#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bvn s TYR 2 N 0.00 0.82 -0.12 3.69 2.02 -1.26 -4.83 117.35 117.67 1bvn s TYR 2 Ca 0.00 -1.06 -0.12 0.00 -0.37 0.00 0.00 57.07 55.52 1bvn s TYR 2 Cb 0.00 -0.50 -0.05 0.00 -0.40 0.00 0.00 41.96 41.02 1bvn s TYR 2 CO 0.00 -0.33 0.27 0.00 -1.57 0.00 0.00 175.55 173.92 1bvn s ALA 3 N -3.83 3.70 0.40 3.71 0.00 -1.26 -4.90 121.76 119.58 1bvn s ALA 3 Ca 0.15 -0.46 0.39 0.00 0.00 0.00 0.00 51.96 52.03 1bvn s ALA 3 Cb 0.07 -2.27 2.03 0.00 0.00 0.00 0.00 23.12 22.96 1bvn s ALA 3 CO -0.03 0.32 2.18 -1.00 0.00 0.00 0.00 175.76 177.23 1bvn h PRO 4 N 5.78 0.00 -0.36 0.00 0.13 -1.96 -3.38 132.00 132.20 1bvn h PRO 4 Ca -0.47 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.50 1bvn h PRO 4 Cb 1.19 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.26 1bvn h PRO 4 CO 0.68 0.00 -0.14 1.04 -0.23 0.00 0.00 178.00 179.35 1bvn n GLN 5 N -2.90 -0.89 -1.11 0.86 1.13 -1.26 -4.69 117.38 108.52 1bvn n GLN 5 Ca -0.02 0.69 -0.30 0.00 -1.94 0.00 0.00 57.00 55.43 1bvn n GLN 5 Cb 0.10 -4.62 0.23 0.00 0.11 0.00 0.00 30.24 26.06 1bvn n GLN 5 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 1bvn s THR 6 N -2.11 1.64 0.02 5.09 -4.23 -1.26 -4.94 115.64 109.86 1bvn s THR 6 Ca 0.00 0.00 -0.30 0.00 -1.18 0.00 0.00 61.69 60.21 1bvn s THR 6 Cb 0.00 -2.50 -0.06 0.00 1.34 0.00 0.00 72.50 71.28 1bvn s THR 6 CO 0.00 0.00 1.36 -1.10 -0.54 0.00 0.00 174.62 174.34 1bvn s GLN 7 N -5.38 4.31 0.15 3.99 -0.21 -1.26 -4.91 119.66 116.35 1bvn s GLN 7 Ca 0.71 1.94 -0.33 0.00 0.02 0.00 0.00 55.36 57.70 1bvn s GLN 7 Cb -0.10 -3.48 -0.17 0.00 1.00 0.00 0.00 33.01 30.26 1bvn s GLN 7 CO 0.56 -0.50 1.01 0.45 -2.12 0.00 0.00 175.29 174.69 1bvn n SER 8 N 4.92 0.57 0.00 5.90 2.88 -1.26 -1.17 113.62 125.47 1bvn n SER 8 Ca 0.12 1.15 0.00 0.00 -1.33 0.00 0.00 58.87 58.81 1bvn n SER 8 Cb 0.44 -1.11 0.00 0.00 -0.75 0.00 0.00 64.21 62.79 1bvn n SER 8 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1bvn n GLY 9 N 1.86 3.08 3.77 0.46 0.00 -1.26 -5.04 105.19 108.07 1bvn n GLY 9 Ca 0.16 -0.99 -0.39 0.00 0.00 0.00 0.00 46.02 44.80 1bvn n GLY 9 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bvn s ARG 10 N 0.00 4.39 -0.05 1.61 0.52 -0.31 -4.72 118.95 120.38 1bvn s ARG 10 Ca 0.00 0.92 0.07 0.00 -0.52 0.00 0.00 55.73 56.19 1bvn s ARG 10 Cb 0.00 -3.30 0.10 0.00 0.52 0.00 0.00 34.95 32.27 1bvn s ARG 10 CO 0.00 0.47 1.02 0.25 0.02 0.00 0.00 175.30 177.06 1bvn n THR 11 N 2.19 0.72 -4.21 0.02 -2.24 -1.26 -4.71 114.28 104.80 1bvn n THR 11 Ca -0.06 -0.86 -0.12 0.00 -2.27 0.00 0.00 64.05 60.73 1bvn n THR 11 Cb 0.50 0.27 -0.10 0.00 -2.10 0.00 0.00 70.33 68.90 1bvn n THR 11 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1bvn s ASP 12 N -1.60 1.34 -0.02 3.42 1.01 -1.26 -4.37 116.67 115.18 1bvn s ASP 12 Ca 0.11 -1.05 0.04 0.00 0.71 0.00 0.00 52.55 52.36 1bvn s ASP 12 Cb 0.10 0.07 -0.01 0.00 1.01 0.00 0.00 42.92 44.10 1bvn s ASP 12 CO 0.01 -0.46 -0.13 -0.63 0.21 0.00 0.00 175.17 174.17 1bvn s ILE 13 N -3.55 1.04 -0.09 0.77 1.01 -1.06 -0.95 121.20 118.37 1bvn s ILE 13 Ca 0.16 -0.54 0.00 0.00 0.00 0.00 0.00 60.65 60.27 1bvn s ILE 13 Cb 0.05 -0.88 -0.03 0.00 0.01 0.00 0.00 42.46 41.61 1bvn s ILE 13 CO -0.01 0.30 -0.08 -0.69 0.00 0.00 0.00 174.94 174.46 1bvn s VAL 14 N -0.15 3.59 -0.53 2.92 1.01 -0.51 0.40 120.40 127.13 1bvn s VAL 14 Ca 0.02 -0.50 -0.17 0.00 0.00 0.00 0.00 61.98 61.32 1bvn s VAL 14 Cb -0.07 -2.49 0.09 0.00 0.00 0.00 0.00 36.38 33.91 1bvn s VAL 14 CO 0.00 0.57 0.56 -2.28 0.00 0.00 0.00 175.10 173.95 1bvn s HIS 15 N -0.44 3.13 -1.25 5.22 2.46 0.25 0.65 115.29 125.31 1bvn s HIS 15 Ca 0.06 -0.93 -0.12 0.00 0.47 0.00 0.00 55.06 54.55 1bvn s HIS 15 Cb -0.12 -3.63 0.16 0.00 -0.13 0.00 0.00 32.58 28.86 1bvn s HIS 15 CO 0.02 -1.04 1.64 1.28 -2.47 0.00 0.00 174.74 174.18 1bvn n LEU 16 N 5.75 5.82 -4.55 8.88 4.77 -1.01 -2.31 117.00 134.34 1bvn n LEU 16 Ca -0.11 -4.51 -0.54 0.00 -0.03 0.00 0.00 56.01 50.83 1bvn n LEU 16 Cb 0.43 -1.57 -0.07 0.00 -2.33 0.00 0.00 43.42 39.88 1bvn n LEU 16 CO 0.53 0.97 1.59 0.33 -1.33 0.00 0.00 177.39 179.49 1bvn n PHE 17 N 5.05 1.82 -1.19 -1.77 7.35 -1.14 -2.55 117.46 125.03 1bvn n PHE 17 Ca 0.39 0.38 -0.07 0.00 -0.76 0.00 0.00 57.45 57.39 1bvn n PHE 17 Cb 0.40 -2.50 -0.03 0.00 0.35 0.00 0.00 39.48 37.70 1bvn n PHE 17 CO 0.00 0.00 0.00 0.39 -0.76 0.00 0.00 176.76 176.39 1bvn n GLU 18 N 6.97 -1.64 -2.33 -4.13 -0.58 -1.26 -4.85 120.64 112.82 1bvn n GLU 18 Ca 0.35 0.70 -0.37 0.00 -0.42 0.00 0.00 57.16 57.42 1bvn n GLU 18 Cb 0.18 -5.04 -0.02 0.00 -0.57 0.00 0.00 31.44 25.99 1bvn n GLU 18 CO 0.00 0.00 0.00 -1.58 -0.48 0.00 0.00 177.13 175.07 1bvn s TRP 19 N -1.65 2.99 0.41 -0.32 0.52 -1.06 -4.92 118.94 114.92 1bvn s TRP 19 Ca 0.00 1.56 -0.23 0.00 0.02 0.00 0.00 56.10 57.45 1bvn s TRP 19 Cb 0.00 -3.32 -0.09 0.00 -1.15 0.00 0.00 33.47 28.91 1bvn s TRP 19 CO 0.00 -1.28 1.01 1.03 0.02 0.00 0.00 176.95 177.74 1bvn s ARG 20 N -2.61 4.16 0.23 4.98 0.52 -1.26 -4.83 118.95 120.14 1bvn s ARG 20 Ca 0.61 1.38 -0.08 0.00 -0.52 0.00 0.00 55.73 57.12 1bvn s ARG 20 Cb -0.27 -2.41 0.38 0.00 0.52 0.00 0.00 34.95 33.17 1bvn s ARG 20 CO 0.33 -0.12 1.66 -1.49 0.02 0.00 0.00 175.30 175.70 1bvn h TRP 21 N 2.27 0.05 0.00 -0.53 -0.00 -1.39 0.45 115.95 116.80 1bvn h TRP 21 Ca -0.48 0.05 -0.05 0.00 -0.00 0.00 0.00 58.89 58.40 1bvn h TRP 21 Cb 1.21 0.09 -0.01 0.00 -0.00 0.00 0.00 29.16 30.44 1bvn h TRP 21 CO 0.59 -0.16 -0.25 -0.24 -0.00 0.00 0.00 178.44 178.38 1bvn h VAL 22 N 0.16 0.94 0.02 1.49 3.04 -1.80 -0.28 116.25 119.83 1bvn h VAL 22 Ca 0.37 -0.91 -0.26 0.00 -1.01 0.00 0.00 66.70 64.89 1bvn h VAL 22 Cb 0.63 1.53 0.02 0.00 -2.01 0.00 0.00 31.29 31.46 1bvn h VAL 22 CO -0.56 0.24 -1.05 0.44 -1.01 0.00 0.00 177.57 175.63 1bvn h ASP 23 N 0.00 0.77 -0.51 3.17 3.32 -1.35 -2.21 116.42 119.60 1bvn h ASP 23 Ca -0.00 -0.64 -0.04 0.00 0.02 0.00 0.00 57.03 56.37 1bvn h ASP 23 Cb 0.51 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.80 1bvn h ASP 23 CO 0.03 1.44 0.17 0.40 -1.72 0.00 0.00 179.24 179.56 1bvn h ILE 24 N 0.31 1.23 0.45 0.35 2.04 -0.58 0.25 117.51 121.56 1bvn h ILE 24 Ca -0.12 -0.75 -0.02 0.00 1.00 0.00 0.00 64.86 64.97 1bvn h ILE 24 Cb 1.70 0.75 -0.00 0.00 -0.74 0.00 0.00 36.82 38.53 1bvn h ILE 24 CO 0.20 0.28 -0.25 0.00 0.00 0.00 0.00 178.15 178.38 1bvn h ALA 25 N 1.03 -0.65 -0.15 1.87 0.00 -1.09 0.49 119.26 120.76 1bvn h ALA 25 Ca 0.17 -0.13 0.05 0.00 0.00 0.00 0.00 54.91 54.99 1bvn h ALA 25 Cb 0.26 0.29 -0.07 0.00 0.00 0.00 0.00 17.79 18.27 1bvn h ALA 25 CO -0.01 -0.87 -0.35 -0.07 0.00 0.00 0.00 179.25 177.95 1bvn h LEU 26 N -0.65 -1.10 -1.14 0.00 3.38 -1.22 -1.00 115.31 113.57 1bvn h LEU 26 Ca -0.06 0.16 0.18 0.00 0.09 0.00 0.00 57.88 58.26 1bvn h LEU 26 Cb 0.52 0.46 -0.09 0.00 0.09 0.00 0.00 40.66 41.64 1bvn h LEU 26 CO 0.08 -0.38 0.61 -0.08 0.09 0.00 0.00 178.44 178.76 1bvn h GLU 27 N -0.41 0.68 0.10 1.13 4.57 -0.28 0.18 114.58 120.55 1bvn h GLU 27 Ca 0.10 -0.04 -0.01 0.00 -1.18 0.00 0.00 59.36 58.23 1bvn h GLU 27 Cb 0.57 -0.15 0.00 0.00 -0.16 0.00 0.00 28.75 29.01 1bvn h GLU 27 CO -0.38 0.45 -0.05 0.00 -1.18 0.00 0.00 179.01 177.85 1bvn h GLU 29 N -0.19 -1.03 0.00 0.00 5.08 -0.68 -0.86 114.58 116.90 1bvn h GLU 29 Ca -0.01 0.07 -0.06 0.00 -1.00 0.00 0.00 59.36 58.36 1bvn h GLU 29 Cb 0.15 0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.63 1bvn h GLU 29 CO 0.02 -0.69 -0.28 0.07 -1.00 0.00 0.00 179.01 177.14 1bvn h ARG 30 N -1.22 0.00 0.00 2.33 0.11 -0.71 -3.42 114.38 111.47 1bvn h ARG 30 Ca -0.11 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.97 1bvn h ARG 30 Cb 0.82 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.90 1bvn h ARG 30 CO 0.18 0.28 0.00 0.98 0.10 0.00 0.00 179.97 181.51 1bvn n TYR 31 N -3.91 -1.46 -0.16 4.08 4.19 0.93 -4.83 117.16 116.00 1bvn n TYR 31 Ca -0.02 0.26 -0.07 0.00 3.31 0.00 0.00 57.90 61.39 1bvn n TYR 31 Cb 0.36 0.35 -0.01 0.00 0.49 0.00 0.00 39.34 40.53 1bvn n TYR 31 CO 0.00 0.00 0.00 -0.07 0.91 0.00 0.00 176.86 177.70 1bvn h LEU 32 N 0.00 -1.16 0.31 2.98 3.38 -1.21 -0.68 115.31 118.92 1bvn h LEU 32 Ca 0.00 0.21 -0.00 0.00 0.09 0.00 0.00 57.88 58.18 1bvn h LEU 32 Cb 0.00 0.56 -0.03 0.00 0.09 0.00 0.00 40.66 41.28 1bvn h LEU 32 CO 0.00 -0.32 -0.46 1.23 0.09 0.00 0.00 178.44 178.99 1bvn h GLY 33 N -0.21 -1.19 0.57 0.83 0.00 -1.38 -1.93 103.07 99.74 1bvn h GLY 33 Ca 0.20 0.59 0.12 0.00 0.00 0.00 0.00 47.33 48.25 1bvn h GLY 33 CO -0.62 -0.33 0.59 -2.55 0.00 0.00 0.00 176.54 173.63 1bvn h PRO 34 N -0.80 0.80 -0.16 4.80 0.11 -1.74 -2.02 132.00 132.99 1bvn h PRO 34 Ca -0.04 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.03 1bvn h PRO 34 Cb 0.73 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 31.66 1bvn h PRO 34 CO -0.14 0.53 0.00 1.63 -0.21 0.00 0.00 178.00 179.81 1bvn n LYS 35 N -4.57 1.44 -2.58 1.05 4.76 -0.29 -4.94 118.16 113.03 1bvn n LYS 35 Ca 0.17 -0.67 -0.16 0.00 -2.87 0.00 0.00 58.31 54.78 1bvn n LYS 35 Cb 0.39 -1.22 0.01 0.00 -1.84 0.00 0.00 35.03 32.37 1bvn n LYS 35 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1bvn n GLY 36 N 0.87 -0.22 3.71 0.72 0.00 -0.76 -4.67 105.19 104.85 1bvn n GLY 36 Ca 0.10 -0.18 -0.41 0.00 0.00 0.00 0.00 46.02 45.53 1bvn n GLY 36 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1bvn s PHE 37 N -2.89 3.64 0.38 1.61 0.40 -0.88 -4.54 117.98 115.70 1bvn s PHE 37 Ca 0.12 1.56 0.07 0.00 -0.60 0.00 0.00 56.93 58.08 1bvn s PHE 37 Cb -0.05 -3.02 0.77 0.00 0.51 0.00 0.00 43.02 41.23 1bvn s PHE 37 CO 0.15 0.03 1.98 0.78 0.70 0.00 0.00 175.22 178.87 1bvn h GLY 38 N 6.71 0.52 -1.61 4.36 0.00 -1.34 -3.41 103.07 108.30 1bvn h GLY 38 Ca -0.41 -0.24 0.31 0.00 0.00 0.00 0.00 47.33 46.98 1bvn h GLY 38 CO 0.75 0.23 0.80 0.61 0.00 0.00 0.00 176.54 178.93 1bvn n GLY 39 N -1.19 0.27 3.07 4.60 0.00 -0.49 -1.74 105.19 109.70 1bvn n GLY 39 Ca 0.02 -1.02 -0.27 0.00 0.00 0.00 0.00 46.02 44.75 1bvn n GLY 39 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bvn s VAL 40 N -2.03 1.38 -0.16 1.61 1.01 0.16 -1.42 120.40 120.94 1bvn s VAL 40 Ca 0.26 -0.62 -0.21 0.00 0.00 0.00 0.00 61.98 61.42 1bvn s VAL 40 Cb -0.01 -1.23 -0.03 0.00 0.00 0.00 0.00 36.38 35.11 1bvn s VAL 40 CO -0.01 0.41 0.61 -1.58 0.00 0.00 0.00 175.10 174.53 1bvn s GLN 41 N 0.59 4.27 0.20 2.72 0.74 0.21 -0.70 119.66 127.69 1bvn s GLN 41 Ca -0.16 0.62 0.08 0.00 0.05 0.00 0.00 55.36 55.95 1bvn s GLN 41 Cb -0.16 -3.53 -0.04 0.00 1.10 0.00 0.00 33.01 30.38 1bvn s GLN 41 CO 0.05 -0.11 -0.04 0.54 -0.55 0.00 0.00 175.29 175.18 1bvn s VAL 42 N 1.47 3.45 0.73 1.34 0.11 0.45 -2.41 120.40 125.53 1bvn s VAL 42 Ca 0.29 -1.63 -0.11 0.00 -2.93 0.00 0.00 61.98 57.61 1bvn s VAL 42 Cb -0.16 -2.75 0.03 0.00 -1.53 0.00 0.00 36.38 31.97 1bvn s VAL 42 CO 0.12 -0.17 1.07 -0.44 -3.33 0.00 0.00 175.10 172.35 1bvn s SER 43 N -3.07 4.97 -0.35 3.54 0.01 -1.26 -2.43 113.70 115.11 1bvn s SER 43 Ca 0.27 1.70 -0.42 0.00 1.31 0.00 0.00 55.95 58.81 1bvn s SER 43 Cb -0.08 -2.49 -0.17 0.00 0.21 0.00 0.00 66.02 63.48 1bvn s SER 43 CO 0.18 -1.72 1.73 -2.65 0.41 0.00 0.00 173.24 171.18 1bvn n PRO 44 N -3.31 0.80 -0.08 12.44 -0.02 -1.26 -4.45 135.00 139.11 1bvn n PRO 44 Ca 0.08 0.29 0.01 0.00 -2.02 0.00 0.00 63.50 61.87 1bvn n PRO 44 Cb 0.53 -1.93 0.05 0.00 -0.02 0.00 0.00 33.50 32.14 1bvn n PRO 44 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1bvn n PRO 45 N 5.11 1.37 -1.84 0.52 -0.05 -1.26 -4.88 135.00 133.97 1bvn n PRO 45 Ca 0.29 -0.40 -0.30 0.00 -0.05 0.00 0.00 63.50 63.04 1bvn n PRO 45 Cb 0.07 -1.30 0.07 0.00 -0.05 0.00 0.00 33.50 32.29 1bvn n PRO 45 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 175.50 174.65 1bvn s ASN 46 N -0.63 4.97 -0.25 3.54 -0.87 -1.26 -3.74 114.94 116.70 1bvn s ASN 46 Ca 0.07 1.04 -0.13 0.00 -1.57 0.00 0.00 52.86 52.27 1bvn s ASN 46 Cb 0.05 -1.72 -0.04 0.00 -0.02 0.00 0.00 41.25 39.51 1bvn s ASN 46 CO 0.04 -1.64 0.30 -0.70 -2.57 0.00 0.00 177.10 172.53 1bvn s GLU 47 N -5.40 4.05 0.53 -0.60 2.12 -0.97 -4.17 118.70 114.26 1bvn s GLU 47 Ca 0.60 -0.06 0.03 0.00 0.36 0.00 0.00 54.97 55.90 1bvn s GLU 47 Cb -0.12 -3.60 0.01 0.00 0.26 0.00 0.00 34.13 30.69 1bvn s GLU 47 CO 0.51 -0.13 0.19 0.54 -0.54 0.00 0.00 175.26 175.83 1bvn s ASN 48 N 1.39 4.36 0.41 -1.70 4.22 -1.26 -0.79 114.94 121.57 1bvn s ASN 48 Ca 0.13 -1.48 -0.23 0.00 -2.14 0.00 0.00 52.86 49.14 1bvn s ASN 48 Cb -0.15 0.52 -0.10 0.00 1.28 0.00 0.00 41.25 42.80 1bvn s ASN 48 CO 0.08 -0.99 1.00 0.54 -2.04 0.00 0.00 177.10 175.70 1bvn s VAL 49 N -2.84 4.02 -0.17 3.54 0.11 -0.78 -1.65 120.40 122.64 1bvn s VAL 49 Ca 0.17 1.41 -0.21 0.00 -2.93 0.00 0.00 61.98 60.42 1bvn s VAL 49 Cb -0.00 -3.66 -0.03 0.00 -1.53 0.00 0.00 36.38 31.16 1bvn s VAL 49 CO 0.11 -0.12 0.64 -0.69 -3.33 0.00 0.00 175.10 171.70 1bvn s VAL 50 N -1.88 5.03 -0.45 2.04 1.01 0.40 -4.79 120.40 121.76 1bvn s VAL 50 Ca 0.60 1.23 -0.04 0.00 0.00 0.00 0.00 61.98 63.78 1bvn s VAL 50 Cb -0.16 -3.96 0.12 0.00 0.00 0.00 0.00 36.38 32.38 1bvn s VAL 50 CO 0.21 0.15 0.26 -0.69 0.00 0.00 0.00 175.10 175.03 1bvn s VAL 51 N 1.62 3.47 -1.26 2.92 1.01 -1.26 -4.79 120.40 122.11 1bvn s VAL 51 Ca 0.30 -2.18 0.29 0.00 0.00 0.00 0.00 61.98 60.39 1bvn s VAL 51 Cb -0.16 -3.35 0.33 0.00 0.00 0.00 0.00 36.38 33.20 1bvn s VAL 51 CO 0.12 -0.73 1.87 0.35 0.00 0.00 0.00 175.10 176.70 1bvn n THR 52 N 4.44 0.00 -3.28 3.92 -2.24 -1.26 0.39 114.28 116.25 1bvn n THR 52 Ca -0.01 -0.01 -0.08 0.00 -2.27 0.00 0.00 64.05 61.68 1bvn n THR 52 Cb 0.41 -0.30 -0.05 0.00 -2.10 0.00 0.00 70.33 68.29 1bvn n THR 52 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1bvn s ASN 53 N -2.77 0.09 -0.01 3.42 2.47 -1.26 -1.32 114.94 115.56 1bvn s ASN 53 Ca 0.21 -0.49 0.01 0.00 0.42 0.00 0.00 52.86 53.01 1bvn s ASN 53 Cb 0.19 1.22 0.04 0.00 -1.45 0.00 0.00 41.25 41.25 1bvn s ASN 53 CO 0.52 -0.32 0.84 -0.81 -3.72 0.00 0.00 177.10 173.61 1bvn n PRO 54 N 5.16 1.14 -1.03 0.43 -0.05 -1.26 -5.01 135.00 134.38 1bvn n PRO 54 Ca 0.03 -0.15 0.00 0.00 -0.05 0.00 0.00 63.50 63.33 1bvn n PRO 54 Cb 0.50 -1.24 0.00 0.00 -0.05 0.00 0.00 33.50 32.71 1bvn n PRO 54 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 175.50 175.90 1bvn n SER 55 N -0.22 -1.37 -3.15 3.54 2.88 -0.44 -4.78 113.62 110.08 1bvn n SER 55 Ca 0.01 0.00 -0.15 0.00 -1.33 0.00 0.00 58.87 57.41 1bvn n SER 55 Cb 0.14 -0.69 0.07 0.00 -0.75 0.00 0.00 64.21 62.99 1bvn n SER 55 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1bvn n ARG 56 N -0.44 -3.82 -1.71 -1.46 5.12 1.28 -4.74 116.66 110.89 1bvn n ARG 56 Ca 0.00 0.79 -0.30 0.00 -1.93 0.00 0.00 57.85 56.41 1bvn n ARG 56 Cb 0.10 -5.52 0.08 0.00 -1.16 0.00 0.00 32.46 25.97 1bvn n ARG 56 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 1bvn s PRO 57 N -4.70 2.14 0.32 5.56 0.04 -1.26 -3.17 135.00 133.94 1bvn s PRO 57 Ca 0.24 0.43 0.08 0.00 0.04 0.00 0.00 61.00 61.79 1bvn s PRO 57 Cb -0.03 -1.94 0.55 0.00 0.04 0.00 0.00 34.50 33.11 1bvn s PRO 57 CO 0.67 -1.53 1.75 0.11 0.04 0.00 0.00 177.00 178.04 1bvn h TRP 58 N -1.02 0.23 0.00 0.56 5.08 -1.72 -3.00 115.95 116.08 1bvn h TRP 58 Ca -0.47 -0.05 0.00 0.00 1.08 0.00 0.00 58.89 59.45 1bvn h TRP 58 Cb 1.29 -0.05 0.00 0.00 -3.00 0.00 0.00 29.16 27.39 1bvn h TRP 58 CO 0.42 0.54 0.00 -2.67 -1.28 0.00 0.00 178.44 175.45 1bvn n TRP 59 N -4.07 0.00 0.70 0.12 4.27 -1.26 -2.49 117.44 114.71 1bvn n TRP 59 Ca -0.01 0.00 0.13 0.00 -3.89 0.00 0.00 57.50 53.72 1bvn n TRP 59 Cb 0.43 0.00 0.31 0.00 -1.36 0.00 0.00 31.31 30.69 1bvn n TRP 59 CO 0.00 0.00 0.00 -0.85 -2.29 0.00 0.00 177.69 174.55 1bvn n GLU 60 N -0.52 0.20 0.07 -2.67 0.28 -1.14 -3.10 120.64 113.77 1bvn n GLU 60 Ca 0.01 0.10 0.13 0.00 -0.16 0.00 0.00 57.16 57.24 1bvn n GLU 60 Cb 0.00 -1.67 0.48 0.00 1.43 0.00 0.00 31.44 31.68 1bvn n GLU 60 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 1bvn n ARG 61 N -1.99 0.17 -1.01 3.44 1.74 -1.04 -2.87 116.66 115.10 1bvn n ARG 61 Ca 0.05 0.14 -0.17 0.00 -0.77 0.00 0.00 57.85 57.10 1bvn n ARG 61 Cb 0.41 -1.70 0.18 0.00 -1.02 0.00 0.00 32.46 30.33 1bvn n ARG 61 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1bvn n TYR 62 N -2.00 2.52 -3.46 -1.55 4.01 -1.18 -4.50 117.16 111.01 1bvn n TYR 62 Ca 0.06 -1.51 -0.26 0.00 -0.16 0.00 0.00 57.90 56.02 1bvn n TYR 62 Cb 0.39 -0.79 -0.09 0.00 -0.31 0.00 0.00 39.34 38.54 1bvn n TYR 62 CO 0.00 0.00 0.00 0.94 -0.46 0.00 0.00 176.86 177.34 1bvn n GLN 63 N -0.71 1.69 -1.59 -0.72 7.27 -1.14 -4.91 117.38 117.28 1bvn n GLN 63 Ca 0.47 -4.12 -0.43 0.00 0.07 0.00 0.00 57.00 52.99 1bvn n GLN 63 Cb 1.45 -1.95 -0.00 0.00 2.41 0.00 0.00 30.24 32.15 1bvn n GLN 63 CO 0.00 0.00 0.00 -2.30 0.07 0.00 0.00 177.06 174.83 1bvn n PRO 64 N 1.42 1.32 0.00 3.69 -0.02 -1.26 -1.86 135.00 138.30 1bvn n PRO 64 Ca 0.26 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 62.21 1bvn n PRO 64 Cb 0.43 -1.91 0.00 0.00 -0.02 0.00 0.00 33.50 32.00 1bvn n PRO 64 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1bvn n VAL 65 N -0.14 0.00 -3.32 -1.45 0.31 0.03 -1.02 118.33 112.74 1bvn n VAL 65 Ca 0.09 0.00 -0.03 0.00 -0.01 0.00 0.00 64.34 64.40 1bvn n VAL 65 Cb 0.36 -0.39 0.00 0.00 -0.91 0.00 0.00 33.84 32.90 1bvn n VAL 65 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 1bvn n SER 66 N -1.41 -0.57 -0.14 4.52 7.64 -0.91 -4.78 113.62 117.96 1bvn n SER 66 Ca 0.00 -1.46 0.03 0.00 1.01 0.00 0.00 58.87 58.46 1bvn n SER 66 Cb 0.25 0.97 0.06 0.00 -1.01 0.00 0.00 64.21 64.48 1bvn n SER 66 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1bvn n TYR 67 N -0.15 0.11 -2.11 1.43 4.01 -1.26 -3.87 117.16 115.31 1bvn n TYR 67 Ca -0.02 -0.63 -0.43 0.00 -0.16 0.00 0.00 57.90 56.67 1bvn n TYR 67 Cb 0.16 -0.08 -0.03 0.00 -0.31 0.00 0.00 39.34 39.09 1bvn n TYR 67 CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 1bvn s LYS 68 N -1.49 4.05 -0.88 -0.72 1.02 -1.26 -4.83 119.74 115.63 1bvn s LYS 68 Ca 0.12 1.92 -0.09 0.00 0.02 0.00 0.00 55.97 57.93 1bvn s LYS 68 Cb 0.09 -3.97 -0.07 0.00 -0.52 0.00 0.00 37.83 33.36 1bvn s LYS 68 CO 0.03 -0.99 2.06 1.28 -0.92 0.00 0.00 175.35 176.81 1bvn n LEU 69 N 7.54 4.72 -3.50 3.17 4.77 -1.26 -2.29 117.00 130.15 1bvn n LEU 69 Ca 0.17 -2.89 -0.27 0.00 -0.03 0.00 0.00 56.01 53.00 1bvn n LEU 69 Cb 0.44 -1.10 -0.13 0.00 -2.33 0.00 0.00 43.42 40.30 1bvn n LEU 69 CO 0.62 0.39 -0.30 0.00 -1.33 0.00 0.00 177.39 176.78 1bvn n THR 71 N 5.06 0.00 0.13 0.00 5.66 -0.51 -4.05 114.28 120.57 1bvn n THR 71 Ca -0.02 -0.15 -0.01 0.00 -3.05 0.00 0.00 64.05 60.82 1bvn n THR 71 Cb 0.42 0.05 0.16 0.00 -1.55 0.00 0.00 70.33 69.41 1bvn n THR 71 CO 0.00 0.00 0.00 -0.09 -3.05 0.00 0.00 175.07 171.93 1bvn h ARG 72 N 0.00 0.00 0.00 1.09 2.43 -1.89 -2.72 114.38 113.29 1bvn h ARG 72 Ca -0.02 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1bvn h ARG 72 Cb 0.07 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.62 1bvn h ARG 72 CO 0.03 0.63 0.00 0.43 -1.51 0.00 0.00 179.97 179.55 1bvn n SER 73 N -3.73 0.21 0.00 -3.80 7.64 -1.26 -4.81 113.62 107.87 1bvn n SER 73 Ca -0.01 0.55 0.00 0.00 1.01 0.00 0.00 58.87 60.42 1bvn n SER 73 Cb 0.63 -0.59 0.00 0.00 -1.01 0.00 0.00 64.21 63.24 1bvn n SER 73 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1bvn n GLY 74 N 0.17 0.10 3.93 0.23 0.00 -1.02 -1.01 105.19 107.59 1bvn n GLY 74 Ca 0.03 -1.74 -0.23 0.00 0.00 0.00 0.00 46.02 44.09 1bvn n GLY 74 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bvn s ASN 75 N -2.23 4.87 0.24 1.61 2.20 -1.26 -1.42 114.94 118.95 1bvn s ASN 75 Ca 0.00 -1.01 -0.07 0.00 -0.94 0.00 0.00 52.86 50.84 1bvn s ASN 75 Cb 0.00 0.12 0.24 0.00 -2.00 0.00 0.00 41.25 39.61 1bvn s ASN 75 CO 0.00 -1.04 1.92 -0.08 -2.94 0.00 0.00 177.10 174.96 1bvn h GLU 76 N 0.68 1.27 0.00 3.55 4.81 -1.69 -1.85 114.58 121.35 1bvn h GLU 76 Ca -0.36 -0.08 -0.04 0.00 -0.13 0.00 0.00 59.36 58.75 1bvn h GLU 76 Cb 1.29 -0.28 -0.01 0.00 0.63 0.00 0.00 28.75 30.38 1bvn h GLU 76 CO 0.53 0.84 -0.19 -2.95 -0.73 0.00 0.00 179.01 176.51 1bvn h ASN 77 N 1.30 0.00 1.29 1.04 7.08 -1.97 0.11 115.58 124.43 1bvn h ASN 77 Ca 0.35 0.00 -0.07 0.00 -3.08 0.00 0.00 56.30 53.50 1bvn h ASN 77 Cb -0.15 0.00 -0.01 0.00 -2.08 0.00 0.00 38.32 36.08 1bvn h ASN 77 CO -0.08 0.19 -0.35 -0.33 -2.08 0.00 0.00 177.43 174.79 1bvn h GLU 78 N 0.00 0.00 0.00 4.14 5.08 -1.88 -0.79 114.58 121.13 1bvn h GLU 78 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1bvn h GLU 78 Cb 0.94 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.19 1bvn h GLU 78 CO 0.02 0.35 -0.04 0.35 -1.00 0.00 0.00 179.01 178.69 1bvn h PHE 79 N 0.00 0.00 -1.04 4.33 3.57 -0.95 -2.69 116.94 120.16 1bvn h PHE 79 Ca -0.00 0.00 0.28 0.00 3.53 0.00 0.00 57.97 61.77 1bvn h PHE 79 Cb 1.09 0.00 -0.12 0.00 2.79 0.00 0.00 35.95 39.72 1bvn h PHE 79 CO 0.00 0.00 0.64 -0.09 -2.23 0.00 0.00 178.31 176.63 1bvn h ARG 80 N -0.92 0.43 0.51 1.11 2.43 -0.87 0.16 114.38 117.24 1bvn h ARG 80 Ca 0.00 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.12 1bvn h ARG 80 Cb 0.04 -0.10 0.01 0.00 -0.42 0.00 0.00 29.97 29.50 1bvn h ARG 80 CO 0.00 0.29 -0.25 0.22 -1.51 0.00 0.00 179.97 178.72 1bvn h ASP 81 N 0.45 -0.58 -0.62 -3.80 3.58 -1.24 -2.82 116.42 111.38 1bvn h ASP 81 Ca 0.65 -0.06 0.12 0.00 0.42 0.00 0.00 57.03 58.16 1bvn h ASP 81 Cb 1.48 0.15 -0.09 0.00 1.72 0.00 0.00 39.33 42.59 1bvn h ASP 81 CO -0.42 -0.27 0.10 -0.03 -2.88 0.00 0.00 179.24 175.74 1bvn h MET 82 N -0.91 0.21 -0.24 0.28 4.05 -0.43 -0.56 114.93 117.33 1bvn h MET 82 Ca -0.07 -0.01 0.05 0.00 -0.28 0.00 0.00 59.70 59.39 1bvn h MET 82 Cb 0.61 -0.05 -0.05 0.00 -0.80 0.00 0.00 31.60 31.31 1bvn h MET 82 CO 0.12 0.14 -0.08 0.28 0.23 0.00 0.00 176.91 177.59 1bvn h VAL 83 N 0.22 0.71 0.46 -5.77 2.07 -0.95 -0.88 116.25 112.11 1bvn h VAL 83 Ca 0.33 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.83 1bvn h VAL 83 Cb 0.51 0.71 -0.00 0.00 -1.52 0.00 0.00 31.29 31.00 1bvn h VAL 83 CO -0.45 0.00 -0.25 0.74 0.02 0.00 0.00 177.57 177.63 1bvn h THR 84 N -0.03 0.48 -0.68 2.57 2.02 -1.09 -1.20 112.91 114.97 1bvn h THR 84 Ca 0.12 0.00 0.13 0.00 0.77 0.00 0.00 66.41 67.43 1bvn h THR 84 Cb 0.21 0.48 -0.09 0.00 -1.74 0.00 0.00 68.15 67.01 1bvn h THR 84 CO -0.27 0.00 0.23 0.03 0.37 0.00 0.00 175.52 175.88 1bvn h ARG 85 N -0.67 0.36 -0.25 6.66 3.08 -0.86 -0.46 114.38 122.25 1bvn h ARG 85 Ca -0.06 -0.02 -0.07 0.00 0.07 0.00 0.00 59.98 59.90 1bvn h ARG 85 Cb 0.53 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.49 1bvn h ARG 85 CO 0.08 0.24 -0.11 0.00 -1.07 0.00 0.00 179.97 179.11 1bvn h ASN 87 N 0.25 0.00 1.20 0.00 2.35 -0.44 0.91 115.58 119.85 1bvn h ASN 87 Ca 0.06 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.77 1bvn h ASN 87 Cb 0.60 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.97 1bvn h ASN 87 CO 0.03 0.00 -0.19 0.78 -1.65 0.00 0.00 177.43 176.40 1bvn h ASN 88 N 0.00 0.00 -0.55 5.81 2.35 -0.80 -2.98 115.58 119.41 1bvn h ASN 88 Ca 0.12 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.87 1bvn h ASN 88 Cb 0.49 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.86 1bvn h ASN 88 CO -0.00 0.19 0.00 1.33 -1.65 0.00 0.00 177.43 177.30 1bvn n VAL 89 N -3.27 1.50 -0.18 2.81 0.24 0.23 -4.95 118.33 114.72 1bvn n VAL 89 Ca 0.01 -1.19 0.00 0.00 -2.04 0.00 0.00 64.34 61.12 1bvn n VAL 89 Cb 0.47 0.26 0.00 0.00 -1.47 0.00 0.00 33.84 33.10 1bvn n VAL 89 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1bvn n GLY 90 N 0.89 1.53 3.65 7.63 0.00 -0.92 -4.51 105.19 113.46 1bvn n GLY 90 Ca 0.21 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 1bvn n GLY 90 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bvn s VAL 91 N -2.79 5.01 0.57 1.61 1.01 -0.70 -4.36 120.40 120.75 1bvn s VAL 91 Ca 0.00 1.16 -0.06 0.00 0.00 0.00 0.00 61.98 63.08 1bvn s VAL 91 Cb 0.00 -3.94 -0.01 0.00 0.00 0.00 0.00 36.38 32.43 1bvn s VAL 91 CO 0.00 0.08 0.89 -0.13 0.00 0.00 0.00 175.10 175.94 1bvn s ARG 92 N 2.15 3.14 -0.04 2.72 3.00 -0.71 -2.96 118.95 126.24 1bvn s ARG 92 Ca 0.28 0.15 0.05 0.00 0.00 0.00 0.00 55.73 56.20 1bvn s ARG 92 Cb -0.16 -2.27 -0.01 0.00 0.00 0.00 0.00 34.95 32.52 1bvn s ARG 92 CO 0.10 -0.58 -0.19 0.42 0.00 0.00 0.00 175.30 175.05 1bvn s ILE 93 N -2.96 1.54 -0.14 1.52 1.01 -1.26 0.40 121.20 121.30 1bvn s ILE 93 Ca 0.52 -0.79 0.01 0.00 0.00 0.00 0.00 60.65 60.39 1bvn s ILE 93 Cb -0.11 -1.31 0.02 0.00 0.01 0.00 0.00 42.46 41.08 1bvn s ILE 93 CO 0.46 0.44 -0.15 -0.31 0.00 0.00 0.00 174.94 175.39 1bvn s TYR 94 N -0.09 2.12 0.29 3.97 1.51 0.12 -1.09 117.35 124.18 1bvn s TYR 94 Ca -0.01 -1.14 -0.19 0.00 -1.01 0.00 0.00 57.07 54.72 1bvn s TYR 94 Cb -0.11 -1.55 -0.09 0.00 -0.11 0.00 0.00 41.96 40.10 1bvn s TYR 94 CO 0.02 -0.61 0.78 0.08 -1.11 0.00 0.00 175.55 174.70 1bvn s VAL 95 N 1.34 4.55 -0.49 0.71 1.01 -0.72 -0.42 120.40 126.38 1bvn s VAL 95 Ca 0.02 1.23 -0.20 0.00 0.00 0.00 0.00 61.98 63.02 1bvn s VAL 95 Cb -0.13 -3.75 0.04 0.00 0.00 0.00 0.00 36.38 32.54 1bvn s VAL 95 CO -0.08 -0.01 0.68 -0.62 0.00 0.00 0.00 175.10 175.07 1bvn s ASP 96 N -1.95 6.27 -0.59 3.32 -1.08 -1.02 -0.85 116.67 120.77 1bvn s ASP 96 Ca 0.50 -0.65 -0.18 0.00 -0.52 0.00 0.00 52.55 51.70 1bvn s ASP 96 Cb -0.13 -2.32 0.12 0.00 -1.46 0.00 0.00 42.92 39.12 1bvn s ASP 96 CO 0.19 -0.91 0.65 0.00 0.52 0.00 0.00 175.17 175.62 1bvn s ALA 97 N 2.91 3.51 -1.07 3.66 0.00 -0.54 -3.99 121.76 126.23 1bvn s ALA 97 Ca 0.20 -2.37 -0.20 0.00 0.00 0.00 0.00 51.96 49.59 1bvn s ALA 97 Cb -0.17 -3.46 0.09 0.00 0.00 0.00 0.00 23.12 19.59 1bvn s ALA 97 CO 0.15 -2.26 1.40 0.08 0.00 0.00 0.00 175.76 175.13 1bvn s VAL 98 N 2.27 4.33 -0.53 0.00 1.01 -1.26 -2.70 120.40 123.52 1bvn s VAL 98 Ca 0.10 -1.43 0.12 0.00 0.00 0.00 0.00 61.98 60.76 1bvn s VAL 98 Cb -0.25 -4.98 0.34 0.00 0.00 0.00 0.00 36.38 31.49 1bvn s VAL 98 CO 0.04 -1.79 1.27 2.30 0.00 0.00 0.00 175.10 176.93 1bvn n ILE 99 N 6.11 1.47 -0.00 2.22 -5.35 -1.26 -4.65 119.36 117.91 1bvn n ILE 99 Ca 0.34 -1.37 0.03 0.00 -0.27 0.00 0.00 62.75 61.48 1bvn n ILE 99 Cb 0.49 0.21 -0.12 0.00 -1.74 0.00 0.00 39.64 38.47 1bvn n ILE 99 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 1bvn n ASN 100 N -0.06 0.36 -3.17 7.28 5.15 -1.26 -4.92 115.26 118.64 1bvn n ASN 100 Ca 0.14 0.15 -0.10 0.00 -0.60 0.00 0.00 54.58 54.17 1bvn n ASN 100 Cb 0.57 1.04 0.00 0.00 -0.53 0.00 0.00 39.78 40.87 1bvn n ASN 100 CO 0.00 0.00 0.00 -1.38 1.40 0.00 0.00 177.26 177.28 1bvn s HIS 101 N -3.11 0.28 0.00 1.20 -3.43 -1.26 -2.31 115.29 106.67 1bvn s HIS 101 Ca -0.06 -0.83 0.00 0.00 -0.80 0.00 0.00 55.06 53.37 1bvn s HIS 101 Cb 0.10 0.60 0.00 0.00 -1.43 0.00 0.00 32.58 31.85 1bvn s HIS 101 CO 0.85 -1.41 0.00 -1.33 -2.00 0.00 0.00 174.74 170.85 1bvn n MET 102 N -0.52 3.97 0.00 -0.38 2.81 -0.14 -4.49 117.12 118.37 1bvn n MET 102 Ca -0.06 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.83 1bvn n MET 102 Cb 0.60 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 33.11 1bvn n MET 102 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1bvn s GLY 104 N -2.42 2.83 0.41 0.00 0.00 -1.26 -2.53 107.32 104.34 1bvn s GLY 104 Ca 0.00 1.08 0.26 0.00 0.00 0.00 0.00 44.72 46.06 1bvn s GLY 104 CO 0.00 1.56 1.75 1.48 0.00 0.00 0.00 173.10 177.89 1bvn h SER 105 N 1.97 0.00 -0.17 1.64 4.64 -1.76 -3.21 113.55 116.67 1bvn h SER 105 Ca -0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.82 1bvn h SER 105 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 1bvn h SER 105 CO 0.60 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.17 1bvn n GLY 106 N 0.76 0.95 3.76 -0.77 0.00 -1.26 -4.41 105.19 104.22 1bvn n GLY 106 Ca 0.03 -0.49 -0.38 0.00 0.00 0.00 0.00 46.02 45.18 1bvn n GLY 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bvn s ALA 107 N -1.24 2.97 1.04 4.61 0.00 -1.21 -4.99 121.76 122.95 1bvn s ALA 107 Ca 0.23 1.11 -0.13 0.00 0.00 0.00 0.00 51.96 53.17 1bvn s ALA 107 Cb 0.15 -3.46 0.14 0.00 0.00 0.00 0.00 23.12 19.95 1bvn s ALA 107 CO 0.21 -0.91 0.64 0.00 0.00 0.00 0.00 175.76 175.70 1bvn n ALA 108 N -0.55 -2.63 -2.69 0.00 0.00 -1.26 -4.53 120.51 108.84 1bvn n ALA 108 Ca 0.08 -0.91 -0.41 0.00 0.00 0.00 0.00 53.44 52.20 1bvn n ALA 108 Cb 0.46 -1.88 -0.04 0.00 0.00 0.00 0.00 19.45 17.99 1bvn n ALA 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bvn s ALA 109 N -2.42 3.40 0.00 0.00 0.00 -1.26 -4.08 121.76 117.40 1bvn s ALA 109 Ca 0.62 0.10 0.00 0.00 0.00 0.00 0.00 51.96 52.68 1bvn s ALA 109 Cb -0.20 -3.09 0.00 0.00 0.00 0.00 0.00 23.12 19.83 1bvn s ALA 109 CO 0.64 -0.35 0.00 0.41 0.00 0.00 0.00 175.76 176.46 1bvn n GLY 110 N 3.28 1.97 5.00 0.00 0.00 0.16 -4.94 105.19 110.67 1bvn n GLY 110 Ca 0.01 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.55 1bvn n GLY 110 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1bvn n THR 111 N 0.00 0.00 0.00 2.61 -1.04 -1.26 -4.48 114.28 110.12 1bvn n THR 111 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1bvn n THR 111 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1bvn n THR 111 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1bvn n GLY 112 N 0.00 4.05 3.40 3.41 0.00 -1.26 -4.94 105.19 109.85 1bvn n GLY 112 Ca 0.00 -0.60 -0.20 0.00 0.00 0.00 0.00 46.02 45.23 1bvn n GLY 112 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1bvn s THR 113 N 0.00 0.94 -0.80 2.61 -4.23 -1.26 -0.46 115.64 112.44 1bvn s THR 113 Ca 0.00 -2.00 0.18 0.00 -1.18 0.00 0.00 61.69 58.69 1bvn s THR 113 Cb 0.00 -2.73 0.17 0.00 1.34 0.00 0.00 72.50 71.29 1bvn s THR 113 CO 0.00 0.00 1.57 0.41 -0.54 0.00 0.00 174.62 176.06 1bvn n THR 114 N -0.61 0.91 -0.44 3.99 -1.04 -0.66 -3.22 114.28 113.21 1bvn n THR 114 Ca -0.01 0.23 0.00 0.00 -2.04 0.00 0.00 64.05 62.23 1bvn n THR 114 Cb 0.66 -1.05 0.00 0.00 -1.82 0.00 0.00 70.33 68.13 1bvn n THR 114 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1bvn n GLY 116 N -0.06 0.60 3.76 0.00 0.00 -1.20 -5.03 105.19 103.27 1bvn n GLY 116 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 1bvn n GLY 116 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1bvn s SER 117 N -2.07 5.20 -0.12 1.61 0.01 -1.26 -4.92 113.70 112.15 1bvn s SER 117 Ca 0.00 2.34 -0.10 0.00 1.31 0.00 0.00 55.95 59.49 1bvn s SER 117 Cb 0.00 -2.59 -0.05 0.00 0.21 0.00 0.00 66.02 63.59 1bvn s SER 117 CO 0.00 -1.58 0.22 -0.47 0.41 0.00 0.00 173.24 171.82 1bvn s TYR 118 N -1.68 3.56 0.03 2.43 5.04 -1.26 -4.57 117.35 120.90 1bvn s TYR 118 Ca 0.76 0.60 -0.03 0.00 -2.44 0.00 0.00 57.07 55.96 1bvn s TYR 118 Cb -0.29 -2.13 -0.02 0.00 0.35 0.00 0.00 41.96 39.88 1bvn s TYR 118 CO 0.33 0.54 0.03 0.00 -1.34 0.00 0.00 175.55 175.11 1bvn n ASN 120 N 1.10 -0.20 -0.02 0.00 5.15 0.90 0.40 115.26 122.60 1bvn n ASN 120 Ca -0.21 -2.52 0.24 0.00 -0.60 0.00 0.00 54.58 51.48 1bvn n ASN 120 Cb 0.57 -0.58 0.67 0.00 -0.53 0.00 0.00 39.78 39.91 1bvn n ASN 120 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 1bvn h PRO 121 N 4.86 0.00 0.17 1.20 0.13 -1.80 -0.36 132.00 136.20 1bvn h PRO 121 Ca 0.17 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.30 1bvn h PRO 121 Cb 0.90 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.03 1bvn h PRO 121 CO 0.41 0.00 -0.10 0.78 -0.23 0.00 0.00 178.00 178.86 1bvn h GLY 122 N 0.00 -0.26 -2.07 1.56 0.00 -1.80 -1.42 103.07 99.08 1bvn h GLY 122 Ca 0.30 0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.74 1bvn h GLY 122 CO -0.00 -0.11 0.00 1.44 0.00 0.00 0.00 176.54 177.87 1bvn n SER 123 N -5.21 3.08 -3.82 0.19 7.64 -0.52 -4.89 113.62 110.10 1bvn n SER 123 Ca -0.08 -2.25 -0.29 0.00 1.01 0.00 0.00 58.87 57.25 1bvn n SER 123 Cb 0.14 -0.44 0.04 0.00 -1.01 0.00 0.00 64.21 62.93 1bvn n SER 123 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1bvn n ARG 124 N 0.63 -5.93 -3.41 1.43 1.74 -0.53 -4.04 116.66 106.55 1bvn n ARG 124 Ca 0.16 0.65 -0.40 0.00 -0.77 0.00 0.00 57.85 57.49 1bvn n ARG 124 Cb 0.58 -5.57 -0.09 0.00 -1.02 0.00 0.00 32.46 26.36 1bvn n ARG 124 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1bvn s GLU 125 N -6.53 3.71 -0.46 5.56 2.02 -0.26 -3.22 118.70 119.51 1bvn s GLU 125 Ca 0.64 -0.29 0.08 0.00 0.02 0.00 0.00 54.97 55.42 1bvn s GLU 125 Cb -0.31 -3.75 0.27 0.00 0.10 0.00 0.00 34.13 30.44 1bvn s GLU 125 CO 0.79 -0.43 0.64 1.19 0.02 0.00 0.00 175.26 177.47 1bvn n PHE 126 N 5.34 1.07 -0.30 1.61 3.01 -1.07 -0.07 117.46 127.06 1bvn n PHE 126 Ca -0.09 -3.79 0.24 0.00 1.01 0.00 0.00 57.45 54.82 1bvn n PHE 126 Cb 0.50 -0.42 0.56 0.00 -0.01 0.00 0.00 39.48 40.10 1bvn n PHE 126 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 1bvn h PRO 127 N 3.80 0.30 0.00 -1.08 0.13 -1.77 -1.02 132.00 132.37 1bvn h PRO 127 Ca 0.11 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 1bvn h PRO 127 Cb 0.81 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 31.87 1bvn h PRO 127 CO 0.59 0.20 0.00 0.00 -0.23 0.00 0.00 178.00 178.56 1bvn h ALA 128 N 1.58 1.00 0.00 -0.56 0.00 -1.88 -3.23 119.26 116.17 1bvn h ALA 128 Ca 0.55 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 55.39 1bvn h ALA 128 Cb 1.56 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.34 1bvn h ALA 128 CO -0.21 0.00 -0.62 0.28 0.00 0.00 0.00 179.25 178.70 1bvn h VAL 129 N 0.00 0.48 -2.36 0.00 2.07 -1.61 -3.45 116.25 111.38 1bvn h VAL 129 Ca 0.00 -1.52 -0.44 0.00 0.82 0.00 0.00 66.70 65.56 1bvn h VAL 129 Cb 0.13 1.07 0.05 0.00 -1.52 0.00 0.00 31.29 31.01 1bvn h VAL 129 CO 0.00 0.16 -0.05 -2.16 0.02 0.00 0.00 177.57 175.54 1bvn s PRO 130 N -2.17 2.52 -0.01 1.57 0.04 -1.22 -5.05 135.00 130.68 1bvn s PRO 130 Ca -0.17 -0.86 -0.03 0.00 0.04 0.00 0.00 61.00 59.98 1bvn s PRO 130 Cb 0.02 -2.51 0.00 0.00 0.04 0.00 0.00 34.50 32.06 1bvn s PRO 130 CO 0.35 -0.71 0.07 0.71 0.04 0.00 0.00 177.00 177.46 1bvn s TYR 131 N -2.74 0.01 0.29 0.56 2.02 -0.48 -4.94 117.35 112.07 1bvn s TYR 131 Ca 0.58 0.00 0.11 0.00 -0.37 0.00 0.00 57.07 57.39 1bvn s TYR 131 Cb -0.10 -0.03 -0.05 0.00 -0.40 0.00 0.00 41.96 41.38 1bvn s TYR 131 CO 0.38 -0.11 -0.16 -1.12 -1.57 0.00 0.00 175.55 172.97 1bvn s SER 132 N -0.49 3.71 0.57 2.29 0.01 -1.26 -2.61 113.70 115.92 1bvn s SER 132 Ca -0.06 -1.01 0.20 0.00 1.31 0.00 0.00 55.95 56.39 1bvn s SER 132 Cb -0.04 -0.36 1.08 0.00 0.21 0.00 0.00 66.02 66.91 1bvn s SER 132 CO 0.00 0.00 1.57 0.00 0.41 0.00 0.00 173.24 175.22 1bvn h ALA 133 N 2.19 1.41 0.00 1.44 0.00 -1.69 0.48 119.26 123.10 1bvn h ALA 133 Ca -0.41 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.50 1bvn h ALA 133 Cb 1.26 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.05 1bvn h ALA 133 CO 0.61 -0.41 -0.01 2.35 0.00 0.00 0.00 179.25 181.79 1bvn h TRP 134 N 0.00 0.00 -0.31 0.00 2.91 -1.93 -3.19 115.95 113.43 1bvn h TRP 134 Ca 0.00 0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.02 1bvn h TRP 134 Cb 0.90 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.55 1bvn h TRP 134 CO 0.00 0.01 0.00 -0.25 -1.03 0.00 0.00 178.44 177.17 1bvn n ASP 135 N -3.11 3.22 -4.73 2.65 8.00 0.17 -4.99 116.55 117.75 1bvn n ASP 135 Ca -0.01 -1.94 -0.25 0.00 0.71 0.00 0.00 54.79 53.30 1bvn n ASP 135 Cb 0.20 -0.20 -0.06 0.00 -0.02 0.00 0.00 41.12 41.03 1bvn n ASP 135 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1bvn s PHE 136 N -1.42 2.96 -1.28 1.24 0.40 -1.21 0.64 117.98 119.31 1bvn s PHE 136 Ca 0.33 -0.11 0.00 0.00 -0.60 0.00 0.00 56.93 56.56 1bvn s PHE 136 Cb 0.20 -1.40 0.00 0.00 0.51 0.00 0.00 43.02 42.33 1bvn s PHE 136 CO 0.28 0.53 0.55 0.09 0.70 0.00 0.00 175.22 177.37 1bvn n ASN 137 N -0.49 0.61 -0.04 1.36 3.02 0.32 -4.51 115.26 115.53 1bvn n ASN 137 Ca -0.08 -1.70 -0.08 0.00 -0.03 0.00 0.00 54.58 52.68 1bvn n ASN 137 Cb 0.56 -0.31 -0.02 0.00 -0.61 0.00 0.00 39.78 39.40 1bvn n ASN 137 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 1bvn h ASP 138 N 0.11 -0.30 0.50 6.41 5.19 -1.84 -1.43 116.42 125.05 1bvn h ASP 138 Ca 0.00 0.08 -0.04 0.00 -0.62 0.00 0.00 57.03 56.45 1bvn h ASP 138 Cb 0.31 0.18 -0.01 0.00 0.18 0.00 0.00 39.33 39.99 1bvn h ASP 138 CO 0.00 -0.12 -0.19 1.23 -3.12 0.00 0.00 179.24 177.04 1bvn h GLY 139 N -0.05 0.00 1.22 2.75 0.00 -1.95 -3.14 103.07 101.89 1bvn h GLY 139 Ca 0.11 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 47.23 1bvn h GLY 139 CO -0.26 0.00 -0.72 1.70 0.00 0.00 0.00 176.54 177.26 1bvn h LYS 140 N 0.00 0.77 -6.75 4.80 3.64 -1.62 -3.45 116.57 113.96 1bvn h LYS 140 Ca -0.00 -0.60 -0.54 0.00 -1.27 0.00 0.00 60.65 58.24 1bvn h LYS 140 Cb 0.49 0.11 0.08 0.00 -0.41 0.00 0.00 32.23 32.51 1bvn h LYS 140 CO 0.02 1.21 0.83 0.00 -2.27 0.00 0.00 179.45 179.25 1bvn n LYS 142 N 2.14 0.26 -2.69 0.00 2.85 -1.26 -4.94 118.16 114.52 1bvn n LYS 142 Ca 0.09 0.04 -0.40 0.00 -1.05 0.00 0.00 58.31 56.98 1bvn n LYS 142 Cb 0.36 -1.62 -0.05 0.00 -0.65 0.00 0.00 35.03 33.06 1bvn n LYS 142 CO 0.00 0.00 0.00 -0.08 -0.05 0.00 0.00 177.40 177.27 1bvn s THR 143 N -3.17 4.03 0.48 0.58 -1.32 -1.26 -4.95 115.64 110.04 1bvn s THR 143 Ca 0.05 1.97 0.25 0.00 -1.21 0.00 0.00 61.69 62.76 1bvn s THR 143 Cb 0.14 -4.26 0.29 0.00 -1.51 0.00 0.00 72.50 67.17 1bvn s THR 143 CO 0.76 0.44 2.12 0.00 -2.21 0.00 0.00 174.62 175.73 1bvn h ALA 144 N 4.36 1.46 0.00 11.08 0.00 -1.92 -2.23 119.26 132.01 1bvn h ALA 144 Ca -0.45 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 54.28 1bvn h ALA 144 Cb 1.20 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.96 1bvn h ALA 144 CO 0.69 0.11 -0.82 0.66 0.00 0.00 0.00 179.25 179.88 1bvn h SER 145 N 0.00 0.00 0.00 0.00 4.64 -1.99 -3.48 113.55 112.72 1bvn h SER 145 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1bvn h SER 145 Cb 0.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 1bvn h SER 145 CO 0.01 0.40 0.00 0.61 -0.87 0.00 0.00 176.83 176.98 1bvn n GLY 146 N 1.26 2.11 2.68 -0.77 0.00 -0.84 -5.07 105.19 104.57 1bvn n GLY 146 Ca -0.02 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.77 1bvn n GLY 146 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bvn n GLY 147 N -1.78 3.51 3.71 -0.02 0.00 -1.26 -2.52 105.19 106.83 1bvn n GLY 147 Ca 0.00 -2.31 -0.42 0.00 0.00 0.00 0.00 46.02 43.29 1bvn n GLY 147 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1bvn s ILE 148 N -2.25 3.46 -0.08 -0.61 1.01 -0.83 -4.65 121.20 117.25 1bvn s ILE 148 Ca 0.06 1.00 0.00 0.00 0.00 0.00 0.00 60.65 61.71 1bvn s ILE 148 Cb -0.00 -3.64 -0.05 0.00 0.01 0.00 0.00 42.46 38.77 1bvn s ILE 148 CO 0.04 0.05 -0.07 1.21 0.00 0.00 0.00 174.94 176.17 1bvn n GLU 149 N 4.42 0.19 -4.42 2.79 4.07 -1.26 -4.97 120.64 121.46 1bvn n GLU 149 Ca 0.12 0.05 -0.33 0.00 -0.06 0.00 0.00 57.16 56.93 1bvn n GLU 149 Cb 0.43 -1.13 -0.15 0.00 -0.06 0.00 0.00 31.44 30.53 1bvn n GLU 149 CO 0.00 0.00 0.00 0.45 -0.06 0.00 0.00 177.13 177.52 1bvn s SER 150 N -4.84 3.64 0.00 4.31 0.15 -1.26 -4.96 113.70 110.74 1bvn s SER 150 Ca -0.11 -0.49 0.17 0.00 0.70 0.00 0.00 55.95 56.23 1bvn s SER 150 Cb 0.03 -1.57 0.69 0.00 -1.71 0.00 0.00 66.02 63.46 1bvn s SER 150 CO 0.18 0.06 1.49 -1.22 1.20 0.00 0.00 173.24 174.95 1bvn n TYR 151 N 4.19 0.21 0.85 3.44 4.02 -1.26 -2.67 117.16 125.94 1bvn n TYR 151 Ca -0.19 -0.10 0.11 0.00 -0.01 0.00 0.00 57.90 57.70 1bvn n TYR 151 Cb 0.51 0.00 -0.02 0.00 -0.02 0.00 0.00 39.34 39.81 1bvn n TYR 151 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 1bvn n ASN 152 N 0.11 0.76 -4.33 7.72 4.13 -1.26 -3.49 115.26 118.90 1bvn n ASN 152 Ca 0.14 -0.64 -0.46 0.00 1.68 0.00 0.00 54.58 55.30 1bvn n ASN 152 Cb 0.25 0.88 -0.04 0.00 -1.54 0.00 0.00 39.78 39.33 1bvn n ASN 152 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1bvn s ASP 153 N -3.27 6.28 0.26 6.41 -1.08 -1.09 -4.63 116.67 119.55 1bvn s ASP 153 Ca 0.07 -1.86 -0.03 0.00 -0.52 0.00 0.00 52.55 50.21 1bvn s ASP 153 Cb 0.16 -2.23 0.56 0.00 -1.46 0.00 0.00 42.92 39.95 1bvn s ASP 153 CO 0.83 -0.87 1.64 -0.65 0.52 0.00 0.00 175.17 176.64 1bvn h PRO 154 N 8.79 0.16 -0.71 4.34 0.11 -1.86 -0.05 132.00 142.77 1bvn h PRO 154 Ca -0.23 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.85 1bvn h PRO 154 Cb 1.09 -0.04 -0.03 0.00 0.11 0.00 0.00 31.00 32.13 1bvn h PRO 154 CO 1.01 0.11 0.39 1.88 -0.21 0.00 0.00 178.00 181.18 1bvn h TYR 155 N 0.17 0.98 -0.45 0.65 0.05 -1.95 -2.17 116.97 114.24 1bvn h TYR 155 Ca 0.48 -0.02 -0.02 0.00 0.05 0.00 0.00 58.73 59.21 1bvn h TYR 155 Cb 0.89 -0.31 -0.02 0.00 1.01 0.00 0.00 36.73 38.30 1bvn h TYR 155 CO -0.34 0.69 0.19 0.37 -1.05 0.00 0.00 178.16 178.02 1bvn h GLN 156 N 0.98 0.67 0.00 4.88 4.15 -1.34 0.34 115.11 124.80 1bvn h GLN 156 Ca 0.25 -0.12 -0.03 0.00 0.77 0.00 0.00 58.65 59.53 1bvn h GLN 156 Cb 0.04 -0.11 -0.00 0.00 0.21 0.00 0.00 27.48 27.61 1bvn h GLN 156 CO -0.04 0.61 -0.12 0.28 -1.93 0.00 0.00 178.83 177.63 1bvn h VAL 157 N 0.59 0.83 0.02 2.39 2.07 -1.09 -1.87 116.25 119.19 1bvn h VAL 157 Ca 0.15 -0.47 -0.37 0.00 0.82 0.00 0.00 66.70 66.83 1bvn h VAL 157 Cb 0.18 1.27 -0.06 0.00 -1.52 0.00 0.00 31.29 31.17 1bvn h VAL 157 CO -0.01 0.12 -2.31 0.54 0.02 0.00 0.00 177.57 175.93 1bvn n ARG 158 N -4.02 0.68 0.03 1.57 1.74 -0.84 -4.39 116.66 111.44 1bvn n ARG 158 Ca -0.02 0.13 0.10 0.00 -0.77 0.00 0.00 57.85 57.29 1bvn n ARG 158 Cb 0.21 -1.58 -0.10 0.00 -1.02 0.00 0.00 32.46 29.98 1bvn n ARG 158 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1bvn n ASP 159 N -3.12 0.38 -4.93 0.55 8.00 0.12 -4.66 116.55 112.89 1bvn n ASP 159 Ca -0.37 0.15 -0.21 0.00 0.71 0.00 0.00 54.79 55.07 1bvn n ASP 159 Cb 1.06 1.25 0.05 0.00 -0.02 0.00 0.00 41.12 43.45 1bvn n ASP 159 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1bvn s GLN 161 N -4.76 4.15 -0.20 0.00 -2.07 -1.05 -4.65 119.66 111.09 1bvn s GLN 161 Ca 0.59 0.72 -0.23 0.00 -1.82 0.00 0.00 55.36 54.62 1bvn s GLN 161 Cb -0.09 -2.91 -0.02 0.00 -1.09 0.00 0.00 33.01 28.91 1bvn s GLN 161 CO 0.39 0.43 0.73 -1.17 -1.32 0.00 0.00 175.29 174.35 1bvn s LEU 162 N -1.95 4.14 -1.17 2.60 2.96 -1.25 -1.96 118.68 122.04 1bvn s LEU 162 Ca 0.41 0.98 -0.15 0.00 -0.22 0.00 0.00 54.13 55.15 1bvn s LEU 162 Cb -0.16 -3.06 0.15 0.00 0.50 0.00 0.00 46.19 43.62 1bvn s LEU 162 CO 0.20 -0.36 0.37 1.33 -1.32 0.00 0.00 176.35 176.58 1bvn n VAL 163 N 4.81 0.00 -0.26 1.68 0.24 -1.26 0.46 118.33 123.99 1bvn n VAL 163 Ca 0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.32 1bvn n VAL 163 Cb 0.49 -0.31 0.00 0.00 -1.47 0.00 0.00 33.84 32.55 1bvn n VAL 163 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1bvn n GLY 164 N -0.83 1.53 3.73 7.63 0.00 -1.26 -4.93 105.19 111.07 1bvn n GLY 164 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 1bvn n GLY 164 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1bvn s LEU 165 N 0.00 4.39 -0.24 0.99 1.43 0.17 -2.03 118.68 123.39 1bvn s LEU 165 Ca 0.00 2.38 -0.33 0.00 -1.03 0.00 0.00 54.13 55.15 1bvn s LEU 165 Cb 0.00 -3.60 -0.09 0.00 0.03 0.00 0.00 46.19 42.53 1bvn s LEU 165 CO 0.00 -0.61 2.12 0.18 0.23 0.00 0.00 176.35 178.28 1bvn n LEU 166 N 3.33 2.81 -4.58 1.79 4.77 -1.05 -3.92 117.00 120.16 1bvn n LEU 166 Ca 0.09 0.48 -0.42 0.00 -0.03 0.00 0.00 56.01 56.13 1bvn n LEU 166 Cb 0.42 -1.38 -0.02 0.00 -2.33 0.00 0.00 43.42 40.11 1bvn n LEU 166 CO 0.58 -0.55 1.12 -0.62 -1.33 0.00 0.00 177.39 176.59 1bvn s ASP 167 N 6.83 6.39 0.51 -1.43 2.15 -1.26 -0.96 116.67 128.89 1bvn s ASP 167 Ca 1.03 0.15 -0.23 0.00 0.43 0.00 0.00 52.55 53.93 1bvn s ASP 167 Cb -0.65 -2.55 -0.06 0.00 -0.30 0.00 0.00 42.92 39.35 1bvn s ASP 167 CO 0.45 -1.52 1.32 -0.76 -0.17 0.00 0.00 175.17 174.49 1bvn s LEU 168 N 5.17 3.94 -1.32 -1.34 1.43 -0.98 0.12 118.68 125.69 1bvn s LEU 168 Ca 0.45 2.67 -0.13 0.00 -1.03 0.00 0.00 54.13 56.09 1bvn s LEU 168 Cb -0.08 -4.21 0.11 0.00 0.03 0.00 0.00 46.19 42.04 1bvn s LEU 168 CO 0.25 -1.34 1.85 0.00 0.23 0.00 0.00 176.35 177.35 1bvn n ALA 169 N -0.75 4.71 0.06 4.21 0.00 0.21 -4.45 120.51 124.49 1bvn n ALA 169 Ca 0.09 -4.08 0.00 0.00 0.00 0.00 0.00 53.44 49.45 1bvn n ALA 169 Cb 0.45 -3.29 0.00 0.00 0.00 0.00 0.00 19.45 16.62 1bvn n ALA 169 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1bvn n LEU 170 N 5.86 0.00 -0.00 0.00 4.77 -1.26 -2.03 117.00 124.34 1bvn n LEU 170 Ca 0.45 0.00 0.10 0.00 -0.03 0.00 0.00 56.01 56.53 1bvn n LEU 170 Cb 0.41 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.37 1bvn n LEU 170 CO 0.79 0.00 -0.27 -1.84 -1.33 0.00 0.00 177.39 174.74 1bvn n GLU 171 N -0.59 0.23 -3.05 3.23 0.28 -1.26 -4.73 120.64 114.76 1bvn n GLU 171 Ca 0.00 -0.07 -0.36 0.00 -0.16 0.00 0.00 57.16 56.58 1bvn n GLU 171 Cb 0.00 -1.51 -0.06 0.00 1.43 0.00 0.00 31.44 31.30 1bvn n GLU 171 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 1bvn s LYS 172 N -3.18 4.28 0.55 3.44 1.02 -0.86 -4.95 119.74 120.03 1bvn s LYS 172 Ca 0.03 0.93 0.33 0.00 0.02 0.00 0.00 55.97 57.28 1bvn s LYS 172 Cb 0.15 -2.80 1.38 0.00 -0.52 0.00 0.00 37.83 36.04 1bvn s LYS 172 CO 0.88 0.34 1.99 0.22 -0.92 0.00 0.00 175.35 177.86 1bvn h ASP 173 N 3.22 0.00 -0.12 2.83 3.58 -1.90 -2.65 116.42 121.37 1bvn h ASP 173 Ca -0.48 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 56.95 1bvn h ASP 173 Cb 1.19 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.24 1bvn h ASP 173 CO 0.65 0.01 0.00 0.22 -2.88 0.00 0.00 179.24 177.25 1bvn h TYR 174 N 0.00 0.24 -0.13 0.28 3.20 -1.94 -1.27 116.97 117.35 1bvn h TYR 174 Ca -0.00 -0.04 -0.02 0.00 3.14 0.00 0.00 58.73 61.81 1bvn h TYR 174 Cb 0.51 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.71 1bvn h TYR 174 CO 0.00 0.45 0.01 0.28 -1.64 0.00 0.00 178.16 177.26 1bvn h VAL 175 N -0.04 1.24 -0.53 1.81 2.07 -1.82 -1.55 116.25 117.42 1bvn h VAL 175 Ca 0.04 -0.77 0.11 0.00 0.82 0.00 0.00 66.70 66.89 1bvn h VAL 175 Cb 0.36 1.49 -0.10 0.00 -1.52 0.00 0.00 31.29 31.52 1bvn h VAL 175 CO 0.01 0.23 -0.07 0.03 0.02 0.00 0.00 177.57 177.78 1bvn h ARG 176 N -0.02 0.05 -0.43 1.57 3.08 -1.47 -2.18 114.38 114.98 1bvn h ARG 176 Ca 0.04 -0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.04 1bvn h ARG 176 Cb 0.34 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.36 1bvn h ARG 176 CO 0.00 0.03 0.10 0.77 -1.07 0.00 0.00 179.97 179.81 1bvn h SER 177 N 0.05 0.65 -0.77 7.04 0.02 -1.08 -1.00 113.55 118.46 1bvn h SER 177 Ca 0.26 -0.23 0.10 0.00 -0.84 0.00 0.00 61.79 61.08 1bvn h SER 177 Cb 0.41 -0.17 -0.07 0.00 0.14 0.00 0.00 62.40 62.70 1bvn h SER 177 CO -0.51 0.72 0.41 -0.03 -1.14 0.00 0.00 176.83 176.29 1bvn h MET 178 N 0.56 0.67 0.37 3.45 -1.53 -0.69 -0.56 114.93 117.21 1bvn h MET 178 Ca 0.13 -0.04 -0.02 0.00 -3.44 0.00 0.00 59.70 56.34 1bvn h MET 178 Cb 0.32 -0.15 0.00 0.00 -0.55 0.00 0.00 31.60 31.22 1bvn h MET 178 CO 0.00 0.44 -0.18 0.82 0.14 0.00 0.00 176.91 178.14 1bvn h ILE 179 N 0.69 0.50 -0.78 1.77 2.04 -1.26 -2.90 117.51 117.56 1bvn h ILE 179 Ca 0.38 -0.63 0.18 0.00 1.00 0.00 0.00 64.86 65.79 1bvn h ILE 179 Cb 0.38 0.74 -0.12 0.00 -0.74 0.00 0.00 36.82 37.09 1bvn h ILE 179 CO -0.26 0.09 0.17 0.00 0.00 0.00 0.00 178.15 178.15 1bvn h ALA 180 N -0.55 1.02 -0.40 1.87 0.00 -0.92 0.38 119.26 120.66 1bvn h ALA 180 Ca -0.05 0.19 0.07 0.00 0.00 0.00 0.00 54.91 55.12 1bvn h ALA 180 Cb 0.54 0.27 -0.06 0.00 0.00 0.00 0.00 17.79 18.54 1bvn h ALA 180 CO 0.08 -0.38 0.02 -0.44 0.00 0.00 0.00 179.25 178.53 1bvn h ASP 181 N 0.24 -0.13 0.16 0.00 5.19 -1.12 0.11 116.42 120.87 1bvn h ASP 181 Ca 0.45 0.09 0.00 0.00 -0.62 0.00 0.00 57.03 56.95 1bvn h ASP 181 Cb 0.81 0.15 -0.01 0.00 0.18 0.00 0.00 39.33 40.46 1bvn h ASP 181 CO -0.57 -0.03 -0.16 0.22 -3.12 0.00 0.00 179.24 175.58 1bvn h TYR 182 N 0.12 -0.42 0.77 4.55 3.20 -0.19 -2.71 116.97 122.30 1bvn h TYR 182 Ca 0.20 0.00 -0.04 0.00 3.14 0.00 0.00 58.73 62.03 1bvn h TYR 182 Cb 0.27 0.16 0.01 0.00 1.54 0.00 0.00 36.73 38.71 1bvn h TYR 182 CO -0.26 -0.24 -0.37 -0.07 -1.64 0.00 0.00 178.16 175.58 1bvn h LEU 183 N -0.35 -0.88 -0.75 2.82 3.38 0.07 -2.57 115.31 117.03 1bvn h LEU 183 Ca 0.00 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1bvn h LEU 183 Cb 0.33 0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.31 1bvn h LEU 183 CO -0.04 -0.60 0.00 -0.46 0.09 0.00 0.00 178.44 177.43 1bvn n ASN 184 N -5.52 0.69 -0.09 -0.43 2.04 0.32 -1.59 115.26 110.67 1bvn n ASN 184 Ca -0.14 -1.83 -0.17 0.00 -0.44 0.00 0.00 54.58 52.00 1bvn n ASN 184 Cb 0.42 -0.34 -0.09 0.00 -2.53 0.00 0.00 39.78 37.23 1bvn n ASN 184 CO 0.00 0.00 0.00 0.50 -0.44 0.00 0.00 177.26 177.32 1bvn h LYS 185 N 0.06 0.00 -0.21 -3.83 3.11 -1.12 -3.00 116.57 111.59 1bvn h LYS 185 Ca 0.00 0.00 -0.01 0.00 -2.81 0.00 0.00 60.65 57.83 1bvn h LYS 185 Cb 0.34 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.56 1bvn h LYS 185 CO 0.00 0.76 0.08 -0.07 -2.81 0.00 0.00 179.45 177.42 1bvn h LEU 186 N -1.00 0.25 -0.33 5.20 3.38 -1.17 -0.04 115.31 121.60 1bvn h LEU 186 Ca -0.22 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.73 1bvn h LEU 186 Cb 1.06 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.73 1bvn h LEU 186 CO -0.14 0.23 0.21 0.40 0.09 0.00 0.00 178.44 179.24 1bvn h ILE 187 N 0.29 1.10 -0.57 1.22 2.04 -1.38 -0.63 117.51 119.57 1bvn h ILE 187 Ca 0.07 -0.20 -0.03 0.00 1.00 0.00 0.00 64.86 65.70 1bvn h ILE 187 Cb 0.06 0.64 -0.03 0.00 -0.74 0.00 0.00 36.82 36.75 1bvn h ILE 187 CO -0.01 0.09 0.23 0.44 0.00 0.00 0.00 178.15 178.90 1bvn h ASP 188 N 0.44 0.76 0.26 1.72 3.32 -0.91 -1.06 116.42 120.95 1bvn h ASP 188 Ca 0.12 -0.10 -0.02 0.00 0.02 0.00 0.00 57.03 57.05 1bvn h ASP 188 Cb -0.03 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 39.32 1bvn h ASP 188 CO -0.02 0.68 -0.10 0.40 -1.72 0.00 0.00 179.24 178.48 1bvn h ILE 189 N 0.82 0.61 0.00 0.35 2.04 -0.61 -3.46 117.51 117.26 1bvn h ILE 189 Ca 0.20 -0.42 0.00 0.00 1.00 0.00 0.00 64.86 65.64 1bvn h ILE 189 Cb 0.16 1.26 0.00 0.00 -0.74 0.00 0.00 36.82 37.51 1bvn h ILE 189 CO -0.02 0.10 0.00 0.61 0.00 0.00 0.00 178.15 178.84 1bvn n GLY 190 N -0.86 0.59 3.77 5.37 0.00 -0.40 -4.59 105.19 109.06 1bvn n GLY 190 Ca -0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.61 1bvn n GLY 190 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bvn s VAL 191 N -1.34 2.80 -0.13 1.61 1.01 -0.31 -4.72 120.40 119.31 1bvn s VAL 191 Ca 0.00 0.69 0.18 0.00 0.00 0.00 0.00 61.98 62.85 1bvn s VAL 191 Cb 0.00 -3.40 -0.23 0.00 0.00 0.00 0.00 36.38 32.75 1bvn s VAL 191 CO 0.00 0.09 0.42 0.00 0.00 0.00 0.00 175.10 175.60 1bvn n ALA 192 N 0.08 1.82 -3.72 5.51 0.00 -0.25 -4.58 120.51 119.38 1bvn n ALA 192 Ca 0.04 -0.92 0.07 0.00 0.00 0.00 0.00 53.44 52.63 1bvn n ALA 192 Cb 0.45 -0.57 0.02 0.00 0.00 0.00 0.00 19.45 19.34 1bvn n ALA 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bvn n GLY 193 N 1.55 0.71 3.10 0.00 0.00 -1.23 -0.96 105.19 108.37 1bvn n GLY 193 Ca -0.20 -1.10 -0.13 0.00 0.00 0.00 0.00 46.02 44.59 1bvn n GLY 193 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1bvn s PHE 194 N -2.87 0.78 -0.27 1.61 0.08 -0.40 -1.76 117.98 115.16 1bvn s PHE 194 Ca 0.19 -0.58 -0.08 0.00 0.12 0.00 0.00 56.93 56.58 1bvn s PHE 194 Cb -0.02 -0.46 -0.02 0.00 -0.57 0.00 0.00 43.02 41.95 1bvn s PHE 194 CO 0.04 -0.08 0.08 0.50 -0.10 0.00 0.00 175.22 175.67 1bvn s ARG 195 N -2.09 3.50 -0.54 0.44 3.52 -0.03 -2.65 118.95 121.11 1bvn s ARG 195 Ca -0.04 -0.58 -0.25 0.00 -0.13 0.00 0.00 55.73 54.72 1bvn s ARG 195 Cb -0.07 -3.37 0.04 0.00 -1.56 0.00 0.00 34.95 29.99 1bvn s ARG 195 CO -0.00 -0.27 0.99 -0.51 -0.81 0.00 0.00 175.30 174.70 1bvn s LEU 196 N 1.59 3.94 0.28 -0.88 1.02 -0.79 -1.47 118.68 122.37 1bvn s LEU 196 Ca 0.05 -0.14 -0.29 0.00 0.02 0.00 0.00 54.13 53.77 1bvn s LEU 196 Cb -0.16 -2.99 -0.10 0.00 0.02 0.00 0.00 46.19 42.97 1bvn s LEU 196 CO 0.04 -1.24 1.22 -0.62 0.02 0.00 0.00 176.35 175.76 1bvn s ASP 197 N 2.73 7.02 -1.39 2.29 2.15 -1.10 -1.35 116.67 127.02 1bvn s ASP 197 Ca 0.35 2.44 -0.07 0.00 0.43 0.00 0.00 52.55 55.69 1bvn s ASP 197 Cb -0.11 -2.63 0.01 0.00 -0.30 0.00 0.00 42.92 39.89 1bvn s ASP 197 CO 0.22 -0.36 0.37 0.00 -0.17 0.00 0.00 175.17 175.23 1bvn n ALA 198 N 1.39 -2.16 0.24 3.66 0.00 -1.26 -4.61 120.51 117.78 1bvn n ALA 198 Ca 0.01 -0.35 0.10 0.00 0.00 0.00 0.00 53.44 53.19 1bvn n ALA 198 Cb 0.43 -1.74 0.61 0.00 0.00 0.00 0.00 19.45 18.75 1bvn n ALA 198 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1bvn h SER 199 N -1.94 0.00 0.02 0.00 0.02 -1.45 -2.62 113.55 107.58 1bvn h SER 199 Ca -0.66 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.29 1bvn h SER 199 Cb 1.39 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.93 1bvn h SER 199 CO 0.62 0.18 0.00 2.29 -1.14 0.00 0.00 176.83 178.78 1bvn n LYS 200 N -3.78 0.48 0.00 3.45 2.85 -1.25 -1.71 118.16 118.19 1bvn n LYS 200 Ca -0.02 0.01 0.09 0.00 -1.05 0.00 0.00 58.31 57.34 1bvn n LYS 200 Cb 0.29 -1.50 -0.04 0.00 -0.65 0.00 0.00 35.03 33.13 1bvn n LYS 200 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 1bvn n HIS 201 N -1.02 0.00 -4.19 5.58 8.25 -0.99 -4.56 115.22 118.30 1bvn n HIS 201 Ca 0.12 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.30 1bvn n HIS 201 Cb 0.06 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.09 1bvn n HIS 201 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 1bvn s MET 202 N -2.28 2.41 0.06 -0.41 -1.94 -0.70 -4.13 119.30 112.31 1bvn s MET 202 Ca 0.12 -1.02 -0.27 0.00 -1.71 0.00 0.00 55.69 52.81 1bvn s MET 202 Cb 0.14 -2.40 -0.05 0.00 2.01 0.00 0.00 34.83 34.53 1bvn s MET 202 CO 0.55 0.49 0.86 -1.58 -0.01 0.00 0.00 175.02 175.32 1bvn s TRP 203 N -1.54 3.75 0.30 -0.03 0.52 -1.26 -4.93 118.94 115.76 1bvn s TRP 203 Ca 0.26 1.62 0.02 0.00 0.02 0.00 0.00 56.10 58.02 1bvn s TRP 203 Cb -0.10 -2.94 0.76 0.00 -1.15 0.00 0.00 33.47 30.04 1bvn s TRP 203 CO 0.18 0.22 1.59 -1.35 0.02 0.00 0.00 176.95 177.61 1bvn h PRO 204 N 5.76 0.05 -0.59 4.98 0.11 -1.89 -0.12 132.00 140.30 1bvn h PRO 204 Ca -0.43 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1bvn h PRO 204 Cb 1.21 -0.01 -0.03 0.00 0.11 0.00 0.00 31.00 32.28 1bvn h PRO 204 CO 0.72 0.04 0.38 0.78 -0.21 0.00 0.00 178.00 179.70 1bvn h GLY 205 N 0.05 0.84 0.89 -0.55 0.00 -1.94 -1.09 103.07 101.28 1bvn h GLY 205 Ca 0.59 -0.32 -0.10 0.00 0.00 0.00 0.00 47.33 47.50 1bvn h GLY 205 CO -0.84 0.32 -0.25 -0.55 0.00 0.00 0.00 176.54 175.22 1bvn h ASP 206 N 0.81 0.63 0.47 0.19 3.32 -1.32 0.35 116.42 120.86 1bvn h ASP 206 Ca 0.22 -0.48 -0.10 0.00 0.02 0.00 0.00 57.03 56.69 1bvn h ASP 206 Cb -0.07 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.29 1bvn h ASP 206 CO -0.04 0.98 -0.45 0.16 -1.72 0.00 0.00 179.24 178.16 1bvn h ILE 207 N 0.28 1.31 -0.53 0.35 -0.00 -1.32 -2.26 117.51 115.34 1bvn h ILE 207 Ca 0.03 -1.56 -0.09 0.00 -0.00 0.00 0.00 64.86 63.24 1bvn h ILE 207 Cb 0.81 1.85 -0.02 0.00 -0.00 0.00 0.00 36.82 39.46 1bvn h ILE 207 CO 0.06 0.44 -0.01 0.50 -0.00 0.00 0.00 178.15 179.14 1bvn h LYS 208 N 0.00 0.94 -0.83 0.16 1.63 -0.94 0.53 116.57 118.05 1bvn h LYS 208 Ca -0.00 -0.30 0.00 0.00 -0.85 0.00 0.00 60.65 59.49 1bvn h LYS 208 Cb 0.81 -0.08 -0.04 0.00 -0.60 0.00 0.00 32.23 32.32 1bvn h LYS 208 CO 0.06 0.96 0.54 0.00 -3.45 0.00 0.00 179.45 177.55 1bvn h ALA 209 N 0.94 1.37 -0.18 5.00 0.00 -0.40 -1.40 119.26 124.58 1bvn h ALA 209 Ca 0.15 -0.07 -0.12 0.00 0.00 0.00 0.00 54.91 54.87 1bvn h ALA 209 Cb 0.55 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1bvn h ALA 209 CO 0.03 0.57 -0.34 0.28 0.00 0.00 0.00 179.25 179.79 1bvn h VAL 210 N 1.14 1.34 -0.38 0.00 2.07 -1.03 -3.15 116.25 116.23 1bvn h VAL 210 Ca 0.30 -1.57 0.02 0.00 0.82 0.00 0.00 66.70 66.27 1bvn h VAL 210 Cb -0.10 1.89 -0.02 0.00 -1.52 0.00 0.00 31.29 31.54 1bvn h VAL 210 CO -0.06 0.48 0.26 -0.07 0.02 0.00 0.00 177.57 178.19 1bvn h LEU 211 N 0.21 0.39 -1.94 2.57 3.38 -0.44 -1.78 115.31 117.70 1bvn h LEU 211 Ca 0.01 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1bvn h LEU 211 Cb 0.93 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.58 1bvn h LEU 211 CO 0.08 0.28 -0.10 0.44 0.09 0.00 0.00 178.44 179.23 1bvn h ASP 212 N 0.46 0.00 -0.77 -0.43 3.32 -1.22 -2.47 116.42 115.31 1bvn h ASP 212 Ca 0.15 0.00 -0.35 0.00 0.02 0.00 0.00 57.03 56.85 1bvn h ASP 212 Cb 0.03 0.00 -0.21 0.00 0.22 0.00 0.00 39.33 39.37 1bvn h ASP 212 CO -0.03 0.10 0.44 0.29 -1.72 0.00 0.00 179.24 178.32 1bvn n LYS 213 N -4.10 2.50 -4.00 3.56 5.02 -0.67 -4.94 118.16 115.52 1bvn n LYS 213 Ca -0.03 -2.55 -0.35 0.00 -2.02 0.00 0.00 58.31 53.36 1bvn n LYS 213 Cb 0.18 -2.02 -0.09 0.00 -0.02 0.00 0.00 35.03 33.08 1bvn n LYS 213 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1bvn s LEU 214 N -2.68 3.88 1.02 -0.35 1.43 -0.93 -4.90 118.68 116.14 1bvn s LEU 214 Ca 0.48 0.13 -0.14 0.00 -1.03 0.00 0.00 54.13 53.57 1bvn s LEU 214 Cb 0.39 -1.97 0.09 0.00 0.03 0.00 0.00 46.19 44.73 1bvn s LEU 214 CO 0.10 0.21 0.40 1.41 0.23 0.00 0.00 176.35 178.70 1bvn n HIS 215 N 3.27 -1.21 -1.91 0.29 8.25 -1.26 -4.98 115.22 117.68 1bvn n HIS 215 Ca -0.17 0.18 -0.31 0.00 -0.26 0.00 0.00 57.72 57.17 1bvn n HIS 215 Cb 0.53 -1.72 0.02 0.00 1.12 0.00 0.00 29.99 29.93 1bvn n HIS 215 CO 0.00 0.00 0.00 -0.80 0.64 0.00 0.00 176.34 176.18 1bvn s ASN 216 N -2.05 6.07 0.66 0.41 -0.87 -1.26 -4.59 114.94 113.31 1bvn s ASN 216 Ca 0.59 1.34 -0.16 0.00 -1.57 0.00 0.00 52.86 53.05 1bvn s ASN 216 Cb -0.19 -2.35 0.00 0.00 -0.02 0.00 0.00 41.25 38.70 1bvn s ASN 216 CO 0.66 -0.95 1.19 -0.76 -2.57 0.00 0.00 177.10 174.66 1bvn s LEU 217 N -5.20 3.47 -0.21 0.60 1.43 -0.76 -4.87 118.68 113.14 1bvn s LEU 217 Ca 0.55 2.30 -0.35 0.00 -1.03 0.00 0.00 54.13 55.60 1bvn s LEU 217 Cb -0.11 -4.59 -0.12 0.00 0.03 0.00 0.00 46.19 41.41 1bvn s LEU 217 CO 0.53 -1.87 1.99 -3.20 0.23 0.00 0.00 176.35 174.03 1bvn n ASN 218 N -2.22 2.86 0.00 2.29 5.15 -1.26 -4.78 115.26 117.31 1bvn n ASN 218 Ca 0.13 0.74 0.03 0.00 -0.60 0.00 0.00 54.58 54.88 1bvn n ASN 218 Cb 0.50 -1.32 0.18 0.00 -0.53 0.00 0.00 39.78 38.61 1bvn n ASN 218 CO 0.00 0.00 0.00 1.07 1.40 0.00 0.00 177.26 179.73 1bvn n THR 219 N 5.95 0.67 0.06 -0.44 5.66 -1.26 -1.48 114.28 123.45 1bvn n THR 219 Ca 0.30 0.17 -0.07 0.00 -3.05 0.00 0.00 64.05 61.39 1bvn n THR 219 Cb 0.26 -1.06 0.08 0.00 -1.55 0.00 0.00 70.33 68.07 1bvn n THR 219 CO 0.00 0.00 0.00 -1.13 -3.05 0.00 0.00 175.07 170.89 1bvn h ASN 220 N 0.00 0.38 0.00 1.09 -0.73 -1.98 -3.37 115.58 110.96 1bvn h ASN 220 Ca 0.00 -0.22 -0.05 0.00 1.87 0.00 0.00 56.30 57.90 1bvn h ASN 220 Cb 0.05 -0.11 -0.01 0.00 0.27 0.00 0.00 38.32 38.52 1bvn h ASN 220 CO 0.00 0.91 -1.20 0.79 -0.37 0.00 0.00 177.43 177.56 1bvn n TRP 221 N -3.87 0.00 -4.03 0.67 8.01 -0.87 -5.05 117.44 112.29 1bvn n TRP 221 Ca -0.03 0.00 -0.25 0.00 -1.31 0.00 0.00 57.50 55.91 1bvn n TRP 221 Cb 0.64 -0.14 -0.04 0.00 -2.01 0.00 0.00 31.31 29.76 1bvn n TRP 221 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.69 176.62 1bvn s PHE 222 N -2.09 3.27 0.57 -5.99 0.08 -0.55 -5.09 117.98 108.19 1bvn s PHE 222 Ca -0.01 0.02 -0.18 0.00 0.12 0.00 0.00 56.93 56.87 1bvn s PHE 222 Cb 0.01 -1.55 -0.04 0.00 -0.57 0.00 0.00 43.02 40.86 1bvn s PHE 222 CO 0.12 0.51 1.12 -1.25 -0.10 0.00 0.00 175.22 175.63 1bvn s PRO 223 N -3.27 3.21 0.64 0.24 0.04 -1.26 -4.28 135.00 130.32 1bvn s PRO 223 Ca 0.32 1.55 -0.17 0.00 0.04 0.00 0.00 61.00 62.74 1bvn s PRO 223 Cb -0.10 -1.99 -0.04 0.00 0.04 0.00 0.00 34.50 32.41 1bvn s PRO 223 CO 0.25 -0.95 0.91 0.00 0.04 0.00 0.00 177.00 177.26 1bvn n ALA 224 N -1.59 -0.09 -1.51 8.56 0.00 -1.26 -3.06 120.51 121.55 1bvn n ALA 224 Ca 0.11 -0.06 -0.05 0.00 0.00 0.00 0.00 53.44 53.44 1bvn n ALA 224 Cb 0.51 -2.08 -0.02 0.00 0.00 0.00 0.00 19.45 17.87 1bvn n ALA 224 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bvn n GLY 225 N 1.31 0.55 3.75 0.00 0.00 -1.26 -5.02 105.19 104.52 1bvn n GLY 225 Ca 0.13 -0.76 -0.39 0.00 0.00 0.00 0.00 46.02 45.00 1bvn n GLY 225 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1bvn s SER 226 N -2.87 7.15 -0.17 1.61 0.01 -1.17 -4.99 113.70 113.25 1bvn s SER 226 Ca 0.00 1.37 -0.10 0.00 1.31 0.00 0.00 55.95 58.53 1bvn s SER 226 Cb 0.00 -2.44 -0.05 0.00 0.21 0.00 0.00 66.02 63.75 1bvn s SER 226 CO 0.00 0.06 0.15 -0.13 0.41 0.00 0.00 173.24 173.73 1bvn s ARG 227 N -0.19 4.00 0.69 12.44 3.00 -1.26 -1.82 118.95 135.81 1bvn s ARG 227 Ca 0.36 -0.17 -0.16 0.00 0.00 0.00 0.00 55.73 55.76 1bvn s ARG 227 Cb -0.20 -3.36 -0.00 0.00 0.00 0.00 0.00 34.95 31.39 1bvn s ARG 227 CO 0.21 0.42 1.03 -0.35 0.00 0.00 0.00 175.30 176.61 1bvn n PRO 228 N 3.11 0.65 -2.73 3.54 -0.04 -1.26 -4.91 135.00 133.37 1bvn n PRO 228 Ca -0.17 0.28 -0.38 0.00 -0.04 0.00 0.00 63.50 63.19 1bvn n PRO 228 Cb 0.53 -2.27 -0.06 0.00 -0.04 0.00 0.00 33.50 31.66 1bvn n PRO 228 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 1bvn s PHE 229 N -1.71 3.68 -0.04 0.54 5.36 -0.13 -4.91 117.98 120.77 1bvn s PHE 229 Ca 0.75 1.78 -0.02 0.00 -0.96 0.00 0.00 56.93 58.49 1bvn s PHE 229 Cb -0.36 -2.98 0.03 0.00 -0.34 0.00 0.00 43.02 39.37 1bvn s PHE 229 CO 0.48 0.10 0.10 0.42 -1.46 0.00 0.00 175.22 174.86 1bvn s ILE 230 N -1.52 -0.04 -0.06 3.12 1.01 -1.26 -1.28 121.20 121.17 1bvn s ILE 230 Ca 0.49 0.15 -0.02 0.00 0.00 0.00 0.00 60.65 61.26 1bvn s ILE 230 Cb -0.21 -0.16 0.04 0.00 0.01 0.00 0.00 42.46 42.13 1bvn s ILE 230 CO 0.27 0.06 0.11 0.72 0.00 0.00 0.00 174.94 176.10 1bvn s PHE 231 N 0.86 -0.09 -0.20 3.97 -0.71 -1.08 -0.57 117.98 120.15 1bvn s PHE 231 Ca -0.07 0.42 -0.11 0.00 -1.04 0.00 0.00 56.93 56.13 1bvn s PHE 231 Cb -0.09 -0.25 -0.05 0.00 -1.21 0.00 0.00 43.02 41.42 1bvn s PHE 231 CO -0.04 -0.20 0.18 -0.65 -1.34 0.00 0.00 175.22 173.18 1bvn s GLN 232 N 1.75 4.19 -0.36 1.99 -0.21 0.18 -1.88 119.66 125.32 1bvn s GLN 232 Ca -0.02 -0.14 -0.29 0.00 0.02 0.00 0.00 55.36 54.93 1bvn s GLN 232 Cb -0.12 -3.44 0.00 0.00 1.00 0.00 0.00 33.01 30.45 1bvn s GLN 232 CO -0.05 0.24 1.40 -2.00 -2.12 0.00 0.00 175.29 172.76 1bvn s GLU 233 N 0.50 3.70 -0.09 2.91 2.12 -0.45 -2.34 118.70 125.04 1bvn s GLU 233 Ca 0.10 1.10 -0.01 0.00 0.36 0.00 0.00 54.97 56.52 1bvn s GLU 233 Cb -0.12 -3.98 0.03 0.00 0.26 0.00 0.00 34.13 30.32 1bvn s GLU 233 CO 0.00 -1.40 -0.02 0.08 -0.54 0.00 0.00 175.26 173.38 1bvn s VAL 234 N 5.09 0.57 -0.77 3.70 1.01 -1.26 -1.84 120.40 126.90 1bvn s VAL 234 Ca 0.61 -0.06 -0.19 0.00 0.00 0.00 0.00 61.98 62.33 1bvn s VAL 234 Cb -0.16 -0.72 0.12 0.00 0.00 0.00 0.00 36.38 35.62 1bvn s VAL 234 CO 0.29 0.24 0.95 -0.63 0.00 0.00 0.00 175.10 175.96 1bvn s ILE 235 N 1.89 4.73 -0.55 2.22 1.01 -1.26 -4.64 121.20 124.59 1bvn s ILE 235 Ca 0.04 -1.21 0.04 0.00 0.00 0.00 0.00 60.65 59.52 1bvn s ILE 235 Cb -0.13 -4.66 0.14 0.00 0.01 0.00 0.00 42.46 37.82 1bvn s ILE 235 CO -0.06 -1.36 0.30 -0.62 0.00 0.00 0.00 174.94 173.20 1bvn s ASP 236 N 3.52 4.45 -0.17 3.58 2.15 -1.26 -4.93 116.67 124.01 1bvn s ASP 236 Ca 0.24 -3.10 -0.17 0.00 0.43 0.00 0.00 52.55 49.95 1bvn s ASP 236 Cb -0.13 -1.66 -0.06 0.00 -0.30 0.00 0.00 42.92 40.77 1bvn s ASP 236 CO -0.01 -0.22 -0.33 0.18 -0.17 0.00 0.00 175.17 174.62 1bvn n LEU 237 N 3.00 1.88 0.00 -1.34 4.77 -1.26 -4.71 117.00 119.34 1bvn n LEU 237 Ca 0.07 0.32 0.00 0.00 -0.03 0.00 0.00 56.01 56.37 1bvn n LEU 237 Cb 0.33 -0.72 0.00 0.00 -2.33 0.00 0.00 43.42 40.70 1bvn n LEU 237 CO 0.33 -0.22 0.00 0.61 -1.33 0.00 0.00 177.39 176.78 1bvn n GLY 238 N 1.57 0.47 2.95 -0.72 0.00 -1.26 -5.03 105.19 103.17 1bvn n GLY 238 Ca -0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.55 1bvn n GLY 238 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1bvn s GLY 239 N 0.00 2.54 0.32 -0.02 0.00 -1.26 -5.08 107.32 103.81 1bvn s GLY 239 Ca 0.00 -3.37 0.10 0.00 0.00 0.00 0.00 44.72 41.44 1bvn s GLY 239 CO 0.00 1.03 -0.03 -0.54 0.00 0.00 0.00 173.10 173.55 1bvn s GLU 240 N -0.48 2.03 0.20 2.90 2.02 -1.26 -5.03 118.70 119.08 1bvn s GLU 240 Ca 0.18 -1.70 -0.11 0.00 0.02 0.00 0.00 54.97 53.36 1bvn s GLU 240 Cb -0.22 -1.93 0.23 0.00 0.10 0.00 0.00 34.13 32.31 1bvn s GLU 240 CO -0.03 0.21 1.72 0.00 0.02 0.00 0.00 175.26 177.19 1bvn h ALA 241 N 1.92 0.65 -2.66 5.21 0.00 -1.82 -3.39 119.26 119.16 1bvn h ALA 241 Ca -0.43 0.10 -0.58 0.00 0.00 0.00 0.00 54.91 54.01 1bvn h ALA 241 Cb 1.25 0.12 -0.08 0.00 0.00 0.00 0.00 17.79 19.09 1bvn h ALA 241 CO 0.65 -0.27 0.08 0.42 0.00 0.00 0.00 179.25 180.13 1bvn s ILE 242 N -6.12 5.05 -0.00 0.00 1.01 -1.26 -4.97 121.20 114.90 1bvn s ILE 242 Ca -0.13 1.26 0.01 0.00 0.00 0.00 0.00 60.65 61.79 1bvn s ILE 242 Cb 0.16 -3.97 -0.04 0.00 0.01 0.00 0.00 42.46 38.63 1bvn s ILE 242 CO 0.73 0.19 0.02 -0.44 0.00 0.00 0.00 174.94 175.45 1bvn s SER 243 N 0.96 5.28 0.58 3.58 0.01 -1.26 -4.90 113.70 117.95 1bvn s SER 243 Ca 0.32 0.04 0.30 0.00 1.31 0.00 0.00 55.95 57.91 1bvn s SER 243 Cb -0.16 -1.42 1.76 0.00 0.21 0.00 0.00 66.02 66.41 1bvn s SER 243 CO 0.13 0.28 2.22 0.77 0.41 0.00 0.00 173.24 177.05 1bvn h SER 244 N 4.27 0.00 0.10 2.44 4.64 -1.93 -2.63 113.55 120.44 1bvn h SER 244 Ca -0.49 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.82 1bvn h SER 244 Cb 1.18 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1bvn h SER 244 CO 0.59 0.03 -0.05 0.77 -0.87 0.00 0.00 176.83 177.30 1bvn h SER 245 N 0.00 0.00 -0.09 4.97 4.64 -2.01 -2.51 113.55 118.55 1bvn h SER 245 Ca -0.00 0.00 0.03 0.00 -0.47 0.00 0.00 61.79 61.35 1bvn h SER 245 Cb 0.08 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.16 1bvn h SER 245 CO 0.00 0.05 0.09 -0.33 -0.87 0.00 0.00 176.83 175.78 1bvn h GLU 246 N 0.00 0.00 -0.44 4.77 5.08 -1.90 -2.26 114.58 119.83 1bvn h GLU 246 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1bvn h GLU 246 Cb 0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.36 1bvn h GLU 246 CO 0.01 0.00 0.00 0.66 -1.00 0.00 0.00 179.01 178.68 1bvn n TYR 247 N -3.89 0.57 0.24 4.33 4.02 -0.94 -4.38 117.16 117.10 1bvn n TYR 247 Ca -0.01 -0.30 0.12 0.00 -0.01 0.00 0.00 57.90 57.70 1bvn n TYR 247 Cb 0.20 -0.00 0.60 0.00 -0.02 0.00 0.00 39.34 40.11 1bvn n TYR 247 CO 0.00 0.00 0.00 0.74 -1.01 0.00 0.00 176.86 176.59 1bvn h PHE 248 N 4.30 0.00 0.00 -0.72 0.04 -1.53 -1.18 116.94 117.85 1bvn h PHE 248 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1bvn h PHE 248 Cb 0.97 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.12 1bvn h PHE 248 CO 0.29 0.00 -0.15 0.41 -0.60 0.00 0.00 178.31 178.26 1bvn n GLY 249 N -0.92 -1.56 0.10 -1.45 0.00 -1.26 -3.90 105.19 96.20 1bvn n GLY 249 Ca -0.01 -0.11 -0.12 0.00 0.00 0.00 0.00 46.02 45.78 1bvn n GLY 249 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1bvn n ASN 250 N -1.96 0.72 0.00 1.61 3.02 -0.45 -5.08 115.26 113.11 1bvn n ASN 250 Ca 0.06 0.07 0.00 0.00 -0.03 0.00 0.00 54.58 54.68 1bvn n ASN 250 Cb 0.40 0.37 0.00 0.00 -0.61 0.00 0.00 39.78 39.94 1bvn n ASN 250 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1bvn n GLY 251 N 1.83 -0.52 3.78 7.41 0.00 -1.20 -4.87 105.19 111.62 1bvn n GLY 251 Ca -0.32 -0.93 -0.30 0.00 0.00 0.00 0.00 46.02 44.46 1bvn n GLY 251 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bvn s ARG 252 N -1.51 2.16 0.02 1.61 0.52 0.26 -4.10 118.95 117.91 1bvn s ARG 252 Ca 0.00 0.88 0.02 0.00 -0.52 0.00 0.00 55.73 56.11 1bvn s ARG 252 Cb 0.00 -1.91 -0.02 0.00 0.52 0.00 0.00 34.95 33.55 1bvn s ARG 252 CO 0.00 -1.63 -0.08 0.08 0.02 0.00 0.00 175.30 173.69 1bvn s VAL 253 N -3.02 0.60 0.04 3.52 1.01 0.80 0.49 120.40 123.83 1bvn s VAL 253 Ca 0.61 -0.71 -0.30 0.00 0.00 0.00 0.00 61.98 61.57 1bvn s VAL 253 Cb -0.16 -0.58 -0.07 0.00 0.00 0.00 0.00 36.38 35.58 1bvn s VAL 253 CO 0.55 -0.10 1.47 0.42 0.00 0.00 0.00 175.10 177.44 1bvn s THR 254 N -0.76 3.46 -1.01 3.92 -4.23 -0.99 -0.56 115.64 115.47 1bvn s THR 254 Ca -0.03 0.91 -0.10 0.00 -1.18 0.00 0.00 61.69 61.28 1bvn s THR 254 Cb -0.06 -3.58 0.26 0.00 1.34 0.00 0.00 72.50 70.45 1bvn s THR 254 CO 0.00 0.01 0.99 -0.70 -0.54 0.00 0.00 174.62 174.38 1bvn s GLU 255 N 2.25 3.98 0.00 3.99 2.56 -0.68 -4.53 118.70 126.26 1bvn s GLU 255 Ca 0.67 -2.98 0.06 0.00 0.00 0.00 0.00 54.97 52.71 1bvn s GLU 255 Cb -0.34 -4.50 0.27 0.00 2.00 0.00 0.00 34.13 31.56 1bvn s GLU 255 CO 0.29 -1.26 1.06 1.19 -0.56 0.00 0.00 175.26 175.98 1bvn n PHE 256 N 3.10 0.00 -0.04 5.30 3.01 -1.26 -1.93 117.46 125.64 1bvn n PHE 256 Ca 0.20 0.00 -0.16 0.00 1.01 0.00 0.00 57.45 58.50 1bvn n PHE 256 Cb 0.42 -0.34 -0.07 0.00 -0.01 0.00 0.00 39.48 39.48 1bvn n PHE 256 CO 0.00 0.00 0.00 -0.22 1.01 0.00 0.00 176.76 177.55 1bvn h LYS 257 N 0.00 0.65 -0.22 -1.08 3.64 -1.88 -3.25 116.57 114.43 1bvn h LYS 257 Ca 0.00 -0.49 0.03 0.00 -1.27 0.00 0.00 60.65 58.91 1bvn h LYS 257 Cb 0.06 0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 31.93 1bvn h LYS 257 CO 0.00 1.11 -0.29 -0.92 -2.27 0.00 0.00 179.45 177.09 1bvn h TYR 258 N 0.32 -0.87 0.00 1.91 5.03 -1.73 -1.63 116.97 120.00 1bvn h TYR 258 Ca -0.03 0.04 -0.03 0.00 2.58 0.00 0.00 58.73 61.30 1bvn h TYR 258 Cb 1.19 0.41 -0.00 0.00 1.55 0.00 0.00 36.73 39.87 1bvn h TYR 258 CO 0.10 -0.25 -0.14 0.78 -1.32 0.00 0.00 178.16 177.33 1bvn h GLY 259 N -0.20 0.00 0.90 1.82 0.00 -1.70 0.12 103.07 104.01 1bvn h GLY 259 Ca 0.04 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.33 1bvn h GLY 259 CO -0.31 0.00 -0.36 0.00 0.00 0.00 0.00 176.54 175.87 1bvn h ALA 260 N 1.86 -1.01 -0.30 3.60 0.00 -1.46 -1.58 119.26 120.38 1bvn h ALA 260 Ca -0.00 -0.23 -0.13 0.00 0.00 0.00 0.00 54.91 54.55 1bvn h ALA 260 Cb 0.25 0.39 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 1bvn h ALA 260 CO 0.02 -1.01 -0.36 0.87 0.00 0.00 0.00 179.25 178.77 1bvn h LYS 261 N -1.12 0.67 -0.63 0.00 1.57 -1.18 -2.52 116.57 113.35 1bvn h LYS 261 Ca -0.10 -0.32 -0.06 0.00 -1.87 0.00 0.00 60.65 58.30 1bvn h LYS 261 Cb 0.79 -0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.07 1bvn h LYS 261 CO 0.17 0.92 0.17 1.25 -0.57 0.00 0.00 179.45 181.39 1bvn h LEU 262 N 0.56 0.91 -0.56 2.94 6.46 -0.78 -2.32 115.31 122.53 1bvn h LEU 262 Ca 0.06 -0.17 -0.03 0.00 -0.12 0.00 0.00 57.88 57.62 1bvn h LEU 262 Cb 0.87 -0.24 -0.00 0.00 -0.73 0.00 0.00 40.66 40.56 1bvn h LEU 262 CO 0.08 0.87 -0.13 1.23 -0.62 0.00 0.00 178.44 179.87 1bvn h GLY 263 N 1.04 0.00 1.71 3.75 0.00 -1.20 -2.17 103.07 106.20 1bvn h GLY 263 Ca 0.20 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.34 1bvn h GLY 263 CO -0.00 0.00 -0.81 -0.84 0.00 0.00 0.00 176.54 174.89 1bvn h THR 264 N 0.00 1.44 0.01 4.70 2.02 -0.98 -2.56 112.91 117.53 1bvn h THR 264 Ca -0.00 -2.39 -0.06 0.00 0.77 0.00 0.00 66.41 64.73 1bvn h THR 264 Cb 0.90 2.31 0.01 0.00 -1.74 0.00 0.00 68.15 69.63 1bvn h THR 264 CO 0.02 0.70 -0.24 0.58 0.37 0.00 0.00 175.52 176.95 1bvn h VAL 265 N 0.17 1.57 0.00 3.16 2.07 -1.32 0.16 116.25 122.06 1bvn h VAL 265 Ca -0.04 -2.00 0.00 0.00 0.82 0.00 0.00 66.70 65.48 1bvn h VAL 265 Cb 1.41 2.84 0.00 0.00 -1.52 0.00 0.00 31.29 34.02 1bvn h VAL 265 CO 0.13 0.54 0.00 0.58 0.02 0.00 0.00 177.57 178.84 1bvn h VAL 266 N -0.56 0.00 -0.00 2.57 2.07 -1.47 0.29 116.25 119.15 1bvn h VAL 266 Ca -0.03 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 67.21 1bvn h VAL 266 Cb 1.02 1.13 0.00 0.00 -1.52 0.00 0.00 31.29 31.92 1bvn h VAL 266 CO 0.05 0.00 -0.62 0.54 0.02 0.00 0.00 177.57 177.56 1bvn n ARG 267 N -2.74 0.32 -1.88 1.57 1.74 -0.96 -4.92 116.66 109.79 1bvn n ARG 267 Ca 0.00 -0.23 -0.19 0.00 -0.77 0.00 0.00 57.85 56.66 1bvn n ARG 267 Cb 0.21 -1.50 -0.06 0.00 -1.02 0.00 0.00 32.46 30.10 1bvn n ARG 267 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1bvn n LYS 268 N -1.14 -1.56 -1.86 5.56 5.02 0.10 -4.96 118.16 119.33 1bvn n LYS 268 Ca 0.07 1.06 -0.29 0.00 -2.02 0.00 0.00 58.31 57.13 1bvn n LYS 268 Cb 0.36 -5.53 0.08 0.00 -0.02 0.00 0.00 35.03 29.91 1bvn n LYS 268 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 1bvn s TRP 269 N -2.76 3.00 -1.19 2.13 0.51 -0.03 -4.36 118.94 116.24 1bvn s TRP 269 Ca 0.00 0.84 -0.34 0.00 -2.12 0.00 0.00 56.10 54.48 1bvn s TRP 269 Cb 0.00 -3.38 0.05 0.00 -0.81 0.00 0.00 33.47 29.33 1bvn s TRP 269 CO 0.00 -1.69 0.67 0.43 -0.51 0.00 0.00 176.95 175.85 1bvn n SER 270 N -3.29 -4.07 0.00 2.95 7.64 -1.26 -1.79 113.62 113.80 1bvn n SER 270 Ca 0.08 -1.29 0.00 0.00 1.01 0.00 0.00 58.87 58.66 1bvn n SER 270 Cb 0.60 -1.56 0.00 0.00 -1.01 0.00 0.00 64.21 62.23 1bvn n SER 270 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1bvn n GLY 271 N -2.09 0.00 3.74 0.23 0.00 -1.26 -4.93 105.19 100.89 1bvn n GLY 271 Ca -0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.49 1bvn n GLY 271 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1bvn s GLU 272 N -0.38 4.58 0.19 1.61 2.56 -0.74 -5.05 118.70 121.46 1bvn s GLU 272 Ca 0.00 1.79 0.11 0.00 0.00 0.00 0.00 54.97 56.87 1bvn s GLU 272 Cb 0.00 -3.24 -0.04 0.00 2.00 0.00 0.00 34.13 32.85 1bvn s GLU 272 CO 0.00 0.06 -0.24 0.15 -0.56 0.00 0.00 175.26 174.68 1bvn s LYS 273 N -0.65 1.49 0.24 4.30 1.02 -1.26 -4.33 119.74 120.55 1bvn s LYS 273 Ca 0.49 -1.51 -0.06 0.00 0.02 0.00 0.00 55.97 54.90 1bvn s LYS 273 Cb -0.31 -1.80 0.30 0.00 -0.52 0.00 0.00 37.83 35.50 1bvn s LYS 273 CO 0.37 0.39 1.87 0.52 -0.92 0.00 0.00 175.35 177.58 1bvn h MET 274 N 3.21 1.04 -0.75 1.68 2.86 -1.77 -2.50 114.93 118.70 1bvn h MET 274 Ca -0.46 -0.06 0.22 0.00 -2.06 0.00 0.00 59.70 57.33 1bvn h MET 274 Cb 1.21 -0.23 -0.03 0.00 0.06 0.00 0.00 31.60 32.60 1bvn h MET 274 CO 0.48 0.69 0.77 0.66 1.06 0.00 0.00 176.91 180.57 1bvn h SER 275 N 1.07 0.00 0.24 1.22 4.64 -1.66 0.53 113.55 119.59 1bvn h SER 275 Ca 0.36 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.68 1bvn h SER 275 Cb 0.06 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.15 1bvn h SER 275 CO -0.14 0.00 -0.01 1.88 -0.87 0.00 0.00 176.83 177.69 1bvn h TYR 276 N 0.00 0.00 0.00 4.77 0.05 -1.72 -3.12 116.97 116.96 1bvn h TYR 276 Ca 0.36 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.14 1bvn h TYR 276 Cb 1.89 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.63 1bvn h TYR 276 CO 0.00 0.01 0.00 1.28 -1.05 0.00 0.00 178.16 178.40 1bvn n LEU 277 N -3.20 0.00 0.21 3.88 4.77 0.18 -3.05 117.00 119.79 1bvn n LEU 277 Ca -0.02 0.00 0.15 0.00 -0.03 0.00 0.00 56.01 56.11 1bvn n LEU 277 Cb 0.13 0.00 0.69 0.00 -2.33 0.00 0.00 43.42 41.92 1bvn n LEU 277 CO 0.23 0.00 0.94 0.50 -1.33 0.00 0.00 177.39 177.73 1bvn h LYS 278 N 0.00 0.00 0.00 3.23 3.64 -1.78 -0.89 116.57 120.76 1bvn h LYS 278 Ca 0.00 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.31 1bvn h LYS 278 Cb 0.00 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.81 1bvn h LYS 278 CO 0.00 0.00 -1.36 0.09 -2.27 0.00 0.00 179.45 175.91 1bvn n ASN 279 N -2.57 0.68 -0.74 4.20 4.13 -1.17 -5.04 115.26 114.76 1bvn n ASN 279 Ca -0.00 0.28 -0.08 0.00 1.68 0.00 0.00 54.58 56.46 1bvn n ASN 279 Cb 0.16 0.62 -0.00 0.00 -1.54 0.00 0.00 39.78 39.02 1bvn n ASN 279 CO 0.00 0.00 0.00 1.87 0.28 0.00 0.00 177.26 179.41 1bvn n TRP 280 N -2.68 -0.26 0.00 3.10 -0.00 -0.34 -3.45 117.44 113.81 1bvn n TRP 280 Ca -0.05 0.13 0.00 0.00 -0.00 0.00 0.00 57.50 57.58 1bvn n TRP 280 Cb 0.67 -0.31 0.00 0.00 -0.00 0.00 0.00 31.31 31.67 1bvn n TRP 280 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1bvn n GLY 281 N 0.38 0.90 0.00 5.87 0.00 -1.26 -4.40 105.19 106.68 1bvn n GLY 281 Ca 0.02 -1.45 0.08 0.00 0.00 0.00 0.00 46.02 44.67 1bvn n GLY 281 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1bvn n GLU 282 N 0.00 0.21 0.00 1.61 1.02 -1.26 -2.53 120.64 119.69 1bvn n GLU 282 Ca 0.00 0.14 0.14 0.00 -0.02 0.00 0.00 57.16 57.42 1bvn n GLU 282 Cb 0.00 -1.50 0.65 0.00 -0.02 0.00 0.00 31.44 30.57 1bvn n GLU 282 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1bvn n GLY 283 N 0.04 -1.31 1.20 0.62 0.00 -1.22 -3.38 105.19 101.13 1bvn n GLY 283 Ca 0.07 -0.16 0.08 0.00 0.00 0.00 0.00 46.02 46.01 1bvn n GLY 283 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1bvn n TRP 284 N -1.33 1.24 -2.02 1.61 7.02 -1.05 -4.93 117.44 117.97 1bvn n TRP 284 Ca 0.11 -0.75 -0.03 0.00 -1.02 0.00 0.00 57.50 55.81 1bvn n TRP 284 Cb 0.29 -0.31 -0.00 0.00 -2.42 0.00 0.00 31.31 28.86 1bvn n TRP 284 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1bvn n GLY 285 N 0.14 0.26 3.92 6.99 0.00 -1.22 -5.05 105.19 110.24 1bvn n GLY 285 Ca 0.22 -0.78 -0.27 0.00 0.00 0.00 0.00 46.02 45.20 1bvn n GLY 285 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1bvn s PHE 286 N -2.14 3.48 1.07 1.61 0.40 -1.25 -5.07 117.98 116.08 1bvn s PHE 286 Ca 0.00 0.42 -0.12 0.00 -0.60 0.00 0.00 56.93 56.63 1bvn s PHE 286 Cb 0.00 -1.93 0.23 0.00 0.51 0.00 0.00 43.02 41.84 1bvn s PHE 286 CO 0.00 0.28 1.07 0.00 0.70 0.00 0.00 175.22 177.26 1bvn s MET 287 N -3.58 -0.20 0.32 0.44 0.23 -1.26 -4.58 119.30 110.67 1bvn s MET 287 Ca 0.40 1.05 -0.29 0.00 -1.03 0.00 0.00 55.69 55.82 1bvn s MET 287 Cb -0.11 -1.62 -0.11 0.00 -1.53 0.00 0.00 34.83 31.46 1bvn s MET 287 CO 0.30 -3.30 1.49 -2.14 -2.03 0.00 0.00 175.02 169.34 1bvn s PRO 288 N -4.55 4.18 0.30 3.16 0.02 -1.26 -4.66 135.00 132.18 1bvn s PRO 288 Ca 0.68 2.47 0.04 0.00 0.02 0.00 0.00 61.00 64.21 1bvn s PRO 288 Cb -0.24 -3.03 0.79 0.00 0.02 0.00 0.00 34.50 32.05 1bvn s PRO 288 CO 0.62 -0.50 1.62 1.03 -0.33 0.00 0.00 177.00 179.44 1bvn h SER 289 N 4.03 -0.08 0.00 2.53 0.87 -1.95 0.34 113.55 119.29 1bvn h SER 289 Ca -0.48 0.22 0.00 0.00 -1.23 0.00 0.00 61.79 60.30 1bvn h SER 289 Cb 1.23 0.32 0.00 0.00 -0.44 0.00 0.00 62.40 63.51 1bvn h SER 289 CO 0.72 -0.23 0.00 -0.90 -0.53 0.00 0.00 176.83 175.88 1bvn n ASP 290 N -5.29 0.00 0.00 6.23 5.68 -1.26 -1.85 116.55 120.06 1bvn n ASP 290 Ca 0.24 -0.29 0.00 0.00 -0.50 0.00 0.00 54.79 54.24 1bvn n ASP 290 Cb 0.77 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.75 1bvn n ASP 290 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1bvn n ARG 291 N -0.78 -0.14 -3.56 0.11 5.12 0.10 -0.84 116.66 116.67 1bvn n ARG 291 Ca 0.03 -0.16 -0.37 0.00 -1.93 0.00 0.00 57.85 55.42 1bvn n ARG 291 Cb 0.01 -0.63 -0.07 0.00 -1.16 0.00 0.00 32.46 30.61 1bvn n ARG 291 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1bvn s ALA 292 N -0.02 3.64 -0.25 7.54 0.00 -0.77 -0.14 121.76 131.76 1bvn s ALA 292 Ca 0.00 -0.43 -0.10 0.00 0.00 0.00 0.00 51.96 51.43 1bvn s ALA 292 Cb 0.00 -2.35 -0.05 0.00 0.00 0.00 0.00 23.12 20.72 1bvn s ALA 292 CO 0.00 0.21 0.15 -1.17 0.00 0.00 0.00 175.76 174.95 1bvn s LEU 293 N 0.05 3.99 0.07 0.00 2.96 0.27 -2.10 118.68 123.93 1bvn s LEU 293 Ca 0.18 0.04 0.08 0.00 -0.22 0.00 0.00 54.13 54.21 1bvn s LEU 293 Cb -0.14 -2.08 -0.04 0.00 0.50 0.00 0.00 46.19 44.44 1bvn s LEU 293 CO 0.06 0.04 -0.17 -0.69 -1.32 0.00 0.00 176.35 174.26 1bvn s VAL 294 N 1.23 2.88 -0.02 1.68 1.01 0.98 -1.69 120.40 126.46 1bvn s VAL 294 Ca 0.07 -1.30 -0.29 0.00 0.00 0.00 0.00 61.98 60.45 1bvn s VAL 294 Cb -0.14 -2.27 0.10 0.00 0.00 0.00 0.00 36.38 34.08 1bvn s VAL 294 CO 0.06 0.23 0.91 0.72 0.00 0.00 0.00 175.10 177.02 1bvn s PHE 295 N -1.03 -0.33 -0.25 5.22 -0.12 -1.26 -0.93 117.98 119.28 1bvn s PHE 295 Ca 0.16 0.21 -0.16 0.00 -0.05 0.00 0.00 56.93 57.09 1bvn s PHE 295 Cb -0.11 0.54 -0.13 0.00 -0.63 0.00 0.00 43.02 42.69 1bvn s PHE 295 CO 0.08 -0.52 -0.20 0.28 -0.05 0.00 0.00 175.22 174.80 1bvn n VAL 296 N -0.23 1.52 0.00 -2.49 0.31 -1.26 -3.64 118.33 112.55 1bvn n VAL 296 Ca -0.08 -0.22 0.00 0.00 -0.01 0.00 0.00 64.34 64.02 1bvn n VAL 296 Cb 0.61 -1.98 0.00 0.00 -0.91 0.00 0.00 33.84 31.56 1bvn n VAL 296 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1bvn n ASP 297 N -4.33 0.00 -0.06 4.52 2.03 -1.26 -4.59 116.55 112.86 1bvn n ASP 297 Ca -0.44 0.00 0.00 0.00 0.52 0.00 0.00 54.79 54.87 1bvn n ASP 297 Cb 0.78 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.18 1bvn n ASP 297 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 1bvn n ASN 298 N 0.00 -1.01 0.33 1.67 4.05 -1.26 -4.10 115.26 114.93 1bvn n ASN 298 Ca 0.00 0.05 0.21 0.00 0.45 0.00 0.00 54.58 55.29 1bvn n ASN 298 Cb 0.00 0.79 1.12 0.00 1.23 0.00 0.00 39.78 42.91 1bvn n ASN 298 CO 0.00 0.00 0.00 1.12 -3.05 0.00 0.00 177.26 175.33 1bvn h HIS 299 N 0.05 0.00 0.00 1.20 2.07 -1.98 -2.45 115.15 114.03 1bvn h HIS 299 Ca 0.00 0.00 -0.09 0.00 -2.85 0.00 0.00 60.37 57.43 1bvn h HIS 299 Cb 0.01 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 29.98 1bvn h HIS 299 CO 0.00 0.00 -0.83 -0.25 -3.07 0.00 0.00 177.93 173.78 1bvn n ASP 300 N -3.19 1.83 -0.24 3.10 9.92 -1.26 -4.49 116.55 122.23 1bvn n ASP 300 Ca -0.03 0.55 0.04 0.00 -0.53 0.00 0.00 54.79 54.82 1bvn n ASP 300 Cb 0.12 -0.90 0.15 0.00 -0.64 0.00 0.00 41.12 39.86 1bvn n ASP 300 CO 0.00 0.00 0.00 0.78 0.13 0.00 0.00 177.20 178.11 1bvn h ASN 301 N -1.00 -0.25 -0.31 -2.24 2.35 -1.72 -2.41 115.58 110.00 1bvn h ASN 301 Ca -0.13 0.18 0.09 0.00 -0.55 0.00 0.00 56.30 55.88 1bvn h ASN 301 Cb 0.82 0.30 -0.01 0.00 0.05 0.00 0.00 38.32 39.47 1bvn h ASN 301 CO -0.08 -0.14 0.34 0.06 -1.65 0.00 0.00 177.43 175.96 1bvn h GLN 302 N 0.14 0.00 -0.28 0.81 3.07 -1.59 -1.71 115.11 115.55 1bvn h GLN 302 Ca 0.39 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.13 1bvn h GLN 302 Cb 0.68 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.24 1bvn h GLN 302 CO -0.60 0.00 0.00 0.54 0.09 0.00 0.00 178.83 178.86 1bvn n ARG 303 N -3.76 1.29 0.00 0.06 5.12 -0.91 -4.95 116.66 113.51 1bvn n ARG 303 Ca 0.05 -0.37 0.00 0.00 -1.93 0.00 0.00 57.85 55.60 1bvn n ARG 303 Cb 0.49 -1.19 0.00 0.00 -1.16 0.00 0.00 32.46 30.60 1bvn n ARG 303 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1bvn n GLY 304 N 0.54 1.97 1.44 -0.13 0.00 -0.64 -4.58 105.19 103.77 1bvn n GLY 304 Ca 0.03 -0.45 -0.05 0.00 0.00 0.00 0.00 46.02 45.56 1bvn n GLY 304 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1bvn n HIS 305 N 0.00 0.48 -2.44 1.61 8.25 -1.26 -3.77 115.22 118.09 1bvn n HIS 305 Ca 0.00 -1.05 0.00 0.00 -0.26 0.00 0.00 57.72 56.41 1bvn n HIS 305 Cb 0.00 -0.52 0.00 0.00 1.12 0.00 0.00 29.99 30.59 1bvn n HIS 305 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1bvn n GLY 306 N 0.75 1.13 3.56 -1.41 0.00 -1.26 -4.85 105.19 103.11 1bvn n GLY 306 Ca 0.09 -2.01 -0.28 0.00 0.00 0.00 0.00 46.02 43.83 1bvn n GLY 306 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bvn s ALA 307 N -2.53 1.60 0.00 4.61 0.00 -1.26 -0.16 121.76 124.02 1bvn s ALA 307 Ca 0.00 -1.07 0.00 0.00 0.00 0.00 0.00 51.96 50.89 1bvn s ALA 307 Cb 0.00 -4.49 0.00 0.00 0.00 0.00 0.00 23.12 18.63 1bvn s ALA 307 CO 0.00 -4.78 0.00 0.41 0.00 0.00 0.00 175.76 171.39 1bvn n GLY 308 N 6.52 1.24 7.00 0.00 0.00 -1.26 -4.83 105.19 113.85 1bvn n GLY 308 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.39 1bvn n GLY 308 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bvn n GLY 309 N 0.00 4.17 0.01 -0.02 0.00 0.77 -2.39 105.19 107.72 1bvn n GLY 309 Ca 0.00 0.08 0.13 0.00 0.00 0.00 0.00 46.02 46.23 1bvn n GLY 309 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1bvn n SER 310 N 7.75 0.19 0.11 1.61 3.41 -1.25 -3.79 113.62 121.65 1bvn n SER 310 Ca 0.00 0.30 -0.04 0.00 -0.26 0.00 0.00 58.87 58.87 1bvn n SER 310 Cb 0.00 -0.31 0.11 0.00 -0.26 0.00 0.00 64.21 63.75 1bvn n SER 310 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1bvn h SER 311 N 0.00 0.13 -2.27 4.04 0.02 -1.82 -3.45 113.55 110.19 1bvn h SER 311 Ca 0.00 -0.08 -0.59 0.00 -0.84 0.00 0.00 61.79 60.27 1bvn h SER 311 Cb 0.52 -0.04 0.06 0.00 0.14 0.00 0.00 62.40 63.08 1bvn h SER 311 CO 0.00 0.77 0.73 -0.38 -1.14 0.00 0.00 176.83 176.80 1bvn n ILE 312 N -3.78 0.16 -3.57 3.27 -0.00 -1.25 -4.38 119.36 109.82 1bvn n ILE 312 Ca -0.02 -0.04 -0.37 0.00 -0.00 0.00 0.00 62.75 62.32 1bvn n ILE 312 Cb 0.66 -1.44 -0.06 0.00 -0.00 0.00 0.00 39.64 38.80 1bvn n ILE 312 CO 0.00 0.00 0.00 -0.76 -0.00 0.00 0.00 176.55 175.79 1bvn s LEU 313 N 0.72 4.43 0.00 1.39 1.43 -1.26 -4.99 118.68 120.40 1bvn s LEU 313 Ca 0.78 0.86 0.01 0.00 -1.03 0.00 0.00 54.13 54.74 1bvn s LEU 313 Cb -0.70 -2.62 -0.00 0.00 0.03 0.00 0.00 46.19 42.89 1bvn s LEU 313 CO 0.41 0.30 0.02 0.41 0.23 0.00 0.00 176.35 177.72 1bvn n THR 314 N 1.61 0.00 0.48 5.49 -1.04 -1.26 -4.39 114.28 115.17 1bvn n THR 314 Ca -0.13 -0.26 0.11 0.00 -2.04 0.00 0.00 64.05 61.72 1bvn n THR 314 Cb 0.53 0.10 0.44 0.00 -1.82 0.00 0.00 70.33 69.58 1bvn n THR 314 CO 0.00 0.00 0.00 2.22 -0.64 0.00 0.00 175.07 176.65 1bvn n PHE 315 N -0.10 0.57 0.23 -1.42 1.16 -1.26 -2.33 117.46 114.32 1bvn n PHE 315 Ca -0.00 0.22 0.11 0.00 -1.87 0.00 0.00 57.45 55.91 1bvn n PHE 315 Cb 0.07 -0.85 0.50 0.00 -1.61 0.00 0.00 39.48 37.59 1bvn n PHE 315 CO 0.00 0.00 0.00 -1.49 -1.87 0.00 0.00 176.76 173.40 1bvn h TRP 316 N 0.00 0.00 -0.76 2.97 4.06 -1.98 -2.68 115.95 117.56 1bvn h TRP 316 Ca 0.00 0.00 -0.48 0.00 2.06 0.00 0.00 58.89 60.47 1bvn h TRP 316 Cb 0.38 0.00 -0.27 0.00 -1.00 0.00 0.00 29.16 28.27 1bvn h TRP 316 CO 0.00 0.18 0.19 -0.25 -3.56 0.00 0.00 178.44 175.00 1bvn n ASP 317 N -3.34 4.91 -0.03 -3.49 8.00 -0.99 -4.88 116.55 116.73 1bvn n ASP 317 Ca 0.00 -3.75 0.01 0.00 0.71 0.00 0.00 54.79 51.75 1bvn n ASP 317 Cb 0.40 -0.72 0.02 0.00 -0.02 0.00 0.00 41.12 40.80 1bvn n ASP 317 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1bvn n ALA 318 N -0.97 0.03 -0.45 2.24 0.00 -1.01 -1.14 120.51 119.21 1bvn n ALA 318 Ca 0.50 0.09 0.00 0.00 0.00 0.00 0.00 53.44 54.02 1bvn n ALA 318 Cb 1.01 -0.06 0.00 0.00 0.00 0.00 0.00 19.45 20.40 1bvn n ALA 318 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1bvn n ARG 319 N -3.99 0.00 -0.00 0.00 0.00 -1.26 -1.17 116.66 110.24 1bvn n ARG 319 Ca 0.02 0.36 0.05 0.00 -0.00 0.00 0.00 57.85 58.28 1bvn n ARG 319 Cb 0.05 -1.28 0.45 0.00 0.00 0.00 0.00 32.46 31.68 1bvn n ARG 319 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.63 177.56 1bvn h LEU 320 N 0.00 0.43 -0.44 6.15 3.38 -1.61 -2.08 115.31 121.15 1bvn h LEU 320 Ca 0.00 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.97 1bvn h LEU 320 Cb 0.00 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 1bvn h LEU 320 CO 0.00 0.30 0.28 0.22 0.09 0.00 0.00 178.44 179.34 1bvn h TYR 321 N 0.51 0.53 -0.51 1.13 3.20 -1.11 0.54 116.97 121.26 1bvn h TYR 321 Ca 0.16 0.01 -0.04 0.00 3.14 0.00 0.00 58.73 62.01 1bvn h TYR 321 Cb 0.04 -0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.11 1bvn h TYR 321 CO -0.00 0.33 0.17 0.87 -1.64 0.00 0.00 178.16 177.89 1bvn h LYS 322 N 0.58 0.74 -0.07 1.82 1.57 -0.45 0.65 116.57 121.41 1bvn h LYS 322 Ca 0.16 -0.12 -0.08 0.00 -1.87 0.00 0.00 60.65 58.74 1bvn h LYS 322 Cb -0.05 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.12 1bvn h LYS 322 CO -0.05 0.64 -0.32 0.28 -0.57 0.00 0.00 179.45 179.43 1bvn h VAL 323 N 0.73 1.25 0.13 0.50 2.07 -0.95 0.16 116.25 120.15 1bvn h VAL 323 Ca 0.17 -1.21 -0.18 0.00 0.82 0.00 0.00 66.70 66.30 1bvn h VAL 323 Cb 0.20 1.56 0.02 0.00 -1.52 0.00 0.00 31.29 31.55 1bvn h VAL 323 CO -0.01 0.36 -0.77 0.00 0.02 0.00 0.00 177.57 177.17 1bvn h ALA 324 N 1.56 -0.08 -0.08 1.67 0.00 0.73 -2.74 119.26 120.32 1bvn h ALA 324 Ca 0.02 -0.68 -0.08 0.00 0.00 0.00 0.00 54.91 54.16 1bvn h ALA 324 Cb 0.63 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 1bvn h ALA 324 CO 0.05 0.36 -0.31 0.28 0.00 0.00 0.00 179.25 179.63 1bvn h VAL 325 N -0.39 1.25 0.70 0.00 2.07 0.30 -2.46 116.25 117.71 1bvn h VAL 325 Ca -0.13 -1.18 -0.03 0.00 0.82 0.00 0.00 66.70 66.17 1bvn h VAL 325 Cb 1.60 1.53 0.01 0.00 -1.52 0.00 0.00 31.29 32.91 1bvn h VAL 325 CO 0.14 0.35 -0.34 1.23 0.02 0.00 0.00 177.57 178.98 1bvn h GLY 326 N 1.02 -0.98 -0.05 2.17 0.00 -1.02 -1.87 103.07 102.33 1bvn h GLY 326 Ca 0.02 0.36 0.25 0.00 0.00 0.00 0.00 47.33 47.96 1bvn h GLY 326 CO 0.04 -0.36 0.64 -2.75 0.00 0.00 0.00 176.54 174.12 1bvn h PHE 327 N -1.18 0.75 0.17 5.60 3.04 -1.46 -0.30 116.94 123.55 1bvn h PHE 327 Ca -0.10 0.03 -0.01 0.00 3.98 0.00 0.00 57.97 61.87 1bvn h PHE 327 Cb 0.72 -0.22 0.00 0.00 2.56 0.00 0.00 35.95 39.01 1bvn h PHE 327 CO 0.01 0.10 -0.08 1.98 -2.02 0.00 0.00 178.31 178.29 1bvn h MET 328 N 0.47 -0.22 -0.16 1.11 4.05 -1.34 -1.10 114.93 117.73 1bvn h MET 328 Ca 0.59 0.02 -0.02 0.00 -0.28 0.00 0.00 59.70 60.00 1bvn h MET 328 Cb 1.35 0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 32.19 1bvn h MET 328 CO -0.32 0.03 -0.00 -0.07 0.23 0.00 0.00 176.91 176.77 1bvn h LEU 329 N -0.46 0.21 0.02 3.39 3.38 -0.36 -2.87 115.31 118.61 1bvn h LEU 329 Ca -0.02 -0.02 -0.24 0.00 0.09 0.00 0.00 57.88 57.68 1bvn h LEU 329 Cb 0.35 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.02 1bvn h LEU 329 CO 0.04 0.25 -1.21 0.00 0.09 0.00 0.00 178.44 177.61 1bvn h ALA 330 N 1.78 0.43 -2.76 1.53 0.00 -1.05 -3.39 119.26 115.80 1bvn h ALA 330 Ca 0.05 -1.05 -0.50 0.00 0.00 0.00 0.00 54.91 53.41 1bvn h ALA 330 Cb 0.16 0.03 0.01 0.00 0.00 0.00 0.00 17.79 17.99 1bvn h ALA 330 CO 0.00 1.30 0.45 -1.58 0.00 0.00 0.00 179.25 179.43 1bvn s HIS 331 N -2.67 3.65 0.10 0.00 5.65 -0.42 -4.95 115.29 116.64 1bvn s HIS 331 Ca -0.01 1.71 0.33 0.00 0.25 0.00 0.00 55.06 57.34 1bvn s HIS 331 Cb 0.09 -3.23 1.58 0.00 -1.18 0.00 0.00 32.58 29.84 1bvn s HIS 331 CO 0.83 -0.39 1.99 -1.00 -0.65 0.00 0.00 174.74 175.52 1bvn h PRO 332 N 4.22 0.00 -6.76 2.88 0.13 -1.88 -3.47 132.00 127.12 1bvn h PRO 332 Ca -0.46 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.14 1bvn h PRO 332 Cb 1.21 0.00 0.07 0.00 0.13 0.00 0.00 31.00 32.41 1bvn h PRO 332 CO 0.69 0.00 0.83 -0.47 -0.23 0.00 0.00 178.00 178.82 1bvn s TYR 333 N -3.72 2.89 0.20 1.56 5.04 -1.26 -4.88 117.35 117.18 1bvn s TYR 333 Ca -0.01 0.87 0.00 0.00 -2.44 0.00 0.00 57.07 55.49 1bvn s TYR 333 Cb 0.10 -3.95 0.00 0.00 0.35 0.00 0.00 41.96 38.45 1bvn s TYR 333 CO 0.42 -3.19 0.00 0.41 -1.34 0.00 0.00 175.55 171.84 1bvn n GLY 334 N 2.33 -1.11 3.72 8.97 0.00 -1.26 -4.76 105.19 113.08 1bvn n GLY 334 Ca 0.08 -0.57 -0.39 0.00 0.00 0.00 0.00 46.02 45.14 1bvn n GLY 334 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1bvn s PHE 335 N -2.19 3.54 -0.15 1.61 5.36 -0.89 -4.90 117.98 120.35 1bvn s PHE 335 Ca 0.00 1.07 -0.16 0.00 -0.96 0.00 0.00 56.93 56.88 1bvn s PHE 335 Cb 0.00 -2.69 -0.04 0.00 -0.34 0.00 0.00 43.02 39.95 1bvn s PHE 335 CO 0.00 0.11 0.38 0.95 -1.46 0.00 0.00 175.22 175.20 1bvn s THR 336 N 0.78 5.24 -0.12 0.12 -4.23 -1.26 -0.02 115.64 116.16 1bvn s THR 336 Ca 0.32 0.74 0.03 0.00 -1.18 0.00 0.00 61.69 61.60 1bvn s THR 336 Cb -0.16 -3.72 0.00 0.00 1.34 0.00 0.00 72.50 69.95 1bvn s THR 336 CO 0.14 0.34 -0.22 -0.60 -0.54 0.00 0.00 174.62 173.75 1bvn s ARG 337 N 0.65 3.09 -0.09 3.99 3.52 -0.10 -2.58 118.95 127.43 1bvn s ARG 337 Ca 0.21 -0.84 -0.04 0.00 -0.13 0.00 0.00 55.73 54.93 1bvn s ARG 337 Cb -0.14 -2.39 -0.04 0.00 -1.56 0.00 0.00 34.95 30.82 1bvn s ARG 337 CO 0.07 0.13 0.06 0.08 -0.81 0.00 0.00 175.30 174.83 1bvn s VAL 338 N 0.47 4.80 0.46 7.11 1.01 0.16 -4.46 120.40 129.95 1bvn s VAL 338 Ca -0.15 -0.08 -0.08 0.00 0.00 0.00 0.00 61.98 61.67 1bvn s VAL 338 Cb -0.17 -3.06 -0.05 0.00 0.00 0.00 0.00 36.38 33.10 1bvn s VAL 338 CO 0.06 0.59 0.81 -0.32 0.00 0.00 0.00 175.10 176.24 1bvn s MET 339 N -0.99 3.67 -0.24 2.72 1.75 -1.26 -0.58 119.30 124.36 1bvn s MET 339 Ca 0.15 0.40 -0.04 0.00 -1.25 0.00 0.00 55.69 54.95 1bvn s MET 339 Cb -0.12 -2.34 0.13 0.00 2.84 0.00 0.00 34.83 35.34 1bvn s MET 339 CO 0.04 -0.17 0.41 0.45 -0.65 0.00 0.00 175.02 175.10 1bvn s SER 340 N -3.66 -0.07 0.00 1.11 0.15 -0.98 -4.30 113.70 105.95 1bvn s SER 340 Ca 0.50 0.49 0.00 0.00 0.70 0.00 0.00 55.95 57.65 1bvn s SER 340 Cb -0.10 1.30 0.00 0.00 -1.71 0.00 0.00 66.02 65.50 1bvn s SER 340 CO 0.39 -0.28 0.00 -1.54 1.20 0.00 0.00 173.24 173.02 1bvn n SER 341 N 5.38 1.39 -4.13 5.45 3.41 -1.26 -2.86 113.62 120.99 1bvn n SER 341 Ca -0.05 -0.68 -0.19 0.00 -0.26 0.00 0.00 58.87 57.70 1bvn n SER 341 Cb 0.50 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 64.32 1bvn n SER 341 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 1bvn s TYR 342 N -0.75 1.13 0.74 7.33 -0.85 -1.26 -0.83 117.35 122.85 1bvn s TYR 342 Ca 0.00 -0.38 -0.11 0.00 -0.52 0.00 0.00 57.07 56.06 1bvn s TYR 342 Cb 0.00 -0.66 0.03 0.00 0.38 0.00 0.00 41.96 41.71 1bvn s TYR 342 CO 0.00 0.03 1.08 1.03 -1.52 0.00 0.00 175.55 176.16 1bvn s ARG 343 N -1.29 2.59 -0.00 -3.49 0.52 -0.17 -4.86 118.95 112.25 1bvn s ARG 343 Ca -0.00 1.03 -0.28 0.00 -0.52 0.00 0.00 55.73 55.96 1bvn s ARG 343 Cb -0.08 -1.94 0.08 0.00 0.52 0.00 0.00 34.95 33.53 1bvn s ARG 343 CO 0.01 -1.37 0.74 1.67 0.02 0.00 0.00 175.30 176.37 1bvn s TRP 344 N -2.99 -0.53 -0.68 -0.53 -2.14 -1.26 -4.84 118.94 105.97 1bvn s TRP 344 Ca 0.60 0.70 -0.26 0.00 2.66 0.00 0.00 56.10 59.79 1bvn s TRP 344 Cb -0.15 0.48 -0.03 0.00 -3.10 0.00 0.00 33.47 30.66 1bvn s TRP 344 CO 0.55 -0.62 1.88 0.00 -2.66 0.00 0.00 176.95 176.10 1bvn s ALA 345 N -2.16 2.05 0.83 2.67 0.00 -1.26 -4.95 121.76 118.93 1bvn s ALA 345 Ca -0.04 -0.85 -0.11 0.00 0.00 0.00 0.00 51.96 50.97 1bvn s ALA 345 Cb -0.00 -4.36 0.09 0.00 0.00 0.00 0.00 23.12 18.84 1bvn s ALA 345 CO -0.00 -4.12 1.10 1.03 0.00 0.00 0.00 175.76 173.77 1bvn s ARG 346 N 7.04 1.80 -0.31 0.00 0.52 -1.26 -4.75 118.95 121.98 1bvn s ARG 346 Ca 0.68 1.21 -0.01 0.00 -0.52 0.00 0.00 55.73 57.09 1bvn s ARG 346 Cb -0.11 -1.84 0.19 0.00 0.52 0.00 0.00 34.95 33.71 1bvn s ARG 346 CO 0.16 -1.98 0.79 1.21 0.02 0.00 0.00 175.30 175.49 1bvn s ASN 347 N -3.21 -1.11 0.01 0.23 3.04 -1.26 -4.96 114.94 107.68 1bvn s ASN 347 Ca 0.63 -0.03 -0.20 0.00 0.04 0.00 0.00 52.86 53.30 1bvn s ASN 347 Cb -0.19 1.62 -0.06 0.00 -1.54 0.00 0.00 41.25 41.09 1bvn s ASN 347 CO 0.57 -0.18 0.58 -0.36 -3.04 0.00 0.00 177.10 174.66 1bvn s PHE 348 N 2.65 3.71 -0.38 0.43 0.08 -1.26 0.29 117.98 123.50 1bvn s PHE 348 Ca 0.17 1.20 0.01 0.00 0.12 0.00 0.00 56.93 58.43 1bvn s PHE 348 Cb -0.05 -2.57 0.12 0.00 -0.57 0.00 0.00 43.02 39.95 1bvn s PHE 348 CO -0.21 0.42 0.17 0.08 -0.10 0.00 0.00 175.22 175.58 1bvn s VAL 349 N -0.43 1.20 -1.29 -0.44 1.01 0.12 -4.81 120.40 115.75 1bvn s VAL 349 Ca 0.30 -2.06 -0.04 0.00 0.00 0.00 0.00 61.98 60.17 1bvn s VAL 349 Cb -0.18 -1.87 0.01 0.00 0.00 0.00 0.00 36.38 34.34 1bvn s VAL 349 CO 0.17 -0.80 1.04 -3.20 0.00 0.00 0.00 175.10 172.32 1bvn n ASN 350 N 4.11 -3.80 0.00 3.32 2.85 -1.26 -3.03 115.26 117.44 1bvn n ASN 350 Ca 0.04 -0.62 0.00 0.00 -0.11 0.00 0.00 54.58 53.90 1bvn n ASN 350 Cb 0.38 -4.92 0.00 0.00 1.24 0.00 0.00 39.78 36.48 1bvn n ASN 350 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1bvn n GLY 351 N -1.55 3.14 3.65 8.20 0.00 -1.26 -5.07 105.19 112.31 1bvn n GLY 351 Ca -0.16 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.52 1bvn n GLY 351 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1bvn s GLU 352 N -0.59 3.72 -0.94 1.61 2.12 -1.17 -4.87 118.70 118.58 1bvn s GLU 352 Ca 0.00 -0.36 -0.24 0.00 0.36 0.00 0.00 54.97 54.73 1bvn s GLU 352 Cb 0.00 -3.10 0.05 0.00 0.26 0.00 0.00 34.13 31.34 1bvn s GLU 352 CO 0.00 0.39 1.39 0.34 -0.54 0.00 0.00 175.26 176.85 1bvn s ASP 353 N 0.02 6.40 0.00 -1.70 2.15 -1.26 0.11 116.67 122.39 1bvn s ASP 353 Ca 0.05 -1.17 0.00 0.00 0.43 0.00 0.00 52.55 51.86 1bvn s ASP 353 Cb -0.12 -2.56 0.00 0.00 -0.30 0.00 0.00 42.92 39.93 1bvn s ASP 353 CO 0.01 -1.60 0.64 0.55 -0.17 0.00 0.00 175.17 174.61 1bvn n VAL 354 N 6.72 0.63 -0.64 1.11 3.14 0.14 -1.45 118.33 127.99 1bvn n VAL 354 Ca 0.24 0.16 0.06 0.00 -2.96 0.00 0.00 64.34 61.85 1bvn n VAL 354 Cb 0.50 -1.16 0.09 0.00 -1.06 0.00 0.00 33.84 32.21 1bvn n VAL 354 CO 0.00 0.00 0.00 0.59 -6.46 0.00 0.00 176.83 170.96 1bvn n ASN 355 N -1.14 2.28 0.00 6.55 3.02 -1.25 -4.75 115.26 119.96 1bvn n ASN 355 Ca 0.00 -2.65 0.06 0.00 -0.03 0.00 0.00 54.58 51.96 1bvn n ASN 355 Cb 0.01 -0.27 0.35 0.00 -0.61 0.00 0.00 39.78 39.26 1bvn n ASN 355 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 1bvn n ASP 356 N -1.01 0.00 0.07 6.41 5.75 -0.53 -3.00 116.55 124.24 1bvn n ASP 356 Ca 0.10 -0.27 0.02 0.00 -0.01 0.00 0.00 54.79 54.63 1bvn n ASP 356 Cb 0.50 -0.06 -0.05 0.00 -1.03 0.00 0.00 41.12 40.48 1bvn n ASP 356 CO 0.00 0.00 0.00 4.11 -0.11 0.00 0.00 177.20 181.20 1bvn h TRP 357 N 0.00 0.00 -1.17 2.11 5.08 -1.85 -3.48 115.95 116.63 1bvn h TRP 357 Ca 0.00 0.00 -0.82 0.00 1.08 0.00 0.00 58.89 59.15 1bvn h TRP 357 Cb 0.02 0.00 0.02 0.00 -3.00 0.00 0.00 29.16 26.20 1bvn h TRP 357 CO 0.00 0.49 0.65 -0.89 -1.28 0.00 0.00 178.44 177.41 1bvn n ILE 358 N -2.94 0.08 -0.97 0.12 5.41 -1.16 -2.67 119.36 117.22 1bvn n ILE 358 Ca -0.06 -0.01 -0.22 0.00 1.00 0.00 0.00 62.75 63.46 1bvn n ILE 358 Cb 0.78 -0.63 0.18 0.00 -0.71 0.00 0.00 39.64 39.26 1bvn n ILE 358 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1bvn n GLY 359 N 3.65 -2.59 3.62 7.39 0.00 -1.19 -4.41 105.19 111.66 1bvn n GLY 359 Ca 0.28 -1.50 -0.30 0.00 0.00 0.00 0.00 46.02 44.50 1bvn n GLY 359 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1bvn s PRO 360 N -4.87 0.45 0.27 1.61 0.04 -1.26 -4.88 135.00 126.35 1bvn s PRO 360 Ca 0.53 1.32 -0.30 0.00 0.04 0.00 0.00 61.00 62.59 1bvn s PRO 360 Cb -0.05 -1.68 -0.13 0.00 0.04 0.00 0.00 34.50 32.68 1bvn s PRO 360 CO 0.40 -2.94 1.27 -2.30 0.04 0.00 0.00 177.00 173.47 1bvn n PRO 361 N -4.43 1.83 -3.83 0.56 -0.02 -1.26 -4.86 135.00 122.99 1bvn n PRO 361 Ca 0.09 0.65 -0.08 0.00 -2.02 0.00 0.00 63.50 62.13 1bvn n PRO 361 Cb 0.53 -2.21 -0.03 0.00 -0.02 0.00 0.00 33.50 31.77 1bvn n PRO 361 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1bvn s ASN 362 N -0.08 -0.25 -0.48 2.55 4.22 -1.26 -0.22 114.94 119.42 1bvn s ASN 362 Ca 0.63 -0.60 0.03 0.00 -2.14 0.00 0.00 52.86 50.78 1bvn s ASN 362 Cb -0.66 0.66 0.13 0.00 1.28 0.00 0.00 41.25 42.66 1bvn s ASN 362 CO 0.56 -1.23 0.23 0.21 -2.04 0.00 0.00 177.10 174.83 1bvn s ASN 363 N -2.92 4.21 -0.72 3.54 2.47 0.35 -4.73 114.94 117.13 1bvn s ASN 363 Ca 0.12 -2.80 -0.00 0.00 0.42 0.00 0.00 52.86 50.60 1bvn s ASN 363 Cb -0.04 -1.48 -0.00 0.00 -1.45 0.00 0.00 41.25 38.28 1bvn s ASN 363 CO 0.04 -0.26 0.68 -3.20 -3.72 0.00 0.00 177.10 170.65 1bvn n ASN 364 N 3.37 -7.63 0.00 -4.21 2.85 -1.26 -2.76 115.26 105.63 1bvn n ASN 364 Ca 0.05 -0.08 0.00 0.00 -0.11 0.00 0.00 54.58 54.45 1bvn n ASN 364 Cb 0.34 -5.20 0.00 0.00 1.24 0.00 0.00 39.78 36.16 1bvn n ASN 364 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1bvn n GLY 365 N -1.74 0.07 3.50 8.20 0.00 -1.26 -4.92 105.19 109.04 1bvn n GLY 365 Ca -0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 1bvn n GLY 365 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bvn s VAL 366 N -1.13 5.26 0.03 1.61 1.01 -1.11 -5.00 120.40 121.06 1bvn s VAL 366 Ca 0.00 -0.35 -0.38 0.00 0.00 0.00 0.00 61.98 61.25 1bvn s VAL 366 Cb 0.00 -3.82 -0.17 0.00 0.00 0.00 0.00 36.38 32.39 1bvn s VAL 366 CO 0.00 -0.14 1.31 -0.38 0.00 0.00 0.00 175.10 175.89 1bvn n ILE 367 N 5.15 0.02 -2.58 2.22 5.41 -1.26 -0.50 119.36 127.83 1bvn n ILE 367 Ca -0.11 -0.00 -0.40 0.00 1.00 0.00 0.00 62.75 63.23 1bvn n ILE 367 Cb 0.49 -0.66 -0.05 0.00 -0.71 0.00 0.00 39.64 38.71 1bvn n ILE 367 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 1bvn s LYS 368 N 0.61 4.72 0.87 0.38 1.02 0.69 -4.83 119.74 123.21 1bvn s LYS 368 Ca 0.87 1.68 -0.11 0.00 0.02 0.00 0.00 55.97 58.43 1bvn s LYS 368 Cb -1.04 -3.21 0.12 0.00 -0.52 0.00 0.00 37.83 33.17 1bvn s LYS 368 CO 0.51 0.32 1.10 -1.83 -0.92 0.00 0.00 175.35 174.53 1bvn s GLU 369 N -1.37 1.41 0.22 1.68 -1.05 -1.26 -4.92 118.70 113.41 1bvn s GLU 369 Ca 0.43 1.16 -0.20 0.00 -0.15 0.00 0.00 54.97 56.22 1bvn s GLU 369 Cb -0.30 -1.80 -0.08 0.00 -0.44 0.00 0.00 34.13 31.51 1bvn s GLU 369 CO 0.37 -2.24 0.73 0.08 0.95 0.00 0.00 175.26 175.15 1bvn s VAL 370 N -2.81 4.56 -0.21 1.83 1.01 -1.26 -4.81 120.40 118.72 1bvn s VAL 370 Ca 0.64 1.29 0.01 0.00 0.00 0.00 0.00 61.98 63.92 1bvn s VAL 370 Cb -0.20 -3.86 0.05 0.00 0.00 0.00 0.00 36.38 32.37 1bvn s VAL 370 CO 0.57 0.21 -0.10 -0.89 0.00 0.00 0.00 175.10 174.90 1bvn s THR 371 N -1.52 1.65 0.04 3.92 2.01 -1.26 -4.99 115.64 115.50 1bvn s THR 371 Ca 0.43 -1.06 -0.30 0.00 0.31 0.00 0.00 61.69 61.07 1bvn s THR 371 Cb -0.17 -1.75 -0.04 0.00 0.01 0.00 0.00 72.50 70.55 1bvn s THR 371 CO 0.21 0.12 0.96 -0.63 -0.69 0.00 0.00 174.62 174.59 1bvn s ILE 372 N 1.38 4.73 0.22 1.82 1.09 -1.26 0.08 121.20 129.25 1bvn s ILE 372 Ca -0.02 2.03 0.05 0.00 -1.10 0.00 0.00 60.65 61.61 1bvn s ILE 372 Cb -0.17 -4.31 -0.03 0.00 -1.06 0.00 0.00 42.46 36.89 1bvn s ILE 372 CO -0.08 0.23 0.25 0.20 -0.10 0.00 0.00 174.94 175.44 1bvn s ASN 373 N 0.57 5.90 0.15 3.58 0.02 0.12 -4.89 114.94 120.39 1bvn s ASN 373 Ca 0.49 -0.06 -0.25 0.00 -1.02 0.00 0.00 52.86 52.02 1bvn s ASN 373 Cb -0.22 -1.63 -0.01 0.00 0.02 0.00 0.00 41.25 39.41 1bvn s ASN 373 CO 0.28 -0.01 1.33 0.00 0.02 0.00 0.00 177.10 178.72 1bvn n ALA 374 N -0.99 -0.48 1.19 0.60 0.00 -1.26 -0.05 120.51 119.52 1bvn n ALA 374 Ca -0.08 0.76 0.00 0.00 0.00 0.00 0.00 53.44 54.12 1bvn n ALA 374 Cb 0.56 -0.17 0.00 0.00 0.00 0.00 0.00 19.45 19.85 1bvn n ALA 374 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1bvn n ASP 375 N -5.12 0.03 0.00 0.00 5.75 -1.26 -4.84 116.55 111.11 1bvn n ASP 375 Ca 0.03 -1.22 0.00 0.00 -0.01 0.00 0.00 54.79 53.59 1bvn n ASP 375 Cb 0.25 -0.01 0.00 0.00 -1.03 0.00 0.00 41.12 40.32 1bvn n ASP 375 CO 0.00 0.00 0.00 0.41 -0.11 0.00 0.00 177.20 177.50 1bvn n THR 376 N -0.47 0.00 -1.16 2.12 -1.04 0.93 -5.06 114.28 109.60 1bvn n THR 376 Ca 0.00 0.00 -0.16 0.00 -2.04 0.00 0.00 64.05 61.85 1bvn n THR 376 Cb 0.01 0.00 0.13 0.00 -1.82 0.00 0.00 70.33 68.64 1bvn n THR 376 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 1bvn n THR 377 N -1.83 0.00 -4.24 12.58 -1.04 -1.26 -4.61 114.28 113.87 1bvn n THR 377 Ca 0.00 -0.41 -0.27 0.00 -2.04 0.00 0.00 64.05 61.33 1bvn n THR 377 Cb 0.00 -1.43 -0.09 0.00 -1.82 0.00 0.00 70.33 66.99 1bvn n THR 377 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1bvn n GLY 379 N 0.10 2.88 2.41 0.00 0.00 0.11 -4.59 105.19 106.09 1bvn n GLY 379 Ca -0.11 -2.20 -0.17 0.00 0.00 0.00 0.00 46.02 43.55 1bvn n GLY 379 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1bvn n ASN 380 N -2.05 -4.97 -0.31 1.61 3.02 -1.26 -3.09 115.26 108.21 1bvn n ASN 380 Ca -0.00 0.21 -0.04 0.00 -0.03 0.00 0.00 54.58 54.72 1bvn n ASN 380 Cb 0.15 -4.00 -0.02 0.00 -0.61 0.00 0.00 39.78 35.30 1bvn n ASN 380 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1bvn n ASP 381 N -0.92 -3.81 -4.57 6.41 8.00 -1.26 -4.75 116.55 115.64 1bvn n ASP 381 Ca -0.18 0.10 -0.42 0.00 0.71 0.00 0.00 54.79 55.00 1bvn n ASP 381 Cb 0.60 -1.67 -0.06 0.00 -0.02 0.00 0.00 41.12 39.96 1bvn n ASP 381 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 1bvn s TRP 382 N -2.04 3.15 0.35 1.24 0.52 -1.18 -1.00 118.94 119.97 1bvn s TRP 382 Ca 0.00 0.38 0.04 0.00 0.02 0.00 0.00 56.10 56.55 1bvn s TRP 382 Cb 0.00 -3.18 0.69 0.00 -1.15 0.00 0.00 33.47 29.83 1bvn s TRP 382 CO 0.00 -0.64 1.96 0.28 0.02 0.00 0.00 176.95 178.56 1bvn h VAL 383 N 5.69 1.05 -6.57 4.03 2.07 -1.32 -3.39 116.25 117.81 1bvn h VAL 383 Ca -0.26 -0.28 -0.49 0.00 0.82 0.00 0.00 66.70 66.49 1bvn h VAL 383 Cb 1.11 0.15 0.02 0.00 -1.52 0.00 0.00 31.29 31.05 1bvn h VAL 383 CO 0.85 0.15 -0.95 0.00 0.02 0.00 0.00 177.57 177.64 1bvn h GLU 385 N -1.72 0.00 0.00 0.00 3.07 -1.88 -2.41 114.58 111.64 1bvn h GLU 385 Ca -0.64 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.22 1bvn h GLU 385 Cb 1.37 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.28 1bvn h GLU 385 CO 0.46 0.26 0.00 -2.39 -1.40 0.00 0.00 179.01 175.94 1bvn n HIS 386 N -3.73 0.37 0.91 4.33 1.44 -1.26 -1.51 115.22 115.76 1bvn n HIS 386 Ca -0.01 0.16 0.10 0.00 -2.01 0.00 0.00 57.72 55.96 1bvn n HIS 386 Cb 0.37 -0.75 -0.05 0.00 0.12 0.00 0.00 29.99 29.67 1bvn n HIS 386 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 1bvn n ARG 387 N -1.85 0.06 -2.14 -1.40 1.74 -0.91 -4.21 116.66 107.95 1bvn n ARG 387 Ca 0.02 -0.01 -0.42 0.00 -0.77 0.00 0.00 57.85 56.67 1bvn n ARG 387 Cb 0.14 -1.51 -0.03 0.00 -1.02 0.00 0.00 32.46 30.05 1bvn n ARG 387 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 1bvn s TRP 388 N -3.04 3.21 0.23 -1.55 0.51 -0.57 -4.83 118.94 112.89 1bvn s TRP 388 Ca 0.07 0.95 -0.10 0.00 -2.12 0.00 0.00 56.10 54.91 1bvn s TRP 388 Cb 0.16 -3.71 0.35 0.00 -0.81 0.00 0.00 33.47 29.46 1bvn s TRP 388 CO 0.84 -2.47 1.64 -0.09 -0.51 0.00 0.00 176.95 176.36 1bvn h ARG 389 N 6.54 0.09 -0.25 4.98 2.43 -1.91 0.10 114.38 126.36 1bvn h ARG 389 Ca -0.43 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 58.72 1bvn h ARG 389 Cb 1.21 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.73 1bvn h ARG 389 CO 0.86 0.06 0.10 0.93 -1.51 0.00 0.00 179.97 180.40 1bvn h GLU 390 N 0.09 0.35 0.05 0.20 3.07 -1.82 -0.14 114.58 116.38 1bvn h GLU 390 Ca 0.36 -0.04 -0.07 0.00 -0.50 0.00 0.00 59.36 59.11 1bvn h GLU 390 Cb 0.60 -0.07 0.01 0.00 -0.84 0.00 0.00 28.75 28.45 1bvn h GLU 390 CO -0.61 0.30 -0.34 0.82 -1.40 0.00 0.00 179.01 177.77 1bvn h ILE 391 N 0.35 1.66 -0.25 3.13 1.08 -1.55 -3.20 117.51 118.74 1bvn h ILE 391 Ca 0.09 -2.41 0.04 0.00 -0.39 0.00 0.00 64.86 62.19 1bvn h ILE 391 Cb 0.08 3.28 -0.07 0.00 -3.07 0.00 0.00 36.82 37.05 1bvn h ILE 391 CO -0.01 0.64 -0.49 -0.09 -0.69 0.00 0.00 178.15 177.50 1bvn h ARG 392 N -0.78 -0.42 0.00 2.37 2.43 -0.47 -1.05 114.38 116.46 1bvn h ARG 392 Ca -0.06 0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.11 1bvn h ARG 392 Cb 1.24 0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 30.88 1bvn h ARG 392 CO 0.05 -0.28 -0.10 -0.91 -1.51 0.00 0.00 179.97 177.22 1bvn h ASN 393 N -0.44 0.00 1.82 -3.80 4.21 -1.19 -1.96 115.58 114.21 1bvn h ASN 393 Ca 0.05 0.00 -0.02 0.00 1.21 0.00 0.00 56.30 57.53 1bvn h ASN 393 Cb 0.57 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.77 1bvn h ASN 393 CO -0.46 0.10 -0.18 0.24 -1.29 0.00 0.00 177.43 175.83 1bvn h MET 394 N 0.00 0.00 -0.25 0.81 2.86 -1.29 0.41 114.93 117.46 1bvn h MET 394 Ca -0.00 0.00 -0.19 0.00 -2.06 0.00 0.00 59.70 57.44 1bvn h MET 394 Cb 0.26 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.92 1bvn h MET 394 CO 0.01 0.10 -0.60 0.28 1.06 0.00 0.00 176.91 177.76 1bvn h VAL 395 N 0.00 1.28 0.00 -2.22 2.07 -0.45 -0.88 116.25 116.05 1bvn h VAL 395 Ca -0.00 -1.79 -0.10 0.00 0.82 0.00 0.00 66.70 65.63 1bvn h VAL 395 Cb 1.08 1.71 -0.01 0.00 -1.52 0.00 0.00 31.29 32.55 1bvn h VAL 395 CO 0.01 0.58 -0.46 -0.25 0.02 0.00 0.00 177.57 177.47 1bvn h TRP 396 N 0.64 0.00 -0.07 1.57 7.01 -1.34 -2.87 115.95 120.88 1bvn h TRP 396 Ca -0.00 0.00 -0.01 0.00 2.11 0.00 0.00 58.89 60.98 1bvn h TRP 396 Cb 1.22 0.00 -0.00 0.00 -2.10 0.00 0.00 29.16 28.27 1bvn h TRP 396 CO 0.07 0.46 -0.01 0.35 -2.79 0.00 0.00 178.44 176.53 1bvn h PHE 397 N 0.00 0.15 0.00 2.65 3.04 0.26 -2.04 116.94 121.00 1bvn h PHE 397 Ca -0.00 -0.03 -0.01 0.00 3.98 0.00 0.00 57.97 61.91 1bvn h PHE 397 Cb 1.15 -0.04 -0.00 0.00 2.56 0.00 0.00 35.95 39.62 1bvn h PHE 397 CO 0.00 0.43 -0.04 -0.09 -2.02 0.00 0.00 178.31 176.59 1bvn h ARG 398 N -0.17 0.00 -0.01 1.11 2.43 -1.13 -2.53 114.38 114.08 1bvn h ARG 398 Ca 0.02 0.00 -0.15 0.00 -0.81 0.00 0.00 59.98 59.04 1bvn h ARG 398 Cb 0.38 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 29.94 1bvn h ARG 398 CO 0.01 0.04 -0.58 -0.91 -1.51 0.00 0.00 179.97 177.02 1bvn h ASN 399 N 0.00 0.53 -0.18 -3.80 2.35 -1.24 -2.90 115.58 110.34 1bvn h ASN 399 Ca -0.00 -0.75 -0.08 0.00 -0.55 0.00 0.00 56.30 54.91 1bvn h ASN 399 Cb 0.22 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.41 1bvn h ASN 399 CO 0.01 1.21 -0.15 0.58 -1.65 0.00 0.00 177.43 177.42 1bvn h VAL 400 N -0.10 1.25 -0.01 2.81 2.07 -0.98 -2.86 116.25 118.43 1bvn h VAL 400 Ca -0.07 -1.13 0.00 0.00 0.82 0.00 0.00 66.70 66.32 1bvn h VAL 400 Cb 1.29 1.16 0.00 0.00 -1.52 0.00 0.00 31.29 32.22 1bvn h VAL 400 CO 0.11 0.37 -0.07 0.52 0.02 0.00 0.00 177.57 178.53 1bvn n VAL 401 N -4.17 0.00 -1.35 2.57 0.31 -1.00 -4.94 118.33 109.74 1bvn n VAL 401 Ca 0.01 -0.21 -0.53 0.00 -0.01 0.00 0.00 64.34 63.59 1bvn n VAL 401 Cb 0.36 0.43 -0.11 0.00 -0.91 0.00 0.00 33.84 33.61 1bvn n VAL 401 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1bvn n ASP 402 N -0.09 0.99 0.00 4.52 2.03 -1.08 -0.83 116.55 122.09 1bvn n ASP 402 Ca 0.17 0.48 0.00 0.00 0.52 0.00 0.00 54.79 55.96 1bvn n ASP 402 Cb 0.35 -1.00 0.00 0.00 -0.72 0.00 0.00 41.12 39.74 1bvn n ASP 402 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1bvn n GLY 403 N 7.05 1.92 3.80 0.27 0.00 -1.26 -5.09 105.19 111.89 1bvn n GLY 403 Ca 0.54 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.21 1bvn n GLY 403 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1bvn s GLN 404 N -0.58 4.16 0.54 1.61 -1.52 -0.01 -5.03 119.66 118.83 1bvn s GLN 404 Ca 0.00 1.29 -0.17 0.00 -1.95 0.00 0.00 55.36 54.52 1bvn s GLN 404 Cb 0.00 -2.31 -0.06 0.00 -0.22 0.00 0.00 33.01 30.41 1bvn s GLN 404 CO 0.00 -0.11 1.02 -1.25 -0.25 0.00 0.00 175.29 174.70 1bvn s PRO 405 N -2.91 3.67 0.22 2.91 0.04 -1.26 -4.59 135.00 133.09 1bvn s PRO 405 Ca 0.61 1.14 -0.30 0.00 0.04 0.00 0.00 61.00 62.49 1bvn s PRO 405 Cb -0.15 -2.09 -0.09 0.00 0.04 0.00 0.00 34.50 32.21 1bvn s PRO 405 CO 0.19 -0.51 1.37 0.12 0.04 0.00 0.00 177.00 178.21 1bvn s PHE 406 N -2.41 3.14 -0.05 0.56 5.36 -1.26 -0.67 117.98 122.65 1bvn s PHE 406 Ca 0.63 1.13 -0.29 0.00 -0.96 0.00 0.00 56.93 57.43 1bvn s PHE 406 Cb -0.14 -3.71 0.11 0.00 -0.34 0.00 0.00 43.02 38.94 1bvn s PHE 406 CO 0.30 -2.26 0.89 0.00 -1.46 0.00 0.00 175.22 172.70 1bvn s ALA 407 N 0.05 -1.84 -0.78 11.12 0.00 -0.28 -4.85 121.76 125.18 1bvn s ALA 407 Ca 0.58 1.19 -0.05 0.00 0.00 0.00 0.00 51.96 53.68 1bvn s ALA 407 Cb -0.39 0.07 0.01 0.00 0.00 0.00 0.00 23.12 22.81 1bvn s ALA 407 CO 0.41 -0.55 0.68 0.09 0.00 0.00 0.00 175.76 176.38 1bvn n ASN 408 N 0.13 -4.34 -4.76 0.00 5.03 -1.26 -0.46 115.26 109.60 1bvn n ASN 408 Ca -0.10 -0.32 -0.37 0.00 0.87 0.00 0.00 54.58 54.66 1bvn n ASN 408 Cb 0.60 -3.12 0.02 0.00 -1.02 0.00 0.00 39.78 36.26 1bvn n ASN 408 CO 0.00 0.00 0.00 0.86 -1.83 0.00 0.00 177.26 176.29 1bvn s TRP 409 N -3.19 2.51 0.05 3.10 -0.11 -1.26 -4.30 118.94 115.74 1bvn s TRP 409 Ca 0.31 1.47 -0.08 0.00 1.22 0.00 0.00 56.10 59.02 1bvn s TRP 409 Cb -0.14 -3.56 -0.00 0.00 -1.50 0.00 0.00 33.47 28.27 1bvn s TRP 409 CO 0.42 -2.23 0.17 -0.46 -4.62 0.00 0.00 176.95 170.24 1bvn s TRP 410 N -1.47 0.11 -0.29 5.86 -0.00 -0.22 -4.97 118.94 117.96 1bvn s TRP 410 Ca 0.71 -0.39 -0.25 0.00 -0.00 0.00 0.00 56.10 56.17 1bvn s TRP 410 Cb -0.33 -0.06 0.15 0.00 -0.00 0.00 0.00 33.47 33.22 1bvn s TRP 410 CO 0.39 -0.44 1.17 0.16 -0.00 0.00 0.00 176.95 178.22 1bvn s ASP 411 N -2.27 -0.32 0.00 5.86 1.47 -1.26 -2.29 116.67 117.86 1bvn s ASP 411 Ca -0.03 0.61 0.01 0.00 1.18 0.00 0.00 52.55 54.32 1bvn s ASP 411 Cb 0.00 0.63 0.04 0.00 -0.34 0.00 0.00 42.92 43.26 1bvn s ASP 411 CO -0.06 -0.11 0.85 -0.46 0.68 0.00 0.00 175.17 176.07 1bvn n ASN 412 N 2.04 0.00 0.00 2.11 6.94 -0.84 -4.82 115.26 120.69 1bvn n ASN 412 Ca -0.12 -1.61 0.00 0.00 -0.02 0.00 0.00 54.58 52.83 1bvn n ASN 412 Cb 0.56 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.98 1bvn n ASN 412 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1bvn n GLY 413 N 0.33 0.49 0.00 4.83 0.00 -1.26 -4.90 105.19 104.68 1bvn n GLY 413 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1bvn n GLY 413 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1bvn n SER 414 N -0.10 0.00 -0.78 1.61 2.88 -1.26 -4.91 113.62 111.06 1bvn n SER 414 Ca 0.00 0.00 0.05 0.00 -1.33 0.00 0.00 58.87 57.59 1bvn n SER 414 Cb 0.05 0.00 0.11 0.00 -0.75 0.00 0.00 64.21 63.62 1bvn n SER 414 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1bvn n ASN 415 N 0.00 1.34 -4.09 -3.46 3.02 -1.26 -1.82 115.26 108.99 1bvn n ASN 415 Ca 0.00 -2.88 -0.30 0.00 -0.03 0.00 0.00 54.58 51.37 1bvn n ASN 415 Cb 0.00 -0.39 -0.17 0.00 -0.61 0.00 0.00 39.78 38.61 1bvn n ASN 415 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1bvn s GLN 416 N -1.66 2.55 0.08 3.52 -0.21 -1.26 -0.76 119.66 121.91 1bvn s GLN 416 Ca 0.30 -0.68 -0.11 0.00 0.02 0.00 0.00 55.36 54.90 1bvn s GLN 416 Cb 0.30 -2.16 0.01 0.00 1.00 0.00 0.00 33.01 32.16 1bvn s GLN 416 CO -0.07 -0.10 0.24 0.14 -2.12 0.00 0.00 175.29 173.38 1bvn s VAL 417 N 1.06 0.12 0.10 1.09 -7.23 -0.72 -1.98 120.40 112.84 1bvn s VAL 417 Ca -0.03 -0.95 -0.11 0.00 -1.81 0.00 0.00 61.98 59.07 1bvn s VAL 417 Cb -0.14 -1.16 0.01 0.00 0.56 0.00 0.00 36.38 35.65 1bvn s VAL 417 CO -0.05 -0.53 0.26 0.00 -0.31 0.00 0.00 175.10 174.48 1bvn s ALA 418 N -3.36 -0.48 -0.24 1.32 0.00 -0.97 0.19 121.76 118.22 1bvn s ALA 418 Ca 0.01 -0.41 -0.29 0.00 0.00 0.00 0.00 51.96 51.27 1bvn s ALA 418 Cb 0.02 0.55 0.17 0.00 0.00 0.00 0.00 23.12 23.86 1bvn s ALA 418 CO -0.08 -0.55 1.22 -0.59 0.00 0.00 0.00 175.76 175.76 1bvn s PHE 419 N -3.81 -0.18 0.33 0.00 -0.71 -0.41 -1.05 117.98 112.15 1bvn s PHE 419 Ca 0.04 0.32 0.00 0.00 -1.04 0.00 0.00 56.93 56.25 1bvn s PHE 419 Cb 0.04 0.47 0.00 0.00 -1.21 0.00 0.00 43.02 42.32 1bvn s PHE 419 CO -0.11 -0.15 0.03 0.41 -1.34 0.00 0.00 175.22 174.06 1bvn n GLY 420 N 0.75 3.67 2.65 1.99 0.00 0.39 -2.14 105.19 112.50 1bvn n GLY 420 Ca -0.05 -2.31 -0.29 0.00 0.00 0.00 0.00 46.02 43.38 1bvn n GLY 420 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bvn s ARG 421 N -3.22 0.43 3.60 1.61 1.81 -0.55 -1.13 118.95 121.50 1bvn s ARG 421 Ca 0.03 -0.63 0.00 0.00 -1.72 0.00 0.00 55.73 53.40 1bvn s ARG 421 Cb -0.00 -1.68 0.00 0.00 -0.45 0.00 0.00 34.95 32.82 1bvn s ARG 421 CO 0.02 -0.90 0.00 0.41 -0.68 0.00 0.00 175.30 174.15 1bvn n GLY 422 N 5.09 0.89 2.01 -3.53 0.00 0.16 -2.78 105.19 107.03 1bvn n GLY 422 Ca -0.05 -0.71 -0.22 0.00 0.00 0.00 0.00 46.02 45.04 1bvn n GLY 422 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1bvn n ASN 423 N -2.76 4.32 -0.00 1.61 2.04 -1.26 -4.45 115.26 114.76 1bvn n ASN 423 Ca 0.00 -3.70 0.01 0.00 -0.44 0.00 0.00 54.58 50.46 1bvn n ASN 423 Cb 0.00 -0.80 -0.01 0.00 -2.53 0.00 0.00 39.78 36.44 1bvn n ASN 423 CO 0.00 0.00 0.00 0.54 -0.44 0.00 0.00 177.26 177.36 1bvn n ARG 424 N -1.08 4.80 -3.57 -3.83 5.12 -1.12 -4.57 116.66 112.42 1bvn n ARG 424 Ca 0.54 -0.01 -0.12 0.00 -1.93 0.00 0.00 57.85 56.33 1bvn n ARG 424 Cb 1.30 -0.71 -0.05 0.00 -1.16 0.00 0.00 32.46 31.83 1bvn n ARG 424 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 1bvn s GLY 425 N -1.47 -0.33 -0.01 -0.13 0.00 -1.23 -1.66 107.32 102.50 1bvn s GLY 425 Ca 0.00 1.90 -0.00 0.00 0.00 0.00 0.00 44.72 46.62 1bvn s GLY 425 CO 0.10 1.03 0.02 -0.12 0.00 0.00 0.00 173.10 174.13 1bvn s PHE 426 N -1.10 -0.01 -0.03 1.90 5.36 -0.37 -1.48 117.98 122.25 1bvn s PHE 426 Ca -0.04 0.06 0.01 0.00 -0.96 0.00 0.00 56.93 56.01 1bvn s PHE 426 Cb -0.00 -0.05 0.01 0.00 -0.34 0.00 0.00 43.02 42.64 1bvn s PHE 426 CO 0.03 -0.03 -0.05 -1.50 -1.46 0.00 0.00 175.22 172.22 1bvn s ILE 427 N 0.26 0.48 0.04 3.12 2.07 -0.91 -0.28 121.20 125.98 1bvn s ILE 427 Ca -0.02 -0.16 0.08 0.00 -1.41 0.00 0.00 60.65 59.14 1bvn s ILE 427 Cb -0.03 -0.47 -0.03 0.00 0.13 0.00 0.00 42.46 42.06 1bvn s ILE 427 CO -0.01 0.18 -0.22 -0.69 -1.91 0.00 0.00 174.94 172.29 1bvn s VAL 428 N 0.50 1.79 0.02 4.00 1.01 0.31 -1.29 120.40 126.74 1bvn s VAL 428 Ca -0.06 -1.23 0.04 0.00 0.00 0.00 0.00 61.98 60.73 1bvn s VAL 428 Cb -0.10 -1.54 -0.01 0.00 0.00 0.00 0.00 36.38 34.72 1bvn s VAL 428 CO -0.00 0.27 -0.12 -0.36 0.00 0.00 0.00 175.10 174.89 1bvn s PHE 429 N -0.78 1.04 -0.43 5.22 0.40 0.50 -1.96 117.98 121.97 1bvn s PHE 429 Ca 0.09 -0.28 0.02 0.00 -0.60 0.00 0.00 56.93 56.16 1bvn s PHE 429 Cb -0.09 -0.64 0.13 0.00 0.51 0.00 0.00 43.02 42.93 1bvn s PHE 429 CO 0.02 -0.00 0.23 1.21 0.70 0.00 0.00 175.22 177.38 1bvn s ASN 430 N -0.73 3.66 -0.13 1.36 2.47 0.26 -1.75 114.94 120.09 1bvn s ASN 430 Ca 0.02 -2.58 0.17 0.00 0.42 0.00 0.00 52.86 50.89 1bvn s ASN 430 Cb -0.06 -1.02 0.69 0.00 -1.45 0.00 0.00 41.25 39.40 1bvn s ASN 430 CO 0.00 -0.27 1.60 -3.20 -3.72 0.00 0.00 177.10 171.51 1bvn n ASN 431 N 3.61 4.69 -4.92 -4.21 5.15 0.06 -4.77 115.26 114.86 1bvn n ASN 431 Ca 0.08 -2.54 -0.22 0.00 -0.60 0.00 0.00 54.58 51.30 1bvn n ASN 431 Cb 0.35 -0.57 0.05 0.00 -0.53 0.00 0.00 39.78 39.08 1bvn n ASN 431 CO 0.00 0.00 0.00 -1.81 1.40 0.00 0.00 177.26 176.85 1bvn s ASP 432 N -1.02 5.08 -0.12 1.20 1.01 -1.22 -4.84 116.67 116.77 1bvn s ASP 432 Ca 0.49 -0.04 0.13 0.00 0.71 0.00 0.00 52.55 53.84 1bvn s ASP 432 Cb 0.33 -0.74 0.58 0.00 1.01 0.00 0.00 42.92 44.10 1bvn s ASP 432 CO 0.21 -1.30 1.43 0.47 0.21 0.00 0.00 175.17 176.19 1bvn n ASP 433 N -2.47 4.03 -4.34 0.27 8.00 -1.26 -4.73 116.55 116.04 1bvn n ASP 433 Ca 0.09 -2.45 -0.25 0.00 0.71 0.00 0.00 54.79 52.89 1bvn n ASP 433 Cb 0.60 -0.55 -0.09 0.00 -0.02 0.00 0.00 41.12 41.06 1bvn n ASP 433 CO 0.00 0.00 0.00 -1.66 -0.39 0.00 0.00 177.20 175.15 1bvn s TRP 434 N -1.95 1.88 0.70 1.24 -2.14 -1.26 -4.91 118.94 112.50 1bvn s TRP 434 Ca 0.40 -1.10 -0.11 0.00 2.66 0.00 0.00 56.10 57.95 1bvn s TRP 434 Cb 0.27 -1.27 0.01 0.00 -3.10 0.00 0.00 33.47 29.38 1bvn s TRP 434 CO 0.17 -0.10 1.06 1.14 -2.66 0.00 0.00 176.95 176.56 1bvn s GLN 435 N -3.80 2.91 -0.06 3.25 0.00 -1.26 -4.06 119.66 116.63 1bvn s GLN 435 Ca 0.27 0.91 0.04 0.00 -0.00 0.00 0.00 55.36 56.58 1bvn s GLN 435 Cb 0.05 -1.99 -0.02 0.00 0.00 0.00 0.00 33.01 31.05 1bvn s GLN 435 CO 0.14 -1.11 -0.17 -1.17 0.00 0.00 0.00 175.29 172.98 1bvn s LEU 436 N -5.54 2.56 -0.30 2.60 0.20 0.15 -4.98 118.68 113.38 1bvn s LEU 436 Ca 0.58 -0.30 -0.15 0.00 0.69 0.00 0.00 54.13 54.95 1bvn s LEU 436 Cb -0.14 -1.52 0.17 0.00 -0.43 0.00 0.00 46.19 44.28 1bvn s LEU 436 CO 0.55 0.29 1.02 -0.94 -0.29 0.00 0.00 176.35 176.98 1bvn s SER 437 N -0.42 -0.52 0.00 3.68 1.04 -1.25 -1.07 113.70 115.16 1bvn s SER 437 Ca 0.04 0.71 0.00 0.00 0.48 0.00 0.00 55.95 57.18 1bvn s SER 437 Cb -0.12 1.59 0.00 0.00 0.10 0.00 0.00 66.02 67.59 1bvn s SER 437 CO 0.02 -0.10 0.00 -1.54 0.98 0.00 0.00 173.24 172.60 1bvn n SER 438 N 4.94 0.00 -4.65 7.02 3.41 -1.07 -5.01 113.62 118.26 1bvn n SER 438 Ca -0.09 0.00 -0.40 0.00 -0.26 0.00 0.00 58.87 58.13 1bvn n SER 438 Cb 0.53 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.41 1bvn n SER 438 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1bvn s THR 439 N -2.00 5.07 0.08 6.66 2.01 -1.26 -1.97 115.64 124.23 1bvn s THR 439 Ca 0.00 1.01 0.09 0.00 0.31 0.00 0.00 61.69 63.10 1bvn s THR 439 Cb 0.00 -3.87 -0.04 0.00 0.01 0.00 0.00 72.50 68.60 1bvn s THR 439 CO 0.00 0.13 -0.21 -0.76 -0.69 0.00 0.00 174.62 173.09 1bvn s LEU 440 N 1.92 2.50 -0.57 4.42 1.43 0.24 -4.85 118.68 123.77 1bvn s LEU 440 Ca 0.25 -0.56 -0.28 0.00 -1.03 0.00 0.00 54.13 52.51 1bvn s LEU 440 Cb -0.16 -1.43 0.03 0.00 0.03 0.00 0.00 46.19 44.67 1bvn s LEU 440 CO 0.10 0.22 1.18 -1.58 0.23 0.00 0.00 176.35 176.49 1bvn s GLN 441 N -1.74 3.54 -0.11 1.70 2.00 -1.26 0.30 119.66 124.08 1bvn s GLN 441 Ca 0.15 0.28 -0.28 0.00 -2.00 0.00 0.00 55.36 53.51 1bvn s GLN 441 Cb -0.10 -4.00 -0.24 0.00 0.80 0.00 0.00 33.01 29.46 1bvn s GLN 441 CO 0.06 -1.64 0.88 1.15 -0.50 0.00 0.00 175.29 175.25 1bvn h THR 442 N 6.17 1.68 0.00 -0.34 2.02 0.06 -3.48 112.91 119.02 1bvn h THR 442 Ca -0.25 -2.05 0.00 0.00 0.77 0.00 0.00 66.41 64.88 1bvn h THR 442 Cb 1.06 3.07 0.00 0.00 -1.74 0.00 0.00 68.15 70.54 1bvn h THR 442 CO 1.18 0.53 0.00 0.61 0.37 0.00 0.00 175.52 178.21 1bvn n GLY 443 N 1.28 0.71 3.87 2.16 0.00 -1.18 -4.74 105.19 107.29 1bvn n GLY 443 Ca -0.10 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.56 1bvn n GLY 443 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1bvn s LEU 444 N 0.00 4.36 0.21 0.99 1.43 -1.26 -4.30 118.68 120.11 1bvn s LEU 444 Ca 0.00 0.45 -0.30 0.00 -1.03 0.00 0.00 54.13 53.25 1bvn s LEU 444 Cb 0.00 -2.06 -0.15 0.00 0.03 0.00 0.00 46.19 44.00 1bvn s LEU 444 CO 0.00 0.40 0.98 -2.65 0.23 0.00 0.00 176.35 175.31 1bvn n PRO 445 N 2.05 0.97 -1.55 1.29 -0.02 -1.26 -4.42 135.00 132.06 1bvn n PRO 445 Ca -0.20 0.34 -0.39 0.00 -2.02 0.00 0.00 63.50 61.23 1bvn n PRO 445 Cb 0.55 -1.70 0.03 0.00 -0.02 0.00 0.00 33.50 32.36 1bvn n PRO 445 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1bvn n GLY 446 N 1.69 -0.80 0.00 -1.23 0.00 -1.25 -4.93 105.19 98.67 1bvn n GLY 446 Ca 0.14 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.09 1bvn n GLY 446 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bvn n GLY 447 N 1.48 -0.46 3.15 -0.02 0.00 0.28 -4.96 105.19 104.65 1bvn n GLY 447 Ca 0.12 -1.22 -0.34 0.00 0.00 0.00 0.00 46.02 44.58 1bvn n GLY 447 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1bvn s THR 448 N -2.98 2.53 0.15 2.61 2.01 -1.26 0.06 115.64 118.75 1bvn s THR 448 Ca 0.00 -1.20 0.06 0.00 0.31 0.00 0.00 61.69 60.85 1bvn s THR 448 Cb 0.00 -2.31 -0.04 0.00 0.01 0.00 0.00 72.50 70.16 1bvn s THR 448 CO 0.00 0.18 0.05 -0.31 -0.69 0.00 0.00 174.62 173.85 1bvn s TYR 449 N 1.25 3.00 -0.12 4.92 1.51 0.95 -0.46 117.35 128.40 1bvn s TYR 449 Ca -0.02 -0.06 -0.12 0.00 -1.01 0.00 0.00 57.07 55.86 1bvn s TYR 449 Cb -0.17 -1.48 -0.05 0.00 -0.11 0.00 0.00 41.96 40.16 1bvn s TYR 449 CO -0.06 0.51 0.27 0.00 -1.11 0.00 0.00 175.55 175.16 1bvn s ASN 451 N -0.15 7.08 0.00 0.00 3.04 -0.46 -4.62 114.94 119.83 1bvn s ASN 451 Ca 0.17 1.78 0.28 0.00 0.04 0.00 0.00 52.86 55.14 1bvn s ASN 451 Cb -0.13 -2.56 1.19 0.00 -1.54 0.00 0.00 41.25 38.21 1bvn s ASN 451 CO 0.05 -0.56 1.82 1.33 -3.04 0.00 0.00 177.10 176.71 1bvn n VAL 452 N 4.58 0.01 -0.09 -5.21 0.24 -1.06 -3.13 118.33 113.67 1bvn n VAL 452 Ca 0.11 -0.21 -0.14 0.00 -2.04 0.00 0.00 64.34 62.06 1bvn n VAL 452 Cb 0.47 0.31 -0.14 0.00 -1.47 0.00 0.00 33.84 33.01 1bvn n VAL 452 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 1bvn n ILE 453 N -0.04 1.49 1.32 1.34 -0.00 -1.26 -4.15 119.36 118.07 1bvn n ILE 453 Ca 0.20 -0.72 0.13 0.00 -0.00 0.00 0.00 62.75 62.36 1bvn n ILE 453 Cb 0.31 -1.01 0.38 0.00 -0.00 0.00 0.00 39.64 39.32 1bvn n ILE 453 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.55 175.01 1bvn n SER 454 N -3.05 1.65 0.00 4.38 3.41 -1.25 -4.65 113.62 114.11 1bvn n SER 454 Ca -0.36 -1.43 0.00 0.00 -0.26 0.00 0.00 58.87 56.82 1bvn n SER 454 Cb 1.07 0.07 0.00 0.00 -0.26 0.00 0.00 64.21 65.09 1bvn n SER 454 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1bvn n GLY 455 N 1.26 -0.60 3.36 5.00 0.00 -1.18 -4.09 105.19 108.94 1bvn n GLY 455 Ca 0.16 -0.91 -0.18 0.00 0.00 0.00 0.00 46.02 45.08 1bvn n GLY 455 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1bvn s ASP 456 N -4.00 2.18 -0.37 1.61 1.01 -1.26 -3.91 116.67 111.92 1bvn s ASP 456 Ca 0.00 -1.19 -0.16 0.00 0.71 0.00 0.00 52.55 51.91 1bvn s ASP 456 Cb 0.00 -0.06 0.00 0.00 1.01 0.00 0.00 42.92 43.87 1bvn s ASP 456 CO 0.00 -0.44 0.39 -0.75 0.21 0.00 0.00 175.17 174.59 1bvn s LYS 457 N -3.80 3.37 -0.16 8.23 2.20 -1.26 -0.79 119.74 127.53 1bvn s LYS 457 Ca 0.28 -0.56 0.01 0.00 -0.36 0.00 0.00 55.97 55.34 1bvn s LYS 457 Cb 0.05 -3.87 0.02 0.00 -1.51 0.00 0.00 37.83 32.52 1bvn s LYS 457 CO 0.09 -0.66 -0.16 0.08 -0.36 0.00 0.00 175.35 174.34 1bvn s VAL 458 N 2.06 1.75 0.00 4.02 1.01 0.56 -4.98 120.40 124.82 1bvn s VAL 458 Ca 0.12 -0.75 0.00 0.00 0.00 0.00 0.00 61.98 61.35 1bvn s VAL 458 Cb -0.17 -1.62 0.00 0.00 0.00 0.00 0.00 36.38 34.59 1bvn s VAL 458 CO 0.12 0.49 0.00 0.61 0.00 0.00 0.00 175.10 176.32 1bvn n GLY 459 N 4.69 3.46 1.28 4.51 0.00 -1.26 -2.19 105.19 115.68 1bvn n GLY 459 Ca -0.19 -0.11 -0.08 0.00 0.00 0.00 0.00 46.02 45.65 1bvn n GLY 459 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1bvn n ASN 460 N 8.69 3.25 -3.59 1.61 3.02 -1.26 -5.01 115.26 121.97 1bvn n ASN 460 Ca 0.00 -3.83 -0.12 0.00 -0.03 0.00 0.00 54.58 50.60 1bvn n ASN 460 Cb 0.00 -0.46 -0.05 0.00 -0.61 0.00 0.00 39.78 38.66 1bvn n ASN 460 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1bvn s SER 461 N -3.33 -0.36 0.13 6.41 0.01 -0.93 -5.05 113.70 110.59 1bvn s SER 461 Ca 0.45 -0.04 0.05 0.00 1.31 0.00 0.00 55.95 57.71 1bvn s SER 461 Cb 0.39 0.49 -0.04 0.00 0.21 0.00 0.00 66.02 67.07 1bvn s SER 461 CO -0.02 -0.78 0.07 0.00 0.41 0.00 0.00 173.24 172.92 1bvn n THR 463 N 0.07 0.00 -2.54 0.00 -2.24 0.03 -4.92 114.28 104.67 1bvn n THR 463 Ca -0.09 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.38 1bvn n THR 463 Cb 0.53 0.82 0.00 0.00 -2.10 0.00 0.00 70.33 69.58 1bvn n THR 463 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1bvn n GLY 464 N 1.25 5.71 3.73 3.38 0.00 -1.26 -4.79 105.19 113.22 1bvn n GLY 464 Ca 0.17 -1.50 -0.40 0.00 0.00 0.00 0.00 46.02 44.28 1bvn n GLY 464 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1bvn n ILE 465 N 0.00 2.93 -4.23 -0.61 5.41 -1.26 -4.84 119.36 116.75 1bvn n ILE 465 Ca 0.00 -0.50 -0.30 0.00 1.00 0.00 0.00 62.75 62.95 1bvn n ILE 465 Cb 0.00 -1.69 -0.09 0.00 -0.71 0.00 0.00 39.64 37.15 1bvn n ILE 465 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 1bvn s LYS 466 N -2.45 2.42 -0.07 0.38 1.02 -1.26 -1.36 119.74 118.42 1bvn s LYS 466 Ca 0.63 -0.87 0.01 0.00 0.02 0.00 0.00 55.97 55.77 1bvn s LYS 466 Cb -0.46 -2.46 0.02 0.00 -0.52 0.00 0.00 37.83 34.41 1bvn s LYS 466 CO 0.56 0.55 -0.08 0.08 -0.92 0.00 0.00 175.35 175.54 1bvn s VAL 467 N -1.21 0.84 -0.46 3.17 1.01 0.12 -4.94 120.40 118.94 1bvn s VAL 467 Ca 0.22 -0.26 -0.19 0.00 0.00 0.00 0.00 61.98 61.75 1bvn s VAL 467 Cb -0.11 -0.83 0.04 0.00 0.00 0.00 0.00 36.38 35.47 1bvn s VAL 467 CO 0.14 0.31 0.56 -0.31 0.00 0.00 0.00 175.10 175.80 1bvn s TYR 468 N 1.09 3.10 -0.33 5.22 1.51 -1.26 -0.04 117.35 126.64 1bvn s TYR 468 Ca -0.07 -0.37 -0.19 0.00 -1.01 0.00 0.00 57.07 55.43 1bvn s TYR 468 Cb -0.14 -3.27 -0.01 0.00 -0.11 0.00 0.00 41.96 38.43 1bvn s TYR 468 CO -0.01 -0.88 0.55 0.08 -1.11 0.00 0.00 175.55 174.19 1bvn s VAL 469 N 2.49 4.99 1.16 0.71 1.01 0.11 -4.25 120.40 126.62 1bvn s VAL 469 Ca 0.16 0.57 -0.13 0.00 0.00 0.00 0.00 61.98 62.58 1bvn s VAL 469 Cb -0.17 -3.96 0.28 0.00 0.00 0.00 0.00 36.38 32.53 1bvn s VAL 469 CO 0.14 -0.16 1.03 -0.55 0.00 0.00 0.00 175.10 175.56 1bvn s SER 470 N 1.71 1.03 0.62 3.32 0.15 -0.02 -0.56 113.70 119.94 1bvn s SER 470 Ca 0.21 1.52 0.36 0.00 0.70 0.00 0.00 55.95 58.74 1bvn s SER 470 Cb -0.15 -2.29 2.05 0.00 -1.71 0.00 0.00 66.02 63.92 1bvn s SER 470 CO 0.13 -4.17 2.29 -1.28 1.20 0.00 0.00 173.24 171.41 1bvn h SER 471 N -2.60 0.00 -0.17 5.45 0.87 -1.93 -1.13 113.55 114.04 1bvn h SER 471 Ca -0.61 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 59.95 1bvn h SER 471 Cb 1.33 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.29 1bvn h SER 471 CO 0.50 0.01 0.10 -0.78 -0.53 0.00 0.00 176.83 176.13 1bvn h ASP 472 N 0.00 0.20 0.00 6.23 1.82 -1.93 -3.41 116.42 119.33 1bvn h ASP 472 Ca -0.00 -0.05 0.00 0.00 -0.39 0.00 0.00 57.03 56.59 1bvn h ASP 472 Cb 0.03 -0.05 0.00 0.00 0.68 0.00 0.00 39.33 39.98 1bvn h ASP 472 CO 0.00 0.19 0.00 0.61 -1.61 0.00 0.00 179.24 178.44 1bvn n GLY 473 N -1.01 0.93 3.74 -0.78 0.00 -0.43 -4.85 105.19 102.79 1bvn n GLY 473 Ca -0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.58 1bvn n GLY 473 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1bvn s THR 474 N -2.00 4.67 0.07 2.61 -1.32 -1.26 0.81 115.64 119.23 1bvn s THR 474 Ca 0.00 1.80 0.00 0.00 -1.21 0.00 0.00 61.69 62.29 1bvn s THR 474 Cb 0.00 -4.20 -0.04 0.00 -1.51 0.00 0.00 72.50 66.75 1bvn s THR 474 CO 0.00 0.33 -0.05 0.00 -2.21 0.00 0.00 174.62 172.69 1bvn s ALA 475 N 0.06 0.70 -0.34 11.08 0.00 0.15 -0.84 121.76 132.56 1bvn s ALA 475 Ca 0.42 -1.24 -0.12 0.00 0.00 0.00 0.00 51.96 51.03 1bvn s ALA 475 Cb -0.21 0.21 -0.01 0.00 0.00 0.00 0.00 23.12 23.11 1bvn s ALA 475 CO 0.25 -0.29 0.22 -1.14 0.00 0.00 0.00 175.76 174.80 1bvn s GLN 476 N -3.73 3.38 -0.18 0.00 0.74 -1.26 0.80 119.66 119.41 1bvn s GLN 476 Ca 0.08 -0.71 -0.03 0.00 0.05 0.00 0.00 55.36 54.74 1bvn s GLN 476 Cb 0.06 -3.75 -0.01 0.00 1.10 0.00 0.00 33.01 30.40 1bvn s GLN 476 CO -0.07 -0.47 -0.06 -0.06 -0.55 0.00 0.00 175.29 174.08 1bvn s PHE 477 N 1.68 2.94 -0.21 1.67 0.40 -0.83 -4.84 117.98 118.78 1bvn s PHE 477 Ca 0.05 -0.70 0.00 0.00 -0.60 0.00 0.00 56.93 55.69 1bvn s PHE 477 Cb -0.17 -2.00 0.05 0.00 0.51 0.00 0.00 43.02 41.40 1bvn s PHE 477 CO 0.09 -0.34 -0.06 0.45 0.70 0.00 0.00 175.22 176.06 1bvn s SER 478 N 0.92 3.53 -0.01 1.36 0.15 -1.26 -2.60 113.70 115.79 1bvn s SER 478 Ca -0.01 -1.00 0.07 0.00 0.70 0.00 0.00 55.95 55.71 1bvn s SER 478 Cb -0.15 -1.13 -0.02 0.00 -1.71 0.00 0.00 66.02 63.01 1bvn s SER 478 CO 0.01 -0.20 -0.21 -0.63 1.20 0.00 0.00 173.24 173.40 1bvn s ILE 479 N 1.45 1.65 0.11 6.45 1.01 -0.24 -4.99 121.20 126.64 1bvn s ILE 479 Ca -0.03 -0.94 0.05 0.00 0.00 0.00 0.00 60.65 59.73 1bvn s ILE 479 Cb -0.17 -1.38 -0.04 0.00 0.01 0.00 0.00 42.46 40.88 1bvn s ILE 479 CO -0.07 0.42 0.02 -0.55 0.00 0.00 0.00 174.94 174.77 1bvn s SER 480 N -0.60 5.10 0.00 3.58 0.15 -1.26 0.35 113.70 121.02 1bvn s SER 480 Ca 0.08 -0.18 0.07 0.00 0.70 0.00 0.00 55.95 56.62 1bvn s SER 480 Cb -0.08 -1.23 0.44 0.00 -1.71 0.00 0.00 66.02 63.44 1bvn s SER 480 CO -0.00 0.15 1.02 -0.46 1.20 0.00 0.00 173.24 175.14 1bvn n ASN 481 N 0.35 0.00 -0.00 5.45 6.94 -1.26 -0.44 115.26 126.30 1bvn n ASN 481 Ca -0.10 -1.11 0.09 0.00 -0.02 0.00 0.00 54.58 53.44 1bvn n ASN 481 Cb 0.53 0.00 -0.11 0.00 -2.36 0.00 0.00 39.78 37.84 1bvn n ASN 481 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 1bvn n SER 482 N -0.67 0.92 -4.50 0.53 7.64 -1.26 -5.00 113.62 111.28 1bvn n SER 482 Ca 0.06 -0.96 -0.48 0.00 1.01 0.00 0.00 58.87 58.50 1bvn n SER 482 Cb 0.03 0.99 -0.03 0.00 -1.01 0.00 0.00 64.21 64.19 1bvn n SER 482 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1bvn n ALA 483 N -1.44 -1.69 0.22 -0.43 0.00 0.42 -4.85 120.51 112.74 1bvn n ALA 483 Ca 0.04 0.44 0.05 0.00 0.00 0.00 0.00 53.44 53.96 1bvn n ALA 483 Cb 0.30 -1.83 0.48 0.00 0.00 0.00 0.00 19.45 18.40 1bvn n ALA 483 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 1bvn h GLN 484 N 1.88 0.00 -2.43 0.00 4.15 -1.94 -3.36 115.11 113.41 1bvn h GLN 484 Ca -0.36 0.00 -0.40 0.00 0.77 0.00 0.00 58.65 58.66 1bvn h GLN 484 Cb 1.39 0.00 -0.36 0.00 0.21 0.00 0.00 27.48 28.72 1bvn h GLN 484 CO 0.61 0.21 -0.69 -0.51 -1.93 0.00 0.00 178.83 176.53 1bvn s ASP 485 N -6.99 2.28 0.00 -0.69 1.01 -1.26 -4.95 116.67 106.07 1bvn s ASP 485 Ca -0.04 -0.87 0.00 0.00 0.71 0.00 0.00 52.55 52.35 1bvn s ASP 485 Cb 0.16 0.19 0.00 0.00 1.01 0.00 0.00 42.92 44.27 1bvn s ASP 485 CO 0.70 -0.40 0.41 -0.81 0.21 0.00 0.00 175.17 175.28 1bvn n PRO 486 N 5.29 0.24 -3.63 8.23 -0.04 -1.26 -4.71 135.00 139.12 1bvn n PRO 486 Ca -0.04 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.28 1bvn n PRO 486 Cb 0.45 -1.38 -0.07 0.00 -0.04 0.00 0.00 33.50 32.46 1bvn n PRO 486 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1bvn s PHE 487 N 1.33 -0.77 -0.11 0.54 -0.71 -1.26 -0.57 117.98 116.43 1bvn s PHE 487 Ca 0.00 1.86 0.01 0.00 -1.04 0.00 0.00 56.93 57.76 1bvn s PHE 487 Cb 0.00 0.27 -0.02 0.00 -1.21 0.00 0.00 43.02 42.06 1bvn s PHE 487 CO 0.00 -0.38 -0.12 0.42 -1.34 0.00 0.00 175.22 173.80 1bvn s ILE 488 N 0.32 3.15 0.08 -4.49 1.01 -0.83 -4.82 121.20 115.62 1bvn s ILE 488 Ca -0.00 -0.65 0.09 0.00 0.00 0.00 0.00 60.65 60.09 1bvn s ILE 488 Cb -0.05 -2.30 -0.03 0.00 0.01 0.00 0.00 42.46 40.09 1bvn s ILE 488 CO 0.01 0.54 -0.23 0.00 0.00 0.00 0.00 174.94 175.27 1bvn s ALA 489 N -0.01 1.99 0.15 9.38 0.00 -1.26 -0.53 121.76 131.48 1bvn s ALA 489 Ca -0.03 -1.24 -0.15 0.00 0.00 0.00 0.00 51.96 50.54 1bvn s ALA 489 Cb -0.14 -0.34 0.02 0.00 0.00 0.00 0.00 23.12 22.66 1bvn s ALA 489 CO 0.04 0.44 0.40 -1.50 0.00 0.00 0.00 175.76 175.14 1bvn s ILE 490 N -0.97 0.06 0.03 0.00 2.07 0.61 -2.58 121.20 120.43 1bvn s ILE 490 Ca 0.09 -0.79 -0.27 0.00 -1.41 0.00 0.00 60.65 58.27 1bvn s ILE 490 Cb -0.10 -1.38 0.09 0.00 0.13 0.00 0.00 42.46 41.21 1bvn s ILE 490 CO 0.03 -0.29 1.23 -1.38 -1.91 0.00 0.00 174.94 172.62 1bvn s HIS 491 N -3.85 0.03 0.23 3.50 -3.43 -1.26 -1.24 115.29 109.26 1bvn s HIS 491 Ca 0.07 -0.20 -0.11 0.00 -0.80 0.00 0.00 55.06 54.01 1bvn s HIS 491 Cb 0.02 0.59 0.30 0.00 -1.43 0.00 0.00 32.58 32.06 1bvn s HIS 491 CO -0.08 -0.42 1.62 0.00 -2.00 0.00 0.00 174.74 173.86 1bvn h ALA 492 N 2.00 0.52 -0.21 -1.38 0.00 -1.64 -1.12 119.26 117.43 1bvn h ALA 492 Ca -0.24 0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1bvn h ALA 492 Cb 1.19 0.50 0.00 0.00 0.00 0.00 0.00 17.79 19.48 1bvn h ALA 492 CO 0.32 -0.42 0.00 0.39 0.00 0.00 0.00 179.25 179.54 1bvn n GLU 493 N -5.44 1.63 0.00 0.00 1.02 -1.26 -3.21 120.64 113.37 1bvn n GLU 493 Ca 0.10 -0.82 0.00 0.00 -0.02 0.00 0.00 57.16 56.42 1bvn n GLU 493 Cb 0.38 -1.27 0.00 0.00 -0.02 0.00 0.00 31.44 30.53 1bvn n GLU 493 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1bvn n SER 494 N 0.15 1.41 -4.70 1.62 3.41 -0.45 -5.01 113.62 110.06 1bvn n SER 494 Ca 0.08 -1.51 -0.41 0.00 -0.26 0.00 0.00 58.87 56.77 1bvn n SER 494 Cb 0.25 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.16 1bvn n SER 494 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1bvn s LYS 495 N -0.51 4.43 0.00 4.33 2.20 -1.07 -1.08 119.74 128.04 1bvn s LYS 495 Ca 0.00 1.02 0.19 0.00 -0.36 0.00 0.00 55.97 56.81 1bvn s LYS 495 Cb 0.00 -3.48 1.13 0.00 -1.51 0.00 0.00 37.83 33.97 1bvn s LYS 495 CO 0.00 -0.05 1.52 1.28 -0.36 0.00 0.00 175.35 177.74