#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b21 n THR 6 N 0.00 0.21 0.10 -5.08 -2.24 -1.26 -2.22 114.28 103.80 2b21 n THR 6 Ca 0.00 0.05 -0.04 0.00 -2.27 0.00 0.00 64.05 61.80 2b21 n THR 6 Cb 0.00 -0.66 0.15 0.00 -2.10 0.00 0.00 70.33 67.72 2b21 n THR 6 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2b21 h ASP 7 N 0.00 0.19 -3.14 3.42 3.32 -1.99 -3.45 116.42 114.78 2b21 h ASP 7 Ca 0.00 -0.11 -0.53 0.00 0.02 0.00 0.00 57.03 56.42 2b21 h ASP 7 Cb 0.21 -0.06 0.03 0.00 0.22 0.00 0.00 39.33 39.73 2b21 h ASP 7 CO 0.00 0.73 0.71 -0.76 -1.72 0.00 0.00 179.24 178.20 2b21 s LEU 8 N -7.89 4.38 0.26 1.55 1.43 -0.94 -4.97 118.68 112.50 2b21 s LEU 8 Ca -0.03 2.37 -0.31 0.00 -1.03 0.00 0.00 54.13 55.13 2b21 s LEU 8 Cb 0.12 -3.60 -0.13 0.00 0.03 0.00 0.00 46.19 42.62 2b21 s LEU 8 CO 0.78 -0.62 1.43 -2.65 0.23 0.00 0.00 176.35 175.53 2b21 n PRO 9 N 3.45 2.18 -1.60 1.29 -0.02 -1.26 -2.14 135.00 136.90 2b21 n PRO 9 Ca 0.10 0.77 -0.07 0.00 -2.02 0.00 0.00 63.50 62.28 2b21 n PRO 9 Cb 0.42 -2.45 -0.02 0.00 -0.02 0.00 0.00 33.50 31.44 2b21 n PRO 9 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2b21 n GLY 10 N 2.02 0.54 2.88 -1.23 0.00 -1.26 -3.35 105.19 104.79 2b21 n GLY 10 Ca 0.10 -0.69 -0.30 0.00 0.00 0.00 0.00 46.02 45.13 2b21 n GLY 10 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b21 s VAL 11 N -2.28 1.50 0.52 1.61 1.01 -0.91 -4.86 120.40 116.98 2b21 s VAL 11 Ca 0.00 -1.63 -0.03 0.00 0.00 0.00 0.00 61.98 60.32 2b21 s VAL 11 Cb 0.00 -2.01 0.11 0.00 0.00 0.00 0.00 36.38 34.47 2b21 s VAL 11 CO 0.00 -0.48 0.70 0.61 0.00 0.00 0.00 175.10 175.94 2b21 n GLY 12 N 4.61 0.11 0.19 4.51 0.00 -1.26 -4.47 105.19 108.89 2b21 n GLY 12 Ca -0.03 -1.92 0.03 0.00 0.00 0.00 0.00 46.02 44.10 2b21 n GLY 12 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2b21 h PRO 13 N 0.00 0.00 -0.06 1.61 0.11 -1.98 -1.39 132.00 130.29 2b21 h PRO 13 Ca -0.23 0.00 -0.23 0.00 0.11 0.00 0.00 66.00 65.65 2b21 h PRO 13 Cb 0.78 0.00 0.02 0.00 0.11 0.00 0.00 31.00 31.91 2b21 h PRO 13 CO 0.22 0.37 -0.85 0.66 -0.21 0.00 0.00 178.00 178.18 2b21 h SER 14 N 0.00 0.85 0.02 -2.05 4.64 -2.00 -2.62 113.55 112.40 2b21 h SER 14 Ca -0.00 -0.70 -0.11 0.00 -0.47 0.00 0.00 61.79 60.51 2b21 h SER 14 Cb 0.67 -0.26 -0.01 0.00 -0.31 0.00 0.00 62.40 62.49 2b21 h SER 14 CO 0.05 1.43 -0.33 0.74 -0.87 0.00 0.00 176.83 177.84 2b21 h THR 15 N 0.34 1.29 -0.75 2.95 2.02 -1.91 -2.68 112.91 114.17 2b21 h THR 15 Ca -0.09 -1.41 -0.05 0.00 0.77 0.00 0.00 66.41 65.63 2b21 h THR 15 Cb 1.51 1.49 -0.03 0.00 -1.74 0.00 0.00 68.15 69.37 2b21 h THR 15 CO 0.17 0.44 0.26 0.00 0.37 0.00 0.00 175.52 176.76 2b21 h ALA 16 N 1.27 1.04 -0.24 6.16 0.00 -1.21 -1.08 119.26 125.19 2b21 h ALA 16 Ca 0.04 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 2b21 h ALA 16 Cb 0.77 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 2b21 h ALA 16 CO 0.06 0.66 0.14 0.93 0.00 0.00 0.00 179.25 181.04 2b21 h GLU 17 N 1.10 0.33 -0.01 0.00 5.08 -1.15 -1.49 114.58 118.45 2b21 h GLU 17 Ca 0.24 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.57 2b21 h GLU 17 Cb 0.27 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.46 2b21 h GLU 17 CO -0.01 0.28 0.00 0.87 -1.00 0.00 0.00 179.01 179.16 2b21 h LYS 18 N 0.29 0.01 -0.65 2.33 1.57 -1.25 -2.58 116.57 116.30 2b21 h LYS 18 Ca 0.09 -0.00 0.07 0.00 -1.87 0.00 0.00 60.65 58.94 2b21 h LYS 18 Cb 0.04 -0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.29 2b21 h LYS 18 CO -0.02 0.08 0.33 -0.07 -0.57 0.00 0.00 179.45 179.21 2b21 h LEU 19 N -0.07 0.46 -1.26 2.94 3.38 -1.05 0.23 115.31 119.94 2b21 h LEU 19 Ca 0.00 0.05 -0.08 0.00 0.09 0.00 0.00 57.88 57.94 2b21 h LEU 19 Cb 0.08 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 2b21 h LEU 19 CO -0.00 0.28 -0.37 1.62 0.09 0.00 0.00 178.44 180.07 2b21 h VAL 20 N 0.60 1.26 0.00 1.22 3.04 -1.21 0.23 116.25 121.38 2b21 h VAL 20 Ca 0.31 -1.26 -0.18 0.00 -1.01 0.00 0.00 66.70 64.55 2b21 h VAL 20 Cb 0.26 1.68 -0.03 0.00 -2.01 0.00 0.00 31.29 31.20 2b21 h VAL 20 CO -0.22 0.36 -0.85 -0.08 -1.01 0.00 0.00 177.57 175.77 2b21 h GLU 21 N 0.00 0.00 -0.15 4.17 4.81 -0.88 -3.00 114.58 119.53 2b21 h GLU 21 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2b21 h GLU 21 Cb 0.65 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.03 2b21 h GLU 21 CO 0.05 0.85 0.00 0.00 -0.73 0.00 0.00 179.01 179.17 2b21 n ALA 22 N -2.35 2.50 -0.65 2.92 0.00 -0.03 -4.88 120.51 118.02 2b21 n ALA 22 Ca -0.00 -0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.12 2b21 n ALA 22 Cb 0.84 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 19.24 2b21 n ALA 22 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2b21 n GLY 23 N 0.83 0.79 3.37 0.00 0.00 -1.11 -5.01 105.19 104.08 2b21 n GLY 23 Ca 0.08 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.65 2b21 n GLY 23 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2b21 s TYR 24 N -3.04 3.47 -0.26 1.61 1.51 0.77 -4.82 117.35 116.60 2b21 s TYR 24 Ca 0.00 -1.70 -0.11 0.00 -1.01 0.00 0.00 57.07 54.26 2b21 s TYR 24 Cb 0.00 -4.00 -0.12 0.00 -0.11 0.00 0.00 41.96 37.73 2b21 s TYR 24 CO 0.00 -1.19 -0.32 0.44 -1.11 0.00 0.00 175.55 173.38 2b21 n ILE 25 N 4.64 1.42 -3.03 2.71 -5.35 -1.26 -3.60 119.36 114.89 2b21 n ILE 25 Ca 0.15 -0.39 -0.25 0.00 -0.27 0.00 0.00 62.75 61.98 2b21 n ILE 25 Cb 0.47 -1.77 -0.01 0.00 -1.74 0.00 0.00 39.64 36.59 2b21 n ILE 25 CO 0.00 0.00 0.00 1.51 -1.76 0.00 0.00 176.55 176.30 2b21 s ASP 26 N -7.18 6.28 0.21 7.28 -4.77 -1.26 -4.77 116.67 112.46 2b21 s ASP 26 Ca -0.36 0.67 -0.08 0.00 -3.30 0.00 0.00 52.55 49.49 2b21 s ASP 26 Cb 0.13 -2.13 0.15 0.00 -1.09 0.00 0.00 42.92 39.98 2b21 s ASP 26 CO 0.47 -0.43 1.75 -0.26 0.70 0.00 0.00 175.17 177.41 2b21 h PHE 27 N 0.51 1.20 -1.01 2.11 0.05 -1.95 -3.15 116.94 114.70 2b21 h PHE 27 Ca -0.48 -0.12 0.07 0.00 3.82 0.00 0.00 57.97 61.26 2b21 h PHE 27 Cb 1.21 -0.35 -0.07 0.00 2.00 0.00 0.00 35.95 38.74 2b21 h PHE 27 CO 0.54 0.94 0.65 0.52 -0.18 0.00 0.00 178.31 180.79 2b21 h MET 28 N 1.12 1.13 -0.30 1.51 2.86 -1.95 0.75 114.93 120.04 2b21 h MET 28 Ca 0.24 -0.07 -0.07 0.00 -2.06 0.00 0.00 59.70 57.74 2b21 h MET 28 Cb 0.30 -0.25 -0.02 0.00 0.06 0.00 0.00 31.60 31.69 2b21 h MET 28 CO -0.01 0.75 -0.11 -0.22 1.06 0.00 0.00 176.91 178.38 2b21 h LYS 29 N 1.16 0.51 0.18 1.72 3.64 -1.95 0.49 116.57 122.32 2b21 h LYS 29 Ca 0.44 -0.14 -0.32 0.00 -1.27 0.00 0.00 60.65 59.36 2b21 h LYS 29 Cb 0.20 -0.06 0.03 0.00 -0.41 0.00 0.00 32.23 32.00 2b21 h LYS 29 CO -0.18 0.62 -1.35 0.82 -2.27 0.00 0.00 179.45 177.09 2b21 h ILE 30 N 0.47 1.28 -0.30 2.00 2.04 -1.28 -2.47 117.51 119.25 2b21 h ILE 30 Ca 0.09 -2.56 -0.04 0.00 1.00 0.00 0.00 64.86 63.35 2b21 h ILE 30 Cb 0.48 2.84 -0.02 0.00 -0.74 0.00 0.00 36.82 39.38 2b21 h ILE 30 CO 0.03 0.77 0.01 0.00 0.00 0.00 0.00 178.15 178.96 2b21 h ALA 31 N 0.24 1.45 -0.65 1.87 0.00 0.71 -2.59 119.26 120.29 2b21 h ALA 31 Ca -0.22 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.52 2b21 h ALA 31 Cb 2.03 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.68 2b21 h ALA 31 CO 0.26 0.39 0.00 0.25 0.00 0.00 0.00 179.25 180.15 2b21 n THR 32 N -4.31 0.91 -2.11 0.00 -2.24 0.14 -4.67 114.28 102.00 2b21 n THR 32 Ca 0.01 -0.95 -0.27 0.00 -2.27 0.00 0.00 64.05 60.57 2b21 n THR 32 Cb 0.22 0.59 0.08 0.00 -2.10 0.00 0.00 70.33 69.13 2b21 n THR 32 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2b21 s ALA 33 N -1.08 2.97 0.27 6.98 0.00 -0.93 -5.03 121.76 124.93 2b21 s ALA 33 Ca 0.46 -0.89 0.08 0.00 0.00 0.00 0.00 51.96 51.61 2b21 s ALA 33 Cb 0.24 -2.70 -0.04 0.00 0.00 0.00 0.00 23.12 20.62 2b21 s ALA 33 CO 0.32 -1.49 0.16 0.95 0.00 0.00 0.00 175.76 175.69 2b21 s THR 34 N -3.38 4.01 0.38 0.00 -4.23 -1.26 -5.00 115.64 106.16 2b21 s THR 34 Ca 0.62 -1.54 0.26 0.00 -1.18 0.00 0.00 61.69 59.84 2b21 s THR 34 Cb -0.10 -3.22 0.27 0.00 1.34 0.00 0.00 72.50 70.79 2b21 s THR 34 CO 0.46 -0.33 2.03 0.58 -0.54 0.00 0.00 174.62 176.82 2b21 h VAL 35 N 1.56 0.61 0.34 2.29 2.07 -1.98 -2.87 116.25 118.28 2b21 h VAL 35 Ca -0.47 -0.65 -0.02 0.00 0.82 0.00 0.00 66.70 66.39 2b21 h VAL 35 Cb 1.24 1.41 0.00 0.00 -1.52 0.00 0.00 31.29 32.43 2b21 h VAL 35 CO 0.60 0.14 -0.16 1.23 0.02 0.00 0.00 177.57 179.41 2b21 h GLY 36 N 1.01 -0.47 -0.15 2.17 0.00 -1.98 0.34 103.07 103.98 2b21 h GLY 36 Ca -0.00 0.18 0.18 0.00 0.00 0.00 0.00 47.33 47.69 2b21 h GLY 36 CO 0.02 -0.17 0.24 0.83 0.00 0.00 0.00 176.54 177.45 2b21 h GLU 37 N -0.73 0.29 0.01 4.80 5.08 -1.92 -1.66 114.58 120.46 2b21 h GLU 37 Ca -0.05 -0.02 -0.19 0.00 -1.00 0.00 0.00 59.36 58.11 2b21 h GLU 37 Cb 0.50 -0.07 0.02 0.00 0.50 0.00 0.00 28.75 29.70 2b21 h GLU 37 CO 0.08 0.19 -0.75 -0.07 -1.00 0.00 0.00 179.01 177.46 2b21 h LEU 38 N 0.30 0.64 -1.64 1.33 3.38 -1.42 -3.29 115.31 114.60 2b21 h LEU 38 Ca 0.47 -0.77 -0.01 0.00 0.09 0.00 0.00 57.88 57.66 2b21 h LEU 38 Cb 0.84 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 2b21 h LEU 38 CO -0.53 1.33 0.10 0.71 0.09 0.00 0.00 178.44 180.13 2b21 h THR 39 N 0.02 1.10 0.00 0.22 1.35 0.15 0.03 112.91 115.77 2b21 h THR 39 Ca -0.10 -0.30 0.00 0.00 -0.55 0.00 0.00 66.41 65.46 2b21 h THR 39 Cb 1.46 0.81 0.00 0.00 -1.73 0.00 0.00 68.15 68.69 2b21 h THR 39 CO 0.15 0.12 0.00 0.47 -0.25 0.00 0.00 175.52 176.00 2b21 n ASP 40 N -4.44 0.00 0.19 5.36 8.00 -0.67 -2.73 116.55 122.26 2b21 n ASP 40 Ca 0.01 -0.60 0.06 0.00 0.71 0.00 0.00 54.79 54.97 2b21 n ASP 40 Cb 0.12 0.00 0.32 0.00 -0.02 0.00 0.00 41.12 41.54 2b21 n ASP 40 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 2b21 h ILE 41 N 0.00 0.87 -1.01 0.53 1.08 -1.12 -3.49 117.51 114.37 2b21 h ILE 41 Ca 0.00 -1.56 0.00 0.00 -0.39 0.00 0.00 64.86 62.91 2b21 h ILE 41 Cb 0.00 1.96 0.00 0.00 -3.07 0.00 0.00 36.82 35.71 2b21 h ILE 41 CO 0.00 0.37 0.00 1.21 -0.69 0.00 0.00 178.15 179.04 2b21 n GLU 42 N -3.50 0.00 -0.45 2.37 4.07 -1.10 -4.80 120.64 117.21 2b21 n GLU 42 Ca -0.00 0.50 0.00 0.00 -0.06 0.00 0.00 57.16 57.60 2b21 n GLU 42 Cb 0.52 -0.01 0.00 0.00 -0.06 0.00 0.00 31.44 31.89 2b21 n GLU 42 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2b21 n GLY 43 N 0.02 0.73 3.14 8.31 0.00 -1.26 -5.02 105.19 111.10 2b21 n GLY 43 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 2b21 n GLY 43 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2b21 s ILE 44 N -2.78 2.53 0.72 -0.61 -1.09 -1.26 -5.02 121.20 113.69 2b21 s ILE 44 Ca 0.00 -1.32 -0.10 0.00 -2.23 0.00 0.00 60.65 57.00 2b21 s ILE 44 Cb 0.00 -2.37 0.04 0.00 -1.58 0.00 0.00 42.46 38.55 2b21 s ILE 44 CO 0.00 0.10 1.09 -0.94 -1.23 0.00 0.00 174.94 173.95 2b21 s SER 45 N 1.22 5.13 0.33 3.58 1.04 -1.26 -4.50 113.70 119.24 2b21 s SER 45 Ca -0.04 0.91 0.25 0.00 0.48 0.00 0.00 55.95 57.56 2b21 s SER 45 Cb -0.18 -1.63 0.71 0.00 0.10 0.00 0.00 66.02 65.02 2b21 s SER 45 CO -0.05 -1.50 1.73 1.05 0.98 0.00 0.00 173.24 175.45 2b21 h GLU 46 N -0.71 0.00 0.11 4.02 9.09 -1.94 0.12 114.58 125.27 2b21 h GLU 46 Ca -0.45 0.00 -0.01 0.00 0.05 0.00 0.00 59.36 58.95 2b21 h GLU 46 Cb 1.28 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.38 2b21 h GLU 46 CO 0.64 0.00 -0.05 -0.22 0.05 0.00 0.00 179.01 179.42 2b21 h LYS 47 N 0.00 -0.15 -0.04 1.06 3.64 -1.98 0.20 116.57 119.30 2b21 h LYS 47 Ca 0.00 0.01 -0.15 0.00 -1.27 0.00 0.00 60.65 59.24 2b21 h LYS 47 Cb 0.78 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.62 2b21 h LYS 47 CO 0.00 0.25 -0.64 0.00 -2.27 0.00 0.00 179.45 176.79 2b21 h ALA 48 N 0.22 0.85 -0.15 5.00 0.00 -1.91 -1.82 119.26 121.46 2b21 h ALA 48 Ca -0.02 -0.57 -0.02 0.00 0.00 0.00 0.00 54.91 54.30 2b21 h ALA 48 Cb 0.47 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 2b21 h ALA 48 CO 0.03 0.77 0.01 0.00 0.00 0.00 0.00 179.25 180.05 2b21 h ALA 49 N 1.23 0.20 0.00 0.00 0.00 -0.69 -1.73 119.26 118.26 2b21 h ALA 49 Ca -0.01 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.62 2b21 h ALA 49 Cb 1.15 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 2b21 h ALA 49 CO 0.09 -0.11 -0.45 0.00 0.00 0.00 0.00 179.25 178.78 2b21 h ALA 50 N 0.77 1.07 -0.28 0.00 0.00 -0.58 -2.37 119.26 117.87 2b21 h ALA 50 Ca 0.04 -0.41 -0.13 0.00 0.00 0.00 0.00 54.91 54.42 2b21 h ALA 50 Cb 0.35 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 2b21 h ALA 50 CO 0.01 0.56 -0.32 -0.22 0.00 0.00 0.00 179.25 179.28 2b21 h LYS 51 N 0.00 0.71 0.00 0.00 3.64 -1.18 -1.69 116.57 118.04 2b21 h LYS 51 Ca -0.00 -0.39 -0.11 0.00 -1.27 0.00 0.00 60.65 58.87 2b21 h LYS 51 Cb 0.90 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.73 2b21 h LYS 51 CO 0.06 1.01 -0.53 0.00 -2.27 0.00 0.00 179.45 177.72 2b21 h MET 52 N 0.46 0.00 -0.25 1.90 -0.00 -1.24 -0.86 114.93 114.94 2b21 h MET 52 Ca 0.04 0.00 -0.11 0.00 -0.00 0.00 0.00 59.70 59.63 2b21 h MET 52 Cb 0.90 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 32.50 2b21 h MET 52 CO 0.08 0.53 -0.26 0.82 -0.00 0.00 0.00 176.91 178.07 2b21 h ILE 53 N 0.00 1.31 -0.66 -0.10 2.04 -1.35 0.21 117.51 118.96 2b21 h ILE 53 Ca -0.01 -1.43 -0.05 0.00 1.00 0.00 0.00 64.86 64.37 2b21 h ILE 53 Cb 1.01 1.67 -0.03 0.00 -0.74 0.00 0.00 36.82 38.74 2b21 h ILE 53 CO 0.07 0.45 0.23 -0.03 0.00 0.00 0.00 178.15 178.86 2b21 h MET 54 N 0.33 1.02 0.26 2.37 4.05 -1.18 -2.06 114.93 119.70 2b21 h MET 54 Ca 0.04 -0.21 -0.01 0.00 -0.28 0.00 0.00 59.70 59.24 2b21 h MET 54 Cb 0.83 -0.15 0.00 0.00 -0.80 0.00 0.00 31.60 31.48 2b21 h MET 54 CO 0.06 0.87 -0.12 0.78 0.23 0.00 0.00 176.91 178.74 2b21 h GLY 55 N 0.95 -0.36 0.39 1.39 0.00 -0.95 -2.61 103.07 101.88 2b21 h GLY 55 Ca 0.22 0.13 0.15 0.00 0.00 0.00 0.00 47.33 47.83 2b21 h GLY 55 CO -0.01 -0.13 0.61 0.00 0.00 0.00 0.00 176.54 177.01 2b21 h ALA 56 N 0.28 1.66 -0.68 3.60 0.00 -0.46 -0.23 119.26 123.42 2b21 h ALA 56 Ca -0.04 0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 2b21 h ALA 56 Cb 0.33 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 2b21 h ALA 56 CO 0.06 0.06 0.16 0.00 0.00 0.00 0.00 179.25 179.53 2b21 h ARG 57 N 0.84 1.08 -0.12 0.00 3.08 -1.20 -1.97 114.38 116.10 2b21 h ARG 57 Ca 0.51 -0.25 -0.04 0.00 0.07 0.00 0.00 59.98 60.26 2b21 h ARG 57 Cb 0.68 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 30.58 2b21 h ARG 57 CO -0.28 0.96 -0.09 -0.44 -1.07 0.00 0.00 179.97 179.05 2b21 h ASP 58 N 1.03 0.28 -0.09 7.04 3.32 -0.74 0.12 116.42 127.38 2b21 h ASP 58 Ca 0.22 -0.46 0.03 0.00 0.02 0.00 0.00 57.03 56.84 2b21 h ASP 58 Cb 0.36 -0.08 -0.00 0.00 0.22 0.00 0.00 39.33 39.83 2b21 h ASP 58 CO 0.00 0.67 0.09 -0.07 -1.72 0.00 0.00 179.24 178.21 2b21 h LEU 59 N -0.12 0.00 -2.13 1.55 4.07 -1.01 0.10 115.31 117.78 2b21 h LEU 59 Ca 0.02 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.98 2b21 h LEU 59 Cb 0.59 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.33 2b21 h LEU 59 CO 0.02 0.00 0.00 0.00 -1.08 0.00 0.00 178.44 177.38 2b21 n ASP 61 N 1.35 -5.80 -3.49 0.00 2.03 0.36 -4.91 116.55 106.09 2b21 n ASP 61 Ca 0.16 -0.71 -0.37 0.00 0.52 0.00 0.00 54.79 54.40 2b21 n ASP 61 Cb 0.58 -3.01 -0.00 0.00 -0.72 0.00 0.00 41.12 37.96 2b21 n ASP 61 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2b21 n LEU 62 N -2.64 6.21 0.00 -2.67 4.32 -0.26 -4.98 117.00 116.99 2b21 n LEU 62 Ca -0.19 -5.45 0.00 0.00 -0.02 0.00 0.00 56.01 50.35 2b21 n LEU 62 Cb 0.62 -0.98 0.00 0.00 -1.62 0.00 0.00 43.42 41.43 2b21 n LEU 62 CO 0.61 2.08 0.00 0.61 -1.22 0.00 0.00 177.39 179.48 2b21 n GLY 63 N 0.15 5.58 3.78 -0.72 0.00 -1.26 -4.96 105.19 107.76 2b21 n GLY 63 Ca 0.39 -1.85 -0.37 0.00 0.00 0.00 0.00 46.02 44.19 2b21 n GLY 63 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2b21 s PHE 64 N 1.80 3.65 0.01 1.61 0.40 -1.26 -5.06 117.98 119.12 2b21 s PHE 64 Ca 0.00 1.77 0.01 0.00 -0.60 0.00 0.00 56.93 58.11 2b21 s PHE 64 Cb 0.00 -2.96 -0.01 0.00 0.51 0.00 0.00 43.02 40.56 2b21 s PHE 64 CO 0.00 0.10 -0.05 0.15 0.70 0.00 0.00 175.22 176.12 2b21 s LYS 65 N -2.07 0.38 0.12 0.44 1.02 -1.26 -5.16 119.74 113.20 2b21 s LYS 65 Ca 0.51 -0.32 0.01 0.00 0.02 0.00 0.00 55.97 56.19 2b21 s LYS 65 Cb -0.19 -0.29 -0.01 0.00 -0.52 0.00 0.00 37.83 36.82 2b21 s LYS 65 CO 0.25 0.07 0.13 -1.13 -0.92 0.00 0.00 175.35 173.75 2b21 n SER 66 N 2.54 -0.34 0.00 2.83 3.41 -1.26 -4.80 113.62 116.00 2b21 n SER 66 Ca -0.16 -1.73 0.00 0.00 -0.26 0.00 0.00 58.87 56.72 2b21 n SER 66 Cb 0.57 0.71 0.00 0.00 -0.26 0.00 0.00 64.21 65.23 2b21 n SER 66 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2b21 n GLY 67 N -0.21 2.29 0.37 5.00 0.00 -1.26 -2.05 105.19 109.32 2b21 n GLY 67 Ca 0.02 -0.33 0.14 0.00 0.00 0.00 0.00 46.02 45.84 2b21 n GLY 67 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2b21 h ILE 68 N 0.00 0.83 -0.81 -0.61 2.10 -2.02 -2.52 117.51 114.48 2b21 h ILE 68 Ca 0.00 -0.16 0.22 0.00 1.08 0.00 0.00 64.86 66.00 2b21 h ILE 68 Cb 0.00 0.34 -0.04 0.00 -1.09 0.00 0.00 36.82 36.03 2b21 h ILE 68 CO 0.00 0.08 0.57 0.44 -1.08 0.00 0.00 178.15 178.16 2b21 h ASP 69 N 0.45 0.12 -0.02 2.19 3.32 -1.81 0.33 116.42 121.00 2b21 h ASP 69 Ca 0.35 0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.38 2b21 h ASP 69 Cb 0.74 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.27 2b21 h ASP 69 CO -0.11 0.05 -0.06 -0.07 -1.72 0.00 0.00 179.24 177.32 2b21 h LEU 70 N 0.12 0.20 -0.38 1.55 3.38 -1.55 -1.96 115.31 116.67 2b21 h LEU 70 Ca 0.39 -0.03 -0.18 0.00 0.09 0.00 0.00 57.88 58.15 2b21 h LEU 70 Cb 1.38 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 42.06 2b21 h LEU 70 CO -0.05 0.30 -0.81 -0.07 0.09 0.00 0.00 178.44 177.89 2b21 h LEU 71 N 0.21 0.22 -0.69 1.67 3.38 -0.53 -3.26 115.31 116.31 2b21 h LEU 71 Ca 0.05 -0.17 -0.14 0.00 0.09 0.00 0.00 57.88 57.71 2b21 h LEU 71 Cb 0.25 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 2b21 h LEU 71 CO 0.01 0.94 -0.64 0.11 0.09 0.00 0.00 178.44 178.95 2b21 h LYS 72 N 0.10 0.08 -0.39 1.13 1.57 -1.11 -2.28 116.57 115.67 2b21 h LYS 72 Ca -0.03 -0.06 -0.08 0.00 -1.87 0.00 0.00 60.65 58.61 2b21 h LYS 72 Cb 1.41 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.72 2b21 h LYS 72 CO 0.12 0.69 -0.07 0.37 -0.57 0.00 0.00 179.45 179.99 2b21 h GLN 73 N 0.06 0.74 0.00 3.15 5.75 -1.52 -2.76 115.11 120.53 2b21 h GLN 73 Ca -0.01 -0.27 -0.01 0.00 -0.15 0.00 0.00 58.65 58.21 2b21 h GLN 73 Cb 1.13 -0.05 -0.00 0.00 1.07 0.00 0.00 27.48 29.63 2b21 h GLN 73 CO 0.09 0.87 -0.05 -0.09 -2.65 0.00 0.00 178.83 177.00 2b21 h ARG 74 N 0.55 0.00 -0.00 1.69 9.65 -1.57 -2.50 114.38 122.20 2b21 h ARG 74 Ca 0.10 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.98 2b21 h ARG 74 Cb 0.58 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.16 2b21 h ARG 74 CO 0.03 0.05 -0.09 0.43 2.80 0.00 0.00 179.97 183.19 2b21 n SER 75 N -3.25 0.10 0.06 -3.80 7.64 -0.87 -3.19 113.62 110.30 2b21 n SER 75 Ca -0.01 0.29 0.12 0.00 1.01 0.00 0.00 58.87 60.29 2b21 n SER 75 Cb 0.23 -0.35 0.48 0.00 -1.01 0.00 0.00 64.21 63.56 2b21 n SER 75 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2b21 n THR 76 N -1.46 0.46 -2.66 0.44 -2.24 -0.94 -4.52 114.28 103.35 2b21 n THR 76 Ca 0.08 -0.04 -0.43 0.00 -2.27 0.00 0.00 64.05 61.39 2b21 n THR 76 Cb 0.33 -0.69 -0.02 0.00 -2.10 0.00 0.00 70.33 67.85 2b21 n THR 76 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2b21 s VAL 77 N -3.08 4.66 0.34 2.28 1.01 -1.19 -4.90 120.40 119.53 2b21 s VAL 77 Ca 0.11 2.00 0.07 0.00 0.00 0.00 0.00 61.98 64.16 2b21 s VAL 77 Cb 0.14 -4.32 -0.02 0.00 0.00 0.00 0.00 36.38 32.18 2b21 s VAL 77 CO 0.50 -0.21 0.33 -1.66 0.00 0.00 0.00 175.10 174.06 2b21 s TRP 78 N 3.24 2.91 0.06 5.22 1.48 -1.26 -4.77 118.94 125.83 2b21 s TRP 78 Ca 0.44 -0.31 0.05 0.00 -1.06 0.00 0.00 56.10 55.23 2b21 s TRP 78 Cb -0.15 -1.86 -0.03 0.00 -1.16 0.00 0.00 33.47 30.27 2b21 s TRP 78 CO 0.07 0.13 -0.15 0.15 -4.06 0.00 0.00 176.95 173.09 2b21 s LYS 79 N -4.03 0.88 -0.15 3.25 1.02 0.10 -1.52 119.74 119.29 2b21 s LYS 79 Ca 0.42 -0.91 -0.04 0.00 0.02 0.00 0.00 55.97 55.46 2b21 s LYS 79 Cb -0.06 -0.91 -0.03 0.00 -0.52 0.00 0.00 37.83 36.31 2b21 s LYS 79 CO 0.27 0.21 -0.01 -1.17 -0.92 0.00 0.00 175.35 173.73 2b21 s LEU 80 N -1.57 3.42 0.49 3.17 2.96 0.67 -0.09 118.68 127.74 2b21 s LEU 80 Ca -0.00 -0.05 -0.21 0.00 -0.22 0.00 0.00 54.13 53.65 2b21 s LEU 80 Cb -0.09 -1.83 -0.07 0.00 0.50 0.00 0.00 46.19 44.70 2b21 s LEU 80 CO 0.02 0.20 1.11 -0.55 -1.32 0.00 0.00 176.35 175.81 2b21 s SER 81 N 0.20 6.09 0.00 3.68 0.15 -0.55 0.17 113.70 123.44 2b21 s SER 81 Ca -0.00 2.14 0.21 0.00 0.70 0.00 0.00 55.95 58.99 2b21 s SER 81 Cb -0.13 -2.58 0.07 0.00 -1.71 0.00 0.00 66.02 61.66 2b21 s SER 81 CO 0.02 -0.96 1.08 0.35 1.20 0.00 0.00 173.24 174.93 2b21 n THR 82 N -0.88 0.00 -0.36 6.45 -2.24 -1.26 -4.89 114.28 111.10 2b21 n THR 82 Ca 0.09 -0.38 0.00 0.00 -2.27 0.00 0.00 64.05 61.49 2b21 n THR 82 Cb 0.50 1.32 0.00 0.00 -2.10 0.00 0.00 70.33 70.06 2b21 n THR 82 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2b21 n SER 83 N 0.48 0.00 -4.51 3.42 7.64 -1.26 -4.73 113.62 114.66 2b21 n SER 83 Ca 0.10 0.00 -0.35 0.00 1.01 0.00 0.00 58.87 59.63 2b21 n SER 83 Cb 0.47 -0.04 -0.12 0.00 -1.01 0.00 0.00 64.21 63.52 2b21 n SER 83 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2b21 s SER 84 N -3.61 5.19 0.05 6.43 0.15 -1.26 -3.94 113.70 116.71 2b21 s SER 84 Ca 0.00 -0.10 -0.24 0.00 0.70 0.00 0.00 55.95 56.31 2b21 s SER 84 Cb 0.00 -1.90 -0.17 0.00 -1.71 0.00 0.00 66.02 62.24 2b21 s SER 84 CO 0.00 0.08 1.56 0.28 1.20 0.00 0.00 173.24 176.35 2b21 h SER 85 N 7.39 -0.02 0.02 5.45 0.02 -1.89 -1.95 113.55 122.57 2b21 h SER 85 Ca -0.36 -0.18 -0.03 0.00 -0.84 0.00 0.00 61.79 60.37 2b21 h SER 85 Cb 1.18 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.71 2b21 h SER 85 CO 0.63 0.17 -0.09 -0.33 -1.14 0.00 0.00 176.83 176.07 2b21 h GLU 86 N -0.20 0.17 -0.02 3.45 5.08 -1.82 -1.67 114.58 119.56 2b21 h GLU 86 Ca -0.00 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.30 2b21 h GLU 86 Cb 0.20 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.42 2b21 h GLU 86 CO 0.00 0.27 -0.09 1.25 -1.00 0.00 0.00 179.01 179.44 2b21 h LEU 87 N 0.17 0.11 -1.63 1.33 5.85 -1.83 -1.80 115.31 117.51 2b21 h LEU 87 Ca 0.04 -0.66 0.05 0.00 0.84 0.00 0.00 57.88 58.14 2b21 h LEU 87 Cb 0.26 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.23 2b21 h LEU 87 CO 0.01 0.75 0.32 0.44 -0.34 0.00 0.00 178.44 179.62 2b21 h ASP 88 N -0.52 0.41 0.47 1.25 3.45 -1.18 -0.53 116.42 119.76 2b21 h ASP 88 Ca -0.01 -0.00 -0.02 0.00 0.43 0.00 0.00 57.03 57.43 2b21 h ASP 88 Cb 0.75 -0.09 0.00 0.00 -0.56 0.00 0.00 39.33 39.43 2b21 h ASP 88 CO 0.02 0.27 -0.23 -1.28 -1.57 0.00 0.00 179.24 176.46 2b21 h SER 89 N 0.47 -0.53 -0.28 6.45 0.87 -1.27 0.55 113.55 119.80 2b21 h SER 89 Ca 0.20 -0.08 0.08 0.00 -1.23 0.00 0.00 61.79 60.77 2b21 h SER 89 Cb 0.20 0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 62.29 2b21 h SER 89 CO -0.05 -0.14 0.35 0.58 -0.53 0.00 0.00 176.83 177.04 2b21 h VAL 90 N -1.02 0.35 -0.00 2.23 2.07 -0.96 0.44 116.25 119.36 2b21 h VAL 90 Ca -0.06 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.46 2b21 h VAL 90 Cb 0.58 0.71 0.00 0.00 -1.52 0.00 0.00 31.29 31.06 2b21 h VAL 90 CO 0.11 0.00 -0.14 0.18 0.02 0.00 0.00 177.57 177.73 2b21 n LEU 91 N -3.62 0.23 -0.34 2.57 4.77 -0.24 -4.91 117.00 115.46 2b21 n LEU 91 Ca 0.04 0.24 -0.03 0.00 -0.03 0.00 0.00 56.01 56.23 2b21 n LEU 91 Cb 0.50 -0.34 -0.00 0.00 -2.33 0.00 0.00 43.42 41.24 2b21 n LEU 91 CO 0.25 0.05 -0.04 0.61 -1.33 0.00 0.00 177.39 176.94 2b21 n GLY 92 N 1.43 0.32 0.00 -0.72 0.00 0.16 -4.06 105.19 102.31 2b21 n GLY 92 Ca 0.09 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.32 2b21 n GLY 92 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b21 n GLY 93 N -1.36 4.17 0.00 -0.02 0.00 0.19 -5.02 105.19 103.15 2b21 n GLY 93 Ca -0.04 -0.86 0.00 0.00 0.00 0.00 0.00 46.02 45.13 2b21 n GLY 93 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b21 n GLY 94 N 0.00 -1.65 3.69 -0.02 0.00 -1.12 -4.74 105.19 101.35 2b21 n GLY 94 Ca 0.00 -1.37 -0.42 0.00 0.00 0.00 0.00 46.02 44.23 2b21 n GLY 94 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2b21 s LEU 95 N 0.00 4.36 0.11 0.99 1.43 0.13 -4.59 118.68 121.11 2b21 s LEU 95 Ca 0.00 2.47 -0.25 0.00 -1.03 0.00 0.00 54.13 55.32 2b21 s LEU 95 Cb 0.00 -3.56 -0.07 0.00 0.03 0.00 0.00 46.19 42.59 2b21 s LEU 95 CO 0.00 -0.88 0.77 -1.61 0.23 0.00 0.00 176.35 174.87 2b21 s GLU 96 N 2.57 4.54 0.67 1.70 2.02 -1.26 -0.24 118.70 128.70 2b21 s GLU 96 Ca 0.73 1.12 -0.11 0.00 0.02 0.00 0.00 54.97 56.73 2b21 s GLU 96 Cb -0.40 -3.31 -0.01 0.00 0.10 0.00 0.00 34.13 30.52 2b21 s GLU 96 CO 0.32 0.44 1.06 -1.54 0.02 0.00 0.00 175.26 175.56 2b21 s SER 97 N -0.65 5.69 -0.96 -0.19 1.04 -0.57 -3.65 113.70 114.41 2b21 s SER 97 Ca 0.37 1.39 0.00 0.00 0.48 0.00 0.00 55.95 58.20 2b21 s SER 97 Cb -0.22 -2.32 0.00 0.00 0.10 0.00 0.00 66.02 63.58 2b21 s SER 97 CO 0.25 -1.21 0.00 0.00 0.98 0.00 0.00 173.24 173.26 2b21 n GLN 98 N -2.96 -0.82 -3.73 4.02 6.02 -0.01 -4.75 117.38 115.15 2b21 n GLN 98 Ca 0.07 0.78 -0.10 0.00 -0.01 0.00 0.00 57.00 57.73 2b21 n GLN 98 Cb 0.55 -4.71 -0.06 0.00 1.02 0.00 0.00 30.24 27.04 2b21 n GLN 98 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 2b21 s SER 99 N -2.73 -0.10 -0.30 1.08 0.01 -1.24 -4.51 113.70 105.91 2b21 s SER 99 Ca 0.00 -0.37 -0.09 0.00 1.31 0.00 0.00 55.95 56.80 2b21 s SER 99 Cb 0.00 0.40 -0.01 0.00 0.21 0.00 0.00 66.02 66.62 2b21 s SER 99 CO 0.00 -0.75 0.14 -0.69 0.41 0.00 0.00 173.24 172.35 2b21 s VAL 100 N -3.44 4.56 -0.18 3.43 1.01 -1.26 -2.80 120.40 121.73 2b21 s VAL 100 Ca 0.01 -0.38 -0.06 0.00 0.00 0.00 0.00 61.98 61.55 2b21 s VAL 100 Cb 0.02 -3.30 -0.04 0.00 0.00 0.00 0.00 36.38 33.07 2b21 s VAL 100 CO -0.09 0.11 0.04 -0.89 0.00 0.00 0.00 175.10 174.26 2b21 s THR 101 N 1.61 4.50 -0.08 3.92 2.01 -0.26 -1.75 115.64 125.59 2b21 s THR 101 Ca 0.05 -0.13 0.01 0.00 0.31 0.00 0.00 61.69 61.92 2b21 s THR 101 Cb -0.17 -3.02 -0.03 0.00 0.01 0.00 0.00 72.50 69.29 2b21 s THR 101 CO 0.06 0.46 -0.08 -0.70 -0.69 0.00 0.00 174.62 173.67 2b21 s GLU 102 N 0.47 2.87 -0.36 4.92 2.12 0.14 -1.73 118.70 127.14 2b21 s GLU 102 Ca 0.01 -0.57 -0.00 0.00 0.36 0.00 0.00 54.97 54.77 2b21 s GLU 102 Cb -0.13 -2.61 0.09 0.00 0.26 0.00 0.00 34.13 31.74 2b21 s GLU 102 CO 0.01 0.58 0.10 -0.06 -0.54 0.00 0.00 175.26 175.35 2b21 s PHE 103 N -0.58 3.57 0.17 5.30 0.40 -0.45 -0.35 117.98 126.03 2b21 s PHE 103 Ca 0.09 -2.50 -0.04 0.00 -0.60 0.00 0.00 56.93 53.87 2b21 s PHE 103 Cb -0.12 -2.84 -0.05 0.00 0.51 0.00 0.00 43.02 40.52 2b21 s PHE 103 CO 0.02 -0.93 0.40 0.00 0.70 0.00 0.00 175.22 175.41 2b21 s ALA 104 N 1.08 3.78 -0.22 5.36 0.00 0.15 -2.00 121.76 129.92 2b21 s ALA 104 Ca 0.06 -0.61 -0.36 0.00 0.00 0.00 0.00 51.96 51.04 2b21 s ALA 104 Cb -0.21 -2.12 0.14 0.00 0.00 0.00 0.00 23.12 20.94 2b21 s ALA 104 CO -0.05 0.58 1.25 0.20 0.00 0.00 0.00 175.76 177.75 2b21 s GLY 105 N -2.65 -0.26 0.80 0.00 0.00 -0.55 0.42 107.32 105.07 2b21 s GLY 105 Ca 0.41 1.70 -0.11 0.00 0.00 0.00 0.00 44.72 46.72 2b21 s GLY 105 CO 0.26 0.57 1.09 -1.34 0.00 0.00 0.00 173.10 173.68 2b21 s VAL 106 N -2.30 3.22 0.07 1.40 -7.23 -1.11 -2.15 120.40 112.31 2b21 s VAL 106 Ca 0.10 0.40 -0.37 0.00 -1.81 0.00 0.00 61.98 60.29 2b21 s VAL 106 Cb -0.01 -2.95 -0.17 0.00 0.56 0.00 0.00 36.38 33.81 2b21 s VAL 106 CO -0.04 -0.52 1.31 0.49 -0.31 0.00 0.00 175.10 176.03 2b21 n PHE 107 N -3.56 1.41 -1.04 2.82 3.72 -1.26 -1.35 117.46 118.21 2b21 n PHE 107 Ca 0.08 0.69 -0.01 0.00 -0.05 0.00 0.00 57.45 58.16 2b21 n PHE 107 Cb 0.54 -2.30 -0.01 0.00 -0.94 0.00 0.00 39.48 36.77 2b21 n PHE 107 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2b21 n GLY 108 N 2.42 0.41 0.06 1.37 0.00 -1.26 -4.90 105.19 103.28 2b21 n GLY 108 Ca 0.19 -0.10 0.10 0.00 0.00 0.00 0.00 46.02 46.21 2b21 n GLY 108 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2b21 n SER 109 N -0.26 0.34 0.00 1.61 3.41 -0.45 -4.87 113.62 113.39 2b21 n SER 109 Ca -0.01 0.57 0.00 0.00 -0.26 0.00 0.00 58.87 59.17 2b21 n SER 109 Cb 0.22 -0.65 0.00 0.00 -0.26 0.00 0.00 64.21 63.52 2b21 n SER 109 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2b21 n GLY 110 N 0.32 1.15 0.40 5.00 0.00 -1.26 -4.74 105.19 106.07 2b21 n GLY 110 Ca 0.04 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.97 2b21 n GLY 110 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2b21 h LYS 111 N 1.25 -0.17 -0.87 1.61 1.57 -1.91 -0.44 116.57 117.61 2b21 h LYS 111 Ca 0.00 0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.78 2b21 h LYS 111 Cb 0.00 0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.31 2b21 h LYS 111 CO 0.00 -0.12 0.50 1.15 -0.57 0.00 0.00 179.45 180.41 2b21 h THR 112 N -0.18 1.25 -0.50 -0.16 2.02 -1.97 -2.61 112.91 110.77 2b21 h THR 112 Ca 0.18 -0.57 0.03 0.00 0.77 0.00 0.00 66.41 66.82 2b21 h THR 112 Cb 0.54 0.04 -0.04 0.00 -1.74 0.00 0.00 68.15 66.96 2b21 h THR 112 CO -0.76 0.27 0.28 1.56 0.37 0.00 0.00 175.52 177.24 2b21 h GLN 113 N 1.21 0.54 -0.67 6.66 1.08 -1.55 -0.28 115.11 122.11 2b21 h GLN 113 Ca 0.31 -0.03 -0.00 0.00 -1.45 0.00 0.00 58.65 57.47 2b21 h GLN 113 Cb -0.01 -0.12 -0.03 0.00 -0.05 0.00 0.00 27.48 27.26 2b21 h GLN 113 CO -0.05 0.36 0.40 0.82 -0.95 0.00 0.00 178.83 179.40 2b21 h ILE 114 N 0.56 1.19 -0.16 2.54 2.04 -0.90 0.40 117.51 123.17 2b21 h ILE 114 Ca 0.20 -0.42 -0.03 0.00 1.00 0.00 0.00 64.86 65.62 2b21 h ILE 114 Cb 0.05 0.26 -0.01 0.00 -0.74 0.00 0.00 36.82 36.38 2b21 h ILE 114 CO -0.11 0.20 0.00 0.24 0.00 0.00 0.00 178.15 178.48 2b21 h MET 115 N 0.92 0.28 0.17 2.37 2.86 -0.98 -1.45 114.93 119.10 2b21 h MET 115 Ca 0.24 -0.09 -0.01 0.00 -2.06 0.00 0.00 59.70 57.78 2b21 h MET 115 Cb -0.03 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.61 2b21 h MET 115 CO -0.04 0.50 -0.08 0.45 1.06 0.00 0.00 176.91 178.80 2b21 h HIS 116 N 0.03 -0.21 -0.91 -0.22 3.86 -0.48 -2.44 115.15 114.77 2b21 h HIS 116 Ca 0.05 -0.01 0.18 0.00 -1.16 0.00 0.00 60.37 59.43 2b21 h HIS 116 Cb 0.38 0.07 -0.07 0.00 1.06 0.00 0.00 27.41 28.84 2b21 h HIS 116 CO 0.03 -0.06 0.59 0.37 0.86 0.00 0.00 177.93 179.72 2b21 h GLN 117 N -0.31 0.55 -0.26 2.45 5.75 -0.20 -0.55 115.11 122.54 2b21 h GLN 117 Ca -0.02 -0.03 -0.12 0.00 -0.15 0.00 0.00 58.65 58.32 2b21 h GLN 117 Cb 0.25 -0.12 -0.01 0.00 1.07 0.00 0.00 27.48 28.66 2b21 h GLN 117 CO 0.04 0.37 -0.34 0.77 -2.65 0.00 0.00 178.83 177.01 2b21 h SER 118 N 0.57 0.60 0.13 -0.69 0.02 -0.88 0.36 113.55 113.65 2b21 h SER 118 Ca 0.48 -0.24 -0.10 0.00 -0.84 0.00 0.00 61.79 61.08 2b21 h SER 118 Cb 0.96 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 63.32 2b21 h SER 118 CO -0.22 0.89 -0.35 0.00 -1.14 0.00 0.00 176.83 176.01 2b21 h VAL 120 N 0.28 1.44 -0.03 0.00 2.07 -1.11 -3.22 116.25 115.67 2b21 h VAL 120 Ca 0.03 -1.38 0.01 0.00 0.82 0.00 0.00 66.70 66.18 2b21 h VAL 120 Cb 0.76 2.37 -0.00 0.00 -1.52 0.00 0.00 31.29 32.90 2b21 h VAL 120 CO 0.06 0.35 0.03 0.78 0.02 0.00 0.00 177.57 178.82 2b21 h ASN 121 N -0.61 0.00 0.24 0.57 2.35 -0.85 -1.56 115.58 115.72 2b21 h ASN 121 Ca -0.00 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.71 2b21 h ASN 121 Cb 0.59 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.96 2b21 h ASN 121 CO 0.00 0.00 -0.16 0.25 -1.65 0.00 0.00 177.43 175.87 2b21 h LEU 122 N 0.00 0.00 -0.69 1.61 6.46 -1.41 -2.28 115.31 119.00 2b21 h LEU 122 Ca 0.01 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.77 2b21 h LEU 122 Cb 0.08 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.01 2b21 h LEU 122 CO -0.00 0.16 0.00 0.00 -0.62 0.00 0.00 178.44 177.98 2b21 n GLN 123 N -4.08 1.48 -3.53 1.25 1.13 -0.59 -4.52 117.38 108.51 2b21 n GLN 123 Ca -0.02 -0.69 -0.41 0.00 -1.94 0.00 0.00 57.00 53.93 2b21 n GLN 123 Cb 0.24 -1.48 -0.08 0.00 0.11 0.00 0.00 30.24 29.03 2b21 n GLN 123 CO 0.00 0.00 0.00 1.21 -1.44 0.00 0.00 177.06 176.83 2b21 s ASN 124 N -1.99 5.79 0.58 1.08 2.47 -0.86 -4.95 114.94 117.06 2b21 s ASN 124 Ca 0.41 -2.07 0.31 0.00 0.42 0.00 0.00 52.86 51.92 2b21 s ASN 124 Cb 0.21 -2.03 1.41 0.00 -1.45 0.00 0.00 41.25 39.39 2b21 s ASN 124 CO 0.34 -0.66 1.77 1.55 -3.72 0.00 0.00 177.10 176.38 2b21 h PRO 125 N 8.28 0.00 0.00 0.43 0.13 -1.82 0.31 132.00 139.33 2b21 h PRO 125 Ca -0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.96 2b21 h PRO 125 Cb 1.06 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.19 2b21 h PRO 125 CO 0.85 0.00 0.00 0.93 -0.23 0.00 0.00 178.00 179.55 2b21 h GLU 126 N 0.00 0.00 -0.01 0.86 4.39 -1.92 -2.86 114.58 115.04 2b21 h GLU 126 Ca 0.36 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.06 2b21 h GLU 126 Cb 1.78 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.43 2b21 h GLU 126 CO -0.00 0.00 -0.17 1.19 -1.16 0.00 0.00 179.01 178.87 2b21 n PHE 127 N -2.51 0.00 -3.44 4.33 0.99 0.11 -4.74 117.46 112.20 2b21 n PHE 127 Ca 0.02 0.00 -0.42 0.00 -0.00 0.00 0.00 57.45 57.04 2b21 n PHE 127 Cb 0.26 -0.08 -0.10 0.00 -1.00 0.00 0.00 39.48 38.56 2b21 n PHE 127 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 2b21 s LEU 128 N -2.33 4.88 -0.16 4.37 1.02 -1.08 -1.49 118.68 123.89 2b21 s LEU 128 Ca 0.29 -0.70 -0.14 0.00 0.02 0.00 0.00 54.13 53.61 2b21 s LEU 128 Cb 0.20 -2.21 -0.05 0.00 0.02 0.00 0.00 46.19 44.15 2b21 s LEU 128 CO 0.46 -0.42 0.29 -0.36 0.02 0.00 0.00 176.35 176.34 2b21 s PHE 129 N 1.80 3.47 0.11 0.29 0.08 0.87 -4.92 117.98 119.69 2b21 s PHE 129 Ca 0.07 0.60 -0.25 0.00 0.12 0.00 0.00 56.93 57.47 2b21 s PHE 129 Cb -0.18 -2.33 0.08 0.00 -0.57 0.00 0.00 43.02 40.01 2b21 s PHE 129 CO 0.11 0.26 0.78 1.52 -0.10 0.00 0.00 175.22 177.79 2b21 s TYR 130 N 0.39 -0.36 -0.64 0.36 -0.85 -1.26 0.02 117.35 115.01 2b21 s TYR 130 Ca 0.17 0.14 -0.25 0.00 -0.52 0.00 0.00 57.07 56.60 2b21 s TYR 130 Cb -0.13 0.58 0.05 0.00 0.38 0.00 0.00 41.96 42.84 2b21 s TYR 130 CO 0.04 -0.78 1.06 0.34 -1.52 0.00 0.00 175.55 174.69 2b21 s ASP 131 N -2.70 6.24 0.00 -0.18 3.68 -1.26 -4.87 116.67 117.58 2b21 s ASP 131 Ca 0.05 -0.59 0.00 0.00 2.13 0.00 0.00 52.55 54.14 2b21 s ASP 131 Cb -0.02 -2.47 0.00 0.00 -1.45 0.00 0.00 42.92 38.98 2b21 s ASP 131 CO -0.07 -1.49 0.56 -0.62 0.13 0.00 0.00 175.17 173.68 2b21 n GLU 132 N 8.14 0.00 -0.03 4.34 1.02 -1.26 -0.28 120.64 132.56 2b21 n GLU 132 Ca 0.00 0.15 -0.05 0.00 -0.02 0.00 0.00 57.16 57.25 2b21 n GLU 132 Cb 0.47 -1.57 -0.13 0.00 -0.02 0.00 0.00 31.44 30.18 2b21 n GLU 132 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 2b21 n GLU 133 N -1.06 0.65 -0.02 3.49 4.07 -1.26 -4.37 120.64 122.14 2b21 n GLU 133 Ca 0.00 0.11 0.06 0.00 -0.06 0.00 0.00 57.16 57.27 2b21 n GLU 133 Cb 0.07 -1.67 -0.13 0.00 -0.06 0.00 0.00 31.44 29.65 2b21 n GLU 133 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2b21 n ALA 134 N -2.55 2.45 -3.91 4.31 0.00 0.62 -4.87 120.51 116.55 2b21 n ALA 134 Ca -0.20 -0.51 -0.29 0.00 0.00 0.00 0.00 53.44 52.44 2b21 n ALA 134 Cb 0.99 -0.49 -0.16 0.00 0.00 0.00 0.00 19.45 19.78 2b21 n ALA 134 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2b21 s VAL 135 N -3.04 1.32 0.79 0.00 1.01 -0.17 -4.74 120.40 115.58 2b21 s VAL 135 Ca -0.06 -0.97 -0.11 0.00 0.00 0.00 0.00 61.98 60.84 2b21 s VAL 135 Cb 0.10 -1.57 0.06 0.00 0.00 0.00 0.00 36.38 34.97 2b21 s VAL 135 CO 0.69 -0.02 1.09 -0.94 0.00 0.00 0.00 175.10 175.92 2b21 s SER 136 N 1.51 4.52 0.24 3.32 1.04 -1.26 -4.20 113.70 118.87 2b21 s SER 136 Ca -0.03 1.46 -0.04 0.00 0.48 0.00 0.00 55.95 57.82 2b21 s SER 136 Cb -0.17 -2.21 0.28 0.00 0.10 0.00 0.00 66.02 64.01 2b21 s SER 136 CO -0.07 -1.97 1.75 0.11 0.98 0.00 0.00 173.24 174.04 2b21 h LYS 137 N -1.09 0.89 -0.11 4.02 1.57 -1.97 -2.94 116.57 116.94 2b21 h LYS 137 Ca -0.46 -0.23 -0.03 0.00 -1.87 0.00 0.00 60.65 58.06 2b21 h LYS 137 Cb 1.25 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 33.45 2b21 h LYS 137 CO 0.57 0.85 -0.06 0.78 -0.57 0.00 0.00 179.45 181.02 2b21 h GLY 138 N 1.00 0.17 2.00 3.86 0.00 -1.95 -2.21 103.07 105.93 2b21 h GLY 138 Ca 0.17 -0.09 -0.04 0.00 0.00 0.00 0.00 47.33 47.37 2b21 h GLY 138 CO 0.01 0.08 -0.21 -2.09 0.00 0.00 0.00 176.54 174.34 2b21 h GLU 139 N 0.16 0.00 -0.15 4.80 4.81 -1.90 -2.68 114.58 119.62 2b21 h GLU 139 Ca 0.04 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.21 2b21 h GLU 139 Cb 0.21 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.56 2b21 h GLU 139 CO 0.01 0.21 -0.16 1.33 -0.73 0.00 0.00 179.01 179.66 2b21 n VAL 140 N -3.55 2.24 -3.45 0.32 0.24 -0.94 -4.99 118.33 108.20 2b21 n VAL 140 Ca -0.01 -2.62 -0.38 0.00 -2.04 0.00 0.00 64.34 59.30 2b21 n VAL 140 Cb 0.36 -0.27 -0.06 0.00 -1.47 0.00 0.00 33.84 32.40 2b21 n VAL 140 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2b21 s ALA 141 N -3.08 3.61 -1.24 2.33 0.00 -0.88 -4.19 121.76 118.32 2b21 s ALA 141 Ca 0.39 -0.25 -0.01 0.00 0.00 0.00 0.00 51.96 52.09 2b21 s ALA 141 Cb 0.35 -2.47 -0.00 0.00 0.00 0.00 0.00 23.12 21.00 2b21 s ALA 141 CO 0.00 0.26 0.85 1.04 0.00 0.00 0.00 175.76 177.92 2b21 n GLN 142 N 2.70 -5.41 -2.20 0.00 6.02 -1.26 -4.86 117.38 112.37 2b21 n GLN 142 Ca -0.11 0.73 -0.40 0.00 -0.01 0.00 0.00 57.00 57.21 2b21 n GLN 142 Cb 0.52 -5.50 -0.02 0.00 1.02 0.00 0.00 30.24 26.26 2b21 n GLN 142 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 2b21 s PRO 143 N -5.60 4.28 0.15 -1.09 0.04 -1.26 -4.31 135.00 127.20 2b21 s PRO 143 Ca 0.04 2.06 0.08 0.00 0.04 0.00 0.00 61.00 63.23 2b21 s PRO 143 Cb -0.01 -2.96 -0.04 0.00 0.04 0.00 0.00 34.50 31.53 2b21 s PRO 143 CO 0.77 -0.20 -0.18 0.15 0.04 0.00 0.00 177.00 177.58 2b21 s LYS 144 N -1.91 1.22 0.14 4.56 1.02 -0.20 -4.90 119.74 119.68 2b21 s LYS 144 Ca 0.51 -1.34 0.10 0.00 0.02 0.00 0.00 55.97 55.26 2b21 s LYS 144 Cb -0.36 -1.31 -0.04 0.00 -0.52 0.00 0.00 37.83 35.60 2b21 s LYS 144 CO 0.47 0.27 -0.22 0.00 -0.92 0.00 0.00 175.35 174.96 2b21 s ALA 145 N -1.88 2.55 -0.12 5.17 0.00 0.41 -0.87 121.76 127.03 2b21 s ALA 145 Ca 0.13 -1.46 0.03 0.00 0.00 0.00 0.00 51.96 50.66 2b21 s ALA 145 Cb -0.07 -0.49 0.01 0.00 0.00 0.00 0.00 23.12 22.57 2b21 s ALA 145 CO 0.06 0.53 -0.22 0.08 0.00 0.00 0.00 175.76 176.22 2b21 s VAL 146 N -1.24 1.95 -0.26 0.00 1.01 0.11 0.89 120.40 122.86 2b21 s VAL 146 Ca 0.17 -0.94 0.03 0.00 0.00 0.00 0.00 61.98 61.24 2b21 s VAL 146 Cb -0.10 -1.72 0.06 0.00 0.00 0.00 0.00 36.38 34.63 2b21 s VAL 146 CO 0.09 0.53 -0.09 -0.47 0.00 0.00 0.00 175.10 175.16 2b21 s TYR 147 N 0.63 3.10 -0.52 5.22 5.04 0.24 0.23 117.35 131.29 2b21 s TYR 147 Ca -0.12 -2.24 -0.18 0.00 -2.44 0.00 0.00 57.07 52.09 2b21 s TYR 147 Cb -0.16 -1.91 0.08 0.00 0.35 0.00 0.00 41.96 40.31 2b21 s TYR 147 CO 0.03 -0.86 0.58 0.42 -1.34 0.00 0.00 175.55 174.38 2b21 s ILE 148 N 1.16 4.96 -0.42 3.14 1.01 0.47 -0.34 121.20 131.18 2b21 s ILE 148 Ca -0.07 -0.80 -0.19 0.00 0.00 0.00 0.00 60.65 59.60 2b21 s ILE 148 Cb -0.20 -4.31 0.02 0.00 0.01 0.00 0.00 42.46 37.99 2b21 s ILE 148 CO -0.06 -0.83 0.52 -0.62 0.00 0.00 0.00 174.94 173.95 2b21 s ASP 149 N 2.94 6.25 -0.04 3.58 2.15 0.36 -1.42 116.67 130.49 2b21 s ASP 149 Ca 0.11 -0.47 0.16 0.00 0.43 0.00 0.00 52.55 52.79 2b21 s ASP 149 Cb -0.22 -2.26 -0.21 0.00 -0.30 0.00 0.00 42.92 39.93 2b21 s ASP 149 CO 0.09 -0.63 0.57 0.41 -0.17 0.00 0.00 175.17 175.44 2b21 n THR 150 N 5.58 1.28 0.03 1.71 -1.04 0.24 -0.58 114.28 121.49 2b21 n THR 150 Ca -0.05 -0.75 -0.03 0.00 -2.04 0.00 0.00 64.05 61.19 2b21 n THR 150 Cb 0.48 -0.71 -0.09 0.00 -1.82 0.00 0.00 70.33 68.18 2b21 n THR 150 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 2b21 h GLU 151 N 0.00 0.00 0.00 -2.82 4.39 -1.82 -3.45 114.58 110.89 2b21 h GLU 151 Ca -0.28 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.42 2b21 h GLU 151 Cb 1.83 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.48 2b21 h GLU 151 CO 0.05 0.40 0.00 0.41 -1.16 0.00 0.00 179.01 178.71 2b21 n GLY 152 N 1.42 0.78 1.34 -3.84 0.00 -1.26 -4.98 105.19 98.65 2b21 n GLY 152 Ca -0.10 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.35 2b21 n GLY 152 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2b21 n THR 153 N -2.57 2.58 -2.56 2.61 -2.24 -1.26 -4.96 114.28 105.88 2b21 n THR 153 Ca 0.00 -2.01 -0.42 0.00 -2.27 0.00 0.00 64.05 59.35 2b21 n THR 153 Cb 0.07 -0.31 -0.03 0.00 -2.10 0.00 0.00 70.33 67.96 2b21 n THR 153 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 2b21 s PHE 154 N -2.99 3.39 -0.32 4.78 5.36 -1.26 -5.00 117.98 121.93 2b21 s PHE 154 Ca 0.47 1.41 0.03 0.00 -0.96 0.00 0.00 56.93 57.88 2b21 s PHE 154 Cb 0.39 -3.31 0.10 0.00 -0.34 0.00 0.00 43.02 39.86 2b21 s PHE 154 CO 0.08 -0.79 0.05 1.03 -1.46 0.00 0.00 175.22 174.13 2b21 s ARG 155 N 1.84 1.35 0.52 10.12 1.81 -1.26 -4.98 118.95 128.36 2b21 s ARG 155 Ca 0.53 -1.62 0.22 0.00 -1.72 0.00 0.00 55.73 53.15 2b21 s ARG 155 Cb -0.23 -2.88 1.34 0.00 -0.45 0.00 0.00 34.95 32.73 2b21 s ARG 155 CO 0.22 -0.91 2.03 -1.00 -0.68 0.00 0.00 175.30 174.96 2b21 h PRO 156 N 7.75 0.04 -0.60 3.54 0.13 -2.00 -0.24 132.00 140.62 2b21 h PRO 156 Ca -0.08 -0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.01 2b21 h PRO 156 Cb 1.02 -0.01 -0.03 0.00 0.13 0.00 0.00 31.00 32.12 2b21 h PRO 156 CO 0.50 0.02 0.22 0.93 -0.23 0.00 0.00 178.00 179.44 2b21 h GLU 157 N 0.04 0.91 -0.05 0.86 3.07 -2.00 -1.64 114.58 115.77 2b21 h GLU 157 Ca 0.20 -0.18 -0.05 0.00 -0.50 0.00 0.00 59.36 58.84 2b21 h GLU 157 Cb 0.76 -0.14 -0.01 0.00 -0.84 0.00 0.00 28.75 28.52 2b21 h GLU 157 CO -0.01 0.79 -0.19 -0.09 -1.40 0.00 0.00 179.01 178.12 2b21 h ARG 158 N 0.83 0.08 -0.15 2.33 9.65 -1.48 -1.03 114.38 124.62 2b21 h ARG 158 Ca 0.20 -0.02 -0.04 0.00 -1.10 0.00 0.00 59.98 59.02 2b21 h ARG 158 Cb 0.24 -0.01 -0.00 0.00 -1.39 0.00 0.00 29.97 28.80 2b21 h ARG 158 CO -0.01 0.27 -0.05 0.82 2.80 0.00 0.00 179.97 183.80 2b21 h ILE 159 N 0.08 1.30 -0.42 1.20 1.08 -0.97 -1.68 117.51 118.10 2b21 h ILE 159 Ca 0.02 -1.04 0.02 0.00 -0.39 0.00 0.00 64.86 63.46 2b21 h ILE 159 Cb 0.38 1.67 -0.03 0.00 -3.07 0.00 0.00 36.82 35.77 2b21 h ILE 159 CO 0.03 0.31 0.25 0.24 -0.69 0.00 0.00 178.15 178.29 2b21 h MET 160 N -0.01 0.50 -0.33 2.37 2.86 -0.82 -0.13 114.93 119.37 2b21 h MET 160 Ca 0.04 -0.03 -0.04 0.00 -2.06 0.00 0.00 59.70 57.61 2b21 h MET 160 Cb 0.50 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 32.03 2b21 h MET 160 CO 0.02 0.33 0.07 0.37 1.06 0.00 0.00 176.91 178.76 2b21 h GLN 161 N 0.51 0.54 -0.77 1.72 4.15 -1.19 0.12 115.11 120.19 2b21 h GLN 161 Ca 0.17 -0.14 -0.05 0.00 0.77 0.00 0.00 58.65 59.40 2b21 h GLN 161 Cb -0.00 -0.07 -0.03 0.00 0.21 0.00 0.00 27.48 27.59 2b21 h GLN 161 CO -0.07 0.61 0.30 0.52 -1.93 0.00 0.00 178.83 178.26 2b21 h MET 162 N 0.38 1.16 0.15 1.69 2.86 -1.15 -2.66 114.93 117.36 2b21 h MET 162 Ca 0.10 -0.22 -0.01 0.00 -2.06 0.00 0.00 59.70 57.52 2b21 h MET 162 Cb 0.32 -0.19 0.00 0.00 0.06 0.00 0.00 31.60 31.80 2b21 h MET 162 CO 0.00 0.95 -0.07 0.00 1.06 0.00 0.00 176.91 178.85 2b21 h ALA 163 N 1.19 -0.20 -0.35 6.32 0.00 -0.73 -3.07 119.26 122.42 2b21 h ALA 163 Ca 0.26 -0.15 0.07 0.00 0.00 0.00 0.00 54.91 55.09 2b21 h ALA 163 Cb 0.23 0.08 -0.07 0.00 0.00 0.00 0.00 17.79 18.03 2b21 h ALA 163 CO -0.02 -0.48 -0.11 1.05 0.00 0.00 0.00 179.25 179.69 2b21 h GLU 164 N -0.46 -0.03 0.00 0.00 4.11 -0.68 0.12 114.58 117.63 2b21 h GLU 164 Ca -0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.41 2b21 h GLU 164 Cb 0.37 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.62 2b21 h GLU 164 CO 0.03 -0.02 0.00 0.72 0.07 0.00 0.00 179.01 179.81 2b21 n HIS 165 N -5.30 0.12 0.70 2.06 8.25 -1.01 -1.16 115.22 118.88 2b21 n HIS 165 Ca 0.01 0.06 0.08 0.00 -0.26 0.00 0.00 57.72 57.61 2b21 n HIS 165 Cb 0.22 -0.59 -0.10 0.00 1.12 0.00 0.00 29.99 30.63 2b21 n HIS 165 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2b21 n ALA 166 N -1.54 4.01 -0.06 -1.41 0.00 0.29 -4.97 120.51 116.82 2b21 n ALA 166 Ca 0.01 -0.47 0.00 0.00 0.00 0.00 0.00 53.44 52.98 2b21 n ALA 166 Cb 0.06 -0.61 0.00 0.00 0.00 0.00 0.00 19.45 18.91 2b21 n ALA 166 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2b21 n GLY 167 N 1.41 1.02 3.82 0.00 0.00 -0.31 -5.04 105.19 106.09 2b21 n GLY 167 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.72 2b21 n GLY 167 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2b21 s ILE 168 N -2.43 4.42 -0.29 -0.61 1.01 -0.85 -4.97 121.20 117.48 2b21 s ILE 168 Ca 0.00 1.44 -0.28 0.00 0.00 0.00 0.00 60.65 61.81 2b21 s ILE 168 Cb 0.00 -3.61 0.01 0.00 0.01 0.00 0.00 42.46 38.87 2b21 s ILE 168 CO 0.00 -0.35 1.01 -0.62 0.00 0.00 0.00 174.94 174.98 2b21 s ASP 169 N -2.26 6.93 0.16 3.58 2.15 -1.26 -3.55 116.67 122.41 2b21 s ASP 169 Ca 0.61 1.08 -0.19 0.00 0.43 0.00 0.00 52.55 54.48 2b21 s ASP 169 Cb -0.09 -2.51 0.08 0.00 -0.30 0.00 0.00 42.92 40.09 2b21 s ASP 169 CO 0.15 -0.76 1.65 1.23 -0.17 0.00 0.00 175.17 177.27 2b21 h GLY 170 N 9.76 0.10 1.49 2.66 0.00 -1.87 -1.13 103.07 114.08 2b21 h GLY 170 Ca -0.21 0.21 0.07 0.00 0.00 0.00 0.00 47.33 47.41 2b21 h GLY 170 CO 0.99 -0.18 0.18 -1.61 0.00 0.00 0.00 176.54 175.92 2b21 h GLN 171 N -0.11 0.00 -0.14 4.80 5.75 -1.94 0.72 115.11 124.18 2b21 h GLN 171 Ca 0.18 0.00 -0.10 0.00 -0.15 0.00 0.00 58.65 58.58 2b21 h GLN 171 Cb 0.38 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.92 2b21 h GLN 171 CO -0.42 0.00 -0.35 1.15 -2.65 0.00 0.00 178.83 176.56 2b21 h THR 172 N 0.00 1.29 -0.17 2.39 2.02 -1.61 -0.56 112.91 116.26 2b21 h THR 172 Ca 0.12 -1.39 -0.08 0.00 0.77 0.00 0.00 66.41 65.83 2b21 h THR 172 Cb 0.49 1.57 -0.00 0.00 -1.74 0.00 0.00 68.15 68.47 2b21 h THR 172 CO -0.00 0.42 -0.20 0.58 0.37 0.00 0.00 175.52 176.69 2b21 h VAL 173 N 0.25 1.34 -0.96 3.16 2.07 -0.63 -2.81 116.25 118.67 2b21 h VAL 173 Ca 0.03 -1.38 -0.00 0.00 0.82 0.00 0.00 66.70 66.17 2b21 h VAL 173 Cb 0.74 1.84 -0.05 0.00 -1.52 0.00 0.00 31.29 32.31 2b21 h VAL 173 CO 0.06 0.42 0.60 -0.07 0.02 0.00 0.00 177.57 178.59 2b21 h LEU 174 N 0.09 1.14 -1.61 2.57 4.07 -1.16 -1.84 115.31 118.57 2b21 h LEU 174 Ca 0.02 -0.06 -0.04 0.00 0.08 0.00 0.00 57.88 57.89 2b21 h LEU 174 Cb 0.75 -0.29 -0.01 0.00 1.08 0.00 0.00 40.66 42.20 2b21 h LEU 174 CO 0.05 0.86 -0.17 0.44 -1.08 0.00 0.00 178.44 178.54 2b21 h ASP 175 N 1.32 0.00 -0.37 -0.43 3.32 -1.07 -3.04 116.42 116.15 2b21 h ASP 175 Ca 0.35 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 57.26 2b21 h ASP 175 Cb -0.08 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 39.38 2b21 h ASP 175 CO -0.07 0.17 0.01 0.59 -1.72 0.00 0.00 179.24 178.22 2b21 n ASN 176 N -3.56 3.10 -3.85 6.45 4.13 -0.74 -4.91 115.26 115.89 2b21 n ASN 176 Ca -0.01 -3.48 -0.25 0.00 1.68 0.00 0.00 54.58 52.52 2b21 n ASN 176 Cb 0.31 -0.62 -0.17 0.00 -1.54 0.00 0.00 39.78 37.76 2b21 n ASN 176 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 2b21 s THR 177 N -3.10 0.72 -0.14 3.41 2.01 -0.94 -0.44 115.64 117.16 2b21 s THR 177 Ca 0.45 -0.10 -0.16 0.00 0.31 0.00 0.00 61.69 62.19 2b21 s THR 177 Cb 0.39 -0.80 -0.04 0.00 0.01 0.00 0.00 72.50 72.06 2b21 s THR 177 CO 0.04 0.31 0.38 -0.36 -0.69 0.00 0.00 174.62 174.31 2b21 s PHE 178 N 1.77 3.49 -0.12 4.92 0.40 0.26 -4.91 117.98 123.80 2b21 s PHE 178 Ca 0.04 0.75 0.02 0.00 -0.60 0.00 0.00 56.93 57.14 2b21 s PHE 178 Cb -0.13 -2.44 -0.00 0.00 0.51 0.00 0.00 43.02 40.96 2b21 s PHE 178 CO -0.06 0.22 -0.20 0.08 0.70 0.00 0.00 175.22 175.96 2b21 s VAL 179 N 0.50 2.43 -0.15 -0.44 1.01 -1.26 0.82 120.40 123.30 2b21 s VAL 179 Ca 0.21 -0.88 0.00 0.00 0.00 0.00 0.00 61.98 61.31 2b21 s VAL 179 Cb -0.14 -1.97 0.02 0.00 0.00 0.00 0.00 36.38 34.29 2b21 s VAL 179 CO 0.07 0.54 -0.14 0.00 0.00 0.00 0.00 175.10 175.58 2b21 s ALA 180 N 0.42 1.88 -0.38 5.51 0.00 0.53 -4.97 121.76 124.75 2b21 s ALA 180 Ca -0.14 -0.94 -0.24 0.00 0.00 0.00 0.00 51.96 50.63 2b21 s ALA 180 Cb -0.17 -1.08 0.01 0.00 0.00 0.00 0.00 23.12 21.89 2b21 s ALA 180 CO 0.06 -0.42 0.84 0.50 0.00 0.00 0.00 175.76 176.74 2b21 s ARG 181 N 1.47 3.72 -0.14 0.00 6.06 -1.26 -0.49 118.95 128.32 2b21 s ARG 181 Ca 0.04 0.33 -0.07 0.00 -2.50 0.00 0.00 55.73 53.54 2b21 s ARG 181 Cb -0.13 -3.83 -0.04 0.00 0.06 0.00 0.00 34.95 31.01 2b21 s ARG 181 CO -0.11 -0.94 0.10 0.00 -2.50 0.00 0.00 175.30 171.85 2b21 s ALA 182 N 3.30 3.65 -1.38 6.12 0.00 0.25 -4.97 121.76 128.73 2b21 s ALA 182 Ca 0.34 -0.70 0.15 0.00 0.00 0.00 0.00 51.96 51.75 2b21 s ALA 182 Cb -0.12 -1.92 0.00 0.00 0.00 0.00 0.00 23.12 21.08 2b21 s ALA 182 CO 0.19 0.43 0.82 0.66 0.00 0.00 0.00 175.76 177.86 2b21 n TYR 183 N 2.64 0.00 -3.82 0.00 4.01 -1.26 -4.33 117.16 114.40 2b21 n TYR 183 Ca -0.18 0.00 -0.06 0.00 -0.16 0.00 0.00 57.90 57.50 2b21 n TYR 183 Cb 0.54 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.55 2b21 n TYR 183 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 2b21 s ASN 184 N -1.75 -0.24 0.47 7.72 4.22 -1.26 -5.02 114.94 119.08 2b21 s ASN 184 Ca 0.13 -0.54 0.13 0.00 -2.14 0.00 0.00 52.86 50.43 2b21 s ASN 184 Cb 0.12 0.66 1.10 0.00 1.28 0.00 0.00 41.25 44.42 2b21 s ASN 184 CO 0.36 -1.23 2.08 0.77 -2.04 0.00 0.00 177.10 177.05 2b21 h SER 185 N 2.00 0.21 -0.08 3.54 4.64 -1.96 -0.91 113.55 120.99 2b21 h SER 185 Ca -0.21 -0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.10 2b21 h SER 185 Cb 1.25 -0.05 -0.00 0.00 -0.31 0.00 0.00 62.40 63.28 2b21 h SER 185 CO 0.24 0.15 0.02 0.44 -0.87 0.00 0.00 176.83 176.81 2b21 h ASP 186 N 0.25 0.12 -0.27 4.97 3.32 -1.98 0.11 116.42 122.94 2b21 h ASP 186 Ca 0.11 -0.24 -0.02 0.00 0.02 0.00 0.00 57.03 56.89 2b21 h ASP 186 Cb 0.12 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 2b21 h ASP 186 CO -0.02 0.34 0.09 0.24 -1.72 0.00 0.00 179.24 178.17 2b21 h MET 187 N -0.09 0.42 -0.52 3.56 2.86 -1.89 0.33 114.93 119.59 2b21 h MET 187 Ca 0.02 -0.09 0.09 0.00 -2.06 0.00 0.00 59.70 57.67 2b21 h MET 187 Cb 0.26 -0.06 -0.08 0.00 0.06 0.00 0.00 31.60 31.78 2b21 h MET 187 CO 0.00 0.47 0.08 0.37 1.06 0.00 0.00 176.91 178.89 2b21 h GLN 188 N 0.28 0.20 -0.23 1.72 4.15 -1.05 0.25 115.11 120.44 2b21 h GLN 188 Ca 0.09 -0.01 -0.06 0.00 0.77 0.00 0.00 58.65 59.44 2b21 h GLN 188 Cb 0.22 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 27.86 2b21 h GLN 188 CO -0.00 0.13 -0.09 0.52 -1.93 0.00 0.00 178.83 177.46 2b21 h MET 189 N 0.21 0.46 -0.29 1.69 2.86 -0.53 -2.73 114.93 116.59 2b21 h MET 189 Ca 0.27 -0.19 -0.01 0.00 -2.06 0.00 0.00 59.70 57.71 2b21 h MET 189 Cb 0.38 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.01 2b21 h MET 189 CO -0.37 0.72 0.16 1.25 1.06 0.00 0.00 176.91 179.73 2b21 h LEU 190 N 0.18 0.37 -0.99 1.22 5.85 -0.42 -1.45 115.31 120.07 2b21 h LEU 190 Ca 0.05 -0.09 0.13 0.00 0.84 0.00 0.00 57.88 58.81 2b21 h LEU 190 Cb 0.57 -0.09 -0.09 0.00 0.37 0.00 0.00 40.66 41.42 2b21 h LEU 190 CO 0.03 0.35 0.62 -0.26 -0.34 0.00 0.00 178.44 178.84 2b21 h PHE 191 N 0.35 1.12 -0.40 1.25 0.05 -0.54 0.88 116.94 119.65 2b21 h PHE 191 Ca 0.10 0.03 -0.03 0.00 3.82 0.00 0.00 57.97 61.90 2b21 h PHE 191 Cb 0.07 -0.35 -0.02 0.00 2.00 0.00 0.00 35.95 37.65 2b21 h PHE 191 CO -0.03 0.41 0.14 0.00 -0.18 0.00 0.00 178.31 178.65 2b21 h ALA 192 N 1.55 0.52 0.00 2.45 0.00 -1.07 -2.64 119.26 120.07 2b21 h ALA 192 Ca 0.50 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 55.18 2b21 h ALA 192 Cb 0.54 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 2b21 h ALA 192 CO -0.28 0.15 -0.35 0.93 0.00 0.00 0.00 179.25 179.70 2b21 h GLU 193 N 0.50 0.00 -0.01 0.00 5.08 -0.19 -2.62 114.58 117.34 2b21 h GLU 193 Ca 0.13 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 2b21 h GLU 193 Cb 0.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.49 2b21 h GLU 193 CO -0.01 0.35 0.00 1.63 -1.00 0.00 0.00 179.01 179.98 2b21 n LYS 194 N -3.89 1.07 0.18 2.33 5.02 0.19 -3.26 118.16 119.80 2b21 n LYS 194 Ca -0.01 -0.10 0.05 0.00 -2.02 0.00 0.00 58.31 56.23 2b21 n LYS 194 Cb 0.41 -1.36 0.33 0.00 -0.02 0.00 0.00 35.03 34.39 2b21 n LYS 194 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 2b21 h ILE 195 N 0.21 0.93 -0.26 -0.18 2.04 -1.31 -2.38 117.51 116.56 2b21 h ILE 195 Ca 0.00 -1.55 -0.03 0.00 1.00 0.00 0.00 64.86 64.28 2b21 h ILE 195 Cb 0.05 1.93 -0.01 0.00 -0.74 0.00 0.00 36.82 38.04 2b21 h ILE 195 CO 0.00 0.38 0.02 -0.08 0.00 0.00 0.00 178.15 178.47 2b21 h GLU 196 N 0.00 0.39 -0.50 2.37 4.81 -1.77 -2.36 114.58 117.52 2b21 h GLU 196 Ca -0.00 -0.06 -0.09 0.00 -0.13 0.00 0.00 59.36 59.07 2b21 h GLU 196 Cb 0.90 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 30.20 2b21 h GLU 196 CO 0.05 0.40 -0.04 -0.44 -0.73 0.00 0.00 179.01 178.25 2b21 h ASP 197 N 0.38 0.90 -0.24 1.04 3.32 -1.66 -1.83 116.42 118.33 2b21 h ASP 197 Ca 0.09 -0.33 -0.00 0.00 0.02 0.00 0.00 57.03 56.81 2b21 h ASP 197 Cb 0.22 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 2b21 h ASP 197 CO 0.00 1.01 0.14 -0.07 -1.72 0.00 0.00 179.24 178.60 2b21 h LEU 198 N 0.77 0.31 -0.05 1.55 3.38 -1.42 -1.22 115.31 118.64 2b21 h LEU 198 Ca 0.14 -0.01 -0.12 0.00 0.09 0.00 0.00 57.88 57.97 2b21 h LEU 198 Cb 0.57 -0.08 0.01 0.00 0.09 0.00 0.00 40.66 41.25 2b21 h LEU 198 CO 0.03 0.25 -0.44 0.40 0.09 0.00 0.00 178.44 178.77 2b21 h ILE 199 N 0.36 1.43 0.00 1.22 2.04 -1.21 -1.50 117.51 119.84 2b21 h ILE 199 Ca 0.09 -1.89 0.00 0.00 1.00 0.00 0.00 64.86 64.07 2b21 h ILE 199 Cb 0.01 2.44 0.00 0.00 -0.74 0.00 0.00 36.82 38.53 2b21 h ILE 199 CO -0.02 0.55 0.00 0.00 0.00 0.00 0.00 178.15 178.68 2b21 n GLN 200 N -4.33 0.05 -0.13 2.37 10.64 -0.72 -0.62 117.38 124.65 2b21 n GLN 200 Ca -0.09 0.35 0.10 0.00 -1.83 0.00 0.00 57.00 55.53 2b21 n GLN 200 Cb 0.58 -1.61 0.30 0.00 -0.86 0.00 0.00 30.24 28.65 2b21 n GLN 200 CO 0.00 0.00 0.00 0.39 -1.83 0.00 0.00 177.06 175.62 2b21 n GLU 201 N -1.70 1.92 0.00 2.61 1.02 -0.50 -4.91 120.64 119.08 2b21 n GLU 201 Ca 0.02 -1.40 0.00 0.00 -0.02 0.00 0.00 57.16 55.77 2b21 n GLU 201 Cb 0.15 -1.40 0.00 0.00 -0.02 0.00 0.00 31.44 30.17 2b21 n GLU 201 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2b21 n GLY 202 N 1.21 0.35 3.66 0.62 0.00 0.21 -5.06 105.19 106.18 2b21 n GLY 202 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 2b21 n GLY 202 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2b21 s ASN 203 N -2.65 7.02 -1.38 1.61 0.01 -0.58 -4.95 114.94 114.02 2b21 s ASN 203 Ca 0.00 1.27 -0.15 0.00 -0.71 0.00 0.00 52.86 53.27 2b21 s ASN 203 Cb 0.00 -2.49 0.02 0.00 0.41 0.00 0.00 41.25 39.19 2b21 s ASN 203 CO 0.00 -0.51 2.16 -3.20 -1.51 0.00 0.00 177.10 174.03 2b21 n ASN 204 N 5.67 3.83 -4.64 -1.22 5.15 -1.26 -4.12 115.26 118.67 2b21 n ASN 204 Ca 0.08 -2.83 -0.43 0.00 -0.60 0.00 0.00 54.58 50.80 2b21 n ASN 204 Cb 0.48 -1.62 -0.03 0.00 -0.53 0.00 0.00 39.78 38.08 2b21 n ASN 204 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2b21 s ILE 205 N 3.53 3.46 0.00 -1.44 -1.09 -1.26 -1.03 121.20 123.37 2b21 s ILE 205 Ca 0.49 0.53 0.00 0.00 -2.23 0.00 0.00 60.65 59.44 2b21 s ILE 205 Cb 0.13 -3.42 0.00 0.00 -1.58 0.00 0.00 42.46 37.59 2b21 s ILE 205 CO -0.05 -0.13 0.16 0.29 -1.23 0.00 0.00 174.94 173.97 2b21 n LYS 206 N 7.61 3.70 -3.76 2.79 4.76 -0.05 -4.74 118.16 128.47 2b21 n LYS 206 Ca 0.20 -0.16 -0.15 0.00 -2.87 0.00 0.00 58.31 55.33 2b21 n LYS 206 Cb 0.44 -0.62 -0.16 0.00 -1.84 0.00 0.00 35.03 32.85 2b21 n LYS 206 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 2b21 s LEU 207 N -1.15 0.93 -0.07 -0.35 2.96 -1.16 -1.24 118.68 118.60 2b21 s LEU 207 Ca 0.00 0.09 0.02 0.00 -0.22 0.00 0.00 54.13 54.03 2b21 s LEU 207 Cb 0.00 0.01 0.01 0.00 0.50 0.00 0.00 46.19 46.71 2b21 s LEU 207 CO 0.00 -0.14 -0.14 -0.69 -1.32 0.00 0.00 176.35 174.06 2b21 s VAL 208 N 1.19 1.27 -0.06 1.68 1.01 0.24 0.05 120.40 125.79 2b21 s VAL 208 Ca -0.08 -0.56 0.06 0.00 0.00 0.00 0.00 61.98 61.40 2b21 s VAL 208 Cb -0.13 -1.15 -0.01 0.00 0.00 0.00 0.00 36.38 35.09 2b21 s VAL 208 CO -0.04 0.39 -0.24 -0.69 0.00 0.00 0.00 175.10 174.53 2b21 s VAL 209 N 0.66 1.95 -0.29 2.92 1.01 0.14 0.25 120.40 127.03 2b21 s VAL 209 Ca -0.14 -1.00 0.02 0.00 0.00 0.00 0.00 61.98 60.85 2b21 s VAL 209 Cb -0.16 -1.65 0.08 0.00 0.00 0.00 0.00 36.38 34.65 2b21 s VAL 209 CO 0.04 0.54 0.01 -0.63 0.00 0.00 0.00 175.10 175.06 2b21 s ILE 210 N -0.09 1.73 -0.26 2.22 -1.09 0.43 -0.40 121.20 123.74 2b21 s ILE 210 Ca -0.05 -1.69 -0.01 0.00 -2.23 0.00 0.00 60.65 56.67 2b21 s ILE 210 Cb -0.14 -2.13 0.08 0.00 -1.58 0.00 0.00 42.46 38.69 2b21 s ILE 210 CO 0.04 -0.38 0.04 -0.62 -1.23 0.00 0.00 174.94 172.79 2b21 s ASP 211 N 1.23 3.70 0.29 3.58 2.15 -0.51 -1.49 116.67 125.62 2b21 s ASP 211 Ca 0.03 -1.31 0.05 0.00 0.43 0.00 0.00 52.55 51.75 2b21 s ASP 211 Cb -0.19 -0.92 -0.02 0.00 -0.30 0.00 0.00 42.92 41.49 2b21 s ASP 211 CO -0.10 -0.33 0.42 -0.55 -0.17 0.00 0.00 175.17 174.43 2b21 s SER 212 N 1.58 6.19 0.04 -0.34 0.15 -1.26 0.80 113.70 120.87 2b21 s SER 212 Ca 0.03 0.03 -0.05 0.00 0.70 0.00 0.00 55.95 56.66 2b21 s SER 212 Cb -0.18 -1.67 -0.29 0.00 -1.71 0.00 0.00 66.02 62.18 2b21 s SER 212 CO -0.14 -0.22 1.02 0.25 1.20 0.00 0.00 173.24 175.35 2b21 h LEU 213 N 1.02 0.44 0.00 3.45 5.85 -1.02 -3.41 115.31 121.65 2b21 h LEU 213 Ca -0.50 -0.52 0.00 0.00 0.84 0.00 0.00 57.88 57.70 2b21 h LEU 213 Cb 1.24 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.12 2b21 h LEU 213 CO 0.58 1.42 -0.92 0.35 -0.34 0.00 0.00 178.44 179.53 2b21 n THR 214 N -3.51 0.00 -0.01 1.05 -2.24 -1.26 -4.76 114.28 103.55 2b21 n THR 214 Ca -0.12 -0.24 -0.13 0.00 -2.27 0.00 0.00 64.05 61.29 2b21 n THR 214 Cb 1.04 0.73 -0.07 0.00 -2.10 0.00 0.00 70.33 69.93 2b21 n THR 214 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2b21 h SER 215 N 0.00 -1.40 -0.63 3.42 0.02 -1.91 -2.13 113.55 110.92 2b21 h SER 215 Ca 0.00 0.18 0.03 0.00 -0.84 0.00 0.00 61.79 61.17 2b21 h SER 215 Cb 0.38 0.57 -0.04 0.00 0.14 0.00 0.00 62.40 63.45 2b21 h SER 215 CO 0.00 -0.44 0.38 0.71 -1.14 0.00 0.00 176.83 176.34 2b21 h THR 216 N -0.51 1.05 -0.35 -2.27 1.35 -1.87 -2.00 112.91 108.31 2b21 h THR 216 Ca 0.07 -0.25 -0.00 0.00 -0.55 0.00 0.00 66.41 65.67 2b21 h THR 216 Cb 0.64 0.25 -0.02 0.00 -1.73 0.00 0.00 68.15 67.29 2b21 h THR 216 CO -0.41 0.13 0.21 -0.26 -0.25 0.00 0.00 175.52 174.94 2b21 h PHE 217 N 0.73 0.47 -0.43 4.73 -1.00 -1.80 -0.04 116.94 119.60 2b21 h PHE 217 Ca 0.26 -0.00 -0.01 0.00 2.81 0.00 0.00 57.97 61.03 2b21 h PHE 217 Cb 0.06 -0.15 -0.02 0.00 3.61 0.00 0.00 35.95 39.44 2b21 h PHE 217 CO -0.06 0.35 0.25 0.00 -1.61 0.00 0.00 178.31 177.24 2b21 h ARG 218 N 0.45 0.59 0.00 1.51 3.08 -1.25 0.33 114.38 119.10 2b21 h ARG 218 Ca 0.13 -0.06 -0.05 0.00 0.07 0.00 0.00 59.98 60.07 2b21 h ARG 218 Cb 0.02 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 29.94 2b21 h ARG 218 CO -0.02 0.45 -0.22 -0.97 -1.07 0.00 0.00 179.97 178.14 2b21 h ASN 219 N 0.56 0.00 0.35 7.04 -0.73 -1.06 -2.43 115.58 119.32 2b21 h ASN 219 Ca 0.15 0.00 -0.27 0.00 1.87 0.00 0.00 56.30 58.06 2b21 h ASN 219 Cb 0.02 0.00 -0.05 0.00 0.27 0.00 0.00 38.32 38.57 2b21 h ASN 219 CO -0.03 0.22 -1.87 -0.62 -0.37 0.00 0.00 177.43 174.76 2b21 n GLU 220 N -3.97 0.65 -1.48 6.67 1.02 -0.06 -4.35 120.64 119.13 2b21 n GLU 220 Ca -0.02 0.15 -0.19 0.00 -0.02 0.00 0.00 57.16 57.08 2b21 n GLU 220 Cb 0.30 -1.69 0.09 0.00 -0.02 0.00 0.00 31.44 30.12 2b21 n GLU 220 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2b21 n TYR 221 N -2.86 2.24 0.00 -0.32 4.01 0.08 -4.77 117.16 115.54 2b21 n TYR 221 Ca -0.19 -2.18 -0.10 0.00 -0.16 0.00 0.00 57.90 55.27 2b21 n TYR 221 Cb 1.00 -0.59 -0.03 0.00 -0.31 0.00 0.00 39.34 39.41 2b21 n TYR 221 CO 0.00 0.00 0.00 1.79 -0.46 0.00 0.00 176.86 178.19 2b21 h THR 222 N 1.57 0.37 -1.09 -0.72 1.35 -1.63 -3.37 112.91 109.38 2b21 h THR 222 Ca 0.36 0.00 -0.53 0.00 -0.55 0.00 0.00 66.41 65.68 2b21 h THR 222 Cb 1.40 0.37 -0.02 0.00 -1.73 0.00 0.00 68.15 68.16 2b21 h THR 222 CO 0.78 0.00 1.61 0.61 -0.25 0.00 0.00 175.52 178.26 2b21 n GLY 223 N -1.38 0.14 0.65 5.82 0.00 -1.26 -4.72 105.19 104.44 2b21 n GLY 223 Ca -0.03 0.86 0.00 0.00 0.00 0.00 0.00 46.02 46.85 2b21 n GLY 223 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2b21 n ARG 224 N 8.66 0.36 -0.08 1.61 1.74 -1.26 -2.51 116.66 125.18 2b21 n ARG 224 Ca 0.45 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 57.44 2b21 n ARG 224 Cb 0.33 -1.22 -0.15 0.00 -1.02 0.00 0.00 32.46 30.39 2b21 n ARG 224 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2b21 n GLY 225 N 0.47 -1.00 1.90 -0.13 0.00 -1.26 -4.28 105.19 100.89 2b21 n GLY 225 Ca 0.00 -0.27 -0.22 0.00 0.00 0.00 0.00 46.02 45.53 2b21 n GLY 225 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2b21 n LYS 226 N -2.80 2.94 0.00 1.61 2.85 -1.04 -4.65 118.16 117.07 2b21 n LYS 226 Ca -0.28 -3.70 0.07 0.00 -1.05 0.00 0.00 58.31 53.35 2b21 n LYS 226 Cb 1.11 -2.17 0.33 0.00 -0.65 0.00 0.00 35.03 33.64 2b21 n LYS 226 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 177.40 177.24 2b21 n LEU 227 N -0.87 0.00 0.03 -5.58 -0.00 -1.26 -2.83 117.00 106.50 2b21 n LEU 227 Ca 0.47 0.50 -0.12 0.00 -0.00 0.00 0.00 56.01 56.85 2b21 n LEU 227 Cb 0.90 -0.50 -0.09 0.00 -0.00 0.00 0.00 43.42 43.74 2b21 n LEU 227 CO 0.46 -0.24 0.48 0.00 -0.00 0.00 0.00 177.39 178.09 2b21 h ALA 228 N 2.53 -0.15 -0.78 1.96 0.00 -1.93 -2.68 119.26 118.21 2b21 h ALA 228 Ca 0.00 -0.25 0.10 0.00 0.00 0.00 0.00 54.91 54.76 2b21 h ALA 228 Cb 0.26 0.06 -0.08 0.00 0.00 0.00 0.00 17.79 18.03 2b21 h ALA 228 CO 0.00 -0.29 0.41 1.49 0.00 0.00 0.00 179.25 180.87 2b21 h GLU 229 N -0.75 0.66 0.41 0.00 4.81 -1.91 -1.79 114.58 116.00 2b21 h GLU 229 Ca -0.02 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.17 2b21 h GLU 229 Cb 0.55 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 29.75 2b21 h GLU 229 CO 0.03 0.44 -0.51 -0.09 -0.73 0.00 0.00 179.01 178.14 2b21 h ARG 230 N 0.68 -0.91 -0.61 1.92 2.43 -1.57 0.19 114.38 116.51 2b21 h ARG 230 Ca 0.39 0.06 0.08 0.00 -0.81 0.00 0.00 59.98 59.71 2b21 h ARG 230 Cb 0.42 0.21 -0.04 0.00 -0.42 0.00 0.00 29.97 30.14 2b21 h ARG 230 CO -0.28 -0.61 0.41 1.96 -1.51 0.00 0.00 179.97 179.94 2b21 h GLN 231 N -0.95 0.48 -0.00 0.20 1.08 -1.10 0.92 115.11 115.74 2b21 h GLN 231 Ca -0.05 -0.03 -0.00 0.00 -1.45 0.00 0.00 58.65 57.12 2b21 h GLN 231 Cb 0.85 -0.11 0.00 0.00 -0.05 0.00 0.00 27.48 28.17 2b21 h GLN 231 CO -0.12 0.32 -0.01 1.96 -0.95 0.00 0.00 178.83 180.03 2b21 h GLN 232 N 0.50 0.01 0.05 1.46 4.20 -0.88 -1.01 115.11 119.43 2b21 h GLN 232 Ca 0.28 -0.01 0.01 0.00 0.06 0.00 0.00 58.65 58.99 2b21 h GLN 232 Cb 0.44 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.20 2b21 h GLN 232 CO -0.08 0.57 -0.09 -0.22 -0.67 0.00 0.00 178.83 178.34 2b21 h LYS 233 N -0.55 -0.17 -0.72 1.46 3.64 -0.06 -0.13 116.57 120.05 2b21 h LYS 233 Ca 0.00 0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.35 2b21 h LYS 233 Cb 0.57 0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.40 2b21 h LYS 233 CO 0.00 -0.11 0.27 1.25 -2.27 0.00 0.00 179.45 178.59 2b21 h LEU 234 N -0.18 0.98 -1.11 5.20 5.85 -0.91 -1.58 115.31 123.56 2b21 h LEU 234 Ca 0.02 -0.15 -0.04 0.00 0.84 0.00 0.00 57.88 58.55 2b21 h LEU 234 Cb 0.19 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 40.94 2b21 h LEU 234 CO -0.06 0.88 0.19 1.23 -0.34 0.00 0.00 178.44 180.34 2b21 h GLY 235 N 1.10 0.88 1.55 3.75 0.00 -0.77 0.55 103.07 110.13 2b21 h GLY 235 Ca 0.24 -0.46 -0.10 0.00 0.00 0.00 0.00 47.33 47.00 2b21 h GLY 235 CO -0.02 0.44 -0.27 -0.09 0.00 0.00 0.00 176.54 176.60 2b21 h ARG 236 N 0.80 0.51 -0.48 4.80 2.43 -0.48 -1.43 114.38 120.53 2b21 h ARG 236 Ca 0.19 -0.20 -0.10 0.00 -0.81 0.00 0.00 59.98 59.05 2b21 h ARG 236 Cb 0.21 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.72 2b21 h ARG 236 CO -0.01 0.74 -0.10 1.25 -1.51 0.00 0.00 179.97 180.34 2b21 h HIS 237 N 0.45 1.02 -0.38 2.20 2.76 -0.30 -1.72 115.15 119.19 2b21 h HIS 237 Ca 0.06 -0.21 -0.09 0.00 -2.20 0.00 0.00 60.37 57.93 2b21 h HIS 237 Cb 0.71 -0.25 -0.02 0.00 1.55 0.00 0.00 27.41 29.40 2b21 h HIS 237 CO 0.02 0.99 -0.13 0.52 -1.30 0.00 0.00 177.93 178.03 2b21 h MET 238 N 0.76 0.68 -0.48 5.26 2.86 -0.63 -1.18 114.93 122.20 2b21 h MET 238 Ca 0.12 -0.22 -0.04 0.00 -2.06 0.00 0.00 59.70 57.50 2b21 h MET 238 Cb 0.64 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.22 2b21 h MET 238 CO 0.04 0.79 0.14 0.00 1.06 0.00 0.00 176.91 178.94 2b21 h ALA 239 N 1.24 0.63 -0.43 6.32 0.00 -1.07 -0.27 119.26 125.67 2b21 h ALA 239 Ca 0.10 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 2b21 h ALA 239 Cb 0.58 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 2b21 h ALA 239 CO 0.04 0.29 0.26 1.15 0.00 0.00 0.00 179.25 180.99 2b21 h THR 240 N 0.64 1.14 -0.45 0.00 2.02 -1.01 -1.33 112.91 113.93 2b21 h THR 240 Ca 0.15 -0.32 -0.01 0.00 0.77 0.00 0.00 66.41 66.99 2b21 h THR 240 Cb 0.29 0.57 -0.02 0.00 -1.74 0.00 0.00 68.15 67.25 2b21 h THR 240 CO -0.00 0.14 0.22 -0.07 0.37 0.00 0.00 175.52 176.18 2b21 h LEU 241 N 0.57 0.58 -0.44 2.58 3.38 -0.90 -1.43 115.31 119.65 2b21 h LEU 241 Ca 0.16 -0.12 -0.05 0.00 0.09 0.00 0.00 57.88 57.96 2b21 h LEU 241 Cb 0.00 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 2b21 h LEU 241 CO -0.03 0.54 0.10 0.78 0.09 0.00 0.00 178.44 179.91 2b21 h ASN 242 N 0.58 0.68 -0.70 -0.43 4.21 -0.88 -1.19 115.58 117.85 2b21 h ASN 242 Ca 0.15 -0.24 -0.03 0.00 1.21 0.00 0.00 56.30 57.40 2b21 h ASN 242 Cb 0.11 -0.18 -0.03 0.00 -1.12 0.00 0.00 38.32 37.09 2b21 h ASN 242 CO -0.02 0.75 0.33 0.50 -1.29 0.00 0.00 177.43 177.69 2b21 h LYS 243 N 0.58 1.01 -0.63 0.81 3.64 -1.13 -0.97 116.57 119.88 2b21 h LYS 243 Ca 0.14 -0.15 0.03 0.00 -1.27 0.00 0.00 60.65 59.40 2b21 h LYS 243 Cb 0.34 -0.18 -0.04 0.00 -0.41 0.00 0.00 32.23 31.94 2b21 h LYS 243 CO 0.00 0.80 0.38 1.25 -2.27 0.00 0.00 179.45 179.61 2b21 h LEU 244 N 0.97 0.61 -0.64 5.20 5.85 -1.07 -0.26 115.31 125.97 2b21 h LEU 244 Ca 0.24 0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.90 2b21 h LEU 244 Cb 0.13 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.01 2b21 h LEU 244 CO -0.03 0.42 0.15 0.00 -0.34 0.00 0.00 178.44 178.64 2b21 h ALA 245 N 1.28 0.85 0.48 1.25 0.00 -0.70 -2.32 119.26 120.09 2b21 h ALA 245 Ca 0.26 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 2b21 h ALA 245 Cb 0.05 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.60 2b21 h ALA 245 CO -0.12 0.57 -0.23 -0.44 0.00 0.00 0.00 179.25 179.03 2b21 h ASP 246 N 0.96 -0.54 -0.96 0.00 3.32 -0.69 -1.75 116.42 116.75 2b21 h ASP 246 Ca 0.20 0.02 0.04 0.00 0.02 0.00 0.00 57.03 57.31 2b21 h ASP 246 Cb 0.38 0.14 -0.06 0.00 0.22 0.00 0.00 39.33 40.01 2b21 h ASP 246 CO 0.00 -0.13 0.63 -0.07 -1.72 0.00 0.00 179.24 177.95 2b21 h LEU 247 N -1.16 1.03 -3.50 1.55 4.07 -1.16 -2.51 115.31 113.64 2b21 h LEU 247 Ca -0.07 -0.01 -0.05 0.00 0.08 0.00 0.00 57.88 57.84 2b21 h LEU 247 Cb 0.49 -0.23 -0.03 0.00 1.08 0.00 0.00 40.66 41.97 2b21 h LEU 247 CO 0.11 0.70 0.05 0.49 -1.08 0.00 0.00 178.44 178.71 2b21 n PHE 248 N -4.45 1.77 -3.92 1.13 0.99 -0.87 -4.98 117.46 107.12 2b21 n PHE 248 Ca 0.13 -0.91 -0.27 0.00 -0.00 0.00 0.00 57.45 56.41 2b21 n PHE 248 Cb 0.12 -0.49 0.01 0.00 -1.00 0.00 0.00 39.48 38.12 2b21 n PHE 248 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.76 175.05 2b21 n ASN 249 N 0.04 -2.19 -4.37 4.37 5.15 -0.75 -4.87 115.26 112.63 2b21 n ASN 249 Ca 0.29 -0.74 -0.19 0.00 -0.60 0.00 0.00 54.58 53.34 2b21 n ASN 249 Cb 1.14 -0.89 -0.10 0.00 -0.53 0.00 0.00 39.78 39.40 2b21 n ASN 249 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2b21 s VAL 251 N -3.12 5.05 -0.17 0.00 1.01 -0.38 -0.83 120.40 121.97 2b21 s VAL 251 Ca 0.26 1.34 -0.01 0.00 0.00 0.00 0.00 61.98 63.57 2b21 s VAL 251 Cb 0.03 -4.00 -0.01 0.00 0.00 0.00 0.00 36.38 32.41 2b21 s VAL 251 CO 0.09 0.22 -0.11 -0.69 0.00 0.00 0.00 175.10 174.61 2b21 s VAL 252 N 1.05 2.97 0.01 2.92 1.01 -1.12 -0.59 120.40 126.65 2b21 s VAL 252 Ca 0.34 -0.66 0.08 0.00 0.00 0.00 0.00 61.98 61.75 2b21 s VAL 252 Cb -0.17 -2.28 -0.03 0.00 0.00 0.00 0.00 36.38 33.90 2b21 s VAL 252 CO 0.15 0.49 -0.24 -0.76 0.00 0.00 0.00 175.10 174.74 2b21 s LEU 253 N 0.89 2.23 0.02 3.92 1.43 0.14 -1.10 118.68 126.20 2b21 s LEU 253 Ca -0.03 -0.50 -0.01 0.00 -1.03 0.00 0.00 54.13 52.57 2b21 s LEU 253 Cb -0.15 -1.36 -0.02 0.00 0.03 0.00 0.00 46.19 44.69 2b21 s LEU 253 CO -0.00 0.29 -0.02 0.68 0.23 0.00 0.00 176.35 177.53 2b21 s VAL 254 N -0.75 0.12 0.22 -1.59 -7.23 -0.71 -0.43 120.40 110.03 2b21 s VAL 254 Ca 0.11 -0.97 0.09 0.00 -1.81 0.00 0.00 61.98 59.41 2b21 s VAL 254 Cb -0.10 -0.38 -0.04 0.00 0.56 0.00 0.00 36.38 36.41 2b21 s VAL 254 CO 0.01 -0.53 -0.07 0.42 -0.31 0.00 0.00 175.10 174.62 2b21 s THR 255 N -1.67 3.24 -0.15 5.32 -4.23 -0.56 -1.34 115.64 116.26 2b21 s THR 255 Ca -0.14 -1.81 -0.06 0.00 -1.18 0.00 0.00 61.69 58.50 2b21 s THR 255 Cb -0.08 -2.66 0.07 0.00 1.34 0.00 0.00 72.50 71.16 2b21 s THR 255 CO -0.02 -0.23 0.31 0.21 -0.54 0.00 0.00 174.62 174.36 2b21 s ASN 256 N -3.20 0.04 -0.31 3.99 2.47 -0.84 -0.79 114.94 116.29 2b21 s ASN 256 Ca 0.28 0.72 -0.28 0.00 0.42 0.00 0.00 52.86 53.99 2b21 s ASN 256 Cb -0.08 0.84 0.01 0.00 -1.45 0.00 0.00 41.25 40.57 2b21 s ASN 256 CO 0.17 -0.22 1.02 -1.58 -3.72 0.00 0.00 177.10 172.76 2b21 s GLN 257 N 2.23 4.07 -0.03 0.43 2.00 -1.26 -1.48 119.66 125.62 2b21 s GLN 257 Ca -0.02 1.01 -0.01 0.00 -2.00 0.00 0.00 55.36 54.34 2b21 s GLN 257 Cb -0.11 -3.72 0.02 0.00 0.80 0.00 0.00 33.01 29.99 2b21 s GLN 257 CO -0.10 -0.83 0.06 0.14 -0.50 0.00 0.00 175.29 174.06 2b21 s VAL 258 N 3.47 -0.03 -0.81 1.34 -7.23 -0.91 -4.90 120.40 111.32 2b21 s VAL 258 Ca 0.43 0.12 0.17 0.00 -1.81 0.00 0.00 61.98 60.88 2b21 s VAL 258 Cb -0.13 -0.11 -0.18 0.00 0.56 0.00 0.00 36.38 36.52 2b21 s VAL 258 CO 0.14 0.05 0.72 -1.54 -0.31 0.00 0.00 175.10 174.16 2b21 n SER 259 N 3.70 0.82 -4.24 4.85 3.41 -1.26 -2.74 113.62 118.15 2b21 n SER 259 Ca -0.21 -0.91 -0.17 0.00 -0.26 0.00 0.00 58.87 57.32 2b21 n SER 259 Cb 0.55 0.99 -0.11 0.00 -0.26 0.00 0.00 64.21 65.38 2b21 n SER 259 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2b21 s GLY 279 N -2.58 1.08 0.15 5.00 0.00 -1.26 -4.89 107.32 104.82 2b21 s GLY 279 Ca 0.07 -1.32 -0.24 0.00 0.00 0.00 0.00 44.72 43.22 2b21 s GLY 279 CO 0.69 -1.39 0.75 -2.38 0.00 0.00 0.00 173.10 170.77 2b21 s HIS 280 N -2.32 -0.35 0.43 1.90 -3.43 -1.26 -5.00 115.29 105.27 2b21 s HIS 280 Ca 0.10 0.07 -0.23 0.00 -0.80 0.00 0.00 55.06 54.20 2b21 s HIS 280 Cb -0.04 0.61 -0.08 0.00 -1.43 0.00 0.00 32.58 31.64 2b21 s HIS 280 CO 0.03 -0.88 1.11 0.00 -2.00 0.00 0.00 174.74 173.00 2b21 s ALA 281 N -3.58 3.02 -0.30 -1.38 0.00 -1.26 -5.04 121.76 113.22 2b21 s ALA 281 Ca 0.06 0.82 -0.16 0.00 0.00 0.00 0.00 51.96 52.68 2b21 s ALA 281 Cb -0.02 -3.33 0.17 0.00 0.00 0.00 0.00 23.12 19.94 2b21 s ALA 281 CO -0.05 -0.45 1.09 0.00 0.00 0.00 0.00 175.76 176.36 2b21 s ALA 282 N -1.61 -2.73 0.21 0.00 0.00 -1.26 -4.99 121.76 111.38 2b21 s ALA 282 Ca 0.61 2.02 0.12 0.00 0.00 0.00 0.00 51.96 54.71 2b21 s ALA 282 Cb -0.25 -2.02 0.36 0.00 0.00 0.00 0.00 23.12 21.21 2b21 s ALA 282 CO 0.31 -0.72 1.60 0.00 0.00 0.00 0.00 175.76 176.94 2b21 h THR 283 N 5.21 1.32 -3.70 0.00 1.03 -1.72 -3.43 112.91 111.62 2b21 h THR 283 Ca -0.20 -2.13 -0.53 0.00 -0.01 0.00 0.00 66.41 63.55 2b21 h THR 283 Cb 1.14 2.18 -0.32 0.00 -1.07 0.00 0.00 68.15 70.09 2b21 h THR 283 CO 0.13 0.59 -0.82 -0.36 -0.01 0.00 0.00 175.52 175.04 2b21 s PHE 284 N -3.48 1.51 -0.10 0.00 0.40 -0.74 -3.87 117.98 111.70 2b21 s PHE 284 Ca -0.00 -0.48 0.01 0.00 -0.60 0.00 0.00 56.93 55.86 2b21 s PHE 284 Cb 0.12 -1.06 0.02 0.00 0.51 0.00 0.00 43.02 42.61 2b21 s PHE 284 CO 0.75 -0.20 -0.12 1.03 0.70 0.00 0.00 175.22 177.38 2b21 s ARG 285 N 0.29 1.87 0.11 0.44 0.52 0.26 0.24 118.95 122.67 2b21 s ARG 285 Ca -0.08 -0.43 0.10 0.00 -0.52 0.00 0.00 55.73 54.81 2b21 s ARG 285 Cb -0.13 -1.67 -0.04 0.00 0.52 0.00 0.00 34.95 33.64 2b21 s ARG 285 CO 0.03 -0.10 -0.26 -0.06 0.02 0.00 0.00 175.30 174.93 2b21 s PHE 286 N 1.12 2.34 -0.18 -0.53 0.40 0.52 -1.36 117.98 120.29 2b21 s PHE 286 Ca -0.05 -0.37 0.01 0.00 -0.60 0.00 0.00 56.93 55.92 2b21 s PHE 286 Cb -0.14 -1.29 0.03 0.00 0.51 0.00 0.00 43.02 42.12 2b21 s PHE 286 CO -0.02 0.30 -0.13 0.12 0.70 0.00 0.00 175.22 176.18 2b21 s PHE 287 N -1.01 2.41 -0.03 0.36 5.36 -0.28 0.31 117.98 125.09 2b21 s PHE 287 Ca 0.14 -1.49 0.00 0.00 -0.96 0.00 0.00 56.93 54.62 2b21 s PHE 287 Cb -0.10 -1.68 -0.04 0.00 -0.34 0.00 0.00 43.02 40.87 2b21 s PHE 287 CO 0.06 -0.73 0.01 0.08 -1.46 0.00 0.00 175.22 173.18 2b21 s VAL 288 N 1.40 4.28 0.04 3.12 1.01 0.17 -0.34 120.40 130.08 2b21 s VAL 288 Ca 0.02 -0.45 -0.04 0.00 0.00 0.00 0.00 61.98 61.50 2b21 s VAL 288 Cb -0.15 -2.87 -0.02 0.00 0.00 0.00 0.00 36.38 33.34 2b21 s VAL 288 CO -0.10 0.45 0.06 0.00 0.00 0.00 0.00 175.10 175.52 2b21 s ARG 289 N -1.34 0.57 0.27 2.72 1.70 0.03 -2.99 118.95 119.91 2b21 s ARG 289 Ca 0.18 -0.82 -0.29 0.00 -0.47 0.00 0.00 55.73 54.32 2b21 s ARG 289 Cb -0.11 0.22 -0.09 0.00 -0.57 0.00 0.00 34.95 34.39 2b21 s ARG 289 CO 0.08 -0.13 1.05 0.15 -1.08 0.00 0.00 175.30 175.36 2b21 s LYS 290 N -2.74 4.68 0.00 3.89 1.02 -1.26 -0.39 119.74 124.94 2b21 s LYS 290 Ca -0.04 1.70 0.00 0.00 0.02 0.00 0.00 55.97 57.65 2b21 s LYS 290 Cb -0.00 -3.18 0.00 0.00 -0.52 0.00 0.00 37.83 34.12 2b21 s LYS 290 CO -0.05 0.29 0.00 0.41 -0.92 0.00 0.00 175.35 175.08 2b21 n GLY 291 N 1.23 1.66 3.60 -3.33 0.00 0.50 -4.82 105.19 104.03 2b21 n GLY 291 Ca -0.01 -1.00 -0.40 0.00 0.00 0.00 0.00 46.02 44.60 2b21 n GLY 291 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2b21 s LYS 292 N 4.58 3.93 4.59 1.61 2.36 -1.26 -4.80 119.74 130.74 2b21 s LYS 292 Ca 0.00 0.18 0.00 0.00 -2.55 0.00 0.00 55.97 53.60 2b21 s LYS 292 Cb 0.00 -3.70 0.00 0.00 -1.05 0.00 0.00 37.83 33.08 2b21 s LYS 292 CO 0.00 -0.46 0.00 0.41 1.55 0.00 0.00 175.35 176.85 2b21 n GLY 293 N 4.52 1.10 0.25 5.54 0.00 -1.26 -1.77 105.19 113.57 2b21 n GLY 293 Ca -0.04 0.51 -0.05 0.00 0.00 0.00 0.00 46.02 46.43 2b21 n GLY 293 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2b21 h ASP 294 N 0.00 0.64 -2.76 1.61 3.32 -1.90 -3.47 116.42 113.86 2b21 h ASP 294 Ca 0.00 -0.22 -0.59 0.00 0.02 0.00 0.00 57.03 56.24 2b21 h ASP 294 Cb 0.00 -0.17 0.14 0.00 0.22 0.00 0.00 39.33 39.51 2b21 h ASP 294 CO 0.00 0.86 -0.04 0.29 -1.72 0.00 0.00 179.24 178.63 2b21 n LYS 295 N -4.12 1.05 -3.85 3.56 4.76 -0.73 -2.40 118.16 116.42 2b21 n LYS 295 Ca 0.00 0.38 -0.12 0.00 -2.87 0.00 0.00 58.31 55.70 2b21 n LYS 295 Cb 0.41 -1.84 -0.12 0.00 -1.84 0.00 0.00 35.03 31.64 2b21 n LYS 295 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 2b21 s ARG 296 N -1.85 0.19 -0.17 1.97 1.81 0.21 -0.37 118.95 120.74 2b21 s ARG 296 Ca 0.63 0.01 0.00 0.00 -1.72 0.00 0.00 55.73 54.66 2b21 s ARG 296 Cb -0.59 0.08 0.04 0.00 -0.45 0.00 0.00 34.95 34.04 2b21 s ARG 296 CO 0.57 -0.03 -0.09 0.08 -0.68 0.00 0.00 175.30 175.15 2b21 s VAL 297 N -0.26 1.37 -0.21 3.52 1.01 0.48 -2.32 120.40 123.99 2b21 s VAL 297 Ca -0.03 -0.73 -0.08 0.00 0.00 0.00 0.00 61.98 61.14 2b21 s VAL 297 Cb -0.02 -1.45 -0.04 0.00 0.00 0.00 0.00 36.38 34.87 2b21 s VAL 297 CO 0.00 0.22 0.08 0.00 0.00 0.00 0.00 175.10 175.41 2b21 s ALA 298 N 1.53 3.35 -0.25 5.51 0.00 -0.64 -0.79 121.76 130.47 2b21 s ALA 298 Ca 0.01 -0.90 -0.05 0.00 0.00 0.00 0.00 51.96 51.02 2b21 s ALA 298 Cb -0.15 -2.04 -0.01 0.00 0.00 0.00 0.00 23.12 20.92 2b21 s ALA 298 CO -0.08 -0.11 0.01 0.21 0.00 0.00 0.00 175.76 175.78 2b21 s LYS 299 N 0.92 3.32 -0.49 0.00 2.47 0.54 -1.06 119.74 125.44 2b21 s LYS 299 Ca 0.04 -0.68 -0.28 0.00 -1.56 0.00 0.00 55.97 53.49 2b21 s LYS 299 Cb -0.14 -3.16 0.03 0.00 -1.46 0.00 0.00 37.83 33.10 2b21 s LYS 299 CO 0.03 -0.27 1.09 -1.17 0.16 0.00 0.00 175.35 175.18 2b21 s LEU 300 N 1.50 3.72 0.00 5.43 1.98 0.11 -1.13 118.68 130.29 2b21 s LEU 300 Ca 0.05 0.31 0.09 0.00 -2.89 0.00 0.00 54.13 51.68 2b21 s LEU 300 Cb -0.15 -3.39 0.19 0.00 0.66 0.00 0.00 46.19 43.49 2b21 s LEU 300 CO -0.01 -1.24 1.06 0.00 -1.89 0.00 0.00 176.35 174.28 2b21 n TYR 301 N 7.75 0.25 -3.59 5.38 4.11 -0.47 -1.83 117.16 128.76 2b21 n TYR 301 Ca 0.10 -0.31 -0.01 0.00 -0.00 0.00 0.00 57.90 57.68 2b21 n TYR 301 Cb 0.49 -0.02 -0.06 0.00 -0.00 0.00 0.00 39.34 39.75 2b21 n TYR 301 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.86 177.20 2b21 s ASP 302 N -0.92 -0.45 0.18 9.48 2.15 -1.22 -4.96 116.67 120.93 2b21 s ASP 302 Ca 0.16 0.70 -0.23 0.00 0.43 0.00 0.00 52.55 53.62 2b21 s ASP 302 Cb 0.09 1.27 0.06 0.00 -0.30 0.00 0.00 42.92 44.04 2b21 s ASP 302 CO 0.13 -0.11 0.69 -0.94 -0.17 0.00 0.00 175.17 174.77 2b21 s SER 303 N 1.53 -0.43 0.14 -0.34 1.04 -1.26 -0.58 113.70 113.80 2b21 s SER 303 Ca -0.08 -0.22 0.04 0.00 0.48 0.00 0.00 55.95 56.18 2b21 s SER 303 Cb -0.04 0.61 -0.13 0.00 0.10 0.00 0.00 66.02 66.57 2b21 s SER 303 CO -0.15 -1.05 1.31 1.55 0.98 0.00 0.00 173.24 175.88 2b21 h PRO 304 N 2.00 0.09 0.00 4.02 0.13 -1.98 -3.40 132.00 132.87 2b21 h PRO 304 Ca -0.27 -0.13 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 2b21 h PRO 304 Cb 1.28 0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.45 2b21 h PRO 304 CO 0.32 1.00 0.00 -2.39 -0.23 0.00 0.00 178.00 176.69 2b21 n HIS 305 N -3.49 0.00 -4.40 1.56 1.44 -1.26 -5.07 115.22 103.99 2b21 n HIS 305 Ca -0.02 -0.19 -0.25 0.00 -2.01 0.00 0.00 57.72 55.25 2b21 n HIS 305 Cb 0.90 -0.02 -0.10 0.00 0.12 0.00 0.00 29.99 30.89 2b21 n HIS 305 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 2b21 s LEU 306 N -0.38 2.72 0.39 2.39 1.43 -1.26 -5.13 118.68 118.84 2b21 s LEU 306 Ca 0.00 -0.86 -0.18 0.00 -1.03 0.00 0.00 54.13 52.06 2b21 s LEU 306 Cb 0.00 -1.30 -0.10 0.00 0.03 0.00 0.00 46.19 44.82 2b21 s LEU 306 CO 0.00 0.06 0.86 -2.16 0.23 0.00 0.00 176.35 175.34 2b21 s PRO 307 N -3.27 4.11 0.71 1.29 0.04 -1.26 -4.62 135.00 132.00 2b21 s PRO 307 Ca 0.28 0.91 -0.16 0.00 0.04 0.00 0.00 61.00 62.06 2b21 s PRO 307 Cb -0.06 -2.28 0.01 0.00 0.04 0.00 0.00 34.50 32.20 2b21 s PRO 307 CO 0.15 0.03 1.14 -0.25 0.04 0.00 0.00 177.00 178.11 2b21 n ASP 308 N -0.60 1.20 -3.63 6.66 9.92 -1.26 -4.98 116.55 123.86 2b21 n ASP 308 Ca 0.05 0.72 -0.03 0.00 -0.53 0.00 0.00 54.79 55.00 2b21 n ASP 308 Cb 0.54 -1.48 -0.01 0.00 -0.64 0.00 0.00 41.12 39.52 2b21 n ASP 308 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2b21 s ALA 309 N -1.70 -1.92 0.17 2.24 0.00 -0.76 -4.98 121.76 114.81 2b21 s ALA 309 Ca 0.77 0.75 0.09 0.00 0.00 0.00 0.00 51.96 53.57 2b21 s ALA 309 Cb -0.35 0.38 -0.04 0.00 0.00 0.00 0.00 23.12 23.11 2b21 s ALA 309 CO 0.46 -0.88 -0.12 -1.21 0.00 0.00 0.00 175.76 174.02 2b21 s GLU 310 N -2.87 1.99 -0.03 0.00 2.02 -1.26 0.07 118.70 118.63 2b21 s GLU 310 Ca 0.10 -1.26 -0.00 0.00 0.02 0.00 0.00 54.97 53.83 2b21 s GLU 310 Cb 0.00 -2.14 0.03 0.00 0.10 0.00 0.00 34.13 32.12 2b21 s GLU 310 CO -0.03 0.44 0.04 0.00 0.02 0.00 0.00 175.26 175.72 2b21 s ALA 311 N -1.61 0.14 -0.11 5.21 0.00 -0.23 -4.93 121.76 120.23 2b21 s ALA 311 Ca 0.24 0.27 -0.05 0.00 0.00 0.00 0.00 51.96 52.42 2b21 s ALA 311 Cb -0.09 -0.35 -0.04 0.00 0.00 0.00 0.00 23.12 22.64 2b21 s ALA 311 CO 0.14 -0.21 0.07 0.42 0.00 0.00 0.00 175.76 176.18 2b21 s ILE 312 N 1.35 4.87 0.15 0.00 1.01 -1.26 -1.62 121.20 125.69 2b21 s ILE 312 Ca -0.05 -0.03 -0.07 0.00 0.00 0.00 0.00 60.65 60.49 2b21 s ILE 312 Cb -0.13 -3.10 0.03 0.00 0.01 0.00 0.00 42.46 39.27 2b21 s ILE 312 CO -0.03 0.60 0.37 2.22 0.00 0.00 0.00 174.94 178.10 2b21 n PHE 313 N 2.22 -1.42 -4.03 3.97 1.16 -0.98 -4.60 117.46 113.78 2b21 n PHE 313 Ca -0.19 -0.74 -0.09 0.00 -1.87 0.00 0.00 57.45 54.55 2b21 n PHE 313 Cb 0.54 0.37 -0.08 0.00 -1.61 0.00 0.00 39.48 38.70 2b21 n PHE 313 CO 0.00 0.00 0.00 -0.98 -1.87 0.00 0.00 176.76 173.91 2b21 s ARG 314 N -2.03 1.05 -0.17 3.97 1.70 -0.87 -0.62 118.95 121.98 2b21 s ARG 314 Ca 0.08 -1.26 0.01 0.00 -0.47 0.00 0.00 55.73 54.09 2b21 s ARG 314 Cb -0.02 0.32 0.02 0.00 -0.57 0.00 0.00 34.95 34.70 2b21 s ARG 314 CO 0.04 -0.35 -0.20 0.42 -1.08 0.00 0.00 175.30 174.13 2b21 s ILE 315 N -3.99 2.05 0.00 4.99 1.01 -1.01 -1.41 121.20 122.83 2b21 s ILE 315 Ca 0.19 -0.94 0.00 0.00 0.00 0.00 0.00 60.65 59.90 2b21 s ILE 315 Cb 0.05 -1.84 0.00 0.00 0.01 0.00 0.00 42.46 40.68 2b21 s ILE 315 CO 0.00 0.54 0.00 0.35 0.00 0.00 0.00 174.94 175.83 2b21 n THR 316 N 4.49 0.00 0.26 2.92 -2.24 -0.46 -4.79 114.28 114.47 2b21 n THR 316 Ca -0.21 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.70 2b21 n THR 316 Cb 0.50 0.00 0.61 0.00 -2.10 0.00 0.00 70.33 69.35 2b21 n THR 316 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 2b21 h GLU 317 N 0.00 0.00 -0.01 -0.78 -0.00 -1.99 -1.21 114.58 110.59 2b21 h GLU 317 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.36 2b21 h GLU 317 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 28.75 2b21 h GLU 317 CO 0.00 0.00 -0.42 1.63 -0.00 0.00 0.00 179.01 180.22 2b21 n LYS 318 N -2.37 0.61 0.00 1.06 5.02 -1.26 -4.48 118.16 116.74 2b21 n LYS 318 Ca -0.00 -0.40 0.00 0.00 -2.02 0.00 0.00 58.31 55.88 2b21 n LYS 318 Cb 0.12 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.64 2b21 n LYS 318 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2b21 n GLY 319 N 1.41 0.59 3.72 0.72 0.00 -0.46 -4.66 105.19 106.51 2b21 n GLY 319 Ca 0.09 -1.74 -0.42 0.00 0.00 0.00 0.00 46.02 43.96 2b21 n GLY 319 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2b21 s ILE 320 N 0.00 4.66 0.08 -0.61 1.09 -1.26 -1.35 121.20 123.81 2b21 s ILE 320 Ca 0.00 2.03 -0.10 0.00 -1.10 0.00 0.00 60.65 61.48 2b21 s ILE 320 Cb 0.00 -4.30 0.01 0.00 -1.06 0.00 0.00 42.46 37.11 2b21 s ILE 320 CO 0.00 0.23 0.23 0.00 -0.10 0.00 0.00 174.94 175.29 2b21 s GLN 321 N 0.55 0.85 0.00 2.79 -2.07 -0.50 -4.53 119.66 116.75 2b21 s GLN 321 Ca 0.50 -0.86 0.00 0.00 -1.82 0.00 0.00 55.36 53.18 2b21 s GLN 321 Cb -0.22 0.35 0.00 0.00 -1.09 0.00 0.00 33.01 32.05 2b21 s GLN 321 CO 0.29 -0.28 0.00 -0.25 -1.32 0.00 0.00 175.29 173.73