#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3idm s ILE 2 N 0.00 5.04 -0.00 5.15 1.01 -1.26 -3.93 121.20 127.20 3idm s ILE 2 Ca 0.00 1.20 0.02 0.00 0.00 0.00 0.00 60.65 61.87 3idm s ILE 2 Cb 0.00 -3.95 -0.01 0.00 0.01 0.00 0.00 42.46 38.52 3idm s ILE 2 CO 0.00 0.14 -0.06 0.42 0.00 0.00 0.00 174.94 175.44 3idm s THR 3 N 1.69 0.49 0.05 2.92 -4.23 -0.77 -4.98 115.64 110.80 3idm s THR 3 Ca 0.29 -0.30 0.05 0.00 -1.18 0.00 0.00 61.69 60.55 3idm s THR 3 Cb -0.16 -0.42 -0.02 0.00 1.34 0.00 0.00 72.50 73.24 3idm s THR 3 CO 0.11 0.11 -0.14 -0.76 -0.54 0.00 0.00 174.62 173.40 3idm s LEU 4 N -0.21 2.20 -0.10 4.79 1.02 -1.26 -2.06 118.68 123.06 3idm s LEU 4 Ca 0.02 -0.51 -0.05 0.00 0.02 0.00 0.00 54.13 53.61 3idm s LEU 4 Cb -0.03 -0.58 0.05 0.00 0.02 0.00 0.00 46.19 45.65 3idm s LEU 4 CO -0.00 -0.00 0.24 -0.75 0.02 0.00 0.00 176.35 175.86 3idm s LYS 5 N -1.33 0.20 0.00 1.70 2.20 -0.02 -4.18 119.74 118.31 3idm s LYS 5 Ca 0.00 0.52 -0.15 0.00 -0.36 0.00 0.00 55.97 55.98 3idm s LYS 5 Cb -0.09 -0.12 -0.06 0.00 -1.51 0.00 0.00 37.83 36.06 3idm s LYS 5 CO 0.02 -0.16 0.43 -1.21 -0.36 0.00 0.00 175.35 174.06 3idm s GLU 6 N 1.23 3.96 0.04 4.03 8.01 -1.26 -0.66 118.70 134.06 3idm s GLU 6 Ca -0.09 0.45 0.01 0.00 0.01 0.00 0.00 54.97 55.35 3idm s GLU 6 Cb -0.10 -3.23 -0.03 0.00 -4.31 0.00 0.00 34.13 26.46 3idm s GLU 6 CO -0.08 0.67 -0.05 -1.54 0.01 0.00 0.00 175.26 174.26 3idm s SER 7 N -1.03 0.63 0.00 -0.19 1.04 0.75 -4.79 113.70 110.11 3idm s SER 7 Ca 0.24 -0.64 0.00 0.00 0.48 0.00 0.00 55.95 56.03 3idm s SER 7 Cb -0.17 0.09 0.00 0.00 0.10 0.00 0.00 66.02 66.04 3idm s SER 7 CO 0.14 -0.32 0.00 0.61 0.98 0.00 0.00 173.24 174.65 3idm n GLY 8 N 1.17 -2.18 3.71 7.32 0.00 -1.26 -0.89 105.19 113.06 3idm n GLY 8 Ca -0.21 -1.32 -0.42 0.00 0.00 0.00 0.00 46.02 44.07 3idm n GLY 8 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3idm s PRO 9 N -1.97 4.38 0.47 1.61 0.02 -1.26 -4.93 135.00 133.31 3idm s PRO 9 Ca 0.00 1.91 0.26 0.00 0.02 0.00 0.00 61.00 63.19 3idm s PRO 9 Cb 0.00 -3.30 0.86 0.00 0.02 0.00 0.00 34.50 32.08 3idm s PRO 9 CO 0.00 -0.34 1.80 -1.00 -0.33 0.00 0.00 177.00 177.13 3idm h PRO 10 N 6.80 0.00 -4.28 5.54 0.13 -1.95 -3.44 132.00 134.80 3idm h PRO 10 Ca -0.42 0.00 -0.45 0.00 -0.87 0.00 0.00 66.00 64.26 3idm h PRO 10 Cb 1.21 0.00 -0.33 0.00 0.13 0.00 0.00 31.00 32.01 3idm h PRO 10 CO 0.84 0.11 -0.79 -0.51 -0.23 0.00 0.00 178.00 177.42 3idm s LEU 11 N -6.39 1.50 0.01 1.56 1.02 -1.26 -0.82 118.68 114.30 3idm s LEU 11 Ca 0.03 -0.20 0.02 0.00 0.02 0.00 0.00 54.13 53.99 3idm s LEU 11 Cb 0.08 -0.61 -0.01 0.00 0.02 0.00 0.00 46.19 45.67 3idm s LEU 11 CO 0.62 -0.01 -0.05 -0.69 0.02 0.00 0.00 176.35 176.24 3idm s VAL 12 N 0.74 0.40 0.21 -1.59 1.01 -0.41 -4.97 120.40 115.79 3idm s VAL 12 Ca -0.12 -0.54 -0.07 0.00 0.00 0.00 0.00 61.98 61.24 3idm s VAL 12 Cb -0.15 -0.40 -0.06 0.00 0.00 0.00 0.00 36.38 35.77 3idm s VAL 12 CO 0.02 -0.11 0.50 -0.54 0.00 0.00 0.00 175.10 174.97 3idm s LYS 13 N -0.70 3.72 0.59 2.72 1.02 -1.26 -2.08 119.74 123.76 3idm s LYS 13 Ca -0.03 0.12 -0.19 0.00 0.02 0.00 0.00 55.97 55.88 3idm s LYS 13 Cb -0.05 -2.71 -0.05 0.00 -0.52 0.00 0.00 37.83 34.50 3idm s LYS 13 CO -0.00 0.35 1.07 -2.30 -0.92 0.00 0.00 175.35 173.55 3idm n PRO 14 N -0.19 1.08 0.00 -1.68 -0.02 -1.26 -2.49 135.00 130.44 3idm n PRO 14 Ca -0.01 0.41 0.00 0.00 -2.02 0.00 0.00 63.50 61.89 3idm n PRO 14 Cb 0.52 -2.27 0.00 0.00 -0.02 0.00 0.00 33.50 31.73 3idm n PRO 14 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 3idm n THR 15 N -1.56 0.00 -2.06 3.45 -2.24 0.81 -4.93 114.28 107.74 3idm n THR 15 Ca 0.13 0.00 -0.27 0.00 -2.27 0.00 0.00 64.05 61.64 3idm n THR 15 Cb 0.46 0.00 0.08 0.00 -2.10 0.00 0.00 70.33 68.77 3idm n THR 15 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 3idm s GLN 16 N 0.00 2.04 -0.20 -0.78 -0.21 -1.04 -4.07 119.66 115.40 3idm s GLN 16 Ca 0.00 -0.11 -0.11 0.00 0.02 0.00 0.00 55.36 55.17 3idm s GLN 16 Cb 0.00 -2.07 -0.05 0.00 1.00 0.00 0.00 33.01 31.90 3idm s GLN 16 CO 0.00 -1.43 0.16 0.99 -2.12 0.00 0.00 175.29 172.89 3idm s THR 17 N -3.41 5.38 -0.26 -0.19 2.01 -1.26 -2.07 115.64 115.85 3idm s THR 17 Ca 0.61 0.24 -0.08 0.00 0.31 0.00 0.00 61.69 62.77 3idm s THR 17 Cb -0.11 -3.50 -0.04 0.00 0.01 0.00 0.00 72.50 68.87 3idm s THR 17 CO 0.47 0.41 0.11 -0.22 -0.69 0.00 0.00 174.62 174.70 3idm s LEU 18 N 0.51 3.63 -0.26 4.42 2.96 0.99 -4.97 118.68 125.97 3idm s LEU 18 Ca 0.09 -0.14 -0.03 0.00 -0.22 0.00 0.00 54.13 53.84 3idm s LEU 18 Cb -0.12 -1.98 0.02 0.00 0.50 0.00 0.00 46.19 44.61 3idm s LEU 18 CO -0.00 -0.03 -0.03 -0.89 -1.32 0.00 0.00 176.35 174.08 3idm s THR 19 N 1.61 3.17 -0.07 3.68 2.01 -1.26 -0.03 115.64 124.75 3idm s THR 19 Ca 0.06 -0.89 0.03 0.00 0.31 0.00 0.00 61.69 61.20 3idm s THR 19 Cb -0.15 -2.60 -0.02 0.00 0.01 0.00 0.00 72.50 69.74 3idm s THR 19 CO 0.06 0.20 -0.15 -0.76 -0.69 0.00 0.00 174.62 173.27 3idm s LEU 20 N 1.38 2.66 -0.09 4.42 1.43 0.03 -4.47 118.68 124.05 3idm s LEU 20 Ca 0.01 -0.27 0.04 0.00 -1.03 0.00 0.00 54.13 52.89 3idm s LEU 20 Cb -0.16 -1.55 -0.01 0.00 0.03 0.00 0.00 46.19 44.49 3idm s LEU 20 CO -0.03 0.28 -0.21 -0.89 0.23 0.00 0.00 176.35 175.73 3idm s THR 21 N -0.35 2.38 -0.40 5.49 2.01 -0.07 -0.81 115.64 123.89 3idm s THR 21 Ca 0.03 -0.93 -0.06 0.00 0.31 0.00 0.00 61.69 61.04 3idm s THR 21 Cb -0.12 -1.92 0.08 0.00 0.01 0.00 0.00 72.50 70.55 3idm s THR 21 CO 0.02 0.56 0.20 0.00 -0.69 0.00 0.00 174.62 174.71 3idm s SER 23 N 1.89 6.56 0.19 0.00 0.01 0.17 -1.79 113.70 120.72 3idm s SER 23 Ca 0.03 0.66 0.01 0.00 1.31 0.00 0.00 55.95 57.96 3idm s SER 23 Cb -0.22 -2.21 -0.05 0.00 0.21 0.00 0.00 66.02 63.75 3idm s SER 23 CO -0.00 0.14 0.04 0.72 0.41 0.00 0.00 173.24 174.55 3idm s PHE 24 N 0.10 1.24 0.05 2.43 -0.12 -0.65 -0.84 117.98 120.19 3idm s PHE 24 Ca 0.20 -1.12 -0.17 0.00 -0.05 0.00 0.00 56.93 55.79 3idm s PHE 24 Cb -0.14 -0.70 0.03 0.00 -0.63 0.00 0.00 43.02 41.58 3idm s PHE 24 CO 0.07 -0.32 0.38 -1.54 -0.05 0.00 0.00 175.22 173.76 3idm s SER 25 N -3.19 -0.23 0.00 1.98 1.04 -0.87 -4.82 113.70 107.60 3idm s SER 25 Ca 0.28 -0.07 0.00 0.00 0.48 0.00 0.00 55.95 56.64 3idm s SER 25 Cb 0.07 0.41 0.00 0.00 0.10 0.00 0.00 66.02 66.60 3idm s SER 25 CO 0.07 -0.66 0.00 0.61 0.98 0.00 0.00 173.24 174.24 3idm n GLY 26 N 0.49 2.85 3.41 7.32 0.00 -1.25 -1.85 105.19 116.16 3idm n GLY 26 Ca -0.18 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.73 3idm n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3idm s PHE 27 N -2.57 0.76 0.07 1.61 -0.12 -1.26 -4.71 117.98 111.76 3idm s PHE 27 Ca 0.00 -1.05 0.07 0.00 -0.05 0.00 0.00 56.93 55.90 3idm s PHE 27 Cb 0.00 -0.17 -0.03 0.00 -0.63 0.00 0.00 43.02 42.20 3idm s PHE 27 CO 0.00 -0.84 -0.20 0.45 -0.05 0.00 0.00 175.22 174.58 3idm s SER 28 N -3.09 2.38 -0.06 1.98 0.15 -1.26 -5.00 113.70 108.79 3idm s SER 28 Ca 0.30 -0.58 0.04 0.00 0.70 0.00 0.00 55.95 56.41 3idm s SER 28 Cb 0.03 -0.16 0.21 0.00 -1.71 0.00 0.00 66.02 64.38 3idm s SER 28 CO 0.11 0.10 0.84 -0.11 1.20 0.00 0.00 173.24 175.38 3idm n LEU 29 N 1.54 2.15 -0.22 3.45 7.94 -1.26 -2.21 117.00 128.39 3idm n LEU 29 Ca -0.18 -1.09 0.04 0.00 -1.11 0.00 0.00 56.01 53.67 3idm n LEU 29 Cb 0.54 -0.52 0.01 0.00 0.53 0.00 0.00 43.42 43.97 3idm n LEU 29 CO 0.23 0.34 0.25 -1.54 -1.11 0.00 0.00 177.39 175.56 3idm n SER 30 N 0.15 1.24 -4.78 1.96 3.41 -1.26 -4.30 113.62 110.05 3idm n SER 30 Ca 0.07 -1.12 -0.37 0.00 -0.26 0.00 0.00 58.87 57.19 3idm n SER 30 Cb 0.48 0.31 -0.05 0.00 -0.26 0.00 0.00 64.21 64.68 3idm n SER 30 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 3idm s ASP 31 N -0.96 7.04 0.29 4.04 1.01 -0.94 -4.97 116.67 122.19 3idm s ASP 31 Ca 0.07 1.98 -0.30 0.00 0.71 0.00 0.00 52.55 55.01 3idm s ASP 31 Cb 0.06 -2.59 -0.12 0.00 1.01 0.00 0.00 42.92 41.29 3idm s ASP 31 CO 0.15 -0.28 1.60 0.33 0.21 0.00 0.00 175.17 177.18 3idm n PHE 32 N 0.31 2.85 -0.17 4.23 7.35 -1.26 -3.25 117.46 127.52 3idm n PHE 32 Ca 0.03 0.25 0.00 0.00 -0.76 0.00 0.00 57.45 56.97 3idm n PHE 32 Cb 0.49 -2.60 0.00 0.00 0.35 0.00 0.00 39.48 37.72 3idm n PHE 32 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3idm n GLY 33 N 2.19 1.51 3.77 7.13 0.00 -1.26 -4.57 105.19 113.96 3idm n GLY 33 Ca 0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.71 3idm n GLY 33 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3idm s VAL 34 N -2.30 2.88 0.06 1.61 1.01 -1.20 -3.98 120.40 118.47 3idm s VAL 34 Ca 0.00 0.78 0.02 0.00 0.00 0.00 0.00 61.98 62.78 3idm s VAL 34 Cb 0.00 -3.46 -0.03 0.00 0.00 0.00 0.00 36.38 32.89 3idm s VAL 34 CO 0.00 0.11 -0.08 -0.83 0.00 0.00 0.00 175.10 174.30 3idm s GLY 35 N -0.87 0.62 -0.09 4.51 0.00 -0.72 -1.46 107.32 109.31 3idm s GLY 35 Ca 0.55 -0.97 -0.01 0.00 0.00 0.00 0.00 44.72 44.29 3idm s GLY 35 CO 0.45 -1.04 -0.04 0.14 0.00 0.00 0.00 173.10 172.61 3idm s VAL 35 N -2.08 0.72 0.39 1.40 1.01 -0.21 -0.77 120.40 120.87 3idm s VAL 35 Ca -0.02 -0.11 0.08 0.00 0.00 0.00 0.00 61.98 61.93 3idm s VAL 35 Cb -0.05 -0.80 -0.05 0.00 0.00 0.00 0.00 36.38 35.47 3idm s VAL 35 CO -0.01 0.32 0.13 -0.83 0.00 0.00 0.00 175.10 174.71 3idm s GLY 35 N 1.77 2.25 -0.05 4.51 0.00 0.11 -1.40 107.32 114.51 3idm s GLY 35 Ca 0.04 -2.06 0.04 0.00 0.00 0.00 0.00 44.72 42.74 3idm s GLY 35 CO -0.06 -1.90 -0.19 -0.98 0.00 0.00 0.00 173.10 169.97 3idm s TRP 36 N -2.57 1.89 -0.01 1.90 0.52 0.11 -0.83 118.94 119.95 3idm s TRP 36 Ca 0.39 -0.59 0.01 0.00 0.02 0.00 0.00 56.10 55.93 3idm s TRP 36 Cb 0.03 -1.27 -0.00 0.00 -1.15 0.00 0.00 33.47 31.07 3idm s TRP 36 CO 0.22 -0.21 -0.04 0.42 0.02 0.00 0.00 176.95 177.35 3idm s ILE 37 N 0.11 0.36 0.25 2.03 1.09 0.63 -1.40 121.20 124.28 3idm s ILE 37 Ca -0.07 -0.18 0.11 0.00 -1.10 0.00 0.00 60.65 59.41 3idm s ILE 37 Cb -0.13 -0.32 -0.05 0.00 -1.06 0.00 0.00 42.46 40.90 3idm s ILE 37 CO 0.03 0.11 -0.17 0.00 -0.10 0.00 0.00 174.94 174.81 3idm s ARG 38 N -0.03 1.76 -0.29 2.79 1.70 -0.26 0.64 118.95 125.27 3idm s ARG 38 Ca 0.01 -1.63 -0.01 0.00 -0.47 0.00 0.00 55.73 53.62 3idm s ARG 38 Cb -0.03 -1.87 0.12 0.00 -0.57 0.00 0.00 34.95 32.61 3idm s ARG 38 CO -0.00 0.36 0.25 -1.14 -1.08 0.00 0.00 175.30 173.68 3idm s GLN 39 N -3.32 0.28 0.41 3.89 0.74 0.49 -0.66 119.66 121.49 3idm s GLN 39 Ca 0.28 -0.22 -0.25 0.00 0.05 0.00 0.00 55.36 55.21 3idm s GLN 39 Cb -0.06 -0.81 -0.08 0.00 1.10 0.00 0.00 33.01 33.16 3idm s GLN 39 CO 0.15 -1.01 1.26 -1.25 -0.55 0.00 0.00 175.29 173.89 3idm s PRO 40 N 2.29 3.94 -0.46 1.67 0.04 -1.26 -1.39 135.00 139.83 3idm s PRO 40 Ca 0.09 2.05 -0.45 0.00 0.04 0.00 0.00 61.00 62.73 3idm s PRO 40 Cb -0.14 -2.69 -0.19 0.00 0.04 0.00 0.00 34.50 31.51 3idm s PRO 40 CO -0.33 -0.48 1.78 -0.35 0.04 0.00 0.00 177.00 177.65 3idm n PRO 41 N 0.03 0.22 -0.98 0.56 -0.04 -1.26 -0.84 135.00 132.69 3idm n PRO 41 Ca 0.04 0.08 0.00 0.00 -0.04 0.00 0.00 63.50 63.58 3idm n PRO 41 Cb 0.45 -1.63 0.00 0.00 -0.04 0.00 0.00 33.50 32.27 3idm n PRO 41 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3idm n GLY 42 N 4.97 0.36 3.33 0.55 0.00 -1.26 -5.00 105.19 108.14 3idm n GLY 42 Ca 0.36 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.14 3idm n GLY 42 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3idm n LYS 43 N -1.66 0.80 -1.67 1.61 5.02 -0.02 -5.14 118.16 117.10 3idm n LYS 43 Ca 0.00 -3.10 -0.30 0.00 -2.02 0.00 0.00 58.31 52.89 3idm n LYS 43 Cb 0.15 0.46 0.08 0.00 -0.02 0.00 0.00 35.03 35.70 3idm n LYS 43 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3idm s ALA 44 N -2.72 2.45 0.31 7.82 0.00 -1.26 -4.69 121.76 123.67 3idm s ALA 44 Ca 0.21 -0.28 -0.28 0.00 0.00 0.00 0.00 51.96 51.61 3idm s ALA 44 Cb -0.02 -3.07 -0.09 0.00 0.00 0.00 0.00 23.12 19.94 3idm s ALA 44 CO 0.13 -1.56 1.08 -0.51 0.00 0.00 0.00 175.76 174.90 3idm s LEU 45 N -5.65 4.46 -0.08 0.00 1.43 -1.26 -4.33 118.68 113.25 3idm s LEU 45 Ca 0.60 2.19 0.02 0.00 -1.03 0.00 0.00 54.13 55.91 3idm s LEU 45 Cb -0.13 -3.76 0.01 0.00 0.03 0.00 0.00 46.19 42.34 3idm s LEU 45 CO 0.53 -0.21 -0.13 -0.70 0.23 0.00 0.00 176.35 176.08 3idm s GLU 46 N -1.68 1.85 0.15 1.70 2.12 0.16 -4.99 118.70 118.00 3idm s GLU 46 Ca 0.47 -0.44 -0.30 0.00 0.36 0.00 0.00 54.97 55.06 3idm s GLU 46 Cb -0.29 -1.58 -0.07 0.00 0.26 0.00 0.00 34.13 32.45 3idm s GLU 46 CO 0.37 -0.03 1.08 -0.46 -0.54 0.00 0.00 175.26 175.67 3idm s TRP 47 N 0.89 3.63 -0.11 5.30 -0.00 -1.26 -1.10 118.94 126.29 3idm s TRP 47 Ca -0.10 1.62 -0.07 0.00 -0.00 0.00 0.00 56.10 57.54 3idm s TRP 47 Cb -0.15 -3.24 -0.05 0.00 -0.00 0.00 0.00 33.47 30.03 3idm s TRP 47 CO 0.01 -0.48 -0.17 1.28 -0.00 0.00 0.00 176.95 177.58 3idm n LEU 48 N 2.66 1.13 -3.66 5.86 4.77 -0.49 -4.72 117.00 122.55 3idm n LEU 48 Ca 0.03 0.19 -0.03 0.00 -0.03 0.00 0.00 56.01 56.17 3idm n LEU 48 Cb 0.47 -0.44 -0.01 0.00 -2.33 0.00 0.00 43.42 41.11 3idm n LEU 48 CO 0.53 0.03 0.85 0.00 -1.33 0.00 0.00 177.39 177.47 3idm s ALA 49 N -2.31 -1.89 -0.08 -1.18 0.00 -1.17 -1.56 121.76 113.57 3idm s ALA 49 Ca -0.17 0.57 -0.16 0.00 0.00 0.00 0.00 51.96 52.19 3idm s ALA 49 Cb 0.06 0.45 0.03 0.00 0.00 0.00 0.00 23.12 23.66 3idm s ALA 49 CO 0.23 -0.95 0.38 -1.50 0.00 0.00 0.00 175.76 173.92 3idm s ILE 50 N -2.92 0.03 -0.02 0.00 2.07 -0.79 -0.71 121.20 118.85 3idm s ILE 50 Ca 0.11 -0.23 0.02 0.00 -1.41 0.00 0.00 60.65 59.15 3idm s ILE 50 Cb 0.01 -0.63 0.00 0.00 0.13 0.00 0.00 42.46 41.97 3idm s ILE 50 CO -0.02 -0.13 -0.08 -0.51 -1.91 0.00 0.00 174.94 172.29 3idm s ILE 51 N -0.66 0.70 0.46 2.00 2.07 -0.49 -1.75 121.20 123.51 3idm s ILE 51 Ca -0.08 -0.33 0.07 0.00 -1.41 0.00 0.00 60.65 58.91 3idm s ILE 51 Cb -0.04 -0.62 -0.00 0.00 0.13 0.00 0.00 42.46 41.93 3idm s ILE 51 CO 0.03 0.22 0.40 -0.31 -1.91 0.00 0.00 174.94 173.37 3idm s TYR 52 N 0.13 2.37 0.40 3.50 1.51 -0.63 -1.04 117.35 123.58 3idm s TYR 52 Ca -0.02 -0.59 0.09 0.00 -1.01 0.00 0.00 57.07 55.54 3idm s TYR 52 Cb -0.07 -2.11 0.87 0.00 -0.11 0.00 0.00 41.96 40.54 3idm s TYR 52 CO 0.00 -0.26 2.00 0.66 -1.11 0.00 0.00 175.55 176.84 3idm h SER 53 N 0.93 0.51 -0.07 2.29 4.64 -1.44 -1.21 113.55 119.20 3idm h SER 53 Ca -0.40 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.92 3idm h SER 53 Cb 1.28 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 3idm h SER 53 CO 0.57 0.34 0.00 -0.90 -0.87 0.00 0.00 176.83 175.97 3idm n ASP 54 N -4.47 0.55 -0.18 4.97 5.75 -1.26 -4.82 116.55 117.08 3idm n ASP 54 Ca 0.08 -2.01 -0.02 0.00 -0.01 0.00 0.00 54.79 52.82 3idm n ASP 54 Cb 0.22 -0.13 -0.01 0.00 -1.03 0.00 0.00 41.12 40.17 3idm n ASP 54 CO 0.00 0.00 0.00 -0.67 -0.11 0.00 0.00 177.20 176.42 3idm n ASP 55 N -0.24 -4.28 -4.73 -1.12 2.03 -0.46 -5.01 116.55 102.75 3idm n ASP 55 Ca 0.02 0.06 -0.42 0.00 0.52 0.00 0.00 54.79 54.98 3idm n ASP 55 Cb 0.11 -1.98 -0.03 0.00 -0.72 0.00 0.00 41.12 38.49 3idm n ASP 55 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 3idm s ASP 56 N -2.23 7.06 0.04 1.67 3.68 -1.26 -4.81 116.67 120.83 3idm s ASP 56 Ca 0.00 2.16 0.08 0.00 2.13 0.00 0.00 52.55 56.92 3idm s ASP 56 Cb 0.00 -2.59 -0.03 0.00 -1.45 0.00 0.00 42.92 38.85 3idm s ASP 56 CO 0.00 -0.43 -0.23 -0.54 0.13 0.00 0.00 175.17 174.10 3idm s LYS 57 N 0.34 1.58 0.01 4.34 1.02 -1.26 -1.61 119.74 124.16 3idm s LYS 57 Ca 0.56 -1.00 0.01 0.00 0.02 0.00 0.00 55.97 55.56 3idm s LYS 57 Cb -0.32 -1.71 -0.01 0.00 -0.52 0.00 0.00 37.83 35.27 3idm s LYS 57 CO 0.33 0.44 -0.04 1.03 -0.92 0.00 0.00 175.35 176.19 3idm s ARG 58 N -1.16 0.34 0.16 1.68 1.81 -0.72 -5.02 118.95 116.04 3idm s ARG 58 Ca 0.09 -0.30 0.06 0.00 -1.72 0.00 0.00 55.73 53.86 3idm s ARG 58 Cb -0.09 -0.25 -0.04 0.00 -0.45 0.00 0.00 34.95 34.12 3idm s ARG 58 CO 0.02 0.06 -0.13 0.71 -0.68 0.00 0.00 175.30 175.28 3idm s TYR 59 N -0.48 1.48 0.03 -0.53 1.51 -1.26 -1.89 117.35 116.21 3idm s TYR 59 Ca -0.03 -0.63 -0.30 0.00 -1.01 0.00 0.00 57.07 55.10 3idm s TYR 59 Cb -0.04 -0.73 -0.06 0.00 -0.11 0.00 0.00 41.96 41.02 3idm s TYR 59 CO -0.00 0.21 1.45 0.45 -1.11 0.00 0.00 175.55 176.55 3idm s SER 60 N -3.04 6.80 0.58 2.29 0.15 -0.60 -4.90 113.70 114.97 3idm s SER 60 Ca 0.17 2.22 0.28 0.00 0.70 0.00 0.00 55.95 59.32 3idm s SER 60 Cb -0.01 -2.57 1.70 0.00 -1.71 0.00 0.00 66.02 63.44 3idm s SER 60 CO 0.04 -0.74 2.19 -0.65 1.20 0.00 0.00 173.24 175.28 3idm h PRO 61 N 7.76 0.00 0.00 5.44 0.11 -1.95 0.54 132.00 143.91 3idm h PRO 61 Ca -0.39 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.59 3idm h PRO 61 Cb 1.19 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.28 3idm h PRO 61 CO 0.90 0.00 -0.59 1.03 -0.21 0.00 0.00 178.00 179.14 3idm h SER 62 N 0.00 0.00 -0.00 -2.05 0.87 -1.98 -3.31 113.55 107.07 3idm h SER 62 Ca 0.03 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.59 3idm h SER 62 Cb 0.17 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.13 3idm h SER 62 CO -0.00 0.59 0.00 0.18 -0.53 0.00 0.00 176.83 177.07 3idm n LEU 63 N -3.71 1.73 -0.26 2.23 7.99 -0.77 -4.86 117.00 119.35 3idm n LEU 63 Ca -0.01 -1.73 -0.01 0.00 -0.01 0.00 0.00 56.01 54.25 3idm n LEU 63 Cb 0.61 -0.00 0.05 0.00 -0.11 0.00 0.00 43.42 43.97 3idm n LEU 63 CO 0.41 0.43 0.65 -1.13 -1.51 0.00 0.00 177.39 176.25 3idm h ASN 64 N 0.00 -1.04 -0.10 -1.43 -0.00 -1.01 -1.78 115.58 110.22 3idm h ASN 64 Ca 0.00 0.25 -0.02 0.00 -0.00 0.00 0.00 56.30 56.53 3idm h ASN 64 Cb 0.37 0.57 -0.01 0.00 -0.00 0.00 0.00 38.32 39.25 3idm h ASN 64 CO 0.00 -0.28 0.02 0.71 -0.00 0.00 0.00 177.43 177.88 3idm h THR 65 N -0.07 1.10 0.00 -3.57 1.35 -1.88 -2.79 112.91 107.05 3idm h THR 65 Ca 0.31 -0.36 0.00 0.00 -0.55 0.00 0.00 66.41 65.82 3idm h THR 65 Cb 0.57 0.95 0.00 0.00 -1.73 0.00 0.00 68.15 67.94 3idm h THR 65 CO -0.79 0.12 -0.92 0.54 -0.25 0.00 0.00 175.52 174.23 3idm n ARG 66 N -4.42 0.36 -3.97 4.72 1.74 -0.74 -4.95 116.66 109.40 3idm n ARG 66 Ca -0.00 0.04 -0.34 0.00 -0.77 0.00 0.00 57.85 56.78 3idm n ARG 66 Cb 0.15 -1.67 -0.06 0.00 -1.02 0.00 0.00 32.46 29.87 3idm n ARG 66 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3idm s LEU 67 N -4.31 4.21 -0.05 0.55 1.43 -0.79 -1.17 118.68 118.55 3idm s LEU 67 Ca 0.03 0.32 -0.02 0.00 -1.03 0.00 0.00 54.13 53.43 3idm s LEU 67 Cb 0.13 -2.34 0.04 0.00 0.03 0.00 0.00 46.19 44.05 3idm s LEU 67 CO 0.77 0.31 0.10 -0.89 0.23 0.00 0.00 176.35 176.88 3idm s THR 68 N -1.19 -0.11 -0.05 5.49 2.01 -0.39 -4.93 115.64 116.47 3idm s THR 68 Ca 0.22 0.27 0.05 0.00 0.31 0.00 0.00 61.69 62.55 3idm s THR 68 Cb -0.12 -0.19 -0.02 0.00 0.01 0.00 0.00 72.50 72.18 3idm s THR 68 CO 0.13 0.11 -0.20 -0.51 -0.69 0.00 0.00 174.62 173.46 3idm s ILE 69 N 1.57 2.51 0.08 1.82 2.07 -1.26 -0.29 121.20 127.69 3idm s ILE 69 Ca -0.04 -0.92 -0.07 0.00 -1.41 0.00 0.00 60.65 58.21 3idm s ILE 69 Cb -0.12 -1.94 -0.01 0.00 0.13 0.00 0.00 42.46 40.52 3idm s ILE 69 CO -0.05 0.58 0.15 0.28 -1.91 0.00 0.00 174.94 173.99 3idm s THR 70 N -0.49 0.15 0.10 4.00 -1.32 -0.33 -5.01 115.64 112.75 3idm s THR 70 Ca 0.06 -1.27 0.07 0.00 -1.21 0.00 0.00 61.69 59.34 3idm s THR 70 Cb -0.11 -1.34 -0.03 0.00 -1.51 0.00 0.00 72.50 69.50 3idm s THR 70 CO 0.01 -0.70 -0.19 -1.59 -2.21 0.00 0.00 174.62 169.94 3idm s LYS 71 N -3.79 1.06 -0.41 7.08 -2.85 -1.26 -0.86 119.74 118.72 3idm s LYS 71 Ca 0.05 -1.14 0.02 0.00 -1.00 0.00 0.00 55.97 53.90 3idm s LYS 71 Cb 0.05 -1.24 0.13 0.00 -2.06 0.00 0.00 37.83 34.70 3idm s LYS 71 CO -0.10 0.28 0.20 0.34 0.10 0.00 0.00 175.35 176.17 3idm s ASP 72 N -1.95 3.85 0.31 0.03 -1.08 0.25 -4.98 116.67 113.09 3idm s ASP 72 Ca 0.05 -2.43 -0.01 0.00 -0.52 0.00 0.00 52.55 49.65 3idm s ASP 72 Cb -0.09 -1.09 0.49 0.00 -1.46 0.00 0.00 42.92 40.77 3idm s ASP 72 CO 0.04 -0.30 1.96 0.74 0.52 0.00 0.00 175.17 178.12 3idm h THR 73 N 5.60 1.16 0.00 1.71 2.02 -1.94 -1.53 112.91 119.93 3idm h THR 73 Ca -0.04 -0.37 -0.10 0.00 0.77 0.00 0.00 66.41 66.67 3idm h THR 73 Cb 0.95 0.01 -0.01 0.00 -1.74 0.00 0.00 68.15 67.35 3idm h THR 73 CO 0.50 0.19 -0.48 0.28 0.37 0.00 0.00 175.52 176.38 3idm h SER 74 N 1.06 0.00 0.01 4.18 0.02 -1.95 -3.06 113.55 113.82 3idm h SER 74 Ca 0.32 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.27 3idm h SER 74 Cb -0.02 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.52 3idm h SER 74 CO -0.09 0.48 -0.35 0.29 -1.14 0.00 0.00 176.83 176.03 3idm n LYS 75 N -3.97 1.39 -3.49 3.45 5.02 -1.08 -4.98 118.16 114.51 3idm n LYS 75 Ca -0.02 -1.11 -0.18 0.00 -2.02 0.00 0.00 58.31 54.98 3idm n LYS 75 Cb 0.50 -1.48 0.07 0.00 -0.02 0.00 0.00 35.03 34.10 3idm n LYS 75 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3idm n ASN 76 N 0.16 -2.23 -4.09 4.39 5.03 -0.67 -4.83 115.26 113.03 3idm n ASN 76 Ca 0.11 -0.68 -0.13 0.00 0.87 0.00 0.00 54.58 54.74 3idm n ASN 76 Cb 0.47 -4.85 -0.11 0.00 -1.02 0.00 0.00 39.78 34.27 3idm n ASN 76 CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 3idm s GLN 77 N -5.44 0.59 -0.07 3.52 -0.21 -0.67 -1.63 119.66 115.75 3idm s GLN 77 Ca 0.04 -0.83 0.01 0.00 0.02 0.00 0.00 55.36 54.61 3idm s GLN 77 Cb -0.01 -0.36 0.02 0.00 1.00 0.00 0.00 33.01 33.66 3idm s GLN 77 CO 0.75 0.06 -0.09 0.08 -2.12 0.00 0.00 175.29 173.97 3idm s VAL 78 N -1.55 0.95 -0.09 1.09 1.01 -0.74 -0.58 120.40 120.48 3idm s VAL 78 Ca -0.07 -0.34 0.01 0.00 0.00 0.00 0.00 61.98 61.58 3idm s VAL 78 Cb -0.09 -0.91 -0.02 0.00 0.00 0.00 0.00 36.38 35.36 3idm s VAL 78 CO 0.00 0.32 -0.13 -0.69 0.00 0.00 0.00 175.10 174.60 3idm s VAL 79 N 0.93 3.08 -0.16 2.92 1.01 -0.04 -0.32 120.40 127.82 3idm s VAL 79 Ca -0.10 -0.68 -0.01 0.00 0.00 0.00 0.00 61.98 61.19 3idm s VAL 79 Cb -0.15 -2.26 -0.01 0.00 0.00 0.00 0.00 36.38 33.97 3idm s VAL 79 CO 0.01 0.55 -0.11 -0.22 0.00 0.00 0.00 175.10 175.33 3idm s LEU 80 N -0.14 2.69 -0.20 3.92 2.96 0.01 -1.18 118.68 126.72 3idm s LEU 80 Ca -0.01 -0.39 -0.02 0.00 -0.22 0.00 0.00 54.13 53.49 3idm s LEU 80 Cb -0.13 -1.63 -0.00 0.00 0.50 0.00 0.00 46.19 44.92 3idm s LEU 80 CO 0.03 0.09 -0.09 -0.69 -1.32 0.00 0.00 176.35 174.37 3idm s VAL 81 N 0.82 3.01 -0.21 1.68 1.01 0.60 -0.79 120.40 126.53 3idm s VAL 81 Ca -0.04 -0.62 -0.02 0.00 0.00 0.00 0.00 61.98 61.30 3idm s VAL 81 Cb -0.15 -2.34 0.00 0.00 0.00 0.00 0.00 36.38 33.89 3idm s VAL 81 CO 0.01 0.46 -0.10 -0.32 0.00 0.00 0.00 175.10 175.15 3idm s MET 82 N 1.36 3.23 0.46 2.72 1.75 0.96 -1.27 119.30 128.51 3idm s MET 82 Ca 0.04 -0.70 0.03 0.00 -1.25 0.00 0.00 55.69 53.81 3idm s MET 82 Cb -0.14 -2.86 0.01 0.00 2.84 0.00 0.00 34.83 34.68 3idm s MET 82 CO -0.05 -0.21 0.66 0.95 -0.65 0.00 0.00 175.02 175.72 3idm s THR 82 N 1.41 3.42 -1.36 10.11 -4.23 -0.31 -0.01 115.64 124.67 3idm s THR 82 Ca 0.05 -0.71 -0.19 0.00 -1.18 0.00 0.00 61.69 59.67 3idm s THR 82 Cb -0.14 -3.24 0.02 0.00 1.34 0.00 0.00 72.50 70.49 3idm s THR 82 CO -0.07 -0.14 0.40 0.54 -0.54 0.00 0.00 174.62 174.81 3idm n ARG 82 N -2.06 -0.71 -2.10 3.99 5.12 -1.16 -4.87 116.66 114.86 3idm n ARG 82 Ca 0.04 0.11 -0.36 0.00 -1.93 0.00 0.00 57.85 55.71 3idm n ARG 82 Cb 0.59 -3.10 0.02 0.00 -1.16 0.00 0.00 32.46 28.81 3idm n ARG 82 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 3idm s VAL 82 N -3.89 2.82 0.23 1.55 -7.23 -0.88 -4.67 120.40 108.33 3idm s VAL 82 Ca 0.27 0.51 0.02 0.00 -1.81 0.00 0.00 61.98 60.97 3idm s VAL 82 Cb -0.15 -3.21 -0.05 0.00 0.56 0.00 0.00 36.38 33.54 3idm s VAL 82 CO 0.98 -0.11 0.05 -0.94 -0.31 0.00 0.00 175.10 174.77 3idm s SER 83 N -1.65 1.30 0.64 4.85 1.04 -1.26 -0.13 113.70 118.48 3idm s SER 83 Ca 0.76 -1.30 0.34 0.00 0.48 0.00 0.00 55.95 56.23 3idm s SER 83 Cb -0.28 0.12 1.89 0.00 0.10 0.00 0.00 66.02 67.86 3idm s SER 83 CO 0.31 -0.65 2.13 -0.65 0.98 0.00 0.00 173.24 175.36 3idm h PRO 84 N 2.49 0.00 0.00 4.02 0.11 -1.98 -1.98 132.00 134.65 3idm h PRO 84 Ca -0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.73 3idm h PRO 84 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 3idm h PRO 84 CO 0.62 0.00 0.00 1.33 -0.21 0.00 0.00 178.00 179.74 3idm n VAL 85 N -3.30 0.85 1.57 3.15 0.24 -1.26 -2.25 118.33 117.33 3idm n VAL 85 Ca -0.01 0.20 0.10 0.00 -2.04 0.00 0.00 64.34 62.59 3idm n VAL 85 Cb 0.26 -1.00 0.44 0.00 -1.47 0.00 0.00 33.84 32.07 3idm n VAL 85 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 3idm n ASP 86 N -1.81 0.92 -4.64 -1.34 8.00 -0.74 -4.81 116.55 112.11 3idm n ASP 86 Ca 0.03 -1.59 -0.43 0.00 0.71 0.00 0.00 54.79 53.52 3idm n ASP 86 Cb 0.22 -0.06 -0.03 0.00 -0.02 0.00 0.00 41.12 41.23 3idm n ASP 86 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 3idm s THR 87 N -1.88 3.72 0.09 -3.53 -4.23 -0.95 -4.86 115.64 104.00 3idm s THR 87 Ca 0.30 0.84 -0.27 0.00 -1.18 0.00 0.00 61.69 61.38 3idm s THR 87 Cb 0.15 -3.64 0.08 0.00 1.34 0.00 0.00 72.50 70.43 3idm s THR 87 CO 0.24 -0.18 1.08 0.00 -0.54 0.00 0.00 174.62 175.22 3idm s ALA 88 N 4.56 -1.86 -0.16 3.99 0.00 -0.66 -4.46 121.76 123.16 3idm s ALA 88 Ca 0.70 0.30 -0.16 0.00 0.00 0.00 0.00 51.96 52.79 3idm s ALA 88 Cb -0.28 0.55 -0.04 0.00 0.00 0.00 0.00 23.12 23.35 3idm s ALA 88 CO 0.27 -1.05 0.41 0.99 0.00 0.00 0.00 175.76 176.38 3idm s THR 89 N -2.92 5.22 -0.19 0.00 2.01 -0.49 -1.09 115.64 118.18 3idm s THR 89 Ca 0.14 0.78 -0.05 0.00 0.31 0.00 0.00 61.69 62.86 3idm s THR 89 Cb 0.01 -3.75 -0.03 0.00 0.01 0.00 0.00 72.50 68.74 3idm s THR 89 CO 0.00 0.31 0.01 -0.31 -0.69 0.00 0.00 174.62 173.94 3idm s TYR 90 N 0.86 3.07 -0.03 4.92 1.51 0.11 -0.38 117.35 127.40 3idm s TYR 90 Ca 0.21 -0.35 0.05 0.00 -1.01 0.00 0.00 57.07 55.98 3idm s TYR 90 Cb -0.14 -2.07 -0.03 0.00 -0.11 0.00 0.00 41.96 39.61 3idm s TYR 90 CO 0.08 -0.15 -0.17 -0.06 -1.11 0.00 0.00 175.55 174.14 3idm s PHE 91 N 0.82 2.60 0.07 2.71 0.40 0.21 -1.28 117.98 123.51 3idm s PHE 91 Ca 0.01 -0.23 0.05 0.00 -0.60 0.00 0.00 56.93 56.16 3idm s PHE 91 Cb -0.14 -1.58 -0.04 0.00 0.51 0.00 0.00 43.02 41.77 3idm s PHE 91 CO 0.02 0.14 -0.04 0.00 0.70 0.00 0.00 175.22 176.04 3idm s ALA 93 N -1.20 -0.25 0.11 0.00 0.00 -0.01 -1.81 121.76 118.61 3idm s ALA 93 Ca 0.22 -0.28 -0.17 0.00 0.00 0.00 0.00 51.96 51.73 3idm s ALA 93 Cb -0.11 0.17 -0.07 0.00 0.00 0.00 0.00 23.12 23.11 3idm s ALA 93 CO 0.14 -0.25 0.57 -1.58 0.00 0.00 0.00 175.76 174.64 3idm s HIS 94 N -1.85 3.71 -0.13 0.00 5.65 0.02 -0.71 115.29 121.97 3idm s HIS 94 Ca -0.11 1.19 0.02 0.00 0.25 0.00 0.00 55.06 56.40 3idm s HIS 94 Cb -0.05 -2.45 0.01 0.00 -1.18 0.00 0.00 32.58 28.91 3idm s HIS 94 CO -0.01 0.50 -0.18 0.50 -0.65 0.00 0.00 174.74 174.90 3idm s ARG 95 N -1.54 2.59 0.65 2.88 3.52 0.05 -1.77 118.95 125.33 3idm s ARG 95 Ca 0.34 -0.69 -0.15 0.00 -0.13 0.00 0.00 55.73 55.09 3idm s ARG 95 Cb -0.17 -2.18 -0.01 0.00 -1.56 0.00 0.00 34.95 31.03 3idm s ARG 95 CO 0.19 -0.08 1.11 1.03 -0.81 0.00 0.00 175.30 176.74 3idm s ARG 96 N 1.02 2.87 0.64 5.12 0.52 -1.26 -1.76 118.95 126.10 3idm s ARG 96 Ca -0.04 1.40 0.07 0.00 -0.52 0.00 0.00 55.73 56.64 3idm s ARG 96 Cb -0.15 -1.96 0.11 0.00 0.52 0.00 0.00 34.95 33.48 3idm s ARG 96 CO -0.04 -1.20 0.88 0.41 0.02 0.00 0.00 175.30 175.37 3idm n GLY 97 N -0.48 1.53 3.75 -3.53 0.00 -1.26 -4.27 105.19 100.94 3idm n GLY 97 Ca 0.10 -2.16 -0.34 0.00 0.00 0.00 0.00 46.02 43.62 3idm n GLY 97 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3idm s PRO 98 N -4.82 2.77 0.14 1.61 0.02 -1.26 -4.46 135.00 128.99 3idm s PRO 98 Ca 0.64 1.62 -0.31 0.00 0.02 0.00 0.00 61.00 62.97 3idm s PRO 98 Cb -0.05 -1.93 -0.08 0.00 0.02 0.00 0.00 34.50 32.47 3idm s PRO 98 CO 0.41 -1.32 1.33 0.99 -0.33 0.00 0.00 177.00 178.08 3idm s THR 99 N -1.98 3.37 0.19 0.99 2.01 -0.40 -4.92 115.64 114.90 3idm s THR 99 Ca 0.72 1.04 0.09 0.00 0.31 0.00 0.00 61.69 63.85 3idm s THR 99 Cb -0.25 -3.67 -0.04 0.00 0.01 0.00 0.00 72.50 68.55 3idm s THR 99 CO 0.38 0.11 -0.06 0.42 -0.69 0.00 0.00 174.62 174.78 3idm s THR 100 N 0.70 3.34 -0.19 -0.82 -4.23 -1.26 -1.17 115.64 112.01 3idm s THR 100 Ca 0.61 -1.62 -0.01 0.00 -1.18 0.00 0.00 61.69 59.48 3idm s THR 100 Cb -0.36 -2.67 0.05 0.00 1.34 0.00 0.00 72.50 70.86 3idm s THR 100 CO 0.33 -0.13 -0.01 -0.22 -0.54 0.00 0.00 174.62 174.05 3idm s LEU 100 N -2.93 1.60 -1.54 4.79 2.96 0.44 -4.74 118.68 119.28 3idm s LEU 100 Ca 0.26 -0.82 -0.04 0.00 -0.22 0.00 0.00 54.13 53.30 3idm s LEU 100 Cb -0.09 -0.82 0.01 0.00 0.50 0.00 0.00 46.19 45.80 3idm s LEU 100 CO 0.16 -0.25 0.49 0.49 -1.32 0.00 0.00 176.35 175.93 3idm n PHE 100 N 4.91 -1.80 0.00 5.38 0.99 -1.26 -1.50 117.46 124.19 3idm n PHE 100 Ca -0.10 0.43 0.00 0.00 -0.00 0.00 0.00 57.45 57.77 3idm n PHE 100 Cb 0.47 -4.17 0.00 0.00 -1.00 0.00 0.00 39.48 34.78 3idm n PHE 100 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3idm n GLY 100 N -1.39 2.07 3.65 1.37 0.00 -1.26 -5.04 105.19 104.59 3idm n GLY 100 Ca -0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.51 3idm n GLY 100 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3idm s VAL 100 N -2.38 5.13 0.05 1.61 1.01 -0.56 -4.95 120.40 120.31 3idm s VAL 100 Ca 0.00 0.83 -0.30 0.00 0.00 0.00 0.00 61.98 62.51 3idm s VAL 100 Cb 0.00 -3.79 -0.09 0.00 0.00 0.00 0.00 36.38 32.50 3idm s VAL 100 CO 0.00 0.17 1.85 -2.16 0.00 0.00 0.00 175.10 174.96 3idm s PRO 100 N 1.76 4.15 -0.01 2.72 0.04 -1.26 -0.42 135.00 141.99 3idm s PRO 100 Ca 0.21 2.51 0.04 0.00 0.04 0.00 0.00 61.00 63.80 3idm s PRO 100 Cb -0.15 -3.92 -0.06 0.00 0.04 0.00 0.00 34.50 30.40 3idm s PRO 100 CO 0.09 -0.88 0.08 0.44 0.04 0.00 0.00 177.00 176.76 3idm n ILE 100 N 5.24 0.04 -3.67 0.56 -5.35 -0.31 -4.93 119.36 110.93 3idm n ILE 100 Ca 0.18 -0.11 -0.19 0.00 -0.27 0.00 0.00 62.75 62.37 3idm n ILE 100 Cb 0.40 0.19 -0.17 0.00 -1.74 0.00 0.00 39.64 38.32 3idm n ILE 100 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3idm s ALA 100 N -2.26 0.15 -1.96 -1.28 0.00 -1.17 -5.01 121.76 110.23 3idm s ALA 100 Ca -0.02 0.27 0.26 0.00 0.00 0.00 0.00 51.96 52.47 3idm s ALA 100 Cb 0.02 -0.65 0.61 0.00 0.00 0.00 0.00 23.12 23.10 3idm s ALA 100 CO 0.17 -0.50 1.47 2.89 0.00 0.00 0.00 175.76 179.80 3idm n ARG 100 N 5.28 1.09 -0.16 0.00 1.85 -1.26 -1.27 116.66 122.19 3idm n ARG 100 Ca -0.04 -0.72 -0.02 0.00 -1.00 0.00 0.00 57.85 56.07 3idm n ARG 100 Cb 0.50 -1.49 0.06 0.00 -1.05 0.00 0.00 32.46 30.49 3idm n ARG 100 CO 0.00 0.00 0.00 0.78 -0.01 0.00 0.00 177.63 178.40 3idm h GLY 100 N 4.89 0.52 1.93 2.89 0.00 -1.96 -2.79 103.07 108.55 3idm h GLY 100 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.39 3idm h GLY 100 CO 0.00 -0.14 0.02 -1.55 0.00 0.00 0.00 176.54 174.87 3idm n PRO 100 N -5.23 0.05 0.17 4.80 -0.04 -1.26 -2.06 135.00 131.43 3idm n PRO 100 Ca 0.06 0.54 0.12 0.00 -0.04 0.00 0.00 63.50 64.18 3idm n PRO 100 Cb 0.27 -1.70 0.27 0.00 -0.04 0.00 0.00 33.50 32.30 3idm n PRO 100 CO 0.00 0.00 0.00 -0.39 -0.04 0.00 0.00 175.50 175.07 3idm h VAL 100 N 0.00 0.00 -0.23 0.52 -1.51 -1.67 -3.40 116.25 109.96 3idm h VAL 100 Ca 0.00 -0.77 -0.69 0.00 -1.23 0.00 0.00 66.70 64.01 3idm h VAL 100 Cb 0.04 1.77 -0.01 0.00 -2.13 0.00 0.00 31.29 30.97 3idm h VAL 100 CO 0.00 0.00 3.50 0.59 -1.23 0.00 0.00 177.57 180.43 3idm n ASN 100 N -2.73 8.03 0.00 4.19 3.02 -0.88 -4.77 115.26 122.12 3idm n ASN 100 Ca 0.05 -2.71 0.00 0.00 -0.03 0.00 0.00 54.58 51.89 3idm n ASN 100 Cb 0.49 -1.54 0.00 0.00 -0.61 0.00 0.00 39.78 38.12 3idm n ASN 100 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3idm n ALA 100 N 3.56 0.00 -3.72 5.41 0.00 -1.26 -5.08 120.51 119.42 3idm n ALA 100 Ca 0.72 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.80 3idm n ALA 100 Cb 0.25 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.58 3idm n ALA 100 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 3idm s MET 100 N -2.00 2.11 0.11 0.00 -1.94 -1.26 -4.42 119.30 111.89 3idm s MET 100 Ca 0.00 -1.69 -0.08 0.00 -1.71 0.00 0.00 55.69 52.22 3idm s MET 100 Cb 0.00 -3.50 -0.13 0.00 2.01 0.00 0.00 34.83 33.21 3idm s MET 100 CO 0.00 -0.97 1.28 0.38 -0.01 0.00 0.00 175.02 175.70 3idm h ASP 101 N 8.05 0.68 -3.85 3.03 2.03 -1.72 -3.46 116.42 121.18 3idm h ASP 101 Ca -0.15 -0.53 -0.56 0.00 -0.73 0.00 0.00 57.03 55.06 3idm h ASP 101 Cb 1.05 -0.21 -0.31 0.00 -0.83 0.00 0.00 39.33 39.03 3idm h ASP 101 CO 0.66 1.33 -0.84 -0.69 -1.03 0.00 0.00 179.24 178.67 3idm s VAL 102 N -3.35 1.42 0.13 4.15 1.01 -1.25 -5.02 120.40 117.50 3idm s VAL 102 Ca -0.07 -0.71 0.09 0.00 0.00 0.00 0.00 61.98 61.29 3idm s VAL 102 Cb 0.08 -1.23 -0.04 0.00 0.00 0.00 0.00 36.38 35.20 3idm s VAL 102 CO 0.89 0.41 -0.22 0.26 0.00 0.00 0.00 175.10 176.44 3idm s TRP 103 N 0.09 1.95 0.63 5.22 0.52 -1.26 -0.80 118.94 125.28 3idm s TRP 103 Ca -0.05 -0.41 -0.07 0.00 0.02 0.00 0.00 56.10 55.58 3idm s TRP 103 Cb -0.12 -1.04 0.01 0.00 -1.15 0.00 0.00 33.47 31.18 3idm s TRP 103 CO 0.02 0.28 0.96 0.20 0.02 0.00 0.00 176.95 178.44 3idm s GLY 104 N -2.14 1.62 0.55 0.98 0.00 -0.75 -4.65 107.32 102.93 3idm s GLY 104 Ca 0.11 -0.62 0.25 0.00 0.00 0.00 0.00 44.72 44.46 3idm s GLY 104 CO 0.06 -0.31 2.18 0.06 0.00 0.00 0.00 173.10 175.09 3idm h GLN 105 N -0.33 0.00 0.00 2.90 3.07 -1.91 -3.45 115.11 115.39 3idm h GLN 105 Ca -0.45 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.29 3idm h GLN 105 Cb 1.26 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.82 3idm h GLN 105 CO 0.61 0.04 0.00 0.41 0.09 0.00 0.00 178.83 179.98 3idm n GLY 106 N -1.23 1.26 3.13 0.06 0.00 -1.26 -5.03 105.19 102.12 3idm n GLY 106 Ca -0.03 -1.63 -0.29 0.00 0.00 0.00 0.00 46.02 44.07 3idm n GLY 106 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3idm s ILE 107 N -2.17 1.69 -0.36 -0.61 -1.16 -0.40 -4.88 121.20 113.31 3idm s ILE 107 Ca 0.00 -0.79 -0.23 0.00 -0.51 0.00 0.00 60.65 59.12 3idm s ILE 107 Cb 0.00 -1.50 0.01 0.00 0.61 0.00 0.00 42.46 41.58 3idm s ILE 107 CO 0.00 0.48 0.79 -0.89 -2.81 0.00 0.00 174.94 172.51 3idm s THR 108 N 0.62 4.73 -0.14 4.00 2.01 -1.26 0.07 115.64 125.67 3idm s THR 108 Ca -0.14 0.91 -0.01 0.00 0.31 0.00 0.00 61.69 62.76 3idm s THR 108 Cb -0.16 -4.21 -0.02 0.00 0.01 0.00 0.00 72.50 68.11 3idm s THR 108 CO 0.04 -0.43 -0.10 -0.69 -0.69 0.00 0.00 174.62 172.76 3idm s VAL 109 N 3.11 3.37 -0.13 3.82 1.01 -0.25 -4.59 120.40 126.75 3idm s VAL 109 Ca 0.32 -0.55 0.01 0.00 0.00 0.00 0.00 61.98 61.76 3idm s VAL 109 Cb -0.13 -2.44 -0.01 0.00 0.00 0.00 0.00 36.38 33.80 3idm s VAL 109 CO 0.17 0.52 -0.16 -0.89 0.00 0.00 0.00 175.10 174.73 3idm s THR 110 N 0.30 2.72 -0.31 3.92 2.01 0.00 -1.66 115.64 122.62 3idm s THR 110 Ca -0.08 -0.77 -0.04 0.00 0.31 0.00 0.00 61.69 61.11 3idm s THR 110 Cb -0.15 -2.12 0.04 0.00 0.01 0.00 0.00 72.50 70.28 3idm s THR 110 CO 0.05 0.53 0.04 -0.63 -0.69 0.00 0.00 174.62 173.91 3idm s ILE 111 N 0.48 3.34 -0.10 1.82 1.01 -1.26 -1.29 121.20 125.20 3idm s ILE 111 Ca -0.11 -1.22 -0.23 0.00 0.00 0.00 0.00 60.65 59.09 3idm s ILE 111 Cb -0.16 -2.88 0.05 0.00 0.01 0.00 0.00 42.46 39.48 3idm s ILE 111 CO 0.05 -0.10 0.55 -0.55 0.00 0.00 0.00 174.94 174.88 3idm s SER 112 N 1.33 -0.52 0.15 3.58 0.15 -0.88 -4.40 113.70 113.10 3idm s SER 112 Ca -0.03 0.73 0.25 0.00 0.70 0.00 0.00 55.95 57.59 3idm s SER 112 Cb -0.19 0.72 0.48 0.00 -1.71 0.00 0.00 66.02 65.31 3idm s SER 112 CO 0.00 -0.41 1.45 -1.54 1.20 0.00 0.00 173.24 173.94 3idm n SER 113 N 1.71 0.74 -4.84 5.45 3.41 -1.26 -3.99 113.62 114.83 3idm n SER 113 Ca -0.18 0.25 -0.32 0.00 -0.26 0.00 0.00 58.87 58.37 3idm n SER 113 Cb 0.56 -0.12 -0.00 0.00 -0.26 0.00 0.00 64.21 64.39 3idm n SER 113 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 3idm s THR 114 N -3.15 4.45 0.59 6.66 -1.32 -1.26 -5.03 115.64 116.58 3idm s THR 114 Ca 0.07 0.99 0.08 0.00 -1.21 0.00 0.00 61.69 61.63 3idm s THR 114 Cb 0.13 -3.69 0.09 0.00 -1.51 0.00 0.00 72.50 67.52 3idm s THR 114 CO 0.69 -0.85 0.81 -0.94 -2.21 0.00 0.00 174.62 172.12 3idm s SER 115 N -3.50 5.01 0.01 8.08 1.04 -1.26 -5.04 113.70 118.04 3idm s SER 115 Ca 0.58 -0.75 -0.33 0.00 0.48 0.00 0.00 55.95 55.93 3idm s SER 115 Cb -0.11 0.20 -0.11 0.00 0.10 0.00 0.00 66.02 66.09 3idm s SER 115 CO 0.43 -1.40 1.85 0.41 0.98 0.00 0.00 173.24 175.50 3idm n THR 116 N -2.32 0.49 -3.79 2.02 -1.04 -1.26 -4.67 114.28 103.70 3idm n THR 116 Ca 0.15 -0.09 -0.13 0.00 -2.04 0.00 0.00 64.05 61.95 3idm n THR 116 Cb 0.61 -1.95 -0.13 0.00 -1.82 0.00 0.00 70.33 67.04 3idm n THR 116 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 3idm s LYS 117 N 3.41 0.19 0.53 -2.82 2.20 0.33 -4.96 119.74 118.63 3idm s LYS 117 Ca 0.88 0.29 -0.14 0.00 -0.36 0.00 0.00 55.97 56.64 3idm s LYS 117 Cb -0.60 0.04 -0.06 0.00 -1.51 0.00 0.00 37.83 35.69 3idm s LYS 117 CO 0.45 -0.06 0.97 0.20 -0.36 0.00 0.00 175.35 176.55 3idm s GLY 118 N 0.37 1.91 0.51 5.54 0.00 -1.26 -1.19 107.32 113.21 3idm s GLY 118 Ca -0.02 0.04 -0.12 0.00 0.00 0.00 0.00 44.72 44.62 3idm s GLY 118 CO -0.02 0.31 0.92 2.56 0.00 0.00 0.00 173.10 176.87 3idm s PRO 119 N -4.40 3.77 -0.25 2.90 0.04 -1.26 -4.51 135.00 131.29 3idm s PRO 119 Ca 0.57 0.70 -0.07 0.00 0.04 0.00 0.00 61.00 62.23 3idm s PRO 119 Cb -0.10 -2.21 -0.03 0.00 0.04 0.00 0.00 34.50 32.20 3idm s PRO 119 CO 0.38 -0.29 0.07 -1.12 0.04 0.00 0.00 177.00 176.09 3idm s SER 120 N -3.51 5.15 -0.27 6.66 0.01 0.09 -4.94 113.70 116.89 3idm s SER 120 Ca 0.55 -0.20 -0.12 0.00 1.31 0.00 0.00 55.95 57.49 3idm s SER 120 Cb -0.10 -1.93 -0.05 0.00 0.21 0.00 0.00 66.02 64.15 3idm s SER 120 CO 0.39 -0.03 0.22 -0.69 0.41 0.00 0.00 173.24 173.54 3idm s VAL 121 N 1.59 5.30 0.07 3.43 1.01 -1.26 -1.49 120.40 129.04 3idm s VAL 121 Ca 0.06 0.24 0.08 0.00 0.00 0.00 0.00 61.98 62.37 3idm s VAL 121 Cb -0.15 -3.55 -0.03 0.00 0.00 0.00 0.00 36.38 32.64 3idm s VAL 121 CO 0.04 0.25 -0.21 -0.36 0.00 0.00 0.00 175.10 174.83 3idm s PHE 122 N 1.67 2.48 0.43 5.22 2.99 -0.42 -4.96 117.98 125.40 3idm s PHE 122 Ca 0.09 -0.30 -0.21 0.00 0.00 0.00 0.00 56.93 56.51 3idm s PHE 122 Cb -0.15 -1.40 -0.11 0.00 0.00 0.00 0.00 43.02 41.35 3idm s PHE 122 CO 0.10 0.27 0.96 -1.25 -0.00 0.00 0.00 175.22 175.29 3idm s PRO 123 N -1.61 4.21 -0.39 0.24 0.04 -1.26 -0.62 135.00 135.61 3idm s PRO 123 Ca 0.15 1.15 0.02 0.00 0.04 0.00 0.00 61.00 62.36 3idm s PRO 123 Cb -0.10 -2.19 0.11 0.00 0.04 0.00 0.00 34.50 32.35 3idm s PRO 123 CO 0.06 -0.05 0.12 -0.51 0.04 0.00 0.00 177.00 176.66 3idm s LEU 124 N -3.17 4.81 -0.14 -3.56 1.43 -0.30 -4.80 118.68 112.95 3idm s LEU 124 Ca 0.62 -2.29 -0.02 0.00 -1.03 0.00 0.00 54.13 51.40 3idm s LEU 124 Cb -0.10 -1.68 -0.02 0.00 0.03 0.00 0.00 46.19 44.42 3idm s LEU 124 CO 0.14 -0.39 -0.07 0.00 0.23 0.00 0.00 176.35 176.27 3idm s ALA 125 N 0.73 2.89 0.00 4.21 0.00 -1.26 -0.76 121.76 127.56 3idm s ALA 125 Ca 0.12 -0.84 0.00 0.00 0.00 0.00 0.00 51.96 51.24 3idm s ALA 125 Cb -0.21 -1.44 0.00 0.00 0.00 0.00 0.00 23.12 21.47 3idm s ALA 125 CO -0.06 0.24 0.00 -0.35 0.00 0.00 0.00 175.76 175.59 3idm n PRO 126 N 3.48 0.00 0.10 0.00 -0.04 -1.26 -4.91 135.00 132.37 3idm n PRO 126 Ca -0.18 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.28 3idm n PRO 126 Cb 0.53 -0.45 0.00 0.00 -0.04 0.00 0.00 33.50 33.54 3idm n PRO 126 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3idm n SER 127 N 0.00 -1.86 -2.88 3.54 2.88 -1.26 -4.97 113.62 109.08 3idm n SER 127 Ca 0.00 0.45 -0.15 0.00 -1.33 0.00 0.00 58.87 57.84 3idm n SER 127 Cb 0.00 1.96 -0.04 0.00 -0.75 0.00 0.00 64.21 65.38 3idm n SER 127 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3idm n GLY 134 N -1.40 2.64 3.92 0.46 0.00 -1.26 -4.62 105.19 104.92 3idm n GLY 134 Ca 0.00 -0.69 -0.28 0.00 0.00 0.00 0.00 46.02 45.05 3idm n GLY 134 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3idm s THR 135 N 3.13 5.13 -0.02 2.61 -1.32 -1.26 -4.29 115.64 119.63 3idm s THR 135 Ca 0.34 -0.19 -0.01 0.00 -1.21 0.00 0.00 61.69 60.62 3idm s THR 135 Cb 0.11 -3.73 -0.04 0.00 -1.51 0.00 0.00 72.50 67.33 3idm s THR 135 CO -0.02 -0.24 0.08 0.00 -2.21 0.00 0.00 174.62 172.23 3idm s ALA 136 N -1.96 3.57 0.06 11.08 0.00 -0.67 -4.89 121.76 128.94 3idm s ALA 136 Ca 0.41 -0.86 0.09 0.00 0.00 0.00 0.00 51.96 51.60 3idm s ALA 136 Cb -0.11 -1.58 -0.03 0.00 0.00 0.00 0.00 23.12 21.40 3idm s ALA 136 CO 0.29 0.68 -0.24 0.00 0.00 0.00 0.00 175.76 176.49 3idm s ALA 137 N -1.16 2.09 0.10 0.00 0.00 -1.26 -1.10 121.76 120.43 3idm s ALA 137 Ca 0.22 -1.23 -0.17 0.00 0.00 0.00 0.00 51.96 50.78 3idm s ALA 137 Cb -0.12 -0.41 0.04 0.00 0.00 0.00 0.00 23.12 22.62 3idm s ALA 137 CO 0.12 0.48 0.40 -0.48 0.00 0.00 0.00 175.76 176.29 3idm s LEU 138 N -1.35 0.40 0.00 0.00 2.34 -0.88 -4.00 118.68 115.19 3idm s LEU 138 Ca 0.10 -0.21 0.00 0.00 0.06 0.00 0.00 54.13 54.09 3idm s LEU 138 Cb -0.10 1.80 0.00 0.00 -0.56 0.00 0.00 46.19 47.34 3idm s LEU 138 CO 0.03 -0.79 0.00 0.61 -1.06 0.00 0.00 176.35 175.14 3idm n GLY 139 N 0.03 2.00 2.85 -3.48 0.00 0.06 -1.00 105.19 105.64 3idm n GLY 139 Ca -0.17 -0.82 -0.15 0.00 0.00 0.00 0.00 46.02 44.89 3idm n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3idm s LEU 141 N 0.50 4.75 -0.84 0.00 2.96 0.21 -1.24 118.68 125.02 3idm s LEU 141 Ca -0.05 -1.08 -0.16 0.00 -0.22 0.00 0.00 54.13 52.62 3idm s LEU 141 Cb -0.07 -2.01 0.17 0.00 0.50 0.00 0.00 46.19 44.79 3idm s LEU 141 CO -0.01 -0.40 0.90 -0.69 -1.32 0.00 0.00 176.35 174.82 3idm s VAL 142 N 1.53 5.19 0.02 1.68 1.01 0.45 -1.30 120.40 128.98 3idm s VAL 142 Ca 0.02 -1.98 0.01 0.00 0.00 0.00 0.00 61.98 60.02 3idm s VAL 142 Cb -0.20 -4.59 -0.04 0.00 0.00 0.00 0.00 36.38 31.55 3idm s VAL 142 CO 0.06 -1.22 0.08 -0.75 0.00 0.00 0.00 175.10 173.26 3idm s LYS 143 N 1.39 3.00 -0.73 2.72 2.20 -0.56 -1.80 119.74 125.96 3idm s LYS 143 Ca 0.23 -0.55 -0.01 0.00 -0.36 0.00 0.00 55.97 55.27 3idm s LYS 143 Cb -0.09 -2.81 0.00 0.00 -1.51 0.00 0.00 37.83 33.42 3idm s LYS 143 CO -0.08 0.62 0.68 -0.25 -0.36 0.00 0.00 175.35 175.96 3idm n ASP 144 N 0.96 -7.35 -4.25 1.43 8.00 -0.79 -0.73 116.55 113.82 3idm n ASP 144 Ca -0.12 -0.17 -0.14 0.00 0.71 0.00 0.00 54.79 55.08 3idm n ASP 144 Cb 0.52 -4.74 -0.10 0.00 -0.02 0.00 0.00 41.12 36.78 3idm n ASP 144 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 3idm s TYR 145 N -2.96 1.23 -0.28 1.24 1.13 -0.94 -4.14 117.35 112.63 3idm s TYR 145 Ca 0.02 -0.93 -0.17 0.00 -1.41 0.00 0.00 57.07 54.58 3idm s TYR 145 Cb -0.00 -0.69 0.09 0.00 -1.10 0.00 0.00 41.96 40.26 3idm s TYR 145 CO 0.77 -0.10 0.76 0.12 -2.51 0.00 0.00 175.55 174.59 3idm s PHE 146 N -3.53 -0.93 0.00 -3.49 2.19 -0.33 -0.25 117.98 111.64 3idm s PHE 146 Ca 0.21 1.90 0.00 0.00 0.33 0.00 0.00 56.93 59.37 3idm s PHE 146 Cb 0.05 0.54 0.00 0.00 -1.31 0.00 0.00 43.02 42.30 3idm s PHE 146 CO 0.03 -0.46 0.00 -0.35 1.83 0.00 0.00 175.22 176.27 3idm n PRO 147 N 3.98 1.78 -2.31 10.12 -0.04 -1.26 -0.52 135.00 146.75 3idm n PRO 147 Ca -0.19 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 62.94 3idm n PRO 147 Cb 0.58 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 34.03 3idm n PRO 147 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 3idm s GLU 148 N -0.01 3.65 0.54 0.54 0.41 -1.26 -4.75 118.70 117.82 3idm s GLU 148 Ca 0.00 1.19 0.08 0.00 -0.41 0.00 0.00 54.97 55.83 3idm s GLU 148 Cb 0.00 -2.08 0.06 0.00 -1.78 0.00 0.00 34.13 30.33 3idm s GLU 148 CO 0.00 -0.53 0.64 -1.25 -0.49 0.00 0.00 175.26 173.63 3idm s PRO 149 N -3.78 2.34 0.01 0.39 0.04 -1.26 -4.99 135.00 127.75 3idm s PRO 149 Ca 0.63 -1.72 0.02 0.00 0.04 0.00 0.00 61.00 59.98 3idm s PRO 149 Cb -0.14 -2.48 -0.01 0.00 0.04 0.00 0.00 34.50 31.91 3idm s PRO 149 CO 0.29 -0.71 -0.06 0.54 0.04 0.00 0.00 177.00 177.10 3idm s VAL 150 N -2.66 0.48 -0.14 -0.36 0.11 -1.26 -4.36 120.40 112.20 3idm s VAL 150 Ca 0.52 -0.48 -0.01 0.00 -2.93 0.00 0.00 61.98 59.08 3idm s VAL 150 Cb -0.05 -0.44 -0.02 0.00 -1.53 0.00 0.00 36.38 34.34 3idm s VAL 150 CO 0.33 -0.02 -0.10 0.42 -3.33 0.00 0.00 175.10 172.40 3idm s THR 151 N -0.48 3.30 -0.10 5.04 -4.23 -0.03 -4.98 115.64 114.15 3idm s THR 151 Ca -0.01 -0.57 0.01 0.00 -1.18 0.00 0.00 61.69 59.94 3idm s THR 151 Cb -0.04 -2.41 0.02 0.00 1.34 0.00 0.00 72.50 71.40 3idm s THR 151 CO -0.00 0.51 -0.14 -0.69 -0.54 0.00 0.00 174.62 173.76 3idm s VAL 152 N 0.40 1.39 0.26 2.29 1.01 -1.26 -1.33 120.40 123.16 3idm s VAL 152 Ca -0.08 -0.58 0.05 0.00 0.00 0.00 0.00 61.98 61.37 3idm s VAL 152 Cb -0.15 -1.28 -0.06 0.00 0.00 0.00 0.00 36.38 34.89 3idm s VAL 152 CO 0.05 0.42 -0.03 -0.94 0.00 0.00 0.00 175.10 174.60 3idm s SER 153 N 1.04 2.38 -0.07 3.32 1.04 -0.51 -4.96 113.70 115.94 3idm s SER 153 Ca -0.06 -1.21 0.05 0.00 0.48 0.00 0.00 55.95 55.21 3idm s SER 153 Cb -0.15 -0.10 -0.01 0.00 0.10 0.00 0.00 66.02 65.87 3idm s SER 153 CO -0.02 -0.43 -0.24 0.26 0.98 0.00 0.00 173.24 173.79 3idm s TRP 154 N -3.19 2.42 -1.39 5.02 0.52 -1.26 -0.03 118.94 121.03 3idm s TRP 154 Ca 0.29 -0.80 -0.05 0.00 0.02 0.00 0.00 56.10 55.57 3idm s TRP 154 Cb 0.05 -1.60 0.03 0.00 -1.15 0.00 0.00 33.47 30.80 3idm s TRP 154 CO 0.11 -0.27 0.77 0.09 0.02 0.00 0.00 176.95 177.66 3idm n ASN 155 N 3.11 -2.26 -1.61 2.95 3.02 0.24 -1.80 115.26 118.92 3idm n ASN 155 Ca -0.18 -0.83 -0.20 0.00 -0.03 0.00 0.00 54.58 53.35 3idm n ASN 155 Cb 0.52 -3.90 -0.08 0.00 -0.61 0.00 0.00 39.78 35.71 3idm n ASN 155 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 3idm n SER 156 N -2.98 -5.24 0.00 6.41 7.64 -1.26 -1.69 113.62 116.51 3idm n SER 156 Ca -0.19 0.47 0.00 0.00 1.01 0.00 0.00 58.87 60.16 3idm n SER 156 Cb 0.63 -4.64 0.00 0.00 -1.01 0.00 0.00 64.21 59.19 3idm n SER 156 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3idm n GLY 157 N -0.39 0.67 0.24 0.23 0.00 -0.74 -4.99 105.19 100.20 3idm n GLY 157 Ca -0.20 0.00 0.15 0.00 0.00 0.00 0.00 46.02 45.97 3idm n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3idm h ALA 158 N 0.00 1.00 -3.05 4.61 0.00 -1.24 -3.42 119.26 117.16 3idm h ALA 158 Ca 0.00 0.00 -0.66 0.00 0.00 0.00 0.00 54.91 54.25 3idm h ALA 158 Cb 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 17.79 17.51 3idm h ALA 158 CO 0.00 0.00 -0.72 -1.17 0.00 0.00 0.00 179.25 177.36 3idm s LEU 159 N -5.96 3.04 0.00 0.00 0.20 -0.96 -4.92 118.68 110.08 3idm s LEU 159 Ca 0.04 -0.52 0.00 0.00 0.69 0.00 0.00 54.13 54.35 3idm s LEU 159 Cb 0.08 -1.74 0.00 0.00 -0.43 0.00 0.00 46.19 44.10 3idm s LEU 159 CO 0.58 -0.06 0.00 0.35 -0.29 0.00 0.00 176.35 176.93 3idm n THR 160 N 4.78 0.00 -2.31 3.68 -2.24 -1.26 -4.17 114.28 112.76 3idm n THR 160 Ca -0.18 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.18 3idm n THR 160 Cb 0.50 -0.54 -0.03 0.00 -2.10 0.00 0.00 70.33 68.16 3idm n THR 160 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3idm s SER 161 N -2.36 6.90 0.00 3.42 0.15 -1.26 -2.86 113.70 117.69 3idm s SER 161 Ca 0.00 1.91 0.00 0.00 0.70 0.00 0.00 55.95 58.56 3idm s SER 161 Cb 0.00 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.76 3idm s SER 161 CO 0.00 -0.74 0.00 0.61 1.20 0.00 0.00 173.24 174.31 3idm n GLY 162 N 3.66 0.73 3.71 9.45 0.00 -1.26 -4.77 105.19 116.71 3idm n GLY 162 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 3idm n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3idm s VAL 163 N -2.59 5.00 -0.25 1.61 1.01 -1.13 -2.12 120.40 121.92 3idm s VAL 163 Ca 0.00 1.59 -0.00 0.00 0.00 0.00 0.00 61.98 63.57 3idm s VAL 163 Cb 0.00 -4.11 0.07 0.00 0.00 0.00 0.00 36.38 32.35 3idm s VAL 163 CO 0.00 0.22 0.02 -1.00 0.00 0.00 0.00 175.10 174.34 3idm s HIS 164 N 0.90 1.95 -0.40 5.22 3.76 0.20 -4.99 115.29 121.93 3idm s HIS 164 Ca 0.41 -1.61 -0.14 0.00 -0.15 0.00 0.00 55.06 53.57 3idm s HIS 164 Cb -0.18 -1.57 0.02 0.00 1.11 0.00 0.00 32.58 31.96 3idm s HIS 164 CO 0.20 -0.77 0.28 0.99 -0.85 0.00 0.00 174.74 174.59 3idm s THR 165 N 1.54 5.08 0.40 1.30 2.01 -1.26 -0.79 115.64 123.92 3idm s THR 165 Ca 0.01 -0.71 -0.23 0.00 0.31 0.00 0.00 61.69 61.07 3idm s THR 165 Cb -0.18 -3.83 -0.09 0.00 0.01 0.00 0.00 72.50 68.40 3idm s THR 165 CO -0.12 -0.29 1.01 -0.36 -0.69 0.00 0.00 174.62 174.17 3idm s PHE 166 N 1.65 3.32 0.38 4.92 0.40 -0.94 -5.03 117.98 122.68 3idm s PHE 166 Ca 0.04 1.66 -0.27 0.00 -0.60 0.00 0.00 56.93 57.76 3idm s PHE 166 Cb -0.19 -3.04 -0.09 0.00 0.51 0.00 0.00 43.02 40.21 3idm s PHE 166 CO 0.09 -0.41 1.25 -1.25 0.70 0.00 0.00 175.22 175.60 3idm s PRO 167 N -2.62 4.12 0.54 0.24 0.04 -1.26 -4.61 135.00 131.45 3idm s PRO 167 Ca 0.58 2.04 -0.21 0.00 0.04 0.00 0.00 61.00 63.46 3idm s PRO 167 Cb -0.18 -2.83 -0.05 0.00 0.04 0.00 0.00 34.50 31.47 3idm s PRO 167 CO 0.23 -0.32 1.22 0.00 0.04 0.00 0.00 177.00 178.17 3idm s ALA 168 N -1.28 2.75 -0.08 8.56 0.00 -1.26 -4.86 121.76 125.59 3idm s ALA 168 Ca 0.54 1.04 0.00 0.00 0.00 0.00 0.00 51.96 53.55 3idm s ALA 168 Cb -0.36 -3.45 -0.03 0.00 0.00 0.00 0.00 23.12 19.29 3idm s ALA 168 CO 0.46 -1.02 -0.06 0.14 0.00 0.00 0.00 175.76 175.28 3idm s VAL 169 N -1.53 3.75 -0.38 0.00 -7.23 -0.56 -4.93 120.40 109.52 3idm s VAL 169 Ca 0.71 -0.46 -0.24 0.00 -1.81 0.00 0.00 61.98 60.19 3idm s VAL 169 Cb -0.32 -2.55 0.01 0.00 0.56 0.00 0.00 36.38 34.09 3idm s VAL 169 CO 0.36 0.59 0.81 -0.22 -0.31 0.00 0.00 175.10 176.33 3idm s LEU 170 N -0.66 4.12 0.80 1.32 0.20 -1.26 -1.85 118.68 121.34 3idm s LEU 170 Ca 0.10 0.32 -0.12 0.00 0.69 0.00 0.00 54.13 55.12 3idm s LEU 170 Cb -0.11 -3.06 0.07 0.00 -0.43 0.00 0.00 46.19 42.65 3idm s LEU 170 CO 0.02 -0.79 1.10 -1.10 -0.29 0.00 0.00 176.35 175.29 3idm s GLN 171 N 3.22 2.10 0.62 1.98 -0.21 -0.25 -4.94 119.66 122.18 3idm s GLN 171 Ca 0.32 0.56 0.41 0.00 0.02 0.00 0.00 55.36 56.68 3idm s GLN 171 Cb -0.13 -1.93 2.15 0.00 1.00 0.00 0.00 33.01 34.11 3idm s GLN 171 CO 0.18 -1.59 2.26 0.66 -2.12 0.00 0.00 175.29 174.68 3idm h SER 172 N -1.07 0.00 0.69 5.90 4.64 -1.97 -1.37 113.55 120.37 3idm h SER 172 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 3idm h SER 172 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 3idm h SER 172 CO 0.60 0.00 -0.17 -1.54 -0.87 0.00 0.00 176.83 174.85 3idm n SER 173 N -3.03 0.26 0.00 4.97 3.41 -1.26 -4.91 113.62 113.05 3idm n SER 173 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.59 3idm n SER 173 Cb 0.12 -0.17 0.00 0.00 -0.26 0.00 0.00 64.21 63.90 3idm n SER 173 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3idm n GLY 174 N 1.44 0.73 3.76 5.00 0.00 -0.52 -4.76 105.19 110.85 3idm n GLY 174 Ca 0.09 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.80 3idm n GLY 174 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3idm s LEU 175 N 0.00 3.75 0.48 0.99 1.43 -1.26 -4.72 118.68 119.35 3idm s LEU 175 Ca 0.00 -0.04 -0.04 0.00 -1.03 0.00 0.00 54.13 53.02 3idm s LEU 175 Cb 0.00 -2.44 -0.03 0.00 0.03 0.00 0.00 46.19 43.76 3idm s LEU 175 CO 0.00 0.17 0.77 -0.31 0.23 0.00 0.00 176.35 177.21 3idm s TYR 176 N -1.38 3.48 -0.23 0.29 2.02 0.66 -1.09 117.35 121.10 3idm s TYR 176 Ca 0.29 0.69 -0.18 0.00 -0.37 0.00 0.00 57.07 57.49 3idm s TYR 176 Cb -0.12 -2.33 0.06 0.00 -0.40 0.00 0.00 41.96 39.17 3idm s TYR 176 CO 0.21 -0.33 0.60 0.45 -1.57 0.00 0.00 175.55 174.91 3idm s SER 177 N -4.14 -0.69 0.15 2.29 0.15 -0.77 -1.89 113.70 108.80 3idm s SER 177 Ca 0.48 1.25 -0.12 0.00 0.70 0.00 0.00 55.95 58.25 3idm s SER 177 Cb -0.10 1.21 0.01 0.00 -1.71 0.00 0.00 66.02 65.43 3idm s SER 177 CO 0.43 -0.22 0.34 -1.48 1.20 0.00 0.00 173.24 173.52 3idm s LEU 178 N 0.76 0.74 0.16 3.45 -0.00 -0.75 -1.50 118.68 121.55 3idm s LEU 178 Ca -0.04 -0.65 0.11 0.00 -0.00 0.00 0.00 54.13 53.56 3idm s LEU 178 Cb -0.05 1.50 -0.04 0.00 -0.00 0.00 0.00 46.19 47.59 3idm s LEU 178 CO -0.06 -0.90 -0.25 -0.94 -0.00 0.00 0.00 176.35 174.20 3idm s SER 179 N -2.90 3.39 -0.10 1.48 1.04 -1.26 -0.42 113.70 114.93 3idm s SER 179 Ca 0.11 -0.81 -0.02 0.00 0.48 0.00 0.00 55.95 55.71 3idm s SER 179 Cb 0.02 -0.24 0.04 0.00 0.10 0.00 0.00 66.02 65.94 3idm s SER 179 CO -0.05 0.15 0.01 -0.55 0.98 0.00 0.00 173.24 173.79 3idm s SER 180 N -2.37 1.91 0.43 7.02 0.15 -0.37 -2.21 113.70 118.26 3idm s SER 180 Ca 0.17 -0.27 0.06 0.00 0.70 0.00 0.00 55.95 56.61 3idm s SER 180 Cb -0.09 -0.47 -0.06 0.00 -1.71 0.00 0.00 66.02 63.69 3idm s SER 180 CO 0.08 -0.22 0.01 0.68 1.20 0.00 0.00 173.24 174.99 3idm s VAL 181 N 1.95 1.82 -0.22 4.45 -7.23 0.03 -0.80 120.40 120.40 3idm s VAL 181 Ca 0.04 -1.99 -0.14 0.00 -1.81 0.00 0.00 61.98 58.08 3idm s VAL 181 Cb -0.13 -2.81 0.07 0.00 0.56 0.00 0.00 36.38 34.06 3idm s VAL 181 CO -0.06 0.00 0.55 0.54 -0.31 0.00 0.00 175.10 175.82 3idm s VAL 182 N -2.74 -0.01 -0.19 1.32 0.11 -0.17 -0.63 120.40 118.09 3idm s VAL 182 Ca 0.29 0.04 -0.08 0.00 -2.93 0.00 0.00 61.98 59.29 3idm s VAL 182 Cb 0.08 -0.80 -0.04 0.00 -1.53 0.00 0.00 36.38 34.08 3idm s VAL 182 CO 0.15 0.02 0.09 0.42 -3.33 0.00 0.00 175.10 172.45 3idm s THR 183 N 1.29 5.07 0.22 5.04 -4.23 -0.90 -2.08 115.64 120.04 3idm s THR 183 Ca -0.08 0.06 0.03 0.00 -1.18 0.00 0.00 61.69 60.52 3idm s THR 183 Cb -0.06 -3.29 -0.05 0.00 1.34 0.00 0.00 72.50 70.44 3idm s THR 183 CO -0.13 0.46 0.01 0.68 -0.54 0.00 0.00 174.62 175.10 3idm s VAL 184 N 0.28 0.86 0.23 2.29 -7.23 -0.26 -4.62 120.40 111.95 3idm s VAL 184 Ca 0.06 -2.01 -0.30 0.00 -1.81 0.00 0.00 61.98 57.91 3idm s VAL 184 Cb -0.12 -2.32 -0.10 0.00 0.56 0.00 0.00 36.38 34.40 3idm s VAL 184 CO -0.01 -0.32 1.46 -2.84 -0.31 0.00 0.00 175.10 173.08 3idm s PRO 185 N -3.90 4.26 0.60 4.82 0.02 -1.26 -1.66 135.00 137.87 3idm s PRO 185 Ca 0.28 2.30 0.29 0.00 0.02 0.00 0.00 61.00 63.89 3idm s PRO 185 Cb 0.06 -3.12 1.46 0.00 0.02 0.00 0.00 34.50 32.91 3idm s PRO 185 CO 0.08 -0.46 1.87 1.03 -0.33 0.00 0.00 177.00 179.19 3idm h SER 186 N 5.45 0.00 0.55 2.53 0.87 -1.91 0.97 113.55 122.01 3idm h SER 186 Ca -0.45 0.00 -0.17 0.00 -1.23 0.00 0.00 61.79 59.94 3idm h SER 186 Cb 1.21 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.16 3idm h SER 186 CO 0.81 0.00 -0.75 0.77 -0.53 0.00 0.00 176.83 177.12 3idm h SER 187 N 0.00 0.19 -2.97 6.23 4.64 -1.93 -3.49 113.55 116.23 3idm h SER 187 Ca 0.21 -0.14 -0.57 0.00 -0.47 0.00 0.00 61.79 60.82 3idm h SER 187 Cb 1.21 -0.06 -0.04 0.00 -0.31 0.00 0.00 62.40 63.20 3idm h SER 187 CO -0.00 0.88 0.95 -0.44 -0.87 0.00 0.00 176.83 177.35 3idm s SER 188 N -6.89 6.79 0.00 4.97 0.01 0.33 -4.93 113.70 113.99 3idm s SER 188 Ca -0.03 1.54 0.00 0.00 1.31 0.00 0.00 55.95 58.77 3idm s SER 188 Cb 0.11 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.80 3idm s SER 188 CO 0.81 -0.92 0.00 0.35 0.41 0.00 0.00 173.24 173.89 3idm n THR 191 N 5.76 0.00 -3.79 1.44 -2.24 -1.26 -4.81 114.28 109.37 3idm n THR 191 Ca 0.15 0.00 -0.26 0.00 -2.27 0.00 0.00 64.05 61.67 3idm n THR 191 Cb 0.45 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.66 3idm n THR 191 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 3idm s GLN 192 N 0.00 3.48 -0.10 -0.78 2.00 -1.26 -5.11 119.66 117.89 3idm s GLN 192 Ca 0.00 -0.48 -0.09 0.00 -2.00 0.00 0.00 55.36 52.79 3idm s GLN 192 Cb 0.00 -2.88 -0.04 0.00 0.80 0.00 0.00 33.01 30.89 3idm s GLN 192 CO 0.00 0.43 0.19 0.95 -0.50 0.00 0.00 175.29 176.36 3idm s THR 193 N -1.87 5.41 -0.22 -0.34 -4.23 -1.26 -5.10 115.64 108.03 3idm s THR 193 Ca 0.37 0.33 0.01 0.00 -1.18 0.00 0.00 61.69 61.22 3idm s THR 193 Cb -0.11 -3.47 0.03 0.00 1.34 0.00 0.00 72.50 70.30 3idm s THR 193 CO 0.29 0.60 -0.14 -0.31 -0.54 0.00 0.00 174.62 174.52 3idm s TYR 194 N -0.97 2.99 -0.09 3.99 1.51 -1.26 -4.94 117.35 118.59 3idm s TYR 194 Ca 0.16 -1.83 0.01 0.00 -1.01 0.00 0.00 57.07 54.41 3idm s TYR 194 Cb -0.13 -1.95 0.02 0.00 -0.11 0.00 0.00 41.96 39.79 3idm s TYR 194 CO 0.06 -0.81 -0.11 -0.08 -1.11 0.00 0.00 175.55 173.49 3idm s THR 195 N 1.24 1.17 -0.07 -0.71 -1.32 -1.26 -0.16 115.64 114.52 3idm s THR 195 Ca -0.00 -0.45 -0.17 0.00 -1.21 0.00 0.00 61.69 59.85 3idm s THR 195 Cb -0.16 -1.10 -0.05 0.00 -1.51 0.00 0.00 72.50 69.68 3idm s THR 195 CO -0.09 0.37 0.47 0.00 -2.21 0.00 0.00 174.62 173.16 3idm s ASN 197 N 0.06 5.52 -0.14 0.00 -0.87 0.95 -1.53 114.94 118.92 3idm s ASN 197 Ca 0.26 -1.30 -0.06 0.00 -1.57 0.00 0.00 52.86 50.18 3idm s ASN 197 Cb -0.16 -1.94 -0.04 0.00 -0.02 0.00 0.00 41.25 39.09 3idm s ASN 197 CO 0.12 -0.43 0.06 -0.69 -2.57 0.00 0.00 177.10 173.58 3idm s VAL 198 N 1.43 4.78 -0.14 1.60 1.01 0.11 -1.43 120.40 127.76 3idm s VAL 198 Ca 0.01 -0.05 -0.04 0.00 0.00 0.00 0.00 61.98 61.90 3idm s VAL 198 Cb -0.21 -3.10 0.06 0.00 0.00 0.00 0.00 36.38 33.13 3idm s VAL 198 CO 0.03 0.53 0.15 0.21 0.00 0.00 0.00 175.10 176.02 3idm s ASN 199 N -0.23 1.39 -0.49 3.32 3.04 -0.45 -0.25 114.94 121.28 3idm s ASN 199 Ca 0.08 -0.10 -0.05 0.00 0.04 0.00 0.00 52.86 52.83 3idm s ASN 199 Cb -0.12 0.13 0.13 0.00 -1.54 0.00 0.00 41.25 39.85 3idm s ASN 199 CO 0.01 -0.30 0.32 -2.28 -3.04 0.00 0.00 177.10 171.82 3idm s HIS 200 N 2.25 3.51 0.29 0.43 5.65 -0.53 -0.85 115.29 126.03 3idm s HIS 200 Ca 0.04 -2.30 -0.01 0.00 0.25 0.00 0.00 55.06 53.04 3idm s HIS 200 Cb -0.14 -3.33 0.45 0.00 -1.18 0.00 0.00 32.58 28.38 3idm s HIS 200 CO -0.08 -0.95 1.91 0.87 -0.65 0.00 0.00 174.74 175.84 3idm h LYS 201 N 7.95 1.09 0.00 2.88 1.57 -1.85 -2.60 116.57 125.62 3idm h LYS 201 Ca -0.12 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 58.59 3idm h LYS 201 Cb 1.03 -0.25 -0.00 0.00 0.08 0.00 0.00 32.23 33.10 3idm h LYS 201 CO 0.75 0.72 -0.01 -1.35 -0.57 0.00 0.00 179.45 179.00 3idm h PRO 202 N 1.12 0.00 -0.09 3.15 0.11 -1.92 -3.03 132.00 131.35 3idm h PRO 202 Ca 0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.50 3idm h PRO 202 Cb 0.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.21 3idm h PRO 202 CO -0.13 0.01 0.00 -1.13 -0.21 0.00 0.00 178.00 176.53 3idm n SER 203 N -4.33 2.05 -3.45 -2.05 3.41 -1.21 -4.98 113.62 103.06 3idm n SER 203 Ca -0.03 -1.56 -0.18 0.00 -0.26 0.00 0.00 58.87 56.84 3idm n SER 203 Cb 0.09 -0.05 0.07 0.00 -0.26 0.00 0.00 64.21 64.06 3idm n SER 203 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3idm n ASN 204 N 0.48 -3.17 -4.05 4.04 3.02 -1.10 -4.88 115.26 109.60 3idm n ASN 204 Ca 0.07 -0.70 -0.32 0.00 -0.03 0.00 0.00 54.58 53.60 3idm n ASN 204 Cb 0.28 -4.87 -0.14 0.00 -0.61 0.00 0.00 39.78 34.44 3idm n ASN 204 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3idm s THR 205 N -3.43 2.47 -0.19 3.41 2.01 -1.00 -5.04 115.64 113.87 3idm s THR 205 Ca 0.14 -2.21 -0.05 0.00 0.31 0.00 0.00 61.69 59.87 3idm s THR 205 Cb -0.02 -2.76 -0.03 0.00 0.01 0.00 0.00 72.50 69.70 3idm s THR 205 CO 0.75 -0.56 0.00 -0.54 -0.69 0.00 0.00 174.62 173.59 3idm s LYS 206 N 0.97 3.66 -0.02 4.92 1.02 -1.26 -1.46 119.74 127.57 3idm s LYS 206 Ca 0.08 -0.50 0.02 0.00 0.02 0.00 0.00 55.97 55.59 3idm s LYS 206 Cb -0.20 -3.07 0.01 0.00 -0.52 0.00 0.00 37.83 34.05 3idm s LYS 206 CO -0.07 0.07 -0.07 0.08 -0.92 0.00 0.00 175.35 174.45 3idm s VAL 207 N 0.84 0.60 -0.22 3.17 1.01 0.66 -5.01 120.40 121.46 3idm s VAL 207 Ca 0.01 -0.25 0.01 0.00 0.00 0.00 0.00 61.98 61.75 3idm s VAL 207 Cb -0.14 -0.56 0.03 0.00 0.00 0.00 0.00 36.38 35.71 3idm s VAL 207 CO 0.02 0.20 -0.14 -1.81 0.00 0.00 0.00 175.10 173.37 3idm s ASP 208 N 0.32 3.79 -0.19 3.32 1.01 -1.26 0.04 116.67 123.70 3idm s ASP 208 Ca -0.04 -0.94 0.01 0.00 0.71 0.00 0.00 52.55 52.29 3idm s ASP 208 Cb -0.09 -1.54 0.03 0.00 1.01 0.00 0.00 42.92 42.33 3idm s ASP 208 CO 0.00 -0.09 -0.18 -0.75 0.21 0.00 0.00 175.17 174.37 3idm s LYS 209 N 1.23 2.79 -0.17 8.23 2.20 -0.58 -4.96 119.74 128.48 3idm s LYS 209 Ca -0.01 -0.86 -0.28 0.00 -0.36 0.00 0.00 55.97 54.47 3idm s LYS 209 Cb -0.16 -2.55 -0.01 0.00 -1.51 0.00 0.00 37.83 33.61 3idm s LYS 209 CO -0.09 -0.26 0.96 0.50 -0.36 0.00 0.00 175.35 176.10 3idm s ARG 210 N 1.30 4.33 -0.23 4.03 3.52 -1.26 -1.56 118.95 129.07 3idm s ARG 210 Ca 0.03 1.26 -0.05 0.00 -0.13 0.00 0.00 55.73 56.84 3idm s ARG 210 Cb -0.14 -3.59 -0.02 0.00 -1.56 0.00 0.00 34.95 29.65 3idm s ARG 210 CO -0.12 -0.43 0.00 0.08 -0.81 0.00 0.00 175.30 174.03 3idm s VAL 211 N 2.47 3.77 0.15 7.11 1.01 0.77 -4.99 120.40 130.70 3idm s VAL 211 Ca 0.44 -0.36 0.06 0.00 0.00 0.00 0.00 61.98 62.12 3idm s VAL 211 Cb -0.17 -2.74 -0.04 0.00 0.00 0.00 0.00 36.38 33.44 3idm s VAL 211 CO 0.12 0.39 -0.13 -1.83 0.00 0.00 0.00 175.10 173.65 3idm s GLU 212 N 1.49 1.12 0.59 2.72 -1.05 -1.26 -4.08 118.70 118.23 3idm s GLU 212 Ca 0.06 -1.39 -0.19 0.00 -0.15 0.00 0.00 54.97 53.30 3idm s GLU 212 Cb -0.15 -0.91 -0.05 0.00 -0.44 0.00 0.00 34.13 32.59 3idm s GLU 212 CO -0.00 0.16 0.96 -2.30 0.95 0.00 0.00 175.26 175.02 3idm n PRO 213 N 0.09 0.92 -0.53 -4.83 -0.02 -1.26 -4.85 135.00 124.53 3idm n PRO 213 Ca -0.12 0.36 -0.30 0.00 -2.02 0.00 0.00 63.50 61.42 3idm n PRO 213 Cb 0.59 -2.16 0.23 0.00 -0.02 0.00 0.00 33.50 32.14 3idm n PRO 213 CO 0.00 0.00 0.00 0.36 1.98 0.00 0.00 175.50 177.84 3idm n LYS 214 N -0.93 -2.37 -2.15 -0.52 2.85 -1.26 -4.69 118.16 109.09 3idm n LYS 214 Ca 0.13 -0.67 -0.02 0.00 -1.05 0.00 0.00 58.31 56.71 3idm n LYS 214 Cb 0.47 -1.97 0.00 0.00 -0.65 0.00 0.00 35.03 32.89 3idm n LYS 214 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 177.40 177.78 3idm n SER 215 N -3.78 -5.05 0.00 -5.58 7.64 -1.26 -5.05 113.62 100.54 3idm n SER 215 Ca 0.02 0.53 0.00 0.00 1.01 0.00 0.00 58.87 60.43 3idm n SER 215 Cb 0.57 -3.22 0.00 0.00 -1.01 0.00 0.00 64.21 60.55 3idm n SER 215 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03