#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2f83 n VAL 3 N 0.00 0.00 -2.10 0.00 0.31 -1.26 -4.77 118.33 110.51 2f83 n VAL 3 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2f83 n VAL 3 Cb 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 2f83 n VAL 3 CO 0.00 0.00 0.00 1.07 -1.32 0.00 0.00 176.83 176.58 2f83 n THR 4 N -0.07 0.00 -2.36 2.52 5.66 -1.26 -4.61 114.28 114.16 2f83 n THR 4 Ca 0.00 0.00 -0.01 0.00 -3.05 0.00 0.00 64.05 60.99 2f83 n THR 4 Cb 0.00 -1.33 -0.01 0.00 -1.55 0.00 0.00 70.33 67.44 2f83 n THR 4 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2f83 n GLN 5 N -0.76 -4.00 -0.85 1.09 0.00 -1.26 -4.97 117.38 106.63 2f83 n GLN 5 Ca 0.00 2.92 -0.21 0.00 0.00 0.00 0.00 57.00 59.71 2f83 n GLN 5 Cb 0.00 -3.83 0.03 0.00 0.00 0.00 0.00 30.24 26.44 2f83 n GLN 5 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 2f83 n LEU 6 N 1.90 -2.43 -4.02 2.61 4.32 -1.26 -4.95 117.00 113.16 2f83 n LEU 6 Ca -0.06 -0.03 -0.31 0.00 -0.02 0.00 0.00 56.01 55.58 2f83 n LEU 6 Cb 0.09 -0.54 -0.16 0.00 -1.62 0.00 0.00 43.42 41.20 2f83 n LEU 6 CO 0.06 -2.37 -0.46 -0.76 -1.22 0.00 0.00 177.39 172.63 2f83 s LEU 7 N 7.00 2.61 -0.27 2.23 1.43 0.23 -4.99 118.68 126.91 2f83 s LEU 7 Ca 0.22 -1.04 -0.30 0.00 -1.03 0.00 0.00 54.13 51.98 2f83 s LEU 7 Cb 0.04 -1.33 -0.07 0.00 0.03 0.00 0.00 46.19 44.86 2f83 s LEU 7 CO 0.36 -0.15 2.22 1.17 0.23 0.00 0.00 176.35 180.18 2f83 n LYS 8 N 4.61 1.65 -0.89 1.70 4.81 -1.26 -2.87 118.16 125.91 2f83 n LYS 8 Ca -0.15 0.44 0.00 0.00 -0.87 0.00 0.00 58.31 57.74 2f83 n LYS 8 Cb 0.45 -2.98 0.00 0.00 0.02 0.00 0.00 35.03 32.52 2f83 n LYS 8 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2f83 n ASP 9 N 11.17 -1.19 -3.54 3.14 8.00 0.23 -4.99 116.55 129.36 2f83 n ASP 9 Ca 0.34 0.00 -0.01 0.00 0.71 0.00 0.00 54.79 55.83 2f83 n ASP 9 Cb 0.38 -0.40 -0.05 0.00 -0.02 0.00 0.00 41.12 41.03 2f83 n ASP 9 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2f83 s THR 10 N -2.60 -0.53 -0.12 -3.53 2.01 0.37 -2.65 115.64 108.60 2f83 s THR 10 Ca 0.00 0.00 -0.06 0.00 0.31 0.00 0.00 61.69 61.94 2f83 s THR 10 Cb 0.00 -1.00 -0.04 0.00 0.01 0.00 0.00 72.50 71.47 2f83 s THR 10 CO 0.00 0.00 0.11 0.00 -0.69 0.00 0.00 174.62 174.04 2f83 s PHE 12 N -0.90 3.73 -0.32 0.00 0.40 -1.26 -1.82 117.98 117.80 2f83 s PHE 12 Ca 0.14 1.32 -0.22 0.00 -0.60 0.00 0.00 56.93 57.57 2f83 s PHE 12 Cb -0.12 -2.67 -0.00 0.00 0.51 0.00 0.00 43.02 40.74 2f83 s PHE 12 CO 0.03 0.37 0.70 -2.00 0.70 0.00 0.00 175.22 175.02 2f83 s GLU 13 N -0.33 3.86 2.57 0.44 2.56 -0.73 -4.94 118.70 122.14 2f83 s GLU 13 Ca 0.33 0.34 0.00 0.00 0.00 0.00 0.00 54.97 55.65 2f83 s GLU 13 Cb -0.19 -3.75 0.00 0.00 2.00 0.00 0.00 34.13 32.19 2f83 s GLU 13 CO 0.20 -0.67 0.00 0.41 -0.56 0.00 0.00 175.26 174.64 2f83 n GLY 14 N 4.41 -0.73 3.06 -1.50 0.00 -1.26 -4.53 105.19 104.63 2f83 n GLY 14 Ca 0.01 -1.15 0.00 0.00 0.00 0.00 0.00 46.02 44.88 2f83 n GLY 14 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2f83 n GLY 15 N 0.00 0.51 3.59 -0.02 0.00 -1.26 -4.77 105.19 103.24 2f83 n GLY 15 Ca 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.53 2f83 n GLY 15 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2f83 n ASP 16 N -0.13 1.54 0.00 1.61 9.92 -1.26 -0.00 116.55 128.23 2f83 n ASP 16 Ca 0.00 1.14 0.00 0.00 -0.53 0.00 0.00 54.79 55.40 2f83 n ASP 16 Cb 0.07 -1.23 0.00 0.00 -0.64 0.00 0.00 41.12 39.31 2f83 n ASP 16 CO 0.00 0.00 0.00 2.30 0.13 0.00 0.00 177.20 179.63 2f83 n ILE 17 N 1.77 0.00 0.00 0.53 -6.64 0.23 -4.81 119.36 110.44 2f83 n ILE 17 Ca 0.15 0.00 0.00 0.00 -1.77 0.00 0.00 62.75 61.13 2f83 n ILE 17 Cb 0.24 0.42 0.00 0.00 -1.44 0.00 0.00 39.64 38.87 2f83 n ILE 17 CO 0.00 0.00 0.00 1.07 -1.77 0.00 0.00 176.55 175.85 2f83 n THR 18 N -1.32 0.00 -4.98 7.28 5.66 -1.14 -5.02 114.28 114.76 2f83 n THR 18 Ca 0.00 0.00 -0.28 0.00 -3.05 0.00 0.00 64.05 60.72 2f83 n THR 18 Cb 0.01 0.00 -0.15 0.00 -1.55 0.00 0.00 70.33 68.63 2f83 n THR 18 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 2f83 s THR 19 N -2.00 1.78 0.16 1.09 2.01 -1.26 -0.39 115.64 117.04 2f83 s THR 19 Ca 0.00 -1.06 0.03 0.00 0.31 0.00 0.00 61.69 60.97 2f83 s THR 19 Cb 0.00 -1.50 -0.01 0.00 0.01 0.00 0.00 72.50 71.00 2f83 s THR 19 CO 0.00 0.42 0.12 1.33 -0.69 0.00 0.00 174.62 175.80 2f83 n VAL 20 N 2.29 0.00 -3.96 3.82 0.24 0.14 -4.97 118.33 115.90 2f83 n VAL 20 Ca -0.16 -1.14 -0.29 0.00 -2.04 0.00 0.00 64.34 60.71 2f83 n VAL 20 Cb 0.52 0.53 -0.17 0.00 -1.47 0.00 0.00 33.84 33.26 2f83 n VAL 20 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 2f83 s PHE 21 N -2.55 1.91 0.22 6.34 0.40 -1.26 0.11 117.98 123.15 2f83 s PHE 21 Ca 0.17 -1.11 0.10 0.00 -0.60 0.00 0.00 56.93 55.49 2f83 s PHE 21 Cb 0.01 -1.44 -0.04 0.00 0.51 0.00 0.00 43.02 42.06 2f83 s PHE 21 CO 0.12 -0.62 -0.14 0.95 0.70 0.00 0.00 175.22 176.22 2f83 s THR 22 N 1.57 2.84 -1.75 0.64 -4.23 -0.94 -3.96 115.64 109.80 2f83 s THR 22 Ca 0.03 -1.96 0.30 0.00 -1.18 0.00 0.00 61.69 58.89 2f83 s THR 22 Cb -0.14 -2.43 0.64 0.00 1.34 0.00 0.00 72.50 71.91 2f83 s THR 22 CO -0.09 -0.21 2.04 -0.81 -0.54 0.00 0.00 174.62 175.01 2f83 n PRO 23 N -0.17 0.78 -3.55 3.99 -0.04 -1.26 -4.64 135.00 130.11 2f83 n PRO 23 Ca -0.09 -0.13 -0.09 0.00 -0.04 0.00 0.00 63.50 63.14 2f83 n PRO 23 Cb 0.57 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.50 2f83 n PRO 23 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2f83 s SER 24 N -2.31 -0.36 0.27 3.54 1.04 -1.26 -5.01 113.70 109.61 2f83 s SER 24 Ca 0.36 0.22 -0.04 0.00 0.48 0.00 0.00 55.95 56.97 2f83 s SER 24 Cb 0.21 0.33 0.35 0.00 0.10 0.00 0.00 66.02 67.01 2f83 s SER 24 CO 0.43 -0.46 1.90 0.00 0.98 0.00 0.00 173.24 176.08 2f83 h ALA 25 N 2.30 1.28 -0.91 5.32 0.00 -1.91 0.45 119.26 125.78 2f83 h ALA 25 Ca -0.20 -0.12 0.12 0.00 0.00 0.00 0.00 54.91 54.72 2f83 h ALA 25 Cb 1.19 -0.32 -0.07 0.00 0.00 0.00 0.00 17.79 18.59 2f83 h ALA 25 CO 0.31 0.59 0.59 -0.22 0.00 0.00 0.00 179.25 180.51 2f83 h LYS 26 N 1.11 0.81 0.12 0.00 3.64 -1.97 0.20 116.57 120.49 2f83 h LYS 26 Ca 0.28 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.61 2f83 h LYS 26 Cb 0.02 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 31.66 2f83 h LYS 26 CO -0.05 0.53 -0.06 -0.92 -2.27 0.00 0.00 179.45 176.69 2f83 h TYR 27 N 0.83 -0.15 -0.99 1.91 3.20 -1.64 -3.13 116.97 117.00 2f83 h TYR 27 Ca 0.44 -0.00 0.30 0.00 3.14 0.00 0.00 58.73 62.61 2f83 h TYR 27 Cb 0.54 0.05 -0.18 0.00 1.54 0.00 0.00 36.73 38.68 2f83 h TYR 27 CO -0.00 0.29 0.16 0.00 -1.64 0.00 0.00 178.16 176.97 2f83 h GLN 29 N 0.02 0.41 0.01 0.00 4.15 -0.64 0.52 115.11 119.59 2f83 h GLN 29 Ca 0.66 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 60.05 2f83 h GLN 29 Cb 1.47 -0.09 -0.00 0.00 0.21 0.00 0.00 27.48 29.06 2f83 h GLN 29 CO -0.87 0.27 -0.01 0.28 -1.93 0.00 0.00 178.83 176.57 2f83 h VAL 30 N 0.42 0.97 -0.51 2.39 2.07 0.21 0.31 116.25 122.12 2f83 h VAL 30 Ca 0.22 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.83 2f83 h VAL 30 Cb 0.17 0.97 -0.07 0.00 -1.52 0.00 0.00 31.29 30.85 2f83 h VAL 30 CO -0.18 0.00 0.10 0.58 0.02 0.00 0.00 177.57 178.08 2f83 h VAL 31 N -0.02 0.71 -0.40 2.57 2.07 0.18 0.51 116.25 121.87 2f83 h VAL 31 Ca 0.00 -0.08 -0.00 0.00 0.82 0.00 0.00 66.70 67.44 2f83 h VAL 31 Cb 0.02 0.45 -0.02 0.00 -1.52 0.00 0.00 31.29 30.23 2f83 h VAL 31 CO -0.00 0.04 0.24 0.00 0.02 0.00 0.00 177.57 177.87 2f83 h THR 33 N 0.52 0.17 0.00 0.00 2.02 0.82 -2.24 112.91 114.20 2f83 h THR 33 Ca 0.14 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.32 2f83 h THR 33 Cb 0.01 0.17 0.00 0.00 -1.74 0.00 0.00 68.15 66.58 2f83 h THR 33 CO -0.03 0.00 0.00 -1.22 0.37 0.00 0.00 175.52 174.64 2f83 n TYR 34 N -5.48 0.65 -2.43 3.16 4.01 0.05 -4.70 117.16 112.42 2f83 n TYR 34 Ca -0.09 0.28 -0.41 0.00 -0.16 0.00 0.00 57.90 57.52 2f83 n TYR 34 Cb 0.39 -0.95 -0.04 0.00 -0.31 0.00 0.00 39.34 38.43 2f83 n TYR 34 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 2f83 s HIS 35 N -3.33 3.49 0.33 -0.72 2.46 -0.59 -4.93 115.29 111.99 2f83 s HIS 35 Ca 0.02 1.48 0.09 0.00 0.47 0.00 0.00 55.06 57.12 2f83 s HIS 35 Cb 0.08 -3.37 0.83 0.00 -0.13 0.00 0.00 32.58 29.98 2f83 s HIS 35 CO 0.30 -0.99 1.78 -1.00 -2.47 0.00 0.00 174.74 172.36 2f83 h PRO 36 N 5.34 0.66 0.00 2.88 0.13 -1.86 -3.22 132.00 135.93 2f83 h PRO 36 Ca -0.44 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2f83 h PRO 36 Cb 1.21 -0.15 0.00 0.00 0.13 0.00 0.00 31.00 32.20 2f83 h PRO 36 CO 0.74 0.43 -0.89 0.54 -0.23 0.00 0.00 178.00 178.60 2f83 n ARG 37 N -4.73 2.15 0.00 0.86 1.74 -1.26 -4.91 116.66 110.51 2f83 n ARG 37 Ca 0.23 -0.04 0.00 0.00 -0.77 0.00 0.00 57.85 57.28 2f83 n ARG 37 Cb 0.63 -1.01 0.00 0.00 -1.02 0.00 0.00 32.46 31.06 2f83 n ARG 37 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2f83 n LEU 39 N -1.13 0.00 -4.37 0.00 0.00 -1.25 -3.87 117.00 106.37 2f83 n LEU 39 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 56.01 55.81 2f83 n LEU 39 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 43.42 43.33 2f83 n LEU 39 CO 0.00 0.00 -0.20 -0.76 0.00 0.00 0.00 177.39 176.43 2f83 s LEU 40 N 0.00 1.77 0.00 -1.96 1.43 -1.03 -2.06 118.68 116.84 2f83 s LEU 40 Ca 0.00 -1.58 0.00 0.00 -1.03 0.00 0.00 54.13 51.52 2f83 s LEU 40 Cb 0.00 0.12 0.00 0.00 0.03 0.00 0.00 46.19 46.34 2f83 s LEU 40 CO 0.00 -0.89 0.00 2.22 0.23 0.00 0.00 176.35 177.91 2f83 n PHE 41 N -0.65 0.00 -3.72 0.29 1.16 -1.04 -2.73 117.46 110.77 2f83 n PHE 41 Ca -0.00 0.00 -0.12 0.00 -1.87 0.00 0.00 57.45 55.46 2f83 n PHE 41 Cb 0.65 0.00 -0.12 0.00 -1.61 0.00 0.00 39.48 38.39 2f83 n PHE 41 CO 0.00 0.00 0.00 0.99 -1.87 0.00 0.00 176.76 175.88 2f83 s THR 42 N -2.00 -0.04 0.04 1.97 2.01 -1.07 -1.66 115.64 114.89 2f83 s THR 42 Ca 0.00 0.13 0.09 0.00 0.31 0.00 0.00 61.69 62.22 2f83 s THR 42 Cb 0.00 -0.45 -0.03 0.00 0.01 0.00 0.00 72.50 72.03 2f83 s THR 42 CO 0.00 0.05 -0.25 0.12 -0.69 0.00 0.00 174.62 173.85 2f83 s PHE 43 N 1.31 2.21 -0.23 4.92 2.19 0.41 -2.04 117.98 126.74 2f83 s PHE 43 Ca -0.09 -0.41 -0.11 0.00 0.33 0.00 0.00 56.93 56.65 2f83 s PHE 43 Cb -0.10 -1.34 -0.05 0.00 -1.31 0.00 0.00 43.02 40.22 2f83 s PHE 43 CO -0.10 0.09 0.19 0.99 1.83 0.00 0.00 175.22 178.23 2f83 s THR 44 N -0.77 5.34 0.22 0.12 2.01 -0.59 0.29 115.64 122.27 2f83 s THR 44 Ca 0.11 0.26 0.06 0.00 0.31 0.00 0.00 61.69 62.42 2f83 s THR 44 Cb -0.10 -3.53 -0.03 0.00 0.01 0.00 0.00 72.50 68.85 2f83 s THR 44 CO 0.02 0.34 0.24 0.00 -0.69 0.00 0.00 174.62 174.52 2f83 s ALA 45 N 1.04 3.72 0.07 7.40 0.00 -0.59 0.63 121.76 134.02 2f83 s ALA 45 Ca 0.09 -1.29 -0.31 0.00 0.00 0.00 0.00 51.96 50.46 2f83 s ALA 45 Cb -0.13 -1.48 -0.09 0.00 0.00 0.00 0.00 23.12 21.42 2f83 s ALA 45 CO 0.05 0.32 1.79 -2.00 0.00 0.00 0.00 175.76 175.92 2f83 s GLU 46 N -3.68 4.16 -0.02 0.00 2.12 -1.26 -4.76 118.70 115.26 2f83 s GLU 46 Ca 0.33 2.47 -0.29 0.00 0.36 0.00 0.00 54.97 57.84 2f83 s GLU 46 Cb -0.09 -3.77 0.10 0.00 0.26 0.00 0.00 34.13 30.63 2f83 s GLU 46 CO 0.26 -0.84 0.89 -1.54 -0.54 0.00 0.00 175.26 173.49 2f83 s SER 47 N 3.10 -0.38 0.52 -1.70 1.04 -1.26 -5.01 113.70 110.01 2f83 s SER 47 Ca 0.80 0.08 0.34 0.00 0.48 0.00 0.00 55.95 57.65 2f83 s SER 47 Cb -0.42 0.38 1.50 0.00 0.10 0.00 0.00 66.02 67.59 2f83 s SER 47 CO 0.36 -0.59 2.01 1.55 0.98 0.00 0.00 173.24 177.54 2f83 h PRO 48 N 2.11 0.00 0.00 4.02 0.13 -1.97 -2.22 132.00 134.07 2f83 h PRO 48 Ca -0.22 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.91 2f83 h PRO 48 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 2f83 h PRO 48 CO 0.31 0.00 0.00 0.77 -0.23 0.00 0.00 178.00 178.85 2f83 h SER 49 N 0.00 0.00 -5.23 1.44 0.02 -1.94 -3.43 113.55 104.40 2f83 h SER 49 Ca 0.00 0.00 -0.38 0.00 -0.84 0.00 0.00 61.79 60.57 2f83 h SER 49 Cb 0.38 0.00 -0.14 0.00 0.14 0.00 0.00 62.40 62.78 2f83 h SER 49 CO 0.00 0.00 -0.56 -1.61 -1.14 0.00 0.00 176.83 173.52 2f83 s GLU 50 N -3.60 1.52 0.61 3.45 0.41 -0.83 -5.06 118.70 115.19 2f83 s GLU 50 Ca -0.00 -1.85 0.02 0.00 -0.41 0.00 0.00 54.97 52.73 2f83 s GLU 50 Cb 0.09 0.10 0.08 0.00 -1.78 0.00 0.00 34.13 32.61 2f83 s GLU 50 CO 0.35 -0.47 0.84 0.16 -0.49 0.00 0.00 175.26 175.65 2f83 s ASP 51 N -3.31 4.92 0.17 -0.19 3.84 -1.26 -4.72 116.67 116.12 2f83 s ASP 51 Ca 0.38 -0.31 -0.15 0.00 -0.00 0.00 0.00 52.55 52.47 2f83 s ASP 51 Cb 0.05 -0.35 0.12 0.00 -1.38 0.00 0.00 42.92 41.36 2f83 s ASP 51 CO 0.18 -1.42 1.71 -0.65 -0.00 0.00 0.00 175.17 174.99 2f83 h PRO 52 N -0.10 0.15 -7.31 2.11 0.11 -2.00 -3.38 132.00 121.58 2f83 h PRO 52 Ca -0.38 -0.01 -0.48 0.00 0.11 0.00 0.00 66.00 65.24 2f83 h PRO 52 Cb 1.28 -0.03 0.16 0.00 0.11 0.00 0.00 31.00 32.52 2f83 h PRO 52 CO 0.45 0.10 0.23 0.95 -0.21 0.00 0.00 178.00 179.52 2f83 s THR 53 N -6.17 2.56 0.00 -1.15 -4.23 -1.26 -2.85 115.64 102.53 2f83 s THR 53 Ca -0.13 0.18 0.00 0.00 -1.18 0.00 0.00 61.69 60.56 2f83 s THR 53 Cb 0.14 -2.59 0.00 0.00 1.34 0.00 0.00 72.50 71.38 2f83 s THR 53 CO 0.71 -0.24 0.00 -1.14 -0.54 0.00 0.00 174.62 173.42 2f83 n ARG 54 N -4.00 0.00 -2.07 3.99 0.63 -1.26 -4.95 116.66 109.00 2f83 n ARG 54 Ca 0.07 0.00 -0.41 0.00 -0.92 0.00 0.00 57.85 56.59 2f83 n ARG 54 Cb 0.55 -1.74 -0.02 0.00 0.45 0.00 0.00 32.46 31.69 2f83 n ARG 54 CO 0.00 0.00 0.00 -1.58 -2.51 0.00 0.00 177.63 173.54 2f83 s TRP 55 N -0.94 3.07 -0.54 -0.14 0.51 -1.13 -1.61 118.94 118.15 2f83 s TRP 55 Ca 0.00 1.12 0.00 0.00 -2.12 0.00 0.00 56.10 55.10 2f83 s TRP 55 Cb 0.00 -3.76 0.00 0.00 -0.81 0.00 0.00 33.47 28.90 2f83 s TRP 55 CO 0.00 -2.39 0.00 1.19 -0.51 0.00 0.00 176.95 175.24 2f83 n PHE 56 N 2.15 0.00 -2.60 -1.98 3.72 0.20 -4.74 117.46 114.21 2f83 n PHE 56 Ca 0.06 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 57.03 2f83 n PHE 56 Cb 0.41 -1.27 -0.02 0.00 -0.94 0.00 0.00 39.48 37.65 2f83 n PHE 56 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 2f83 s THR 57 N -2.10 4.42 -0.40 4.37 2.01 -0.63 -2.21 115.64 121.09 2f83 s THR 57 Ca 0.00 1.62 -0.10 0.00 0.31 0.00 0.00 61.69 63.52 2f83 s THR 57 Cb 0.00 -4.40 0.06 0.00 0.01 0.00 0.00 72.50 68.17 2f83 s THR 57 CO 0.00 -0.54 0.24 0.00 -0.69 0.00 0.00 174.62 173.63 2f83 s VAL 59 N 1.48 5.10 -0.21 0.00 1.01 -0.87 0.28 120.40 127.19 2f83 s VAL 59 Ca 0.02 0.18 -0.22 0.00 0.00 0.00 0.00 61.98 61.96 2f83 s VAL 59 Cb -0.22 -3.88 -0.02 0.00 0.00 0.00 0.00 36.38 32.26 2f83 s VAL 59 CO 0.04 -0.14 0.69 -0.76 0.00 0.00 0.00 175.10 174.92 2f83 s LEU 60 N 2.18 4.13 0.29 3.92 1.43 0.47 -2.61 118.68 128.50 2f83 s LEU 60 Ca 0.15 0.89 0.10 0.00 -1.03 0.00 0.00 54.13 54.24 2f83 s LEU 60 Cb -0.16 -2.98 -0.05 0.00 0.03 0.00 0.00 46.19 43.04 2f83 s LEU 60 CO 0.12 -0.33 -0.08 -0.54 0.23 0.00 0.00 176.35 175.75 2f83 s LYS 61 N 2.13 2.00 -0.05 1.70 1.02 -1.10 -0.60 119.74 124.84 2f83 s LYS 61 Ca 0.31 -1.65 -0.21 0.00 0.02 0.00 0.00 55.97 54.44 2f83 s LYS 61 Cb -0.16 -1.94 0.04 0.00 -0.52 0.00 0.00 37.83 35.25 2f83 s LYS 61 CO 0.10 0.29 0.46 0.34 -0.92 0.00 0.00 175.35 175.62 2f83 s ASP 62 N -3.62 -0.40 0.15 2.83 3.68 0.99 -2.45 116.67 117.85 2f83 s ASP 62 Ca 0.32 0.44 -0.24 0.00 2.13 0.00 0.00 52.55 55.20 2f83 s ASP 62 Cb -0.04 0.49 0.07 0.00 -1.45 0.00 0.00 42.92 41.99 2f83 s ASP 62 CO 0.18 -0.46 0.65 -0.94 0.13 0.00 0.00 175.17 174.72 2f83 s SER 63 N -1.05 -0.51 0.74 -0.34 1.04 -1.26 -4.43 113.70 107.88 2f83 s SER 63 Ca -0.11 -0.06 0.00 0.00 0.48 0.00 0.00 55.95 56.26 2f83 s SER 63 Cb -0.03 0.59 0.00 0.00 0.10 0.00 0.00 66.02 66.67 2f83 s SER 63 CO 0.06 -0.96 0.00 0.52 0.98 0.00 0.00 173.24 173.83 2f83 n VAL 64 N -0.37 0.00 0.00 5.02 0.31 -1.26 -2.88 118.33 119.14 2f83 n VAL 64 Ca -0.15 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.18 2f83 n VAL 64 Cb 0.64 -1.66 0.00 0.00 -0.91 0.00 0.00 33.84 31.91 2f83 n VAL 64 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2f83 n THR 65 N -1.65 0.00 -1.40 2.52 -2.24 -1.26 -3.45 114.28 106.80 2f83 n THR 65 Ca 0.00 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.64 2f83 n THR 65 Cb 0.00 0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 68.17 2f83 n THR 65 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2f83 n GLU 66 N -0.54 -0.98 -3.90 -0.78 1.02 -1.14 -4.96 120.64 109.37 2f83 n GLU 66 Ca 0.00 0.98 -0.09 0.00 -0.02 0.00 0.00 57.16 58.03 2f83 n GLU 66 Cb 0.00 -5.07 -0.02 0.00 -0.02 0.00 0.00 31.44 26.33 2f83 n GLU 66 CO 0.00 0.00 0.00 -0.08 1.18 0.00 0.00 177.13 178.23 2f83 s THR 67 N -2.49 0.00 0.09 2.62 -1.32 -1.22 -4.97 115.64 108.34 2f83 s THR 67 Ca 0.00 -1.15 -0.01 0.00 -1.21 0.00 0.00 61.69 59.32 2f83 s THR 67 Cb 0.00 -2.37 -0.04 0.00 -1.51 0.00 0.00 72.50 68.58 2f83 s THR 67 CO 0.00 0.00 0.01 -0.76 -2.21 0.00 0.00 174.62 171.66 2f83 s LEU 68 N -3.02 2.13 0.06 9.08 1.02 -1.26 -4.81 118.68 121.88 2f83 s LEU 68 Ca 0.17 -1.11 -0.31 0.00 0.02 0.00 0.00 54.13 52.91 2f83 s LEU 68 Cb -0.04 0.24 -0.08 0.00 0.02 0.00 0.00 46.19 46.33 2f83 s LEU 68 CO 0.10 -0.66 1.63 -2.84 0.02 0.00 0.00 176.35 174.61 2f83 s PRO 69 N -3.98 4.20 0.49 1.29 0.02 -1.26 -4.82 135.00 130.93 2f83 s PRO 69 Ca 0.16 2.30 -0.16 0.00 0.02 0.00 0.00 61.00 63.32 2f83 s PRO 69 Cb 0.08 -3.60 -0.08 0.00 0.02 0.00 0.00 34.50 30.91 2f83 s PRO 69 CO -0.04 -0.72 0.94 1.03 -0.33 0.00 0.00 177.00 177.88 2f83 s ARG 70 N 2.65 3.94 -0.20 5.54 0.52 -1.26 -1.77 118.95 128.36 2f83 s ARG 70 Ca 0.73 0.88 -0.27 0.00 -0.52 0.00 0.00 55.73 56.55 2f83 s ARG 70 Cb -0.39 -2.18 0.07 0.00 0.52 0.00 0.00 34.95 32.97 2f83 s ARG 70 CO 0.32 -0.21 0.73 0.54 0.02 0.00 0.00 175.30 176.70 2f83 s VAL 71 N -2.55 0.00 0.24 3.52 0.11 -0.76 -4.93 120.40 116.04 2f83 s VAL 71 Ca 0.58 0.00 -0.30 0.00 -2.93 0.00 0.00 61.98 59.33 2f83 s VAL 71 Cb -0.10 -1.00 -0.09 0.00 -1.53 0.00 0.00 36.38 33.66 2f83 s VAL 71 CO 0.30 0.00 1.00 0.20 -3.33 0.00 0.00 175.10 173.27 2f83 s ASN 72 N -0.16 7.49 -0.30 3.54 0.01 -1.26 0.38 114.94 124.65 2f83 s ASN 72 Ca -0.03 2.06 -0.08 0.00 -0.71 0.00 0.00 52.86 54.10 2f83 s ASN 72 Cb -0.03 -2.61 0.16 0.00 0.41 0.00 0.00 41.25 39.18 2f83 s ASN 72 CO 0.03 0.03 0.73 -0.13 -1.51 0.00 0.00 177.10 176.25 2f83 s ARG 73 N -1.17 0.49 0.21 -0.60 1.81 -1.08 -4.78 118.95 113.82 2f83 s ARG 73 Ca 0.43 1.05 -0.32 0.00 -1.72 0.00 0.00 55.73 55.17 2f83 s ARG 73 Cb -0.28 0.61 -0.14 0.00 -0.45 0.00 0.00 34.95 34.70 2f83 s ARG 73 CO 0.35 -0.34 1.41 2.41 -0.68 0.00 0.00 175.30 178.45 2f83 n THR 74 N 5.37 0.73 -1.20 0.02 -1.04 -1.26 -1.51 114.28 115.39 2f83 n THR 74 Ca -0.07 -0.18 -0.07 0.00 -2.04 0.00 0.00 64.05 61.69 2f83 n THR 74 Cb 0.51 -1.39 -0.03 0.00 -1.82 0.00 0.00 70.33 67.60 2f83 n THR 74 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2f83 n ALA 75 N 2.16 -0.10 -2.91 2.41 0.00 -1.26 -4.93 120.51 115.88 2f83 n ALA 75 Ca 0.13 0.11 -0.41 0.00 0.00 0.00 0.00 53.44 53.27 2f83 n ALA 75 Cb 0.30 -1.01 -0.11 0.00 0.00 0.00 0.00 19.45 18.63 2f83 n ALA 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2f83 s ALA 76 N -2.22 3.31 -0.34 0.00 0.00 -0.57 -1.54 121.76 120.40 2f83 s ALA 76 Ca 0.00 -1.85 -0.10 0.00 0.00 0.00 0.00 51.96 50.01 2f83 s ALA 76 Cb 0.00 -2.66 0.01 0.00 0.00 0.00 0.00 23.12 20.47 2f83 s ALA 76 CO 0.00 -1.48 0.18 0.42 0.00 0.00 0.00 175.76 174.88 2f83 s ILE 77 N 1.54 4.61 0.31 0.00 -1.09 0.15 0.14 121.20 126.85 2f83 s ILE 77 Ca 0.02 -0.63 0.08 0.00 -2.23 0.00 0.00 60.65 57.90 2f83 s ILE 77 Cb -0.20 -3.46 -0.04 0.00 -1.58 0.00 0.00 42.46 37.18 2f83 s ILE 77 CO 0.06 -0.08 0.12 -0.44 -1.23 0.00 0.00 174.94 173.37 2f83 s SER 78 N 1.59 4.79 0.00 3.58 0.01 -1.14 0.15 113.70 122.69 2f83 s SER 78 Ca 0.03 -0.65 0.00 0.00 1.31 0.00 0.00 55.95 56.64 2f83 s SER 78 Cb -0.18 -0.86 0.00 0.00 0.21 0.00 0.00 66.02 65.19 2f83 s SER 78 CO 0.07 -0.19 0.00 0.61 0.41 0.00 0.00 173.24 174.14 2f83 n GLY 79 N -1.10 1.47 3.28 3.44 0.00 -0.66 -0.60 105.19 111.02 2f83 n GLY 79 Ca -0.04 -0.94 -0.20 0.00 0.00 0.00 0.00 46.02 44.84 2f83 n GLY 79 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2f83 s TYR 80 N -6.61 1.59 0.73 1.61 1.51 -1.26 -2.49 117.35 112.42 2f83 s TYR 80 Ca 0.00 -0.52 -0.11 0.00 -1.01 0.00 0.00 57.07 55.43 2f83 s TYR 80 Cb 0.00 -0.81 0.03 0.00 -0.11 0.00 0.00 41.96 41.07 2f83 s TYR 80 CO 0.00 0.22 1.08 -1.54 -1.11 0.00 0.00 175.55 174.21 2f83 s SER 81 N -2.55 5.16 -0.18 2.29 1.04 -0.87 -4.94 113.70 113.65 2f83 s SER 81 Ca 0.12 1.30 0.02 0.00 0.48 0.00 0.00 55.95 57.87 2f83 s SER 81 Cb -0.05 -2.11 0.28 0.00 0.10 0.00 0.00 66.02 64.24 2f83 s SER 81 CO 0.05 -1.54 1.35 0.49 0.98 0.00 0.00 173.24 174.56 2f83 n PHE 82 N -3.16 1.23 0.01 5.02 3.72 -1.26 -4.42 117.46 118.61 2f83 n PHE 82 Ca 0.07 -0.99 -0.13 0.00 -0.05 0.00 0.00 57.45 56.36 2f83 n PHE 82 Cb 0.56 -0.51 -0.10 0.00 -0.94 0.00 0.00 39.48 38.49 2f83 n PHE 82 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 2f83 h LYS 83 N 0.53 -0.08 -0.90 -1.08 1.57 -1.92 -3.00 116.57 111.70 2f83 h LYS 83 Ca 0.24 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.02 2f83 h LYS 83 Cb 1.71 0.02 0.00 0.00 0.08 0.00 0.00 32.23 34.04 2f83 h LYS 83 CO 0.43 0.42 0.00 1.04 -0.57 0.00 0.00 179.45 180.77 2f83 n GLN 84 N -4.88 0.94 -3.89 3.15 3.00 -1.26 -4.85 117.38 109.59 2f83 n GLN 84 Ca -0.09 0.00 -0.24 0.00 -0.01 0.00 0.00 57.00 56.66 2f83 n GLN 84 Cb 0.27 -1.45 -0.03 0.00 0.00 0.00 0.00 30.24 29.04 2f83 n GLN 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2f83 n SER 86 N -0.98 0.00 0.00 0.00 7.64 -1.26 -4.91 113.62 114.10 2f83 n SER 86 Ca -0.07 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.81 2f83 n SER 86 Cb 0.55 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.75 2f83 n SER 86 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2f83 n HIS 87 N 0.00 0.00 -0.74 1.43 -0.00 -1.26 -4.78 115.22 109.87 2f83 n HIS 87 Ca 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 57.72 57.70 2f83 n HIS 87 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 29.99 2f83 n HIS 87 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.34 177.38 2f83 n GLN 88 N 0.33 0.00 0.00 -1.40 6.02 -1.26 -5.02 117.38 116.05 2f83 n GLN 88 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 2f83 n GLN 88 Cb 0.00 -0.98 0.00 0.00 1.02 0.00 0.00 30.24 30.28 2f83 n GLN 88 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 2f83 n ILE 89 N -2.96 0.00 0.00 5.09 5.41 -1.25 -5.04 119.36 120.62 2f83 n ILE 89 Ca -0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 2f83 n ILE 89 Cb 0.03 -0.07 0.00 0.00 -0.71 0.00 0.00 39.64 38.89 2f83 n ILE 89 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 2f83 n SER 90 N 0.00 0.00 0.00 4.38 2.88 -1.26 -5.01 113.62 114.61 2f83 n SER 90 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2f83 n SER 90 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2f83 n SER 90 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2f83 n ALA 91 N 0.00 0.98 -2.93 -1.46 0.00 -1.26 -4.53 120.51 111.31 2f83 n ALA 91 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.16 2f83 n ALA 91 Cb 0.00 -0.71 -0.16 0.00 0.00 0.00 0.00 19.45 18.58 2f83 n ALA 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2f83 s ASN 93 N 0.06 3.92 0.00 0.00 4.22 -1.26 -4.96 114.94 116.92 2f83 s ASN 93 Ca -0.06 -0.62 0.24 0.00 -2.14 0.00 0.00 52.86 50.27 2f83 s ASN 93 Cb -0.13 -1.63 1.39 0.00 1.28 0.00 0.00 41.25 42.16 2f83 s ASN 93 CO 0.03 -0.05 1.79 0.29 -2.04 0.00 0.00 177.10 177.13 2f83 n LYS 94 N 4.70 0.68 -1.09 3.55 5.02 -1.26 -4.82 118.16 124.94 2f83 n LYS 94 Ca -0.19 0.01 -0.37 0.00 -2.02 0.00 0.00 58.31 55.74 2f83 n LYS 94 Cb 0.49 -1.50 0.03 0.00 -0.02 0.00 0.00 35.03 34.03 2f83 n LYS 94 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2f83 n ASP 95 N -1.04 -5.00 -3.58 4.39 9.92 -1.26 -5.02 116.55 114.95 2f83 n ASP 95 Ca 0.17 0.37 -0.19 0.00 -0.53 0.00 0.00 54.79 54.61 2f83 n ASP 95 Cb 0.10 -0.81 -0.15 0.00 -0.64 0.00 0.00 41.12 39.62 2f83 n ASP 95 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 2f83 s ILE 96 N -2.00 -0.26 -0.22 0.53 -1.09 -1.26 -4.63 121.20 112.26 2f83 s ILE 96 Ca 0.47 0.06 -0.16 0.00 -2.23 0.00 0.00 60.65 58.79 2f83 s ILE 96 Cb -0.30 -0.51 -0.04 0.00 -1.58 0.00 0.00 42.46 40.03 2f83 s ILE 96 CO 0.76 -0.08 0.41 -0.31 -1.23 0.00 0.00 174.94 174.49 2f83 s TYR 97 N 2.28 3.33 0.17 3.97 1.51 -0.53 -4.97 117.35 123.11 2f83 s TYR 97 Ca 0.04 0.58 -0.24 0.00 -1.01 0.00 0.00 57.07 56.45 2f83 s TYR 97 Cb -0.14 -2.56 -0.08 0.00 -0.11 0.00 0.00 41.96 39.06 2f83 s TYR 97 CO -0.09 -0.09 0.75 0.08 -1.11 0.00 0.00 175.55 175.09 2f83 s VAL 98 N 1.60 4.43 -1.81 0.71 1.01 -1.26 -1.80 120.40 123.28 2f83 s VAL 98 Ca 0.19 1.60 0.00 0.00 0.00 0.00 0.00 61.98 63.76 2f83 s VAL 98 Cb -0.15 -4.07 0.00 0.00 0.00 0.00 0.00 36.38 32.16 2f83 s VAL 98 CO 0.09 0.47 0.00 0.47 0.00 0.00 0.00 175.10 176.12 2f83 n ASP 99 N 1.44 -5.42 -4.27 3.32 8.00 0.19 -4.96 116.55 114.85 2f83 n ASP 99 Ca -0.05 0.19 -0.33 0.00 0.71 0.00 0.00 54.79 55.31 2f83 n ASP 99 Cb 0.49 -4.63 -0.15 0.00 -0.02 0.00 0.00 41.12 36.81 2f83 n ASP 99 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2f83 s LEU 100 N -5.46 2.44 -0.29 0.64 1.02 -1.25 -1.21 118.68 114.58 2f83 s LEU 100 Ca 0.00 -0.46 -0.04 0.00 0.02 0.00 0.00 54.13 53.65 2f83 s LEU 100 Cb 0.00 -1.54 0.03 0.00 0.02 0.00 0.00 46.19 44.70 2f83 s LEU 100 CO 0.00 0.12 0.02 -0.62 0.02 0.00 0.00 176.35 175.89 2f83 s ASP 101 N 0.62 4.86 -0.31 2.29 2.15 0.11 -3.35 116.67 123.04 2f83 s ASP 101 Ca -0.09 -0.93 -0.14 0.00 0.43 0.00 0.00 52.55 51.82 2f83 s ASP 101 Cb -0.16 -1.78 -0.03 0.00 -0.30 0.00 0.00 42.92 40.65 2f83 s ASP 101 CO 0.03 -0.20 0.34 -0.04 -0.17 0.00 0.00 175.17 175.12 2f83 s MET 102 N 1.38 3.79 0.33 4.34 -1.94 -1.26 -1.72 119.30 124.23 2f83 s MET 102 Ca -0.00 -0.24 -0.26 0.00 -1.71 0.00 0.00 55.69 53.48 2f83 s MET 102 Cb -0.18 -3.73 -0.10 0.00 2.01 0.00 0.00 34.83 32.84 2f83 s MET 102 CO -0.00 -0.38 0.99 0.21 -0.01 0.00 0.00 175.02 175.83 2f83 s LYS 103 N 2.00 4.49 0.04 2.03 2.20 -0.26 -4.89 119.74 125.35 2f83 s LYS 103 Ca 0.12 1.45 -0.27 0.00 -0.36 0.00 0.00 55.97 56.91 2f83 s LYS 103 Cb -0.16 -2.80 0.10 0.00 -1.51 0.00 0.00 37.83 33.45 2f83 s LYS 103 CO 0.11 0.16 1.20 0.20 -0.36 0.00 0.00 175.35 176.66 2f83 s GLY 104 N -1.49 -0.18 -0.27 5.54 0.00 -1.26 -2.14 107.32 107.53 2f83 s GLY 104 Ca 0.51 0.18 -0.29 0.00 0.00 0.00 0.00 44.72 45.13 2f83 s GLY 104 CO 0.27 2.54 1.84 -0.42 0.00 0.00 0.00 173.10 177.33 2f83 s ILE 105 N -2.31 3.42 -0.51 0.90 -1.09 -0.77 -4.79 121.20 116.05 2f83 s ILE 105 Ca 0.21 0.45 -0.29 0.00 -2.23 0.00 0.00 60.65 58.79 2f83 s ILE 105 Cb 0.01 -3.52 0.03 0.00 -1.58 0.00 0.00 42.46 37.40 2f83 s ILE 105 CO -0.00 -0.30 1.16 0.20 -1.23 0.00 0.00 174.94 174.77 2f83 s ASN 106 N 5.98 6.57 0.00 3.58 -0.87 -1.26 -2.76 114.94 126.17 2f83 s ASN 106 Ca 0.82 0.35 0.04 0.00 -1.57 0.00 0.00 52.86 52.50 2f83 s ASN 106 Cb -0.26 -2.55 0.08 0.00 -0.02 0.00 0.00 41.25 38.51 2f83 s ASN 106 CO 0.33 -1.33 0.93 0.00 -2.57 0.00 0.00 177.10 174.46 2f83 n TYR 107 N 8.06 0.11 -3.63 2.20 4.11 -0.96 -4.99 117.16 122.06 2f83 n TYR 107 Ca 0.11 -0.33 -0.05 0.00 -0.00 0.00 0.00 57.90 57.63 2f83 n TYR 107 Cb 0.49 -0.03 -0.07 0.00 -0.00 0.00 0.00 39.34 39.74 2f83 n TYR 107 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.86 178.07 2f83 s ASN 108 N -0.77 -0.80 -0.07 9.48 3.84 -1.25 -5.02 114.94 120.35 2f83 s ASN 108 Ca 0.07 1.26 -0.01 0.00 0.21 0.00 0.00 52.86 54.40 2f83 s ASN 108 Cb 0.04 1.40 0.03 0.00 -0.55 0.00 0.00 41.25 42.17 2f83 s ASN 108 CO 0.06 -0.20 -0.01 -0.55 -2.79 0.00 0.00 177.10 173.60 2f83 s SER 109 N 1.66 1.46 0.00 -4.21 0.15 -1.26 -1.53 113.70 109.97 2f83 s SER 109 Ca -0.09 -0.11 -0.19 0.00 0.70 0.00 0.00 55.95 56.26 2f83 s SER 109 Cb -0.05 -0.47 0.04 0.00 -1.71 0.00 0.00 66.02 63.83 2f83 s SER 109 CO -0.18 -0.15 0.41 -0.44 1.20 0.00 0.00 173.24 174.08 2f83 s SER 110 N 1.69 -0.31 0.43 5.45 0.01 -0.13 -4.95 113.70 115.89 2f83 s SER 110 Ca 0.01 0.16 -0.24 0.00 1.31 0.00 0.00 55.95 57.20 2f83 s SER 110 Cb -0.13 0.39 -0.08 0.00 0.21 0.00 0.00 66.02 66.41 2f83 s SER 110 CO -0.04 -0.56 1.11 0.54 0.41 0.00 0.00 173.24 174.69 2f83 s VAL 111 N -1.74 3.43 -0.05 3.43 0.11 -1.26 0.29 120.40 124.61 2f83 s VAL 111 Ca -0.10 1.09 -0.05 0.00 -2.93 0.00 0.00 61.98 59.99 2f83 s VAL 111 Cb -0.03 -3.56 0.02 0.00 -1.53 0.00 0.00 36.38 31.28 2f83 s VAL 111 CO 0.03 0.00 0.14 0.00 -3.33 0.00 0.00 175.10 171.94 2f83 s ALA 112 N -1.60 -0.34 -1.17 1.54 0.00 0.89 -4.74 121.76 116.35 2f83 s ALA 112 Ca 0.60 0.43 0.14 0.00 0.00 0.00 0.00 51.96 53.14 2f83 s ALA 112 Cb -0.25 -0.26 0.66 0.00 0.00 0.00 0.00 23.12 23.27 2f83 s ALA 112 CO 0.31 -0.08 1.44 0.36 0.00 0.00 0.00 175.76 177.79 2f83 n LYS 113 N 3.15 0.08 -3.53 0.00 -0.00 -1.26 -4.71 118.16 111.89 2f83 n LYS 113 Ca -0.14 0.21 -0.10 0.00 -0.00 0.00 0.00 58.31 58.28 2f83 n LYS 113 Cb 0.58 -1.50 -0.03 0.00 -0.00 0.00 0.00 35.03 34.08 2f83 n LYS 113 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 2f83 s SER 114 N -2.83 -0.38 0.43 -5.58 1.04 -1.26 -5.00 113.70 100.11 2f83 s SER 114 Ca 0.10 0.19 0.09 0.00 0.48 0.00 0.00 55.95 56.81 2f83 s SER 114 Cb 0.10 0.36 0.93 0.00 0.10 0.00 0.00 66.02 67.51 2f83 s SER 114 CO 0.25 -0.52 2.06 0.00 0.98 0.00 0.00 173.24 176.01 2f83 h ALA 115 N 2.27 1.74 0.45 5.32 0.00 -1.97 -2.31 119.26 124.75 2f83 h ALA 115 Ca -0.21 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 2f83 h ALA 115 Cb 1.21 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.87 2f83 h ALA 115 CO 0.31 0.23 -0.22 0.37 0.00 0.00 0.00 179.25 179.95 2f83 h GLN 116 N 0.42 -0.58 0.00 0.00 4.15 -1.99 -2.07 115.11 115.03 2f83 h GLN 116 Ca 0.11 0.04 -0.01 0.00 0.77 0.00 0.00 58.65 59.56 2f83 h GLN 116 Cb -0.01 0.13 -0.00 0.00 0.21 0.00 0.00 27.48 27.82 2f83 h GLN 116 CO -0.02 -0.34 -0.05 1.05 -1.93 0.00 0.00 178.83 177.54 2f83 h GLU 117 N -0.71 0.00 -0.47 1.69 4.11 -1.90 0.81 114.58 118.12 2f83 h GLU 117 Ca -0.06 0.00 -0.09 0.00 0.07 0.00 0.00 59.36 59.27 2f83 h GLU 117 Cb 0.52 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.75 2f83 h GLU 117 CO 0.10 0.05 -0.09 0.00 0.07 0.00 0.00 179.01 179.15 2f83 h GLN 119 N 0.76 0.93 -0.27 0.00 4.15 -0.22 -1.03 115.11 119.42 2f83 h GLN 119 Ca 0.13 -0.45 -0.07 0.00 0.77 0.00 0.00 58.65 59.03 2f83 h GLN 119 Cb 0.58 -0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.26 2f83 h GLN 119 CO 0.04 1.11 -0.13 0.93 -1.93 0.00 0.00 178.83 178.85 2f83 h GLU 120 N 0.77 0.46 -0.05 1.69 5.08 -0.83 1.00 114.58 122.70 2f83 h GLU 120 Ca 0.08 -0.13 -0.03 0.00 -1.00 0.00 0.00 59.36 58.28 2f83 h GLU 120 Cb 0.91 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.11 2f83 h GLU 120 CO 0.08 0.58 -0.10 -0.09 -1.00 0.00 0.00 179.01 178.49 2f83 h ARG 121 N 0.42 0.15 -0.83 2.33 2.43 -0.76 -1.71 114.38 116.41 2f83 h ARG 121 Ca 0.08 -0.10 0.02 0.00 -0.81 0.00 0.00 59.98 59.17 2f83 h ARG 121 Cb 0.48 0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 30.00 2f83 h ARG 121 CO 0.03 0.68 0.54 0.00 -1.51 0.00 0.00 179.97 179.71 2f83 h THR 123 N 1.08 1.23 -0.39 0.00 2.02 -0.75 -2.53 112.91 113.57 2f83 h THR 123 Ca 0.32 -0.64 0.00 0.00 0.77 0.00 0.00 66.41 66.86 2f83 h THR 123 Cb -0.06 0.27 0.00 0.00 -1.74 0.00 0.00 68.15 66.61 2f83 h THR 123 CO -0.09 0.27 0.00 0.47 0.37 0.00 0.00 175.52 176.54 2f83 n ASP 124 N -4.33 2.66 -4.93 4.18 9.92 -0.65 -4.70 116.55 118.70 2f83 n ASP 124 Ca 0.07 -2.15 -0.25 0.00 -0.53 0.00 0.00 54.79 51.93 2f83 n ASP 124 Cb 0.13 -0.38 -0.03 0.00 -0.64 0.00 0.00 41.12 40.20 2f83 n ASP 124 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 2f83 s ASP 125 N -0.83 6.22 0.06 -2.24 -1.08 -0.80 -4.69 116.67 113.30 2f83 s ASP 125 Ca 0.29 0.11 0.26 0.00 -0.52 0.00 0.00 52.55 52.69 2f83 s ASP 125 Cb 0.17 -1.83 0.74 0.00 -1.46 0.00 0.00 42.92 40.54 2f83 s ASP 125 CO 0.16 0.03 1.61 0.55 0.52 0.00 0.00 175.17 178.04 2f83 n VAL 126 N -0.66 0.18 -0.00 1.11 3.14 -1.26 -4.28 118.33 116.55 2f83 n VAL 126 Ca -0.07 -0.11 0.01 0.00 -2.96 0.00 0.00 64.34 61.21 2f83 n VAL 126 Cb 0.55 -0.20 -0.02 0.00 -1.06 0.00 0.00 33.84 33.10 2f83 n VAL 126 CO 0.00 0.00 0.00 1.41 -6.46 0.00 0.00 176.83 171.78 2f83 n HIS 127 N -1.76 0.00 -1.78 1.45 8.25 -1.26 -5.04 115.22 115.08 2f83 n HIS 127 Ca 0.05 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.10 2f83 n HIS 127 Cb 0.38 -0.08 -0.02 0.00 1.12 0.00 0.00 29.99 31.38 2f83 n HIS 127 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2f83 n HIS 129 N 2.91 0.00 -4.01 0.00 8.25 -0.59 -4.73 115.22 117.04 2f83 n HIS 129 Ca 0.11 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.49 2f83 n HIS 129 Cb 0.37 -0.61 -0.09 0.00 1.12 0.00 0.00 29.99 30.78 2f83 n HIS 129 CO 0.00 0.00 0.00 -0.59 0.64 0.00 0.00 176.34 176.39 2f83 s PHE 130 N -2.32 0.43 0.13 4.41 -0.12 -1.24 0.11 117.98 119.38 2f83 s PHE 130 Ca -0.24 -0.90 0.01 0.00 -0.05 0.00 0.00 56.93 55.75 2f83 s PHE 130 Cb 0.09 -0.26 -0.04 0.00 -0.63 0.00 0.00 43.02 42.17 2f83 s PHE 130 CO 0.30 -0.48 -0.02 -0.59 -0.05 0.00 0.00 175.22 174.38 2f83 s PHE 131 N -3.92 0.97 -0.01 3.49 -0.71 0.26 -1.80 117.98 116.27 2f83 s PHE 131 Ca 0.09 -1.01 0.03 0.00 -1.04 0.00 0.00 56.93 55.00 2f83 s PHE 131 Cb 0.07 -0.56 -0.01 0.00 -1.21 0.00 0.00 43.02 41.30 2f83 s PHE 131 CO -0.08 -0.25 -0.10 0.99 -1.34 0.00 0.00 175.22 174.44 2f83 s THR 132 N -3.73 0.81 -0.00 -4.49 2.01 -0.96 -0.62 115.64 108.66 2f83 s THR 132 Ca 0.18 -0.44 0.06 0.00 0.31 0.00 0.00 61.69 61.80 2f83 s THR 132 Cb 0.06 -0.68 -0.02 0.00 0.01 0.00 0.00 72.50 71.87 2f83 s THR 132 CO -0.01 0.23 -0.18 -0.47 -0.69 0.00 0.00 174.62 173.50 2f83 s TYR 133 N -0.23 1.64 -0.70 4.92 5.04 0.32 -1.36 117.35 126.98 2f83 s TYR 133 Ca 0.04 -0.32 -0.15 0.00 -2.44 0.00 0.00 57.07 54.20 2f83 s TYR 133 Cb -0.04 -1.04 0.18 0.00 0.35 0.00 0.00 41.96 41.41 2f83 s TYR 133 CO -0.00 -0.00 0.65 0.00 -1.34 0.00 0.00 175.55 174.85 2f83 s ALA 134 N -0.51 3.90 1.13 3.97 0.00 -0.70 -1.55 121.76 128.00 2f83 s ALA 134 Ca 0.07 -2.99 -0.15 0.00 0.00 0.00 0.00 51.96 48.89 2f83 s ALA 134 Cb -0.07 -3.40 0.21 0.00 0.00 0.00 0.00 23.12 19.85 2f83 s ALA 134 CO -0.00 -2.17 0.64 0.25 0.00 0.00 0.00 175.76 174.48 2f83 n THR 135 N 4.50 0.00 -0.61 0.00 -2.24 -1.06 0.19 114.28 115.06 2f83 n THR 135 Ca 0.02 -0.36 -0.04 0.00 -2.27 0.00 0.00 64.05 61.41 2f83 n THR 135 Cb 0.44 -0.84 0.03 0.00 -2.10 0.00 0.00 70.33 67.86 2f83 n THR 135 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 2f83 n ARG 136 N -3.76 -1.16 -1.30 -0.78 1.85 -1.26 -3.28 116.66 106.97 2f83 n ARG 136 Ca 0.03 -0.21 -0.12 0.00 -1.00 0.00 0.00 57.85 56.55 2f83 n ARG 136 Cb 0.57 -0.19 -0.05 0.00 -1.05 0.00 0.00 32.46 31.74 2f83 n ARG 136 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2f83 n GLN 137 N -1.85 -1.38 -3.61 2.89 10.64 -1.26 -4.89 117.38 117.92 2f83 n GLN 137 Ca 0.02 0.74 -0.39 0.00 -1.83 0.00 0.00 57.00 55.54 2f83 n GLN 137 Cb 0.07 -4.93 -0.11 0.00 -0.86 0.00 0.00 30.24 24.41 2f83 n GLN 137 CO 0.00 0.00 0.00 0.12 -1.83 0.00 0.00 177.06 175.35 2f83 s PHE 138 N -1.96 3.19 0.00 2.61 2.19 -1.20 -4.87 117.98 117.94 2f83 s PHE 138 Ca 0.00 -0.23 0.00 0.00 0.33 0.00 0.00 56.93 57.03 2f83 s PHE 138 Cb 0.00 -2.38 0.00 0.00 -1.31 0.00 0.00 43.02 39.33 2f83 s PHE 138 CO 0.00 -0.32 0.00 -2.30 1.83 0.00 0.00 175.22 174.43 2f83 n PRO 139 N 5.03 0.00 -1.95 10.12 -0.02 -1.26 -4.34 135.00 142.58 2f83 n PRO 139 Ca -0.14 0.00 -0.42 0.00 -2.02 0.00 0.00 63.50 60.92 2f83 n PRO 139 Cb 0.51 0.00 -0.03 0.00 -0.02 0.00 0.00 33.50 33.96 2f83 n PRO 139 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2f83 s SER 140 N -0.34 6.60 0.35 2.55 0.15 -1.26 -4.90 113.70 116.85 2f83 s SER 140 Ca 0.00 2.60 0.19 0.00 0.70 0.00 0.00 55.95 59.44 2f83 s SER 140 Cb 0.00 -2.59 0.49 0.00 -1.71 0.00 0.00 66.02 62.20 2f83 s SER 140 CO 0.00 -0.82 1.64 0.25 1.20 0.00 0.00 173.24 175.51 2f83 h LEU 141 N 6.80 0.00 0.03 3.45 5.85 -1.96 -2.62 115.31 126.85 2f83 h LEU 141 Ca -0.43 0.00 -0.28 0.00 0.84 0.00 0.00 57.88 58.02 2f83 h LEU 141 Cb 1.20 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 42.20 2f83 h LEU 141 CO 0.91 0.38 -1.51 1.05 -0.34 0.00 0.00 178.44 178.93 2f83 h GLU 142 N 0.00 0.05 -0.62 1.25 4.11 -1.92 -3.31 114.58 114.15 2f83 h GLU 142 Ca -0.00 -0.09 0.00 0.00 0.07 0.00 0.00 59.36 59.33 2f83 h GLU 142 Cb 1.06 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.34 2f83 h GLU 142 CO 0.05 0.76 0.00 0.72 0.07 0.00 0.00 179.01 180.61 2f83 n HIS 143 N -3.21 0.93 -3.35 2.06 8.25 -1.23 -4.91 115.22 113.76 2f83 n HIS 143 Ca -0.13 -0.43 -0.34 0.00 -0.26 0.00 0.00 57.72 56.56 2f83 n HIS 143 Cb 1.02 -0.06 -0.06 0.00 1.12 0.00 0.00 29.99 32.02 2f83 n HIS 143 CO 0.00 0.00 0.00 0.50 0.64 0.00 0.00 176.34 177.48 2f83 s ARG 144 N -1.35 3.92 -0.30 -0.41 3.52 -0.99 -4.19 118.95 119.14 2f83 s ARG 144 Ca 0.41 0.43 0.00 0.00 -0.13 0.00 0.00 55.73 56.45 2f83 s ARG 144 Cb 0.23 -2.75 0.00 0.00 -1.56 0.00 0.00 34.95 30.86 2f83 s ARG 144 CO 0.26 0.37 0.00 0.09 -0.81 0.00 0.00 175.30 175.21 2f83 n ASN 145 N 0.27 -5.29 -4.87 -2.12 4.13 0.50 -4.99 115.26 102.89 2f83 n ASN 145 Ca -0.02 0.07 -0.36 0.00 1.68 0.00 0.00 54.58 55.95 2f83 n ASN 145 Cb 0.52 -3.05 -0.06 0.00 -1.54 0.00 0.00 39.78 35.66 2f83 n ASN 145 CO 0.00 0.00 0.00 0.27 0.28 0.00 0.00 177.26 177.81 2f83 s ILE 146 N -1.46 5.30 -0.26 2.41 -5.25 -1.23 -0.07 121.20 120.64 2f83 s ILE 146 Ca 0.00 0.35 -0.09 0.00 -0.99 0.00 0.00 60.65 59.92 2f83 s ILE 146 Cb 0.00 -3.55 -0.04 0.00 2.95 0.00 0.00 42.46 41.83 2f83 s ILE 146 CO 0.00 0.50 0.13 0.00 -1.79 0.00 0.00 174.94 173.78 2f83 s LEU 148 N 1.59 2.47 0.33 0.00 2.34 -0.46 -0.95 118.68 123.99 2f83 s LEU 148 Ca 0.06 -0.96 -0.27 0.00 0.06 0.00 0.00 54.13 53.03 2f83 s LEU 148 Cb -0.15 -1.31 -0.09 0.00 -0.56 0.00 0.00 46.19 44.07 2f83 s LEU 148 CO 0.07 -0.14 1.01 -0.76 -1.06 0.00 0.00 176.35 175.46 2f83 s LEU 149 N 1.34 4.35 0.18 1.48 1.43 -0.58 -2.27 118.68 124.61 2f83 s LEU 149 Ca -0.02 2.00 -0.00 0.00 -1.03 0.00 0.00 54.13 55.08 2f83 s LEU 149 Cb -0.17 -3.95 -0.04 0.00 0.03 0.00 0.00 46.19 42.07 2f83 s LEU 149 CO -0.08 -0.19 0.08 -0.54 0.23 0.00 0.00 176.35 175.84 2f83 s LYS 150 N -1.97 1.13 -0.00 1.70 1.02 -0.74 -2.27 119.74 118.60 2f83 s LYS 150 Ca 0.50 -1.57 -0.26 0.00 0.02 0.00 0.00 55.97 54.66 2f83 s LYS 150 Cb -0.23 0.08 0.06 0.00 -0.52 0.00 0.00 37.83 37.21 2f83 s LYS 150 CO 0.29 -0.29 0.59 -3.38 -0.92 0.00 0.00 175.35 171.64 2f83 s HIS 151 N -3.97 -0.53 0.02 3.18 -3.43 -1.11 -1.55 115.29 107.90 2f83 s HIS 151 Ca 0.31 0.78 -0.11 0.00 -0.80 0.00 0.00 55.06 55.24 2f83 s HIS 151 Cb 0.07 0.37 0.01 0.00 -1.43 0.00 0.00 32.58 31.60 2f83 s HIS 151 CO 0.08 -0.62 0.22 0.95 -2.00 0.00 0.00 174.74 173.37 2f83 s THR 152 N -1.78 0.09 0.42 -5.38 -4.23 -1.26 -1.84 115.64 101.66 2f83 s THR 152 Ca -0.09 -0.70 0.27 0.00 -1.18 0.00 0.00 61.69 59.99 2f83 s THR 152 Cb -0.01 -0.71 0.46 0.00 1.34 0.00 0.00 72.50 73.57 2f83 s THR 152 CO 0.04 -0.39 1.63 -0.61 -0.54 0.00 0.00 174.62 174.75 2f83 h GLN 153 N 3.74 0.10 0.00 3.99 4.15 -1.99 -1.42 115.11 123.68 2f83 h GLN 153 Ca -0.31 -0.01 -0.31 0.00 0.77 0.00 0.00 58.65 58.79 2f83 h GLN 153 Cb 1.19 -0.02 -0.06 0.00 0.21 0.00 0.00 27.48 28.80 2f83 h GLN 153 CO 0.44 0.07 -2.12 0.25 -1.93 0.00 0.00 178.83 175.54 2f83 n THR 154 N -4.78 1.36 0.00 2.39 -2.24 -1.26 -4.55 114.28 105.20 2f83 n THR 154 Ca 0.37 -0.81 0.00 0.00 -2.27 0.00 0.00 64.05 61.33 2f83 n THR 154 Cb 1.36 -0.61 0.00 0.00 -2.10 0.00 0.00 70.33 68.99 2f83 n THR 154 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2f83 n GLY 155 N 1.65 2.26 3.85 3.38 0.00 -0.54 -4.62 105.19 111.16 2f83 n GLY 155 Ca -0.25 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.42 2f83 n GLY 155 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2f83 s THR 156 N -2.35 4.86 0.68 2.61 -4.23 -1.26 -4.68 115.64 111.27 2f83 s THR 156 Ca 0.00 0.79 -0.17 0.00 -1.18 0.00 0.00 61.69 61.13 2f83 s THR 156 Cb 0.00 -3.72 0.01 0.00 1.34 0.00 0.00 72.50 70.13 2f83 s THR 156 CO 0.00 0.20 1.25 -2.16 -0.54 0.00 0.00 174.62 173.37 2f83 s PRO 157 N -2.08 2.39 0.46 3.99 0.04 -1.25 -4.83 135.00 133.72 2f83 s PRO 157 Ca 0.39 1.93 0.26 0.00 0.04 0.00 0.00 61.00 63.63 2f83 s PRO 157 Cb -0.14 -1.84 0.62 0.00 0.04 0.00 0.00 34.50 33.18 2f83 s PRO 157 CO 0.19 -1.69 1.71 1.79 0.04 0.00 0.00 177.00 179.05 2f83 h THR 158 N 0.21 0.00 -2.93 1.26 1.35 -1.77 -3.34 112.91 107.69 2f83 h THR 158 Ca -0.50 -0.86 -0.03 0.00 -0.55 0.00 0.00 66.41 64.47 2f83 h THR 158 Cb 1.32 1.85 -0.13 0.00 -1.73 0.00 0.00 68.15 69.46 2f83 h THR 158 CO 0.52 0.00 0.14 -0.13 -0.25 0.00 0.00 175.52 175.80 2f83 s ARG 159 N -3.33 1.19 -0.03 4.72 0.52 -1.26 -4.86 118.95 115.90 2f83 s ARG 159 Ca 0.06 -0.40 -0.00 0.00 -0.52 0.00 0.00 55.73 54.86 2f83 s ARG 159 Cb 0.06 0.55 0.03 0.00 0.52 0.00 0.00 34.95 36.11 2f83 s ARG 159 CO 0.63 -0.49 0.01 0.42 0.02 0.00 0.00 175.30 175.89 2f83 s ILE 160 N -3.33 0.14 0.11 1.52 1.01 -1.26 -1.10 121.20 118.29 2f83 s ILE 160 Ca -0.01 0.14 0.02 0.00 0.00 0.00 0.00 60.65 60.80 2f83 s ILE 160 Cb -0.00 -0.26 -0.04 0.00 0.01 0.00 0.00 42.46 42.16 2f83 s ILE 160 CO -0.09 0.15 -0.07 0.42 0.00 0.00 0.00 174.94 175.35 2f83 s THR 161 N 1.23 0.81 0.35 2.92 -4.23 -0.70 -4.90 115.64 111.11 2f83 s THR 161 Ca -0.07 -1.95 -0.12 0.00 -1.18 0.00 0.00 61.69 58.37 2f83 s THR 161 Cb -0.13 -1.71 -0.07 0.00 1.34 0.00 0.00 72.50 71.93 2f83 s THR 161 CO -0.02 -0.84 0.73 -0.54 -0.54 0.00 0.00 174.62 173.41 2f83 s LYS 162 N -3.78 3.86 -0.30 3.99 -0.14 -1.26 0.07 119.74 122.19 2f83 s LYS 162 Ca 0.13 0.51 -0.08 0.00 -1.36 0.00 0.00 55.97 55.17 2f83 s LYS 162 Cb 0.04 -2.44 0.18 0.00 -1.68 0.00 0.00 37.83 33.94 2f83 s LYS 162 CO -0.03 0.08 0.87 -1.17 -0.76 0.00 0.00 175.35 174.34 2f83 s LEU 163 N -3.40 -0.84 0.59 3.17 0.20 -0.35 -4.80 118.68 113.26 2f83 s LEU 163 Ca 0.52 0.48 -0.19 0.00 0.69 0.00 0.00 54.13 55.63 2f83 s LEU 163 Cb -0.10 1.69 -0.05 0.00 -0.43 0.00 0.00 46.19 47.29 2f83 s LEU 163 CO 0.25 -0.16 0.98 0.47 -0.29 0.00 0.00 176.35 177.60 2f83 n ASP 164 N 5.44 0.84 -2.80 3.68 8.00 -1.26 -2.80 116.55 127.64 2f83 n ASP 164 Ca -0.03 0.82 -0.18 0.00 0.71 0.00 0.00 54.79 56.10 2f83 n ASP 164 Cb 0.53 -1.39 0.00 0.00 -0.02 0.00 0.00 41.12 40.24 2f83 n ASP 164 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2f83 n LYS 165 N -0.97 -3.01 -4.22 -1.24 4.01 -1.26 -4.90 118.16 106.57 2f83 n LYS 165 Ca 0.13 0.68 -0.18 0.00 -0.51 0.00 0.00 58.31 58.44 2f83 n LYS 165 Cb 0.47 -5.37 -0.11 0.00 -0.51 0.00 0.00 35.03 29.51 2f83 n LYS 165 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 2f83 s VAL 166 N -2.87 1.25 -0.20 -0.18 1.01 -1.12 -2.57 120.40 115.72 2f83 s VAL 166 Ca 0.17 -1.65 -0.17 0.00 0.00 0.00 0.00 61.98 60.33 2f83 s VAL 166 Cb -0.08 -1.44 0.05 0.00 0.00 0.00 0.00 36.38 34.91 2f83 s VAL 166 CO 0.21 -0.40 0.53 0.54 0.00 0.00 0.00 175.10 175.97 2f83 s VAL 167 N -2.05 -0.00 0.33 2.92 0.11 -0.59 0.56 120.40 121.67 2f83 s VAL 167 Ca 0.07 0.01 0.04 0.00 -2.93 0.00 0.00 61.98 59.16 2f83 s VAL 167 Cb -0.05 -0.74 -0.06 0.00 -1.53 0.00 0.00 36.38 33.99 2f83 s VAL 167 CO 0.02 0.00 0.06 -0.44 -3.33 0.00 0.00 175.10 171.42 2f83 s SER 168 N 0.47 2.33 -0.06 3.54 0.01 -0.75 0.12 113.70 119.36 2f83 s SER 168 Ca -0.02 -1.39 -0.32 0.00 1.31 0.00 0.00 55.95 55.54 2f83 s SER 168 Cb -0.04 -0.05 0.13 0.00 0.21 0.00 0.00 66.02 66.27 2f83 s SER 168 CO -0.02 -0.63 1.29 -0.83 0.41 0.00 0.00 173.24 173.47 2f83 s GLY 169 N -3.48 -0.40 0.49 3.44 0.00 0.21 -1.46 107.32 106.12 2f83 s GLY 169 Ca 0.36 0.90 0.00 0.00 0.00 0.00 0.00 44.72 45.99 2f83 s GLY 169 CO 0.15 0.21 0.71 -1.36 0.00 0.00 0.00 173.10 172.82 2f83 s PHE 170 N -2.38 3.11 0.51 1.90 0.08 -1.26 0.92 117.98 120.86 2f83 s PHE 170 Ca 0.13 0.17 -0.20 0.00 0.12 0.00 0.00 56.93 57.15 2f83 s PHE 170 Cb 0.04 -2.47 -0.07 0.00 -0.57 0.00 0.00 43.02 39.95 2f83 s PHE 170 CO -0.04 -0.54 1.09 0.45 -0.10 0.00 0.00 175.22 176.08 2f83 s SER 171 N -4.29 6.03 -0.42 1.36 0.15 0.30 -4.86 113.70 111.99 2f83 s SER 171 Ca 0.51 2.07 0.05 0.00 0.70 0.00 0.00 55.95 59.29 2f83 s SER 171 Cb -0.10 -2.57 0.53 0.00 -1.71 0.00 0.00 66.02 62.17 2f83 s SER 171 CO 0.38 -1.00 1.67 0.18 1.20 0.00 0.00 173.24 175.68 2f83 n LEU 172 N -1.09 5.72 0.00 3.45 4.77 -1.26 -4.51 117.00 124.09 2f83 n LEU 172 Ca 0.10 -4.00 -0.01 0.00 -0.03 0.00 0.00 56.01 52.08 2f83 n LEU 172 Cb 0.51 -0.73 0.27 0.00 -2.33 0.00 0.00 43.42 41.15 2f83 n LEU 172 CO 0.41 1.38 0.87 0.11 -1.33 0.00 0.00 177.39 178.84 2f83 h LYS 173 N 1.39 0.51 -0.13 3.23 1.57 -1.92 -0.98 116.57 120.25 2f83 h LYS 173 Ca 0.44 -0.13 -0.11 0.00 -1.87 0.00 0.00 60.65 58.98 2f83 h LYS 173 Cb 1.77 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 34.00 2f83 h LYS 173 CO 0.90 0.60 -0.40 0.66 -0.57 0.00 0.00 179.45 180.63 2f83 h SER 174 N 0.48 0.29 0.00 0.86 4.64 -1.84 -2.87 113.55 115.12 2f83 h SER 174 Ca 0.10 -0.12 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 2f83 h SER 174 Cb 0.43 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.44 2f83 h SER 174 CO 0.02 0.67 0.00 0.00 -0.87 0.00 0.00 176.83 176.65 2f83 n ALA 176 N 0.44 -0.11 0.27 0.00 0.00 -1.08 -4.81 120.51 115.22 2f83 n ALA 176 Ca 0.00 0.11 0.08 0.00 0.00 0.00 0.00 53.44 53.63 2f83 n ALA 176 Cb 0.28 -1.31 0.24 0.00 0.00 0.00 0.00 19.45 18.66 2f83 n ALA 176 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2f83 n LEU 177 N -0.93 2.96 -4.82 0.00 4.32 -1.17 -4.74 117.00 112.62 2f83 n LEU 177 Ca -0.07 -1.49 -0.35 0.00 -0.02 0.00 0.00 56.01 54.09 2f83 n LEU 177 Cb 0.42 -0.38 -0.06 0.00 -1.62 0.00 0.00 43.42 41.78 2f83 n LEU 177 CO 0.11 0.67 0.44 -0.55 -1.22 0.00 0.00 177.39 176.84 2f83 s SER 178 N -0.94 6.97 0.00 -1.43 0.15 -1.26 -4.91 113.70 112.28 2f83 s SER 178 Ca 0.35 1.41 0.19 0.00 0.70 0.00 0.00 55.95 58.60 2f83 s SER 178 Cb 0.19 -2.42 -0.10 0.00 -1.71 0.00 0.00 66.02 61.99 2f83 s SER 178 CO 0.22 -0.07 0.91 0.59 1.20 0.00 0.00 173.24 176.09 2f83 n ASN 179 N 0.28 1.44 -4.65 5.45 3.02 -1.26 -4.20 115.26 115.34 2f83 n ASN 179 Ca 0.00 -1.22 -0.42 0.00 -0.03 0.00 0.00 54.58 52.91 2f83 n ASN 179 Cb 0.52 0.71 -0.03 0.00 -0.61 0.00 0.00 39.78 40.37 2f83 n ASN 179 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2f83 s LEU 180 N -2.57 4.19 0.56 3.41 1.43 -1.26 -4.70 118.68 119.74 2f83 s LEU 180 Ca 0.12 2.18 -0.21 0.00 -1.03 0.00 0.00 54.13 55.19 2f83 s LEU 180 Cb 0.15 -3.53 -0.04 0.00 0.03 0.00 0.00 46.19 42.80 2f83 s LEU 180 CO 0.63 -1.11 1.36 0.00 0.23 0.00 0.00 176.35 177.46 2f83 n ALA 181 N 7.87 1.56 -2.83 4.21 0.00 -1.26 -4.37 120.51 125.70 2f83 n ALA 181 Ca 0.19 0.11 -0.36 0.00 0.00 0.00 0.00 53.44 53.38 2f83 n ALA 181 Cb 0.43 -2.36 -0.07 0.00 0.00 0.00 0.00 19.45 17.45 2f83 n ALA 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2f83 s ILE 183 N -0.76 4.35 -1.62 0.00 1.01 -1.26 -4.84 121.20 118.08 2f83 s ILE 183 Ca 0.13 -1.49 0.28 0.00 0.00 0.00 0.00 60.65 59.58 2f83 s ILE 183 Cb -0.12 -3.72 0.40 0.00 0.01 0.00 0.00 42.46 39.03 2f83 s ILE 183 CO 0.03 -0.61 1.80 0.54 0.00 0.00 0.00 174.94 176.70 2f83 n ARG 184 N 4.95 0.67 -2.10 2.79 1.74 -1.26 -4.41 116.66 119.04 2f83 n ARG 184 Ca -0.10 -0.26 -0.42 0.00 -0.77 0.00 0.00 57.85 56.31 2f83 n ARG 184 Cb 0.42 -1.49 -0.03 0.00 -1.02 0.00 0.00 32.46 30.34 2f83 n ARG 184 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2f83 s ASP 185 N -2.51 6.76 0.43 0.55 1.01 -1.26 -4.99 116.67 116.65 2f83 s ASP 185 Ca 0.27 2.52 0.07 0.00 0.71 0.00 0.00 52.55 56.12 2f83 s ASP 185 Cb 0.20 -2.61 -0.03 0.00 1.01 0.00 0.00 42.92 41.49 2f83 s ASP 185 CO 0.49 -0.65 0.29 0.27 0.21 0.00 0.00 175.17 175.78 2f83 s ILE 186 N 0.32 2.40 -0.32 0.77 -5.25 -1.26 -4.41 121.20 113.45 2f83 s ILE 186 Ca 0.60 -1.52 -0.02 0.00 -0.99 0.00 0.00 60.65 58.73 2f83 s ILE 186 Cb -0.39 -2.92 0.11 0.00 2.95 0.00 0.00 42.46 42.20 2f83 s ILE 186 CO 0.38 0.00 0.14 -0.36 -1.79 0.00 0.00 174.94 173.31 2f83 s PHE 187 N -2.56 1.02 0.37 1.37 0.08 0.28 -4.97 117.98 113.57 2f83 s PHE 187 Ca 0.43 -1.43 -0.25 0.00 0.12 0.00 0.00 56.93 55.80 2f83 s PHE 187 Cb 0.00 -1.28 -0.10 0.00 -0.57 0.00 0.00 43.02 41.07 2f83 s PHE 187 CO 0.25 -0.84 1.00 -1.25 -0.10 0.00 0.00 175.22 174.27 2f83 s PRO 188 N 1.62 4.36 -1.33 0.24 0.04 -1.26 -0.30 135.00 138.36 2f83 s PRO 188 Ca 0.11 1.40 -0.08 0.00 0.04 0.00 0.00 61.00 62.48 2f83 s PRO 188 Cb -0.18 -2.62 0.01 0.00 0.04 0.00 0.00 34.50 31.75 2f83 s PRO 188 CO -0.24 0.05 1.02 0.09 0.04 0.00 0.00 177.00 177.97 2f83 n ASN 189 N 0.15 -6.14 -4.00 6.66 5.03 0.37 -4.93 115.26 112.39 2f83 n ASN 189 Ca 0.04 -0.47 -0.09 0.00 0.87 0.00 0.00 54.58 54.94 2f83 n ASN 189 Cb 0.50 -4.81 -0.11 0.00 -1.02 0.00 0.00 39.78 34.35 2f83 n ASN 189 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 2f83 s THR 190 N -3.27 0.14 -0.02 3.41 2.01 0.19 -1.06 115.64 117.03 2f83 s THR 190 Ca 0.51 -1.15 -0.05 0.00 0.31 0.00 0.00 61.69 61.31 2f83 s THR 190 Cb -0.22 -0.62 0.00 0.00 0.01 0.00 0.00 72.50 71.67 2f83 s THR 190 CO 0.63 -0.63 0.11 0.68 -0.69 0.00 0.00 174.62 174.71 2f83 s VAL 191 N -2.15 0.04 0.39 3.82 -7.23 0.42 -3.75 120.40 111.93 2f83 s VAL 191 Ca -0.09 -0.36 0.08 0.00 -1.81 0.00 0.00 61.98 59.79 2f83 s VAL 191 Cb -0.05 -0.28 -0.03 0.00 0.56 0.00 0.00 36.38 36.59 2f83 s VAL 191 CO -0.03 -0.20 0.33 -0.36 -0.31 0.00 0.00 175.10 174.52 2f83 s PHE 192 N -0.65 2.77 -0.46 2.82 0.08 -1.26 -0.61 117.98 120.67 2f83 s PHE 192 Ca -0.07 -0.43 0.05 0.00 0.12 0.00 0.00 56.93 56.60 2f83 s PHE 192 Cb -0.04 -2.01 0.27 0.00 -0.57 0.00 0.00 43.02 40.66 2f83 s PHE 192 CO 0.01 0.02 1.01 0.00 -0.10 0.00 0.00 175.22 176.15 2f83 n ALA 193 N -1.45 -1.58 -3.36 5.36 0.00 -1.26 -4.99 120.51 113.22 2f83 n ALA 193 Ca 0.01 -1.25 0.00 0.00 0.00 0.00 0.00 53.44 52.21 2f83 n ALA 193 Cb 0.61 -1.59 0.00 0.00 0.00 0.00 0.00 19.45 18.47 2f83 n ALA 193 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2f83 n ASP 194 N 1.25 1.53 -4.50 0.00 9.92 -1.26 -4.90 116.55 118.59 2f83 n ASP 194 Ca 0.07 -0.60 -0.49 0.00 -0.53 0.00 0.00 54.79 53.24 2f83 n ASP 194 Cb 0.66 0.00 -0.03 0.00 -0.64 0.00 0.00 41.12 41.11 2f83 n ASP 194 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 2f83 n SER 195 N -0.88 0.19 -4.15 -2.24 7.64 -0.66 -4.71 113.62 108.80 2f83 n SER 195 Ca 0.00 1.15 -0.37 0.00 1.01 0.00 0.00 58.87 60.66 2f83 n SER 195 Cb 0.00 -1.10 -0.11 0.00 -1.01 0.00 0.00 64.21 61.99 2f83 n SER 195 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 2f83 s ASN 196 N -0.53 5.35 0.31 6.43 -0.87 -1.26 -1.53 114.94 122.85 2f83 s ASN 196 Ca 0.68 -1.92 0.24 0.00 -1.57 0.00 0.00 52.86 50.29 2f83 s ASN 196 Cb -0.89 -1.87 0.48 0.00 -0.02 0.00 0.00 41.25 38.95 2f83 s ASN 196 CO 0.56 -0.56 1.60 0.16 -2.57 0.00 0.00 177.10 176.30 2f83 h ILE 197 N 6.30 0.00 0.00 0.60 -0.00 -0.74 -3.49 117.51 120.19 2f83 h ILE 197 Ca -0.16 -0.77 0.00 0.00 -0.00 0.00 0.00 64.86 63.93 2f83 h ILE 197 Cb 1.06 1.70 0.00 0.00 -0.00 0.00 0.00 36.82 39.58 2f83 h ILE 197 CO 0.72 0.00 0.00 -0.67 -0.00 0.00 0.00 178.15 178.20 2f83 n ASP 198 N -2.69 0.00 -3.82 2.16 2.03 -1.09 -5.01 116.55 108.12 2f83 n ASP 198 Ca 0.04 0.00 -0.10 0.00 0.52 0.00 0.00 54.79 55.25 2f83 n ASP 198 Cb 0.49 0.00 -0.08 0.00 -0.72 0.00 0.00 41.12 40.81 2f83 n ASP 198 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 2f83 s SER 199 N 0.00 0.01 0.24 1.67 1.04 -1.26 0.98 113.70 116.37 2f83 s SER 199 Ca 0.00 -0.37 -0.12 0.00 0.48 0.00 0.00 55.95 55.94 2f83 s SER 199 Cb 0.00 0.32 -0.01 0.00 0.10 0.00 0.00 66.02 66.43 2f83 s SER 199 CO 0.00 -0.60 0.45 0.68 0.98 0.00 0.00 173.24 174.75 2f83 s VAL 200 N -2.79 0.01 -0.28 5.02 -7.23 -0.64 -4.99 120.40 109.49 2f83 s VAL 200 Ca -0.03 -1.41 -0.11 0.00 -1.81 0.00 0.00 61.98 58.62 2f83 s VAL 200 Cb 0.00 -2.17 -0.05 0.00 0.56 0.00 0.00 36.38 34.72 2f83 s VAL 200 CO -0.05 -0.02 0.18 -0.04 -0.31 0.00 0.00 175.10 174.85 2f83 s MET 201 N -4.02 3.92 0.03 4.82 -1.94 -1.26 -0.08 119.30 120.77 2f83 s MET 201 Ca 0.22 -0.34 0.09 0.00 -1.71 0.00 0.00 55.69 53.95 2f83 s MET 201 Cb -0.00 -3.62 -0.03 0.00 2.01 0.00 0.00 34.83 33.19 2f83 s MET 201 CO 0.08 -0.18 -0.25 0.00 -0.01 0.00 0.00 175.02 174.66 2f83 s ALA 202 N 1.73 2.12 0.09 3.03 0.00 -0.11 -4.80 121.76 123.82 2f83 s ALA 202 Ca 0.07 -1.18 0.08 0.00 0.00 0.00 0.00 51.96 50.93 2f83 s ALA 202 Cb -0.16 -0.47 -0.19 0.00 0.00 0.00 0.00 23.12 22.30 2f83 s ALA 202 CO 0.10 0.50 1.23 -1.00 0.00 0.00 0.00 175.76 176.59 2f83 h PRO 203 N 5.01 0.00 -6.12 0.00 0.13 -1.98 -3.42 132.00 125.62 2f83 h PRO 203 Ca -0.45 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.16 2f83 h PRO 203 Cb 1.14 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.21 2f83 h PRO 203 CO 0.45 0.91 -0.49 -0.51 -0.23 0.00 0.00 178.00 178.13 2f83 s ASP 204 N -6.63 4.88 0.00 1.44 1.11 -1.26 -4.97 116.67 111.25 2f83 s ASP 204 Ca 0.01 -0.71 0.22 0.00 0.18 0.00 0.00 52.55 52.25 2f83 s ASP 204 Cb 0.10 -0.77 -0.09 0.00 1.07 0.00 0.00 42.92 43.22 2f83 s ASP 204 CO 0.82 -0.36 0.95 0.00 1.18 0.00 0.00 175.17 177.76 2f83 n ALA 205 N -1.26 4.20 -0.06 5.23 0.00 -1.26 -3.24 120.51 124.12 2f83 n ALA 205 Ca -0.02 -0.53 -0.12 0.00 0.00 0.00 0.00 53.44 52.78 2f83 n ALA 205 Cb 0.61 -0.85 -0.11 0.00 0.00 0.00 0.00 19.45 19.10 2f83 n ALA 205 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 2f83 h PHE 206 N 0.00 -0.00 -0.48 0.00 0.05 -1.99 -1.97 116.94 112.54 2f83 h PHE 206 Ca 0.00 -0.00 0.08 0.00 3.82 0.00 0.00 57.97 61.87 2f83 h PHE 206 Cb 0.58 0.00 -0.07 0.00 2.00 0.00 0.00 35.95 38.46 2f83 h PHE 206 CO 0.00 0.81 0.08 0.28 -0.18 0.00 0.00 178.31 179.30 2f83 h VAL 207 N -0.98 0.72 -0.15 -0.55 2.07 -1.97 0.18 116.25 115.57 2f83 h VAL 207 Ca -0.00 -0.07 0.02 0.00 0.82 0.00 0.00 66.70 67.47 2f83 h VAL 207 Cb 0.82 0.49 -0.04 0.00 -1.52 0.00 0.00 31.29 31.03 2f83 h VAL 207 CO 0.00 0.04 -0.32 0.00 0.02 0.00 0.00 177.57 177.31 2f83 h GLY 209 N -0.29 0.78 0.94 0.00 0.00 -0.53 -1.65 103.07 102.33 2f83 h GLY 209 Ca 0.03 -0.19 -0.01 0.00 0.00 0.00 0.00 47.33 47.15 2f83 h GLY 209 CO -0.30 0.06 0.16 3.21 0.00 0.00 0.00 176.54 179.67 2f83 h ARG 210 N 0.44 0.51 -0.26 4.80 3.08 0.16 -2.36 114.38 120.75 2f83 h ARG 210 Ca 0.39 -0.08 0.01 0.00 0.07 0.00 0.00 59.98 60.37 2f83 h ARG 210 Cb 0.87 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.82 2f83 h ARG 210 CO -0.13 0.47 0.15 0.82 -1.07 0.00 0.00 179.97 180.20 2f83 h ILE 211 N 0.43 1.02 -0.84 2.04 2.04 -0.08 -1.52 117.51 120.60 2f83 h ILE 211 Ca 0.12 -0.10 0.19 0.00 1.00 0.00 0.00 64.86 66.06 2f83 h ILE 211 Cb 0.13 0.70 -0.11 0.00 -0.74 0.00 0.00 36.82 36.79 2f83 h ILE 211 CO -0.01 0.06 0.33 0.00 0.00 0.00 0.00 178.15 178.52 2f83 h THR 213 N 0.40 0.78 -1.76 0.00 2.02 -0.73 -2.80 112.91 110.80 2f83 h THR 213 Ca 0.50 -0.25 -0.69 0.00 0.77 0.00 0.00 66.41 66.74 2f83 h THR 213 Cb 0.88 -0.01 -0.34 0.00 -1.74 0.00 0.00 68.15 66.94 2f83 h THR 213 CO -0.49 0.13 0.26 0.00 0.37 0.00 0.00 175.52 175.79 2f83 n HIS 214 N -4.80 3.17 -0.07 3.16 1.44 -0.55 -4.28 115.22 113.30 2f83 n HIS 214 Ca 0.18 -2.68 -0.07 0.00 -2.01 0.00 0.00 57.72 53.14 2f83 n HIS 214 Cb 0.42 -0.70 -0.05 0.00 0.12 0.00 0.00 29.99 29.79 2f83 n HIS 214 CO 0.00 0.00 0.00 1.25 -2.81 0.00 0.00 176.34 174.78 2f83 h HIS 215 N 2.79 0.00 -0.89 -1.40 2.76 -1.50 -3.48 115.15 113.44 2f83 h HIS 215 Ca 0.45 0.00 -0.59 0.00 -2.20 0.00 0.00 60.37 58.03 2f83 h HIS 215 Cb 0.44 0.00 -0.39 0.00 1.55 0.00 0.00 27.41 29.01 2f83 h HIS 215 CO 1.02 0.41 -0.29 -0.35 -1.30 0.00 0.00 177.93 177.41 2f83 n PRO 216 N -4.65 3.33 0.16 5.26 -0.05 -1.26 -4.83 135.00 132.96 2f83 n PRO 216 Ca -0.09 -3.93 0.12 0.00 -0.05 0.00 0.00 63.50 59.55 2f83 n PRO 216 Cb 0.27 -2.28 0.07 0.00 -0.05 0.00 0.00 33.50 31.51 2f83 n PRO 216 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 175.50 176.23 2f83 h GLY 217 N 2.17 0.00 -4.82 0.55 0.00 -1.87 -3.45 103.07 95.64 2f83 h GLY 217 Ca 0.44 0.00 -0.56 0.00 0.00 0.00 0.00 47.33 47.21 2f83 h GLY 217 CO 1.02 0.00 0.56 0.00 0.00 0.00 0.00 176.54 178.12 2f83 n LEU 219 N 5.13 0.22 0.00 0.00 7.94 -0.07 -4.73 117.00 125.49 2f83 n LEU 219 Ca 0.08 -0.21 0.00 0.00 -1.11 0.00 0.00 56.01 54.77 2f83 n LEU 219 Cb 0.49 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.44 2f83 n LEU 219 CO 0.52 0.06 0.00 2.22 -1.11 0.00 0.00 177.39 179.07 2f83 n PHE 220 N -1.62 0.00 -3.62 1.96 -1.74 -1.11 -2.51 117.46 108.82 2f83 n PHE 220 Ca -0.00 0.00 -0.06 0.00 -0.56 0.00 0.00 57.45 56.83 2f83 n PHE 220 Cb 0.24 0.00 -0.00 0.00 1.52 0.00 0.00 39.48 41.24 2f83 n PHE 220 CO 0.00 0.00 0.00 1.97 -0.56 0.00 0.00 176.76 178.17 2f83 n PHE 221 N -0.02 -1.19 -3.76 2.97 -1.74 0.40 -1.31 117.46 112.82 2f83 n PHE 221 Ca 0.00 -0.99 -0.13 0.00 -0.56 0.00 0.00 57.45 55.77 2f83 n PHE 221 Cb 0.00 0.32 -0.11 0.00 1.52 0.00 0.00 39.48 41.22 2f83 n PHE 221 CO 0.00 0.00 0.00 0.99 -0.56 0.00 0.00 176.76 177.19 2f83 s THR 222 N -2.60 0.00 -0.03 1.97 2.01 -0.86 -2.20 115.64 113.94 2f83 s THR 222 Ca 0.11 -0.03 0.06 0.00 0.31 0.00 0.00 61.69 62.14 2f83 s THR 222 Cb -0.01 -0.47 -0.01 0.00 0.01 0.00 0.00 72.50 72.01 2f83 s THR 222 CO 0.08 -0.02 -0.22 0.12 -0.69 0.00 0.00 174.62 173.90 2f83 s PHE 223 N 0.08 2.00 -0.35 4.92 5.36 0.94 0.00 117.98 130.92 2f83 s PHE 223 Ca -0.01 -0.45 -0.07 0.00 -0.96 0.00 0.00 56.93 55.45 2f83 s PHE 223 Cb -0.02 -1.30 0.05 0.00 -0.34 0.00 0.00 43.02 41.40 2f83 s PHE 223 CO 0.01 -0.08 0.13 -0.06 -1.46 0.00 0.00 175.22 173.76 2f83 s PHE 224 N -0.37 3.28 1.07 10.12 0.40 0.11 -1.87 117.98 130.72 2f83 s PHE 224 Ca 0.05 -1.45 -0.19 0.00 -0.60 0.00 0.00 56.93 54.74 2f83 s PHE 224 Cb -0.10 -2.41 0.04 0.00 0.51 0.00 0.00 43.02 41.06 2f83 s PHE 224 CO 0.00 -0.75 -0.22 -1.13 0.70 0.00 0.00 175.22 173.83 2f83 n SER 225 N 4.83 -2.60 0.27 1.36 3.41 0.12 0.12 113.62 121.14 2f83 n SER 225 Ca -0.12 -0.02 0.14 0.00 -0.26 0.00 0.00 58.87 58.61 2f83 n SER 225 Cb 0.44 -0.91 0.78 0.00 -0.26 0.00 0.00 64.21 64.25 2f83 n SER 225 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 2f83 h GLN 226 N -1.78 0.00 -0.64 4.33 4.15 -1.92 -2.02 115.11 117.22 2f83 h GLN 226 Ca -0.49 0.00 -0.05 0.00 0.77 0.00 0.00 58.65 58.88 2f83 h GLN 226 Cb 1.35 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 29.01 2f83 h GLN 226 CO 0.34 0.09 0.06 0.39 -1.93 0.00 0.00 178.83 177.79 2f83 n GLU 227 N -3.61 4.49 -2.37 1.69 1.02 -1.26 -4.90 120.64 115.70 2f83 n GLU 227 Ca -0.02 -3.00 -0.41 0.00 -0.02 0.00 0.00 57.16 53.71 2f83 n GLU 227 Cb 0.21 -2.23 -0.04 0.00 -0.02 0.00 0.00 31.44 29.37 2f83 n GLU 227 CO 0.00 0.00 0.00 -0.46 1.18 0.00 0.00 177.13 177.85 2f83 s TRP 228 N -2.73 3.42 0.00 -0.32 -0.11 -0.76 -4.91 118.94 113.53 2f83 s TRP 228 Ca 0.52 1.52 0.00 0.00 1.22 0.00 0.00 56.10 59.36 2f83 s TRP 228 Cb 0.40 -3.42 0.00 0.00 -1.50 0.00 0.00 33.47 28.96 2f83 s TRP 228 CO 0.15 -1.08 0.01 -2.30 -4.62 0.00 0.00 176.95 169.11 2f83 n PRO 229 N 1.75 0.00 -1.54 5.86 -0.02 -1.26 -3.74 135.00 136.06 2f83 n PRO 229 Ca 0.02 0.01 -0.13 0.00 -2.02 0.00 0.00 63.50 61.37 2f83 n PRO 229 Cb 0.44 -0.50 -0.10 0.00 -0.02 0.00 0.00 33.50 33.32 2f83 n PRO 229 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2f83 n LYS 230 N -0.02 0.31 0.27 -0.52 5.02 -1.26 -4.72 118.16 117.24 2f83 n LYS 230 Ca 0.00 -1.15 0.00 0.00 -2.02 0.00 0.00 58.31 55.14 2f83 n LYS 230 Cb 0.00 -3.57 0.00 0.00 -0.02 0.00 0.00 35.03 31.44 2f83 n LYS 230 CO 0.00 0.00 0.00 1.05 -0.52 0.00 0.00 177.40 177.93 2f83 h GLU 231 N 12.03 0.00 0.00 1.97 -0.00 -1.97 0.65 114.58 127.25 2f83 h GLU 231 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.36 2f83 h GLU 231 Cb 1.01 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.76 2f83 h GLU 231 CO 1.03 0.00 0.00 -1.13 -0.00 0.00 0.00 179.01 178.91 2f83 n SER 232 N -2.24 0.00 -0.07 3.06 3.41 -1.26 -2.49 113.62 114.02 2f83 n SER 232 Ca -0.00 0.44 0.04 0.00 -0.26 0.00 0.00 58.87 59.09 2f83 n SER 232 Cb 0.91 -0.46 0.05 0.00 -0.26 0.00 0.00 64.21 64.45 2f83 n SER 232 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2f83 n GLN 233 N -1.46 1.74 -2.47 4.33 6.02 0.23 -4.98 117.38 120.78 2f83 n GLN 233 Ca 0.02 -1.72 -0.40 0.00 -0.01 0.00 0.00 57.00 54.88 2f83 n GLN 233 Cb 0.09 -1.07 -0.04 0.00 1.02 0.00 0.00 30.24 30.24 2f83 n GLN 233 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 2f83 s ARG 234 N -1.46 4.62 -0.20 -1.09 0.52 -1.04 -2.36 118.95 117.93 2f83 s ARG 234 Ca 0.12 1.80 0.00 0.00 -0.52 0.00 0.00 55.73 57.13 2f83 s ARG 234 Cb 0.10 -3.20 0.00 0.00 0.52 0.00 0.00 34.95 32.37 2f83 s ARG 234 CO 0.01 0.17 0.00 0.09 0.02 0.00 0.00 175.30 175.59 2f83 n ASN 235 N 1.42 -4.62 -4.70 0.23 5.03 0.33 -4.89 115.26 108.07 2f83 n ASN 235 Ca -0.00 0.05 -0.42 0.00 0.87 0.00 0.00 54.58 55.07 2f83 n ASN 235 Cb 0.45 -2.29 -0.03 0.00 -1.02 0.00 0.00 39.78 36.89 2f83 n ASN 235 CO 0.00 0.00 0.00 -0.22 -1.83 0.00 0.00 177.26 175.21 2f83 s LEU 236 N -0.44 4.33 -0.32 3.41 2.96 -1.00 -0.94 118.68 126.69 2f83 s LEU 236 Ca 0.00 1.63 0.01 0.00 -0.22 0.00 0.00 54.13 55.55 2f83 s LEU 236 Cb 0.00 -3.57 0.08 0.00 0.50 0.00 0.00 46.19 43.20 2f83 s LEU 236 CO 0.00 -0.33 0.01 0.00 -1.32 0.00 0.00 176.35 174.71 2f83 s LEU 238 N 1.10 4.40 -0.42 0.00 1.43 0.10 -1.63 118.68 123.66 2f83 s LEU 238 Ca 0.00 1.30 -0.12 0.00 -1.03 0.00 0.00 54.13 54.28 2f83 s LEU 238 Cb -0.20 -3.12 0.06 0.00 0.03 0.00 0.00 46.19 42.96 2f83 s LEU 238 CO -0.04 -0.01 0.29 -0.76 0.23 0.00 0.00 176.35 176.05 2f83 s LEU 239 N 0.22 5.19 0.38 1.79 1.43 0.27 -2.02 118.68 125.94 2f83 s LEU 239 Ca 0.37 -1.27 0.08 0.00 -1.03 0.00 0.00 54.13 52.28 2f83 s LEU 239 Cb -0.19 -2.07 -0.03 0.00 0.03 0.00 0.00 46.19 43.93 2f83 s LEU 239 CO 0.20 -0.53 0.30 -0.54 0.23 0.00 0.00 176.35 176.02 2f83 s LYS 240 N 1.55 2.55 0.19 1.70 1.02 -0.42 0.03 119.74 126.35 2f83 s LYS 240 Ca 0.03 -1.48 -0.23 0.00 0.02 0.00 0.00 55.97 54.31 2f83 s LYS 240 Cb -0.22 -2.35 0.05 0.00 -0.52 0.00 0.00 37.83 34.79 2f83 s LYS 240 CO 0.05 -0.05 0.75 -0.08 -0.92 0.00 0.00 175.35 175.10 2f83 s THR 241 N -2.42 0.00 -0.11 2.17 -1.32 -0.58 -0.89 115.64 112.48 2f83 s THR 241 Ca 0.44 -0.53 -0.30 0.00 -1.21 0.00 0.00 61.69 60.09 2f83 s THR 241 Cb -0.03 -1.60 0.07 0.00 -1.51 0.00 0.00 72.50 69.43 2f83 s THR 241 CO 0.26 0.00 0.71 -0.94 -2.21 0.00 0.00 174.62 172.45 2f83 s SER 242 N -2.82 -0.66 0.25 8.08 1.04 -1.26 -1.66 113.70 116.67 2f83 s SER 242 Ca 0.08 0.87 -0.03 0.00 0.48 0.00 0.00 55.95 57.34 2f83 s SER 242 Cb -0.03 0.74 0.51 0.00 0.10 0.00 0.00 66.02 67.34 2f83 s SER 242 CO -0.01 -0.51 1.69 -0.33 0.98 0.00 0.00 173.24 175.06 2f83 h GLU 243 N 3.44 0.30 -0.85 4.02 5.08 -2.02 0.27 114.58 124.83 2f83 h GLU 243 Ca -0.27 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.07 2f83 h GLU 243 Cb 1.15 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 30.29 2f83 h GLU 243 CO 0.31 0.20 0.53 1.03 -1.00 0.00 0.00 179.01 180.08 2f83 h SER 244 N 0.31 1.00 0.00 1.42 0.87 -2.01 -3.46 113.55 111.68 2f83 h SER 244 Ca 0.44 -0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.96 2f83 h SER 244 Cb 0.76 -0.25 0.00 0.00 -0.44 0.00 0.00 62.40 62.47 2f83 h SER 244 CO -0.50 0.75 0.00 0.61 -0.53 0.00 0.00 176.83 177.16 2f83 n GLY 245 N -1.32 2.49 3.85 5.77 0.00 0.95 -5.04 105.19 111.89 2f83 n GLY 245 Ca 0.09 -0.46 -0.32 0.00 0.00 0.00 0.00 46.02 45.34 2f83 n GLY 245 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2f83 s LEU 246 N 0.00 4.12 0.18 0.99 1.43 -1.26 -4.68 118.68 119.46 2f83 s LEU 246 Ca 0.00 0.18 -0.33 0.00 -1.03 0.00 0.00 54.13 52.95 2f83 s LEU 246 Cb 0.00 -2.63 -0.14 0.00 0.03 0.00 0.00 46.19 43.45 2f83 s LEU 246 CO 0.00 0.21 1.49 -0.81 0.23 0.00 0.00 176.35 177.47 2f83 n PRO 247 N 0.64 2.00 -0.24 1.29 -0.04 -1.26 -4.80 135.00 132.58 2f83 n PRO 247 Ca -0.09 0.72 -0.07 0.00 -0.04 0.00 0.00 63.50 64.02 2f83 n PRO 247 Cb 0.52 -2.43 -0.02 0.00 -0.04 0.00 0.00 33.50 31.53 2f83 n PRO 247 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2f83 h SER 248 N 5.16 -1.46 -5.25 3.54 4.64 -1.95 -3.44 113.55 114.79 2f83 h SER 248 Ca -0.45 0.26 -0.09 0.00 -0.47 0.00 0.00 61.79 61.03 2f83 h SER 248 Cb 1.27 0.69 -0.12 0.00 -0.31 0.00 0.00 62.40 63.93 2f83 h SER 248 CO 0.83 -0.32 -0.25 0.42 -0.87 0.00 0.00 176.83 176.64 2f83 s THR 249 N -5.86 0.05 -0.12 2.95 -4.23 -1.26 -5.15 115.64 102.01 2f83 s THR 249 Ca -0.14 -1.34 0.01 0.00 -1.18 0.00 0.00 61.69 59.04 2f83 s THR 249 Cb 0.15 -1.90 0.02 0.00 1.34 0.00 0.00 72.50 72.10 2f83 s THR 249 CO 0.67 -0.21 -0.15 0.00 -0.54 0.00 0.00 174.62 174.39 2f83 s ARG 250 N -3.97 2.27 -0.17 3.99 3.03 -1.26 -4.37 118.95 118.46 2f83 s ARG 250 Ca 0.18 -0.57 -0.08 0.00 2.03 0.00 0.00 55.73 57.29 2f83 s ARG 250 Cb 0.02 -1.95 -0.04 0.00 -1.03 0.00 0.00 34.95 31.95 2f83 s ARG 250 CO 0.02 -0.10 0.09 0.42 -1.13 0.00 0.00 175.30 174.60 2f83 s ILE 251 N 1.08 5.01 0.25 4.99 1.09 0.22 -4.89 121.20 128.95 2f83 s ILE 251 Ca -0.04 0.04 -0.30 0.00 -1.10 0.00 0.00 60.65 59.25 2f83 s ILE 251 Cb -0.14 -3.25 -0.09 0.00 -1.06 0.00 0.00 42.46 37.91 2f83 s ILE 251 CO -0.03 0.48 1.26 -0.75 -0.10 0.00 0.00 174.94 175.80 2f83 s LYS 252 N 0.12 4.44 0.00 2.79 2.36 -1.26 -0.44 119.74 127.75 2f83 s LYS 252 Ca 0.06 2.04 0.00 0.00 -2.55 0.00 0.00 55.97 55.52 2f83 s LYS 252 Cb -0.12 -3.16 0.00 0.00 -1.05 0.00 0.00 37.83 33.50 2f83 s LYS 252 CO 0.00 -0.13 0.00 1.17 1.55 0.00 0.00 175.35 177.94 2f83 n LYS 253 N 1.79 0.00 -0.76 4.03 4.81 -0.22 -4.88 118.16 122.92 2f83 n LYS 253 Ca 0.03 0.00 -0.30 0.00 -0.87 0.00 0.00 58.31 57.17 2f83 n LYS 253 Cb 0.43 0.00 0.18 0.00 0.02 0.00 0.00 35.03 35.66 2f83 n LYS 253 CO 0.00 0.00 0.00 -1.12 1.17 0.00 0.00 177.40 177.45 2f83 s SER 254 N 0.00 2.48 -0.77 3.14 0.01 -1.26 -3.12 113.70 114.17 2f83 s SER 254 Ca 0.00 1.85 0.00 0.00 1.31 0.00 0.00 55.95 59.11 2f83 s SER 254 Cb 0.00 -2.42 0.00 0.00 0.21 0.00 0.00 66.02 63.81 2f83 s SER 254 CO 0.00 -3.32 0.00 0.29 0.41 0.00 0.00 173.24 170.62 2f83 n LYS 255 N -4.36 -1.76 -4.45 12.44 4.01 -1.26 -4.91 118.16 117.87 2f83 n LYS 255 Ca 0.08 0.75 -0.25 0.00 -0.51 0.00 0.00 58.31 58.38 2f83 n LYS 255 Cb 0.53 -5.17 -0.17 0.00 -0.51 0.00 0.00 35.03 29.71 2f83 n LYS 255 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2f83 s ALA 256 N -1.64 1.25 -0.04 7.82 0.00 -1.24 0.16 121.76 128.07 2f83 s ALA 256 Ca 0.00 -0.42 0.05 0.00 0.00 0.00 0.00 51.96 51.59 2f83 s ALA 256 Cb 0.00 -0.62 -0.02 0.00 0.00 0.00 0.00 23.12 22.48 2f83 s ALA 256 CO 0.00 0.02 -0.19 -1.17 0.00 0.00 0.00 175.76 174.42 2f83 s LEU 257 N 0.85 2.43 0.08 0.00 1.98 -0.78 0.14 118.68 123.37 2f83 s LEU 257 Ca -0.11 -0.32 0.05 0.00 -2.89 0.00 0.00 54.13 50.86 2f83 s LEU 257 Cb -0.15 -1.46 -0.03 0.00 0.66 0.00 0.00 46.19 45.21 2f83 s LEU 257 CO 0.02 0.33 -0.14 -0.44 -1.89 0.00 0.00 176.35 174.22 2f83 s SER 258 N -0.65 1.71 0.05 3.68 0.01 0.58 -0.04 113.70 119.05 2f83 s SER 258 Ca 0.10 -0.65 -0.02 0.00 1.31 0.00 0.00 55.95 56.69 2f83 s SER 258 Cb -0.11 -0.05 0.01 0.00 0.21 0.00 0.00 66.02 66.08 2f83 s SER 258 CO 0.00 -0.09 0.10 0.61 0.41 0.00 0.00 173.24 174.27 2f83 n GLY 259 N 1.14 1.96 3.62 3.44 0.00 -0.93 0.10 105.19 114.53 2f83 n GLY 259 Ca -0.20 -1.08 -0.25 0.00 0.00 0.00 0.00 46.02 44.49 2f83 n GLY 259 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2f83 s PHE 260 N -7.79 2.70 0.16 1.61 0.08 -1.26 -0.45 117.98 113.02 2f83 s PHE 260 Ca 0.02 -0.21 -0.30 0.00 0.12 0.00 0.00 56.93 56.56 2f83 s PHE 260 Cb -0.01 -1.25 -0.08 0.00 -0.57 0.00 0.00 43.02 41.11 2f83 s PHE 260 CO 0.02 0.57 1.21 0.45 -0.10 0.00 0.00 175.22 177.36 2f83 s SER 261 N -3.26 7.08 -0.52 1.36 0.15 -1.04 -4.85 113.70 112.61 2f83 s SER 261 Ca 0.29 2.19 0.02 0.00 0.70 0.00 0.00 55.95 59.15 2f83 s SER 261 Cb -0.08 -2.60 0.44 0.00 -1.71 0.00 0.00 66.02 62.07 2f83 s SER 261 CO 0.18 -0.40 1.60 0.18 1.20 0.00 0.00 173.24 176.00 2f83 n LEU 262 N 2.87 6.28 0.21 3.45 4.77 -1.26 -4.69 117.00 128.62 2f83 n LEU 262 Ca 0.06 -4.64 0.05 0.00 -0.03 0.00 0.00 56.01 51.44 2f83 n LEU 262 Cb 0.45 -0.68 0.45 0.00 -2.33 0.00 0.00 43.42 41.31 2f83 n LEU 262 CO 0.56 1.84 0.83 0.06 -1.33 0.00 0.00 177.39 179.34 2f83 h GLN 263 N 2.26 0.00 0.00 3.23 3.07 -1.93 -1.66 115.11 120.08 2f83 h GLN 263 Ca 0.48 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.22 2f83 h GLN 263 Cb 1.01 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.57 2f83 h GLN 263 CO 1.17 0.26 0.00 0.45 0.09 0.00 0.00 178.83 180.80 2f83 n SER 264 N -4.16 0.22 -0.17 0.06 2.88 -1.26 -2.91 113.62 108.28 2f83 n SER 264 Ca -0.02 0.55 0.02 0.00 -1.33 0.00 0.00 58.87 58.09 2f83 n SER 264 Cb 0.32 -0.60 0.02 0.00 -0.75 0.00 0.00 64.21 63.20 2f83 n SER 264 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2f83 n ARG 266 N 0.14 -0.07 -2.55 0.00 1.74 -1.03 -2.72 116.66 112.17 2f83 n ARG 266 Ca 0.03 0.31 -0.41 0.00 -0.77 0.00 0.00 57.85 57.01 2f83 n ARG 266 Cb 0.14 -0.46 -0.03 0.00 -1.02 0.00 0.00 32.46 31.09 2f83 n ARG 266 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 2f83 s HIS 267 N -4.59 2.32 0.00 -1.55 3.76 -1.26 -2.42 115.29 111.56 2f83 s HIS 267 Ca -0.02 -0.20 0.00 0.00 -0.15 0.00 0.00 55.06 54.69 2f83 s HIS 267 Cb 0.02 -4.64 0.00 0.00 1.11 0.00 0.00 32.58 29.07 2f83 s HIS 267 CO 0.11 -2.05 0.00 0.45 -0.85 0.00 0.00 174.74 172.39 2f83 n SER 268 N 9.31 0.00 -3.62 1.40 2.88 -1.10 -4.63 113.62 117.85 2f83 n SER 268 Ca 0.09 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.53 2f83 n SER 268 Cb 0.49 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.89 2f83 n SER 268 CO 0.00 0.00 0.00 -0.51 -1.23 0.00 0.00 175.04 173.30 2f83 s ILE 269 N 0.00 0.00 0.37 2.46 1.10 -1.01 -4.95 121.20 119.17 2f83 s ILE 269 Ca 0.00 0.00 -0.27 0.00 -0.51 0.00 0.00 60.65 59.87 2f83 s ILE 269 Cb 0.00 -1.00 -0.10 0.00 0.15 0.00 0.00 42.46 41.51 2f83 s ILE 269 CO 0.00 0.00 1.32 -2.16 -2.11 0.00 0.00 174.94 171.99 2f83 s PRO 270 N -0.02 4.14 0.00 3.50 0.04 -1.26 -4.80 135.00 136.61 2f83 s PRO 270 Ca 0.02 2.21 0.00 0.00 0.04 0.00 0.00 61.00 63.27 2f83 s PRO 270 Cb -0.04 -2.91 0.00 0.00 0.04 0.00 0.00 34.50 31.59 2f83 s PRO 270 CO -0.04 -0.37 0.00 0.28 0.04 0.00 0.00 177.00 176.91 2f83 n VAL 271 N 0.44 0.00 -1.30 -0.36 0.31 -1.26 -4.80 118.33 111.35 2f83 n VAL 271 Ca 0.02 0.00 -0.29 0.00 -0.01 0.00 0.00 64.34 64.06 2f83 n VAL 271 Cb 0.42 -0.59 0.13 0.00 -0.91 0.00 0.00 33.84 32.89 2f83 n VAL 271 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 2f83 n PHE 272 N -2.35 3.11 -3.70 3.52 3.01 -1.26 -4.71 117.46 115.08 2f83 n PHE 272 Ca 0.00 -2.46 -0.15 0.00 1.01 0.00 0.00 57.45 55.85 2f83 n PHE 272 Cb 0.20 -1.19 -0.15 0.00 -0.01 0.00 0.00 39.48 38.34 2f83 n PHE 272 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2f83 n HIS 274 N 4.87 2.66 -2.31 0.00 8.25 -1.26 -4.96 115.22 122.46 2f83 n HIS 274 Ca -0.14 -4.02 -0.36 0.00 -0.26 0.00 0.00 57.72 52.95 2f83 n HIS 274 Cb 0.51 -0.50 -0.04 0.00 1.12 0.00 0.00 29.99 31.08 2f83 n HIS 274 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2f83 s SER 275 N -2.10 5.82 -0.29 0.41 0.15 -1.26 -4.48 113.70 111.94 2f83 s SER 275 Ca 0.38 -0.79 -0.25 0.00 0.70 0.00 0.00 55.95 55.99 2f83 s SER 275 Cb 0.14 -2.56 0.17 0.00 -1.71 0.00 0.00 66.02 62.06 2f83 s SER 275 CO -0.04 -2.10 1.32 -0.44 1.20 0.00 0.00 173.24 173.18 2f83 s SER 276 N 6.26 -0.17 0.10 5.45 0.01 -1.26 -5.17 113.70 118.93 2f83 s SER 276 Ca 0.55 0.32 0.04 0.00 1.31 0.00 0.00 55.95 58.17 2f83 s SER 276 Cb -0.05 0.33 -0.04 0.00 0.21 0.00 0.00 66.02 66.46 2f83 s SER 276 CO 0.01 -0.06 0.09 -0.36 0.41 0.00 0.00 173.24 173.33 2f83 s PHE 277 N 0.05 3.16 -0.40 2.43 0.40 -1.26 -4.61 117.98 117.75 2f83 s PHE 277 Ca 0.06 0.04 0.03 0.00 -0.60 0.00 0.00 56.93 56.47 2f83 s PHE 277 Cb -0.05 -1.59 0.11 0.00 0.51 0.00 0.00 43.02 42.01 2f83 s PHE 277 CO -0.13 0.52 0.13 0.71 0.70 0.00 0.00 175.22 177.15 2f83 s TYR 278 N -1.48 3.27 0.37 0.36 2.02 0.94 -4.93 117.35 117.90 2f83 s TYR 278 Ca 0.29 -2.89 -0.26 0.00 -0.37 0.00 0.00 57.07 53.84 2f83 s TYR 278 Cb -0.12 -2.71 -0.09 0.00 -0.40 0.00 0.00 41.96 38.65 2f83 s TYR 278 CO 0.22 -0.87 1.13 -1.01 -1.57 0.00 0.00 175.55 173.45 2f83 s HIS 279 N 0.59 3.23 -1.27 2.71 3.76 -1.26 -0.64 115.29 122.42 2f83 s HIS 279 Ca 0.13 1.60 -0.07 0.00 -0.15 0.00 0.00 55.06 56.57 2f83 s HIS 279 Cb -0.21 -3.32 -0.01 0.00 1.11 0.00 0.00 32.58 30.15 2f83 s HIS 279 CO -0.07 -1.00 0.66 -3.47 -0.85 0.00 0.00 174.74 170.01 2f83 n ASP 280 N 0.34 -2.52 -3.68 1.40 4.64 0.61 -4.85 116.55 112.49 2f83 n ASP 280 Ca 0.03 -0.93 -0.09 0.00 -1.38 0.00 0.00 54.79 52.42 2f83 n ASP 280 Cb 0.47 -3.65 -0.10 0.00 -1.04 0.00 0.00 41.12 36.80 2f83 n ASP 280 CO 0.00 0.00 0.00 -0.89 -0.82 0.00 0.00 177.20 175.49 2f83 s THR 281 N -3.67 -0.14 -0.14 5.18 2.01 0.68 -1.30 115.64 118.26 2f83 s THR 281 Ca 0.17 0.09 0.01 0.00 0.31 0.00 0.00 61.69 62.27 2f83 s THR 281 Cb -0.06 -0.70 0.02 0.00 0.01 0.00 0.00 72.50 71.77 2f83 s THR 281 CO 0.84 0.04 -0.16 -1.81 -0.69 0.00 0.00 174.62 172.84 2f83 s ASP 282 N 1.67 2.71 -0.32 3.53 1.01 -0.66 -2.86 116.67 121.75 2f83 s ASP 282 Ca -0.08 -0.50 -0.23 0.00 0.71 0.00 0.00 52.55 52.44 2f83 s ASP 282 Cb -0.08 -1.22 0.00 0.00 1.01 0.00 0.00 42.92 42.63 2f83 s ASP 282 CO -0.14 -0.01 0.78 -0.36 0.21 0.00 0.00 175.17 175.65 2f83 s PHE 283 N 1.22 3.18 0.40 4.23 2.99 -1.26 -2.68 117.98 126.04 2f83 s PHE 283 Ca -0.00 0.73 -0.19 0.00 0.00 0.00 0.00 56.93 57.47 2f83 s PHE 283 Cb -0.14 -3.27 -0.10 0.00 0.00 0.00 0.00 43.02 39.52 2f83 s PHE 283 CO -0.07 -0.61 0.87 -0.51 -0.00 0.00 0.00 175.22 174.90 2f83 s LEU 284 N 2.99 3.97 0.00 -0.37 1.43 -0.87 -4.80 118.68 121.03 2f83 s LEU 284 Ca 0.32 1.53 0.00 0.00 -1.03 0.00 0.00 54.13 54.95 2f83 s LEU 284 Cb -0.14 -4.37 0.00 0.00 0.03 0.00 0.00 46.19 41.71 2f83 s LEU 284 CO 0.14 -0.32 0.00 0.61 0.23 0.00 0.00 176.35 177.01 2f83 n GLY 285 N -0.59 -1.37 3.78 -3.19 0.00 -1.26 -2.94 105.19 99.61 2f83 n GLY 285 Ca 0.06 -0.97 -0.37 0.00 0.00 0.00 0.00 46.02 44.73 2f83 n GLY 285 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2f83 s GLU 286 N -1.07 4.37 -0.28 1.61 2.02 -1.13 -4.84 118.70 119.36 2f83 s GLU 286 Ca 0.00 1.47 -0.15 0.00 0.02 0.00 0.00 54.97 56.31 2f83 s GLU 286 Cb 0.00 -2.70 -0.03 0.00 0.10 0.00 0.00 34.13 31.50 2f83 s GLU 286 CO 0.00 0.05 0.40 -1.21 0.02 0.00 0.00 175.26 174.52 2f83 s GLU 287 N -2.24 3.94 -0.06 1.61 2.02 -1.26 -1.74 118.70 120.97 2f83 s GLU 287 Ca 0.54 0.00 -0.05 0.00 0.02 0.00 0.00 54.97 55.48 2f83 s GLU 287 Cb -0.22 -3.68 -0.28 0.00 0.10 0.00 0.00 34.13 30.05 2f83 s GLU 287 CO 0.27 -0.34 0.61 1.25 0.02 0.00 0.00 175.26 177.07 2f83 h LEU 288 N 8.68 0.43 -7.00 1.80 5.85 -0.32 -3.49 115.31 121.27 2f83 h LEU 288 Ca -0.31 -0.75 0.23 0.00 0.84 0.00 0.00 57.88 57.89 2f83 h LEU 288 Cb 1.15 -0.14 -0.28 0.00 0.37 0.00 0.00 40.66 41.76 2f83 h LEU 288 CO 0.67 1.65 0.93 -0.62 -0.34 0.00 0.00 178.44 180.73 2f83 s ASP 289 N -7.01 -0.05 -0.25 1.25 2.15 -1.02 -4.98 116.67 106.75 2f83 s ASP 289 Ca -0.15 0.06 0.01 0.00 0.43 0.00 0.00 52.55 52.90 2f83 s ASP 289 Cb 0.06 0.05 0.04 0.00 -0.30 0.00 0.00 42.92 42.78 2f83 s ASP 289 CO 0.82 -0.04 -0.10 -0.63 -0.17 0.00 0.00 175.17 175.06 2f83 s ILE 290 N -0.87 2.45 0.21 4.11 1.01 -1.26 0.55 121.20 127.40 2f83 s ILE 290 Ca 0.08 -1.34 0.09 0.00 0.00 0.00 0.00 60.65 59.48 2f83 s ILE 290 Cb -0.01 -2.33 -0.05 0.00 0.01 0.00 0.00 42.46 40.08 2f83 s ILE 290 CO -0.09 0.10 -0.18 0.54 0.00 0.00 0.00 174.94 175.32 2f83 s VAL 291 N 1.21 1.98 0.49 2.92 0.11 0.24 -4.91 120.40 122.43 2f83 s VAL 291 Ca -0.04 -2.16 -0.22 0.00 -2.93 0.00 0.00 61.98 56.63 2f83 s VAL 291 Cb -0.18 -2.05 -0.07 0.00 -1.53 0.00 0.00 36.38 32.55 2f83 s VAL 291 CO -0.06 -0.43 1.19 0.00 -3.33 0.00 0.00 175.10 172.48 2f83 s ALA 292 N -2.50 2.90 -0.29 1.54 0.00 -1.26 -0.78 121.76 121.37 2f83 s ALA 292 Ca 0.22 0.99 -0.21 0.00 0.00 0.00 0.00 51.96 52.96 2f83 s ALA 292 Cb -0.04 -3.41 0.17 0.00 0.00 0.00 0.00 23.12 19.84 2f83 s ALA 292 CO 0.09 -0.81 1.20 0.00 0.00 0.00 0.00 175.76 176.24 2f83 s ALA 293 N -1.53 -2.25 -0.20 0.00 0.00 -0.95 -4.81 121.76 112.02 2f83 s ALA 293 Ca 0.66 1.90 -0.12 0.00 0.00 0.00 0.00 51.96 54.40 2f83 s ALA 293 Cb -0.30 -1.71 -0.05 0.00 0.00 0.00 0.00 23.12 21.06 2f83 s ALA 293 CO 0.36 -0.23 0.21 -1.59 0.00 0.00 0.00 175.76 174.51 2f83 s LYS 294 N 0.54 4.18 0.50 0.00 0.00 -1.26 0.14 119.74 123.84 2f83 s LYS 294 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 55.97 55.87 2f83 s LYS 294 Cb -0.04 -3.46 0.00 0.00 0.00 0.00 0.00 37.83 34.33 2f83 s LYS 294 CO -0.12 0.20 0.00 0.45 0.00 0.00 0.00 175.35 175.88 2f83 n SER 295 N 3.79 -7.96 -3.50 0.03 2.88 -1.26 -4.59 113.62 103.02 2f83 n SER 295 Ca -0.14 1.29 0.00 0.00 -1.33 0.00 0.00 58.87 58.69 2f83 n SER 295 Cb 0.52 -4.41 0.00 0.00 -0.75 0.00 0.00 64.21 59.57 2f83 n SER 295 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2f83 n HIS 296 N -1.29 -1.26 0.00 0.66 1.44 -1.26 -3.33 115.22 110.18 2f83 n HIS 296 Ca 0.00 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.71 2f83 n HIS 296 Cb 0.11 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.22 2f83 n HIS 296 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 2f83 n GLU 297 N -0.52 0.00 -0.19 -1.40 1.02 -1.26 -3.60 120.64 114.69 2f83 n GLU 297 Ca 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 57.16 57.12 2f83 n GLU 297 Cb 0.00 0.00 0.08 0.00 -0.02 0.00 0.00 31.44 31.50 2f83 n GLU 297 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2f83 h ALA 298 N 0.00 0.76 0.96 0.62 0.00 -1.80 2.64 119.26 122.43 2f83 h ALA 298 Ca 0.00 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 2f83 h ALA 298 Cb 0.00 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 17.74 2f83 h ALA 298 CO 0.00 -0.07 -0.46 0.00 0.00 0.00 0.00 179.25 178.72 2f83 h GLN 300 N -1.32 0.38 -0.27 0.00 4.15 -1.53 0.61 115.11 117.12 2f83 h GLN 300 Ca -0.13 -0.02 -0.01 0.00 0.77 0.00 0.00 58.65 59.26 2f83 h GLN 300 Cb 0.98 -0.09 -0.01 0.00 0.21 0.00 0.00 27.48 28.58 2f83 h GLN 300 CO 0.22 0.25 0.14 -0.22 -1.93 0.00 0.00 178.83 177.29 2f83 h LYS 301 N 0.39 0.37 -0.25 1.69 3.11 0.48 0.65 116.57 123.01 2f83 h LYS 301 Ca 0.51 -0.03 -0.10 0.00 -2.81 0.00 0.00 60.65 58.21 2f83 h LYS 301 Cb 0.91 -0.08 -0.00 0.00 -1.00 0.00 0.00 32.23 32.06 2f83 h LYS 301 CO -0.51 0.28 -0.25 -0.07 -2.81 0.00 0.00 179.45 176.10 2f83 h LEU 302 N 0.38 0.65 -0.27 5.20 -0.00 0.11 -0.92 115.31 120.46 2f83 h LEU 302 Ca 0.10 -0.47 -0.03 0.00 -0.00 0.00 0.00 57.88 57.48 2f83 h LEU 302 Cb 0.02 -0.18 -0.01 0.00 -0.00 0.00 0.00 40.66 40.49 2f83 h LEU 302 CO -0.02 0.99 0.05 0.00 -0.00 0.00 0.00 178.44 179.46 2f83 h THR 304 N 0.27 0.83 -0.00 0.00 2.02 0.34 -1.22 112.91 115.15 2f83 h THR 304 Ca 0.08 -0.09 0.00 0.00 0.77 0.00 0.00 66.41 67.17 2f83 h THR 304 Cb 0.32 0.55 0.00 0.00 -1.74 0.00 0.00 68.15 67.28 2f83 h THR 304 CO 0.00 0.05 -0.36 0.59 0.37 0.00 0.00 175.52 176.18 2f83 n ASN 305 N -4.45 0.48 -4.39 4.18 4.13 -0.36 -4.49 115.26 110.36 2f83 n ASN 305 Ca 0.10 -0.23 -0.41 0.00 1.68 0.00 0.00 54.58 55.72 2f83 n ASN 305 Cb 0.46 0.09 -0.11 0.00 -1.54 0.00 0.00 39.78 38.67 2f83 n ASN 305 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2f83 s ALA 306 N -2.90 3.31 0.21 5.41 0.00 -0.46 -4.98 121.76 122.34 2f83 s ALA 306 Ca 0.15 -1.69 -0.18 0.00 0.00 0.00 0.00 51.96 50.23 2f83 s ALA 306 Cb 0.18 -2.62 0.19 0.00 0.00 0.00 0.00 23.12 20.87 2f83 s ALA 306 CO 0.63 -1.36 1.58 0.28 0.00 0.00 0.00 175.76 176.90 2f83 h VAL 307 N 5.82 0.15 0.00 0.00 2.07 -1.84 0.64 116.25 123.09 2f83 h VAL 307 Ca -0.26 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.23 2f83 h VAL 307 Cb 1.11 0.15 -0.00 0.00 -1.52 0.00 0.00 31.29 31.02 2f83 h VAL 307 CO 0.67 0.00 -0.15 0.03 0.02 0.00 0.00 177.57 178.14 2f83 h ARG 308 N -0.10 0.00 -6.35 1.57 2.47 -1.94 -3.44 114.38 106.60 2f83 h ARG 308 Ca 0.28 0.00 -0.54 0.00 -1.26 0.00 0.00 59.98 58.47 2f83 h ARG 308 Cb 0.56 0.00 0.01 0.00 -1.65 0.00 0.00 29.97 28.90 2f83 h ARG 308 CO -0.77 0.15 1.14 0.00 0.56 0.00 0.00 179.97 181.05 2f83 n GLN 310 N 6.98 0.96 -3.60 0.00 6.02 -0.64 -4.60 117.38 122.51 2f83 n GLN 310 Ca 0.18 -0.01 -0.07 0.00 -0.01 0.00 0.00 57.00 57.09 2f83 n GLN 310 Cb 0.41 -1.48 -0.02 0.00 1.02 0.00 0.00 30.24 30.18 2f83 n GLN 310 CO 0.00 0.00 0.00 -0.59 -1.01 0.00 0.00 177.06 175.46 2f83 s PHE 311 N -2.48 -0.29 0.22 1.08 -0.12 -1.02 -2.55 117.98 112.84 2f83 s PHE 311 Ca -0.09 0.06 -0.08 0.00 -0.05 0.00 0.00 56.93 56.77 2f83 s PHE 311 Cb 0.06 0.59 -0.02 0.00 -0.63 0.00 0.00 43.02 43.01 2f83 s PHE 311 CO 0.76 -0.72 0.33 -0.59 -0.05 0.00 0.00 175.22 174.94 2f83 s PHE 312 N -3.31 0.68 -0.04 3.49 -0.12 -0.72 -0.48 117.98 117.48 2f83 s PHE 312 Ca 0.07 -0.99 -0.01 0.00 -0.05 0.00 0.00 56.93 55.96 2f83 s PHE 312 Cb -0.01 -0.12 0.03 0.00 -0.63 0.00 0.00 43.02 42.28 2f83 s PHE 312 CO -0.05 -0.84 0.03 0.99 -0.05 0.00 0.00 175.22 175.31 2f83 s THR 313 N -4.07 0.07 -0.14 -4.49 2.01 -0.76 -2.18 115.64 106.08 2f83 s THR 313 Ca 0.29 0.28 -0.12 0.00 0.31 0.00 0.00 61.69 62.44 2f83 s THR 313 Cb 0.03 -0.26 -0.05 0.00 0.01 0.00 0.00 72.50 72.23 2f83 s THR 313 CO 0.10 0.19 0.25 -0.47 -0.69 0.00 0.00 174.62 174.00 2f83 s TYR 314 N 1.83 3.51 -0.32 4.92 5.04 0.13 -1.43 117.35 131.04 2f83 s TYR 314 Ca 0.01 0.59 -0.05 0.00 -2.44 0.00 0.00 57.07 55.19 2f83 s TYR 314 Cb -0.12 -2.23 0.04 0.00 0.35 0.00 0.00 41.96 39.99 2f83 s TYR 314 CO -0.03 0.39 0.06 -0.08 -1.34 0.00 0.00 175.55 174.54 2f83 s THR 315 N -0.02 3.47 0.78 4.34 -1.32 0.59 -1.52 115.64 121.97 2f83 s THR 315 Ca 0.16 -1.18 -0.12 0.00 -1.21 0.00 0.00 61.69 59.34 2f83 s THR 315 Cb -0.13 -2.95 0.07 0.00 -1.51 0.00 0.00 72.50 67.97 2f83 s THR 315 CO 0.04 -0.11 1.12 -2.16 -2.21 0.00 0.00 174.62 171.30 2f83 s PRO 316 N 1.35 2.04 0.12 7.08 0.04 -1.26 0.82 135.00 145.19 2f83 s PRO 316 Ca -0.03 1.38 -0.31 0.00 0.04 0.00 0.00 61.00 62.08 2f83 s PRO 316 Cb -0.19 -1.86 -0.08 0.00 0.04 0.00 0.00 34.50 32.41 2f83 s PRO 316 CO 0.01 -1.84 1.37 0.00 0.04 0.00 0.00 177.00 176.58 2f83 s ALA 317 N -2.63 3.58 -0.45 8.56 0.00 -1.26 -4.78 121.76 124.78 2f83 s ALA 317 Ca 0.65 1.10 -0.42 0.00 0.00 0.00 0.00 51.96 53.29 2f83 s ALA 317 Cb -0.21 -3.53 -0.17 0.00 0.00 0.00 0.00 23.12 19.21 2f83 s ALA 317 CO 0.53 -0.60 2.02 1.04 0.00 0.00 0.00 175.76 178.75 2f83 n GLN 318 N 3.84 0.32 -1.47 0.00 1.13 -1.26 -4.58 117.38 115.36 2f83 n GLN 318 Ca 0.11 0.10 0.18 0.00 -1.94 0.00 0.00 57.00 55.45 2f83 n GLN 318 Cb 0.43 -1.74 -0.08 0.00 0.11 0.00 0.00 30.24 28.95 2f83 n GLN 318 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2f83 n ALA 319 N 7.15 -3.85 0.31 -1.58 0.00 -1.26 -3.51 120.51 117.78 2f83 n ALA 319 Ca 0.46 0.78 0.20 0.00 0.00 0.00 0.00 53.44 54.88 2f83 n ALA 319 Cb 0.02 -1.51 0.97 0.00 0.00 0.00 0.00 19.45 18.93 2f83 n ALA 319 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2f83 h SER 320 N -1.43 0.00 -0.00 0.00 0.87 -1.98 -3.10 113.55 107.91 2f83 h SER 320 Ca -0.12 0.00 0.02 0.00 -1.23 0.00 0.00 61.79 60.46 2f83 h SER 320 Cb 1.39 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 63.32 2f83 h SER 320 CO 0.06 0.00 -0.14 0.00 -0.53 0.00 0.00 176.83 176.21 2f83 s ASN 322 N -5.00 7.19 0.08 0.00 3.04 -1.17 -5.05 114.94 114.03 2f83 s ASN 322 Ca -0.14 1.43 0.00 0.00 0.04 0.00 0.00 52.86 54.18 2f83 s ASN 322 Cb 0.09 -2.46 0.00 0.00 -1.54 0.00 0.00 41.25 37.33 2f83 s ASN 322 CO 0.67 -0.01 0.00 -1.84 -3.04 0.00 0.00 177.10 172.88 2f83 n GLU 323 N 2.94 1.88 0.00 0.43 -0.00 -1.26 -4.75 120.64 119.87 2f83 n GLU 323 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.14 2f83 n GLU 323 Cb 0.50 0.00 0.00 0.00 -0.00 0.00 0.00 31.44 31.94 2f83 n GLU 323 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2f83 n GLY 324 N 0.00 -2.17 0.83 -1.84 0.00 -1.26 -4.48 105.19 96.27 2f83 n GLY 324 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2f83 n GLY 324 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2f83 n LYS 325 N -0.85 0.00 -1.71 1.61 5.02 -1.26 -4.03 118.16 116.94 2f83 n LYS 325 Ca 0.00 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.19 2f83 n LYS 325 Cb 0.00 0.00 0.04 0.00 -0.02 0.00 0.00 35.03 35.05 2f83 n LYS 325 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2f83 n GLY 326 N -0.16 1.35 3.23 0.72 0.00 0.12 -4.63 105.19 105.82 2f83 n GLY 326 Ca 0.00 -2.08 -0.33 0.00 0.00 0.00 0.00 46.02 43.61 2f83 n GLY 326 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2f83 s LYS 327 N -3.40 3.14 -0.29 1.61 3.01 0.24 -2.23 119.74 121.82 2f83 s LYS 327 Ca 0.29 -0.79 -0.06 0.00 -1.01 0.00 0.00 55.97 54.40 2f83 s LYS 327 Cb -0.02 -2.56 0.01 0.00 -1.01 0.00 0.00 37.83 34.25 2f83 s LYS 327 CO 0.19 -0.01 0.05 0.00 0.51 0.00 0.00 175.35 176.09 2f83 s TYR 329 N 1.46 3.20 -0.22 0.00 1.51 -0.51 -0.59 117.35 122.19 2f83 s TYR 329 Ca 0.02 -0.33 -0.20 0.00 -1.01 0.00 0.00 57.07 55.55 2f83 s TYR 329 Cb -0.17 -2.39 -0.03 0.00 -0.11 0.00 0.00 41.96 39.26 2f83 s TYR 329 CO 0.01 -0.37 0.58 -0.51 -1.11 0.00 0.00 175.55 174.15 2f83 s LEU 330 N 1.67 4.12 0.29 -1.29 1.43 0.19 -1.83 118.68 123.26 2f83 s LEU 330 Ca 0.06 0.72 0.06 0.00 -1.03 0.00 0.00 54.13 53.93 2f83 s LEU 330 Cb -0.17 -2.79 -0.06 0.00 0.03 0.00 0.00 46.19 43.20 2f83 s LEU 330 CO 0.08 -0.26 -0.03 -0.54 0.23 0.00 0.00 176.35 175.83 2f83 s LYS 331 N 1.99 1.56 -0.25 1.70 1.02 0.37 0.47 119.74 126.60 2f83 s LYS 331 Ca 0.26 -1.81 -0.14 0.00 0.02 0.00 0.00 55.97 54.31 2f83 s LYS 331 Cb -0.16 -1.05 0.08 0.00 -0.52 0.00 0.00 37.83 36.18 2f83 s LYS 331 CO 0.10 -0.02 0.61 -0.48 -0.92 0.00 0.00 175.35 174.63 2f83 s LEU 332 N -3.44 -0.74 0.00 3.17 0.05 -0.71 -1.61 118.68 115.39 2f83 s LEU 332 Ca 0.31 1.35 0.00 0.00 0.05 0.00 0.00 54.13 55.84 2f83 s LEU 332 Cb 0.05 2.09 0.00 0.00 -2.05 0.00 0.00 46.19 46.28 2f83 s LEU 332 CO 0.12 -0.23 0.00 -1.54 -0.55 0.00 0.00 176.35 174.16 2f83 n SER 333 N 4.44 0.55 -2.56 1.48 3.41 -1.26 -2.85 113.62 116.82 2f83 n SER 333 Ca -0.20 -0.80 -0.35 0.00 -0.26 0.00 0.00 58.87 57.26 2f83 n SER 333 Cb 0.57 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.57 2f83 n SER 333 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2f83 n SER 334 N -1.95 7.47 0.00 4.04 3.41 -1.26 -4.74 113.62 120.59 2f83 n SER 334 Ca 0.00 -3.72 0.00 0.00 -0.26 0.00 0.00 58.87 54.89 2f83 n SER 334 Cb 0.00 -1.04 0.00 0.00 -0.26 0.00 0.00 64.21 62.91 2f83 n SER 334 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 2f83 n ASN 335 N -0.55 0.00 -3.11 4.04 2.04 -1.26 -4.94 115.26 111.47 2f83 n ASN 335 Ca 0.56 0.00 -0.05 0.00 -0.44 0.00 0.00 54.58 54.65 2f83 n ASN 335 Cb 0.47 0.00 -0.02 0.00 -2.53 0.00 0.00 39.78 37.70 2f83 n ASN 335 CO 0.00 0.00 0.00 -0.83 -0.44 0.00 0.00 177.26 175.99 2f83 s GLY 336 N 0.00 -0.91 0.05 4.83 0.00 -1.26 -4.96 107.32 105.06 2f83 s GLY 336 Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 44.72 44.39 2f83 s GLY 336 CO 0.00 3.42 0.00 -1.14 0.00 0.00 0.00 173.10 175.38 2f83 n SER 337 N 3.86 -9.08 0.00 1.64 3.41 -1.26 -4.50 113.62 107.68 2f83 n SER 337 Ca 0.14 1.78 -0.05 0.00 -0.26 0.00 0.00 58.87 60.48 2f83 n SER 337 Cb 0.54 -5.06 -0.03 0.00 -0.26 0.00 0.00 64.21 59.40 2f83 n SER 337 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 2f83 h PRO 338 N 4.33 -0.18 -4.75 4.33 0.11 -1.90 -3.37 132.00 130.57 2f83 h PRO 338 Ca 0.00 0.01 -0.34 0.00 0.11 0.00 0.00 66.00 65.78 2f83 h PRO 338 Cb 0.00 0.04 -0.24 0.00 0.11 0.00 0.00 31.00 30.91 2f83 h PRO 338 CO 0.00 -0.12 -0.76 -0.08 -0.21 0.00 0.00 178.00 176.83 2f83 s THR 339 N -3.83 0.70 -1.03 -1.15 -1.32 -1.26 -4.72 115.64 103.02 2f83 s THR 339 Ca -0.05 -0.83 -0.06 0.00 -1.21 0.00 0.00 61.69 59.54 2f83 s THR 339 Cb 0.02 -0.68 0.26 0.00 -1.51 0.00 0.00 72.50 70.60 2f83 s THR 339 CO 0.19 -0.12 1.03 1.17 -2.21 0.00 0.00 174.62 174.68 2f83 n LYS 340 N 1.99 3.31 -1.92 7.08 4.81 -1.26 -2.06 118.16 130.11 2f83 n LYS 340 Ca -0.19 -4.48 -0.42 0.00 -0.87 0.00 0.00 58.31 52.35 2f83 n LYS 340 Cb 0.56 -2.49 -0.03 0.00 0.02 0.00 0.00 35.03 33.09 2f83 n LYS 340 CO 0.00 0.00 0.00 0.96 1.17 0.00 0.00 177.40 179.53 2f83 s ILE 341 N -1.51 3.37 0.00 3.15 -4.36 -1.09 -4.88 121.20 115.88 2f83 s ILE 341 Ca 0.30 0.36 0.00 0.00 -0.26 0.00 0.00 60.65 61.05 2f83 s ILE 341 Cb -0.07 -3.55 0.00 0.00 1.25 0.00 0.00 42.46 40.09 2f83 s ILE 341 CO -0.08 -0.39 0.00 0.18 0.24 0.00 0.00 174.94 174.90 2f83 n LEU 342 N 11.01 0.00 -2.74 0.37 4.77 -1.26 -1.65 117.00 127.50 2f83 n LEU 342 Ca 0.24 0.00 -0.25 0.00 -0.03 0.00 0.00 56.01 55.97 2f83 n LEU 342 Cb 0.47 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.57 2f83 n LEU 342 CO 0.68 -0.06 -0.47 0.00 -1.33 0.00 0.00 177.39 176.22 2f83 n HIS 343 N -0.13 -2.04 0.00 -1.77 1.44 -0.42 -4.57 115.22 107.74 2f83 n HIS 343 Ca 0.00 0.26 0.00 0.00 -2.01 0.00 0.00 57.72 55.97 2f83 n HIS 343 Cb 0.00 -1.08 0.00 0.00 0.12 0.00 0.00 29.99 29.03 2f83 n HIS 343 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2f83 n GLY 344 N 1.69 1.32 4.45 -1.39 0.00 -1.26 -4.84 105.19 105.16 2f83 n GLY 344 Ca 0.04 -1.88 0.00 0.00 0.00 0.00 0.00 46.02 44.19 2f83 n GLY 344 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2f83 n ARG 345 N 1.45 0.00 -3.58 1.61 3.00 -1.26 -4.37 116.66 113.51 2f83 n ARG 345 Ca 0.00 0.00 -0.19 0.00 -0.01 0.00 0.00 57.85 57.65 2f83 n ARG 345 Cb 0.00 -2.85 -0.04 0.00 0.00 0.00 0.00 32.46 29.57 2f83 n ARG 345 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2f83 n GLY 346 N -1.69 -0.16 3.92 -0.13 0.00 -1.26 -4.94 105.19 100.93 2f83 n GLY 346 Ca 0.00 0.12 -0.20 0.00 0.00 0.00 0.00 46.02 45.93 2f83 n GLY 346 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2f83 s GLY 347 N -3.86 2.08 -0.09 -0.02 0.00 -1.26 -4.62 107.32 99.56 2f83 s GLY 347 Ca 0.07 -1.80 -0.01 0.00 0.00 0.00 0.00 44.72 42.98 2f83 s GLY 347 CO 0.53 -1.68 -0.03 -1.50 0.00 0.00 0.00 173.10 170.42 2f83 s ILE 348 N -2.50 0.66 0.20 0.90 -1.16 -0.57 0.22 121.20 118.94 2f83 s ILE 348 Ca 0.49 -0.06 0.11 0.00 -0.51 0.00 0.00 60.65 60.69 2f83 s ILE 348 Cb -0.05 -0.76 -0.04 0.00 0.61 0.00 0.00 42.46 42.22 2f83 s ILE 348 CO 0.29 0.31 -0.23 -0.44 -2.81 0.00 0.00 174.94 172.06 2f83 s SER 349 N 1.86 3.50 0.09 4.50 0.01 0.19 0.22 113.70 124.07 2f83 s SER 349 Ca 0.05 -0.85 -0.03 0.00 1.31 0.00 0.00 55.95 56.43 2f83 s SER 349 Cb -0.12 -0.29 0.01 0.00 0.21 0.00 0.00 66.02 65.83 2f83 s SER 349 CO -0.07 0.12 0.17 0.61 0.41 0.00 0.00 173.24 174.48 2f83 n GLY 350 N 0.21 1.93 3.96 3.44 0.00 -0.93 -0.04 105.19 113.76 2f83 n GLY 350 Ca -0.12 -1.12 -0.21 0.00 0.00 0.00 0.00 46.02 44.57 2f83 n GLY 350 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2f83 s TYR 351 N -7.05 1.95 -1.54 1.61 2.02 -1.26 -1.76 117.35 111.32 2f83 s TYR 351 Ca 0.04 -0.66 0.17 0.00 -0.37 0.00 0.00 57.07 56.24 2f83 s TYR 351 Cb -0.01 -2.14 0.87 0.00 -0.40 0.00 0.00 41.96 40.28 2f83 s TYR 351 CO 0.03 -0.63 1.47 -2.37 -1.57 0.00 0.00 175.55 172.48 2f83 n THR 352 N -1.90 0.42 0.00 -0.71 5.66 -1.06 -4.75 114.28 111.94 2f83 n THR 352 Ca 0.07 0.10 0.00 0.00 -3.05 0.00 0.00 64.05 61.18 2f83 n THR 352 Cb 0.62 -0.83 0.00 0.00 -1.55 0.00 0.00 70.33 68.57 2f83 n THR 352 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 2f83 n LEU 353 N -1.23 0.00 0.00 1.09 4.32 -1.26 -3.44 117.00 116.48 2f83 n LEU 353 Ca 0.09 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.08 2f83 n LEU 353 Cb 0.12 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.92 2f83 n LEU 353 CO 0.12 0.00 0.41 -1.14 -1.22 0.00 0.00 177.39 175.56 2f83 n ARG 354 N -0.09 0.00 0.10 3.23 0.00 -1.26 -0.91 116.66 117.73 2f83 n ARG 354 Ca 0.00 0.31 -0.21 0.00 -0.00 0.00 0.00 57.85 57.95 2f83 n ARG 354 Cb 0.00 -1.53 -0.15 0.00 0.00 0.00 0.00 32.46 30.78 2f83 n ARG 354 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.63 177.56 2f83 h LEU 355 N 0.00 0.62 -1.91 6.15 3.38 -1.78 -3.35 115.31 118.42 2f83 h LEU 355 Ca 0.00 -0.78 0.18 0.00 0.09 0.00 0.00 57.88 57.36 2f83 h LEU 355 Cb 0.06 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.58 2f83 h LEU 355 CO 0.00 1.64 0.46 0.00 0.09 0.00 0.00 178.44 180.63 2f83 h LYS 357 N 0.08 0.00 -0.57 0.00 1.79 -1.71 0.37 116.57 116.53 2f83 h LYS 357 Ca 0.31 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.78 2f83 h LYS 357 Cb 1.13 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.78 2f83 h LYS 357 CO -0.03 0.00 0.00 -0.12 -1.08 0.00 0.00 179.45 178.22 2f83 n MET 358 N -2.82 4.53 -4.09 3.15 1.56 0.25 -3.77 117.12 115.93 2f83 n MET 358 Ca -0.02 -3.09 -0.33 0.00 -0.27 0.00 0.00 57.70 53.99 2f83 n MET 358 Cb 0.08 -2.16 -0.16 0.00 2.15 0.00 0.00 33.22 33.14 2f83 n MET 358 CO 0.00 0.00 0.00 0.34 -0.73 0.00 0.00 175.97 175.58 2f83 s ASP 359 N -0.89 3.51 -0.44 6.12 -1.08 0.13 -4.81 116.67 119.20 2f83 s ASP 359 Ca 0.53 -0.78 -0.44 0.00 -0.52 0.00 0.00 52.55 51.35 2f83 s ASP 359 Cb 0.39 -1.52 -0.18 0.00 -1.46 0.00 0.00 42.92 40.15 2f83 s ASP 359 CO 0.17 -0.04 1.85 -3.20 0.52 0.00 0.00 175.17 174.47 2f83 n ASN 360 N 4.60 1.41 -4.79 -0.34 2.85 -1.26 -4.85 115.26 112.89 2f83 n ASN 360 Ca -0.19 0.94 -0.36 0.00 -0.11 0.00 0.00 54.58 54.85 2f83 n ASN 360 Cb 0.48 -0.98 -0.04 0.00 1.24 0.00 0.00 39.78 40.49 2f83 n ASN 360 CO 0.00 0.00 0.00 -1.83 -2.11 0.00 0.00 177.26 173.32 2f83 s GLU 361 N 4.34 4.08 0.00 1.20 -1.05 -1.26 -3.55 118.70 122.46 2f83 s GLU 361 Ca 1.09 1.48 0.00 0.00 -0.15 0.00 0.00 54.97 57.39 2f83 s GLU 361 Cb -1.35 -2.44 0.00 0.00 -0.44 0.00 0.00 34.13 29.91 2f83 s GLU 361 CO 0.71 -0.21 0.00 0.00 0.95 0.00 0.00 175.26 176.71 2f83 n THR 363 N 0.00 0.69 -1.52 0.00 -2.24 -1.23 -4.33 114.28 105.65 2f83 n THR 363 Ca 0.00 -0.47 -0.39 0.00 -2.27 0.00 0.00 64.05 60.92 2f83 n THR 363 Cb 0.00 -0.56 0.03 0.00 -2.10 0.00 0.00 70.33 67.71 2f83 n THR 363 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2f83 n THR 364 N -2.36 2.60 -0.55 4.28 -2.24 -1.26 -4.85 114.28 109.90 2f83 n THR 364 Ca -0.17 -0.50 -0.29 0.00 -2.27 0.00 0.00 64.05 60.82 2f83 n THR 364 Cb 0.80 -0.85 0.27 0.00 -2.10 0.00 0.00 70.33 68.45 2f83 n THR 364 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 2f83 n LYS 365 N -0.20 -4.12 -3.92 -0.78 -0.00 -1.26 -5.03 118.16 102.85 2f83 n LYS 365 Ca 0.12 -1.53 -0.22 0.00 -0.00 0.00 0.00 58.31 56.68 2f83 n LYS 365 Cb 0.45 -1.74 -0.17 0.00 -0.00 0.00 0.00 35.03 33.58 2f83 n LYS 365 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 2f83 s ILE 366 N -2.41 0.48 0.23 0.58 1.09 -1.26 -5.10 121.20 114.80 2f83 s ILE 366 Ca 0.67 0.01 -0.30 0.00 -1.10 0.00 0.00 60.65 59.92 2f83 s ILE 366 Cb -0.10 -0.58 -0.09 0.00 -1.06 0.00 0.00 42.46 40.64 2f83 s ILE 366 CO 0.54 0.25 0.95 -1.59 -0.10 0.00 0.00 174.94 174.99 2f83 s LYS 367 N 1.56 4.84 0.84 2.79 -2.85 -1.26 -5.02 119.74 120.65 2f83 s LYS 367 Ca -0.01 1.50 -0.16 0.00 -1.00 0.00 0.00 55.97 56.30 2f83 s LYS 367 Cb -0.13 -3.28 -0.13 0.00 -2.06 0.00 0.00 37.83 32.22 2f83 s LYS 367 CO -0.04 0.48 -0.81 -2.30 0.10 0.00 0.00 175.35 172.79 2f83 n PRO 368 N 1.57 0.00 0.00 1.78 -0.02 -1.26 -4.81 135.00 132.26 2f83 n PRO 368 Ca -0.02 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.46 2f83 n PRO 368 Cb 0.47 -0.84 0.00 0.00 -0.02 0.00 0.00 33.50 33.11 2f83 n PRO 368 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 2f83 n ARG 369 N 2.10 0.00 0.00 -0.52 1.85 -1.26 -5.13 116.66 113.70 2f83 n ARG 369 Ca -0.02 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.83 2f83 n ARG 369 Cb 0.50 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.91 2f83 n ARG 369 CO 0.00 0.00 0.00 -0.89 -0.01 0.00 0.00 177.63 176.73 2f83 n ILE 370 N 0.00 0.00 -1.47 8.89 2.08 -1.26 -4.86 119.36 122.75 2f83 n ILE 370 Ca 0.00 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.31 2f83 n ILE 370 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 38.89 2f83 n ILE 370 CO 0.00 0.00 0.00 0.55 0.56 0.00 0.00 176.55 177.66 2f83 n VAL 371 N 0.00 0.00 0.00 1.39 3.14 -1.26 -4.81 118.33 116.79 2f83 n VAL 371 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 2f83 n VAL 371 Cb 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.78 2f83 n VAL 371 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2f83 n GLY 372 N 0.00 1.63 3.21 7.55 0.00 -1.26 -4.42 105.19 111.90 2f83 n GLY 372 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 2f83 n GLY 372 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2f83 n GLY 373 N 0.00 -0.69 1.13 -0.02 0.00 -1.26 -4.54 105.19 99.81 2f83 n GLY 373 Ca 0.00 1.12 0.00 0.00 0.00 0.00 0.00 46.02 47.14 2f83 n GLY 373 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2f83 n THR 374 N -0.55 -3.48 0.00 2.61 -1.04 -1.26 -4.98 114.28 105.58 2f83 n THR 374 Ca -0.01 1.52 0.00 0.00 -2.04 0.00 0.00 64.05 63.52 2f83 n THR 374 Cb 0.58 -2.17 0.00 0.00 -1.82 0.00 0.00 70.33 66.91 2f83 n THR 374 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2f83 n ALA 375 N -1.33 0.00 -1.59 2.41 0.00 -1.26 -5.01 120.51 113.72 2f83 n ALA 375 Ca 0.00 0.00 -0.50 0.00 0.00 0.00 0.00 53.44 52.94 2f83 n ALA 375 Cb 0.10 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.50 2f83 n ALA 375 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2f83 n SER 376 N 0.00 1.67 -4.86 0.00 7.64 -1.23 -4.77 113.62 112.07 2f83 n SER 376 Ca 0.00 1.13 -0.33 0.00 1.01 0.00 0.00 58.87 60.68 2f83 n SER 376 Cb 0.00 -1.23 -0.06 0.00 -1.01 0.00 0.00 64.21 61.91 2f83 n SER 376 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2f83 s VAL 377 N 0.17 4.80 0.25 0.44 0.11 -1.26 -4.87 120.40 120.05 2f83 s VAL 377 Ca 0.78 0.75 -0.30 0.00 -2.93 0.00 0.00 61.98 60.28 2f83 s VAL 377 Cb -0.87 -3.64 -0.14 0.00 -1.53 0.00 0.00 36.38 30.19 2f83 s VAL 377 CO 0.49 -0.06 1.15 -1.14 -3.33 0.00 0.00 175.10 172.21 2f83 n ARG 378 N -0.06 1.49 -0.57 1.54 0.00 -1.26 -1.06 116.66 116.74 2f83 n ARG 378 Ca 0.01 0.53 0.00 0.00 -0.00 0.00 0.00 57.85 58.38 2f83 n ARG 378 Cb 0.53 -2.00 0.00 0.00 0.00 0.00 0.00 32.46 30.98 2f83 n ARG 378 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2f83 n GLY 379 N 1.58 0.85 0.24 5.14 0.00 -1.26 -4.84 105.19 106.91 2f83 n GLY 379 Ca 0.11 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.16 2f83 n GLY 379 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2f83 h GLU 380 N 1.51 0.21 -2.40 1.61 4.81 -1.40 -3.32 114.58 115.61 2f83 h GLU 380 Ca 0.00 -0.04 -0.59 0.00 -0.13 0.00 0.00 59.36 58.60 2f83 h GLU 380 Cb 0.00 -0.03 -0.39 0.00 0.63 0.00 0.00 28.75 28.96 2f83 h GLU 380 CO 0.00 0.32 -0.93 0.91 -0.73 0.00 0.00 179.01 178.58 2f83 n TRP 381 N -4.32 -0.21 0.32 0.92 7.02 -1.26 -4.99 117.44 114.92 2f83 n TRP 381 Ca -0.01 -3.49 0.04 0.00 -1.02 0.00 0.00 57.50 53.03 2f83 n TRP 381 Cb 0.24 0.05 0.19 0.00 -2.42 0.00 0.00 31.31 29.37 2f83 n TRP 381 CO 0.00 0.00 0.00 -0.35 -2.02 0.00 0.00 177.69 175.32 2f83 n PRO 382 N 2.48 0.02 -0.06 -0.99 -0.04 -1.25 -2.55 135.00 132.61 2f83 n PRO 382 Ca 0.27 0.33 0.12 0.00 -0.04 0.00 0.00 63.50 64.19 2f83 n PRO 382 Cb 0.47 -1.50 0.27 0.00 -0.04 0.00 0.00 33.50 32.70 2f83 n PRO 382 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 2f83 n TRP 383 N -1.47 0.16 -2.95 0.54 2.14 -1.07 -2.00 117.44 112.78 2f83 n TRP 383 Ca 0.02 -0.08 -0.38 0.00 2.07 0.00 0.00 57.50 59.14 2f83 n TRP 383 Cb 0.10 0.00 -0.06 0.00 -0.81 0.00 0.00 31.31 30.54 2f83 n TRP 383 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 2f83 s GLN 384 N -1.84 4.49 -0.01 -2.67 2.00 -1.06 -0.45 119.66 120.13 2f83 s GLN 384 Ca 0.34 1.13 -0.07 0.00 -2.00 0.00 0.00 55.36 54.76 2f83 s GLN 384 Cb 0.20 -3.03 0.00 0.00 0.80 0.00 0.00 33.01 30.99 2f83 s GLN 384 CO 0.31 0.44 0.14 0.14 -0.50 0.00 0.00 175.29 175.82 2f83 s VAL 385 N -1.38 0.07 -0.22 1.34 -7.23 -0.93 -3.58 120.40 108.46 2f83 s VAL 385 Ca 0.42 -0.58 -0.09 0.00 -1.81 0.00 0.00 61.98 59.92 2f83 s VAL 385 Cb -0.20 -0.40 -0.04 0.00 0.56 0.00 0.00 36.38 36.29 2f83 s VAL 385 CO 0.24 -0.32 0.11 0.28 -0.31 0.00 0.00 175.10 175.10 2f83 s THR 386 N -1.15 4.93 -0.18 5.32 -1.32 0.28 -1.87 115.64 121.65 2f83 s THR 386 Ca -0.12 0.03 -0.20 0.00 -1.21 0.00 0.00 61.69 60.18 2f83 s THR 386 Cb -0.07 -3.28 -0.03 0.00 -1.51 0.00 0.00 72.50 67.62 2f83 s THR 386 CO 0.01 0.38 0.60 -0.22 -2.21 0.00 0.00 174.62 173.18 2f83 s LEU 387 N 0.99 4.18 0.02 9.08 1.98 0.57 -1.89 118.68 133.61 2f83 s LEU 387 Ca 0.06 0.83 0.08 0.00 -2.89 0.00 0.00 54.13 52.21 2f83 s LEU 387 Cb -0.14 -2.85 -0.03 0.00 0.66 0.00 0.00 46.19 43.84 2f83 s LEU 387 CO 0.03 -0.21 -0.23 -1.00 -1.89 0.00 0.00 176.35 173.05 2f83 s HIS 388 N 1.60 2.41 -0.07 5.38 3.76 -0.44 0.10 115.29 128.03 2f83 s HIS 388 Ca 0.28 -0.36 0.03 0.00 -0.15 0.00 0.00 55.06 54.86 2f83 s HIS 388 Cb -0.16 -1.46 -0.02 0.00 1.11 0.00 0.00 32.58 32.05 2f83 s HIS 388 CO 0.11 0.11 -0.17 -0.08 -0.85 0.00 0.00 174.74 173.86 2f83 s THR 389 N -0.76 2.79 -0.70 1.30 -1.32 -0.75 -1.21 115.64 114.98 2f83 s THR 389 Ca 0.12 -0.80 0.26 0.00 -1.21 0.00 0.00 61.69 60.05 2f83 s THR 389 Cb -0.10 -2.09 0.29 0.00 -1.51 0.00 0.00 72.50 69.09 2f83 s THR 389 CO 0.02 0.57 1.76 0.71 -2.21 0.00 0.00 174.62 175.47 2f83 h THR 390 N 4.78 0.00 -3.12 5.08 1.35 -1.38 -2.18 112.91 117.43 2f83 h THR 390 Ca -0.38 -0.52 -0.61 0.00 -0.55 0.00 0.00 66.41 64.35 2f83 h THR 390 Cb 1.17 1.52 -0.10 0.00 -1.73 0.00 0.00 68.15 69.01 2f83 h THR 390 CO 0.51 0.00 -0.42 -0.55 -0.25 0.00 0.00 175.52 174.81 2f83 s SER 391 N -4.69 6.36 0.08 5.36 0.15 -1.26 -2.60 113.70 117.10 2f83 s SER 391 Ca 0.10 0.41 0.03 0.00 0.70 0.00 0.00 55.95 57.19 2f83 s SER 391 Cb 0.12 -2.12 -0.24 0.00 -1.71 0.00 0.00 66.02 62.06 2f83 s SER 391 CO 0.60 0.22 1.16 1.55 1.20 0.00 0.00 173.24 177.96 2f83 h PRO 392 N 6.17 0.11 -5.84 5.44 0.13 -2.00 -3.46 132.00 132.54 2f83 h PRO 392 Ca -0.45 -0.20 -0.53 0.00 -0.87 0.00 0.00 66.00 63.96 2f83 h PRO 392 Cb 1.18 0.07 -0.14 0.00 0.13 0.00 0.00 31.00 32.24 2f83 h PRO 392 CO 0.71 1.05 -0.74 0.95 -0.23 0.00 0.00 178.00 179.75 2f83 s THR 393 N -2.68 2.06 -0.11 1.56 -4.23 -1.07 -5.08 115.64 106.09 2f83 s THR 393 Ca -0.02 -2.28 -0.29 0.00 -1.18 0.00 0.00 61.69 57.91 2f83 s THR 393 Cb 0.09 -2.22 -0.03 0.00 1.34 0.00 0.00 72.50 71.67 2f83 s THR 393 CO 0.85 -0.46 1.41 -1.58 -0.54 0.00 0.00 174.62 174.29 2f83 s GLN 394 N -3.60 4.22 0.15 3.99 0.74 -1.19 -4.49 119.66 119.48 2f83 s GLN 394 Ca 0.27 1.87 -0.15 0.00 0.05 0.00 0.00 55.36 57.41 2f83 s GLN 394 Cb -0.02 -3.83 0.02 0.00 1.10 0.00 0.00 33.01 30.29 2f83 s GLN 394 CO 0.11 -0.74 0.39 -0.98 -0.55 0.00 0.00 175.29 173.52 2f83 s ARG 395 N 3.60 1.14 0.18 1.67 1.70 -0.82 -4.99 118.95 121.43 2f83 s ARG 395 Ca 0.62 -0.84 -0.32 0.00 -0.47 0.00 0.00 55.73 54.73 2f83 s ARG 395 Cb -0.27 0.46 -0.11 0.00 -0.57 0.00 0.00 34.95 34.46 2f83 s ARG 395 CO 0.21 -0.45 1.64 -1.58 -1.08 0.00 0.00 175.30 174.05 2f83 s HIS 396 N -3.85 2.97 -0.05 5.89 5.65 -1.26 -1.82 115.29 122.82 2f83 s HIS 396 Ca 0.07 0.48 0.04 0.00 0.25 0.00 0.00 55.06 55.90 2f83 s HIS 396 Cb 0.02 -4.03 -0.06 0.00 -1.18 0.00 0.00 32.58 27.32 2f83 s HIS 396 CO -0.08 -3.86 0.02 -0.11 -0.65 0.00 0.00 174.74 170.05 2f83 n LEU 397 N 4.02 0.06 -3.79 8.88 7.94 0.28 -4.86 117.00 129.54 2f83 n LEU 397 Ca 0.15 -0.00 -0.02 0.00 -1.11 0.00 0.00 56.01 55.03 2f83 n LEU 397 Cb 0.37 0.12 0.00 0.00 0.53 0.00 0.00 43.42 44.44 2f83 n LEU 397 CO 0.63 0.14 0.82 0.00 -1.11 0.00 0.00 177.39 177.87 2f83 s GLY 399 N -3.15 1.67 0.30 0.00 0.00 0.74 0.21 107.32 107.09 2f83 s GLY 399 Ca 0.17 -1.64 -0.12 0.00 0.00 0.00 0.00 44.72 43.13 2f83 s GLY 399 CO 0.02 -1.70 0.56 -0.32 0.00 0.00 0.00 173.10 171.66 2f83 s GLY 400 N -3.59 0.66 -0.05 0.20 0.00 -0.78 -3.21 107.32 100.55 2f83 s GLY 400 Ca 0.31 -0.94 0.05 0.00 0.00 0.00 0.00 44.72 44.13 2f83 s GLY 400 CO 0.19 -0.60 -0.19 -0.56 0.00 0.00 0.00 173.10 171.94 2f83 s SER 401 N -3.07 2.42 -0.31 1.64 0.01 -0.71 -2.18 113.70 111.50 2f83 s SER 401 Ca 0.22 -0.40 -0.29 0.00 1.31 0.00 0.00 55.95 56.79 2f83 s SER 401 Cb -0.02 -0.72 0.01 0.00 0.21 0.00 0.00 66.02 65.51 2f83 s SER 401 CO 0.12 0.17 1.09 -0.63 0.41 0.00 0.00 173.24 174.40 2f83 s ILE 402 N 0.04 4.49 -0.48 1.44 1.01 0.41 0.25 121.20 128.35 2f83 s ILE 402 Ca -0.05 1.73 0.04 0.00 0.00 0.00 0.00 60.65 62.37 2f83 s ILE 402 Cb -0.13 -4.38 0.02 0.00 0.01 0.00 0.00 42.46 37.99 2f83 s ILE 402 CO 0.03 -0.44 0.56 2.30 0.00 0.00 0.00 174.94 177.39 2f83 n ILE 403 N 5.83 0.00 -3.83 2.92 -5.35 -0.76 -1.07 119.36 117.09 2f83 n ILE 403 Ca 0.12 -0.49 -0.07 0.00 -0.27 0.00 0.00 62.75 62.05 2f83 n ILE 403 Cb 0.47 1.08 -0.01 0.00 -1.74 0.00 0.00 39.64 39.44 2f83 n ILE 403 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2f83 s GLY 404 N -0.51 -0.00 0.35 3.28 0.00 -1.15 -4.85 107.32 104.44 2f83 s GLY 404 Ca 0.04 -0.34 0.05 0.00 0.00 0.00 0.00 44.72 44.47 2f83 s GLY 404 CO 0.07 -0.02 1.92 3.43 0.00 0.00 0.00 173.10 178.49 2f83 h ASN 405 N 2.00 0.50 -0.07 1.64 2.35 -1.97 -3.00 115.58 117.03 2f83 h ASN 405 Ca -0.23 -0.07 0.00 0.00 -0.55 0.00 0.00 56.30 55.45 2f83 h ASN 405 Cb 1.25 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 39.49 2f83 h ASN 405 CO 0.28 0.52 0.00 0.00 -1.65 0.00 0.00 177.43 176.57 2f83 n GLN 406 N -4.32 2.15 -4.36 0.81 6.02 -1.26 -0.41 117.38 116.00 2f83 n GLN 406 Ca 0.02 -2.27 -0.19 0.00 -0.01 0.00 0.00 57.00 54.56 2f83 n GLN 406 Cb 0.20 -1.39 -0.15 0.00 1.02 0.00 0.00 30.24 29.92 2f83 n GLN 406 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 2f83 s TRP 407 N -2.18 0.81 -0.13 1.08 0.52 -1.13 -0.93 118.94 116.98 2f83 s TRP 407 Ca 0.24 -0.16 0.01 0.00 0.02 0.00 0.00 56.10 56.21 2f83 s TRP 407 Cb 0.20 -0.53 0.02 0.00 -1.15 0.00 0.00 33.47 32.01 2f83 s TRP 407 CO 0.04 -0.02 -0.15 0.42 0.02 0.00 0.00 176.95 177.26 2f83 s ILE 408 N -0.17 1.52 -0.19 2.03 -1.09 -1.12 -1.83 121.20 120.35 2f83 s ILE 408 Ca 0.03 -0.63 -0.18 0.00 -2.23 0.00 0.00 60.65 57.64 2f83 s ILE 408 Cb -0.04 -1.41 -0.04 0.00 -1.58 0.00 0.00 42.46 39.39 2f83 s ILE 408 CO -0.00 0.45 0.47 -0.22 -1.23 0.00 0.00 174.94 174.41 2f83 s LEU 409 N 1.24 4.16 0.00 2.97 2.96 0.14 -2.25 118.68 127.90 2f83 s LEU 409 Ca -0.01 0.63 0.00 0.00 -0.22 0.00 0.00 54.13 54.53 2f83 s LEU 409 Cb -0.14 -2.64 0.00 0.00 0.50 0.00 0.00 46.19 43.91 2f83 s LEU 409 CO -0.06 -0.13 0.00 1.07 -1.32 0.00 0.00 176.35 175.91 2f83 n THR 410 N 4.41 0.00 -3.72 3.68 5.66 0.04 -1.74 114.28 122.60 2f83 n THR 410 Ca -0.06 0.00 -0.36 0.00 -3.05 0.00 0.00 64.05 60.58 2f83 n THR 410 Cb 0.51 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 69.22 2f83 n THR 410 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2f83 s ALA 411 N -1.79 3.72 0.25 1.79 0.00 -1.26 0.25 121.76 124.71 2f83 s ALA 411 Ca 0.00 -0.60 -0.03 0.00 0.00 0.00 0.00 51.96 51.32 2f83 s ALA 411 Cb 0.00 -2.17 0.41 0.00 0.00 0.00 0.00 23.12 21.36 2f83 s ALA 411 CO 0.00 0.29 1.83 0.00 0.00 0.00 0.00 175.76 177.87 2f83 h ALA 412 N 6.12 1.25 0.00 0.00 0.00 -1.72 -1.70 119.26 123.20 2f83 h ALA 412 Ca -0.45 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2f83 h ALA 412 Cb 1.18 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.79 2f83 h ALA 412 CO 0.70 0.17 0.00 -2.39 0.00 0.00 0.00 179.25 177.74 2f83 n HIS 413 N -4.68 0.31 0.32 0.00 1.44 -1.26 -2.19 115.22 109.16 2f83 n HIS 413 Ca 0.14 0.16 0.14 0.00 -2.01 0.00 0.00 57.72 56.15 2f83 n HIS 413 Cb 0.27 -0.75 0.60 0.00 0.12 0.00 0.00 29.99 30.22 2f83 n HIS 413 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2f83 n PHE 415 N -2.47 1.17 -1.83 0.00 3.01 -0.93 -4.90 117.46 111.50 2f83 n PHE 415 Ca 0.01 -1.25 -0.42 0.00 1.01 0.00 0.00 57.45 56.80 2f83 n PHE 415 Cb 0.20 -0.44 -0.03 0.00 -0.01 0.00 0.00 39.48 39.20 2f83 n PHE 415 CO 0.00 0.00 0.00 -0.47 1.01 0.00 0.00 176.76 177.30 2f83 s TYR 416 N -3.04 2.17 0.00 1.38 5.04 -1.19 -2.45 117.35 119.27 2f83 s TYR 416 Ca 0.44 0.11 0.00 0.00 -2.44 0.00 0.00 57.07 55.18 2f83 s TYR 416 Cb 0.38 -4.06 0.00 0.00 0.35 0.00 0.00 41.96 38.63 2f83 s TYR 416 CO 0.05 -4.39 0.00 0.41 -1.34 0.00 0.00 175.55 170.29 2f83 n GLY 417 N 4.14 2.55 2.47 8.97 0.00 -1.26 -4.98 105.19 117.08 2f83 n GLY 417 Ca 0.17 -0.56 -0.45 0.00 0.00 0.00 0.00 46.02 45.18 2f83 n GLY 417 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2f83 n VAL 418 N 0.00 0.00 0.04 1.61 0.31 -1.03 -4.78 118.33 114.48 2f83 n VAL 418 Ca 0.00 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.20 2f83 n VAL 418 Cb 0.00 -0.35 -0.14 0.00 -0.91 0.00 0.00 33.84 32.44 2f83 n VAL 418 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 2f83 h GLU 419 N 5.06 0.14 -3.74 5.55 5.08 -1.94 -3.47 114.58 121.26 2f83 h GLU 419 Ca -0.18 -0.25 -0.17 0.00 -1.00 0.00 0.00 59.36 57.76 2f83 h GLU 419 Cb 0.99 0.09 -0.22 0.00 0.50 0.00 0.00 28.75 30.11 2f83 h GLU 419 CO 0.74 0.94 -0.62 0.45 -1.00 0.00 0.00 179.01 179.52 2f83 s SER 420 N -6.71 0.10 0.02 1.42 0.15 -1.26 -5.00 113.70 102.43 2f83 s SER 420 Ca -0.07 -0.27 0.15 0.00 0.70 0.00 0.00 55.95 56.46 2f83 s SER 420 Cb 0.08 0.14 0.65 0.00 -1.71 0.00 0.00 66.02 65.18 2f83 s SER 420 CO 0.83 -0.27 1.48 -0.81 1.20 0.00 0.00 173.24 175.68 2f83 n PRO 421 N 1.85 0.02 0.00 5.44 -0.04 -1.26 -2.39 135.00 138.61 2f83 n PRO 421 Ca -0.21 0.27 0.09 0.00 -0.04 0.00 0.00 63.50 63.60 2f83 n PRO 421 Cb 0.56 -1.53 0.52 0.00 -0.04 0.00 0.00 33.50 33.01 2f83 n PRO 421 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2f83 n LYS 422 N -1.57 0.60 -0.12 0.54 4.76 -1.26 -1.43 118.16 119.68 2f83 n LYS 422 Ca 0.03 0.00 0.08 0.00 -2.87 0.00 0.00 58.31 55.56 2f83 n LYS 422 Cb 0.17 -1.46 0.14 0.00 -1.84 0.00 0.00 35.03 32.04 2f83 n LYS 422 CO 0.00 0.00 0.00 0.44 -1.37 0.00 0.00 177.40 176.47 2f83 n ILE 423 N -0.96 0.44 -3.68 -0.18 -5.35 -1.01 -4.96 119.36 103.66 2f83 n ILE 423 Ca 0.13 -0.72 -0.37 0.00 -0.27 0.00 0.00 62.75 61.52 2f83 n ILE 423 Cb 0.06 0.97 -0.06 0.00 -1.74 0.00 0.00 39.64 38.87 2f83 n ILE 423 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 2f83 s LEU 424 N -1.21 4.41 -0.14 7.28 1.43 -0.51 -1.20 118.68 128.73 2f83 s LEU 424 Ca 0.26 0.68 -0.01 0.00 -1.03 0.00 0.00 54.13 54.03 2f83 s LEU 424 Cb 0.16 -2.32 0.04 0.00 0.03 0.00 0.00 46.19 44.09 2f83 s LEU 424 CO 0.22 0.34 -0.03 -0.13 0.23 0.00 0.00 176.35 176.98 2f83 s ARG 425 N -0.86 1.12 -0.45 1.70 1.81 -0.35 -3.98 118.95 117.94 2f83 s ARG 425 Ca 0.19 -0.31 -0.16 0.00 -1.72 0.00 0.00 55.73 53.73 2f83 s ARG 425 Cb -0.14 -1.72 0.05 0.00 -0.45 0.00 0.00 34.95 32.69 2f83 s ARG 425 CO 0.08 -0.41 0.37 0.08 -0.68 0.00 0.00 175.30 174.74 2f83 s VAL 426 N 1.76 5.22 -0.24 3.52 1.01 0.21 -1.32 120.40 130.56 2f83 s VAL 426 Ca 0.02 -0.84 -0.13 0.00 0.00 0.00 0.00 61.98 61.03 2f83 s VAL 426 Cb -0.14 -4.05 -0.04 0.00 0.00 0.00 0.00 36.38 32.14 2f83 s VAL 426 CO -0.07 -0.48 0.28 -0.31 0.00 0.00 0.00 175.10 174.52 2f83 s TYR 427 N 1.73 3.30 0.10 5.22 1.51 -0.79 -0.49 117.35 127.94 2f83 s TYR 427 Ca 0.05 0.36 0.05 0.00 -1.01 0.00 0.00 57.07 56.53 2f83 s TYR 427 Cb -0.22 -2.42 -0.04 0.00 -0.11 0.00 0.00 41.96 39.17 2f83 s TYR 427 CO 0.09 -0.05 0.01 -1.54 -1.11 0.00 0.00 175.55 172.95 2f83 s SER 428 N 1.27 5.08 -1.22 2.29 1.04 -1.26 -0.56 113.70 120.34 2f83 s SER 428 Ca 0.12 -0.17 -0.06 0.00 0.48 0.00 0.00 55.95 56.32 2f83 s SER 428 Cb -0.15 -1.22 -0.01 0.00 0.10 0.00 0.00 66.02 64.74 2f83 s SER 428 CO 0.07 0.16 0.76 0.61 0.98 0.00 0.00 173.24 175.83 2f83 n GLY 429 N 0.46 -0.60 3.10 7.32 0.00 -1.24 -4.98 105.19 109.26 2f83 n GLY 429 Ca -0.10 0.28 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 2f83 n GLY 429 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2f83 s ILE 430 N -3.57 2.00 -0.17 -0.61 -1.09 -1.26 -5.00 121.20 111.50 2f83 s ILE 430 Ca 0.19 -0.92 -0.26 0.00 -2.23 0.00 0.00 60.65 57.43 2f83 s ILE 430 Cb -0.05 -1.82 -0.23 0.00 -1.58 0.00 0.00 42.46 38.77 2f83 s ILE 430 CO 0.81 0.51 0.55 0.25 -1.23 0.00 0.00 174.94 175.83 2f83 h LEU 431 N 7.95 0.00 -8.50 2.97 5.85 -1.93 -3.46 115.31 118.19 2f83 h LEU 431 Ca -0.44 -0.80 -0.66 0.00 0.84 0.00 0.00 57.88 56.82 2f83 h LEU 431 Cb 1.14 0.00 -0.27 0.00 0.37 0.00 0.00 40.66 41.89 2f83 h LEU 431 CO 0.62 1.19 -0.74 0.20 -0.34 0.00 0.00 178.44 179.36 2f83 s ASN 432 N -6.46 4.16 0.29 1.25 0.01 -1.25 -0.76 114.94 112.17 2f83 s ASN 432 Ca -0.23 -0.36 0.03 0.00 -0.71 0.00 0.00 52.86 51.59 2f83 s ASN 432 Cb 0.00 -1.68 0.70 0.00 0.41 0.00 0.00 41.25 40.69 2f83 s ASN 432 CO 0.65 0.07 1.68 1.56 -1.51 0.00 0.00 177.10 179.54 2f83 h GLN 433 N 7.45 0.31 0.00 -0.60 1.08 0.08 0.72 115.11 124.16 2f83 h GLN 433 Ca -0.35 -0.02 0.00 0.00 -1.45 0.00 0.00 58.65 56.83 2f83 h GLN 433 Cb 1.18 -0.07 0.00 0.00 -0.05 0.00 0.00 27.48 28.54 2f83 h GLN 433 CO 0.59 0.21 0.00 -1.13 -0.95 0.00 0.00 178.83 177.55 2f83 n SER 434 N -5.11 0.00 0.09 1.46 3.41 -1.26 -0.38 113.62 111.82 2f83 n SER 434 Ca 0.21 0.10 -0.07 0.00 -0.26 0.00 0.00 58.87 58.85 2f83 n SER 434 Cb 0.65 -0.17 0.05 0.00 -0.26 0.00 0.00 64.21 64.48 2f83 n SER 434 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2f83 h GLU 435 N 0.00 0.21 -6.24 4.33 5.08 0.11 -3.43 114.58 114.64 2f83 h GLU 435 Ca 0.00 -0.19 -0.56 0.00 -1.00 0.00 0.00 59.36 57.61 2f83 h GLU 435 Cb 0.02 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 2f83 h GLU 435 CO 0.00 0.87 1.21 0.42 -1.00 0.00 0.00 179.01 180.51 2f83 s ILE 436 N -3.45 3.44 0.00 3.13 1.01 0.49 -4.93 121.20 120.88 2f83 s ILE 436 Ca -0.03 0.50 0.00 0.00 0.00 0.00 0.00 60.65 61.12 2f83 s ILE 436 Cb 0.11 -3.44 0.00 0.00 0.01 0.00 0.00 42.46 39.14 2f83 s ILE 436 CO 0.81 -0.17 0.00 0.29 0.00 0.00 0.00 174.94 175.87 2f83 n LYS 437 N 7.80 2.02 0.03 2.79 5.02 -1.26 -5.01 118.16 129.55 2f83 n LYS 437 Ca 0.21 0.00 -0.14 0.00 -2.02 0.00 0.00 58.31 56.36 2f83 n LYS 437 Cb 0.44 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.42 2f83 n LYS 437 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 2f83 h GLU 438 N 0.00 0.57 0.00 1.97 4.81 -2.01 -3.15 114.58 116.77 2f83 h GLU 438 Ca 0.00 -0.50 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 2f83 h GLU 438 Cb 0.00 0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.50 2f83 h GLU 438 CO 0.00 1.13 -0.19 -3.47 -0.73 0.00 0.00 179.01 175.75 2f83 n ASP 439 N -3.85 0.68 -4.67 1.04 2.03 -1.26 -4.88 116.55 105.63 2f83 n ASP 439 Ca -0.06 0.41 -0.47 0.00 0.52 0.00 0.00 54.79 55.18 2f83 n ASP 439 Cb 0.76 -0.46 -0.05 0.00 -0.72 0.00 0.00 41.12 40.66 2f83 n ASP 439 CO 0.00 0.00 0.00 0.41 -1.92 0.00 0.00 177.20 175.69 2f83 n THR 440 N -2.10 0.32 -2.67 5.18 -1.04 -1.19 -4.95 114.28 107.82 2f83 n THR 440 Ca 0.05 -0.06 -0.38 0.00 -2.04 0.00 0.00 64.05 61.62 2f83 n THR 440 Cb 0.42 -1.71 -0.05 0.00 -1.82 0.00 0.00 70.33 67.17 2f83 n THR 440 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 2f83 s SER 441 N 2.63 7.26 0.00 8.00 0.15 -1.26 -4.88 113.70 125.60 2f83 s SER 441 Ca 0.87 1.98 0.00 0.00 0.70 0.00 0.00 55.95 59.49 2f83 s SER 441 Cb -0.69 -2.59 0.00 0.00 -1.71 0.00 0.00 66.02 61.02 2f83 s SER 441 CO 0.46 -0.13 0.00 2.22 1.20 0.00 0.00 173.24 176.99 2f83 n PHE 442 N 0.71 0.00 -4.13 3.44 1.16 -1.26 -4.87 117.46 112.51 2f83 n PHE 442 Ca 0.01 0.00 -0.33 0.00 -1.87 0.00 0.00 57.45 55.27 2f83 n PHE 442 Cb 0.48 0.00 -0.16 0.00 -1.61 0.00 0.00 39.48 38.19 2f83 n PHE 442 CO 0.00 0.00 0.00 -0.06 -1.87 0.00 0.00 176.76 174.83 2f83 s PHE 443 N -1.91 2.72 0.30 2.97 0.08 0.36 -4.91 117.98 117.58 2f83 s PHE 443 Ca 0.00 -1.60 -0.17 0.00 0.12 0.00 0.00 56.93 55.28 2f83 s PHE 443 Cb 0.00 -1.89 -0.09 0.00 -0.57 0.00 0.00 43.02 40.48 2f83 s PHE 443 CO 0.00 -0.79 0.76 0.20 -0.10 0.00 0.00 175.22 175.29 2f83 s GLY 444 N 1.29 2.45 -0.09 4.36 0.00 -1.26 0.64 107.32 114.71 2f83 s GLY 444 Ca 0.05 0.13 -0.23 0.00 0.00 0.00 0.00 44.72 44.67 2f83 s GLY 444 CO -0.12 0.40 0.68 0.14 0.00 0.00 0.00 173.10 174.20 2f83 s VAL 445 N -1.83 5.05 -0.12 1.40 1.01 -1.26 -0.27 120.40 124.38 2f83 s VAL 445 Ca 0.51 1.38 -0.22 0.00 0.00 0.00 0.00 61.98 63.65 2f83 s VAL 445 Cb -0.13 -4.01 -0.26 0.00 0.00 0.00 0.00 36.38 31.98 2f83 s VAL 445 CO 0.18 0.23 0.62 -0.61 0.00 0.00 0.00 175.10 175.53 2f83 h GLN 446 N 6.86 0.13 -3.92 2.72 4.15 -0.66 -3.41 115.11 120.98 2f83 h GLN 446 Ca -0.39 -0.22 -0.15 0.00 0.77 0.00 0.00 58.65 58.66 2f83 h GLN 446 Cb 1.19 0.08 -0.19 0.00 0.21 0.00 0.00 27.48 28.76 2f83 h GLN 446 CO 0.76 1.11 -0.64 -2.00 -1.93 0.00 0.00 178.83 176.13 2f83 s GLU 447 N -2.36 0.43 -0.09 1.69 2.12 -1.06 -4.92 118.70 114.50 2f83 s GLU 447 Ca -0.20 -0.69 0.03 0.00 0.36 0.00 0.00 54.97 54.46 2f83 s GLU 447 Cb 0.02 0.16 -0.01 0.00 0.26 0.00 0.00 34.13 34.55 2f83 s GLU 447 CO 0.72 -0.08 -0.18 0.42 -0.54 0.00 0.00 175.26 175.60 2f83 s ILE 448 N -2.00 2.69 -0.32 -3.70 1.01 -1.26 -1.77 121.20 115.84 2f83 s ILE 448 Ca -0.11 -0.81 0.02 0.00 0.00 0.00 0.00 60.65 59.75 2f83 s ILE 448 Cb -0.06 -2.07 0.09 0.00 0.01 0.00 0.00 42.46 40.44 2f83 s ILE 448 CO -0.03 0.55 0.05 -0.63 0.00 0.00 0.00 174.94 174.88 2f83 s ILE 449 N 0.03 1.76 -0.08 2.92 1.01 -0.34 -4.98 121.20 121.52 2f83 s ILE 449 Ca -0.06 -1.90 -0.10 0.00 0.00 0.00 0.00 60.65 58.58 2f83 s ILE 449 Cb -0.15 -2.26 -0.05 0.00 0.01 0.00 0.00 42.46 40.02 2f83 s ILE 449 CO 0.05 -0.55 0.24 -0.63 0.00 0.00 0.00 174.94 174.05 2f83 s ILE 450 N 1.18 5.32 0.11 2.92 1.01 -1.26 -0.30 121.20 130.19 2f83 s ILE 450 Ca 0.08 0.45 -0.33 0.00 0.00 0.00 0.00 60.65 60.85 2f83 s ILE 450 Cb -0.18 -3.53 -0.13 0.00 0.01 0.00 0.00 42.46 38.63 2f83 s ILE 450 CO -0.13 0.58 1.70 1.57 0.00 0.00 0.00 174.94 178.66 2f83 n HIS 451 N 2.08 2.39 -0.49 3.97 -0.00 -1.18 -4.86 115.22 117.13 2f83 n HIS 451 Ca -0.17 0.12 0.40 0.00 -0.00 0.00 0.00 57.72 58.07 2f83 n HIS 451 Cb 0.54 -2.61 0.69 0.00 -0.00 0.00 0.00 29.99 28.61 2f83 n HIS 451 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 176.34 175.90 2f83 h ASP 452 N 7.10 0.18 -0.67 0.26 3.32 -1.95 0.11 116.42 124.77 2f83 h ASP 452 Ca -0.46 0.10 0.00 0.00 0.02 0.00 0.00 57.03 56.70 2f83 h ASP 452 Cb 1.25 0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.89 2f83 h ASP 452 CO 0.92 -0.14 0.00 0.00 -1.72 0.00 0.00 179.24 178.30 2f83 n GLN 453 N -4.51 2.69 -2.44 3.56 6.02 -1.26 -4.98 117.38 116.46 2f83 n GLN 453 Ca 0.38 -2.59 -0.38 0.00 -0.01 0.00 0.00 57.00 54.40 2f83 n GLN 453 Cb 1.54 -1.56 -0.03 0.00 1.02 0.00 0.00 30.24 31.22 2f83 n GLN 453 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.06 175.58 2f83 s TYR 454 N -1.09 3.23 0.00 1.08 5.04 0.36 -4.90 117.35 121.06 2f83 s TYR 454 Ca 0.47 1.62 0.00 0.00 -2.44 0.00 0.00 57.07 56.72 2f83 s TYR 454 Cb 0.25 -3.24 0.00 0.00 0.35 0.00 0.00 41.96 39.31 2f83 s TYR 454 CO 0.33 -0.88 0.00 1.63 -1.34 0.00 0.00 175.55 175.29 2f83 n LYS 455 N 0.12 0.00 -3.58 4.97 4.01 -1.26 -5.02 118.16 117.40 2f83 n LYS 455 Ca 0.04 0.00 -0.16 0.00 -0.51 0.00 0.00 58.31 57.68 2f83 n LYS 455 Cb 0.48 -0.29 -0.07 0.00 -0.51 0.00 0.00 35.03 34.64 2f83 n LYS 455 CO 0.00 0.00 0.00 1.41 -1.11 0.00 0.00 177.40 177.70 2f83 s MET 456 N -1.38 0.93 0.14 1.97 1.75 -1.26 -5.01 119.30 116.45 2f83 s MET 456 Ca 0.00 0.68 -0.11 0.00 -1.25 0.00 0.00 55.69 55.01 2f83 s MET 456 Cb 0.00 0.45 0.15 0.00 2.84 0.00 0.00 34.83 38.27 2f83 s MET 456 CO 0.00 -0.20 0.96 0.00 -0.65 0.00 0.00 175.02 175.13 2f83 n ALA 457 N 1.92 -0.07 0.04 4.11 0.00 -1.26 0.26 120.51 125.51 2f83 n ALA 457 Ca -0.16 0.62 -0.17 0.00 0.00 0.00 0.00 53.44 53.73 2f83 n ALA 457 Cb 0.56 -0.28 -0.07 0.00 0.00 0.00 0.00 19.45 19.66 2f83 n ALA 457 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2f83 h GLU 458 N 0.00 0.60 0.00 0.00 3.07 -1.96 -3.07 114.58 113.21 2f83 h GLU 458 Ca 0.22 -0.60 0.00 0.00 -0.50 0.00 0.00 59.36 58.48 2f83 h GLU 458 Cb 0.37 0.16 0.00 0.00 -0.84 0.00 0.00 28.75 28.45 2f83 h GLU 458 CO -0.62 1.22 0.18 0.43 -1.40 0.00 0.00 179.01 178.81 2f83 n SER 459 N -3.83 0.19 0.00 1.42 7.64 0.14 -4.91 113.62 114.27 2f83 n SER 459 Ca -0.08 0.48 0.00 0.00 1.01 0.00 0.00 58.87 60.27 2f83 n SER 459 Cb 0.83 -0.47 0.00 0.00 -1.01 0.00 0.00 64.21 63.56 2f83 n SER 459 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2f83 n GLY 460 N -1.32 -0.56 2.40 0.23 0.00 -0.99 -4.89 105.19 100.06 2f83 n GLY 460 Ca -0.00 -1.78 -0.02 0.00 0.00 0.00 0.00 46.02 44.21 2f83 n GLY 460 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2f83 n TYR 461 N -0.58 0.00 -2.20 1.61 4.02 -1.26 -4.34 117.16 114.40 2f83 n TYR 461 Ca 0.00 0.00 -0.32 0.00 -0.01 0.00 0.00 57.90 57.57 2f83 n TYR 461 Cb 0.00 -1.08 -0.05 0.00 -0.02 0.00 0.00 39.34 38.19 2f83 n TYR 461 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 2f83 s ASP 462 N -2.21 5.50 -0.15 7.72 2.15 -1.26 -4.60 116.67 123.82 2f83 s ASP 462 Ca 0.00 -1.83 -0.10 0.00 0.43 0.00 0.00 52.55 51.05 2f83 s ASP 462 Cb 0.00 -2.59 0.05 0.00 -0.30 0.00 0.00 42.92 40.08 2f83 s ASP 462 CO 0.00 -2.58 0.38 -0.51 -0.17 0.00 0.00 175.17 172.29 2f83 s ILE 463 N 9.24 -0.02 0.04 4.11 2.07 -1.26 -3.82 121.20 131.56 2f83 s ILE 463 Ca 0.65 0.07 0.00 0.00 -1.41 0.00 0.00 60.65 59.95 2f83 s ILE 463 Cb 0.00 -0.55 -0.03 0.00 0.13 0.00 0.00 42.46 42.01 2f83 s ILE 463 CO 0.11 0.03 -0.04 0.00 -1.91 0.00 0.00 174.94 173.13 2f83 s ALA 464 N 0.96 0.44 0.28 1.50 0.00 0.14 -3.10 121.76 121.97 2f83 s ALA 464 Ca -0.06 -0.95 0.10 0.00 0.00 0.00 0.00 51.96 51.04 2f83 s ALA 464 Cb -0.07 0.18 -0.04 0.00 0.00 0.00 0.00 23.12 23.19 2f83 s ALA 464 CO -0.08 -0.23 -0.00 -0.51 0.00 0.00 0.00 175.76 174.94 2f83 s LEU 465 N -2.24 3.16 -0.17 0.00 1.43 0.59 -0.78 118.68 120.68 2f83 s LEU 465 Ca -0.03 -0.69 -0.04 0.00 -1.03 0.00 0.00 54.13 52.35 2f83 s LEU 465 Cb -0.01 -1.67 0.06 0.00 0.03 0.00 0.00 46.19 44.59 2f83 s LEU 465 CO -0.05 -0.03 0.06 -0.76 0.23 0.00 0.00 176.35 175.80 2f83 s LEU 466 N -3.68 0.71 -0.05 1.79 1.43 -0.95 -1.20 118.68 116.73 2f83 s LEU 466 Ca 0.32 -0.63 -0.28 0.00 -1.03 0.00 0.00 54.13 52.51 2f83 s LEU 466 Cb -0.06 -0.40 -0.03 0.00 0.03 0.00 0.00 46.19 45.73 2f83 s LEU 466 CO 0.20 -0.32 0.90 -0.75 0.23 0.00 0.00 176.35 176.61 2f83 s LYS 467 N 2.01 4.48 0.34 1.70 2.20 -0.73 -2.79 119.74 126.95 2f83 s LYS 467 Ca 0.01 1.23 -0.10 0.00 -0.36 0.00 0.00 55.97 56.75 2f83 s LYS 467 Cb -0.16 -3.48 -0.07 0.00 -1.51 0.00 0.00 37.83 32.61 2f83 s LYS 467 CO -0.08 -0.09 0.69 -0.51 -0.36 0.00 0.00 175.35 175.01 2f83 s LEU 468 N 1.22 3.97 0.20 5.43 1.43 -0.11 0.00 118.68 130.82 2f83 s LEU 468 Ca 0.46 1.07 -0.10 0.00 -1.03 0.00 0.00 54.13 54.53 2f83 s LEU 468 Cb -0.19 -3.90 0.12 0.00 0.03 0.00 0.00 46.19 42.25 2f83 s LEU 468 CO 0.22 -0.28 1.76 -0.33 0.23 0.00 0.00 176.35 177.95 2f83 h GLU 469 N 1.73 1.06 -4.74 1.70 4.39 -0.94 -3.41 114.58 114.37 2f83 h GLU 469 Ca -0.47 -0.19 -0.28 0.00 0.34 0.00 0.00 59.36 58.75 2f83 h GLU 469 Cb 1.18 -0.17 -0.15 0.00 -0.10 0.00 0.00 28.75 29.51 2f83 h GLU 469 CO 0.65 0.88 -0.64 0.95 -1.16 0.00 0.00 179.01 179.69 2f83 s THR 470 N -5.55 0.49 0.43 1.13 -4.23 -1.26 -5.02 115.64 101.62 2f83 s THR 470 Ca -0.13 -1.98 -0.01 0.00 -1.18 0.00 0.00 61.69 58.40 2f83 s THR 470 Cb 0.14 -2.28 -0.02 0.00 1.34 0.00 0.00 72.50 71.68 2f83 s THR 470 CO 0.82 -0.30 0.67 0.42 -0.54 0.00 0.00 174.62 175.69 2f83 s THR 471 N -3.80 4.59 -0.22 3.99 -4.23 -1.26 -4.74 115.64 109.97 2f83 s THR 471 Ca 0.29 -0.29 -0.07 0.00 -1.18 0.00 0.00 61.69 60.44 2f83 s THR 471 Cb 0.07 -3.71 -0.03 0.00 1.34 0.00 0.00 72.50 70.17 2f83 s THR 471 CO 0.07 -0.54 0.06 -0.69 -0.54 0.00 0.00 174.62 172.98 2f83 s VAL 472 N -2.54 4.45 -0.44 2.29 1.01 0.45 -4.99 120.40 120.62 2f83 s VAL 472 Ca 0.45 -0.14 -0.28 0.00 0.00 0.00 0.00 61.98 62.01 2f83 s VAL 472 Cb -0.10 -3.04 0.03 0.00 0.00 0.00 0.00 36.38 33.26 2f83 s VAL 472 CO 0.39 0.39 1.09 0.20 0.00 0.00 0.00 175.10 177.17 2f83 s ASN 473 N 1.10 6.67 0.64 3.32 -0.87 -1.26 -4.82 114.94 119.71 2f83 s ASN 473 Ca 0.04 0.52 -0.18 0.00 -1.57 0.00 0.00 52.86 51.67 2f83 s ASN 473 Cb -0.14 -2.53 -0.01 0.00 -0.02 0.00 0.00 41.25 38.54 2f83 s ASN 473 CO 0.03 -1.15 1.27 -0.31 -2.57 0.00 0.00 177.10 174.37 2f83 s TYR 474 N 4.18 2.14 0.23 2.20 2.02 -1.26 -4.93 117.35 121.94 2f83 s TYR 474 Ca 0.46 1.50 -0.04 0.00 -0.37 0.00 0.00 57.07 58.61 2f83 s TYR 474 Cb -0.09 -3.64 -0.03 0.00 -0.40 0.00 0.00 41.96 37.81 2f83 s TYR 474 CO 0.28 -2.75 0.27 0.95 -1.57 0.00 0.00 175.55 172.73 2f83 s THR 475 N -1.47 0.00 -0.30 -0.71 -4.23 -0.99 -4.92 115.64 103.02 2f83 s THR 475 Ca 0.81 -1.79 0.20 0.00 -1.18 0.00 0.00 61.69 59.73 2f83 s THR 475 Cb -0.36 -2.42 0.20 0.00 1.34 0.00 0.00 72.50 71.27 2f83 s THR 475 CO 0.38 0.00 1.61 0.47 -0.54 0.00 0.00 174.62 176.54 2f83 n ASP 476 N -0.46 0.52 0.02 3.99 8.00 -1.26 -0.76 116.55 126.59 2f83 n ASP 476 Ca 0.01 0.73 0.11 0.00 0.71 0.00 0.00 54.79 56.35 2f83 n ASP 476 Cb 0.64 -0.80 -0.06 0.00 -0.02 0.00 0.00 41.12 40.88 2f83 n ASP 476 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2f83 n SER 477 N -2.18 0.51 -3.36 -2.24 7.64 -1.26 -4.65 113.62 108.07 2f83 n SER 477 Ca -0.01 -0.22 -0.17 0.00 1.01 0.00 0.00 58.87 59.48 2f83 n SER 477 Cb 0.05 1.15 -0.08 0.00 -1.01 0.00 0.00 64.21 64.32 2f83 n SER 477 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2f83 s GLN 478 N -3.28 0.63 0.34 1.43 -2.07 0.06 -4.26 119.66 112.51 2f83 s GLN 478 Ca 0.00 -0.84 0.09 0.00 -1.82 0.00 0.00 55.36 52.80 2f83 s GLN 478 Cb 0.14 -0.73 -0.06 0.00 -1.09 0.00 0.00 33.01 31.27 2f83 s GLN 478 CO 0.84 -1.19 -0.05 1.03 -1.32 0.00 0.00 175.29 174.60 2f83 s ARG 479 N 1.47 1.94 0.31 9.60 1.81 -0.85 -2.35 118.95 130.88 2f83 s ARG 479 Ca 0.17 -1.83 -0.06 0.00 -1.72 0.00 0.00 55.73 52.29 2f83 s ARG 479 Cb -0.15 -1.82 -0.05 0.00 -0.45 0.00 0.00 34.95 32.47 2f83 s ARG 479 CO -0.05 0.16 0.59 -1.25 -0.68 0.00 0.00 175.30 174.07 2f83 s PRO 480 N -3.65 3.65 0.18 3.54 0.04 -1.26 -2.58 135.00 134.92 2f83 s PRO 480 Ca 0.33 0.08 0.04 0.00 0.04 0.00 0.00 61.00 61.49 2f83 s PRO 480 Cb 0.01 -2.60 -0.03 0.00 0.04 0.00 0.00 34.50 31.91 2f83 s PRO 480 CO 0.18 0.17 0.29 -1.50 0.04 0.00 0.00 177.00 176.18 2f83 s ILE 481 N -2.14 5.22 0.44 0.56 2.07 -0.24 -4.27 121.20 122.84 2f83 s ILE 481 Ca 0.45 -0.83 -0.06 0.00 -1.41 0.00 0.00 60.65 58.80 2f83 s ILE 481 Cb -0.11 -3.74 -0.04 0.00 0.13 0.00 0.00 42.46 38.71 2f83 s ILE 481 CO 0.30 -0.17 0.74 0.00 -1.91 0.00 0.00 174.94 173.90 2f83 s LEU 483 N -4.41 4.32 -0.05 0.00 1.43 -1.26 -0.25 118.68 118.47 2f83 s LEU 483 Ca 0.47 0.96 -0.29 0.00 -1.03 0.00 0.00 54.13 54.23 2f83 s LEU 483 Cb -0.10 -3.21 -0.07 0.00 0.03 0.00 0.00 46.19 42.84 2f83 s LEU 483 CO 0.40 0.11 1.94 -2.84 0.23 0.00 0.00 176.35 176.19 2f83 s PRO 484 N -2.03 3.92 0.33 1.29 0.02 -1.26 -4.81 135.00 132.45 2f83 s PRO 484 Ca 0.37 2.35 -0.29 0.00 0.02 0.00 0.00 61.00 63.45 2f83 s PRO 484 Cb -0.14 -4.17 -0.11 0.00 0.02 0.00 0.00 34.50 30.10 2f83 s PRO 484 CO 0.19 -1.20 1.56 0.43 -0.33 0.00 0.00 177.00 177.65 2f83 n SER 485 N 8.39 3.87 0.07 2.53 7.64 -1.26 -4.77 113.62 130.09 2f83 n SER 485 Ca 0.21 1.18 0.19 0.00 1.01 0.00 0.00 58.87 61.46 2f83 n SER 485 Cb 0.42 -1.61 0.71 0.00 -1.01 0.00 0.00 64.21 62.73 2f83 n SER 485 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 2f83 h LYS 486 N 4.12 0.00 0.00 1.43 1.57 -1.85 0.18 116.57 122.02 2f83 h LYS 486 Ca -0.48 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.30 2f83 h LYS 486 Cb 1.23 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.54 2f83 h LYS 486 CO 0.74 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 180.03 2f83 n GLY 487 N -1.58 -0.72 0.97 3.86 0.00 -1.26 -3.24 105.19 103.22 2f83 n GLY 487 Ca 0.07 -0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.10 2f83 n GLY 487 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2f83 n ASP 488 N -0.51 2.14 0.03 1.61 8.00 0.62 -0.32 116.55 128.12 2f83 n ASP 488 Ca 0.00 -3.63 -0.04 0.00 0.71 0.00 0.00 54.79 51.84 2f83 n ASP 488 Cb 0.00 -0.47 0.19 0.00 -0.02 0.00 0.00 41.12 40.82 2f83 n ASP 488 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 2f83 h ARG 489 N 1.22 0.43 -0.00 -1.24 3.08 -1.73 -2.30 114.38 113.84 2f83 h ARG 489 Ca 0.03 -0.18 0.00 0.00 0.07 0.00 0.00 59.98 59.90 2f83 h ARG 489 Cb 1.19 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 31.22 2f83 h ARG 489 CO 0.13 0.70 -0.11 0.09 -1.07 0.00 0.00 179.97 179.71 2f83 n ASN 490 N -4.08 0.34 -4.64 7.04 3.02 -1.26 -4.86 115.26 110.81 2f83 n ASN 490 Ca -0.01 -0.35 -0.36 0.00 -0.03 0.00 0.00 54.58 53.83 2f83 n ASN 490 Cb 0.44 -0.13 0.08 0.00 -0.61 0.00 0.00 39.78 39.56 2f83 n ASN 490 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 2f83 n VAL 491 N -1.12 3.39 -4.01 2.41 0.31 -0.87 -4.97 118.33 113.48 2f83 n VAL 491 Ca 0.13 -0.41 -0.31 0.00 -0.01 0.00 0.00 64.34 63.73 2f83 n VAL 491 Cb 0.28 -1.19 -0.15 0.00 -0.91 0.00 0.00 33.84 31.87 2f83 n VAL 491 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 2f83 s ILE 492 N -1.69 2.15 0.17 2.52 1.01 -1.26 -5.10 121.20 119.01 2f83 s ILE 492 Ca 0.76 -2.12 -0.30 0.00 0.00 0.00 0.00 60.65 58.99 2f83 s ILE 492 Cb -0.36 -2.52 -0.07 0.00 0.01 0.00 0.00 42.46 39.51 2f83 s ILE 492 CO 0.47 -0.48 0.98 -0.31 0.00 0.00 0.00 174.94 175.61 2f83 s TYR 493 N 1.00 3.83 0.00 3.97 2.02 -1.26 -4.93 117.35 121.98 2f83 s TYR 493 Ca 0.06 1.81 0.00 0.00 -0.37 0.00 0.00 57.07 58.57 2f83 s TYR 493 Cb -0.19 -3.07 0.00 0.00 -0.40 0.00 0.00 41.96 38.30 2f83 s TYR 493 CO -0.08 0.13 0.10 0.25 -1.57 0.00 0.00 175.55 174.38 2f83 n THR 494 N 2.20 0.00 -3.53 -0.71 -2.24 -1.26 -4.85 114.28 103.89 2f83 n THR 494 Ca 0.01 -0.30 -0.27 0.00 -2.27 0.00 0.00 64.05 61.22 2f83 n THR 494 Cb 0.48 1.13 -0.09 0.00 -2.10 0.00 0.00 70.33 69.75 2f83 n THR 494 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2f83 n ASP 495 N -0.40 2.33 -4.83 3.42 2.03 -1.26 -5.01 116.55 112.82 2f83 n ASP 495 Ca 0.00 -3.09 -0.22 0.00 0.52 0.00 0.00 54.79 52.00 2f83 n ASP 495 Cb 0.03 -0.68 -0.04 0.00 -0.72 0.00 0.00 41.12 39.72 2f83 n ASP 495 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2f83 s TRP 497 N -2.18 0.08 -0.17 0.00 0.52 0.19 -1.80 118.94 115.59 2f83 s TRP 497 Ca 0.35 -0.38 0.01 0.00 0.02 0.00 0.00 56.10 56.10 2f83 s TRP 497 Cb -0.07 -0.03 0.02 0.00 -1.15 0.00 0.00 33.47 32.24 2f83 s TRP 497 CO 0.25 -0.48 -0.17 0.14 0.02 0.00 0.00 176.95 176.72 2f83 s VAL 498 N -3.06 1.81 0.01 4.03 -7.23 0.29 -2.04 120.40 114.22 2f83 s VAL 498 Ca -0.01 -0.81 0.02 0.00 -1.81 0.00 0.00 61.98 59.37 2f83 s VAL 498 Cb 0.01 -1.68 -0.04 0.00 0.56 0.00 0.00 36.38 35.24 2f83 s VAL 498 CO -0.07 0.48 -0.01 0.42 -0.31 0.00 0.00 175.10 175.61 2f83 s THR 499 N 1.39 4.03 -1.76 5.32 -4.23 -1.24 -2.35 115.64 116.80 2f83 s THR 499 Ca 0.05 -0.69 0.00 0.00 -1.18 0.00 0.00 61.69 59.87 2f83 s THR 499 Cb -0.13 -2.81 0.00 0.00 1.34 0.00 0.00 72.50 70.90 2f83 s THR 499 CO -0.12 0.34 0.00 0.61 -0.54 0.00 0.00 174.62 174.92 2f83 n GLY 500 N 1.31 -1.47 0.00 3.99 0.00 -0.93 -4.44 105.19 103.66 2f83 n GLY 500 Ca -0.14 -1.02 0.00 0.00 0.00 0.00 0.00 46.02 44.86 2f83 n GLY 500 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2f83 n TRP 501 N 1.73 0.00 -1.52 1.61 8.01 -1.10 0.14 117.44 126.32 2f83 n TRP 501 Ca 0.00 0.00 -0.32 0.00 -1.31 0.00 0.00 57.50 55.87 2f83 n TRP 501 Cb 0.00 0.00 -0.13 0.00 -2.01 0.00 0.00 31.31 29.17 2f83 n TRP 501 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2f83 n GLY 502 N 0.43 -0.30 0.00 6.99 0.00 -1.07 -3.48 105.19 107.75 2f83 n GLY 502 Ca 0.00 0.66 0.00 0.00 0.00 0.00 0.00 46.02 46.68 2f83 n GLY 502 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2f83 n LYS 509 N 7.93 0.00 0.00 1.61 2.85 -1.26 -4.70 118.16 124.59 2f83 n LYS 509 Ca 0.58 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.84 2f83 n LYS 509 Cb 0.22 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.60 2f83 n LYS 509 CO 0.00 0.00 0.00 1.51 -0.05 0.00 0.00 177.40 178.86 2f83 n ILE 510 N -0.88 0.00 0.00 0.58 3.06 -1.26 -5.12 119.36 115.74 2f83 n ILE 510 Ca 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.25 2f83 n ILE 510 Cb 0.00 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.18 2f83 n ILE 510 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2f83 n GLN 511 N 0.00 0.00 -0.10 9.51 1.13 -1.23 -4.98 117.38 121.72 2f83 n GLN 511 Ca 0.00 0.00 -0.14 0.00 -1.94 0.00 0.00 57.00 54.92 2f83 n GLN 511 Cb 0.00 0.00 -0.03 0.00 0.11 0.00 0.00 30.24 30.32 2f83 n GLN 511 CO 0.00 0.00 0.00 -0.97 -1.44 0.00 0.00 177.06 174.65 2f83 h ASN 512 N 0.00 0.98 -2.72 1.08 -1.24 -1.95 -3.43 115.58 108.31 2f83 h ASN 512 Ca 0.00 -0.50 -0.66 0.00 0.71 0.00 0.00 56.30 55.86 2f83 h ASN 512 Cb 0.00 -0.28 -0.06 0.00 0.73 0.00 0.00 38.32 38.71 2f83 h ASN 512 CO 0.00 1.28 -0.48 -0.89 -1.29 0.00 0.00 177.43 176.05 2f83 s THR 513 N -4.27 5.47 0.12 -3.57 2.01 -1.26 0.76 115.64 114.90 2f83 s THR 513 Ca -0.11 0.05 -0.34 0.00 0.31 0.00 0.00 61.69 61.61 2f83 s THR 513 Cb 0.10 -3.46 -0.13 0.00 0.01 0.00 0.00 72.50 69.02 2f83 s THR 513 CO 0.88 0.49 1.66 -0.11 -0.69 0.00 0.00 174.62 176.85 2f83 n LEU 514 N 1.52 3.30 -4.43 4.42 7.94 0.06 -4.87 117.00 124.93 2f83 n LEU 514 Ca -0.16 1.06 -0.44 0.00 -1.11 0.00 0.00 56.01 55.36 2f83 n LEU 514 Cb 0.54 -1.44 -0.05 0.00 0.53 0.00 0.00 43.42 43.00 2f83 n LEU 514 CO 0.37 -0.18 0.46 -1.58 -1.11 0.00 0.00 177.39 175.36 2f83 s GLN 515 N 1.56 3.12 0.38 1.96 2.00 0.38 -3.53 119.66 125.54 2f83 s GLN 515 Ca 0.81 -0.94 -0.13 0.00 -2.00 0.00 0.00 55.36 53.10 2f83 s GLN 515 Cb -0.65 -4.16 -0.08 0.00 0.80 0.00 0.00 33.01 28.92 2f83 s GLN 515 CO 0.39 -1.43 0.78 -1.59 -0.50 0.00 0.00 175.29 172.94 2f83 s LYS 516 N 3.00 3.90 -0.30 1.67 -2.85 -1.26 -2.18 119.74 121.72 2f83 s LYS 516 Ca 0.17 0.61 -0.13 0.00 -1.00 0.00 0.00 55.97 55.62 2f83 s LYS 516 Cb -0.20 -2.38 0.17 0.00 -2.06 0.00 0.00 37.83 33.37 2f83 s LYS 516 CO 0.11 0.03 0.99 0.00 0.10 0.00 0.00 175.35 176.58 2f83 s ALA 517 N -2.22 -2.93 0.06 0.59 0.00 -0.99 -4.60 121.76 111.68 2f83 s ALA 517 Ca 0.53 1.83 -0.31 0.00 0.00 0.00 0.00 51.96 54.02 2f83 s ALA 517 Cb -0.10 -2.21 -0.06 0.00 0.00 0.00 0.00 23.12 20.75 2f83 s ALA 517 CO 0.25 -1.14 1.24 0.21 0.00 0.00 0.00 175.76 176.32 2f83 s LYS 518 N 2.62 4.40 0.04 0.00 2.36 -1.26 0.10 119.74 128.00 2f83 s LYS 518 Ca -0.00 1.83 0.02 0.00 -2.55 0.00 0.00 55.97 55.27 2f83 s LYS 518 Cb -0.08 -3.35 -0.02 0.00 -1.05 0.00 0.00 37.83 33.33 2f83 s LYS 518 CO -0.16 -0.31 -0.07 0.42 1.55 0.00 0.00 175.35 176.78 2f83 s ILE 519 N 1.17 0.51 0.30 5.43 1.01 -0.74 -4.90 121.20 123.98 2f83 s ILE 519 Ca 0.60 -1.04 -0.14 0.00 0.00 0.00 0.00 60.65 60.07 2f83 s ILE 519 Cb -0.31 -0.58 -0.09 0.00 0.01 0.00 0.00 42.46 41.50 2f83 s ILE 519 CO 0.29 -0.37 0.69 -2.16 0.00 0.00 0.00 174.94 173.39 2f83 s PRO 520 N -1.52 3.95 0.57 2.79 0.04 -1.26 -4.15 135.00 135.42 2f83 s PRO 520 Ca -0.10 0.57 -0.07 0.00 0.04 0.00 0.00 61.00 61.45 2f83 s PRO 520 Cb -0.10 -2.48 -0.01 0.00 0.04 0.00 0.00 34.50 31.95 2f83 s PRO 520 CO 0.00 0.19 0.89 -0.51 0.04 0.00 0.00 177.00 177.62 2f83 s LEU 521 N -2.95 3.34 -0.14 -3.56 1.02 -1.26 -4.60 118.68 110.53 2f83 s LEU 521 Ca 0.53 0.91 -0.04 0.00 0.02 0.00 0.00 54.13 55.55 2f83 s LEU 521 Cb -0.10 -3.81 0.06 0.00 0.02 0.00 0.00 46.19 42.36 2f83 s LEU 521 CO 0.18 -0.90 0.11 0.68 0.02 0.00 0.00 176.35 176.44 2f83 s VAL 522 N -2.96 -0.14 0.23 -1.59 -7.23 -0.81 -4.92 120.40 102.98 2f83 s VAL 522 Ca 0.52 0.02 -0.26 0.00 -1.81 0.00 0.00 61.98 60.45 2f83 s VAL 522 Cb -0.11 -0.47 -0.17 0.00 0.56 0.00 0.00 36.38 36.20 2f83 s VAL 522 CO 0.47 -0.13 0.44 0.35 -0.31 0.00 0.00 175.10 175.92 2f83 n THR 523 N 5.29 1.74 0.35 5.32 -2.24 -1.26 -4.25 114.28 119.24 2f83 n THR 523 Ca -0.06 -0.49 0.13 0.00 -2.27 0.00 0.00 64.05 61.36 2f83 n THR 523 Cb 0.49 0.00 0.56 0.00 -2.10 0.00 0.00 70.33 69.29 2f83 n THR 523 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2f83 h ASN 524 N 0.87 0.00 -0.70 3.42 7.08 -1.92 -1.62 115.58 122.71 2f83 h ASN 524 Ca -0.29 0.00 -0.06 0.00 -3.08 0.00 0.00 56.30 52.86 2f83 h ASN 524 Cb 1.42 0.00 -0.03 0.00 -2.08 0.00 0.00 38.32 37.63 2f83 h ASN 524 CO 0.54 0.00 0.19 -0.08 -2.08 0.00 0.00 177.43 176.00 2f83 h GLU 525 N 0.00 1.11 0.00 4.14 4.81 -1.96 -0.80 114.58 121.88 2f83 h GLU 525 Ca 0.00 -0.26 -0.12 0.00 -0.13 0.00 0.00 59.36 58.85 2f83 h GLU 525 Cb 0.36 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.57 2f83 h GLU 525 CO 0.00 0.98 -0.56 1.49 -0.73 0.00 0.00 179.01 180.19 2f83 h GLU 526 N 1.05 0.00 0.85 1.92 4.57 -1.65 -3.28 114.58 118.05 2f83 h GLU 526 Ca 0.22 0.00 -0.04 0.00 -1.18 0.00 0.00 59.36 58.36 2f83 h GLU 526 Cb 0.35 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 28.95 2f83 h GLU 526 CO -0.00 0.56 -0.41 0.00 -1.18 0.00 0.00 179.01 177.98 2f83 h GLN 528 N -1.27 0.05 0.00 0.00 5.75 -1.25 2.13 115.11 120.52 2f83 h GLN 528 Ca -0.12 -0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.38 2f83 h GLN 528 Cb 0.88 -0.01 0.00 0.00 1.07 0.00 0.00 27.48 29.42 2f83 h GLN 528 CO 0.19 0.03 0.00 1.63 -2.65 0.00 0.00 178.83 178.04 2f83 n LYS 529 N -5.32 0.00 -0.00 1.69 5.02 -1.15 -1.17 118.16 117.23 2f83 n LYS 529 Ca 0.31 0.16 0.01 0.00 -2.02 0.00 0.00 58.31 56.77 2f83 n LYS 529 Cb 1.01 -1.50 -0.02 0.00 -0.02 0.00 0.00 35.03 34.51 2f83 n LYS 529 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2f83 n ARG 530 N -1.15 5.42 -3.43 1.97 3.00 0.72 -4.86 116.66 118.33 2f83 n ARG 530 Ca 0.00 -0.00 -0.24 0.00 -0.01 0.00 0.00 57.85 57.59 2f83 n ARG 530 Cb 0.00 -0.68 -0.11 0.00 0.00 0.00 0.00 32.46 31.68 2f83 n ARG 530 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.63 178.34 2f83 s TYR 531 N -1.36 0.30 0.01 -1.55 1.51 -0.31 -4.88 117.35 111.07 2f83 s TYR 531 Ca 0.01 -1.26 -0.12 0.00 -1.01 0.00 0.00 57.07 54.69 2f83 s TYR 531 Cb 0.02 -0.71 -0.33 0.00 -0.11 0.00 0.00 41.96 40.83 2f83 s TYR 531 CO 0.11 -0.88 0.91 0.00 -1.11 0.00 0.00 175.55 174.58 2f83 h ARG 532 N 7.14 0.44 -0.92 -0.62 2.47 -1.89 -3.34 114.38 117.66 2f83 h ARG 532 Ca 0.04 -0.75 -0.02 0.00 -1.26 0.00 0.00 59.98 57.98 2f83 h ARG 532 Cb 1.01 0.28 -0.01 0.00 -1.65 0.00 0.00 29.97 29.59 2f83 h ARG 532 CO 0.25 1.35 0.03 0.41 0.56 0.00 0.00 179.97 182.57 2f83 n GLY 533 N 1.73 1.95 3.05 0.04 0.00 -1.26 -4.55 105.19 106.15 2f83 n GLY 533 Ca -0.18 -0.21 -0.04 0.00 0.00 0.00 0.00 46.02 45.59 2f83 n GLY 533 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2f83 s HIS 534 N -1.27 -1.33 0.09 1.61 0.00 -1.25 -5.14 115.29 108.00 2f83 s HIS 534 Ca 0.12 0.22 -0.36 0.00 -3.00 0.00 0.00 55.06 52.04 2f83 s HIS 534 Cb 0.09 0.08 -0.16 0.00 -4.00 0.00 0.00 32.58 28.59 2f83 s HIS 534 CO 0.03 -1.08 1.41 1.17 -1.00 0.00 0.00 174.74 175.27 2f83 n LYS 535 N 4.77 1.36 -3.40 -0.38 4.81 -1.26 -4.92 118.16 119.14 2f83 n LYS 535 Ca 0.08 0.49 -0.43 0.00 -0.87 0.00 0.00 58.31 57.58 2f83 n LYS 535 Cb 0.52 -2.17 -0.09 0.00 0.02 0.00 0.00 35.03 33.32 2f83 n LYS 535 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 2f83 s ILE 536 N 0.71 5.19 0.71 3.15 -1.09 -1.26 -5.03 121.20 123.57 2f83 s ILE 536 Ca 0.84 -0.54 -0.10 0.00 -2.23 0.00 0.00 60.65 58.61 2f83 s ILE 536 Cb -0.90 -3.98 0.03 0.00 -1.58 0.00 0.00 42.46 36.03 2f83 s ILE 536 CO 0.46 -0.36 1.07 0.42 -1.23 0.00 0.00 174.94 175.29 2f83 s THR 537 N 1.86 3.09 0.06 2.92 -4.23 -1.26 -4.92 115.64 113.16 2f83 s THR 537 Ca 0.08 0.21 0.30 0.00 -1.18 0.00 0.00 61.69 61.10 2f83 s THR 537 Cb -0.18 -3.32 0.31 0.00 1.34 0.00 0.00 72.50 70.64 2f83 s THR 537 CO 0.11 -0.40 1.92 1.12 -0.54 0.00 0.00 174.62 176.83 2f83 h HIS 538 N -0.64 0.00 0.00 3.99 2.07 -2.01 0.46 115.15 119.02 2f83 h HIS 538 Ca -0.45 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.07 2f83 h HIS 538 Cb 1.28 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.26 2f83 h HIS 538 CO 0.44 0.00 0.00 1.63 -3.07 0.00 0.00 177.93 176.93 2f83 n LYS 539 N -2.59 0.65 -4.39 5.12 4.76 -1.26 -4.68 118.16 115.76 2f83 n LYS 539 Ca -0.01 0.02 -0.28 0.00 -2.87 0.00 0.00 58.31 55.17 2f83 n LYS 539 Cb 0.10 -1.50 -0.12 0.00 -1.84 0.00 0.00 35.03 31.67 2f83 n LYS 539 CO 0.00 0.00 0.00 -1.64 -1.37 0.00 0.00 177.40 174.39 2f83 s MET 540 N -2.24 1.58 -0.25 1.97 -1.94 0.16 0.81 119.30 119.39 2f83 s MET 540 Ca 0.34 -1.43 -0.03 0.00 -1.71 0.00 0.00 55.69 52.86 2f83 s MET 540 Cb 0.18 -1.92 0.11 0.00 2.01 0.00 0.00 34.83 35.22 2f83 s MET 540 CO 0.35 0.42 0.24 -1.50 -0.01 0.00 0.00 175.02 174.52 2f83 s ILE 541 N -1.51 -0.32 0.44 2.53 2.07 0.52 -4.58 121.20 120.36 2f83 s ILE 541 Ca 0.20 -0.37 -0.17 0.00 -1.41 0.00 0.00 60.65 58.90 2f83 s ILE 541 Cb -0.09 -0.85 -0.09 0.00 0.13 0.00 0.00 42.46 41.56 2f83 s ILE 541 CO 0.10 -0.40 0.90 0.00 -1.91 0.00 0.00 174.94 173.63 2f83 n ALA 543 N -1.06 1.99 -2.50 0.00 0.00 -0.50 -1.93 120.51 116.51 2f83 n ALA 543 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.08 2f83 n ALA 543 Cb 0.54 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.90 2f83 n ALA 543 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2f83 s LYS 554 N -1.65 3.27 0.00 0.00 -0.14 -1.26 -3.55 119.74 116.40 2f83 s LYS 554 Ca 0.00 -0.68 0.00 0.00 -1.36 0.00 0.00 55.97 53.93 2f83 s LYS 554 Cb 0.00 -3.90 0.00 0.00 -1.68 0.00 0.00 37.83 32.25 2f83 s LYS 554 CO 0.00 -0.69 0.00 0.41 -0.76 0.00 0.00 175.35 174.31 2f83 n GLY 555 N 5.07 0.33 0.11 -3.33 0.00 -1.26 -3.78 105.19 102.32 2f83 n GLY 555 Ca -0.09 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.94 2f83 n GLY 555 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2f83 n ASP 556 N 0.00 1.21 -4.71 1.61 8.00 -1.26 -2.61 116.55 118.79 2f83 n ASP 556 Ca 0.00 -1.11 -0.42 0.00 0.71 0.00 0.00 54.79 53.97 2f83 n ASP 556 Cb 0.00 0.01 -0.03 0.00 -0.02 0.00 0.00 41.12 41.08 2f83 n ASP 556 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 2f83 s SER 557 N -0.23 6.54 0.00 -2.24 0.01 -1.26 0.19 113.70 116.71 2f83 s SER 557 Ca 0.03 2.64 0.00 0.00 1.31 0.00 0.00 55.95 59.93 2f83 s SER 557 Cb 0.02 -2.59 0.00 0.00 0.21 0.00 0.00 66.02 63.67 2f83 s SER 557 CO 0.03 -0.88 0.00 0.61 0.41 0.00 0.00 173.24 173.42 2f83 n GLY 558 N 3.89 2.53 3.70 3.44 0.00 -1.07 -0.18 105.19 117.49 2f83 n GLY 558 Ca 0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.77 2f83 n GLY 558 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2f83 n GLY 559 N -2.00 0.54 3.84 -0.02 0.00 0.50 -3.70 105.19 104.35 2f83 n GLY 559 Ca 0.00 0.15 -0.34 0.00 0.00 0.00 0.00 46.02 45.83 2f83 n GLY 559 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2f83 s PRO 560 N -2.33 4.07 -0.59 1.61 0.04 -1.26 -0.52 135.00 136.01 2f83 s PRO 560 Ca 0.63 0.69 -0.01 0.00 0.04 0.00 0.00 61.00 62.36 2f83 s PRO 560 Cb -0.49 -2.63 0.15 0.00 0.04 0.00 0.00 34.50 31.58 2f83 s PRO 560 CO 0.56 0.27 0.38 -1.17 0.04 0.00 0.00 177.00 177.08 2f83 s LEU 561 N -2.58 4.98 0.14 -3.56 2.96 -0.25 -3.65 118.68 116.74 2f83 s LEU 561 Ca 0.49 -2.87 -0.21 0.00 -0.22 0.00 0.00 54.13 51.33 2f83 s LEU 561 Cb -0.13 -1.79 -0.07 0.00 0.50 0.00 0.00 46.19 44.70 2f83 s LEU 561 CO 0.19 -0.34 0.67 -0.44 -1.32 0.00 0.00 176.35 175.11 2f83 s SER 562 N 0.46 7.14 -0.11 3.68 0.01 -0.86 -2.23 113.70 121.78 2f83 s SER 562 Ca 0.17 1.40 -0.00 0.00 1.31 0.00 0.00 55.95 58.82 2f83 s SER 562 Cb -0.22 -2.41 0.02 0.00 0.21 0.00 0.00 66.02 63.63 2f83 s SER 562 CO -0.03 0.18 -0.08 0.00 0.41 0.00 0.00 173.24 173.73 2f83 s LYS 564 N 1.65 4.50 -0.25 0.00 2.20 0.48 -1.07 119.74 127.25 2f83 s LYS 564 Ca 0.04 1.24 -0.12 0.00 -0.36 0.00 0.00 55.97 56.77 2f83 s LYS 564 Cb -0.13 -2.73 0.09 0.00 -1.51 0.00 0.00 37.83 33.55 2f83 s LYS 564 CO -0.08 0.26 0.59 -1.58 -0.36 0.00 0.00 175.35 174.18 2f83 s HIS 565 N -1.68 -1.01 -1.55 4.03 2.46 0.46 -4.37 115.29 113.64 2f83 s HIS 565 Ca 0.51 1.93 -0.15 0.00 0.47 0.00 0.00 55.06 57.82 2f83 s HIS 565 Cb -0.17 0.56 0.12 0.00 -0.13 0.00 0.00 32.58 32.96 2f83 s HIS 565 CO 0.22 -0.52 0.76 0.09 -2.47 0.00 0.00 174.74 172.82 2f83 n ASN 566 N 4.72 -3.84 -1.48 9.88 3.02 -1.26 -0.15 115.26 126.16 2f83 n ASN 566 Ca -0.17 -0.78 -0.11 0.00 -0.03 0.00 0.00 54.58 53.49 2f83 n ASN 566 Cb 0.55 -3.12 0.01 0.00 -0.61 0.00 0.00 39.78 36.60 2f83 n ASN 566 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2f83 n GLU 567 N -4.28 -1.99 -3.81 3.52 -0.58 -1.26 -5.03 120.64 107.20 2f83 n GLU 567 Ca 0.05 0.45 -0.13 0.00 -0.42 0.00 0.00 57.16 57.12 2f83 n GLU 567 Cb 0.51 -4.39 -0.12 0.00 -0.57 0.00 0.00 31.44 26.87 2f83 n GLU 567 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 2f83 s VAL 568 N -2.76 0.00 0.05 2.62 1.01 0.79 -4.90 120.40 117.22 2f83 s VAL 568 Ca 0.11 -0.01 -0.20 0.00 0.00 0.00 0.00 61.98 61.89 2f83 s VAL 568 Cb -0.05 -0.27 -0.06 0.00 0.00 0.00 0.00 36.38 36.00 2f83 s VAL 568 CO 0.14 -0.00 0.58 0.26 0.00 0.00 0.00 175.10 176.07 2f83 s TRP 569 N 0.08 3.78 -0.15 5.22 0.52 -1.26 0.17 118.94 127.30 2f83 s TRP 569 Ca -0.00 1.26 0.00 0.00 0.02 0.00 0.00 56.10 57.38 2f83 s TRP 569 Cb -0.01 -2.53 0.03 0.00 -1.15 0.00 0.00 33.47 29.81 2f83 s TRP 569 CO 0.00 0.53 -0.10 -1.01 0.02 0.00 0.00 176.95 176.39 2f83 s HIS 570 N -0.88 1.94 -0.91 -1.98 3.76 -0.23 -3.05 115.29 113.94 2f83 s HIS 570 Ca 0.30 -1.14 -0.24 0.00 -0.15 0.00 0.00 55.06 53.82 2f83 s HIS 570 Cb -0.19 -1.45 -0.03 0.00 1.11 0.00 0.00 32.58 32.01 2f83 s HIS 570 CO 0.19 -0.63 1.88 -1.17 -0.85 0.00 0.00 174.74 174.16 2f83 s LEU 571 N 1.56 3.21 0.02 0.89 2.96 0.66 -2.38 118.68 125.60 2f83 s LEU 571 Ca 0.03 -0.75 -0.17 0.00 -0.22 0.00 0.00 54.13 53.02 2f83 s LEU 571 Cb -0.14 -2.56 -0.33 0.00 0.50 0.00 0.00 46.19 43.66 2f83 s LEU 571 CO -0.09 -2.59 1.01 -0.37 -1.32 0.00 0.00 176.35 172.99 2f83 h VAL 572 N 7.20 1.33 -3.99 1.68 -1.51 -1.76 -3.38 116.25 115.82 2f83 h VAL 572 Ca 0.10 -2.58 -0.12 0.00 -1.23 0.00 0.00 66.70 62.87 2f83 h VAL 572 Cb 1.01 2.97 -0.13 0.00 -2.13 0.00 0.00 31.29 33.01 2f83 h VAL 572 CO 1.24 0.77 -0.39 -0.83 -1.23 0.00 0.00 177.57 177.13 2f83 s GLY 573 N -4.50 0.57 -0.07 5.19 0.00 -1.21 -1.25 107.32 106.04 2f83 s GLY 573 Ca -0.10 -0.99 0.05 0.00 0.00 0.00 0.00 44.72 43.68 2f83 s GLY 573 CO 0.92 -0.94 -0.25 -0.42 0.00 0.00 0.00 173.10 172.41 2f83 s ILE 574 N -3.98 2.05 -0.52 0.90 1.01 -0.93 -1.09 121.20 118.64 2f83 s ILE 574 Ca 0.18 -1.05 -0.27 0.00 0.00 0.00 0.00 60.65 59.52 2f83 s ILE 574 Cb 0.04 -1.75 -0.08 0.00 0.01 0.00 0.00 42.46 40.68 2f83 s ILE 574 CO -0.00 0.57 2.43 0.41 0.00 0.00 0.00 174.94 178.35 2f83 n THR 575 N 3.15 -0.06 -0.09 2.92 -1.04 0.32 -1.22 114.28 118.25 2f83 n THR 575 Ca -0.18 -0.73 -0.11 0.00 -2.04 0.00 0.00 64.05 60.99 2f83 n THR 575 Cb 0.52 -2.61 -0.04 0.00 -1.82 0.00 0.00 70.33 66.38 2f83 n THR 575 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 2f83 n SER 576 N 15.36 1.89 -3.20 8.00 2.88 -1.19 -2.61 113.62 134.73 2f83 n SER 576 Ca 0.39 0.45 0.04 0.00 -1.33 0.00 0.00 58.87 58.42 2f83 n SER 576 Cb 0.50 -0.82 -0.02 0.00 -0.75 0.00 0.00 64.21 63.12 2f83 n SER 576 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 2f83 s TRP 577 N -2.57 -1.04 -0.11 0.66 1.48 -1.21 -4.95 118.94 111.20 2f83 s TRP 577 Ca -0.25 1.21 0.00 0.00 -1.06 0.00 0.00 56.10 56.00 2f83 s TRP 577 Cb 0.05 0.40 0.02 0.00 -1.16 0.00 0.00 33.47 32.78 2f83 s TRP 577 CO 0.38 -0.56 -0.10 0.20 -4.06 0.00 0.00 176.95 172.80 2f83 s GLY 578 N 2.86 0.91 0.45 3.67 0.00 -1.26 -2.99 107.32 110.96 2f83 s GLY 578 Ca 0.08 -0.62 -0.20 0.00 0.00 0.00 0.00 44.72 43.97 2f83 s GLY 578 CO -0.16 0.60 0.97 1.85 0.00 0.00 0.00 173.10 176.35 2f83 s GLU 579 N 1.45 4.12 6.42 2.90 2.12 -1.26 -4.96 118.70 129.49 2f83 s GLU 579 Ca 0.01 1.14 0.00 0.00 0.36 0.00 0.00 54.97 56.48 2f83 s GLU 579 Cb -0.13 -2.16 0.00 0.00 0.26 0.00 0.00 34.13 32.10 2f83 s GLU 579 CO -0.06 -0.13 0.00 0.41 -0.54 0.00 0.00 175.26 174.94 2f83 n GLY 580 N -0.70 2.28 0.01 -1.50 0.00 -1.26 -4.65 105.19 99.37 2f83 n GLY 580 Ca 0.07 0.34 0.00 0.00 0.00 0.00 0.00 46.02 46.43 2f83 n GLY 580 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2f83 n GLU 585 N 4.44 -0.02 -3.28 1.61 1.02 -1.26 -4.89 120.64 118.27 2f83 n GLU 585 Ca 0.00 0.00 -0.25 0.00 -0.02 0.00 0.00 57.16 56.89 2f83 n GLU 585 Cb 0.00 0.00 -0.08 0.00 -0.02 0.00 0.00 31.44 31.34 2f83 n GLU 585 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2f83 n ARG 586 N 0.00 0.78 0.00 3.49 3.00 -1.26 -4.68 116.66 117.99 2f83 n ARG 586 Ca 0.00 -3.37 0.00 0.00 -0.01 0.00 0.00 57.85 54.47 2f83 n ARG 586 Cb 0.00 -1.44 0.00 0.00 0.00 0.00 0.00 32.46 31.02 2f83 n ARG 586 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.63 177.28 2f83 n PRO 587 N 1.70 0.00 0.00 5.56 -0.04 -1.26 -4.82 135.00 136.14 2f83 n PRO 587 Ca 0.24 0.10 0.00 0.00 -0.04 0.00 0.00 63.50 63.80 2f83 n PRO 587 Cb 0.50 -0.73 0.00 0.00 -0.04 0.00 0.00 33.50 33.23 2f83 n PRO 587 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2f83 n GLY 588 N -0.33 3.08 3.80 0.55 0.00 -1.23 -4.77 105.19 106.28 2f83 n GLY 588 Ca 0.00 -0.19 -0.34 0.00 0.00 0.00 0.00 46.02 45.49 2f83 n GLY 588 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2f83 s VAL 589 N 0.00 3.81 0.06 1.61 1.01 -1.16 -1.41 120.40 124.32 2f83 s VAL 589 Ca 0.00 1.15 -0.03 0.00 0.00 0.00 0.00 61.98 63.10 2f83 s VAL 589 Cb 0.00 -3.48 -0.03 0.00 0.00 0.00 0.00 36.38 32.87 2f83 s VAL 589 CO 0.00 -0.22 0.02 -0.31 0.00 0.00 0.00 175.10 174.59 2f83 s TYR 590 N -1.96 0.44 -0.02 5.22 1.51 -1.09 -3.20 117.35 118.26 2f83 s TYR 590 Ca 0.66 -0.96 -0.21 0.00 -1.01 0.00 0.00 57.07 55.55 2f83 s TYR 590 Cb -0.17 -0.32 -0.05 0.00 -0.11 0.00 0.00 41.96 41.32 2f83 s TYR 590 CO 0.20 -0.42 0.62 0.95 -1.11 0.00 0.00 175.55 175.79 2f83 s THR 591 N -3.91 4.93 -1.10 -0.71 -4.23 -0.36 -0.35 115.64 109.92 2f83 s THR 591 Ca 0.07 1.29 -0.22 0.00 -1.18 0.00 0.00 61.69 61.65 2f83 s THR 591 Cb 0.07 -3.96 0.04 0.00 1.34 0.00 0.00 72.50 70.00 2f83 s THR 591 CO -0.10 0.38 1.59 0.21 -0.54 0.00 0.00 174.62 176.16 2f83 s ASN 592 N 0.02 6.44 0.22 3.99 2.47 0.24 -2.19 114.94 126.14 2f83 s ASN 592 Ca 0.32 -1.68 -0.08 0.00 0.42 0.00 0.00 52.86 51.84 2f83 s ASN 592 Cb -0.18 -2.57 0.33 0.00 -1.45 0.00 0.00 41.25 37.38 2f83 s ASN 592 CO 0.17 -1.56 1.27 0.52 -3.72 0.00 0.00 177.10 173.78 2f83 n VAL 593 N 6.86 -0.36 -0.22 -5.21 0.31 -0.38 -0.81 118.33 118.51 2f83 n VAL 593 Ca 0.38 1.87 -0.10 0.00 -0.01 0.00 0.00 64.34 66.49 2f83 n VAL 593 Cb 0.49 -2.56 -0.05 0.00 -0.91 0.00 0.00 33.84 30.80 2f83 n VAL 593 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 2f83 h VAL 594 N 0.00 0.05 0.00 2.52 2.07 -1.85 0.54 116.25 119.59 2f83 h VAL 594 Ca 0.36 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.88 2f83 h VAL 594 Cb 0.57 0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.39 2f83 h VAL 594 CO -0.83 0.00 0.00 -0.62 0.02 0.00 0.00 177.57 176.14 2f83 n GLU 595 N -5.39 0.00 0.00 1.57 -0.58 0.01 -0.85 120.64 115.40 2f83 n GLU 595 Ca 0.01 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.75 2f83 n GLU 595 Cb 0.34 -1.13 0.00 0.00 -0.57 0.00 0.00 31.44 30.08 2f83 n GLU 595 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 2f83 n TYR 596 N -0.58 0.00 -0.17 -0.32 4.01 0.19 -4.86 117.16 115.43 2f83 n TYR 596 Ca 0.00 -0.24 -0.03 0.00 -0.16 0.00 0.00 57.90 57.47 2f83 n TYR 596 Cb 0.00 -0.02 0.04 0.00 -0.31 0.00 0.00 39.34 39.04 2f83 n TYR 596 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 2f83 h VAL 597 N 0.93 0.41 0.66 -0.72 2.07 -0.87 -1.50 116.25 117.22 2f83 h VAL 597 Ca 0.00 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.50 2f83 h VAL 597 Cb 0.57 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 30.74 2f83 h VAL 597 CO 0.00 0.00 -0.48 0.44 0.02 0.00 0.00 177.57 177.55 2f83 h ASP 598 N -0.05 -1.24 -0.93 0.57 3.45 -1.89 -0.67 116.42 115.66 2f83 h ASP 598 Ca 0.25 0.08 0.16 0.00 0.43 0.00 0.00 57.03 57.96 2f83 h ASP 598 Cb 0.43 0.38 -0.16 0.00 -0.56 0.00 0.00 39.33 39.41 2f83 h ASP 598 CO -0.56 -0.69 -0.32 -0.25 -1.57 0.00 0.00 179.24 175.85 2f83 h TRP 599 N -1.09 -0.82 -0.09 4.55 7.01 -1.82 0.91 115.95 124.61 2f83 h TRP 599 Ca -0.08 0.09 0.00 0.00 2.11 0.00 0.00 58.89 61.01 2f83 h TRP 599 Cb 0.90 0.50 -0.01 0.00 -2.10 0.00 0.00 29.16 28.45 2f83 h TRP 599 CO -0.16 -0.40 0.04 0.82 -2.79 0.00 0.00 178.44 175.95 2f83 h ILE 600 N -0.02 1.00 -0.27 2.65 2.04 -0.92 0.41 117.51 122.40 2f83 h ILE 600 Ca 0.38 -0.03 -0.08 0.00 1.00 0.00 0.00 64.86 66.13 2f83 h ILE 600 Cb 0.63 0.90 -0.02 0.00 -0.74 0.00 0.00 36.82 37.60 2f83 h ILE 600 CO -0.95 0.02 -0.16 -0.07 0.00 0.00 0.00 178.15 176.98 2f83 h LEU 601 N 0.09 0.46 -0.39 1.44 3.38 0.96 -2.36 115.31 118.89 2f83 h LEU 601 Ca 0.03 -0.13 -0.14 0.00 0.09 0.00 0.00 57.88 57.73 2f83 h LEU 601 Cb 0.00 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 2f83 h LEU 601 CO -0.02 0.65 -0.31 -0.08 0.09 0.00 0.00 178.44 178.76 2f83 h GLU 602 N 0.43 0.90 -0.22 1.13 4.22 0.94 -2.79 114.58 119.19 2f83 h GLU 602 Ca 0.08 -0.45 0.00 0.00 0.08 0.00 0.00 59.36 59.07 2f83 h GLU 602 Cb 0.54 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.79 2f83 h GLU 602 CO 0.03 1.10 0.00 1.63 -2.18 0.00 0.00 179.01 179.59 2f83 n LYS 603 N -4.13 0.47 0.00 1.92 4.76 0.11 -5.08 118.16 116.21 2f83 n LYS 603 Ca -0.02 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.42 2f83 n LYS 603 Cb 0.50 -1.11 0.00 0.00 -1.84 0.00 0.00 35.03 32.58 2f83 n LYS 603 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28