#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2aab s VAL 2 N 0.00 3.97 0.24 2.53 1.01 -1.26 -4.62 120.40 122.28 2aab s VAL 2 Ca 0.00 1.29 -0.13 0.00 0.00 0.00 0.00 61.98 63.14 2aab s VAL 2 Cb 0.00 -3.83 -0.00 0.00 0.00 0.00 0.00 36.38 32.55 2aab s VAL 2 CO 0.00 -0.04 0.47 0.00 0.00 0.00 0.00 175.10 175.53 2aab s GLN 3 N 2.76 1.52 -0.02 2.72 -2.07 -1.25 -5.04 119.66 118.28 2aab s GLN 3 Ca 0.61 -1.24 0.00 0.00 -1.82 0.00 0.00 55.36 52.91 2aab s GLN 3 Cb -0.28 0.47 0.02 0.00 -1.09 0.00 0.00 33.01 32.13 2aab s GLN 3 CO 0.23 -0.63 -0.00 -0.51 -1.32 0.00 0.00 175.29 173.05 2aab s LEU 4 N -3.01 1.35 -0.43 2.60 1.43 -1.26 -3.00 118.68 116.36 2aab s LEU 4 Ca 0.22 -0.02 0.02 0.00 -1.03 0.00 0.00 54.13 53.32 2aab s LEU 4 Cb -0.00 -0.18 0.13 0.00 0.03 0.00 0.00 46.19 46.16 2aab s LEU 4 CO 0.08 -0.07 0.22 -0.69 0.23 0.00 0.00 176.35 176.12 2aab s VAL 5 N 0.77 1.50 0.50 -1.59 1.01 -0.60 -3.85 120.40 118.14 2aab s VAL 5 Ca -0.08 -2.52 -0.19 0.00 0.00 0.00 0.00 61.98 59.19 2aab s VAL 5 Cb -0.11 -2.06 -0.08 0.00 0.00 0.00 0.00 36.38 34.14 2aab s VAL 5 CO -0.01 -0.86 1.01 -1.83 0.00 0.00 0.00 175.10 173.41 2aab s GLU 6 N 0.42 3.83 0.25 2.72 1.03 -1.26 -2.54 118.70 123.15 2aab s GLU 6 Ca 0.17 1.22 -0.11 0.00 0.03 0.00 0.00 54.97 56.28 2aab s GLU 6 Cb -0.24 -2.11 -0.01 0.00 -0.80 0.00 0.00 34.13 30.97 2aab s GLU 6 CO -0.02 -0.39 0.44 -1.54 -1.33 0.00 0.00 175.26 172.42 2aab s SER 7 N -2.34 0.00 0.00 0.83 1.04 0.32 -4.50 113.70 109.05 2aab s SER 7 Ca 0.64 -1.03 0.00 0.00 0.48 0.00 0.00 55.95 56.05 2aab s SER 7 Cb -0.14 0.57 0.00 0.00 0.10 0.00 0.00 66.02 66.55 2aab s SER 7 CO 0.23 -1.12 0.00 0.61 0.98 0.00 0.00 173.24 173.94 2aab n GLY 8 N -0.38 0.75 3.83 7.32 0.00 -1.26 -1.36 105.19 114.08 2aab n GLY 8 Ca -0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.71 2aab n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2aab s GLY 9 N -0.92 1.64 0.00 -0.02 0.00 -1.26 -4.68 107.32 102.09 2aab s GLY 9 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 44.72 44.59 2aab s GLY 9 CO 0.00 0.24 0.00 0.61 0.00 0.00 0.00 173.10 173.95 2aab n GLY 10 N -2.25 -0.52 3.82 0.20 0.00 0.23 -4.87 105.19 101.81 2aab n GLY 10 Ca 0.07 -0.90 -0.38 0.00 0.00 0.00 0.00 46.02 44.81 2aab n GLY 10 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2aab s LEU 11 N 0.00 4.42 -0.05 0.99 1.43 -1.26 -1.34 118.68 122.88 2aab s LEU 11 Ca 0.00 0.84 -0.04 0.00 -1.03 0.00 0.00 54.13 53.90 2aab s LEU 11 Cb 0.00 -2.50 0.02 0.00 0.03 0.00 0.00 46.19 43.73 2aab s LEU 11 CO 0.00 0.29 0.12 -0.69 0.23 0.00 0.00 176.35 176.29 2aab s VAL 12 N -0.76 -0.01 0.43 -1.59 1.01 -0.30 -4.97 120.40 114.21 2aab s VAL 12 Ca 0.22 0.03 -0.22 0.00 0.00 0.00 0.00 61.98 62.01 2aab s VAL 12 Cb -0.16 -0.18 -0.10 0.00 0.00 0.00 0.00 36.38 35.95 2aab s VAL 12 CO 0.11 0.01 0.99 -1.10 0.00 0.00 0.00 175.10 175.11 2aab s GLN 13 N 0.25 4.14 0.06 2.72 -1.52 -1.24 -0.21 119.66 123.86 2aab s GLN 13 Ca -0.02 1.28 -0.34 0.00 -1.95 0.00 0.00 55.36 54.34 2aab s GLN 13 Cb -0.03 -2.29 -0.13 0.00 -0.22 0.00 0.00 33.01 30.34 2aab s GLN 13 CO -0.01 -0.13 1.72 -2.30 -0.25 0.00 0.00 175.29 174.33 2aab n PRO 14 N -0.49 2.24 0.00 2.91 -0.02 -1.25 -0.37 135.00 138.02 2aab n PRO 14 Ca 0.07 0.81 0.00 0.00 -2.02 0.00 0.00 63.50 62.36 2aab n PRO 14 Cb 0.52 -2.63 0.00 0.00 -0.02 0.00 0.00 33.50 31.38 2aab n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2aab n GLY 15 N 3.89 0.77 2.41 -1.23 0.00 0.90 -4.94 105.19 107.00 2aab n GLY 15 Ca 0.19 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.02 2aab n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2aab n GLY 16 N -1.89 -1.75 3.22 -0.02 0.00 0.51 -3.63 105.19 101.62 2aab n GLY 16 Ca 0.00 -1.63 -0.13 0.00 0.00 0.00 0.00 46.02 44.25 2aab n GLY 16 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2aab s SER 17 N -3.92 1.57 -0.27 1.61 0.01 -1.26 -2.42 113.70 109.02 2aab s SER 17 Ca 0.48 -0.97 -0.25 0.00 1.31 0.00 0.00 55.95 56.52 2aab s SER 17 Cb -0.02 0.02 0.08 0.00 0.21 0.00 0.00 66.02 66.31 2aab s SER 17 CO 0.34 -0.35 0.79 -0.60 0.41 0.00 0.00 173.24 173.84 2aab s ARG 18 N -3.57 0.77 -0.13 12.44 3.52 -0.19 -4.99 118.95 126.79 2aab s ARG 18 Ca 0.13 0.89 -0.05 0.00 -0.13 0.00 0.00 55.73 56.57 2aab s ARG 18 Cb 0.02 0.37 -0.04 0.00 -1.56 0.00 0.00 34.95 33.75 2aab s ARG 18 CO -0.01 -0.10 0.06 0.21 -0.81 0.00 0.00 175.30 174.66 2aab s LYS 19 N 0.31 3.50 -0.09 5.12 2.20 -1.26 -0.89 119.74 128.63 2aab s LYS 19 Ca 0.01 -0.31 0.02 0.00 -0.36 0.00 0.00 55.97 55.33 2aab s LYS 19 Cb -0.05 -3.07 -0.02 0.00 -1.51 0.00 0.00 37.83 33.19 2aab s LYS 19 CO -0.00 0.55 -0.15 -0.51 -0.36 0.00 0.00 175.35 174.88 2aab s LEU 20 N -0.42 2.67 -0.01 5.43 1.43 0.40 -4.64 118.68 123.53 2aab s LEU 20 Ca 0.10 -0.29 0.07 0.00 -1.03 0.00 0.00 54.13 52.98 2aab s LEU 20 Cb -0.12 -1.57 -0.02 0.00 0.03 0.00 0.00 46.19 44.51 2aab s LEU 20 CO 0.02 0.25 -0.23 -0.94 0.23 0.00 0.00 176.35 175.68 2aab s SER 21 N -0.14 3.38 -0.18 2.29 1.04 -0.46 -1.07 113.70 118.57 2aab s SER 21 Ca -0.01 -0.43 0.01 0.00 0.48 0.00 0.00 55.95 56.00 2aab s SER 21 Cb -0.14 -0.47 0.03 0.00 0.10 0.00 0.00 66.02 65.54 2aab s SER 21 CO 0.03 0.31 -0.16 0.00 0.98 0.00 0.00 173.24 174.40 2aab s ALA 23 N 1.37 3.47 0.71 0.00 0.00 -1.05 -0.75 121.76 125.49 2aab s ALA 23 Ca 0.03 -1.72 -0.07 0.00 0.00 0.00 0.00 51.96 50.20 2aab s ALA 23 Cb -0.14 -3.01 0.06 0.00 0.00 0.00 0.00 23.12 20.04 2aab s ALA 23 CO -0.11 -1.59 1.02 0.00 0.00 0.00 0.00 175.76 175.08 2aab s ALA 24 N 1.89 3.16 0.00 0.00 0.00 -1.06 -1.56 121.76 124.18 2aab s ALA 24 Ca 0.08 -0.93 0.00 0.00 0.00 0.00 0.00 51.96 51.11 2aab s ALA 24 Cb -0.19 -2.60 0.00 0.00 0.00 0.00 0.00 23.12 20.33 2aab s ALA 24 CO 0.11 -1.31 0.00 -1.13 0.00 0.00 0.00 175.76 173.43 2aab n SER 25 N -2.93 0.00 0.00 0.00 3.41 -1.16 -4.96 113.62 107.98 2aab n SER 25 Ca 0.08 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.69 2aab n SER 25 Cb 0.60 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.55 2aab n SER 25 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2aab n GLY 26 N 0.00 0.00 0.00 5.00 0.00 -1.26 -3.88 105.19 105.05 2aab n GLY 26 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2aab n GLY 26 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2aab n PHE 27 N 0.00 0.00 -0.91 1.61 -1.74 -1.26 -4.52 117.46 110.64 2aab n PHE 27 Ca 0.00 0.00 -0.34 0.00 -0.56 0.00 0.00 57.45 56.55 2aab n PHE 27 Cb 0.00 0.00 -0.12 0.00 1.52 0.00 0.00 39.48 40.88 2aab n PHE 27 CO 0.00 0.00 0.00 -2.37 -0.56 0.00 0.00 176.76 173.83 2aab n THR 28 N -0.17 0.05 -0.09 1.97 5.66 -1.26 -4.68 114.28 115.77 2aab n THR 28 Ca 0.00 -0.05 0.25 0.00 -3.05 0.00 0.00 64.05 61.20 2aab n THR 28 Cb 0.00 -2.01 0.53 0.00 -1.55 0.00 0.00 70.33 67.31 2aab n THR 28 CO 0.00 0.00 0.00 0.15 -3.05 0.00 0.00 175.07 172.17 2aab h PHE 29 N 10.56 0.00 -0.00 1.09 3.57 -1.93 0.57 116.94 130.81 2aab h PHE 29 Ca 0.17 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.67 2aab h PHE 29 Cb 0.81 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.55 2aab h PHE 29 CO 1.01 0.00 -0.03 0.43 -2.23 0.00 0.00 178.31 177.49 2aab n SER 30 N -3.35 0.09 -0.08 0.41 7.64 -1.26 -3.67 113.62 113.39 2aab n SER 30 Ca 0.17 -0.21 -0.07 0.00 1.01 0.00 0.00 58.87 59.77 2aab n SER 30 Cb 1.20 -0.24 -0.14 0.00 -1.01 0.00 0.00 64.21 64.01 2aab n SER 30 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2aab n SER 31 N -1.24 0.56 -4.76 6.43 7.64 0.20 -4.60 113.62 117.86 2aab n SER 31 Ca 0.14 0.00 -0.37 0.00 1.01 0.00 0.00 58.87 59.65 2aab n SER 31 Cb 0.25 1.02 -0.06 0.00 -1.01 0.00 0.00 64.21 64.41 2aab n SER 31 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 2aab s PHE 32 N -2.51 3.56 0.70 1.43 0.08 -1.22 -4.72 117.98 115.30 2aab s PHE 32 Ca -0.09 0.81 -0.12 0.00 0.12 0.00 0.00 56.93 57.65 2aab s PHE 32 Cb 0.06 -2.39 0.02 0.00 -0.57 0.00 0.00 43.02 40.14 2aab s PHE 32 CO 0.74 0.34 1.08 0.20 -0.10 0.00 0.00 175.22 177.48 2aab s GLY 33 N 0.05 1.83 0.15 4.36 0.00 -1.26 -4.12 107.32 108.33 2aab s GLY 33 Ca 0.22 0.29 0.07 0.00 0.00 0.00 0.00 44.72 45.30 2aab s GLY 33 CO 0.09 0.62 -0.16 1.06 0.00 0.00 0.00 173.10 174.70 2aab s MET 34 N -4.67 1.17 0.13 2.90 -1.94 0.39 -1.50 119.30 115.78 2aab s MET 34 Ca 0.62 -1.34 0.03 0.00 -1.71 0.00 0.00 55.69 53.29 2aab s MET 34 Cb -0.17 -1.15 -0.04 0.00 2.01 0.00 0.00 34.83 35.48 2aab s MET 34 CO 0.50 0.23 -0.09 -1.01 -0.01 0.00 0.00 175.02 174.64 2aab s HIS 35 N -2.11 1.12 -0.10 -0.03 3.76 0.21 0.07 115.29 118.22 2aab s HIS 35 Ca 0.13 -0.82 0.02 0.00 -0.15 0.00 0.00 55.06 54.24 2aab s HIS 35 Cb -0.05 -0.59 0.01 0.00 1.11 0.00 0.00 32.58 33.05 2aab s HIS 35 CO 0.05 -0.01 -0.17 -1.58 -0.85 0.00 0.00 174.74 172.18 2aab s TRP 36 N -3.44 1.98 -0.02 1.40 0.52 -0.21 -0.88 118.94 118.29 2aab s TRP 36 Ca 0.15 -0.86 0.02 0.00 0.02 0.00 0.00 56.10 55.43 2aab s TRP 36 Cb 0.04 -1.40 0.00 0.00 -1.15 0.00 0.00 33.47 30.96 2aab s TRP 36 CO -0.01 -0.41 -0.08 0.08 0.02 0.00 0.00 176.95 176.54 2aab s VAL 37 N 0.74 0.71 0.31 4.03 1.01 -0.03 -0.69 120.40 126.48 2aab s VAL 37 Ca -0.12 -0.32 0.10 0.00 0.00 0.00 0.00 61.98 61.64 2aab s VAL 37 Cb -0.16 -0.64 -0.05 0.00 0.00 0.00 0.00 36.38 35.53 2aab s VAL 37 CO 0.02 0.23 -0.08 0.00 0.00 0.00 0.00 175.10 175.27 2aab s ARG 38 N 0.19 1.94 -0.19 2.72 1.70 -0.61 0.18 118.95 124.87 2aab s ARG 38 Ca -0.03 -1.73 -0.04 0.00 -0.47 0.00 0.00 55.73 53.47 2aab s ARG 38 Cb -0.08 -1.88 0.09 0.00 -0.57 0.00 0.00 34.95 32.51 2aab s ARG 38 CO 0.00 0.25 0.24 -1.14 -1.08 0.00 0.00 175.30 173.57 2aab s GLN 39 N -3.62 0.19 0.49 3.89 0.74 0.08 -0.60 119.66 120.84 2aab s GLN 39 Ca 0.32 0.35 -0.20 0.00 0.05 0.00 0.00 55.36 55.88 2aab s GLN 39 Cb -0.03 -0.88 -0.08 0.00 1.10 0.00 0.00 33.01 33.12 2aab s GLN 39 CO 0.17 -0.58 1.06 0.00 -0.55 0.00 0.00 175.29 175.40 2aab s ALA 40 N 2.37 2.85 0.20 1.58 0.00 -1.25 -0.48 121.76 127.03 2aab s ALA 40 Ca 0.06 0.67 -0.31 0.00 0.00 0.00 0.00 51.96 52.38 2aab s ALA 40 Cb -0.15 -3.28 -0.15 0.00 0.00 0.00 0.00 23.12 19.54 2aab s ALA 40 CO -0.12 -0.41 1.09 -2.30 0.00 0.00 0.00 175.76 174.02 2aab n PRO 41 N -0.95 1.14 -0.12 0.00 -0.02 -1.26 0.29 135.00 134.08 2aab n PRO 41 Ca 0.09 0.41 0.00 0.00 -2.02 0.00 0.00 63.50 61.98 2aab n PRO 41 Cb 0.52 -1.85 0.00 0.00 -0.02 0.00 0.00 33.50 32.15 2aab n PRO 41 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2aab n GLU 42 N 1.46 0.00 -1.76 -0.52 1.02 -1.26 -4.90 120.64 114.68 2aab n GLU 42 Ca 0.14 0.00 -0.17 0.00 -0.02 0.00 0.00 57.16 57.11 2aab n GLU 42 Cb 0.26 -3.74 0.10 0.00 -0.02 0.00 0.00 31.44 28.05 2aab n GLU 42 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2aab n LYS 43 N -2.00 -0.20 -0.52 3.49 4.76 0.15 -5.12 118.16 118.71 2aab n LYS 43 Ca 0.00 -1.73 0.00 0.00 -2.87 0.00 0.00 58.31 53.71 2aab n LYS 43 Cb 0.00 -0.61 0.00 0.00 -1.84 0.00 0.00 35.03 32.58 2aab n LYS 43 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2aab n GLY 44 N -0.52 1.27 3.80 0.72 0.00 -1.26 -4.70 105.19 104.50 2aab n GLY 44 Ca 0.11 -2.00 -0.37 0.00 0.00 0.00 0.00 46.02 43.76 2aab n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2aab s LEU 45 N 0.00 4.38 -0.15 0.99 1.43 -1.26 -3.84 118.68 120.23 2aab s LEU 45 Ca 0.00 0.77 -0.00 0.00 -1.03 0.00 0.00 54.13 53.87 2aab s LEU 45 Cb 0.00 -2.49 0.04 0.00 0.03 0.00 0.00 46.19 43.77 2aab s LEU 45 CO 0.00 0.23 -0.06 -0.70 0.23 0.00 0.00 176.35 176.05 2aab s GLU 46 N -0.44 1.48 0.31 1.70 2.12 0.23 -5.01 118.70 119.09 2aab s GLU 46 Ca 0.21 -0.42 -0.29 0.00 0.36 0.00 0.00 54.97 54.83 2aab s GLU 46 Cb -0.15 -1.86 -0.11 0.00 0.26 0.00 0.00 34.13 32.28 2aab s GLU 46 CO 0.09 -0.37 1.47 -0.46 -0.54 0.00 0.00 175.26 175.45 2aab s TRP 47 N 1.66 2.84 -0.18 5.30 -0.00 -1.26 -1.57 118.94 125.72 2aab s TRP 47 Ca 0.02 1.08 -0.09 0.00 -0.00 0.00 0.00 56.10 57.11 2aab s TRP 47 Cb -0.14 -3.91 -0.08 0.00 -0.00 0.00 0.00 33.47 29.34 2aab s TRP 47 CO -0.08 -2.83 -0.24 0.28 -0.00 0.00 0.00 176.95 174.08 2aab n VAL 48 N 1.49 1.03 -3.52 5.86 0.31 0.14 -4.65 118.33 118.98 2aab n VAL 48 Ca 0.04 -0.24 -0.09 0.00 -0.01 0.00 0.00 64.34 64.05 2aab n VAL 48 Cb 0.40 -1.77 -0.02 0.00 -0.91 0.00 0.00 33.84 31.54 2aab n VAL 48 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2aab s ALA 49 N -2.35 -1.85 0.02 3.52 0.00 -1.06 -0.99 121.76 119.05 2aab s ALA 49 Ca -0.25 1.12 0.05 0.00 0.00 0.00 0.00 51.96 52.87 2aab s ALA 49 Cb 0.10 0.25 -0.02 0.00 0.00 0.00 0.00 23.12 23.45 2aab s ALA 49 CO 0.32 -0.64 -0.14 -0.47 0.00 0.00 0.00 175.76 174.84 2aab s TYR 50 N -2.83 1.24 0.00 0.00 5.04 0.17 -1.04 117.35 119.93 2aab s TYR 50 Ca 0.04 -0.30 0.00 0.00 -2.44 0.00 0.00 57.07 54.37 2aab s TYR 50 Cb -0.01 -0.76 0.00 0.00 0.35 0.00 0.00 41.96 41.54 2aab s TYR 50 CO -0.07 0.01 0.00 1.51 -1.34 0.00 0.00 175.55 175.66 2aab n ILE 51 N 2.27 0.00 0.62 3.14 3.06 0.11 -0.85 119.36 127.71 2aab n ILE 51 Ca -0.16 0.00 0.07 0.00 -2.50 0.00 0.00 62.75 60.16 2aab n ILE 51 Cb 0.55 0.00 0.01 0.00 0.54 0.00 0.00 39.64 40.74 2aab n ILE 51 CO 0.00 0.00 0.00 -1.54 -2.50 0.00 0.00 176.55 172.51 2aab n SER 52 N 0.00 1.58 -0.10 9.51 3.41 -1.26 -0.46 113.62 126.30 2aab n SER 52 Ca 0.00 -1.29 0.06 0.00 -0.26 0.00 0.00 58.87 57.38 2aab n SER 52 Cb 0.00 0.41 0.09 0.00 -0.26 0.00 0.00 64.21 64.45 2aab n SER 52 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2aab n ASP 53 N -0.04 1.91 -1.07 4.04 2.03 -1.26 -4.63 116.55 117.53 2aab n ASP 53 Ca 0.06 -2.65 -0.08 0.00 0.52 0.00 0.00 54.79 52.65 2aab n ASP 53 Cb 0.31 -0.29 -0.03 0.00 -0.72 0.00 0.00 41.12 40.38 2aab n ASP 53 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 2aab n SER 54 N -1.01 -2.48 0.25 1.67 7.64 -1.26 -4.79 113.62 113.64 2aab n SER 54 Ca 0.10 0.19 -0.12 0.00 1.01 0.00 0.00 58.87 60.05 2aab n SER 54 Cb 0.56 -2.34 -0.06 0.00 -1.01 0.00 0.00 64.21 61.35 2aab n SER 54 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2aab h SER 55 N 0.00 -0.57 -3.87 6.43 0.02 -1.95 -3.45 113.55 110.17 2aab h SER 55 Ca -0.16 -0.05 -0.68 0.00 -0.84 0.00 0.00 61.79 60.06 2aab h SER 55 Cb 0.58 0.15 -0.21 0.00 0.14 0.00 0.00 62.40 63.06 2aab h SER 55 CO 0.24 -0.17 -0.77 0.20 -1.14 0.00 0.00 176.83 175.19 2aab s ASN 56 N -4.79 4.11 -0.05 3.07 0.01 -1.26 -5.11 114.94 110.91 2aab s ASN 56 Ca -0.12 -0.29 -0.02 0.00 -0.71 0.00 0.00 52.86 51.71 2aab s ASN 56 Cb 0.01 -0.81 0.04 0.00 0.41 0.00 0.00 41.25 40.90 2aab s ASN 56 CO 0.41 0.28 0.09 0.27 -1.51 0.00 0.00 177.10 176.64 2aab s ILE 57 N -0.91 -0.13 -0.02 0.60 -4.36 -1.26 -4.18 121.20 110.94 2aab s ILE 57 Ca 0.15 0.32 0.08 0.00 -0.26 0.00 0.00 60.65 60.94 2aab s ILE 57 Cb -0.11 -0.18 -0.02 0.00 1.25 0.00 0.00 42.46 43.40 2aab s ILE 57 CO 0.05 0.13 -0.25 -0.31 0.24 0.00 0.00 174.94 174.81 2aab s TYR 58 N 1.79 2.37 0.13 1.37 2.02 -0.03 -4.95 117.35 120.04 2aab s TYR 58 Ca -0.01 -0.41 0.10 0.00 -0.37 0.00 0.00 57.07 56.38 2aab s TYR 58 Cb -0.12 -1.51 -0.04 0.00 -0.40 0.00 0.00 41.96 39.89 2aab s TYR 58 CO -0.04 -0.01 -0.25 0.71 -1.57 0.00 0.00 175.55 174.39 2aab s TYR 59 N -0.63 2.14 0.16 2.71 2.02 -1.26 -0.65 117.35 121.84 2aab s TYR 59 Ca 0.10 -0.39 -0.30 0.00 -0.37 0.00 0.00 57.07 56.11 2aab s TYR 59 Cb -0.10 -1.15 -0.07 0.00 -0.40 0.00 0.00 41.96 40.23 2aab s TYR 59 CO -0.01 0.31 1.03 0.00 -1.57 0.00 0.00 175.55 175.32 2aab s ALA 60 N -1.15 3.32 0.49 3.71 0.00 -0.17 -4.87 121.76 123.10 2aab s ALA 60 Ca 0.12 0.71 0.31 0.00 0.00 0.00 0.00 51.96 53.10 2aab s ALA 60 Cb -0.10 -3.31 1.41 0.00 0.00 0.00 0.00 23.12 21.13 2aab s ALA 60 CO 0.06 -0.10 1.78 -0.44 0.00 0.00 0.00 175.76 177.06 2aab h ASP 61 N 5.17 0.15 0.00 0.00 3.45 -1.95 -0.05 116.42 123.19 2aab h ASP 61 Ca -0.44 0.03 0.00 0.00 0.43 0.00 0.00 57.03 57.05 2aab h ASP 61 Cb 1.21 0.01 0.00 0.00 -0.56 0.00 0.00 39.33 39.99 2aab h ASP 61 CO 0.72 0.02 0.10 0.71 -1.57 0.00 0.00 179.24 179.22 2aab h THR 62 N 0.12 0.00 0.00 0.35 1.35 -1.96 -2.80 112.91 109.97 2aab h THR 62 Ca 0.59 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.45 2aab h THR 62 Cb 2.07 0.65 0.00 0.00 -1.73 0.00 0.00 68.15 69.14 2aab h THR 62 CO -0.12 0.00 0.00 1.33 -0.25 0.00 0.00 175.52 176.48 2aab n VAL 63 N -2.60 0.09 0.00 6.82 0.24 -0.08 -4.98 118.33 117.82 2aab n VAL 63 Ca -0.02 -0.19 0.00 0.00 -2.04 0.00 0.00 64.34 62.09 2aab n VAL 63 Cb 0.15 1.45 0.00 0.00 -1.47 0.00 0.00 33.84 33.97 2aab n VAL 63 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 2aab n LYS 64 N -0.04 0.00 -0.89 7.34 3.00 -0.93 -1.52 118.16 125.12 2aab n LYS 64 Ca 0.00 0.54 -0.16 0.00 -0.00 0.00 0.00 58.31 58.70 2aab n LYS 64 Cb 0.26 -0.86 0.03 0.00 0.00 0.00 0.00 35.03 34.45 2aab n LYS 64 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2aab n GLY 65 N -0.95 3.96 0.00 3.14 0.00 -1.26 -4.04 105.19 106.05 2aab n GLY 65 Ca 0.00 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 44.97 2aab n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2aab n ARG 66 N 0.51 0.00 -4.46 1.61 1.74 -0.68 -5.05 116.66 110.33 2aab n ARG 66 Ca 0.29 0.00 -0.34 0.00 -0.77 0.00 0.00 57.85 57.02 2aab n ARG 66 Cb 0.57 -0.31 -0.11 0.00 -1.02 0.00 0.00 32.46 31.59 2aab n ARG 66 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2aab s PHE 67 N -1.00 3.03 -0.08 -1.55 0.40 -0.57 -2.18 117.98 116.03 2aab s PHE 67 Ca 0.00 -0.08 0.03 0.00 -0.60 0.00 0.00 56.93 56.28 2aab s PHE 67 Cb 0.00 -1.84 0.01 0.00 0.51 0.00 0.00 43.02 41.70 2aab s PHE 67 CO 0.00 0.20 -0.16 0.95 0.70 0.00 0.00 175.22 176.91 2aab s THR 68 N -0.29 1.44 0.05 0.64 -4.23 -0.59 -4.81 115.64 107.83 2aab s THR 68 Ca 0.05 -0.64 -0.04 0.00 -1.18 0.00 0.00 61.69 59.87 2aab s THR 68 Cb -0.12 -1.29 -0.05 0.00 1.34 0.00 0.00 72.50 72.38 2aab s THR 68 CO 0.02 0.42 0.27 -0.51 -0.54 0.00 0.00 174.62 174.28 2aab s ILE 69 N 0.66 5.31 0.10 2.99 2.07 -1.26 -0.41 121.20 130.65 2aab s ILE 69 Ca -0.14 -0.03 -0.18 0.00 -1.41 0.00 0.00 60.65 58.89 2aab s ILE 69 Cb -0.16 -3.59 0.04 0.00 0.13 0.00 0.00 42.46 38.88 2aab s ILE 69 CO 0.04 0.24 0.45 -0.94 -1.91 0.00 0.00 174.94 172.81 2aab s SER 70 N -2.08 -0.32 -0.01 4.50 1.04 -0.42 -5.00 113.70 111.42 2aab s SER 70 Ca 0.32 -0.12 0.01 0.00 0.48 0.00 0.00 55.95 56.64 2aab s SER 70 Cb -0.13 0.48 0.00 0.00 0.10 0.00 0.00 66.02 66.48 2aab s SER 70 CO 0.21 -0.80 -0.04 -0.13 0.98 0.00 0.00 173.24 173.46 2aab s ARG 71 N -3.26 0.38 -0.60 4.02 0.52 -1.26 -0.06 118.95 118.68 2aab s ARG 71 Ca -0.01 -0.11 0.00 0.00 -0.52 0.00 0.00 55.73 55.09 2aab s ARG 71 Cb 0.01 -0.39 0.15 0.00 0.52 0.00 0.00 34.95 35.23 2aab s ARG 71 CO -0.08 0.04 0.39 0.34 0.02 0.00 0.00 175.30 176.01 2aab s ASP 72 N 0.15 4.89 0.31 0.23 2.15 -0.33 -4.97 116.67 119.10 2aab s ASP 72 Ca -0.01 -3.01 0.07 0.00 0.43 0.00 0.00 52.55 50.03 2aab s ASP 72 Cb -0.04 -1.77 0.83 0.00 -0.30 0.00 0.00 42.92 41.64 2aab s ASP 72 CO -0.00 -0.29 1.72 0.78 -0.17 0.00 0.00 175.17 177.20 2aab h ASN 73 N 6.69 0.57 0.59 -0.34 -0.26 -1.95 -0.46 115.58 120.43 2aab h ASN 73 Ca -0.02 0.14 -0.03 0.00 -0.56 0.00 0.00 56.30 55.83 2aab h ASN 73 Cb 0.91 0.06 0.01 0.00 -1.06 0.00 0.00 38.32 38.24 2aab h ASN 73 CO 0.71 0.08 -0.28 1.55 -1.06 0.00 0.00 177.43 178.42 2aab h PRO 74 N 0.53 -0.76 0.00 0.81 0.13 -1.96 -2.90 132.00 127.84 2aab h PRO 74 Ca 0.61 0.05 0.00 0.00 -0.87 0.00 0.00 66.00 65.80 2aab h PRO 74 Cb 1.16 0.17 0.00 0.00 0.13 0.00 0.00 31.00 32.46 2aab h PRO 74 CO -0.49 -0.51 0.00 1.63 -0.23 0.00 0.00 178.00 178.40 2aab n LYS 75 N -4.38 0.74 -3.53 0.86 5.02 -1.18 -4.90 118.16 110.77 2aab n LYS 75 Ca -0.10 0.00 -0.19 0.00 -2.02 0.00 0.00 58.31 56.00 2aab n LYS 75 Cb 0.31 -1.36 0.01 0.00 -0.02 0.00 0.00 35.03 33.97 2aab n LYS 75 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2aab n ASN 76 N -0.86 -5.92 -3.83 4.39 3.02 -0.21 -4.88 115.26 106.97 2aab n ASN 76 Ca 0.13 -0.70 -0.12 0.00 -0.03 0.00 0.00 54.58 53.86 2aab n ASN 76 Cb 0.06 -3.30 -0.10 0.00 -0.61 0.00 0.00 39.78 35.83 2aab n ASN 76 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2aab s THR 77 N -3.13 0.06 -0.06 3.41 -4.23 -1.03 -2.57 115.64 108.10 2aab s THR 77 Ca 0.13 -0.48 0.02 0.00 -1.18 0.00 0.00 61.69 60.18 2aab s THR 77 Cb -0.05 -0.45 -0.03 0.00 1.34 0.00 0.00 72.50 73.31 2aab s THR 77 CO 0.84 -0.27 -0.08 -0.22 -0.54 0.00 0.00 174.62 174.35 2aab s LEU 78 N -1.03 3.08 0.13 4.79 2.96 0.07 -1.19 118.68 127.49 2aab s LEU 78 Ca -0.11 -0.07 0.08 0.00 -0.22 0.00 0.00 54.13 53.81 2aab s LEU 78 Cb -0.06 -1.67 -0.04 0.00 0.50 0.00 0.00 46.19 44.93 2aab s LEU 78 CO 0.02 0.35 -0.18 -0.36 -1.32 0.00 0.00 176.35 174.86 2aab s PHE 79 N -0.81 1.73 -0.09 5.38 0.40 0.92 0.12 117.98 125.63 2aab s PHE 79 Ca 0.13 -0.46 -0.02 0.00 -0.60 0.00 0.00 56.93 55.98 2aab s PHE 79 Cb -0.11 -0.90 0.03 0.00 0.51 0.00 0.00 43.02 42.55 2aab s PHE 79 CO 0.02 0.25 0.02 -1.17 0.70 0.00 0.00 175.22 175.04 2aab s LEU 80 N -2.35 0.58 -0.27 -0.37 2.96 -0.23 -1.30 118.68 117.70 2aab s LEU 80 Ca 0.11 -0.17 -0.14 0.00 -0.22 0.00 0.00 54.13 53.71 2aab s LEU 80 Cb -0.07 -0.41 -0.04 0.00 0.50 0.00 0.00 46.19 46.17 2aab s LEU 80 CO 0.05 -0.22 0.31 -1.10 -1.32 0.00 0.00 176.35 174.07 2aab s GLN 81 N 1.99 4.01 -0.13 1.98 -1.52 0.45 -0.45 119.66 125.98 2aab s GLN 81 Ca 0.04 -0.08 -0.02 0.00 -1.95 0.00 0.00 55.36 53.36 2aab s GLN 81 Cb -0.13 -3.64 -0.02 0.00 -0.22 0.00 0.00 33.01 28.99 2aab s GLN 81 CO -0.05 -0.21 -0.08 -1.64 -0.25 0.00 0.00 175.29 173.05 2aab s MET 82 N 1.88 3.41 0.23 2.91 -1.94 -0.07 -1.55 119.30 124.17 2aab s MET 82 Ca 0.12 -0.58 0.01 0.00 -1.71 0.00 0.00 55.69 53.53 2aab s MET 82 Cb -0.16 -2.76 -0.05 0.00 2.01 0.00 0.00 34.83 33.88 2aab s MET 82 CO 0.10 0.31 0.08 0.95 -0.01 0.00 0.00 175.02 176.45 2aab s THR 82 N 0.15 0.45 -1.61 2.05 -4.23 -0.92 -1.02 115.64 110.51 2aab s THR 82 Ca -0.04 -1.99 -0.06 0.00 -1.18 0.00 0.00 61.69 58.42 2aab s THR 82 Cb -0.14 -2.49 0.06 0.00 1.34 0.00 0.00 72.50 71.27 2aab s THR 82 CO 0.04 -0.10 0.26 -1.20 -0.54 0.00 0.00 174.62 173.08 2aab n SER 82 N -0.37 -0.20 -4.76 3.99 7.64 -1.11 -4.75 113.62 114.05 2aab n SER 82 Ca -0.01 -1.20 -0.38 0.00 1.01 0.00 0.00 58.87 58.29 2aab n SER 82 Cb 0.66 -1.96 0.02 0.00 -1.01 0.00 0.00 64.21 61.92 2aab n SER 82 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2aab s LEU 82 N -7.28 3.94 0.31 -3.43 1.43 -1.02 -4.67 118.68 107.97 2aab s LEU 82 Ca 0.23 2.61 0.07 0.00 -1.03 0.00 0.00 54.13 56.01 2aab s LEU 82 Cb -0.13 -4.23 -0.06 0.00 0.03 0.00 0.00 46.19 41.80 2aab s LEU 82 CO 0.98 -1.28 -0.05 -0.13 0.23 0.00 0.00 176.35 176.09 2aab s ARG 83 N -2.77 1.65 0.30 1.70 0.52 -1.26 -0.07 118.95 119.02 2aab s ARG 83 Ca 0.67 -1.85 0.06 0.00 -0.52 0.00 0.00 55.73 54.09 2aab s ARG 83 Cb -0.36 -1.29 0.76 0.00 0.52 0.00 0.00 34.95 34.57 2aab s ARG 83 CO 0.44 0.04 1.74 1.03 0.02 0.00 0.00 175.30 178.56 2aab h SER 84 N 2.17 0.60 0.55 0.23 0.87 -1.97 0.25 113.55 116.24 2aab h SER 84 Ca -0.41 0.12 0.00 0.00 -1.23 0.00 0.00 61.79 60.28 2aab h SER 84 Cb 1.24 0.03 0.00 0.00 -0.44 0.00 0.00 62.40 63.23 2aab h SER 84 CO 0.69 0.14 0.00 -0.62 -0.53 0.00 0.00 176.83 176.51 2aab n GLU 85 N -4.89 0.06 0.00 2.24 4.71 -1.26 -2.41 120.64 119.08 2aab n GLU 85 Ca 0.23 0.18 0.16 0.00 -0.01 0.00 0.00 57.16 57.72 2aab n GLU 85 Cb 0.63 -1.50 0.90 0.00 -1.01 0.00 0.00 31.44 30.46 2aab n GLU 85 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 2aab n ASP 86 N -1.45 0.02 -4.66 1.62 8.00 0.08 -4.80 116.55 115.36 2aab n ASP 86 Ca 0.05 -0.80 -0.42 0.00 0.71 0.00 0.00 54.79 54.33 2aab n ASP 86 Cb 0.19 -0.07 -0.03 0.00 -0.02 0.00 0.00 41.12 41.20 2aab n ASP 86 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2aab s THR 87 N -2.14 3.33 -0.05 -3.53 2.01 -1.01 -4.88 115.64 109.36 2aab s THR 87 Ca 0.43 0.42 -0.31 0.00 0.31 0.00 0.00 61.69 62.54 2aab s THR 87 Cb 0.22 -3.27 0.13 0.00 0.01 0.00 0.00 72.50 69.58 2aab s THR 87 CO 0.39 -0.04 1.35 0.00 -0.69 0.00 0.00 174.62 175.64 2aab s ALA 88 N 4.16 -2.41 -0.10 7.40 0.00 -0.89 -4.40 121.76 125.51 2aab s ALA 88 Ca 0.80 0.69 -0.21 0.00 0.00 0.00 0.00 51.96 53.24 2aab s ALA 88 Cb -0.37 0.41 -0.04 0.00 0.00 0.00 0.00 23.12 23.12 2aab s ALA 88 CO 0.35 -1.08 0.59 1.41 0.00 0.00 0.00 175.76 177.03 2aab s MET 89 N -2.19 4.37 -0.24 0.00 -2.45 0.37 -2.10 119.30 117.06 2aab s MET 89 Ca 0.17 0.66 -0.09 0.00 -1.25 0.00 0.00 55.69 55.19 2aab s MET 89 Cb 0.05 -3.46 -0.04 0.00 1.25 0.00 0.00 34.83 32.63 2aab s MET 89 CO -0.05 0.07 0.12 0.71 1.05 0.00 0.00 175.02 176.92 2aab s TYR 90 N 0.85 3.19 0.01 4.11 2.02 -0.57 -0.74 117.35 126.22 2aab s TYR 90 Ca 0.31 -0.07 -0.01 0.00 -0.37 0.00 0.00 57.07 56.94 2aab s TYR 90 Cb -0.16 -2.25 -0.04 0.00 -0.40 0.00 0.00 41.96 39.11 2aab s TYR 90 CO 0.14 -0.13 0.14 0.71 -1.57 0.00 0.00 175.55 174.83 2aab s TYR 91 N 1.32 3.41 -0.16 2.71 2.02 0.47 -2.58 117.35 124.54 2aab s TYR 91 Ca 0.06 0.26 -0.05 0.00 -0.37 0.00 0.00 57.07 56.97 2aab s TYR 91 Cb -0.15 -1.77 -0.03 0.00 -0.40 0.00 0.00 41.96 39.61 2aab s TYR 91 CO 0.05 0.59 0.01 0.00 -1.57 0.00 0.00 175.55 174.64 2aab s ALA 93 N 0.19 -0.34 0.12 0.00 0.00 -0.06 -1.98 121.76 119.68 2aab s ALA 93 Ca 0.01 0.75 -0.28 0.00 0.00 0.00 0.00 51.96 52.45 2aab s ALA 93 Cb -0.13 -0.49 -0.06 0.00 0.00 0.00 0.00 23.12 22.43 2aab s ALA 93 CO 0.02 -0.16 0.89 0.50 0.00 0.00 0.00 175.76 177.00 2aab s ARG 94 N 1.16 4.65 0.74 0.00 3.52 -0.89 0.64 118.95 128.77 2aab s ARG 94 Ca -0.09 1.32 -0.06 0.00 -0.13 0.00 0.00 55.73 56.78 2aab s ARG 94 Cb -0.11 -3.35 0.11 0.00 -1.56 0.00 0.00 34.95 30.04 2aab s ARG 94 CO -0.06 0.31 1.04 0.45 -0.81 0.00 0.00 175.30 176.23 2aab s SER 95 N -0.31 4.39 -0.11 -2.12 0.15 -0.57 0.16 113.70 115.30 2aab s SER 95 Ca 0.43 0.10 -0.30 0.00 0.70 0.00 0.00 55.95 56.87 2aab s SER 95 Cb -0.23 -0.57 0.11 0.00 -1.71 0.00 0.00 66.02 63.62 2aab s SER 95 CO 0.28 -1.85 0.91 0.21 1.20 0.00 0.00 173.24 173.98 2aab s ASN 96 N -4.65 -0.43 -0.17 5.45 3.84 -0.56 -4.56 114.94 113.87 2aab s ASN 96 Ca 0.64 0.39 -0.02 0.00 0.21 0.00 0.00 52.86 54.09 2aab s ASN 96 Cb -0.08 0.37 -0.01 0.00 -0.55 0.00 0.00 41.25 40.98 2aab s ASN 96 CO 0.45 -0.45 -0.08 -0.31 -2.79 0.00 0.00 177.10 173.92 2aab s TYR 97 N -1.51 2.92 -0.22 0.43 4.12 -1.26 -1.53 117.35 120.30 2aab s TYR 97 Ca -0.02 -0.68 -0.09 0.00 0.02 0.00 0.00 57.07 56.29 2aab s TYR 97 Cb -0.00 -1.97 -0.19 0.00 -1.52 0.00 0.00 41.96 38.28 2aab s TYR 97 CO 0.01 -0.30 -0.02 1.55 0.02 0.00 0.00 175.55 176.82 2aab n VAL 98 N 4.01 1.58 -0.12 0.71 3.14 -1.22 -4.68 118.33 121.75 2aab n VAL 98 Ca -0.18 -0.43 -0.23 0.00 -2.96 0.00 0.00 64.34 60.55 2aab n VAL 98 Cb 0.52 -1.75 -0.10 0.00 -1.06 0.00 0.00 33.84 31.45 2aab n VAL 98 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2aab n GLY 99 N 1.75 -0.37 0.00 7.55 0.00 -1.26 -5.11 105.19 107.76 2aab n GLY 99 Ca -0.42 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.47 2aab n GLY 99 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 2aab n TYR 100 N -3.76 0.00 0.00 1.61 0.18 -1.26 -5.08 117.16 108.85 2aab n TYR 100 Ca -0.46 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.32 2aab n TYR 100 Cb 0.88 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.84 2aab n TYR 100 CO 0.00 0.00 0.00 -2.39 -2.08 0.00 0.00 176.86 172.39 2aab n HIS 100 N 0.00 0.00 -0.46 -3.48 1.44 -1.26 -3.63 115.22 107.83 2aab n HIS 100 Ca 0.00 0.00 0.42 0.00 -2.01 0.00 0.00 57.72 56.13 2aab n HIS 100 Cb 0.00 -0.35 0.76 0.00 0.12 0.00 0.00 29.99 30.52 2aab n HIS 100 CO 0.00 0.00 0.00 -0.24 -2.81 0.00 0.00 176.34 173.29 2aab h VAL 100 N 0.00 0.20 -0.96 0.61 3.04 -1.99 -2.67 116.25 114.48 2aab h VAL 100 Ca 0.00 0.00 -0.73 0.00 -1.01 0.00 0.00 66.70 64.96 2aab h VAL 100 Cb 0.00 0.21 -0.10 0.00 -2.01 0.00 0.00 31.29 29.39 2aab h VAL 100 CO 0.00 0.00 2.65 -1.14 -1.01 0.00 0.00 177.57 178.07 2aab n ARG 100 N -3.96 4.44 -2.85 4.17 0.63 -1.24 -4.96 116.66 112.89 2aab n ARG 100 Ca 0.33 -3.24 -0.19 0.00 -0.92 0.00 0.00 57.85 53.83 2aab n ARG 100 Cb 1.58 -2.66 0.02 0.00 0.45 0.00 0.00 32.46 31.85 2aab n ARG 100 CO 0.00 0.00 0.00 1.67 -2.51 0.00 0.00 177.63 176.79 2aab s TRP 100 N -0.60 2.82 -0.08 -0.14 1.48 -1.01 -3.43 118.94 117.98 2aab s TRP 100 Ca 0.57 -0.24 -0.31 0.00 -1.06 0.00 0.00 56.10 55.06 2aab s TRP 100 Cb 0.19 -2.54 0.09 0.00 -1.16 0.00 0.00 33.47 30.04 2aab s TRP 100 CO -0.09 -0.62 0.77 1.52 -4.06 0.00 0.00 176.95 174.47 2aab s TYR 100 N -2.53 -0.58 -0.30 1.66 -0.85 -0.58 -4.92 117.35 109.25 2aab s TYR 100 Ca 0.56 0.99 -0.29 0.00 -0.52 0.00 0.00 57.07 57.81 2aab s TYR 100 Cb -0.10 0.42 -0.02 0.00 0.38 0.00 0.00 41.96 42.64 2aab s TYR 100 CO 0.35 -0.54 1.74 -0.06 -1.52 0.00 0.00 175.55 175.53 2aab s PHE 100 N -1.19 1.89 -0.13 -3.49 0.40 -1.26 -1.49 117.98 112.71 2aab s PHE 100 Ca -0.08 0.58 -0.14 0.00 -0.60 0.00 0.00 56.93 56.69 2aab s PHE 100 Cb -0.00 -4.11 -0.12 0.00 0.51 0.00 0.00 43.02 39.30 2aab s PHE 100 CO 0.08 -2.96 0.29 0.22 0.70 0.00 0.00 175.22 173.54 2aab h ASP 101 N 12.22 0.00 -4.32 1.36 1.82 -0.52 -3.49 116.42 123.49 2aab h ASP 101 Ca -0.34 -0.43 -0.49 0.00 -0.39 0.00 0.00 57.03 55.38 2aab h ASP 101 Cb 1.16 0.00 -0.22 0.00 0.68 0.00 0.00 39.33 40.95 2aab h ASP 101 CO 1.02 0.84 -0.81 -0.69 -1.61 0.00 0.00 179.24 177.99 2aab s VAL 102 N -1.98 1.41 -0.01 2.25 1.01 -1.23 -4.97 120.40 116.87 2aab s VAL 102 Ca -0.12 -1.35 0.05 0.00 0.00 0.00 0.00 61.98 60.55 2aab s VAL 102 Cb -0.00 -1.30 -0.01 0.00 0.00 0.00 0.00 36.38 35.07 2aab s VAL 102 CO 0.35 -0.09 -0.15 0.26 0.00 0.00 0.00 175.10 175.47 2aab s TRP 103 N -1.13 1.40 0.91 5.22 0.52 -1.26 -2.10 118.94 122.49 2aab s TRP 103 Ca 0.03 -0.27 -0.11 0.00 0.02 0.00 0.00 56.10 55.76 2aab s TRP 103 Cb -0.10 -0.90 0.20 0.00 -1.15 0.00 0.00 33.47 31.52 2aab s TRP 103 CO 0.03 -0.03 1.24 0.41 0.02 0.00 0.00 176.95 178.61 2aab n GLY 104 N 2.74 -0.76 0.02 0.98 0.00 -0.84 -4.67 105.19 102.66 2aab n GLY 104 Ca -0.15 -1.82 0.14 0.00 0.00 0.00 0.00 46.02 44.19 2aab n GLY 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2aab n ALA 105 N -3.54 2.34 -0.74 4.61 0.00 -1.25 -4.77 120.51 117.17 2aab n ALA 105 Ca -0.20 -0.09 0.09 0.00 0.00 0.00 0.00 53.44 53.24 2aab n ALA 105 Cb 0.59 -1.46 -0.05 0.00 0.00 0.00 0.00 19.45 18.53 2aab n ALA 105 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2aab n GLY 106 N 1.46 -3.03 3.13 0.00 0.00 -1.26 -5.01 105.19 100.48 2aab n GLY 106 Ca 0.07 -1.24 -0.22 0.00 0.00 0.00 0.00 46.02 44.63 2aab n GLY 106 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2aab s THR 107 N -3.70 1.13 0.47 2.61 -4.23 -1.07 -4.87 115.64 105.99 2aab s THR 107 Ca 0.00 -0.76 -0.19 0.00 -1.18 0.00 0.00 61.69 59.56 2aab s THR 107 Cb 0.00 -0.97 -0.09 0.00 1.34 0.00 0.00 72.50 72.77 2aab s THR 107 CO 0.00 0.21 0.98 -0.89 -0.54 0.00 0.00 174.62 174.38 2aab s THR 108 N -0.52 4.32 -0.11 3.99 2.01 -1.26 -1.51 115.64 122.55 2aab s THR 108 Ca 0.04 1.33 -0.04 0.00 0.31 0.00 0.00 61.69 63.34 2aab s THR 108 Cb -0.06 -3.60 0.05 0.00 0.01 0.00 0.00 72.50 68.90 2aab s THR 108 CO 0.00 -0.42 0.11 -0.69 -0.69 0.00 0.00 174.62 172.93 2aab s VAL 109 N -2.29 -0.15 -0.19 3.82 1.01 -0.89 -0.60 120.40 121.11 2aab s VAL 109 Ca 0.62 0.15 -0.01 0.00 0.00 0.00 0.00 61.98 62.74 2aab s VAL 109 Cb -0.11 -0.38 0.00 0.00 0.00 0.00 0.00 36.38 35.89 2aab s VAL 109 CO 0.20 -0.03 -0.12 -0.89 0.00 0.00 0.00 175.10 174.27 2aab s THR 110 N 2.20 2.84 -0.39 3.92 2.01 -0.45 -2.10 115.64 123.67 2aab s THR 110 Ca 0.04 -0.69 -0.14 0.00 0.31 0.00 0.00 61.69 61.21 2aab s THR 110 Cb -0.14 -2.25 0.01 0.00 0.01 0.00 0.00 72.50 70.14 2aab s THR 110 CO -0.07 0.48 0.28 -0.69 -0.69 0.00 0.00 174.62 173.94 2aab s VAL 111 N 1.20 5.26 0.12 3.82 1.01 -1.26 -1.15 120.40 129.41 2aab s VAL 111 Ca 0.02 -0.55 -0.17 0.00 0.00 0.00 0.00 61.98 61.29 2aab s VAL 111 Cb -0.14 -3.87 0.04 0.00 0.00 0.00 0.00 36.38 32.40 2aab s VAL 111 CO -0.05 -0.23 0.41 -0.55 0.00 0.00 0.00 175.10 174.68 2aab s SER 112 N 1.69 -0.26 0.00 3.32 0.15 0.71 -4.50 113.70 114.81 2aab s SER 112 Ca 0.05 -0.29 0.19 0.00 0.70 0.00 0.00 55.95 56.61 2aab s SER 112 Cb -0.19 0.48 0.11 0.00 -1.71 0.00 0.00 66.02 64.71 2aab s SER 112 CO 0.10 -0.85 1.07 -1.54 1.20 0.00 0.00 173.24 173.22 2aab n SER 113 N -0.21 2.39 -4.77 5.45 3.41 -1.26 -3.69 113.62 114.95 2aab n SER 113 Ca -0.16 -1.70 -0.36 0.00 -0.26 0.00 0.00 58.87 56.39 2aab n SER 113 Cb 0.64 0.14 0.01 0.00 -0.26 0.00 0.00 64.21 64.74 2aab n SER 113 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2aab s ALA 114 N -1.79 2.78 -0.01 7.33 0.00 -1.26 -5.04 121.76 123.76 2aab s ALA 114 Ca 0.21 0.96 0.00 0.00 0.00 0.00 0.00 51.96 53.13 2aab s ALA 114 Cb 0.16 -3.41 -0.04 0.00 0.00 0.00 0.00 23.12 19.83 2aab s ALA 114 CO 0.31 -0.88 0.04 -1.59 0.00 0.00 0.00 175.76 173.65 2aab s LYS 115 N -3.04 2.94 -0.02 0.00 0.00 -1.26 -5.03 119.74 113.33 2aab s LYS 115 Ca 0.70 -0.53 -0.40 0.00 0.00 0.00 0.00 55.97 55.74 2aab s LYS 115 Cb -0.29 -2.77 -0.20 0.00 0.00 0.00 0.00 37.83 34.57 2aab s LYS 115 CO 0.33 0.65 1.09 2.41 0.00 0.00 0.00 175.35 179.82 2aab n THR 116 N 1.39 0.00 -3.62 3.79 -1.04 -1.26 -4.76 114.28 108.78 2aab n THR 116 Ca -0.14 0.00 -0.16 0.00 -2.04 0.00 0.00 64.05 61.71 2aab n THR 116 Cb 0.53 -0.02 -0.14 0.00 -1.82 0.00 0.00 70.33 68.88 2aab n THR 116 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2aab s THR 117 N 0.10 -0.33 0.73 12.58 2.01 0.29 -4.94 115.64 126.09 2aab s THR 117 Ca 0.91 0.21 -0.14 0.00 0.31 0.00 0.00 61.69 62.98 2aab s THR 117 Cb -1.27 -0.44 0.04 0.00 0.01 0.00 0.00 72.50 70.83 2aab s THR 117 CO 0.58 0.05 1.18 -2.16 -0.69 0.00 0.00 174.62 173.57 2aab s PRO 118 N 2.35 2.16 0.65 4.92 0.04 -1.26 -1.64 135.00 142.22 2aab s PRO 118 Ca 0.03 1.66 -0.09 0.00 0.04 0.00 0.00 61.00 62.64 2aab s PRO 118 Cb -0.13 -1.85 0.01 0.00 0.04 0.00 0.00 34.50 32.58 2aab s PRO 118 CO -0.08 -1.80 1.01 -1.25 0.04 0.00 0.00 177.00 174.92 2aab s PRO 119 N -4.04 2.89 -0.18 0.56 0.04 -1.26 -4.52 135.00 128.49 2aab s PRO 119 Ca 0.72 0.26 -0.06 0.00 0.04 0.00 0.00 61.00 61.95 2aab s PRO 119 Cb -0.27 -2.13 -0.04 0.00 0.04 0.00 0.00 34.50 32.10 2aab s PRO 119 CO 0.46 -0.88 0.04 -1.12 0.04 0.00 0.00 177.00 175.53 2aab s SER 120 N -4.33 5.35 -0.31 6.66 0.01 -0.10 -4.89 113.70 116.09 2aab s SER 120 Ca 0.56 -0.01 -0.07 0.00 1.31 0.00 0.00 55.95 57.74 2aab s SER 120 Cb -0.11 -1.91 0.01 0.00 0.21 0.00 0.00 66.02 64.23 2aab s SER 120 CO 0.49 0.15 0.10 -0.69 0.41 0.00 0.00 173.24 173.70 2aab s VAL 121 N 0.49 4.05 -0.14 3.43 1.01 -1.26 -0.10 120.40 127.88 2aab s VAL 121 Ca 0.01 -0.75 -0.02 0.00 0.00 0.00 0.00 61.98 61.22 2aab s VAL 121 Cb -0.13 -3.13 -0.03 0.00 0.00 0.00 0.00 36.38 33.09 2aab s VAL 121 CO 0.01 0.01 -0.06 -0.31 0.00 0.00 0.00 175.10 174.76 2aab s TYR 122 N 1.50 2.98 0.25 5.22 4.12 -0.15 -4.96 117.35 126.31 2aab s TYR 122 Ca 0.02 -0.32 -0.30 0.00 0.02 0.00 0.00 57.07 56.50 2aab s TYR 122 Cb -0.18 -1.90 -0.09 0.00 -1.52 0.00 0.00 41.96 38.27 2aab s TYR 122 CO 0.03 -0.01 1.21 -1.25 0.02 0.00 0.00 175.55 175.55 2aab s PRO 123 N 0.19 4.49 -0.39 -1.71 0.04 -1.26 -1.51 135.00 134.86 2aab s PRO 123 Ca -0.03 1.96 -0.03 0.00 0.04 0.00 0.00 61.00 62.94 2aab s PRO 123 Cb -0.14 -3.17 0.10 0.00 0.04 0.00 0.00 34.50 31.32 2aab s PRO 123 CO 0.03 -0.04 0.17 -0.51 0.04 0.00 0.00 177.00 176.70 2aab s LEU 124 N -0.99 5.02 0.01 -3.56 1.43 0.68 -4.91 118.68 116.36 2aab s LEU 124 Ca 0.50 -1.86 0.08 0.00 -1.03 0.00 0.00 54.13 51.82 2aab s LEU 124 Cb -0.35 -1.82 -0.02 0.00 0.03 0.00 0.00 46.19 44.03 2aab s LEU 124 CO 0.42 -0.50 -0.24 0.00 0.23 0.00 0.00 176.35 176.27 2aab s ALA 125 N 1.18 2.03 1.04 4.21 0.00 -1.26 -2.06 121.76 126.90 2aab s ALA 125 Ca 0.06 -1.11 -0.10 0.00 0.00 0.00 0.00 51.96 50.81 2aab s ALA 125 Cb -0.22 -0.47 0.14 0.00 0.00 0.00 0.00 23.12 22.57 2aab s ALA 125 CO -0.03 0.48 0.72 -0.35 0.00 0.00 0.00 175.76 176.58 2aab n PRO 126 N 2.15 -1.14 -3.61 0.00 -0.04 -1.26 -4.93 135.00 126.17 2aab n PRO 126 Ca -0.16 -1.12 -0.19 0.00 -0.04 0.00 0.00 63.50 61.99 2aab n PRO 126 Cb 0.52 -0.82 -0.01 0.00 -0.04 0.00 0.00 33.50 33.16 2aab n PRO 126 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2aab s GLY 127 N -4.36 1.50 0.00 0.55 0.00 -1.26 -4.45 107.32 99.30 2aab s GLY 127 Ca 0.42 -1.40 0.00 0.00 0.00 0.00 0.00 44.72 43.74 2aab s GLY 127 CO 0.30 -1.34 0.54 -1.26 0.00 0.00 0.00 173.10 171.33 2aab n SER 128 N -1.58 0.00 -0.08 1.64 2.88 -1.26 -3.17 113.62 112.05 2aab n SER 128 Ca -0.02 0.54 -0.15 0.00 -1.33 0.00 0.00 58.87 57.90 2aab n SER 128 Cb 0.58 -0.04 -0.04 0.00 -0.75 0.00 0.00 64.21 63.96 2aab n SER 128 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2aab h ALA 129 N -1.93 0.46 0.00 -1.46 0.00 -1.99 -3.29 119.26 111.04 2aab h ALA 129 Ca 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 54.39 2aab h ALA 129 Cb 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.71 2aab h ALA 129 CO 0.00 0.68 0.00 0.00 0.00 0.00 0.00 179.25 179.93 2aab n ALA 130 N -2.57 1.84 -0.06 0.00 0.00 -1.19 -3.46 120.51 115.07 2aab n ALA 130 Ca -0.04 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.33 2aab n ALA 130 Cb 0.63 -1.71 -0.02 0.00 0.00 0.00 0.00 19.45 18.35 2aab n ALA 130 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 2aab n GLN 131 N 1.76 0.37 -0.96 0.00 7.27 -1.21 -4.18 117.38 120.43 2aab n GLN 131 Ca 0.00 0.15 0.09 0.00 0.07 0.00 0.00 57.00 57.30 2aab n GLN 131 Cb 0.08 -1.14 -0.04 0.00 2.41 0.00 0.00 30.24 31.54 2aab n GLN 131 CO 0.00 0.00 0.00 -2.37 0.07 0.00 0.00 177.06 174.76 2aab n THR 132 N -4.03 -0.20 -0.87 1.69 5.66 -1.22 -4.98 114.28 110.32 2aab n THR 132 Ca -0.10 0.34 0.11 0.00 -3.05 0.00 0.00 64.05 61.35 2aab n THR 132 Cb 0.37 -0.57 -0.04 0.00 -1.55 0.00 0.00 70.33 68.54 2aab n THR 132 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 175.07 168.82 2aab n ASN 133 N -3.95 -5.21 0.07 1.09 4.05 -1.26 -4.62 115.26 105.44 2aab n ASN 133 Ca -0.03 0.51 0.11 0.00 0.45 0.00 0.00 54.58 55.62 2aab n ASN 133 Cb 0.48 -2.74 -0.00 0.00 1.23 0.00 0.00 39.78 38.74 2aab n ASN 133 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 177.26 172.67 2aab n SER 134 N -3.33 0.67 -4.66 1.20 3.41 -1.26 -4.81 113.62 104.83 2aab n SER 134 Ca -0.01 0.16 -0.33 0.00 -0.26 0.00 0.00 58.87 58.43 2aab n SER 134 Cb 0.40 0.71 -0.10 0.00 -0.26 0.00 0.00 64.21 64.96 2aab n SER 134 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 2aab s MET 135 N -3.34 2.81 -0.01 4.33 -1.94 -1.26 0.45 119.30 120.34 2aab s MET 135 Ca -0.00 -0.55 0.05 0.00 -1.71 0.00 0.00 55.69 53.48 2aab s MET 135 Cb 0.11 -2.68 -0.01 0.00 2.01 0.00 0.00 34.83 34.26 2aab s MET 135 CO 0.80 0.65 -0.18 0.54 -0.01 0.00 0.00 175.02 176.83 2aab s VAL 136 N -0.98 1.40 -0.15 -6.03 0.11 0.24 -4.74 120.40 110.26 2aab s VAL 136 Ca 0.16 -0.76 -0.03 0.00 -2.93 0.00 0.00 61.98 58.42 2aab s VAL 136 Cb -0.11 -1.17 -0.03 0.00 -1.53 0.00 0.00 36.38 33.54 2aab s VAL 136 CO 0.06 0.40 -0.03 -0.89 -3.33 0.00 0.00 175.10 171.31 2aab s THR 137 N -0.42 3.93 0.34 5.04 2.01 -1.26 -0.90 115.64 124.39 2aab s THR 137 Ca 0.07 -0.35 0.04 0.00 0.31 0.00 0.00 61.69 61.76 2aab s THR 137 Cb -0.07 -2.71 -0.06 0.00 0.01 0.00 0.00 72.50 69.67 2aab s THR 137 CO -0.01 0.51 0.06 -0.76 -0.69 0.00 0.00 174.62 173.73 2aab s LEU 138 N 0.21 2.20 0.19 4.42 1.43 -0.58 -4.67 118.68 121.88 2aab s LEU 138 Ca -0.02 -1.41 -0.22 0.00 -1.03 0.00 0.00 54.13 51.45 2aab s LEU 138 Cb -0.14 -0.39 0.07 0.00 0.03 0.00 0.00 46.19 45.77 2aab s LEU 138 CO 0.03 -0.64 1.02 -0.83 0.23 0.00 0.00 176.35 176.16 2aab s GLY 139 N -3.52 0.10 -0.00 -3.19 0.00 -0.88 -0.73 107.32 99.10 2aab s GLY 139 Ca 0.35 -0.31 0.02 0.00 0.00 0.00 0.00 44.72 44.77 2aab s GLY 139 CO 0.15 2.00 -0.06 0.00 0.00 0.00 0.00 173.10 175.19 2aab s LEU 141 N -0.23 4.07 -0.48 0.00 2.96 -0.57 -0.65 118.68 123.78 2aab s LEU 141 Ca 0.02 -1.02 -0.15 0.00 -0.22 0.00 0.00 54.13 52.76 2aab s LEU 141 Cb -0.03 -1.84 0.08 0.00 0.50 0.00 0.00 46.19 44.90 2aab s LEU 141 CO -0.00 -0.27 0.40 -0.69 -1.32 0.00 0.00 176.35 174.47 2aab s VAL 142 N 1.41 5.13 0.08 1.68 1.01 0.23 -0.97 120.40 128.97 2aab s VAL 142 Ca -0.01 -1.18 0.09 0.00 0.00 0.00 0.00 61.98 60.88 2aab s VAL 142 Cb -0.19 -4.12 -0.04 0.00 0.00 0.00 0.00 36.38 32.04 2aab s VAL 142 CO 0.02 -0.63 -0.22 -0.75 0.00 0.00 0.00 175.10 173.52 2aab s LYS 143 N 1.61 1.80 -1.21 2.72 2.20 0.86 -0.92 119.74 126.80 2aab s LYS 143 Ca 0.04 -1.14 -0.03 0.00 -0.36 0.00 0.00 55.97 54.48 2aab s LYS 143 Cb -0.25 -2.07 -0.01 0.00 -1.51 0.00 0.00 37.83 33.99 2aab s LYS 143 CO 0.05 0.50 0.84 0.41 -0.36 0.00 0.00 175.35 176.79 2aab n GLY 144 N 1.26 -0.54 3.70 5.54 0.00 -0.73 -0.92 105.19 113.49 2aab n GLY 144 Ca -0.17 0.24 -0.24 0.00 0.00 0.00 0.00 46.02 45.85 2aab n GLY 144 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2aab s TYR 145 N -3.51 2.62 -0.28 1.61 1.13 -0.43 -4.60 117.35 113.89 2aab s TYR 145 Ca 0.13 -0.47 -0.21 0.00 -1.41 0.00 0.00 57.07 55.11 2aab s TYR 145 Cb -0.03 -1.70 0.12 0.00 -1.10 0.00 0.00 41.96 39.26 2aab s TYR 145 CO 0.78 0.33 0.97 0.12 -2.51 0.00 0.00 175.55 175.24 2aab s PHE 146 N -2.52 -0.58 0.40 -3.49 5.36 -0.65 0.37 117.98 116.87 2aab s PHE 146 Ca 0.38 1.28 0.04 0.00 -0.96 0.00 0.00 56.93 57.66 2aab s PHE 146 Cb 0.01 0.38 0.07 0.00 -0.34 0.00 0.00 43.02 43.13 2aab s PHE 146 CO 0.21 -0.28 0.55 -0.35 -1.46 0.00 0.00 175.22 173.89 2aab n PRO 147 N 2.98 0.54 -1.76 10.12 -0.04 -1.26 0.10 135.00 145.68 2aab n PRO 147 Ca -0.15 -1.88 -0.32 0.00 -0.04 0.00 0.00 63.50 61.10 2aab n PRO 147 Cb 0.57 -0.24 0.04 0.00 -0.04 0.00 0.00 33.50 33.82 2aab n PRO 147 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 2aab s GLU 148 N -3.81 2.91 0.61 0.54 2.56 -1.26 -4.79 118.70 115.46 2aab s GLU 148 Ca 0.40 1.26 0.07 0.00 0.00 0.00 0.00 54.97 56.70 2aab s GLU 148 Cb -0.03 -1.97 0.11 0.00 2.00 0.00 0.00 34.13 34.24 2aab s GLU 148 CO 0.25 -1.15 0.85 -0.35 -0.56 0.00 0.00 175.26 174.30 2aab n PRO 149 N -2.52 0.44 -3.79 4.30 -0.04 -1.26 -5.00 135.00 127.14 2aab n PRO 149 Ca 0.09 -3.04 -0.13 0.00 -0.04 0.00 0.00 63.50 60.39 2aab n PRO 149 Cb 0.53 -0.34 -0.12 0.00 -0.04 0.00 0.00 33.50 33.53 2aab n PRO 149 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2aab s VAL 150 N -2.71 -0.00 0.18 0.52 1.01 -1.26 -4.56 120.40 113.57 2aab s VAL 150 Ca 0.62 0.00 0.08 0.00 0.00 0.00 0.00 61.98 62.69 2aab s VAL 150 Cb -0.05 -0.32 -0.04 0.00 0.00 0.00 0.00 36.38 35.97 2aab s VAL 150 CO 0.40 0.00 -0.07 0.42 0.00 0.00 0.00 175.10 175.85 2aab s THR 151 N 0.15 3.35 -0.02 3.92 -4.23 -0.38 -4.95 115.64 113.48 2aab s THR 151 Ca -0.00 -1.59 -0.01 0.00 -1.18 0.00 0.00 61.69 58.91 2aab s THR 151 Cb -0.02 -2.67 0.02 0.00 1.34 0.00 0.00 72.50 71.17 2aab s THR 151 CO 0.00 -0.11 0.04 -0.69 -0.54 0.00 0.00 174.62 173.32 2aab s VAL 152 N -1.72 -0.03 0.10 2.29 1.01 -1.26 -1.39 120.40 119.41 2aab s VAL 152 Ca 0.26 0.12 0.01 0.00 0.00 0.00 0.00 61.98 62.37 2aab s VAL 152 Cb -0.09 -0.08 -0.04 0.00 0.00 0.00 0.00 36.38 36.17 2aab s VAL 152 CO 0.16 0.05 -0.02 0.42 0.00 0.00 0.00 175.10 175.71 2aab s THR 153 N 0.65 0.46 -0.18 3.92 -4.23 -0.43 -4.97 115.64 110.86 2aab s THR 153 Ca -0.05 -1.90 -0.01 0.00 -1.18 0.00 0.00 61.69 58.54 2aab s THR 153 Cb -0.08 -1.78 -0.00 0.00 1.34 0.00 0.00 72.50 71.98 2aab s THR 153 CO -0.02 -0.77 -0.11 0.26 -0.54 0.00 0.00 174.62 173.44 2aab s TRP 154 N -3.78 2.86 -1.41 3.99 0.52 -1.26 0.04 118.94 119.90 2aab s TRP 154 Ca 0.15 -1.04 -0.07 0.00 0.02 0.00 0.00 56.10 55.16 2aab s TRP 154 Cb 0.07 -1.98 0.04 0.00 -1.15 0.00 0.00 33.47 30.45 2aab s TRP 154 CO -0.04 -0.52 0.86 0.09 0.02 0.00 0.00 176.95 177.36 2aab n ASN 155 N 4.37 -3.07 -1.73 2.95 4.13 0.90 -0.74 115.26 122.08 2aab n ASN 155 Ca -0.19 -0.78 -0.14 0.00 1.68 0.00 0.00 54.58 55.15 2aab n ASN 155 Cb 0.51 -4.05 -0.04 0.00 -1.54 0.00 0.00 39.78 34.66 2aab n ASN 155 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 2aab n SER 156 N -2.96 -3.94 0.00 6.41 7.64 -1.26 -1.80 113.62 117.71 2aab n SER 156 Ca -0.13 0.29 0.00 0.00 1.01 0.00 0.00 58.87 60.04 2aab n SER 156 Cb 0.60 -3.54 0.00 0.00 -1.01 0.00 0.00 64.21 60.27 2aab n SER 156 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2aab n GLY 157 N -0.45 1.77 0.33 0.23 0.00 0.08 -4.95 105.19 102.20 2aab n GLY 157 Ca -0.15 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.03 2aab n GLY 157 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2aab h SER 158 N 0.00 0.00 -3.43 1.61 0.02 -1.29 -3.29 113.55 107.17 2aab h SER 158 Ca 0.00 0.00 -0.71 0.00 -0.84 0.00 0.00 61.79 60.24 2aab h SER 158 Cb 0.00 0.00 -0.31 0.00 0.14 0.00 0.00 62.40 62.23 2aab h SER 158 CO 0.00 0.00 -0.48 -0.76 -1.14 0.00 0.00 176.83 174.45 2aab s LEU 159 N -8.51 5.30 -0.08 5.07 2.01 -1.16 -4.87 118.68 116.43 2aab s LEU 159 Ca -0.05 -1.80 0.03 0.00 0.01 0.00 0.00 54.13 52.32 2aab s LEU 159 Cb 0.18 -1.93 -0.07 0.00 0.01 0.00 0.00 46.19 44.38 2aab s LEU 159 CO 0.66 -0.58 -0.04 -1.20 1.01 0.00 0.00 176.35 176.20 2aab n SER 160 N 4.80 3.30 -4.78 2.29 7.64 -1.24 -4.32 113.62 121.31 2aab n SER 160 Ca -0.07 -0.03 -0.37 0.00 1.01 0.00 0.00 58.87 59.41 2aab n SER 160 Cb 0.42 0.16 -0.05 0.00 -1.01 0.00 0.00 64.21 63.72 2aab n SER 160 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2aab s SER 161 N -4.49 7.09 -0.78 6.43 0.01 -1.26 -3.57 113.70 117.12 2aab s SER 161 Ca -0.09 1.93 0.00 0.00 1.31 0.00 0.00 55.95 59.10 2aab s SER 161 Cb 0.03 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.68 2aab s SER 161 CO 0.23 -0.25 0.00 0.61 0.41 0.00 0.00 173.24 174.24 2aab n GLY 162 N 0.42 0.79 3.77 3.44 0.00 -1.26 -4.74 105.19 107.61 2aab n GLY 162 Ca 0.03 -0.67 -0.30 0.00 0.00 0.00 0.00 46.02 45.09 2aab n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2aab s VAL 163 N -2.31 4.49 -0.22 1.61 1.01 -1.23 -1.01 120.40 122.74 2aab s VAL 163 Ca 0.00 -0.83 -0.04 0.00 0.00 0.00 0.00 61.98 61.11 2aab s VAL 163 Cb 0.00 -3.18 0.11 0.00 0.00 0.00 0.00 36.38 33.31 2aab s VAL 163 CO 0.00 0.09 0.32 -1.00 0.00 0.00 0.00 175.10 174.51 2aab s HIS 164 N -1.44 -0.61 -0.16 5.22 3.76 -0.13 -4.99 115.29 116.94 2aab s HIS 164 Ca 0.29 0.68 0.01 0.00 -0.15 0.00 0.00 55.06 55.89 2aab s HIS 164 Cb -0.12 -0.10 0.01 0.00 1.11 0.00 0.00 32.58 33.49 2aab s HIS 164 CO 0.22 -0.64 -0.19 0.95 -0.85 0.00 0.00 174.74 174.23 2aab s THR 165 N 2.47 2.25 0.39 1.30 -4.23 -1.26 0.00 115.64 116.56 2aab s THR 165 Ca 0.09 -0.90 -0.17 0.00 -1.18 0.00 0.00 61.69 59.54 2aab s THR 165 Cb -0.15 -1.93 -0.09 0.00 1.34 0.00 0.00 72.50 71.67 2aab s THR 165 CO -0.14 0.53 0.84 -0.36 -0.54 0.00 0.00 174.62 174.96 2aab s PHE 166 N 1.01 3.38 0.55 3.99 0.08 -0.25 -4.99 117.98 121.75 2aab s PHE 166 Ca -0.02 1.36 -0.21 0.00 0.12 0.00 0.00 56.93 58.18 2aab s PHE 166 Cb -0.15 -2.66 -0.05 0.00 -0.57 0.00 0.00 43.02 39.60 2aab s PHE 166 CO -0.05 -0.06 1.28 -1.25 -0.10 0.00 0.00 175.22 175.04 2aab s PRO 167 N -3.31 3.15 0.68 0.24 0.04 -1.26 -4.26 135.00 130.28 2aab s PRO 167 Ca 0.57 2.05 -0.15 0.00 0.04 0.00 0.00 61.00 63.51 2aab s PRO 167 Cb -0.10 -2.17 0.01 0.00 0.04 0.00 0.00 34.50 32.29 2aab s PRO 167 CO 0.20 -1.12 1.15 0.00 0.04 0.00 0.00 177.00 177.26 2aab s ALA 168 N -1.42 2.33 -0.06 8.56 0.00 -1.26 -4.80 121.76 125.12 2aab s ALA 168 Ca 0.73 0.69 0.04 0.00 0.00 0.00 0.00 51.96 53.42 2aab s ALA 168 Cb -0.36 -3.38 -0.00 0.00 0.00 0.00 0.00 23.12 19.38 2aab s ALA 168 CO 0.41 -1.50 -0.20 0.08 0.00 0.00 0.00 175.76 174.56 2aab s VAL 169 N -2.18 1.65 -1.06 0.00 1.01 0.30 -4.91 120.40 115.23 2aab s VAL 169 Ca 0.70 -0.82 -0.16 0.00 0.00 0.00 0.00 61.98 61.70 2aab s VAL 169 Cb -0.24 -1.42 0.16 0.00 0.00 0.00 0.00 36.38 34.87 2aab s VAL 169 CO 0.42 0.47 1.25 -0.22 0.00 0.00 0.00 175.10 177.02 2aab s LEU 170 N 0.11 5.17 -0.09 3.92 2.96 -1.26 -1.59 118.68 127.90 2aab s LEU 170 Ca -0.08 -2.56 -0.22 0.00 -0.22 0.00 0.00 54.13 51.06 2aab s LEU 170 Cb -0.14 -2.38 -0.04 0.00 0.50 0.00 0.00 46.19 44.13 2aab s LEU 170 CO 0.04 -0.87 0.63 0.00 -1.32 0.00 0.00 176.35 174.83 2aab s GLN 171 N 1.93 4.39 7.89 1.98 1.03 -0.84 -4.77 119.66 131.27 2aab s GLN 171 Ca 0.36 0.74 0.00 0.00 0.04 0.00 0.00 55.36 56.50 2aab s GLN 171 Cb -0.04 -3.45 0.00 0.00 0.03 0.00 0.00 33.01 29.54 2aab s GLN 171 CO -0.05 0.07 0.00 0.45 -2.54 0.00 0.00 175.29 173.22 2aab n SER 172 N 3.85 0.00 -0.25 12.60 2.88 -1.26 -2.06 113.62 129.39 2aab n SER 172 Ca -0.03 0.00 0.06 0.00 -1.33 0.00 0.00 58.87 57.57 2aab n SER 172 Cb 0.51 0.00 0.08 0.00 -0.75 0.00 0.00 64.21 64.05 2aab n SER 172 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 2aab n ASP 173 N 9.13 1.37 -4.38 -3.46 9.92 -1.26 -5.05 116.55 122.82 2aab n ASP 173 Ca 0.00 -2.63 -0.26 0.00 -0.53 0.00 0.00 54.79 51.37 2aab n ASP 173 Cb 0.00 -0.33 -0.12 0.00 -0.64 0.00 0.00 41.12 40.03 2aab n ASP 173 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 2aab s LEU 174 N -1.67 2.41 0.05 0.64 1.02 -0.87 -4.76 118.68 115.50 2aab s LEU 174 Ca 0.19 -0.84 -0.02 0.00 0.02 0.00 0.00 54.13 53.48 2aab s LEU 174 Cb 0.16 -1.06 -0.04 0.00 0.02 0.00 0.00 46.19 45.27 2aab s LEU 174 CO 0.02 0.08 0.24 -0.31 0.02 0.00 0.00 176.35 176.40 2aab s TYR 175 N -1.65 3.53 -0.00 0.29 1.51 0.16 -1.99 117.35 119.19 2aab s TYR 175 Ca 0.17 0.37 0.00 0.00 -1.01 0.00 0.00 57.07 56.60 2aab s TYR 175 Cb -0.08 -1.85 0.00 0.00 -0.11 0.00 0.00 41.96 39.93 2aab s TYR 175 CO 0.08 0.58 -0.00 0.99 -1.11 0.00 0.00 175.55 176.09 2aab s THR 176 N -1.46 0.04 0.20 -0.71 2.01 -0.62 -1.31 115.64 113.79 2aab s THR 176 Ca 0.33 -0.02 -0.10 0.00 0.31 0.00 0.00 61.69 62.21 2aab s THR 176 Cb -0.13 -0.05 -0.01 0.00 0.01 0.00 0.00 72.50 72.32 2aab s THR 176 CO 0.24 0.02 0.35 -0.22 -0.69 0.00 0.00 174.62 174.31 2aab s LEU 177 N 0.02 0.69 0.13 4.42 0.20 -0.09 -0.53 118.68 123.51 2aab s LEU 177 Ca -0.00 -0.94 -0.06 0.00 0.69 0.00 0.00 54.13 53.83 2aab s LEU 177 Cb -0.01 1.36 -0.02 0.00 -0.43 0.00 0.00 46.19 47.09 2aab s LEU 177 CO -0.00 -0.99 0.17 -0.94 -0.29 0.00 0.00 176.35 174.30 2aab s SER 178 N -3.01 0.18 -0.07 3.68 1.04 -1.26 -0.60 113.70 113.67 2aab s SER 178 Ca 0.21 -0.93 -0.07 0.00 0.48 0.00 0.00 55.95 55.65 2aab s SER 178 Cb 0.02 0.35 0.02 0.00 0.10 0.00 0.00 66.02 66.51 2aab s SER 178 CO 0.05 -0.78 0.20 -0.55 0.98 0.00 0.00 173.24 173.13 2aab s SER 179 N -2.96 -0.19 0.17 7.02 0.15 0.18 -1.08 113.70 116.99 2aab s SER 179 Ca 0.15 0.34 0.08 0.00 0.70 0.00 0.00 55.95 57.23 2aab s SER 179 Cb 0.05 0.39 -0.04 0.00 -1.71 0.00 0.00 66.02 64.71 2aab s SER 179 CO -0.03 -0.11 -0.18 -0.94 1.20 0.00 0.00 173.24 173.18 2aab s SER 180 N -0.06 2.69 -0.08 5.45 1.04 0.10 0.07 113.70 122.90 2aab s SER 180 Ca -0.02 -0.88 -0.04 0.00 0.48 0.00 0.00 55.95 55.50 2aab s SER 180 Cb -0.02 -0.16 0.04 0.00 0.10 0.00 0.00 66.02 65.98 2aab s SER 180 CO 0.00 -0.05 0.18 0.54 0.98 0.00 0.00 173.24 174.90 2aab s VAL 181 N -2.15 -0.06 -0.19 5.02 0.11 0.09 -0.96 120.40 122.27 2aab s VAL 181 Ca 0.17 0.18 -0.06 0.00 -2.93 0.00 0.00 61.98 59.34 2aab s VAL 181 Cb -0.05 -0.29 -0.03 0.00 -1.53 0.00 0.00 36.38 34.47 2aab s VAL 181 CO 0.07 0.07 0.02 -0.89 -3.33 0.00 0.00 175.10 171.04 2aab s THR 182 N 1.27 4.23 0.22 5.04 2.01 -0.18 -1.53 115.64 126.70 2aab s THR 182 Ca -0.09 -0.22 0.00 0.00 0.31 0.00 0.00 61.69 61.69 2aab s THR 182 Cb -0.11 -2.90 -0.05 0.00 0.01 0.00 0.00 72.50 69.45 2aab s THR 182 CO -0.07 0.45 0.09 0.68 -0.69 0.00 0.00 174.62 175.08 2aab s VAL 183 N 0.70 0.33 0.37 3.82 -7.23 -0.07 -4.77 120.40 113.54 2aab s VAL 183 Ca 0.01 -1.99 -0.27 0.00 -1.81 0.00 0.00 61.98 57.92 2aab s VAL 183 Cb -0.14 -2.48 -0.09 0.00 0.56 0.00 0.00 36.38 34.23 2aab s VAL 183 CO 0.02 -0.09 1.17 -2.84 -0.31 0.00 0.00 175.10 173.05 2aab s PRO 184 N -4.07 4.22 0.42 4.82 0.02 -1.26 0.81 135.00 139.97 2aab s PRO 184 Ca 0.36 1.88 0.11 0.00 0.02 0.00 0.00 61.00 63.36 2aab s PRO 184 Cb 0.07 -2.83 0.95 0.00 0.02 0.00 0.00 34.50 32.71 2aab s PRO 184 CO 0.11 -0.19 2.01 0.77 -0.33 0.00 0.00 177.00 179.37 2aab h SER 185 N 2.98 0.42 0.00 2.53 0.02 -0.29 0.12 113.55 119.34 2aab h SER 185 Ca -0.48 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.47 2aab h SER 185 Cb 1.23 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.68 2aab h SER 185 CO 0.64 0.28 0.00 -1.54 -1.14 0.00 0.00 176.83 175.07 2aab n SER 186 N -4.47 0.00 -0.03 3.07 3.41 -1.26 -3.48 113.62 110.86 2aab n SER 186 Ca 0.07 -0.69 -0.03 0.00 -0.26 0.00 0.00 58.87 57.96 2aab n SER 186 Cb 0.24 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.16 2aab n SER 186 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 2aab n THR 187 N -0.79 0.33 0.00 6.66 -1.04 0.03 -4.81 114.28 114.66 2aab n THR 187 Ca 0.07 -0.17 0.00 0.00 -2.04 0.00 0.00 64.05 61.91 2aab n THR 187 Cb 0.03 -0.80 0.00 0.00 -1.82 0.00 0.00 70.33 67.74 2aab n THR 187 CO 0.00 0.00 0.00 1.87 -0.64 0.00 0.00 175.07 176.30 2aab n TRP 188 N -2.39 0.00 -0.21 -1.42 -0.00 -1.21 -0.20 117.44 112.01 2aab n TRP 188 Ca -0.09 0.00 0.02 0.00 -0.00 0.00 0.00 57.50 57.43 2aab n TRP 188 Cb 0.63 0.00 0.06 0.00 -0.00 0.00 0.00 31.31 32.01 2aab n TRP 188 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 177.69 177.34 2aab n PRO 189 N -0.04 -0.07 -0.25 5.87 -0.04 -1.26 0.79 135.00 139.99 2aab n PRO 189 Ca 0.00 0.89 -0.04 0.00 -0.04 0.00 0.00 63.50 64.31 2aab n PRO 189 Cb 0.00 -1.32 0.07 0.00 -0.04 0.00 0.00 33.50 32.21 2aab n PRO 189 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2aab h SER 190 N 0.00 0.74 -2.22 3.54 4.64 -1.88 -3.43 113.55 114.95 2aab h SER 190 Ca 0.25 -0.01 -0.57 0.00 -0.47 0.00 0.00 61.79 61.00 2aab h SER 190 Cb 0.40 -0.17 -0.10 0.00 -0.31 0.00 0.00 62.40 62.22 2aab h SER 190 CO -0.58 0.52 -0.66 -1.61 -0.87 0.00 0.00 176.83 173.62 2aab s GLU 191 N -6.12 2.20 0.42 4.77 2.02 0.24 -5.10 118.70 117.13 2aab s GLU 191 Ca -0.13 -1.47 -0.21 0.00 0.02 0.00 0.00 54.97 53.18 2aab s GLU 191 Cb 0.15 -2.10 -0.11 0.00 0.10 0.00 0.00 34.13 32.17 2aab s GLU 191 CO 0.77 0.36 0.96 0.95 0.02 0.00 0.00 175.26 178.32 2aab s THR 192 N -2.34 4.33 -0.09 3.63 -4.23 -1.26 -4.43 115.64 111.24 2aab s THR 192 Ca 0.31 1.50 -0.02 0.00 -1.18 0.00 0.00 61.69 62.30 2aab s THR 192 Cb -0.06 -3.63 0.04 0.00 1.34 0.00 0.00 72.50 70.18 2aab s THR 192 CO 0.19 -0.27 0.02 -0.69 -0.54 0.00 0.00 174.62 173.34 2aab s VAL 193 N -2.11 0.28 0.00 2.29 1.01 -1.26 -5.01 120.40 115.60 2aab s VAL 193 Ca 0.61 0.04 0.05 0.00 0.00 0.00 0.00 61.98 62.69 2aab s VAL 193 Cb -0.10 -0.55 -0.02 0.00 0.00 0.00 0.00 36.38 35.71 2aab s VAL 193 CO 0.15 0.13 -0.16 -0.89 0.00 0.00 0.00 175.10 174.32 2aab s THR 194 N 2.00 1.29 -0.16 3.92 2.01 -1.26 -0.67 115.64 122.77 2aab s THR 194 Ca 0.04 -0.80 -0.05 0.00 0.31 0.00 0.00 61.69 61.18 2aab s THR 194 Cb -0.13 -1.09 -0.03 0.00 0.01 0.00 0.00 72.50 71.25 2aab s THR 194 CO -0.06 0.28 0.02 0.00 -0.69 0.00 0.00 174.62 174.17 2aab s ASN 196 N 0.22 5.30 -0.11 0.00 -0.87 0.11 -0.75 114.94 118.84 2aab s ASN 196 Ca 0.01 -0.17 0.01 0.00 -1.57 0.00 0.00 52.86 51.14 2aab s ASN 196 Cb -0.13 -1.96 -0.02 0.00 -0.02 0.00 0.00 41.25 39.12 2aab s ASN 196 CO 0.01 -0.04 -0.14 -0.69 -2.57 0.00 0.00 177.10 173.68 2aab s VAL 197 N 1.64 2.97 -0.08 1.60 1.01 0.25 -1.31 120.40 126.47 2aab s VAL 197 Ca 0.06 -0.71 0.03 0.00 0.00 0.00 0.00 61.98 61.37 2aab s VAL 197 Cb -0.15 -2.22 0.01 0.00 0.00 0.00 0.00 36.38 34.01 2aab s VAL 197 CO 0.05 0.54 -0.18 0.00 0.00 0.00 0.00 175.10 175.51 2aab s ALA 198 N 0.11 1.68 -0.44 5.51 0.00 -0.48 -1.00 121.76 127.14 2aab s ALA 198 Ca -0.07 -0.68 0.03 0.00 0.00 0.00 0.00 51.96 51.24 2aab s ALA 198 Cb -0.15 -0.67 0.15 0.00 0.00 0.00 0.00 23.12 22.45 2aab s ALA 198 CO 0.05 0.20 0.30 -1.58 0.00 0.00 0.00 175.76 174.73 2aab s HIS 199 N 0.49 1.55 0.27 0.00 2.46 0.64 -1.25 115.29 119.45 2aab s HIS 199 Ca -0.16 -2.30 -0.01 0.00 0.47 0.00 0.00 55.06 53.06 2aab s HIS 199 Cb -0.17 -1.41 0.55 0.00 -0.13 0.00 0.00 32.58 31.42 2aab s HIS 199 CO 0.06 -0.78 1.75 -1.35 -2.47 0.00 0.00 174.74 171.95 2aab h PRO 200 N 6.27 0.58 -0.61 2.88 0.11 -1.80 -1.38 132.00 138.04 2aab h PRO 200 Ca 0.12 -0.03 0.18 0.00 0.11 0.00 0.00 66.00 66.37 2aab h PRO 200 Cb 0.91 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 31.87 2aab h PRO 200 CO 0.42 0.38 0.53 0.00 -0.21 0.00 0.00 178.00 179.12 2aab h ALA 201 N 1.57 2.45 -0.16 -0.75 0.00 -1.90 0.37 119.26 120.85 2aab h ALA 201 Ca 0.47 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.36 2aab h ALA 201 Cb 0.70 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.53 2aab h ALA 201 CO -0.38 -0.84 0.00 -1.13 0.00 0.00 0.00 179.25 176.90 2aab n SER 202 N -3.99 2.42 -3.83 0.00 3.41 -0.88 -4.99 113.62 105.76 2aab n SER 202 Ca 0.12 -2.00 -0.26 0.00 -0.26 0.00 0.00 58.87 56.47 2aab n SER 202 Cb 0.76 -0.10 0.03 0.00 -0.26 0.00 0.00 64.21 64.64 2aab n SER 202 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2aab n SER 203 N -0.04 -3.15 -4.54 4.04 7.64 0.13 -4.96 113.62 112.74 2aab n SER 203 Ca 0.05 -0.80 -0.34 0.00 1.01 0.00 0.00 58.87 58.79 2aab n SER 203 Cb 0.33 -3.92 -0.11 0.00 -1.01 0.00 0.00 64.21 59.49 2aab n SER 203 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2aab s THR 204 N -3.48 4.12 -0.21 0.44 2.01 -0.59 -4.98 115.64 112.96 2aab s THR 204 Ca 0.37 -0.28 -0.02 0.00 0.31 0.00 0.00 61.69 62.07 2aab s THR 204 Cb -0.18 -2.82 0.06 0.00 0.01 0.00 0.00 72.50 69.57 2aab s THR 204 CO 0.83 0.49 0.04 -0.54 -0.69 0.00 0.00 174.62 174.74 2aab s LYS 205 N 0.33 0.72 -0.09 4.92 1.02 -1.26 -0.26 119.74 125.11 2aab s LYS 205 Ca -0.02 -0.52 0.04 0.00 0.02 0.00 0.00 55.97 55.49 2aab s LYS 205 Cb -0.14 -2.12 -0.01 0.00 -0.52 0.00 0.00 37.83 35.04 2aab s LYS 205 CO 0.02 -0.67 -0.21 0.08 -0.92 0.00 0.00 175.35 173.65 2aab s VAL 206 N 1.81 2.35 -0.48 3.17 1.01 -0.17 -4.99 120.40 123.10 2aab s VAL 206 Ca -0.00 -0.93 -0.05 0.00 0.00 0.00 0.00 61.98 61.00 2aab s VAL 206 Cb -0.17 -1.91 0.13 0.00 0.00 0.00 0.00 36.38 34.42 2aab s VAL 206 CO -0.10 0.56 0.30 -1.81 0.00 0.00 0.00 175.10 174.05 2aab s ASP 207 N 0.15 5.39 -0.44 3.32 1.01 -1.26 -0.58 116.67 124.26 2aab s ASP 207 Ca -0.11 -2.19 -0.19 0.00 0.71 0.00 0.00 52.55 50.77 2aab s ASP 207 Cb -0.16 -1.88 0.03 0.00 1.01 0.00 0.00 42.92 41.91 2aab s ASP 207 CO 0.06 -0.54 0.53 -0.75 0.21 0.00 0.00 175.17 174.68 2aab s LYS 208 N 0.92 3.16 0.10 8.23 2.47 0.07 -4.90 119.74 129.80 2aab s LYS 208 Ca 0.10 -0.64 -0.30 0.00 -1.56 0.00 0.00 55.97 53.56 2aab s LYS 208 Cb -0.23 -3.98 -0.06 0.00 -1.46 0.00 0.00 37.83 32.10 2aab s LYS 208 CO -0.03 -0.94 1.20 0.21 0.16 0.00 0.00 175.35 175.95 2aab s LYS 209 N 2.41 4.45 -0.57 4.03 2.20 -1.26 -1.36 119.74 129.64 2aab s LYS 209 Ca 0.16 1.81 -0.22 0.00 -0.36 0.00 0.00 55.97 57.36 2aab s LYS 209 Cb -0.16 -3.31 0.06 0.00 -1.51 0.00 0.00 37.83 32.90 2aab s LYS 209 CO 0.15 -0.21 0.85 0.42 -0.36 0.00 0.00 175.35 176.20 2aab s ILE 210 N 0.73 4.53 0.08 5.43 -1.09 0.16 -4.91 121.20 126.13 2aab s ILE 210 Ca 0.57 -0.22 0.01 0.00 -2.23 0.00 0.00 60.65 58.79 2aab s ILE 210 Cb -0.31 -4.52 -0.04 0.00 -1.58 0.00 0.00 42.46 36.02 2aab s ILE 210 CO 0.31 -1.14 0.19 0.54 -1.23 0.00 0.00 174.94 173.62 2aab s VAL 211 N 3.53 5.15 0.77 2.92 0.11 -1.26 -4.65 120.40 126.97 2aab s VAL 211 Ca 0.22 -0.55 -0.13 0.00 -2.93 0.00 0.00 61.98 58.59 2aab s VAL 211 Cb -0.17 -3.54 0.06 0.00 -1.53 0.00 0.00 36.38 31.21 2aab s VAL 211 CO 0.14 0.09 1.14 -2.84 -3.33 0.00 0.00 175.10 170.29 2aab s PRO 212 N -2.63 2.08 -0.09 1.54 0.02 -1.26 -4.83 135.00 129.83 2aab s PRO 212 Ca 0.33 1.46 -0.16 0.00 0.02 0.00 0.00 61.00 62.66 2aab s PRO 212 Cb -0.12 -1.86 -0.05 0.00 0.02 0.00 0.00 34.50 32.49 2aab s PRO 212 CO 0.27 -1.82 0.40 1.03 -0.33 0.00 0.00 177.00 176.54 2aab s ARG 213 N -4.40 4.15 0.00 5.54 0.52 -1.26 -5.15 118.95 118.36 2aab s ARG 213 Ca 0.67 0.33 0.13 0.00 -0.52 0.00 0.00 55.73 56.34 2aab s ARG 213 Cb -0.22 -3.35 0.78 0.00 0.52 0.00 0.00 34.95 32.67 2aab s ARG 213 CO 0.50 0.38 1.20 -3.47 0.02 0.00 0.00 175.30 173.93