62 109.75 3h4g n SER 215 Ca 0.00 -1.07 0.02 0.00 -1.33 0.00 0.00 58.87 56.49 3h4g n SER 215 Cb 0.00 -2.86 0.09 0.00 -0.75 0.00 0.00 64.21 60.69 3h4g n SER 215 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 3h4g n SER 216 N -2.77 0.03 0.24 -3.46 3.41 -1.26 -1.44 113.62 108.38 3h4g n SER 216 Ca -0.22 0.51 0.12 0.00 -0.26 0.00 0.00 58.87 59.03 3h4g n SER 216 Cb 0.64 -0.52 0.56 0.00 -0.26 0.00 0.00 64.21 64.64 3h4g n SER 216 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 3h4g h ASP 217 N 0.00 0.00 -4.04 4.04 1.82 -1.95 -3.47 116.42 112.81 3h4g h ASP 217 Ca 0.00 0.00 -0.51 0.00 -0.39 0.00 0.00 57.03 56.13 3h4g h ASP 217 Cb 0.05 0.00 0.08 0.00 0.68 0.00 0.00 39.33 40.14 3h4g h ASP 217 CO 0.00 0.15 0.48 0.00 -1.61 0.00 0.00 179.24 178.26 3h4g s ARG 218 N -3.73 3.44 0.00 0.28 1.70 -0.52 -4.96 118.95 115.17 3h4g s ARG 218 Ca 0.00 1.80 0.27 0.00 -0.47 0.00 0.00 55.73 57.34 3h4g s ARG 218 Cb 0.10 -2.20 0.90 0.00 -0.57 0.00 0.00 34.95 33.18 3h4g s ARG 218 CO 0.60 -0.82 1.66 0.00 -1.08 0.00 0.00 175.30 175.66 3h4g n ALA 219 N -0.95 2.92 -2.53 7.88 0.00 -1.26 -4.27 120.51 122.30 3h4g n ALA 219 Ca 0.10 -0.39 -0.20 0.00 0.00 0.00 0.00 53.44 52.95 3h4g n ALA 219 Cb 0.49 -1.18 0.01 0.00 0.00 0.00 0.00 19.45 18.77 3h4g n ALA 219 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.50 174.83 3h4g n TRP 220 N -0.54 2.55 -2.46 0.00 4.27 -1.26 -5.09 117.44 114.90 3h4g n TRP 220 Ca 0.14 -2.94 -0.42 0.00 -3.89 0.00 0.00 57.50 50.40 3h4g n TRP 220 Cb 0.34 -0.20 -0.03 0.00 -1.36 0.00 0.00 31.31 30.05 3h4g n TRP 220 CO 0.00 0.00 0.00 1.03 -2.29 0.00 0.00 177.69 176.43 3h4g s ARG 221 N -3.40 4.51 -0.44 -2.67 0.52 -1.26 -5.01 118.95 111.20 3h4g s ARG 221 Ca 0.40 1.75 -0.29 0.00 -0.52 0.00 0.00 55.73 57.07 3h4g s ARG 221 Cb 0.42 -3.31 0.03 0.00 0.52 0.00 0.00 34.95 32.60 3h4g s ARG 221 CO -0.10 -0.10 1.10 0.34 0.02 0.00 0.00 175.30 176.57 3h4g s ASP 222 N 0.49 6.70 0.66 0.23 2.15 -1.26 -4.89 116.67 120.74 3h4g s ASP 222 Ca 0.54 0.58 0.36 0.00 0.43 0.00 0.00 52.55 54.46 3h4g s ASP 222 Cb -0.29 -2.54 1.96 0.00 -0.30 0.00 0.00 42.92 41.75 3h4g s ASP 222 CO 0.32 -1.14 2.12 -0.65 -0.17 0.00 0.00 175.17 175.65 3h4g h PRO 223 N 8.93 0.00 0.00 4.34 0.11 -2.02 0.12 132.00 143.48 3h4g h PRO 223 Ca -0.22 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.83 3h4g h PRO 223 Cb 1.06 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 3h4g h PRO 223 CO 1.10 0.00 -0.24 -0.91 -0.21 0.00 0.00 178.00 177.73 3h4g h ASN 224 N 0.00 0.00 -3.80 -2.05 2.35 -2.04 -3.46 115.58 106.57 3h4g h ASN 224 Ca 0.01 0.00 -0.48 0.00 -0.55 0.00 0.00 56.30 55.28 3h4g h ASN 224 Cb 0.39 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.74 3h4g h ASN 224 CO -0.00 0.24 0.35 -1.61 -1.65 0.00 0.00 177.43 174.76 3h4g s GLU 225 N -3.09 4.75 0.64 0.81 2.02 0.41 -5.02 118.70 119.21 3h4g s GLU 225 Ca 0.06 1.44 -0.18 0.00 0.02 0.00 0.00 54.97 56.30 3h4g s GLU 225 Cb 0.06 -3.09 -0.01 0.00 0.10 0.00 0.00 34.13 31.19 3h4g s GLU 225 CO 0.71 0.42 1.25 -1.25 0.02 0.00 0.00 175.26 176.40 3h4g s PRO 226 N -1.53 2.62 -0.25 0.39 0.04 -1.26 -4.95 135.00 130.06 3h4g s PRO 226 Ca 0.45 1.93 -0.10 0.00 0.04 0.00 0.00 61.00 63.31 3h4g s PRO 226 Cb -0.23 -1.87 -0.05 0.00 0.04 0.00 0.00 34.50 32.39 3h4g s PRO 226 CO 0.29 -1.51 0.16 0.08 0.04 0.00 0.00 177.00 176.06 3h4g s VAL 227 N -1.57 5.29 0.18 -0.36 1.01 -1.26 -5.01 120.40 118.68 3h4g s VAL 227 Ca 0.79 0.16 -0.14 0.00 0.00 0.00 0.00 61.98 62.79 3h4g s VAL 227 Cb -0.33 -3.47 0.07 0.00 0.00 0.00 0.00 36.38 32.64 3h4g s VAL 227 CO 0.38 0.33 1.84 0.25 0.00 0.00 0.00 175.10 177.90 3h4g h LEU 228 N 7.67 0.63 -1.54 3.92 5.85 -1.92 -1.72 115.31 128.21 3h4g h LEU 228 Ca -0.37 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.32 3h4g h LEU 228 Cb 1.17 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 42.05 3h4g h LEU 228 CO 0.63 0.46 0.00 -0.07 -0.34 0.00 0.00 178.44 179.13 3h4g h LEU 229 N 0.74 0.00 -2.21 2.25 3.38 -1.95 -2.13 115.31 115.39 3h4g h LEU 229 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.17 3h4g h LEU 229 Cb -0.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.68 3h4g h LEU 229 CO -0.04 0.00 0.00 -0.62 0.09 0.00 0.00 178.44 177.87 3h4g n GLU 230 N -2.53 2.29 -1.74 1.13 1.02 -0.66 -4.76 120.64 115.38 3h4g n GLU 230 Ca -0.00 -2.09 -0.42 0.00 -0.02 0.00 0.00 57.16 54.62 3h4g n GLU 230 Cb 0.13 -1.45 -0.03 0.00 -0.02 0.00 0.00 31.44 30.07 3h4g n GLU 230 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 3h4g s GLU 231 N -1.47 4.15 0.30 3.49 2.56 -0.80 -4.89 118.70 122.03 3h4g s GLU 231 Ca 0.33 2.55 0.05 0.00 0.00 0.00 0.00 54.97 57.89 3h4g s GLU 231 Cb 0.20 -3.75 0.69 0.00 2.00 0.00 0.00 34.13 33.27 3h4g s GLU 231 CO 0.28 -0.86 1.79 -1.35 -0.56 0.00 0.00 175.26 174.57 3h4g h PRO 232 N 9.08 0.79 -0.56 4.30 0.11 -1.93 -0.81 132.00 142.98 3h4g h PRO 232 Ca -0.46 -0.05 -0.07 0.00 0.11 0.00 0.00 66.00 65.53 3h4g h PRO 232 Cb 1.22 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 32.13 3h4g h PRO 232 CO 0.94 0.52 0.08 0.28 -0.21 0.00 0.00 178.00 179.62 3h4g h VAL 233 N 0.82 1.26 -0.19 3.15 2.07 -1.98 -0.23 116.25 121.14 3h4g h VAL 233 Ca 0.56 -0.99 -0.01 0.00 0.82 0.00 0.00 66.70 67.08 3h4g h VAL 233 Cb 0.80 0.81 -0.01 0.00 -1.52 0.00 0.00 31.29 31.37 3h4g h VAL 233 CO -0.36 0.36 0.09 0.58 0.02 0.00 0.00 177.57 178.26 3h4g h VAL 234 N 0.82 1.13 -0.77 2.57 2.07 -1.72 -1.43 116.25 118.92 3h4g h VAL 234 Ca 0.17 -0.39 -0.03 0.00 0.82 0.00 0.00 66.70 67.27 3h4g h VAL 234 Cb 0.43 1.05 -0.04 0.00 -1.52 0.00 0.00 31.29 31.21 3h4g h VAL 234 CO 0.01 0.13 0.36 1.56 0.02 0.00 0.00 177.57 179.65 3h4g h GLN 235 N 0.18 1.12 -0.29 1.57 4.20 -1.07 -0.19 115.11 120.61 3h4g h GLN 235 Ca 0.06 -0.17 0.02 0.00 0.06 0.00 0.00 58.65 58.63 3h4g h GLN 235 Cb 0.12 -0.20 -0.02 0.00 0.30 0.00 0.00 27.48 27.68 3h4g h GLN 235 CO -0.01 0.87 0.14 0.00 -0.67 0.00 0.00 178.83 179.16 3h4g h ALA 236 N 1.29 0.35 -0.12 3.87 0.00 -0.83 -1.53 119.26 122.29 3h4g h ALA 236 Ca 0.27 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.11 3h4g h ALA 236 Cb 0.13 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3h4g h ALA 236 CO -0.03 -0.25 -0.27 -0.07 0.00 0.00 0.00 179.25 178.64 3h4g h LEU 237 N 0.30 0.20 -0.43 0.00 3.38 -0.92 -1.75 115.31 116.10 3h4g h LEU 237 Ca 0.12 -0.06 -0.04 0.00 0.09 0.00 0.00 57.88 57.99 3h4g h LEU 237 Cb 0.04 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 3h4g h LEU 237 CO -0.08 0.48 0.10 0.00 0.09 0.00 0.00 178.44 179.03 3h4g h ALA 238 N 1.54 0.57 -0.15 1.53 0.00 -0.70 -1.62 119.26 120.42 3h4g h ALA 238 Ca 0.03 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 3h4g h ALA 238 Cb 0.58 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 3h4g h ALA 238 CO 0.04 0.25 0.08 0.93 0.00 0.00 0.00 179.25 180.55 3h4g h GLU 239 N 0.56 0.21 -0.84 0.00 3.07 -1.10 -0.30 114.58 116.19 3h4g h GLU 239 Ca 0.13 -0.03 0.04 0.00 -0.50 0.00 0.00 59.36 59.00 3h4g h GLU 239 Cb 0.32 -0.04 -0.05 0.00 -0.84 0.00 0.00 28.75 28.14 3h4g h GLU 239 CO 0.00 0.25 0.53 -0.22 -1.40 0.00 0.00 179.01 178.17 3h4g h LYS 240 N 0.13 0.99 -0.05 2.33 3.64 -1.18 -2.85 116.57 119.58 3h4g h LYS 240 Ca 0.05 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 3h4g h LYS 240 Cb 0.10 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 31.70 3h4g h LYS 240 CO -0.01 0.66 0.00 0.66 -2.27 0.00 0.00 179.45 178.49 3h4g n TYR 241 N -4.58 0.03 -3.68 1.91 4.02 -0.62 -4.96 117.16 109.28 3h4g n TYR 241 Ca 0.11 -0.02 -0.24 0.00 -0.01 0.00 0.00 57.90 57.74 3h4g n TYR 241 Cb 0.11 0.00 0.06 0.00 -0.02 0.00 0.00 39.34 39.49 3h4g n TYR 241 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 3h4g n ASN 242 N 0.90 -4.50 -4.47 7.72 4.05 -0.60 -5.00 115.26 113.36 3h4g n ASN 242 Ca 0.16 -0.67 -0.22 0.00 0.45 0.00 0.00 54.58 54.30 3h4g n ASN 242 Cb 0.50 -4.56 -0.11 0.00 1.23 0.00 0.00 39.78 36.85 3h4g n ASN 242 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 177.26 174.08 3h4g s ARG 243 N -6.22 1.67 0.51 1.20 1.81 -0.22 -5.04 118.95 112.65 3h4g s ARG 243 Ca 0.44 -1.91 -0.15 0.00 -1.72 0.00 0.00 55.73 52.40 3h4g s ARG 243 Cb -0.21 -1.05 -0.07 0.00 -0.45 0.00 0.00 34.95 33.18 3h4g s ARG 243 CO 0.77 -0.11 0.95 -1.54 -0.68 0.00 0.00 175.30 174.69 3h4g s SER 244 N -3.51 6.55 0.35 0.23 1.04 -1.26 -4.43 113.70 112.68 3h4g s SER 244 Ca 0.34 1.46 0.08 0.00 0.48 0.00 0.00 55.95 58.31 3h4g s SER 244 Cb 0.08 -2.47 0.78 0.00 0.10 0.00 0.00 66.02 64.51 3h4g s SER 244 CO 0.15 -0.59 1.89 -0.65 0.98 0.00 0.00 173.24 175.02 3h4g h PRO 245 N 0.81 0.71 -0.97 4.02 0.11 -1.89 -1.26 132.00 133.53 3h4g h PRO 245 Ca -0.46 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3h4g h PRO 245 Cb 1.19 -0.16 -0.05 0.00 0.11 0.00 0.00 31.00 32.09 3h4g h PRO 245 CO 0.62 0.47 0.61 0.00 -0.21 0.00 0.00 178.00 179.49 3h4g h ALA 246 N 1.59 1.23 -0.19 -0.75 0.00 -1.93 -1.72 119.26 117.49 3h4g h ALA 246 Ca 0.42 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 55.17 3h4g h ALA 246 Cb 0.59 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3h4g h ALA 246 CO -0.18 0.66 -0.17 1.96 0.00 0.00 0.00 179.25 181.51 3h4g h GLN 247 N 1.33 0.32 -0.08 0.00 4.20 -1.58 -0.80 115.11 118.50 3h4g h GLN 247 Ca 0.35 -0.09 -0.01 0.00 0.06 0.00 0.00 58.65 58.96 3h4g h GLN 247 Cb -0.10 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 27.65 3h4g h GLN 247 CO -0.07 0.49 0.02 0.82 -0.67 0.00 0.00 178.83 179.42 3h4g h ILE 248 N 0.29 1.20 -0.93 2.54 1.08 -0.81 0.51 117.51 121.40 3h4g h ILE 248 Ca 0.05 -0.61 0.02 0.00 -0.39 0.00 0.00 64.86 63.94 3h4g h ILE 248 Cb 0.48 1.46 -0.05 0.00 -3.07 0.00 0.00 36.82 35.65 3h4g h ILE 248 CO 0.03 0.17 0.61 -0.07 -0.69 0.00 0.00 178.15 178.20 3h4g h LEU 249 N -0.10 1.04 -0.17 1.44 3.38 -1.07 -1.76 115.31 118.08 3h4g h LEU 249 Ca 0.02 -0.02 -0.20 0.00 0.09 0.00 0.00 57.88 57.78 3h4g h LEU 249 Cb 0.26 -0.25 0.01 0.00 0.09 0.00 0.00 40.66 40.76 3h4g h LEU 249 CO 0.00 0.74 -0.66 -0.07 0.09 0.00 0.00 178.44 178.54 3h4g h LEU 250 N 1.22 0.87 -0.42 1.67 3.38 -1.07 -3.16 115.31 117.80 3h4g h LEU 250 Ca 0.35 -0.61 0.01 0.00 0.09 0.00 0.00 57.88 57.72 3h4g h LEU 250 Cb -0.09 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.38 3h4g h LEU 250 CO -0.09 1.34 0.26 -0.09 0.09 0.00 0.00 178.44 179.95 3h4g h ARG 251 N 0.46 0.52 -0.76 1.13 9.65 -0.70 -1.40 114.38 123.29 3h4g h ARG 251 Ca -0.03 -0.03 0.16 0.00 -1.10 0.00 0.00 59.98 58.97 3h4g h ARG 251 Cb 1.29 -0.12 -0.10 0.00 -1.39 0.00 0.00 29.97 29.65 3h4g h ARG 251 CO 0.14 0.34 0.25 2.35 2.80 0.00 0.00 179.97 185.85 3h4g h TRP 252 N 0.53 0.41 0.13 2.20 7.01 -1.35 0.75 115.95 125.64 3h4g h TRP 252 Ca 0.16 0.04 -0.01 0.00 2.11 0.00 0.00 58.89 61.19 3h4g h TRP 252 Cb -0.03 -0.07 0.00 0.00 -2.10 0.00 0.00 29.16 26.97 3h4g h TRP 252 CO -0.06 -0.02 -0.06 1.96 -2.79 0.00 0.00 178.44 177.47 3h4g h GLN 253 N 0.35 -0.17 0.00 2.65 1.08 -1.39 -2.83 115.11 114.81 3h4g h GLN 253 Ca 0.43 0.01 -0.03 0.00 -1.45 0.00 0.00 58.65 57.60 3h4g h GLN 253 Cb 0.71 0.04 -0.00 0.00 -0.05 0.00 0.00 27.48 28.17 3h4g h GLN 253 CO -0.46 0.25 -0.16 -0.39 -0.95 0.00 0.00 178.83 177.11 3h4g h VAL 254 N -0.65 0.64 0.00 -0.54 -1.51 -0.92 0.12 116.25 113.39 3h4g h VAL 254 Ca -0.02 -0.70 -0.09 0.00 -1.23 0.00 0.00 66.70 64.66 3h4g h VAL 254 Cb 0.49 1.45 -0.01 0.00 -2.13 0.00 0.00 31.29 31.09 3h4g h VAL 254 CO 0.03 0.16 -0.42 -0.61 -1.23 0.00 0.00 177.57 175.50 3h4g h GLN 255 N 0.00 0.00 -0.00 5.19 4.15 -0.87 -1.56 115.11 122.02 3h4g h GLN 255 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 3h4g h GLN 255 Cb 0.43 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.12 3h4g h GLN 255 CO 0.02 0.42 -0.01 0.54 -1.93 0.00 0.00 178.83 177.87 3h4g n ARG 256 N -4.03 0.95 -2.80 1.69 1.74 -0.11 -4.91 116.66 109.19 3h4g n ARG 256 Ca -0.02 -0.14 -0.18 0.00 -0.77 0.00 0.00 57.85 56.73 3h4g n ARG 256 Cb 0.45 -1.50 0.02 0.00 -1.02 0.00 0.00 32.46 30.42 3h4g n ARG 256 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 3h4g n LYS 257 N -0.90 -3.65 -3.70 5.56 4.76 -0.59 -5.01 118.16 114.63 3h4g n LYS 257 Ca 0.21 0.77 -0.36 0.00 -2.87 0.00 0.00 58.31 56.06 3h4g n LYS 257 Cb 0.18 -5.30 -0.09 0.00 -1.84 0.00 0.00 35.03 27.98 3h4g n LYS 257 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 3h4g s VAL 258 N -3.04 5.35 0.24 -0.18 1.01 -0.39 -4.79 120.40 118.60 3h4g s VAL 258 Ca 0.21 0.17 -0.30 0.00 0.00 0.00 0.00 61.98 62.07 3h4g s VAL 258 Cb -0.09 -3.47 -0.10 0.00 0.00 0.00 0.00 36.38 32.72 3h4g s VAL 258 CO 0.26 0.38 1.35 -0.63 0.00 0.00 0.00 175.10 176.47 3h4g s ILE 259 N 0.80 2.92 0.00 2.22 1.01 -0.61 -3.54 121.20 123.99 3h4g s ILE 259 Ca 0.08 0.79 0.08 0.00 0.00 0.00 0.00 60.65 61.59 3h4g s ILE 259 Cb -0.13 -3.51 -0.02 0.00 0.01 0.00 0.00 42.46 38.82 3h4g s ILE 259 CO 0.02 0.14 -0.23 0.00 0.00 0.00 0.00 174.94 174.86 3h4g n ILE 261 N 2.26 2.12 -1.93 0.00 -5.35 -1.11 -0.97 119.36 114.38 3h4g n ILE 261 Ca -0.16 -5.23 -0.41 0.00 -0.27 0.00 0.00 62.75 56.68 3h4g n ILE 261 Cb 0.52 -1.40 -0.01 0.00 -1.74 0.00 0.00 39.64 37.01 3h4g n ILE 261 CO 0.00 0.00 0.00 -2.16 -1.76 0.00 0.00 176.55 172.63 3h4g s PRO 262 N -2.93 4.21 -0.17 6.28 0.04 -1.21 -3.13 135.00 138.10 3h4g s PRO 262 Ca 0.45 2.42 -0.10 0.00 0.04 0.00 0.00 61.00 63.80 3h4g s PRO 262 Cb 0.26 -3.02 -0.05 0.00 0.04 0.00 0.00 34.50 31.73 3h4g s PRO 262 CO -0.10 -0.41 0.18 0.21 0.04 0.00 0.00 177.00 176.92 3h4g s LYS 263 N -1.74 4.07 -0.04 4.56 2.36 -1.26 -1.46 119.74 126.23 3h4g s LYS 263 Ca 0.53 -0.12 -0.20 0.00 -2.55 0.00 0.00 55.97 53.62 3h4g s LYS 263 Cb -0.44 -3.38 0.04 0.00 -1.05 0.00 0.00 37.83 33.01 3h4g s LYS 263 CO 0.57 0.38 0.45 0.45 1.55 0.00 0.00 175.35 178.74 3h4g s SER 264 N 0.11 -0.37 0.00 1.43 0.15 -1.26 -4.94 113.70 108.82 3h4g s SER 264 Ca 0.12 0.36 0.13 0.00 0.70 0.00 0.00 55.95 57.26 3h4g s SER 264 Cb -0.12 0.44 0.05 0.00 -1.71 0.00 0.00 66.02 64.68 3h4g s SER 264 CO 0.01 -0.48 0.83 1.33 1.20 0.00 0.00 173.24 176.12 3h4g n VAL 265 N 1.26 0.00 -3.08 4.45 0.24 -1.26 -4.87 118.33 115.07 3h4g n VAL 265 Ca -0.20 -0.43 -0.42 0.00 -2.04 0.00 0.00 64.34 61.25 3h4g n VAL 265 Cb 0.56 1.21 -0.06 0.00 -1.47 0.00 0.00 33.84 34.08 3h4g n VAL 265 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 3h4g s THR 266 N -1.39 4.87 0.27 3.34 2.01 -1.26 -4.82 115.64 118.66 3h4g s THR 266 Ca 0.13 0.70 0.00 0.00 0.31 0.00 0.00 61.69 62.83 3h4g s THR 266 Cb 0.11 -4.09 0.26 0.00 0.01 0.00 0.00 72.50 68.79 3h4g s THR 266 CO 0.25 -0.31 1.80 -0.65 -0.69 0.00 0.00 174.62 175.02 3h4g h PRO 267 N 8.41 0.77 -0.55 4.92 0.11 -1.99 0.22 132.00 143.90 3h4g h PRO 267 Ca -0.26 -0.05 -0.06 0.00 0.11 0.00 0.00 66.00 65.74 3h4g h PRO 267 Cb 1.11 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 32.02 3h4g h PRO 267 CO 0.84 0.51 0.08 0.66 -0.21 0.00 0.00 178.00 179.88 3h4g h SER 268 N 0.79 0.83 -0.11 -2.05 4.64 -1.99 -1.26 113.55 114.40 3h4g h SER 268 Ca 0.48 -0.18 -0.15 0.00 -0.47 0.00 0.00 61.79 61.47 3h4g h SER 268 Cb 0.60 -0.22 0.01 0.00 -0.31 0.00 0.00 62.40 62.48 3h4g h SER 268 CO -0.32 0.85 -0.53 0.03 -0.87 0.00 0.00 176.83 175.98 3h4g h ARG 269 N 0.83 0.56 -0.74 4.77 3.08 -1.68 -1.63 114.38 119.58 3h4g h ARG 269 Ca 0.17 -0.45 0.14 0.00 0.07 0.00 0.00 59.98 59.90 3h4g h ARG 269 Cb 0.38 0.09 -0.09 0.00 0.08 0.00 0.00 29.97 30.43 3h4g h ARG 269 CO 0.01 1.08 0.29 0.82 -1.07 0.00 0.00 179.97 181.10 3h4g h ILE 270 N 0.18 0.67 0.06 2.04 2.04 -0.43 0.73 117.51 122.80 3h4g h ILE 270 Ca -0.03 -0.15 -0.00 0.00 1.00 0.00 0.00 64.86 65.67 3h4g h ILE 270 Cb 1.17 0.19 0.00 0.00 -0.74 0.00 0.00 36.82 37.45 3h4g h ILE 270 CO 0.11 0.08 -0.03 0.25 0.00 0.00 0.00 178.15 178.56 3h4g h LEU 271 N 0.44 -0.06 -0.76 1.44 5.85 -1.19 -3.14 115.31 117.89 3h4g h LEU 271 Ca 0.40 -0.30 0.14 0.00 0.84 0.00 0.00 57.88 58.96 3h4g h LEU 271 Cb 0.59 0.02 -0.09 0.00 0.37 0.00 0.00 40.66 41.55 3h4g h LEU 271 CO -0.39 0.27 0.31 1.56 -0.34 0.00 0.00 178.44 179.85 3h4g h GLN 272 N -0.41 0.45 0.00 1.25 4.20 -0.96 -2.73 115.11 116.91 3h4g h GLN 272 Ca -0.01 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.66 3h4g h GLN 272 Cb 0.36 -0.10 -0.00 0.00 0.30 0.00 0.00 27.48 28.04 3h4g h GLN 272 CO 0.01 0.30 -0.10 -0.91 -0.67 0.00 0.00 178.83 177.47 3h4g h ASN 273 N 0.47 0.00 0.29 1.46 -0.26 -0.81 -1.95 115.58 114.77 3h4g h ASN 273 Ca 0.41 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.15 3h4g h ASN 273 Cb 0.61 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.87 3h4g h ASN 273 CO -0.39 0.10 -0.85 0.00 -1.06 0.00 0.00 177.43 175.22 3h4g n ILE 274 N -4.11 0.04 -2.27 2.81 3.06 -1.04 -4.54 119.36 113.30 3h4g n ILE 274 Ca -0.03 -0.07 -0.41 0.00 -2.50 0.00 0.00 62.75 59.74 3h4g n ILE 274 Cb 0.18 0.51 0.00 0.00 0.54 0.00 0.00 39.64 40.88 3h4g n ILE 274 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 3h4g n GLN 275 N -1.63 4.19 -0.39 9.51 6.02 -0.73 -4.45 117.38 129.89 3h4g n GLN 275 Ca 0.04 -3.65 0.05 0.00 -0.01 0.00 0.00 57.00 53.43 3h4g n GLN 275 Cb 0.36 -2.74 0.08 0.00 1.02 0.00 0.00 30.24 28.96 3h4g n GLN 275 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.06 177.38 3h4g n VAL 276 N 2.32 1.06 -0.40 5.09 0.24 -1.26 -4.75 118.33 120.63 3h4g n VAL 276 Ca 0.48 -1.40 0.04 0.00 -2.04 0.00 0.00 64.34 61.42 3h4g n VAL 276 Cb 0.31 0.14 0.08 0.00 -1.47 0.00 0.00 33.84 32.90 3h4g n VAL 276 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 3h4g n PHE 277 N -0.71 0.15 0.05 6.34 3.01 -1.26 -4.64 117.46 120.40 3h4g n PHE 277 Ca 0.09 -0.67 0.03 0.00 1.01 0.00 0.00 57.45 57.92 3h4g n PHE 277 Cb 0.71 -0.10 0.06 0.00 -0.01 0.00 0.00 39.48 40.14 3h4g n PHE 277 CO 0.00 0.00 0.00 -0.40 1.01 0.00 0.00 176.76 177.37 3h4g n ASP 278 N -0.60 2.09 -3.99 4.37 5.75 -1.26 -5.01 116.55 117.90 3h4g n ASP 278 Ca 0.08 -1.69 -0.09 0.00 -0.01 0.00 0.00 54.79 53.08 3h4g n ASP 278 Cb 0.44 -0.07 -0.08 0.00 -1.03 0.00 0.00 41.12 40.37 3h4g n ASP 278 CO 0.00 0.00 0.00 0.72 -0.11 0.00 0.00 177.20 177.81 3h4g s PHE 279 N -0.80 0.43 -0.00 2.11 -0.71 -1.26 -5.18 117.98 112.57 3h4g s PHE 279 Ca 0.10 -0.86 0.00 0.00 -1.04 0.00 0.00 56.93 55.13 3h4g s PHE 279 Cb 0.06 -0.22 0.00 0.00 -1.21 0.00 0.00 43.02 41.65 3h4g s PHE 279 CO 0.08 -0.54 -0.01 0.99 -1.34 0.00 0.00 175.22 174.41 3h4g s THR 280 N -3.93 0.09 0.25 -4.49 2.01 -1.26 -5.06 115.64 103.25 3h4g s THR 280 Ca 0.12 -0.03 -0.23 0.00 0.31 0.00 0.00 61.69 61.86 3h4g s THR 280 Cb 0.06 -0.10 -0.09 0.00 0.01 0.00 0.00 72.50 72.38 3h4g s THR 280 CO -0.06 0.04 0.81 -0.36 -0.69 0.00 0.00 174.62 174.36 3h4g s PHE 281 N 0.11 3.70 0.79 4.92 2.99 -1.26 -5.07 117.98 124.15 3h4g s PHE 281 Ca -0.01 1.56 -0.11 0.00 0.00 0.00 0.00 56.93 58.37 3h4g s PHE 281 Cb -0.02 -2.74 0.07 0.00 0.00 0.00 0.00 43.02 40.32 3h4g s PHE 281 CO -0.00 0.32 1.09 -1.54 -0.00 0.00 0.00 175.22 175.09 3h4g s SER 282 N -1.58 4.37 0.49 1.36 1.04 -1.26 -4.79 113.70 113.33 3h4g s SER 282 Ca 0.45 1.82 0.21 0.00 0.48 0.00 0.00 55.95 58.91 3h4g s SER 282 Cb -0.18 -2.51 1.25 0.00 0.10 0.00 0.00 66.02 64.69 3h4g s SER 282 CO 0.23 -2.12 1.97 -0.65 0.98 0.00 0.00 173.24 173.64 3h4g h PRO 283 N -1.19 0.17 -0.20 4.02 0.11 -1.99 0.05 132.00 132.97 3h4g h PRO 283 Ca -0.44 -0.01 -0.21 0.00 0.11 0.00 0.00 66.00 65.45 3h4g h PRO 283 Cb 1.24 -0.04 0.01 0.00 0.11 0.00 0.00 31.00 32.31 3h4g h PRO 283 CO 0.51 0.11 -0.70 1.49 -0.21 0.00 0.00 178.00 179.20 3h4g h GLU 284 N 0.17 0.82 -0.41 1.05 4.57 -1.99 -1.59 114.58 117.20 3h4g h GLU 284 Ca 0.30 -0.62 -0.11 0.00 -1.18 0.00 0.00 59.36 57.75 3h4g h GLU 284 Cb 0.94 0.11 -0.02 0.00 -0.16 0.00 0.00 28.75 29.63 3h4g h GLU 284 CO -0.05 1.23 -0.19 0.93 -1.18 0.00 0.00 179.01 179.76 3h4g h GLU 285 N 0.58 0.80 -0.60 1.92 5.08 -1.70 -1.69 114.58 118.97 3h4g h GLU 285 Ca -0.03 -0.30 -0.03 0.00 -1.00 0.00 0.00 59.36 58.00 3h4g h GLU 285 Cb 1.33 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 30.50 3h4g h GLU 285 CO 0.15 0.92 0.27 0.52 -1.00 0.00 0.00 179.01 179.87 3h4g h MET 286 N 0.70 0.88 -0.97 2.33 2.86 -0.91 -2.45 114.93 117.37 3h4g h MET 286 Ca 0.10 -0.14 0.02 0.00 -2.06 0.00 0.00 59.70 57.62 3h4g h MET 286 Cb 0.69 -0.15 -0.05 0.00 0.06 0.00 0.00 31.60 32.15 3h4g h MET 286 CO 0.05 0.72 0.64 -0.22 1.06 0.00 0.00 176.91 179.17 3h4g h LYS 287 N 0.83 1.25 -0.81 1.72 3.11 -0.99 0.12 116.57 121.81 3h4g h LYS 287 Ca 0.20 -0.08 -0.03 0.00 -2.81 0.00 0.00 60.65 57.94 3h4g h LYS 287 Cb 0.15 -0.28 -0.04 0.00 -1.00 0.00 0.00 32.23 31.06 3h4g h LYS 287 CO -0.02 0.83 0.40 1.96 -2.81 0.00 0.00 179.45 179.81 3h4g h GLN 288 N 1.29 1.15 0.02 1.90 4.20 -1.06 -0.86 115.11 121.75 3h4g h GLN 288 Ca 0.36 -0.16 -0.23 0.00 0.06 0.00 0.00 58.65 58.69 3h4g h GLN 288 Cb -0.11 -0.21 -0.00 0.00 0.30 0.00 0.00 27.48 27.45 3h4g h GLN 288 CO -0.09 0.87 -0.98 -0.07 -0.67 0.00 0.00 178.83 177.90 3h4g h LEU 289 N 1.14 0.44 -1.66 1.46 3.38 -0.96 -3.18 115.31 115.94 3h4g h LEU 289 Ca 0.28 -0.37 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 3h4g h LEU 289 Cb 0.09 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 3h4g h LEU 289 CO -0.04 1.19 -0.09 0.44 0.09 0.00 0.00 178.44 180.03 3h4g h ASP 290 N 0.17 0.09 0.83 -0.43 3.32 -0.49 -2.61 116.42 117.31 3h4g h ASP 290 Ca -0.08 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.96 3h4g h ASP 290 Cb 1.62 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 41.15 3h4g h ASP 290 CO 0.16 0.20 0.00 0.00 -1.72 0.00 0.00 179.24 177.88 3h4g n ALA 291 N -2.51 1.76 0.65 3.45 0.00 -0.35 -3.16 120.51 120.34 3h4g n ALA 291 Ca -0.02 0.06 0.12 0.00 0.00 0.00 0.00 53.44 53.60 3h4g n ALA 291 Cb 0.20 -1.39 0.46 0.00 0.00 0.00 0.00 19.45 18.72 3h4g n ALA 291 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3h4g n LEU 292 N -2.19 0.47 -4.67 0.00 4.77 -0.98 -4.87 117.00 109.53 3h4g n LEU 292 Ca 0.03 0.57 -0.48 0.00 -0.03 0.00 0.00 56.01 56.10 3h4g n LEU 292 Cb 0.26 -0.45 -0.05 0.00 -2.33 0.00 0.00 43.42 40.85 3h4g n LEU 292 CO 0.21 -0.23 1.34 -3.20 -1.33 0.00 0.00 177.39 174.17 3h4g n ASN 293 N -1.97 3.17 -0.29 -1.43 5.15 -0.76 -4.39 115.26 114.75 3h4g n ASN 293 Ca 0.05 1.03 0.00 0.00 -0.60 0.00 0.00 54.58 55.06 3h4g n ASN 293 Cb 0.33 -1.37 0.00 0.00 -0.53 0.00 0.00 39.78 38.21 3h4g n ASN 293 CO 0.00 0.00 0.00 2.29 1.40 0.00 0.00 177.26 180.95 3h4g n LYS 294 N 5.10 0.10 -3.80 1.20 2.85 -0.34 -5.01 118.16 118.26 3h4g n LYS 294 Ca 0.20 -0.88 -0.26 0.00 -1.05 0.00 0.00 58.31 56.32 3h4g n LYS 294 Cb 0.28 -0.54 0.04 0.00 -0.65 0.00 0.00 35.03 34.15 3h4g n LYS 294 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 177.40 175.64 3h4g n ASN 295 N -0.06 -3.92 -4.30 -5.58 4.05 -0.75 -4.95 115.26 99.76 3h4g n ASN 295 Ca 0.01 -0.75 -0.39 0.00 0.45 0.00 0.00 54.58 53.89 3h4g n ASN 295 Cb 0.61 -4.13 -0.11 0.00 1.23 0.00 0.00 39.78 37.38 3h4g n ASN 295 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 177.26 173.99 3h4g s LEU 296 N -7.09 4.74 -0.25 1.20 1.98 -1.04 -5.02 118.68 113.21 3h4g s LEU 296 Ca 0.45 -1.24 -0.13 0.00 -2.89 0.00 0.00 54.13 50.32 3h4g s LEU 296 Cb -0.22 -1.95 -0.04 0.00 0.66 0.00 0.00 46.19 44.63 3h4g s LEU 296 CO 0.81 -0.42 0.27 -0.60 -1.89 0.00 0.00 176.35 174.52 3h4g s ARG 297 N 1.45 4.04 -0.01 1.98 3.52 -1.26 -4.20 118.95 124.47 3h4g s ARG 297 Ca 0.01 -0.11 0.02 0.00 -0.13 0.00 0.00 55.73 55.52 3h4g s ARG 297 Cb -0.21 -3.61 -0.25 0.00 -1.56 0.00 0.00 34.95 29.32 3h4g s ARG 297 CO 0.04 -0.12 0.80 0.74 -0.81 0.00 0.00 175.30 175.94 3h4g h PHE 298 N 7.91 0.28 -3.20 5.12 -1.00 -1.97 -3.44 116.94 120.63 3h4g h PHE 298 Ca -0.35 -0.20 -0.75 0.00 2.81 0.00 0.00 57.97 59.48 3h4g h PHE 298 Cb 1.17 -0.01 -0.26 0.00 3.61 0.00 0.00 35.95 40.46 3h4g h PHE 298 CO 0.72 1.28 -0.29 0.42 -1.61 0.00 0.00 178.31 178.83 3h4g s ILE 299 N -2.62 4.77 -0.03 -0.55 -1.09 -1.26 -5.02 121.20 115.41 3h4g s ILE 299 Ca -0.08 -1.66 0.01 0.00 -2.23 0.00 0.00 60.65 56.69 3h4g s ILE 299 Cb 0.07 -4.09 0.02 0.00 -1.58 0.00 0.00 42.46 36.89 3h4g s ILE 299 CO 0.83 -0.83 -0.02 0.68 -1.23 0.00 0.00 174.94 174.37 3h4g s VAL 300 N 1.45 0.32 0.13 2.92 -7.23 -1.26 -5.05 120.40 111.68 3h4g s VAL 300 Ca 0.05 -0.02 -0.32 0.00 -1.81 0.00 0.00 61.98 59.87 3h4g s VAL 300 Cb -0.28 -0.37 -0.12 0.00 0.56 0.00 0.00 36.38 36.18 3h4g s VAL 300 CO 0.01 0.16 1.77 -2.65 -0.31 0.00 0.00 175.10 174.08 3h4g n PRO 301 N 3.94 2.63 -4.33 4.82 -0.02 -1.26 -4.96 135.00 135.82 3h4g n PRO 301 Ca -0.25 0.95 -0.22 0.00 -2.02 0.00 0.00 63.50 61.97 3h4g n PRO 301 Cb 0.51 -2.81 -0.11 0.00 -0.02 0.00 0.00 33.50 31.07 3h4g n PRO 301 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 3h4g s MET 302 N 2.15 1.28 0.11 -0.52 -1.94 -1.26 -0.80 119.30 118.32 3h4g s MET 302 Ca 0.81 -1.42 0.02 0.00 -1.71 0.00 0.00 55.69 53.39 3h4g s MET 302 Cb -0.54 -1.32 -0.04 0.00 2.01 0.00 0.00 34.83 34.94 3h4g s MET 302 CO 0.37 0.26 -0.07 -0.48 -0.01 0.00 0.00 175.02 175.09 3h4g s LEU 303 N -2.72 2.51 0.00 -0.03 2.34 0.10 -4.66 118.68 116.21 3h4g s LEU 303 Ca 0.16 -0.99 0.00 0.00 0.06 0.00 0.00 54.13 53.36 3h4g s LEU 303 Cb -0.05 -0.14 0.00 0.00 -0.56 0.00 0.00 46.19 45.44 3h4g s LEU 303 CO 0.07 -0.42 0.00 1.07 -1.06 0.00 0.00 176.35 176.00 3h4g n THR 304 N -0.02 0.00 -0.11 5.48 5.66 -1.26 -0.69 114.28 123.33 3h4g n THR 304 Ca -0.12 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.88 3h4g n THR 304 Cb 0.61 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.39 3h4g n THR 304 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 3h4g n ARG 309 N 0.00 0.00 -4.37 1.09 3.00 -1.26 -5.06 116.66 110.07 3h4g n ARG 309 Ca 0.00 0.00 -0.19 0.00 -0.01 0.00 0.00 57.85 57.65 3h4g n ARG 309 Cb 0.00 -0.11 -0.14 0.00 0.00 0.00 0.00 32.46 32.21 3h4g n ARG 309 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 3h4g s VAL 310 N -0.92 0.96 -0.01 1.55 0.11 0.13 -5.09 120.40 117.13 3h4g s VAL 310 Ca 0.00 -0.80 -0.38 0.00 -2.93 0.00 0.00 61.98 57.88 3h4g s VAL 310 Cb 0.00 -0.86 -0.17 0.00 -1.53 0.00 0.00 36.38 33.83 3h4g s VAL 310 CO 0.00 0.06 1.44 -0.81 -3.33 0.00 0.00 175.10 172.45 3h4g n PRO 311 N 2.21 1.13 -0.03 1.54 -0.04 -1.26 0.01 135.00 138.55 3h4g n PRO 311 Ca -0.17 0.41 -0.20 0.00 -0.04 0.00 0.00 63.50 63.50 3h4g n PRO 311 Cb 0.55 -2.06 -0.13 0.00 -0.04 0.00 0.00 33.50 31.82 3h4g n PRO 311 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 3h4g h ARG 312 N 5.19 0.14 -0.01 0.54 2.43 -1.23 -3.40 114.38 118.03 3h4g h ARG 312 Ca -0.47 -0.24 0.00 0.00 -0.81 0.00 0.00 59.98 58.45 3h4g h ARG 312 Cb 1.33 0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.97 3h4g h ARG 312 CO 0.82 1.12 -0.34 -0.25 -1.51 0.00 0.00 179.97 179.81 3h4g n ASP 313 N -4.15 1.72 0.30 -3.80 10.43 -1.26 -4.61 116.55 115.18 3h4g n ASP 313 Ca -0.25 -1.36 0.19 0.00 2.57 0.00 0.00 54.79 55.94 3h4g n ASP 313 Cb 0.78 0.45 1.02 0.00 1.84 0.00 0.00 41.12 45.21 3h4g n ASP 313 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3h4g h ALA 314 N 2.97 1.04 -0.00 2.24 0.00 -1.87 0.49 119.26 124.13 3h4g h ALA 314 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3h4g h ALA 314 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.37 3h4g h ALA 314 CO 0.00 -0.04 -0.45 0.41 0.00 0.00 0.00 179.25 179.17 3h4g n GLY 315 N -1.15 -1.06 3.75 0.00 0.00 -1.26 -4.94 105.19 100.53 3h4g n GLY 315 Ca -0.02 -0.38 -0.41 0.00 0.00 0.00 0.00 46.02 45.21 3h4g n GLY 315 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3h4g s HIS 316 N -2.86 3.15 0.45 1.61 5.04 0.16 -4.94 115.29 117.90 3h4g s HIS 316 Ca 0.15 1.21 0.18 0.00 -1.54 0.00 0.00 55.06 55.05 3h4g s HIS 316 Cb 0.18 -3.68 1.13 0.00 0.04 0.00 0.00 32.58 30.25 3h4g s HIS 316 CO 0.66 -2.10 1.95 -1.35 -2.34 0.00 0.00 174.74 171.56 3h4g h PRO 317 N 4.83 0.30 -0.64 2.88 0.11 -1.92 -2.13 132.00 135.43 3h4g h PRO 317 Ca -0.46 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3h4g h PRO 317 Cb 1.22 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.26 3h4g h PRO 317 CO 0.75 0.20 0.00 1.28 -0.21 0.00 0.00 178.00 180.02 3h4g n LEU 318 N -4.45 4.40 -4.70 2.35 4.77 -1.26 -4.95 117.00 113.16 3h4g n LEU 318 Ca 0.12 -2.22 -0.42 0.00 -0.03 0.00 0.00 56.01 53.46 3h4g n LEU 318 Cb 0.51 -0.57 -0.03 0.00 -2.33 0.00 0.00 43.42 41.01 3h4g n LEU 318 CO 0.34 0.69 1.31 -0.47 -1.33 0.00 0.00 177.39 177.93 3h4g s TYR 319 N -1.96 2.56 -0.10 -1.77 6.14 -0.81 -4.45 117.35 116.96 3h4g s TYR 319 Ca 0.45 0.38 0.25 0.00 0.64 0.00 0.00 57.07 58.79 3h4g s TYR 319 Cb 0.30 -3.96 0.74 0.00 0.42 0.00 0.00 41.96 39.45 3h4g s TYR 319 CO 0.20 -3.81 1.75 -1.00 0.64 0.00 0.00 175.55 173.33 3h4g h PRO 320 N 7.99 0.00 0.00 4.97 0.13 -1.91 -3.34 132.00 139.85 3h4g h PRO 320 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 3h4g h PRO 320 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 3h4g h PRO 320 CO 0.93 0.13 -0.46 0.74 -0.23 0.00 0.00 178.00 179.11 3h4g h PHE 321 N 0.00 0.00 -0.16 1.56 0.04 -1.91 -3.36 116.94 113.11 3h4g h PHE 321 Ca -0.00 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.73 3h4g h PHE 321 Cb 0.85 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.99 3h4g h PHE 321 CO 0.00 0.00 -0.08 -0.91 -0.60 0.00 0.00 178.31 176.72 3h4g h ASN 322 N 0.00 0.23 -4.24 2.17 2.35 -1.93 -3.42 115.58 110.74 3h4g h ASN 322 Ca 0.00 -0.04 -0.53 0.00 -0.55 0.00 0.00 56.30 55.19 3h4g h ASN 322 Cb 0.85 -0.06 0.17 0.00 0.05 0.00 0.00 38.32 39.33 3h4g h ASN 322 CO 0.00 0.35 0.31 -1.81 -1.65 0.00 0.00 177.43 174.62 3h4g s ASP 323 N -6.88 3.65 0.00 5.81 -0.00 -1.26 -5.23 116.67 112.76 3h4g s ASP 323 Ca -0.06 2.21 0.04 0.00 -0.00 0.00 0.00 52.55 54.74 3h4g s ASP 323 Cb 0.16 -2.57 0.23 0.00 -0.00 0.00 0.00 42.92 40.74 3h4g s ASP 323 CO 0.73 -2.62 0.71 -2.65 -0.00 0.00 0.00 175.17 171.34