#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h2s n ILE 2 N 0.00 1.30 -3.93 2.12 2.08 -1.26 -4.99 119.36 114.68 2h2s n ILE 2 Ca 0.00 -0.25 -0.30 0.00 0.56 0.00 0.00 62.75 62.76 2h2s n ILE 2 Cb 0.00 -0.89 -0.15 0.00 -0.75 0.00 0.00 39.64 37.85 2h2s n ILE 2 CO 0.00 0.00 0.00 -0.69 0.56 0.00 0.00 176.55 176.42 2h2s s VAL 3 N -2.16 1.59 0.09 1.39 1.01 -1.26 -4.80 120.40 116.26 2h2s s VAL 3 Ca 0.66 -1.43 -0.20 0.00 0.00 0.00 0.00 61.98 61.01 2h2s s VAL 3 Cb -0.28 -1.93 -0.07 0.00 0.00 0.00 0.00 36.38 34.09 2h2s s VAL 3 CO 0.58 -0.24 0.61 -0.76 0.00 0.00 0.00 175.10 175.29 2h2s s LEU 4 N 1.33 4.54 -0.09 3.92 1.43 -1.26 -2.98 118.68 125.58 2h2s s LEU 4 Ca -0.02 1.34 0.00 0.00 -1.03 0.00 0.00 54.13 54.42 2h2s s LEU 4 Cb -0.19 -2.99 0.02 0.00 0.03 0.00 0.00 46.19 43.07 2h2s s LEU 4 CO -0.09 0.26 -0.08 -0.89 0.23 0.00 0.00 176.35 175.79 2h2s s THR 5 N -1.13 0.92 0.03 5.49 2.01 0.93 -4.17 115.64 119.71 2h2s s THR 5 Ca 0.31 -0.27 -0.15 0.00 0.31 0.00 0.00 61.69 61.89 2h2s s THR 5 Cb -0.20 -0.92 -0.06 0.00 0.01 0.00 0.00 72.50 71.33 2h2s s THR 5 CO 0.20 0.33 0.45 -1.10 -0.69 0.00 0.00 174.62 173.82 2h2s s GLN 6 N 1.36 3.96 0.00 4.92 -0.21 -1.26 -0.74 119.66 127.69 2h2s s GLN 6 Ca -0.02 0.46 0.00 0.00 0.02 0.00 0.00 55.36 55.81 2h2s s GLN 6 Cb -0.14 -3.18 0.00 0.00 1.00 0.00 0.00 33.01 30.70 2h2s s GLN 6 CO -0.04 0.65 0.00 0.45 -2.12 0.00 0.00 175.29 174.24 2h2s n SER 7 N 1.62 0.00 -4.69 5.90 2.88 0.67 -4.33 113.62 115.67 2h2s n SER 7 Ca -0.12 0.00 -0.40 0.00 -1.33 0.00 0.00 58.87 57.02 2h2s n SER 7 Cb 0.52 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.93 2h2s n SER 7 CO 0.00 0.00 0.00 -2.84 -1.23 0.00 0.00 175.04 170.97 2h2s s PRO 8 N 0.00 4.35 0.53 -1.46 0.02 -1.26 -4.89 135.00 132.29 2h2s s PRO 8 Ca 0.00 0.86 0.20 0.00 0.02 0.00 0.00 61.00 62.09 2h2s s PRO 8 Cb 0.00 -3.51 1.41 0.00 0.02 0.00 0.00 34.50 32.42 2h2s s PRO 8 CO 0.00 -0.11 2.16 0.00 -0.33 0.00 0.00 177.00 178.72 2h2s h ALA 9 N 7.07 1.79 -2.93 -1.55 0.00 -1.81 -3.40 119.26 118.44 2h2s h ALA 9 Ca -0.36 -0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.38 2h2s h ALA 9 Cb 1.17 -0.00 -0.25 0.00 0.00 0.00 0.00 17.79 18.70 2h2s h ALA 9 CO 0.78 0.03 -0.35 0.42 0.00 0.00 0.00 179.25 180.14 2h2s s ILE 10 N -4.85 -0.01 0.10 0.00 1.01 -1.26 -0.48 121.20 115.71 2h2s s ILE 10 Ca -0.05 0.02 -0.12 0.00 0.00 0.00 0.00 60.65 60.50 2h2s s ILE 10 Cb 0.16 -0.46 0.01 0.00 0.01 0.00 0.00 42.46 42.18 2h2s s ILE 10 CO 0.63 0.01 0.28 0.00 0.00 0.00 0.00 174.94 175.87 2h2s s MET 11 N 0.37 0.94 0.06 2.79 0.23 -0.58 -4.93 119.30 118.19 2h2s s MET 11 Ca -0.02 -0.84 0.07 0.00 -1.03 0.00 0.00 55.69 53.87 2h2s s MET 11 Cb -0.04 0.40 -0.03 0.00 -1.53 0.00 0.00 34.83 33.64 2h2s s MET 11 CO -0.01 -0.33 -0.18 -1.12 -2.03 0.00 0.00 175.02 171.34 2h2s s SER 12 N -2.83 2.21 -0.17 -1.18 0.01 -1.25 -0.23 113.70 110.25 2h2s s SER 12 Ca 0.04 -0.57 -0.24 0.00 1.31 0.00 0.00 55.95 56.49 2h2s s SER 12 Cb 0.03 -0.14 0.06 0.00 0.21 0.00 0.00 66.02 66.18 2h2s s SER 12 CO -0.11 0.07 0.62 0.00 0.41 0.00 0.00 173.24 174.23 2h2s s ALA 13 N -0.99 -1.57 0.08 1.44 0.00 -0.27 -4.95 121.76 115.50 2h2s s ALA 13 Ca 0.05 1.54 -0.26 0.00 0.00 0.00 0.00 51.96 53.29 2h2s s ALA 13 Cb -0.09 -0.65 -0.06 0.00 0.00 0.00 0.00 23.12 22.32 2h2s s ALA 13 CO 0.03 -0.32 0.81 0.00 0.00 0.00 0.00 175.76 176.27 2h2s s ALA 14 N -0.24 3.36 0.79 0.00 0.00 -1.26 -2.62 121.76 121.79 2h2s s ALA 14 Ca -0.04 0.35 -0.16 0.00 0.00 0.00 0.00 51.96 52.11 2h2s s ALA 14 Cb -0.03 -3.05 -0.06 0.00 0.00 0.00 0.00 23.12 19.98 2h2s s ALA 14 CO 0.04 0.09 0.16 -2.30 0.00 0.00 0.00 175.76 173.75 2h2s n PRO 15 N 2.58 0.08 0.00 0.00 -0.02 -1.26 -1.35 135.00 135.03 2h2s n PRO 15 Ca -0.02 0.06 0.00 0.00 -2.02 0.00 0.00 63.50 61.52 2h2s n PRO 15 Cb 0.50 -1.57 0.00 0.00 -0.02 0.00 0.00 33.50 32.41 2h2s n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2h2s n GLY 16 N 2.08 2.62 3.77 -1.23 0.00 -0.37 -4.91 105.19 107.15 2h2s n GLY 16 Ca 0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 2h2s n GLY 16 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2h2s s ASP 17 N -2.32 6.99 -0.15 1.61 3.68 -0.46 -4.47 116.67 121.55 2h2s s ASP 17 Ca 0.00 2.19 -0.22 0.00 2.13 0.00 0.00 52.55 56.65 2h2s s ASP 17 Cb 0.00 -2.61 -0.03 0.00 -1.45 0.00 0.00 42.92 38.83 2h2s s ASP 17 CO 0.00 -0.33 0.68 -0.75 0.13 0.00 0.00 175.17 174.90 2h2s s LYS 18 N -1.94 4.30 -0.12 4.34 2.20 -1.26 -0.04 119.74 127.23 2h2s s LYS 18 Ca 0.51 0.76 0.03 0.00 -0.36 0.00 0.00 55.97 56.91 2h2s s LYS 18 Cb -0.28 -3.53 0.01 0.00 -1.51 0.00 0.00 37.83 32.51 2h2s s LYS 18 CO 0.36 -0.16 -0.22 0.08 -0.36 0.00 0.00 175.35 175.05 2h2s s VAL 19 N 1.59 1.97 0.03 4.02 1.01 -0.70 -4.87 120.40 123.44 2h2s s VAL 19 Ca 0.33 -0.94 0.06 0.00 0.00 0.00 0.00 61.98 61.43 2h2s s VAL 19 Cb -0.16 -1.72 -0.02 0.00 0.00 0.00 0.00 36.38 34.47 2h2s s VAL 19 CO 0.13 0.54 -0.19 -0.89 0.00 0.00 0.00 175.10 174.68 2h2s s THR 20 N 0.61 1.52 0.04 3.92 2.01 -1.26 0.56 115.64 123.05 2h2s s THR 20 Ca -0.13 -1.06 0.01 0.00 0.31 0.00 0.00 61.69 60.82 2h2s s THR 20 Cb -0.17 -1.32 -0.03 0.00 0.01 0.00 0.00 72.50 71.00 2h2s s THR 20 CO 0.03 0.23 -0.06 0.00 -0.69 0.00 0.00 174.62 174.13 2h2s s MET 21 N -0.98 0.52 0.20 4.92 0.23 -0.72 -4.96 119.30 118.51 2h2s s MET 21 Ca 0.06 -0.85 0.09 0.00 -1.03 0.00 0.00 55.69 53.97 2h2s s MET 21 Cb -0.08 -0.12 -0.04 0.00 -1.53 0.00 0.00 34.83 33.06 2h2s s MET 21 CO 0.01 -0.00 -0.08 0.99 -2.03 0.00 0.00 175.02 173.90 2h2s s THR 22 N -1.99 3.21 -0.14 3.16 2.01 -1.26 -1.22 115.64 119.42 2h2s s THR 22 Ca -0.07 -1.73 -0.04 0.00 0.31 0.00 0.00 61.69 60.16 2h2s s THR 22 Cb -0.06 -2.62 0.07 0.00 0.01 0.00 0.00 72.50 69.90 2h2s s THR 22 CO -0.02 -0.17 0.18 0.00 -0.69 0.00 0.00 174.62 173.93 2h2s s SER 24 N 2.30 3.64 0.02 0.00 0.01 0.08 -0.09 113.70 119.66 2h2s s SER 24 Ca 0.04 -0.49 0.05 0.00 1.31 0.00 0.00 55.95 56.87 2h2s s SER 24 Cb -0.14 -0.52 -0.03 0.00 0.21 0.00 0.00 66.02 65.54 2h2s s SER 24 CO -0.09 0.25 -0.12 0.00 0.41 0.00 0.00 173.24 173.69 2h2s s ALA 25 N -0.92 2.82 0.35 1.44 0.00 0.14 -0.05 121.76 125.54 2h2s s ALA 25 Ca 0.14 -1.10 0.07 0.00 0.00 0.00 0.00 51.96 51.07 2h2s s ALA 25 Cb -0.10 -0.95 0.65 0.00 0.00 0.00 0.00 23.12 22.71 2h2s s ALA 25 CO 0.05 0.60 1.86 0.66 0.00 0.00 0.00 175.76 178.92 2h2s h SER 26 N 4.53 0.34 -2.56 0.00 4.64 -1.85 -3.44 113.55 115.22 2h2s h SER 26 Ca -0.48 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 60.76 2h2s h SER 26 Cb 1.16 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 2h2s h SER 26 CO 0.51 0.51 0.00 -1.20 -0.87 0.00 0.00 176.83 175.78 2h2s n SER 27 N -4.23 1.60 -4.43 4.97 7.64 -1.26 -5.04 113.62 112.87 2h2s n SER 27 Ca -0.00 -0.68 -0.42 0.00 1.01 0.00 0.00 58.87 58.78 2h2s n SER 27 Cb 0.30 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.39 2h2s n SER 27 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2h2s s SER 28 N -0.49 5.99 0.38 6.43 0.15 -1.26 -4.55 113.70 120.35 2h2s s SER 28 Ca 0.00 -0.93 0.07 0.00 0.70 0.00 0.00 55.95 55.79 2h2s s SER 28 Cb 0.00 -2.12 -0.00 0.00 -1.71 0.00 0.00 66.02 62.19 2h2s s SER 28 CO 0.00 -0.43 0.48 0.68 1.20 0.00 0.00 173.24 175.17 2h2s s VAL 29 N 1.64 3.38 0.04 4.45 -7.23 -0.89 -4.97 120.40 116.82 2h2s s VAL 29 Ca 0.04 -1.08 -0.13 0.00 -1.81 0.00 0.00 61.98 59.00 2h2s s VAL 29 Cb -0.19 -3.16 0.02 0.00 0.56 0.00 0.00 36.38 33.61 2h2s s VAL 29 CO 0.09 -0.07 0.29 -0.94 -0.31 0.00 0.00 175.10 174.16 2h2s s SER 30 N -4.22 -0.11 -0.69 4.85 1.04 -1.26 -3.28 113.70 110.02 2h2s s SER 30 Ca 0.49 -0.21 -0.08 0.00 0.48 0.00 0.00 55.95 56.63 2h2s s SER 30 Cb -0.09 0.35 0.01 0.00 0.10 0.00 0.00 66.02 66.39 2h2s s SER 30 CO 0.31 -0.60 0.64 -1.22 0.98 0.00 0.00 173.24 173.35 2h2s n TYR 31 N 0.61 -2.62 -3.36 5.02 4.02 -1.26 -4.56 117.16 115.00 2h2s n TYR 31 Ca -0.19 1.05 -0.19 0.00 -0.01 0.00 0.00 57.90 58.56 2h2s n TYR 31 Cb 0.59 -3.21 -0.00 0.00 -0.02 0.00 0.00 39.34 36.71 2h2s n TYR 31 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 176.86 176.81 2h2s s ILE 32 N -2.71 3.98 0.31 -0.72 -4.36 -1.26 -4.34 121.20 112.10 2h2s s ILE 32 Ca 0.09 -0.93 0.08 0.00 -0.26 0.00 0.00 60.65 59.64 2h2s s ILE 32 Cb -0.02 -3.39 -0.06 0.00 1.25 0.00 0.00 42.46 40.25 2h2s s ILE 32 CO 0.83 -0.17 -0.09 -1.00 0.24 0.00 0.00 174.94 174.76 2h2s s HIS 33 N -2.24 2.19 -0.02 1.37 3.76 0.11 0.88 115.29 121.34 2h2s s HIS 33 Ca 0.46 -0.58 0.01 0.00 -0.15 0.00 0.00 55.06 54.81 2h2s s HIS 33 Cb -0.10 -1.24 0.01 0.00 1.11 0.00 0.00 32.58 32.37 2h2s s HIS 33 CO 0.32 0.46 -0.04 -1.58 -0.85 0.00 0.00 174.74 173.05 2h2s s TRP 34 N -2.78 0.56 0.16 1.40 0.52 0.32 0.32 118.94 119.44 2h2s s TRP 34 Ca 0.31 -0.12 0.07 0.00 0.02 0.00 0.00 56.10 56.39 2h2s s TRP 34 Cb 0.03 -0.47 -0.04 0.00 -1.15 0.00 0.00 33.47 31.83 2h2s s TRP 34 CO 0.14 -0.10 -0.03 0.71 0.02 0.00 0.00 176.95 177.69 2h2s s TYR 35 N 0.52 2.80 -0.18 -1.98 1.51 0.82 -0.60 117.35 120.24 2h2s s TYR 35 Ca -0.06 -0.15 -0.00 0.00 -1.01 0.00 0.00 57.07 55.85 2h2s s TYR 35 Cb -0.10 -1.38 0.01 0.00 -0.11 0.00 0.00 41.96 40.38 2h2s s TYR 35 CO -0.00 0.50 -0.15 -1.14 -1.11 0.00 0.00 175.55 173.65 2h2s s GLN 36 N -2.78 3.13 -0.34 -0.62 0.74 0.62 -2.31 119.66 118.11 2h2s s GLN 36 Ca 0.26 -0.76 -0.03 0.00 0.05 0.00 0.00 55.36 54.88 2h2s s GLN 36 Cb -0.10 -2.68 0.06 0.00 1.10 0.00 0.00 33.01 31.40 2h2s s GLN 36 CO 0.17 -0.15 0.07 -1.14 -0.55 0.00 0.00 175.29 173.69 2h2s s GLN 37 N 1.22 2.33 0.68 1.67 0.74 -0.57 -1.33 119.66 124.40 2h2s s GLN 37 Ca 0.02 -1.41 -0.11 0.00 0.05 0.00 0.00 55.36 53.92 2h2s s GLN 37 Cb -0.14 -3.33 -0.00 0.00 1.10 0.00 0.00 33.01 30.64 2h2s s GLN 37 CO -0.07 -0.75 1.07 0.15 -0.55 0.00 0.00 175.29 175.14 2h2s s LYS 38 N 1.24 3.06 0.08 1.67 -0.14 -1.26 -1.40 119.74 122.99 2h2s s LYS 38 Ca -0.01 0.63 -0.31 0.00 -1.36 0.00 0.00 55.97 54.93 2h2s s LYS 38 Cb -0.20 -2.03 -0.09 0.00 -1.68 0.00 0.00 37.83 33.82 2h2s s LYS 38 CO -0.01 -0.93 1.79 0.45 -0.76 0.00 0.00 175.35 175.89 2h2s s SER 39 N -4.19 6.50 -0.75 2.83 0.15 -1.26 -2.96 113.70 114.00 2h2s s SER 39 Ca 0.57 2.63 -0.03 0.00 0.70 0.00 0.00 55.95 59.82 2h2s s SER 39 Cb -0.12 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.64 2h2s s SER 39 CO 0.53 -0.98 0.65 0.61 1.20 0.00 0.00 173.24 175.25 2h2s n GLY 40 N 4.22 0.03 3.59 9.45 0.00 -1.26 -5.04 105.19 116.18 2h2s n GLY 40 Ca 0.18 -0.13 -0.14 0.00 0.00 0.00 0.00 46.02 45.92 2h2s n GLY 40 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2h2s s THR 41 N -3.20 0.00 0.60 2.61 -1.32 -1.16 -5.16 115.64 108.01 2h2s s THR 41 Ca 0.19 -0.00 -0.20 0.00 -1.21 0.00 0.00 61.69 60.47 2h2s s THR 41 Cb -0.08 -0.95 -0.03 0.00 -1.51 0.00 0.00 72.50 69.93 2h2s s THR 41 CO 0.43 -0.00 1.30 -0.44 -2.21 0.00 0.00 174.62 173.70 2h2s s SER 42 N 0.30 4.98 0.79 8.08 0.01 -1.26 -4.29 113.70 122.31 2h2s s SER 42 Ca -0.00 2.64 -0.14 0.00 1.31 0.00 0.00 55.95 59.75 2h2s s SER 42 Cb -0.05 -2.62 0.04 0.00 0.21 0.00 0.00 66.02 63.60 2h2s s SER 42 CO 0.01 -1.75 0.92 -0.81 0.41 0.00 0.00 173.24 172.02 2h2s n PRO 43 N -1.48 0.22 -4.37 12.44 -0.04 -1.26 -4.75 135.00 135.75 2h2s n PRO 43 Ca 0.13 0.14 -0.21 0.00 -0.04 0.00 0.00 63.50 63.52 2h2s n PRO 43 Cb 0.47 -2.20 -0.16 0.00 -0.04 0.00 0.00 33.50 31.57 2h2s n PRO 43 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2h2s s LYS 44 N -3.62 1.03 -0.11 0.54 1.02 -0.44 -4.87 119.74 113.29 2h2s s LYS 44 Ca 0.70 -0.27 -0.29 0.00 0.02 0.00 0.00 55.97 56.12 2h2s s LYS 44 Cb -0.30 -0.95 -0.07 0.00 -0.52 0.00 0.00 37.83 35.99 2h2s s LYS 44 CO 0.54 0.06 2.12 -2.13 -0.92 0.00 0.00 175.35 175.02 2h2s n ARG 45 N 3.53 2.36 -0.10 1.68 0.63 -1.26 -0.27 116.66 123.22 2h2s n ARG 45 Ca -0.21 0.76 -0.14 0.00 -0.92 0.00 0.00 57.85 57.34 2h2s n ARG 45 Cb 0.53 -3.14 -0.05 0.00 0.45 0.00 0.00 32.46 30.25 2h2s n ARG 45 CO 0.00 0.00 0.00 1.87 -2.51 0.00 0.00 177.63 176.99 2h2s n TRP 46 N 9.92 0.06 -4.24 -0.14 -0.00 0.23 -4.65 117.44 118.63 2h2s n TRP 46 Ca 0.26 0.03 -0.18 0.00 -0.00 0.00 0.00 57.50 57.61 2h2s n TRP 46 Cb 0.43 -0.65 -0.13 0.00 -0.00 0.00 0.00 31.31 30.97 2h2s n TRP 46 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 177.69 178.11 2h2s s ILE 47 N -2.77 0.89 0.12 5.87 1.01 -0.61 -0.33 121.20 125.39 2h2s s ILE 47 Ca -0.31 -0.97 -0.01 0.00 0.00 0.00 0.00 60.65 59.36 2h2s s ILE 47 Cb 0.07 -0.84 -0.04 0.00 0.01 0.00 0.00 42.46 41.65 2h2s s ILE 47 CO 0.44 -0.11 0.05 -0.72 0.00 0.00 0.00 174.94 174.60 2h2s s TYR 48 N -0.95 0.83 -1.30 3.97 1.13 -0.28 0.12 117.35 120.87 2h2s s TYR 48 Ca -0.02 -1.22 -0.08 0.00 -1.41 0.00 0.00 57.07 54.35 2h2s s TYR 48 Cb -0.08 -0.47 -0.00 0.00 -1.10 0.00 0.00 41.96 40.31 2h2s s TYR 48 CO 0.01 -0.51 0.59 -0.25 -2.51 0.00 0.00 175.55 172.88 2h2s n ASP 49 N -0.08 -2.14 0.00 -0.18 8.00 -0.84 -1.73 116.55 119.58 2h2s n ASP 49 Ca -0.06 -0.99 0.00 0.00 0.71 0.00 0.00 54.79 54.45 2h2s n ASP 49 Cb 0.63 -3.28 0.00 0.00 -0.02 0.00 0.00 41.12 38.45 2h2s n ASP 49 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 2h2s n THR 50 N -4.32 0.00 -2.93 -3.53 -1.04 0.26 -4.28 114.28 98.43 2h2s n THR 50 Ca -0.23 0.00 -0.13 0.00 -2.04 0.00 0.00 64.05 61.65 2h2s n THR 50 Cb 0.65 0.00 0.03 0.00 -1.82 0.00 0.00 70.33 69.20 2h2s n THR 50 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 2h2s n SER 51 N 2.32 -0.76 -3.83 8.00 3.41 -1.19 -2.89 113.62 118.69 2h2s n SER 51 Ca 0.00 -3.31 -0.24 0.00 -0.26 0.00 0.00 58.87 55.07 2h2s n SER 51 Cb 0.00 0.66 -0.17 0.00 -0.26 0.00 0.00 64.21 64.44 2h2s n SER 51 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2h2s s LYS 52 N -1.08 0.91 0.25 4.33 1.02 -0.70 -4.83 119.74 119.65 2h2s s LYS 52 Ca 0.30 -0.03 -0.30 0.00 0.02 0.00 0.00 55.97 55.97 2h2s s LYS 52 Cb 0.33 -1.14 -0.09 0.00 -0.52 0.00 0.00 37.83 36.40 2h2s s LYS 52 CO -0.06 -0.26 1.16 -0.51 -0.92 0.00 0.00 175.35 174.75 2h2s s LEU 53 N 1.76 4.50 0.00 3.17 1.43 -1.26 -1.13 118.68 127.15 2h2s s LEU 53 Ca 0.03 2.30 0.00 0.00 -1.03 0.00 0.00 54.13 55.43 2h2s s LEU 53 Cb -0.13 -3.62 0.00 0.00 0.03 0.00 0.00 46.19 42.47 2h2s s LEU 53 CO -0.05 -0.27 0.00 0.41 0.23 0.00 0.00 176.35 176.67 2h2s n THR 54 N 1.61 0.00 -3.61 5.49 -1.04 0.56 -4.93 114.28 112.36 2h2s n THR 54 Ca 0.01 0.00 -0.40 0.00 -2.04 0.00 0.00 64.05 61.62 2h2s n THR 54 Cb 0.44 -0.49 -0.11 0.00 -1.82 0.00 0.00 70.33 68.36 2h2s n THR 54 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 2h2s s SER 55 N -1.76 5.68 0.00 8.00 0.15 -1.26 -4.02 113.70 120.50 2h2s s SER 55 Ca 0.00 -1.12 0.00 0.00 0.70 0.00 0.00 55.95 55.53 2h2s s SER 55 Cb 0.00 -2.00 0.00 0.00 -1.71 0.00 0.00 66.02 62.31 2h2s s SER 55 CO 0.00 -0.42 0.00 0.61 1.20 0.00 0.00 173.24 174.63 2h2s n GLY 56 N 4.97 1.30 3.52 9.45 0.00 -1.26 -5.08 105.19 118.08 2h2s n GLY 56 Ca -0.12 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.48 2h2s n GLY 56 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2h2s s VAL 57 N -2.00 4.85 -0.06 1.61 1.01 -1.26 -5.00 120.40 119.56 2h2s s VAL 57 Ca 0.00 0.14 -0.26 0.00 0.00 0.00 0.00 61.98 61.85 2h2s s VAL 57 Cb 0.00 -4.18 -0.13 0.00 0.00 0.00 0.00 36.38 32.07 2h2s s VAL 57 CO 0.00 -0.56 0.75 -0.81 0.00 0.00 0.00 175.10 174.48 2h2s n PRO 58 N 6.21 0.00 0.20 2.72 -0.04 -1.26 -4.76 135.00 138.06 2h2s n PRO 58 Ca -0.02 0.00 0.13 0.00 -0.04 0.00 0.00 63.50 63.57 2h2s n PRO 58 Cb 0.48 -0.96 0.67 0.00 -0.04 0.00 0.00 33.50 33.65 2h2s n PRO 58 CO 0.00 0.00 0.00 -0.39 -0.04 0.00 0.00 175.50 175.07 2h2s h VAL 59 N 2.15 0.00 0.00 0.52 -1.51 -2.01 -0.54 116.25 114.87 2h2s h VAL 59 Ca -0.32 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.15 2h2s h VAL 59 Cb 0.91 0.55 0.00 0.00 -2.13 0.00 0.00 31.29 30.62 2h2s h VAL 59 CO 0.45 0.00 0.00 -2.11 -1.23 0.00 0.00 177.57 174.68 2h2s n ARG 60 N -2.39 0.01 -3.26 5.19 1.85 -1.26 -4.61 116.66 112.18 2h2s n ARG 60 Ca -0.02 0.41 -0.22 0.00 -1.00 0.00 0.00 57.85 57.03 2h2s n ARG 60 Cb 0.09 -1.50 0.00 0.00 -1.05 0.00 0.00 32.46 30.00 2h2s n ARG 60 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 2h2s s PHE 61 N -2.95 3.25 0.00 2.89 0.40 -0.21 -1.78 117.98 119.59 2h2s s PHE 61 Ca 0.02 0.10 0.00 0.00 -0.60 0.00 0.00 56.93 56.45 2h2s s PHE 61 Cb 0.02 -2.10 0.00 0.00 0.51 0.00 0.00 43.02 41.46 2h2s s PHE 61 CO 0.07 -0.12 0.00 -1.13 0.70 0.00 0.00 175.22 174.74 2h2s n SER 62 N -1.85 0.00 -4.76 1.36 3.41 -0.16 -4.92 113.62 106.69 2h2s n SER 62 Ca -0.01 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.31 2h2s n SER 62 Cb 0.57 0.00 0.13 0.00 -0.26 0.00 0.00 64.21 64.66 2h2s n SER 62 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2h2s s GLY 63 N 0.00 1.59 0.00 5.00 0.00 -1.26 -2.38 107.32 110.27 2h2s s GLY 63 Ca 0.00 -0.38 -0.00 0.00 0.00 0.00 0.00 44.72 44.34 2h2s s GLY 63 CO 0.00 0.16 0.00 -1.26 0.00 0.00 0.00 173.10 172.00 2h2s n SER 64 N -3.79 -0.00 0.00 1.64 2.88 0.75 -4.45 113.62 110.64 2h2s n SER 64 Ca 0.06 -1.00 0.00 0.00 -1.33 0.00 0.00 58.87 56.60 2h2s n SER 64 Cb 0.58 0.01 0.00 0.00 -0.75 0.00 0.00 64.21 64.04 2h2s n SER 64 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2h2s n GLY 65 N -0.00 -0.11 0.00 0.46 0.00 -1.26 -1.56 105.19 102.72 2h2s n GLY 65 Ca -0.00 -2.28 0.00 0.00 0.00 0.00 0.00 46.02 43.74 2h2s n GLY 65 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2h2s n SER 66 N 0.00 0.00 0.00 1.61 3.41 -1.04 -4.99 113.62 112.61 2h2s n SER 66 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2h2s n SER 66 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2h2s n SER 66 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2h2s n GLY 67 N 0.00 1.65 0.04 5.00 0.00 -1.21 -3.75 105.19 106.93 2h2s n GLY 67 Ca 0.00 -0.17 0.07 0.00 0.00 0.00 0.00 46.02 45.92 2h2s n GLY 67 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2h2s n THR 68 N 0.00 0.39 -4.79 2.61 -2.24 -1.26 -2.10 114.28 106.90 2h2s n THR 68 Ca 0.00 -0.58 -0.33 0.00 -2.27 0.00 0.00 64.05 60.87 2h2s n THR 68 Cb 0.00 -0.17 -0.16 0.00 -2.10 0.00 0.00 70.33 67.90 2h2s n THR 68 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2h2s s SER 69 N -4.87 3.28 0.10 3.42 1.04 -1.25 0.26 113.70 115.68 2h2s s SER 69 Ca -0.07 -0.55 0.03 0.00 0.48 0.00 0.00 55.95 55.84 2h2s s SER 69 Cb 0.12 -1.47 -0.04 0.00 0.10 0.00 0.00 66.02 64.73 2h2s s SER 69 CO 0.88 0.11 -0.08 -0.31 0.98 0.00 0.00 173.24 174.81 2h2s s TYR 70 N 0.67 0.99 0.06 5.02 1.51 0.87 -2.48 117.35 123.98 2h2s s TYR 70 Ca -0.10 -0.78 -0.00 0.00 -1.01 0.00 0.00 57.07 55.18 2h2s s TYR 70 Cb -0.16 -0.55 -0.04 0.00 -0.11 0.00 0.00 41.96 41.10 2h2s s TYR 70 CO 0.02 -0.06 -0.04 -1.54 -1.11 0.00 0.00 175.55 172.82 2h2s s SER 71 N -2.78 0.65 -0.09 2.29 1.04 -0.60 0.63 113.70 114.84 2h2s s SER 71 Ca 0.09 -0.97 0.03 0.00 0.48 0.00 0.00 55.95 55.58 2h2s s SER 71 Cb 0.01 0.17 0.01 0.00 0.10 0.00 0.00 66.02 66.30 2h2s s SER 71 CO -0.02 -0.54 -0.20 -0.22 0.98 0.00 0.00 173.24 173.24 2h2s s LEU 72 N -2.86 1.92 0.09 2.42 0.20 -0.36 -0.17 118.68 119.92 2h2s s LEU 72 Ca 0.07 -0.47 0.08 0.00 0.69 0.00 0.00 54.13 54.50 2h2s s LEU 72 Cb 0.06 -1.21 -0.03 0.00 -0.43 0.00 0.00 46.19 44.58 2h2s s LEU 72 CO -0.08 0.10 -0.22 -0.89 -0.29 0.00 0.00 176.35 174.97 2h2s s THR 73 N 0.54 1.80 -0.55 3.68 2.01 -1.00 -1.76 115.64 120.35 2h2s s THR 73 Ca -0.16 -1.50 0.05 0.00 0.31 0.00 0.00 61.69 60.40 2h2s s THR 73 Cb -0.17 -1.61 0.19 0.00 0.01 0.00 0.00 72.50 70.93 2h2s s THR 73 CO 0.06 0.03 0.49 -0.38 -0.69 0.00 0.00 174.62 174.13 2h2s n ILE 74 N 1.24 0.49 -1.66 1.82 5.41 0.19 -0.99 119.36 125.87 2h2s n ILE 74 Ca -0.19 -4.33 -0.38 0.00 1.00 0.00 0.00 62.75 58.86 2h2s n ILE 74 Cb 0.53 -1.97 -0.03 0.00 -0.71 0.00 0.00 39.64 37.47 2h2s n ILE 74 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 176.55 176.76 2h2s s ASN 75 N -1.10 4.74 -0.02 4.38 2.47 -0.73 -1.72 114.94 122.96 2h2s s ASN 75 Ca 0.31 1.06 -0.00 0.00 0.42 0.00 0.00 52.86 54.65 2h2s s ASN 75 Cb 0.05 -2.51 0.00 0.00 -1.45 0.00 0.00 41.25 37.34 2h2s s ASN 75 CO -0.15 -2.65 0.02 0.41 -3.72 0.00 0.00 177.10 171.01 2h2s n THR 76 N 7.82 -2.44 -1.17 -5.21 -1.04 -1.11 -4.81 114.28 106.32 2h2s n THR 76 Ca 0.33 0.06 -0.32 0.00 -2.04 0.00 0.00 64.05 62.08 2h2s n THR 76 Cb 0.53 -4.15 0.11 0.00 -1.82 0.00 0.00 70.33 65.00 2h2s n THR 76 CO 0.00 0.00 0.00 -0.32 -0.64 0.00 0.00 175.07 174.11 2h2s s MET 77 N -0.74 1.92 0.20 -2.82 1.75 0.95 -4.67 119.30 115.88 2h2s s MET 77 Ca 0.01 1.39 0.04 0.00 -1.25 0.00 0.00 55.69 55.88 2h2s s MET 77 Cb -0.00 -1.84 -0.05 0.00 2.84 0.00 0.00 34.83 35.78 2h2s s MET 77 CO 0.04 -1.93 -0.04 -1.21 -0.65 0.00 0.00 175.02 171.22 2h2s s GLU 78 N -4.59 1.23 0.49 4.11 0.41 -1.26 -1.24 118.70 117.86 2h2s s GLU 78 Ca 0.65 -1.59 0.15 0.00 -0.41 0.00 0.00 54.97 53.77 2h2s s GLU 78 Cb -0.21 -0.64 1.17 0.00 -1.78 0.00 0.00 34.13 32.68 2h2s s GLU 78 CO 0.53 -0.02 2.11 0.00 -0.49 0.00 0.00 175.26 177.39 2h2s h ALA 79 N 2.59 1.91 0.00 5.21 0.00 -1.90 -1.97 119.26 125.10 2h2s h ALA 79 Ca -0.38 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.50 2h2s h ALA 79 Cb 1.21 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2h2s h ALA 79 CO 0.64 0.07 0.00 -0.85 0.00 0.00 0.00 179.25 179.11 2h2s n GLU 80 N -4.49 0.12 -0.31 0.00 0.28 -1.25 -3.23 120.64 111.77 2h2s n GLU 80 Ca -0.02 0.20 0.02 0.00 -0.16 0.00 0.00 57.16 57.20 2h2s n GLU 80 Cb 0.12 -1.67 0.14 0.00 1.43 0.00 0.00 31.44 31.45 2h2s n GLU 80 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2h2s n ASP 81 N -1.89 2.61 -4.57 -1.84 8.00 -0.74 -4.81 116.55 113.30 2h2s n ASP 81 Ca 0.05 -2.31 -0.42 0.00 0.71 0.00 0.00 54.79 52.81 2h2s n ASP 81 Cb 0.32 -0.56 -0.05 0.00 -0.02 0.00 0.00 41.12 40.80 2h2s n ASP 81 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2h2s s ALA 82 N -1.60 3.39 0.00 2.24 0.00 -1.20 -4.90 121.76 119.70 2h2s s ALA 82 Ca 0.19 -0.76 0.00 0.00 0.00 0.00 0.00 51.96 51.39 2h2s s ALA 82 Cb 0.14 -3.38 0.00 0.00 0.00 0.00 0.00 23.12 19.88 2h2s s ALA 82 CO 0.05 -1.59 0.00 0.00 0.00 0.00 0.00 175.76 174.23 2h2s n ALA 83 N 6.47 0.00 -3.86 0.00 0.00 -1.24 -4.71 120.51 117.18 2h2s n ALA 83 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.15 2h2s n ALA 83 Cb 0.48 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.77 2h2s n ALA 83 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2h2s s THR 84 N -2.62 1.84 -0.35 0.00 2.01 -0.49 -0.64 115.64 115.38 2h2s s THR 84 Ca 0.00 -0.82 -0.12 0.00 0.31 0.00 0.00 61.69 61.06 2h2s s THR 84 Cb 0.00 -1.66 0.00 0.00 0.01 0.00 0.00 72.50 70.85 2h2s s THR 84 CO 0.00 0.51 0.21 -0.31 -0.69 0.00 0.00 174.62 174.33 2h2s s TYR 85 N 1.12 3.22 -0.26 4.92 1.51 0.39 -1.51 117.35 126.73 2h2s s TYR 85 Ca -0.01 -0.59 -0.09 0.00 -1.01 0.00 0.00 57.07 55.37 2h2s s TYR 85 Cb -0.14 -2.44 -0.04 0.00 -0.11 0.00 0.00 41.96 39.23 2h2s s TYR 85 CO -0.07 -0.50 0.14 0.71 -1.11 0.00 0.00 175.55 174.72 2h2s s TYR 86 N 1.63 3.18 0.33 2.71 1.51 -0.98 -2.73 117.35 123.00 2h2s s TYR 86 Ca 0.04 -0.07 -0.07 0.00 -1.01 0.00 0.00 57.07 55.96 2h2s s TYR 86 Cb -0.18 -2.31 -0.06 0.00 -0.11 0.00 0.00 41.96 39.30 2h2s s TYR 86 CO 0.08 -0.21 0.63 0.00 -1.11 0.00 0.00 175.55 174.94 2h2s s GLN 88 N -3.61 0.80 0.08 0.00 0.74 0.15 0.64 119.66 118.45 2h2s s GLN 88 Ca 0.47 -0.44 0.03 0.00 0.05 0.00 0.00 55.36 55.47 2h2s s GLN 88 Cb -0.11 0.35 -0.03 0.00 1.10 0.00 0.00 33.01 34.32 2h2s s GLN 88 CO 0.30 -0.25 -0.10 1.14 -0.55 0.00 0.00 175.29 175.82 2h2s s GLN 89 N -2.35 0.75 -0.18 1.67 1.03 -0.90 0.05 119.66 119.72 2h2s s GLN 89 Ca -0.06 -1.02 0.17 0.00 0.04 0.00 0.00 55.36 54.48 2h2s s GLN 89 Cb -0.01 -0.50 0.37 0.00 0.03 0.00 0.00 33.01 32.90 2h2s s GLN 89 CO -0.02 0.09 1.23 1.87 -2.54 0.00 0.00 175.29 175.92 2h2s n TRP 90 N 0.90 -0.19 1.18 9.60 -0.00 -1.26 -2.39 117.44 125.29 2h2s n TRP 90 Ca -0.19 -1.40 0.12 0.00 -0.00 0.00 0.00 57.50 56.04 2h2s n TRP 90 Cb 0.56 0.44 0.26 0.00 -0.00 0.00 0.00 31.31 32.57 2h2s n TRP 90 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 177.69 176.56 2h2s n SER 91 N -0.55 1.47 -0.45 5.87 3.41 -1.26 -4.88 113.62 117.22 2h2s n SER 91 Ca -0.07 -1.19 0.00 0.00 -0.26 0.00 0.00 58.87 57.36 2h2s n SER 91 Cb 0.88 0.23 0.00 0.00 -0.26 0.00 0.00 64.21 65.06 2h2s n SER 91 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2h2s n SER 92 N -0.30 0.57 -3.68 4.04 7.64 -1.26 -4.96 113.62 115.67 2h2s n SER 92 Ca 0.12 -0.35 -0.13 0.00 1.01 0.00 0.00 58.87 59.51 2h2s n SER 92 Cb 0.40 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.51 2h2s n SER 92 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 2h2s s HIS 93 N -0.88 -0.63 0.93 1.43 2.46 -1.26 -4.32 115.29 113.02 2h2s s HIS 93 Ca 0.00 1.53 -0.14 0.00 0.47 0.00 0.00 55.06 56.92 2h2s s HIS 93 Cb 0.00 0.22 0.16 0.00 -0.13 0.00 0.00 32.58 32.83 2h2s s HIS 93 CO 0.00 -0.30 1.20 -1.25 -2.47 0.00 0.00 174.74 171.92 2h2s s PRO 94 N 0.34 0.94 0.80 2.88 0.04 -1.26 -3.59 135.00 135.15 2h2s s PRO 94 Ca -0.00 -0.01 -0.11 0.00 0.04 0.00 0.00 61.00 60.92 2h2s s PRO 94 Cb -0.04 -1.84 0.08 0.00 0.04 0.00 0.00 34.50 32.74 2h2s s PRO 94 CO 0.00 -2.28 1.12 1.14 0.04 0.00 0.00 177.00 177.03 2h2s s GLN 95 N -5.56 1.89 -0.03 4.56 0.00 -1.26 -4.55 119.66 114.72 2h2s s GLN 95 Ca 0.67 1.37 -0.04 0.00 -0.00 0.00 0.00 55.36 57.36 2h2s s GLN 95 Cb -0.10 -1.84 0.01 0.00 0.00 0.00 0.00 33.01 31.08 2h2s s GLN 95 CO 0.52 -1.95 0.09 0.95 0.00 0.00 0.00 175.29 174.91 2h2s s THR 96 N -2.68 0.02 -0.05 3.63 -4.23 -1.00 -4.97 115.64 106.35 2h2s s THR 96 Ca 0.65 -0.20 -0.03 0.00 -1.18 0.00 0.00 61.69 60.93 2h2s s THR 96 Cb -0.20 -0.20 -0.04 0.00 1.34 0.00 0.00 72.50 73.40 2h2s s THR 96 CO 0.54 -0.11 0.08 -0.36 -0.54 0.00 0.00 174.62 174.24 2h2s s PHE 97 N -0.32 3.35 0.99 3.99 0.08 -1.26 -2.11 117.98 122.71 2h2s s PHE 97 Ca -0.04 0.29 -0.12 0.00 0.12 0.00 0.00 56.93 57.19 2h2s s PHE 97 Cb -0.03 -1.81 0.19 0.00 -0.57 0.00 0.00 43.02 40.80 2h2s s PHE 97 CO 0.00 0.58 1.08 0.20 -0.10 0.00 0.00 175.22 176.99 2h2s s GLY 98 N -1.37 1.59 0.20 4.36 0.00 0.21 -4.63 107.32 107.67 2h2s s GLY 98 Ca 0.19 -0.12 0.25 0.00 0.00 0.00 0.00 44.72 45.04 2h2s s GLY 98 CO 0.09 0.46 1.76 0.61 0.00 0.00 0.00 173.10 176.02 2h2s n GLY 99 N -0.56 -1.54 0.00 0.20 0.00 -1.26 -4.68 105.19 97.35 2h2s n GLY 99 Ca 0.06 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 2h2s n GLY 99 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2h2s n GLY 100 N 0.90 1.70 2.86 -0.02 0.00 -1.26 -5.00 105.19 104.37 2h2s n GLY 100 Ca 0.05 -1.99 -0.16 0.00 0.00 0.00 0.00 46.02 43.92 2h2s n GLY 100 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2h2s s THR 101 N -2.27 -0.22 -0.34 2.61 2.01 -1.10 -4.59 115.64 111.74 2h2s s THR 101 Ca 0.00 0.32 -0.16 0.00 0.31 0.00 0.00 61.69 62.16 2h2s s THR 101 Cb 0.00 -0.29 -0.01 0.00 0.01 0.00 0.00 72.50 72.21 2h2s s THR 101 CO 0.00 0.13 0.40 -0.54 -0.69 0.00 0.00 174.62 173.92 2h2s s LYS 102 N 2.05 3.61 -0.15 4.92 1.02 0.36 -0.46 119.74 131.09 2h2s s LYS 102 Ca 0.00 -0.33 -0.18 0.00 0.02 0.00 0.00 55.97 55.49 2h2s s LYS 102 Cb -0.12 -3.80 -0.04 0.00 -0.52 0.00 0.00 37.83 33.36 2h2s s LYS 102 CO -0.06 -0.53 0.48 -1.17 -0.92 0.00 0.00 175.35 173.14 2h2s s LEU 103 N 2.10 4.22 -0.03 3.17 2.96 0.18 -1.53 118.68 129.76 2h2s s LEU 103 Ca 0.13 0.73 0.07 0.00 -0.22 0.00 0.00 54.13 54.84 2h2s s LEU 103 Cb -0.16 -2.67 -0.02 0.00 0.50 0.00 0.00 46.19 43.84 2h2s s LEU 103 CO 0.12 -0.06 -0.23 -1.61 -1.32 0.00 0.00 176.35 173.24 2h2s s GLU 104 N 1.02 2.04 -0.02 1.98 2.02 0.68 -3.67 118.70 122.75 2h2s s GLU 104 Ca 0.24 -0.84 -0.08 0.00 0.02 0.00 0.00 54.97 54.32 2h2s s GLU 104 Cb -0.15 -1.89 -0.05 0.00 0.10 0.00 0.00 34.13 32.14 2h2s s GLU 104 CO 0.10 0.46 0.26 0.42 0.02 0.00 0.00 175.26 176.52 2h2s s ILE 105 N -0.42 5.30 -0.18 -1.63 1.01 -1.26 -1.12 121.20 122.90 2h2s s ILE 105 Ca 0.05 0.27 -0.04 0.00 0.00 0.00 0.00 60.65 60.93 2h2s s ILE 105 Cb -0.10 -3.55 -0.02 0.00 0.01 0.00 0.00 42.46 38.79 2h2s s ILE 105 CO 0.00 0.44 -0.03 -0.76 0.00 0.00 0.00 174.94 174.59 2h2s s LEU 106 N -1.54 3.15 0.29 2.97 1.43 -1.08 -4.86 118.68 119.04 2h2s s LEU 106 Ca 0.25 -0.22 0.02 0.00 -1.03 0.00 0.00 54.13 53.15 2h2s s LEU 106 Cb -0.13 -1.78 -0.03 0.00 0.03 0.00 0.00 46.19 44.28 2h2s s LEU 106 CO 0.13 0.09 0.28 0.00 0.23 0.00 0.00 176.35 177.08 2h2s s ARG 107 N 0.82 1.61 0.98 1.70 1.70 -1.26 -4.44 118.95 120.06 2h2s s ARG 107 Ca -0.01 -1.83 -0.14 0.00 -0.47 0.00 0.00 55.73 53.28 2h2s s ARG 107 Cb -0.14 0.34 0.02 0.00 -0.57 0.00 0.00 34.95 34.59 2h2s s ARG 107 CO 0.02 -0.60 0.17 0.00 -1.08 0.00 0.00 175.30 173.81 2h2s n ALA 108 N -0.50 -3.21 -0.96 7.88 0.00 -1.26 -4.87 120.51 117.59 2h2s n ALA 108 Ca 0.04 -0.71 -0.29 0.00 0.00 0.00 0.00 53.44 52.48 2h2s n ALA 108 Cb 0.63 -1.67 0.18 0.00 0.00 0.00 0.00 19.45 18.59 2h2s n ALA 108 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2h2s s ASP 109 N -1.85 2.62 -0.30 0.00 1.01 -1.26 -4.78 116.67 112.10 2h2s s ASP 109 Ca 0.54 1.55 -0.10 0.00 0.71 0.00 0.00 52.55 55.25 2h2s s ASP 109 Cb -0.19 -2.21 0.15 0.00 1.01 0.00 0.00 42.92 41.68 2h2s s ASP 109 CO 0.69 -3.19 0.76 0.00 0.21 0.00 0.00 175.17 173.64 2h2s s ALA 110 N -2.78 -2.34 0.40 5.23 0.00 0.92 -4.87 121.76 118.32 2h2s s ALA 110 Ca 0.65 2.14 -0.23 0.00 0.00 0.00 0.00 51.96 54.53 2h2s s ALA 110 Cb -0.21 -1.95 -0.10 0.00 0.00 0.00 0.00 23.12 20.86 2h2s s ALA 110 CO 0.59 -1.03 0.97 0.00 0.00 0.00 0.00 175.76 176.30 2h2s s ALA 111 N 2.77 3.08 0.89 0.00 0.00 -1.26 -0.70 121.76 126.54 2h2s s ALA 111 Ca -0.01 0.51 -0.10 0.00 0.00 0.00 0.00 51.96 52.36 2h2s s ALA 111 Cb -0.11 -3.19 0.13 0.00 0.00 0.00 0.00 23.12 19.95 2h2s s ALA 111 CO -0.18 0.04 1.14 -2.14 0.00 0.00 0.00 175.76 174.61 2h2s s PRO 112 N -2.74 1.22 -0.60 0.00 0.02 -1.26 -4.59 135.00 127.04 2h2s s PRO 112 Ca 0.58 1.49 0.04 0.00 0.02 0.00 0.00 61.00 63.14 2h2s s PRO 112 Cb -0.15 -1.76 0.17 0.00 0.02 0.00 0.00 34.50 32.78 2h2s s PRO 112 CO 0.19 -2.47 0.43 0.99 -0.33 0.00 0.00 177.00 175.81 2h2s s THR 113 N -2.69 2.08 0.61 0.99 2.01 -1.21 -4.92 115.64 112.51 2h2s s THR 113 Ca 0.66 -3.69 -0.19 0.00 0.31 0.00 0.00 61.69 58.78 2h2s s THR 113 Cb -0.22 -2.38 -0.04 0.00 0.01 0.00 0.00 72.50 69.87 2h2s s THR 113 CO 0.58 -1.06 1.08 0.52 -0.69 0.00 0.00 174.62 175.05 2h2s n VAL 114 N 2.34 4.03 -3.73 3.82 0.31 -1.25 -3.73 118.33 120.12 2h2s n VAL 114 Ca 0.21 -0.50 -0.14 0.00 -0.01 0.00 0.00 64.34 63.91 2h2s n VAL 114 Cb 0.38 -1.28 -0.09 0.00 -0.91 0.00 0.00 33.84 31.95 2h2s n VAL 114 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 2h2s s SER 115 N -1.25 -0.33 -0.02 4.52 0.01 -0.30 -4.95 113.70 111.39 2h2s s SER 115 Ca 0.77 0.47 0.03 0.00 1.31 0.00 0.00 55.95 58.54 2h2s s SER 115 Cb -0.41 0.57 -0.01 0.00 0.21 0.00 0.00 66.02 66.38 2h2s s SER 115 CO 0.45 -0.31 -0.11 -0.63 0.41 0.00 0.00 173.24 173.06 2h2s s ILE 116 N -0.57 0.92 -0.03 1.44 -1.09 -1.26 -1.51 121.20 119.10 2h2s s ILE 116 Ca -0.07 -0.48 0.03 0.00 -2.23 0.00 0.00 60.65 57.91 2h2s s ILE 116 Cb -0.04 -0.79 0.00 0.00 -1.58 0.00 0.00 42.46 40.06 2h2s s ILE 116 CO 0.03 0.27 -0.12 -0.36 -1.23 0.00 0.00 174.94 173.52 2h2s s PHE 117 N -0.12 1.25 0.04 3.97 0.40 0.03 -5.00 117.98 118.55 2h2s s PHE 117 Ca 0.02 -0.33 -0.30 0.00 -0.60 0.00 0.00 56.93 55.71 2h2s s PHE 117 Cb -0.06 -0.86 -0.07 0.00 0.51 0.00 0.00 43.02 42.54 2h2s s PHE 117 CO -0.00 -0.12 1.45 -2.14 0.70 0.00 0.00 175.22 175.11 2h2s s PRO 118 N 0.11 4.27 -0.38 0.24 0.02 -1.26 -2.75 135.00 135.25 2h2s s PRO 118 Ca -0.03 2.06 -0.07 0.00 0.02 0.00 0.00 61.00 62.99 2h2s s PRO 118 Cb -0.09 -3.51 -0.11 0.00 0.02 0.00 0.00 34.50 30.81 2h2s s PRO 118 CO 0.01 -0.58 1.45 -2.30 -0.33 0.00 0.00 177.00 175.25 2h2s n PRO 119 N 5.12 0.04 -0.24 5.54 -0.02 -1.07 -4.71 135.00 139.66 2h2s n PRO 119 Ca 0.13 -0.28 -0.09 0.00 -2.02 0.00 0.00 63.50 61.25 2h2s n PRO 119 Cb 0.43 -1.53 -0.01 0.00 -0.02 0.00 0.00 33.50 32.36 2h2s n PRO 119 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2h2s n SER 120 N 7.52 -0.08 -0.23 2.55 2.88 -1.26 -4.46 113.62 120.53 2h2s n SER 120 Ca 0.21 0.19 -0.03 0.00 -1.33 0.00 0.00 58.87 57.91 2h2s n SER 120 Cb 0.42 -0.15 0.03 0.00 -0.75 0.00 0.00 64.21 63.76 2h2s n SER 120 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 2h2s h SER 121 N 0.35 -1.07 -0.74 -3.46 4.64 -1.98 0.17 113.55 111.47 2h2s h SER 121 Ca -0.07 0.23 0.11 0.00 -0.47 0.00 0.00 61.79 61.60 2h2s h SER 121 Cb 0.23 0.56 -0.08 0.00 -0.31 0.00 0.00 62.40 62.81 2h2s h SER 121 CO 0.10 -0.29 0.35 -0.33 -0.87 0.00 0.00 176.83 175.80 2h2s h GLU 122 N -0.11 0.55 0.00 4.77 5.08 -1.99 0.31 114.58 123.19 2h2s h GLU 122 Ca 0.27 -0.03 -0.06 0.00 -1.00 0.00 0.00 59.36 58.54 2h2s h GLU 122 Cb 0.55 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.67 2h2s h GLU 122 CO -0.73 0.37 -0.28 0.37 -1.00 0.00 0.00 179.01 177.74 2h2s h GLN 123 N 0.57 0.00 -0.06 2.33 4.15 -1.07 -2.87 115.11 118.16 2h2s h GLN 123 Ca 0.38 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.79 2h2s h GLN 123 Cb 0.47 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.15 2h2s h GLN 123 CO -0.31 0.28 -0.02 -0.07 -1.93 0.00 0.00 178.83 176.78 2h2s h LEU 124 N 0.00 0.12 0.00 -2.39 3.38 0.15 -0.98 115.31 115.59 2h2s h LEU 124 Ca -0.00 -0.39 0.00 0.00 0.09 0.00 0.00 57.88 57.58 2h2s h LEU 124 Cb 0.63 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.35 2h2s h LEU 124 CO 0.04 0.48 0.00 0.41 0.09 0.00 0.00 178.44 179.46 2h2s n THR 125 N -4.81 0.00 -0.11 0.22 -1.04 -0.18 0.12 114.28 108.48 2h2s n THR 125 Ca -0.07 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.94 2h2s n THR 125 Cb 0.23 -0.71 0.00 0.00 -1.82 0.00 0.00 70.33 68.04 2h2s n THR 125 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 2h2s n SER 126 N -0.59 0.13 0.00 8.00 2.88 -1.09 -5.02 113.62 117.93 2h2s n SER 126 Ca 0.00 -0.44 0.00 0.00 -1.33 0.00 0.00 58.87 57.10 2h2s n SER 126 Cb 0.00 0.42 0.00 0.00 -0.75 0.00 0.00 64.21 63.88 2h2s n SER 126 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2h2s n GLY 127 N 0.42 0.86 3.91 0.46 0.00 0.32 -5.08 105.19 106.08 2h2s n GLY 127 Ca 0.00 -0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 2h2s n GLY 127 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2h2s s GLY 128 N -2.00 2.22 -0.35 -0.02 0.00 -0.39 -3.08 107.32 103.69 2h2s s GLY 128 Ca 0.00 -0.68 0.00 0.00 0.00 0.00 0.00 44.72 44.04 2h2s s GLY 128 CO 0.00 -0.61 0.14 0.00 0.00 0.00 0.00 173.10 172.62 2h2s s ALA 129 N -1.54 1.77 -0.39 3.20 0.00 -0.67 -3.72 121.76 120.42 2h2s s ALA 129 Ca 0.36 -1.99 -0.07 0.00 0.00 0.00 0.00 51.96 50.26 2h2s s ALA 129 Cb -0.13 -1.72 0.07 0.00 0.00 0.00 0.00 23.12 21.34 2h2s s ALA 129 CO 0.25 -1.80 0.20 -1.12 0.00 0.00 0.00 175.76 173.29 2h2s s SER 130 N 1.20 5.48 -0.57 0.00 0.01 -1.26 0.47 113.70 119.02 2h2s s SER 130 Ca 0.12 -1.43 -0.17 0.00 1.31 0.00 0.00 55.95 55.78 2h2s s SER 130 Cb -0.20 -1.93 0.12 0.00 0.21 0.00 0.00 66.02 64.23 2h2s s SER 130 CO -0.16 -0.46 0.61 -0.69 0.41 0.00 0.00 173.24 172.95 2h2s s VAL 131 N 1.38 5.03 0.15 3.43 1.01 -0.04 -2.61 120.40 128.75 2h2s s VAL 131 Ca 0.02 -1.28 -0.19 0.00 0.00 0.00 0.00 61.98 60.53 2h2s s VAL 131 Cb -0.22 -4.42 -0.07 0.00 0.00 0.00 0.00 36.38 31.67 2h2s s VAL 131 CO 0.02 -1.00 0.64 -0.69 0.00 0.00 0.00 175.10 174.06 2h2s s VAL 132 N 2.10 4.68 -0.23 2.92 1.01 -1.11 -2.44 120.40 127.32 2h2s s VAL 132 Ca 0.08 1.19 -0.03 0.00 0.00 0.00 0.00 61.98 63.21 2h2s s VAL 132 Cb -0.27 -3.87 0.10 0.00 0.00 0.00 0.00 36.38 32.34 2h2s s VAL 132 CO 0.04 0.36 0.20 0.00 0.00 0.00 0.00 175.10 175.70 2h2s s PHE 134 N 2.27 3.22 -0.63 0.00 0.08 -0.57 -1.18 117.98 121.16 2h2s s PHE 134 Ca 0.07 0.31 0.01 0.00 0.12 0.00 0.00 56.93 57.44 2h2s s PHE 134 Cb -0.15 -2.74 0.16 0.00 -0.57 0.00 0.00 43.02 39.71 2h2s s PHE 134 CO -0.20 -0.38 0.42 -0.48 -0.10 0.00 0.00 175.22 174.48 2h2s s LEU 135 N 2.23 4.87 0.00 -0.37 2.34 -0.53 -1.15 118.68 126.07 2h2s s LEU 135 Ca 0.17 -3.18 -0.16 0.00 0.06 0.00 0.00 54.13 51.03 2h2s s LEU 135 Cb -0.16 -1.75 0.21 0.00 -0.56 0.00 0.00 46.19 43.94 2h2s s LEU 135 CO 0.11 -0.25 1.26 0.59 -1.06 0.00 0.00 176.35 177.00 2h2s n ASN 136 N 2.97 0.10 -2.06 1.48 5.03 -1.24 -2.31 115.26 119.23 2h2s n ASN 136 Ca 0.10 -1.46 0.00 0.00 0.87 0.00 0.00 54.58 54.10 2h2s n ASN 136 Cb 0.35 -0.96 0.00 0.00 -1.02 0.00 0.00 39.78 38.15 2h2s n ASN 136 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 2h2s n ASN 137 N -3.81 0.00 -4.47 6.41 3.02 -1.09 -3.32 115.26 112.01 2h2s n ASN 137 Ca 0.16 0.00 -0.22 0.00 -0.03 0.00 0.00 54.58 54.48 2h2s n ASN 137 Cb 0.55 0.00 -0.11 0.00 -0.61 0.00 0.00 39.78 39.61 2h2s n ASN 137 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 2h2s s PHE 138 N -1.61 2.04 -0.29 3.10 -0.12 -0.82 -4.54 117.98 115.73 2h2s s PHE 138 Ca 0.00 -0.82 -0.21 0.00 -0.05 0.00 0.00 56.93 55.84 2h2s s PHE 138 Cb 0.00 -1.30 0.17 0.00 -0.63 0.00 0.00 43.02 41.26 2h2s s PHE 138 CO 0.00 0.17 1.23 -0.47 -0.05 0.00 0.00 175.22 176.10 2h2s s TYR 139 N -3.11 -0.24 1.24 3.49 6.14 0.12 0.39 117.35 125.38 2h2s s TYR 139 Ca 0.34 0.54 -0.19 0.00 0.64 0.00 0.00 57.07 58.41 2h2s s TYR 139 Cb 0.07 0.33 0.29 0.00 0.42 0.00 0.00 41.96 43.07 2h2s s TYR 139 CO 0.15 -0.12 0.64 -2.30 0.64 0.00 0.00 175.55 174.56 2h2s n PRO 140 N 2.44 -3.64 0.11 4.97 -0.02 -1.26 -0.06 135.00 137.55 2h2s n PRO 140 Ca -0.14 -1.08 -0.01 0.00 -2.02 0.00 0.00 63.50 60.25 2h2s n PRO 140 Cb 0.57 -1.70 0.02 0.00 -0.02 0.00 0.00 33.50 32.36 2h2s n PRO 140 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 2h2s h LYS 141 N -3.22 0.00 -6.09 -0.52 2.10 -1.98 -3.45 116.57 103.42 2h2s h LYS 141 Ca -0.31 0.00 -0.62 0.00 -2.00 0.00 0.00 60.65 57.72 2h2s h LYS 141 Cb 1.02 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.35 2h2s h LYS 141 CO 0.19 0.69 1.36 -0.25 -2.00 0.00 0.00 179.45 179.43 2h2s n ASP 142 N -3.35 3.05 -3.70 7.07 8.00 -1.26 -4.94 116.55 121.43 2h2s n ASP 142 Ca 0.01 0.51 -0.12 0.00 0.71 0.00 0.00 54.79 55.89 2h2s n ASP 142 Cb 0.78 -1.42 -0.06 0.00 -0.02 0.00 0.00 41.12 40.39 2h2s n ASP 142 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 2h2s s ILE 143 N 6.69 0.07 -0.07 0.53 2.07 -1.26 -4.50 121.20 124.72 2h2s s ILE 143 Ca 1.01 -0.56 0.01 0.00 -1.41 0.00 0.00 60.65 59.69 2h2s s ILE 143 Cb -0.58 -0.98 0.02 0.00 0.13 0.00 0.00 42.46 41.05 2h2s s ILE 143 CO 0.44 -0.31 -0.07 0.20 -1.91 0.00 0.00 174.94 173.29 2h2s s ASN 144 N -2.12 1.54 0.16 4.50 0.01 -1.04 -4.99 114.94 113.00 2h2s s ASN 144 Ca -0.04 -0.21 0.05 0.00 -0.71 0.00 0.00 52.86 51.95 2h2s s ASN 144 Cb -0.00 -0.64 -0.04 0.00 0.41 0.00 0.00 41.25 40.97 2h2s s ASN 144 CO -0.04 -0.06 0.14 0.54 -1.51 0.00 0.00 177.10 176.17 2h2s s VAL 145 N 1.16 4.51 -0.04 1.60 0.11 -1.26 -0.01 120.40 126.47 2h2s s VAL 145 Ca -0.06 -1.07 0.02 0.00 -2.93 0.00 0.00 61.98 57.94 2h2s s VAL 145 Cb -0.14 -3.30 0.01 0.00 -1.53 0.00 0.00 36.38 31.42 2h2s s VAL 145 CO -0.01 -0.11 -0.07 -0.75 -3.33 0.00 0.00 175.10 170.83 2h2s s LYS 146 N -3.10 0.90 -0.13 1.54 2.20 0.20 -4.89 119.74 116.46 2h2s s LYS 146 Ca 0.31 -0.20 -0.04 0.00 -0.36 0.00 0.00 55.97 55.68 2h2s s LYS 146 Cb -0.10 -0.85 -0.03 0.00 -1.51 0.00 0.00 37.83 35.33 2h2s s LYS 146 CO 0.24 0.01 -0.00 -1.58 -0.36 0.00 0.00 175.35 173.66 2h2s s TRP 147 N 0.55 3.13 -0.16 4.03 0.52 -1.26 0.91 118.94 126.66 2h2s s TRP 147 Ca -0.08 0.00 -0.03 0.00 0.02 0.00 0.00 56.10 56.01 2h2s s TRP 147 Cb -0.11 -1.90 0.05 0.00 -1.15 0.00 0.00 33.47 30.36 2h2s s TRP 147 CO 0.01 0.23 0.05 0.15 0.02 0.00 0.00 176.95 177.41 2h2s s LYS 148 N -0.21 0.42 -0.46 4.98 1.02 -0.47 -0.25 119.74 124.77 2h2s s LYS 148 Ca 0.05 -0.19 -0.13 0.00 0.02 0.00 0.00 55.97 55.72 2h2s s LYS 148 Cb -0.12 -1.77 0.09 0.00 -0.52 0.00 0.00 37.83 35.50 2h2s s LYS 148 CO 0.02 -0.58 0.35 0.42 -0.92 0.00 0.00 175.35 174.64 2h2s s ILE 149 N 1.98 4.78 -0.66 2.17 1.01 -0.99 -0.36 121.20 129.12 2h2s s ILE 149 Ca 0.01 -1.29 -0.08 0.00 0.00 0.00 0.00 60.65 59.29 2h2s s ILE 149 Cb -0.16 -3.93 0.01 0.00 0.01 0.00 0.00 42.46 38.40 2h2s s ILE 149 CO -0.08 -0.60 0.65 0.47 0.00 0.00 0.00 174.94 175.38 2h2s n ASP 150 N 5.08 -6.82 0.00 3.58 9.92 1.28 -2.85 116.55 126.74 2h2s n ASP 150 Ca -0.11 -0.18 0.00 0.00 -0.53 0.00 0.00 54.79 53.97 2h2s n ASP 150 Cb 0.43 -3.98 0.00 0.00 -0.64 0.00 0.00 41.12 36.93 2h2s n ASP 150 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2h2s n GLY 151 N -1.24 0.97 3.57 0.44 0.00 -1.26 -4.95 105.19 102.71 2h2s n GLY 151 Ca -0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.56 2h2s n GLY 151 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2h2s s SER 152 N -1.59 6.08 -0.74 1.61 0.15 -1.13 -5.01 113.70 113.07 2h2s s SER 152 Ca 0.00 -0.09 -0.25 0.00 0.70 0.00 0.00 55.95 56.31 2h2s s SER 152 Cb 0.00 -2.15 -0.14 0.00 -1.71 0.00 0.00 66.02 62.03 2h2s s SER 152 CO 0.00 -0.15 2.41 1.21 1.20 0.00 0.00 173.24 177.91 2h2s n GLU 153 N 5.15 0.62 -2.01 5.44 2.13 -1.25 -2.36 120.64 128.37 2h2s n GLU 153 Ca -0.12 -0.64 -0.32 0.00 0.66 0.00 0.00 57.16 56.73 2h2s n GLU 153 Cb 0.51 -3.51 0.01 0.00 0.27 0.00 0.00 31.44 28.72 2h2s n GLU 153 CO 0.00 0.00 0.00 0.50 -0.41 0.00 0.00 177.13 177.22 2h2s s ARG 154 N 8.72 3.35 0.06 5.31 6.06 0.65 -4.96 118.95 138.14 2h2s s ARG 154 Ca 0.96 1.11 0.00 0.00 -2.50 0.00 0.00 55.73 55.31 2h2s s ARG 154 Cb -0.19 -2.04 0.00 0.00 0.06 0.00 0.00 34.95 32.78 2h2s s ARG 154 CO 0.14 -0.78 0.00 1.04 -2.50 0.00 0.00 175.30 173.20 2h2s n GLN 155 N -2.18 0.00 -1.48 5.12 6.02 -1.26 -4.24 117.38 119.36 2h2s n GLN 155 Ca 0.08 0.00 -0.30 0.00 -0.01 0.00 0.00 57.00 56.77 2h2s n GLN 155 Cb 0.53 -0.41 0.11 0.00 1.02 0.00 0.00 30.24 31.49 2h2s n GLN 155 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 2h2s s ASN 156 N -5.33 4.18 0.00 1.08 0.01 -1.26 -3.54 114.94 110.08 2h2s s ASN 156 Ca 0.00 1.31 0.00 0.00 -0.71 0.00 0.00 52.86 53.46 2h2s s ASN 156 Cb 0.00 -2.01 0.00 0.00 0.41 0.00 0.00 41.25 39.65 2h2s s ASN 156 CO 0.00 -2.17 0.00 0.61 -1.51 0.00 0.00 177.10 174.03 2h2s n GLY 157 N -1.91 0.86 3.64 0.66 0.00 -1.26 -4.84 105.19 102.34 2h2s n GLY 157 Ca 0.07 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.72 2h2s n GLY 157 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2h2s s VAL 158 N -2.95 5.33 0.01 1.61 1.01 -1.23 0.21 120.40 124.39 2h2s s VAL 158 Ca 0.00 0.22 0.02 0.00 0.00 0.00 0.00 61.98 62.22 2h2s s VAL 158 Cb 0.00 -3.53 -0.01 0.00 0.00 0.00 0.00 36.38 32.84 2h2s s VAL 158 CO 0.00 0.30 -0.06 -0.76 0.00 0.00 0.00 175.10 174.58 2h2s s LEU 159 N 1.33 2.09 -0.04 3.92 1.43 0.11 -4.92 118.68 122.60 2h2s s LEU 159 Ca 0.08 -0.24 -0.03 0.00 -1.03 0.00 0.00 54.13 52.91 2h2s s LEU 159 Cb -0.14 -0.26 0.02 0.00 0.03 0.00 0.00 46.19 45.84 2h2s s LEU 159 CO 0.07 -0.01 0.10 0.54 0.23 0.00 0.00 176.35 177.27 2h2s s ASN 160 N -0.58 -0.07 -0.08 2.29 4.22 -1.25 0.28 114.94 119.75 2h2s s ASN 160 Ca -0.01 0.19 0.04 0.00 -2.14 0.00 0.00 52.86 50.94 2h2s s ASN 160 Cb -0.05 0.15 -0.01 0.00 1.28 0.00 0.00 41.25 42.62 2h2s s ASN 160 CO 0.00 -0.08 -0.21 -0.55 -2.04 0.00 0.00 177.10 174.22 2h2s s SER 161 N 0.52 3.43 -0.15 3.54 0.15 -0.68 -4.88 113.70 115.64 2h2s s SER 161 Ca -0.04 -0.42 -0.15 0.00 0.70 0.00 0.00 55.95 56.04 2h2s s SER 161 Cb -0.06 -1.06 -0.05 0.00 -1.71 0.00 0.00 66.02 63.15 2h2s s SER 161 CO -0.02 0.24 0.33 0.26 1.20 0.00 0.00 173.24 175.24 2h2s s TRP 162 N -0.11 3.48 0.78 3.44 0.51 -1.26 -2.48 118.94 123.30 2h2s s TRP 162 Ca -0.04 0.66 -0.12 0.00 -2.12 0.00 0.00 56.10 54.48 2h2s s TRP 162 Cb -0.14 -2.38 0.06 0.00 -0.81 0.00 0.00 33.47 30.20 2h2s s TRP 162 CO 0.04 0.24 1.11 0.95 -0.51 0.00 0.00 176.95 178.78 2h2s s THR 163 N 0.45 2.97 0.46 2.01 -4.23 -0.91 -4.97 115.64 111.42 2h2s s THR 163 Ca 0.18 0.31 -0.10 0.00 -1.18 0.00 0.00 61.69 60.91 2h2s s THR 163 Cb -0.13 -3.17 -0.06 0.00 1.34 0.00 0.00 72.50 70.48 2h2s s THR 163 CO 0.05 -0.41 0.84 -0.62 -0.54 0.00 0.00 174.62 173.94 2h2s s ASP 164 N -4.14 6.44 0.32 3.99 -1.08 -1.26 -4.25 116.67 116.69 2h2s s ASP 164 Ca 0.60 1.18 -0.23 0.00 -0.52 0.00 0.00 52.55 53.58 2h2s s ASP 164 Cb -0.13 -2.35 -0.16 0.00 -1.46 0.00 0.00 42.92 38.82 2h2s s ASP 164 CO 0.53 -0.53 0.24 1.67 0.52 0.00 0.00 175.17 177.60 2h2s n GLN 165 N -1.74 0.00 -2.72 4.34 7.27 -1.26 -4.80 117.38 118.46 2h2s n GLN 165 Ca 0.03 0.00 -0.40 0.00 0.07 0.00 0.00 57.00 56.70 2h2s n GLN 165 Cb 0.54 -0.97 -0.06 0.00 2.41 0.00 0.00 30.24 32.16 2h2s n GLN 165 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 2h2s s ASP 166 N -0.97 7.58 0.12 1.69 -1.08 -0.39 -4.94 116.67 118.67 2h2s s ASP 166 Ca 0.59 1.97 -0.20 0.00 -0.52 0.00 0.00 52.55 54.39 2h2s s ASP 166 Cb -0.73 -2.61 -0.06 0.00 -1.46 0.00 0.00 42.92 38.06 2h2s s ASP 166 CO 0.59 0.11 1.74 0.28 0.52 0.00 0.00 175.17 178.40 2h2s h SER 167 N 4.02 0.04 0.00 -0.34 0.02 -1.89 -2.27 113.55 113.13 2h2s h SER 167 Ca -0.45 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.52 2h2s h SER 167 Cb 1.20 0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.76 2h2s h SER 167 CO 0.68 0.05 0.00 0.29 -1.14 0.00 0.00 176.83 176.70 2h2s n LYS 168 N -5.07 0.00 0.23 3.45 4.76 -1.26 -3.86 118.16 116.41 2h2s n LYS 168 Ca -0.04 0.20 0.16 0.00 -2.87 0.00 0.00 58.31 55.76 2h2s n LYS 168 Cb 0.07 -0.80 0.63 0.00 -1.84 0.00 0.00 35.03 33.10 2h2s n LYS 168 CO 0.00 0.00 0.00 0.38 -1.37 0.00 0.00 177.40 176.41 2h2s h ASP 169 N 0.00 0.00 0.00 4.39 3.04 -1.92 -3.41 116.42 118.53 2h2s h ASP 169 Ca 0.00 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.79 2h2s h ASP 169 Cb 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.29 2h2s h ASP 169 CO 0.00 0.00 0.00 -1.20 -2.04 0.00 0.00 179.24 176.00 2h2s n SER 170 N -2.78 -1.86 -4.89 4.15 7.64 -0.85 -4.97 113.62 110.05 2h2s n SER 170 Ca 0.01 0.00 -0.29 0.00 1.01 0.00 0.00 58.87 59.60 2h2s n SER 170 Cb 0.27 -0.31 -0.03 0.00 -1.01 0.00 0.00 64.21 63.13 2h2s n SER 170 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2h2s s THR 171 N -2.75 4.95 0.00 0.44 -4.23 -1.26 -4.43 115.64 108.37 2h2s s THR 171 Ca 0.00 0.24 0.00 0.00 -1.18 0.00 0.00 61.69 60.75 2h2s s THR 171 Cb 0.00 -3.72 0.00 0.00 1.34 0.00 0.00 72.50 70.12 2h2s s THR 171 CO 0.00 -0.35 0.00 -1.22 -0.54 0.00 0.00 174.62 172.51 2h2s n TYR 172 N -0.96 -2.67 -3.70 3.99 4.02 0.16 -1.27 117.16 116.73 2h2s n TYR 172 Ca -0.00 0.00 -0.08 0.00 -0.01 0.00 0.00 57.90 57.81 2h2s n TYR 172 Cb 0.54 0.00 -0.02 0.00 -0.02 0.00 0.00 39.34 39.84 2h2s n TYR 172 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 176.86 174.73 2h2s s SER 173 N -1.00 -0.33 0.16 7.72 0.01 -1.26 -1.95 113.70 117.05 2h2s s SER 173 Ca 0.00 -0.37 -0.19 0.00 1.31 0.00 0.00 55.95 56.70 2h2s s SER 173 Cb 0.00 0.62 0.05 0.00 0.21 0.00 0.00 66.02 66.89 2h2s s SER 173 CO 0.00 -1.10 0.51 -0.32 0.41 0.00 0.00 173.24 172.74 2h2s s MET 174 N -3.67 1.23 -0.22 12.44 1.75 -0.98 -2.14 119.30 127.71 2h2s s MET 174 Ca 0.08 -0.65 -0.03 0.00 -1.25 0.00 0.00 55.69 53.84 2h2s s MET 174 Cb -0.03 0.53 0.11 0.00 2.84 0.00 0.00 34.83 38.28 2h2s s MET 174 CO -0.00 -0.51 0.31 -1.54 -0.65 0.00 0.00 175.02 172.63 2h2s s SER 175 N -2.80 0.69 -0.08 1.11 1.04 -1.04 -1.45 113.70 111.17 2h2s s SER 175 Ca 0.04 0.08 -0.16 0.00 0.48 0.00 0.00 55.95 56.38 2h2s s SER 175 Cb 0.00 0.81 -0.05 0.00 0.10 0.00 0.00 66.02 66.89 2h2s s SER 175 CO -0.10 -0.31 0.42 -0.55 0.98 0.00 0.00 173.24 173.68 2h2s s SER 176 N 2.45 6.69 -0.11 7.02 0.15 -0.33 -1.69 113.70 127.88 2h2s s SER 176 Ca 0.10 0.82 -0.03 0.00 0.70 0.00 0.00 55.95 57.53 2h2s s SER 176 Cb -0.15 -2.26 0.05 0.00 -1.71 0.00 0.00 66.02 61.95 2h2s s SER 176 CO -0.14 0.13 0.07 -0.89 1.20 0.00 0.00 173.24 173.61 2h2s s THR 177 N -0.01 -0.04 -0.18 6.45 2.01 0.82 -1.14 115.64 123.56 2h2s s THR 177 Ca 0.23 0.08 -0.10 0.00 0.31 0.00 0.00 61.69 62.21 2h2s s THR 177 Cb -0.15 -0.42 -0.05 0.00 0.01 0.00 0.00 72.50 71.89 2h2s s THR 177 CO 0.10 -0.05 0.17 -0.22 -0.69 0.00 0.00 174.62 173.93 2h2s s LEU 178 N 2.13 4.25 -0.07 4.42 2.96 -1.02 -0.71 118.68 130.63 2h2s s LEU 178 Ca 0.03 0.33 0.04 0.00 -0.22 0.00 0.00 54.13 54.31 2h2s s LEU 178 Cb -0.14 -2.15 0.00 0.00 0.50 0.00 0.00 46.19 44.40 2h2s s LEU 178 CO -0.06 0.20 -0.19 -0.89 -1.32 0.00 0.00 176.35 174.09 2h2s s THR 179 N 0.15 1.59 0.50 3.68 2.01 0.13 -0.86 115.64 122.85 2h2s s THR 179 Ca 0.11 -0.77 0.05 0.00 0.31 0.00 0.00 61.69 61.39 2h2s s THR 179 Cb -0.12 -1.38 0.01 0.00 0.01 0.00 0.00 72.50 71.02 2h2s s THR 179 CO 0.00 0.45 0.28 -0.76 -0.69 0.00 0.00 174.62 173.91 2h2s s LEU 180 N 0.26 2.74 -0.02 4.42 1.43 0.18 -4.69 118.68 123.00 2h2s s LEU 180 Ca -0.11 -1.26 0.00 0.00 -1.03 0.00 0.00 54.13 51.73 2h2s s LEU 180 Cb -0.15 -1.20 0.04 0.00 0.03 0.00 0.00 46.19 44.91 2h2s s LEU 180 CO 0.05 -0.92 1.03 0.35 0.23 0.00 0.00 176.35 177.09 2h2s n THR 181 N -1.55 1.09 0.00 5.49 -2.24 -1.26 -1.67 114.28 114.13 2h2s n THR 181 Ca -0.05 -0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.63 2h2s n THR 181 Cb 0.65 -0.96 0.00 0.00 -2.10 0.00 0.00 70.33 67.92 2h2s n THR 181 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 2h2s n LYS 182 N 0.40 0.00 0.19 -0.78 4.81 -1.18 -3.67 118.16 117.94 2h2s n LYS 182 Ca 0.03 0.00 0.14 0.00 -0.87 0.00 0.00 58.31 57.61 2h2s n LYS 182 Cb 0.55 0.00 0.61 0.00 0.02 0.00 0.00 35.03 36.21 2h2s n LYS 182 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 2h2s h ASP 183 N 0.00 0.00 0.38 3.14 3.32 -1.90 -0.17 116.42 121.18 2h2s h ASP 183 Ca 0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 2h2s h ASP 183 Cb 0.00 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.55 2h2s h ASP 183 CO 0.00 0.00 -0.08 -0.08 -1.72 0.00 0.00 179.24 177.36 2h2s h GLU 184 N 0.00 0.00 0.00 3.56 4.57 -1.91 -2.87 114.58 117.93 2h2s h GLU 184 Ca 0.00 0.00 -0.33 0.00 -1.18 0.00 0.00 59.36 57.85 2h2s h GLU 184 Cb 0.35 0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 28.89 2h2s h GLU 184 CO 0.00 0.08 -1.90 0.98 -1.18 0.00 0.00 179.01 176.99 2h2s n TYR 185 N -3.49 0.36 0.77 0.92 9.36 -0.20 -4.39 117.16 120.49 2h2s n TYR 185 Ca -0.02 0.16 0.00 0.00 3.32 0.00 0.00 57.90 61.36 2h2s n TYR 185 Cb 0.21 -0.97 0.00 0.00 -0.63 0.00 0.00 39.34 37.95 2h2s n TYR 185 CO 0.00 0.00 0.00 0.39 0.22 0.00 0.00 176.86 177.47 2h2s n GLU 186 N -4.35 0.39 -0.07 2.98 1.02 -0.49 -1.66 120.64 118.46 2h2s n GLU 186 Ca -0.41 0.00 -0.10 0.00 -0.02 0.00 0.00 57.16 56.63 2h2s n GLU 186 Cb 0.76 -1.01 -0.08 0.00 -0.02 0.00 0.00 31.44 31.09 2h2s n GLU 186 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 2h2s n ARG 187 N -0.47 0.74 -2.98 3.49 1.85 -1.10 -4.96 116.66 113.23 2h2s n ARG 187 Ca 0.00 0.07 -0.18 0.00 -1.00 0.00 0.00 57.85 56.74 2h2s n ARG 187 Cb 0.00 -1.31 0.01 0.00 -1.05 0.00 0.00 32.46 30.12 2h2s n ARG 187 CO 0.00 0.00 0.00 -1.01 -0.01 0.00 0.00 177.63 176.61 2h2s s HIS 188 N -2.31 2.86 0.00 2.89 3.76 -0.67 -5.06 115.29 116.77 2h2s s HIS 188 Ca -0.18 -0.28 0.00 0.00 -0.15 0.00 0.00 55.06 54.45 2h2s s HIS 188 Cb 0.05 -2.42 0.00 0.00 1.11 0.00 0.00 32.58 31.32 2h2s s HIS 188 CO 0.39 -0.48 0.00 -1.71 -0.85 0.00 0.00 174.74 172.09 2h2s n ASN 189 N -1.94 1.04 -4.06 1.40 2.85 -1.26 -4.79 115.26 108.51 2h2s n ASN 189 Ca 0.07 -0.18 -0.30 0.00 -0.11 0.00 0.00 54.58 54.07 2h2s n ASN 189 Cb 0.59 0.57 -0.17 0.00 1.24 0.00 0.00 39.78 42.01 2h2s n ASN 189 CO 0.00 0.00 0.00 -0.55 -2.11 0.00 0.00 177.26 174.60 2h2s s SER 190 N -0.77 2.63 -0.04 1.20 0.15 -1.26 0.64 113.70 116.24 2h2s s SER 190 Ca 0.00 -0.48 0.05 0.00 0.70 0.00 0.00 55.95 56.23 2h2s s SER 190 Cb 0.00 -1.18 -0.02 0.00 -1.71 0.00 0.00 66.02 63.11 2h2s s SER 190 CO 0.00 -0.00 -0.20 -0.31 1.20 0.00 0.00 173.24 173.93 2h2s s TYR 191 N 1.14 2.54 0.05 3.44 1.51 0.11 0.39 117.35 126.53 2h2s s TYR 191 Ca -0.02 -0.30 0.00 0.00 -1.01 0.00 0.00 57.07 55.74 2h2s s TYR 191 Cb -0.14 -1.58 -0.03 0.00 -0.11 0.00 0.00 41.96 40.10 2h2s s TYR 191 CO -0.05 0.07 -0.05 0.95 -1.11 0.00 0.00 175.55 175.36 2h2s s THR 192 N -0.64 0.35 -0.06 -0.71 -4.23 0.51 -0.18 115.64 110.68 2h2s s THR 192 Ca 0.10 -1.44 0.01 0.00 -1.18 0.00 0.00 61.69 59.18 2h2s s THR 192 Cb -0.11 -1.02 0.02 0.00 1.34 0.00 0.00 72.50 72.74 2h2s s THR 192 CO 0.00 -0.71 -0.05 0.00 -0.54 0.00 0.00 174.62 173.32 2h2s s GLU 194 N 1.12 1.77 -0.12 0.00 2.02 0.26 -0.55 118.70 123.20 2h2s s GLU 194 Ca -0.08 -1.73 -0.17 0.00 0.02 0.00 0.00 54.97 53.02 2h2s s GLU 194 Cb -0.14 -3.20 -0.04 0.00 0.10 0.00 0.00 34.13 30.85 2h2s s GLU 194 CO -0.01 -0.87 0.44 0.00 0.02 0.00 0.00 175.26 174.85 2h2s s ALA 195 N 1.00 3.51 -0.25 5.21 0.00 0.20 0.62 121.76 132.05 2h2s s ALA 195 Ca 0.06 -0.23 0.01 0.00 0.00 0.00 0.00 51.96 51.79 2h2s s ALA 195 Cb -0.20 -2.59 0.07 0.00 0.00 0.00 0.00 23.12 20.40 2h2s s ALA 195 CO -0.06 0.05 -0.03 0.99 0.00 0.00 0.00 175.76 176.71 2h2s s THR 196 N 0.48 1.52 -0.05 0.00 2.01 0.98 -0.36 115.64 120.21 2h2s s THR 196 Ca 0.24 -1.33 0.00 0.00 0.31 0.00 0.00 61.69 60.91 2h2s s THR 196 Cb -0.15 -1.85 0.02 0.00 0.01 0.00 0.00 72.50 70.53 2h2s s THR 196 CO 0.10 -0.21 -0.02 -2.28 -0.69 0.00 0.00 174.62 171.52 2h2s s HIS 197 N 1.38 0.63 0.00 4.92 5.65 -1.26 -2.50 115.29 124.12 2h2s s HIS 197 Ca -0.03 -0.15 0.00 0.00 0.25 0.00 0.00 55.06 55.13 2h2s s HIS 197 Cb -0.19 -0.65 0.00 0.00 -1.18 0.00 0.00 32.58 30.56 2h2s s HIS 197 CO -0.08 -0.22 0.00 1.17 -0.65 0.00 0.00 174.74 174.96 2h2s n LYS 198 N 4.40 0.00 0.03 2.88 4.81 -1.26 0.36 118.16 129.38 2h2s n LYS 198 Ca -0.20 0.00 0.01 0.00 -0.87 0.00 0.00 58.31 57.25 2h2s n LYS 198 Cb 0.50 0.00 0.05 0.00 0.02 0.00 0.00 35.03 35.61 2h2s n LYS 198 CO 0.00 0.00 0.00 2.41 1.17 0.00 0.00 177.40 180.98 2h2s n THR 199 N -0.51 0.76 -3.67 3.15 -1.04 -1.26 -4.49 114.28 107.22 2h2s n THR 199 Ca 0.00 0.55 -0.14 0.00 -2.04 0.00 0.00 64.05 62.42 2h2s n THR 199 Cb 0.00 -1.55 -0.08 0.00 -1.82 0.00 0.00 70.33 66.88 2h2s n THR 199 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 2h2s s SER 200 N -2.57 -0.57 -0.01 8.00 0.15 0.16 -4.99 113.70 113.86 2h2s s SER 200 Ca -0.00 1.04 -0.20 0.00 0.70 0.00 0.00 55.95 57.49 2h2s s SER 200 Cb 0.01 1.05 -0.28 0.00 -1.71 0.00 0.00 66.02 65.08 2h2s s SER 200 CO 0.02 -0.25 1.01 0.71 1.20 0.00 0.00 173.24 175.93 2h2s h THR 201 N 4.11 1.43 -2.89 6.45 1.35 -1.86 -3.39 112.91 118.12 2h2s h THR 201 Ca -0.28 -2.36 -0.70 0.00 -0.55 0.00 0.00 66.41 62.52 2h2s h THR 201 Cb 1.17 2.89 -0.20 0.00 -1.73 0.00 0.00 68.15 70.28 2h2s h THR 201 CO 0.19 0.69 0.13 -0.94 -0.25 0.00 0.00 175.52 175.34 2h2s s SER 202 N -6.99 6.18 0.11 5.36 1.04 -1.26 -5.02 113.70 113.11 2h2s s SER 202 Ca -0.13 -1.42 -0.15 0.00 0.48 0.00 0.00 55.95 54.74 2h2s s SER 202 Cb 0.03 -2.31 -0.09 0.00 0.10 0.00 0.00 66.02 63.75 2h2s s SER 202 CO 0.85 -1.13 0.27 -0.81 0.98 0.00 0.00 173.24 173.40 2h2s n PRO 203 N 6.39 0.00 -3.33 4.02 -0.04 -1.26 -4.94 135.00 135.84 2h2s n PRO 203 Ca -0.09 0.00 -0.38 0.00 -0.04 0.00 0.00 63.50 62.98 2h2s n PRO 203 Cb 0.42 -0.54 -0.06 0.00 -0.04 0.00 0.00 33.50 33.29 2h2s n PRO 203 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2h2s s ILE 204 N -0.54 4.87 -0.03 0.52 1.01 0.51 -4.90 121.20 122.65 2h2s s ILE 204 Ca 0.34 1.10 -0.01 0.00 0.00 0.00 0.00 60.65 62.09 2h2s s ILE 204 Cb -0.49 -3.85 0.03 0.00 0.01 0.00 0.00 42.46 38.15 2h2s s ILE 204 CO 0.30 0.52 0.05 0.68 0.00 0.00 0.00 174.94 176.50 2h2s s VAL 205 N -0.84 -0.05 0.04 2.92 -7.23 -1.26 0.59 120.40 114.58 2h2s s VAL 205 Ca 0.28 0.17 0.05 0.00 -1.81 0.00 0.00 61.98 60.67 2h2s s VAL 205 Cb -0.18 -0.11 -0.03 0.00 0.56 0.00 0.00 36.38 36.62 2h2s s VAL 205 CO 0.17 0.07 -0.11 -0.54 -0.31 0.00 0.00 175.10 174.37 2h2s s LYS 206 N 0.90 2.30 0.08 4.82 -0.14 0.29 -4.91 119.74 123.08 2h2s s LYS 206 Ca -0.07 -0.87 -0.13 0.00 -1.36 0.00 0.00 55.97 53.54 2h2s s LYS 206 Cb -0.10 -2.35 0.02 0.00 -1.68 0.00 0.00 37.83 33.71 2h2s s LYS 206 CO -0.03 0.56 0.29 -1.12 -0.76 0.00 0.00 175.35 174.30 2h2s s SER 207 N -1.58 -0.08 0.05 2.83 0.01 -1.26 0.94 113.70 114.62 2h2s s SER 207 Ca 0.17 -0.37 -0.17 0.00 1.31 0.00 0.00 55.95 56.89 2h2s s SER 207 Cb -0.11 0.38 0.03 0.00 0.21 0.00 0.00 66.02 66.54 2h2s s SER 207 CO 0.08 -0.71 0.40 0.72 0.41 0.00 0.00 173.24 174.14 2h2s s PHE 208 N -3.28 -0.24 -0.02 2.43 -0.12 0.75 -4.97 117.98 112.52 2h2s s PHE 208 Ca 0.00 0.16 0.03 0.00 -0.05 0.00 0.00 56.93 57.08 2h2s s PHE 208 Cb 0.02 0.21 -0.00 0.00 -0.63 0.00 0.00 43.02 42.61 2h2s s PHE 208 CO -0.08 -0.58 -0.12 -0.80 -0.05 0.00 0.00 175.22 173.60 2h2s s ASN 209 N -2.09 1.46 0.23 1.98 0.01 -1.25 0.06 114.94 115.34 2h2s s ASN 209 Ca -0.04 -0.23 0.16 0.00 -0.71 0.00 0.00 52.86 52.04 2h2s s ASN 209 Cb -0.01 -0.30 0.81 0.00 0.41 0.00 0.00 41.25 42.16 2h2s s ASN 209 CO -0.03 0.11 0.89 0.54 -1.51 0.00 0.00 177.10 177.10 2h2s n ARG 210 N 3.06 -0.03 0.00 -0.60 5.12 0.21 -4.98 116.66 119.44 2h2s n ARG 210 Ca -0.16 0.74 0.15 0.00 -1.93 0.00 0.00 57.85 56.65 2h2s n ARG 210 Cb 0.55 -1.40 0.78 0.00 -1.16 0.00 0.00 32.46 31.22 2h2s n ARG 210 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70