#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x8c s LEU 3 N 0.00 4.29 -0.35 0.00 1.98 0.57 -4.98 118.68 120.19 1x8c s LEU 3 Ca 0.00 1.03 -0.11 0.00 -2.89 0.00 0.00 54.13 52.16 1x8c s LEU 3 Cb 0.00 -2.93 0.02 0.00 0.66 0.00 0.00 46.19 43.94 1x8c s LEU 3 CO 0.00 -0.08 0.19 -0.22 -1.89 0.00 0.00 176.35 174.35 1x8c s LEU 4 N 0.82 4.52 -0.16 -0.68 2.96 -1.26 -1.08 118.68 123.79 1x8c s LEU 4 Ca 0.33 -0.83 -0.05 0.00 -0.22 0.00 0.00 54.13 53.36 1x8c s LEU 4 Cb -0.17 -2.02 -0.03 0.00 0.50 0.00 0.00 46.19 44.47 1x8c s LEU 4 CO 0.15 -0.32 -0.01 -0.70 -1.32 0.00 0.00 176.35 174.15 1x8c s GLU 5 N 1.58 3.74 -0.13 1.98 2.12 0.00 -0.88 118.70 127.11 1x8c s GLU 5 Ca 0.03 -0.47 -0.00 0.00 0.36 0.00 0.00 54.97 54.89 1x8c s GLU 5 Cb -0.18 -2.99 -0.01 0.00 0.26 0.00 0.00 34.13 31.20 1x8c s GLU 5 CO 0.07 0.26 -0.12 0.42 -0.54 0.00 0.00 175.26 175.35 1x8c s ILE 6 N 0.33 3.09 -0.18 -3.70 -1.09 -0.35 -1.30 121.20 117.99 1x8c s ILE 6 Ca -0.02 -0.65 -0.29 0.00 -2.23 0.00 0.00 60.65 57.47 1x8c s ILE 6 Cb -0.14 -2.30 0.00 0.00 -1.58 0.00 0.00 42.46 38.44 1x8c s ILE 6 CO 0.02 0.52 1.01 0.00 -1.23 0.00 0.00 174.94 175.26 1x8c n TYR 9 N 2.52 1.13 0.00 0.00 4.02 -1.26 -0.90 117.16 122.67 1x8c n TYR 9 Ca -0.16 -0.64 0.00 0.00 -0.01 0.00 0.00 57.90 57.09 1x8c n TYR 9 Cb 0.52 -0.20 0.00 0.00 -0.02 0.00 0.00 39.34 39.63 1x8c n TYR 9 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 1x8c n SER 10 N 0.67 0.08 0.00 7.72 3.41 -1.26 -4.72 113.62 119.52 1x8c n SER 10 Ca 0.22 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.83 1x8c n SER 10 Cb 0.78 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.73 1x8c n SER 10 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1x8c n GLU 12 N 0.00 0.00 -0.14 4.33 1.02 -1.26 -2.13 120.64 122.46 1x8c n GLU 12 Ca 0.00 0.00 -0.07 0.00 -0.02 0.00 0.00 57.16 57.07 1x8c n GLU 12 Cb 0.00 0.00 0.10 0.00 -0.02 0.00 0.00 31.44 31.52 1x8c n GLU 12 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1x8c h ALA 14 N 1.14 1.16 -0.30 0.00 0.00 -1.80 0.12 119.26 119.58 1x8c h ALA 14 Ca 0.15 -0.28 -0.10 0.00 0.00 0.00 0.00 54.91 54.68 1x8c h ALA 14 Cb 0.54 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1x8c h ALA 14 CO 0.03 0.54 -0.22 1.25 0.00 0.00 0.00 179.25 180.85 1x8c h LEU 15 N 0.59 0.71 -0.91 0.00 5.85 -1.76 -0.78 115.31 119.01 1x8c h LEU 15 Ca 0.11 -0.44 -0.01 0.00 0.84 0.00 0.00 57.88 58.37 1x8c h LEU 15 Cb 0.50 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.29 1x8c h LEU 15 CO 0.03 1.00 0.52 0.74 -0.34 0.00 0.00 178.44 180.39 1x8c h THR 16 N 0.42 1.26 -0.47 1.05 2.02 -0.81 0.32 112.91 116.70 1x8c h THR 16 Ca 0.06 -0.62 -0.07 0.00 0.77 0.00 0.00 66.41 66.55 1x8c h THR 16 Cb 0.77 0.01 -0.02 0.00 -1.74 0.00 0.00 68.15 67.17 1x8c h THR 16 CO 0.06 0.29 0.03 0.00 0.37 0.00 0.00 175.52 176.26 1x8c h ALA 17 N 1.28 0.63 0.09 6.16 0.00 -0.79 -2.05 119.26 124.59 1x8c h ALA 17 Ca 0.32 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1x8c h ALA 17 Cb 0.00 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 1x8c h ALA 17 CO -0.05 0.41 -0.07 0.37 0.00 0.00 0.00 179.25 179.90 1x8c h GLN 18 N 0.67 -0.17 0.00 0.00 4.15 -0.54 -1.00 115.11 118.23 1x8c h GLN 18 Ca 0.14 0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.57 1x8c h GLN 18 Cb 0.46 0.04 0.00 0.00 0.21 0.00 0.00 27.48 28.19 1x8c h GLN 18 CO 0.02 -0.11 0.00 1.04 -1.93 0.00 0.00 178.83 177.85 1x8c n GLN 19 N -5.18 0.14 -0.45 1.69 6.02 0.05 -2.59 117.38 117.07 1x8c n GLN 19 Ca -0.08 0.49 0.08 0.00 -0.01 0.00 0.00 57.00 57.48 1x8c n GLN 19 Cb 0.11 -1.84 0.27 0.00 1.02 0.00 0.00 30.24 29.79 1x8c n GLN 19 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1x8c n ASN 20 N -2.12 3.98 0.00 1.08 3.02 -0.78 -4.96 115.26 115.47 1x8c n ASN 20 Ca 0.01 -2.60 0.00 0.00 -0.03 0.00 0.00 54.58 51.96 1x8c n ASN 20 Cb 0.14 -0.48 0.00 0.00 -0.61 0.00 0.00 39.78 38.83 1x8c n ASN 20 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1x8c n GLY 21 N 0.24 0.54 3.77 7.41 0.00 -1.07 -2.92 105.19 113.17 1x8c n GLY 21 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 1x8c n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x8c s ALA 22 N -2.00 3.55 -0.07 4.61 0.00 -0.44 -4.91 121.76 122.50 1x8c s ALA 22 Ca 0.00 1.46 0.14 0.00 0.00 0.00 0.00 51.96 53.56 1x8c s ALA 22 Cb 0.00 -3.56 -0.16 0.00 0.00 0.00 0.00 23.12 19.40 1x8c s ALA 22 CO 0.00 -0.91 0.87 -0.44 0.00 0.00 0.00 175.76 175.28 1x8c h ASP 23 N 3.19 0.00 -5.05 0.00 3.32 -1.34 -3.43 116.42 113.10 1x8c h ASP 23 Ca -0.50 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.50 1x8c h ASP 23 Cb 1.23 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 40.65 1x8c h ASP 23 CO 0.65 0.76 0.01 -0.60 -1.72 0.00 0.00 179.24 178.33 1x8c s ARG 24 N -2.79 1.11 -0.01 3.56 3.52 -0.90 -4.13 118.95 119.32 1x8c s ARG 24 Ca -0.03 -0.61 0.04 0.00 -0.13 0.00 0.00 55.73 55.01 1x8c s ARG 24 Cb 0.08 0.50 -0.01 0.00 -1.56 0.00 0.00 34.95 33.96 1x8c s ARG 24 CO 0.81 -0.45 -0.15 0.08 -0.81 0.00 0.00 175.30 174.79 1x8c s VAL 25 N -3.66 1.15 -0.27 7.11 1.01 -0.24 -1.21 120.40 124.28 1x8c s VAL 25 Ca 0.02 -0.62 -0.08 0.00 0.00 0.00 0.00 61.98 61.29 1x8c s VAL 25 Cb 0.01 -0.96 -0.02 0.00 0.00 0.00 0.00 36.38 35.41 1x8c s VAL 25 CO -0.11 0.32 0.10 -0.70 0.00 0.00 0.00 175.10 174.71 1x8c s GLU 26 N -0.34 3.51 -0.23 2.72 2.12 -0.61 -0.44 118.70 125.43 1x8c s GLU 26 Ca 0.06 -0.58 -0.16 0.00 0.36 0.00 0.00 54.97 54.65 1x8c s GLU 26 Cb -0.06 -3.41 -0.04 0.00 0.26 0.00 0.00 34.13 30.88 1x8c s GLU 26 CO -0.01 -0.28 0.40 -1.17 -0.54 0.00 0.00 175.26 173.66 1x8c s LEU 27 N 1.61 4.11 0.27 2.70 2.96 -0.62 -0.58 118.68 129.13 1x8c s LEU 27 Ca 0.05 0.44 0.02 0.00 -0.22 0.00 0.00 54.13 54.43 1x8c s LEU 27 Cb -0.16 -2.50 -0.04 0.00 0.50 0.00 0.00 46.19 43.99 1x8c s LEU 27 CO 0.05 -0.13 0.14 0.00 -1.32 0.00 0.00 176.35 175.09 1x8c s ALA 29 N -3.75 1.36 -0.68 0.00 0.00 -0.40 -4.08 121.76 114.22 1x8c s ALA 29 Ca 0.37 -1.49 -0.00 0.00 0.00 0.00 0.00 51.96 50.84 1x8c s ALA 29 Cb 0.06 0.15 -0.00 0.00 0.00 0.00 0.00 23.12 23.33 1x8c s ALA 29 CO 0.16 -0.16 0.64 0.00 0.00 0.00 0.00 175.76 176.40 1x8c n ALA 30 N -0.18 -2.40 -0.07 0.00 0.00 -1.26 -0.13 120.51 116.45 1x8c n ALA 30 Ca -0.10 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.46 1x8c n ALA 30 Cb 0.61 -1.49 0.50 0.00 0.00 0.00 0.00 19.45 19.07 1x8c n ALA 30 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1x8c h PRO 31 N 0.37 0.40 0.00 0.00 0.13 -1.94 -0.91 132.00 130.04 1x8c h PRO 31 Ca -0.02 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.09 1x8c h PRO 31 Cb 1.01 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.05 1x8c h PRO 31 CO 0.28 0.26 0.00 0.87 -0.23 0.00 0.00 178.00 179.18 1x8c h LYS 32 N 0.41 0.00 -0.01 0.86 1.57 -2.02 -1.67 116.57 115.71 1x8c h LYS 32 Ca 0.27 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.05 1x8c h LYS 32 Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.82 1x8c h LYS 32 CO -0.07 0.00 -0.55 0.39 -0.57 0.00 0.00 179.45 178.65 1x8c n GLU 33 N -2.34 0.93 -0.43 3.15 -0.58 -0.38 -4.94 120.64 116.05 1x8c n GLU 33 Ca 0.01 -0.75 0.00 0.00 -0.42 0.00 0.00 57.16 56.00 1x8c n GLU 33 Cb 0.19 -1.48 0.00 0.00 -0.57 0.00 0.00 31.44 29.57 1x8c n GLU 33 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1x8c n GLY 34 N 1.43 0.76 0.00 0.62 0.00 -0.63 -4.53 105.19 102.83 1x8c n GLY 34 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1x8c n GLY 34 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x8c n GLY 35 N -2.27 1.61 3.44 -0.02 0.00 -1.00 -5.01 105.19 101.95 1x8c n GLY 35 Ca 0.00 -1.08 -0.21 0.00 0.00 0.00 0.00 46.02 44.73 1x8c n GLY 35 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1x8c s LEU 36 N 0.00 2.34 0.26 0.99 1.43 0.81 -4.80 118.68 119.71 1x8c s LEU 36 Ca 0.00 -1.30 -0.31 0.00 -1.03 0.00 0.00 54.13 51.49 1x8c s LEU 36 Cb 0.00 -0.49 -0.13 0.00 0.03 0.00 0.00 46.19 45.60 1x8c s LEU 36 CO 0.00 -0.50 1.51 0.41 0.23 0.00 0.00 176.35 178.00 1x8c n THR 37 N -0.64 0.92 -1.96 5.49 -1.04 -0.36 -1.27 114.28 115.41 1x8c n THR 37 Ca -0.04 -0.23 -0.32 0.00 -2.04 0.00 0.00 64.05 61.42 1x8c n THR 37 Cb 0.65 -1.72 0.02 0.00 -1.82 0.00 0.00 70.33 67.46 1x8c n THR 37 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 1x8c s PRO 38 N -0.35 3.30 0.87 -2.82 0.02 -1.26 -4.64 135.00 130.11 1x8c s PRO 38 Ca 0.67 1.11 -0.11 0.00 0.02 0.00 0.00 61.00 62.68 1x8c s PRO 38 Cb -0.57 -2.03 0.11 0.00 0.02 0.00 0.00 34.50 32.02 1x8c s PRO 38 CO 0.48 -0.82 1.09 -1.54 -0.33 0.00 0.00 177.00 175.88 1x8c s SER 39 N -3.09 3.73 0.34 2.53 1.04 -1.26 -4.79 113.70 112.20 1x8c s SER 39 Ca 0.62 1.58 0.02 0.00 0.48 0.00 0.00 55.95 58.64 1x8c s SER 39 Cb -0.15 -2.26 0.61 0.00 0.10 0.00 0.00 66.02 64.32 1x8c s SER 39 CO 0.41 -2.49 2.00 0.25 0.98 0.00 0.00 173.24 174.39 1x8c h LEU 40 N -1.45 0.74 -0.78 2.42 5.85 -1.99 -1.37 115.31 118.74 1x8c h LEU 40 Ca -0.48 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.22 1x8c h LEU 40 Cb 1.27 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 42.08 1x8c h LEU 40 CO 0.54 0.55 0.50 1.23 -0.34 0.00 0.00 178.44 180.91 1x8c h GLY 41 N 0.88 1.11 0.95 3.75 0.00 -1.99 0.04 103.07 107.81 1x8c h GLY 41 Ca 0.23 -0.44 -0.12 0.00 0.00 0.00 0.00 47.33 47.01 1x8c h GLY 41 CO -0.05 0.43 -0.29 -2.08 0.00 0.00 0.00 176.54 174.55 1x8c h VAL 42 N 1.06 1.31 0.13 4.60 2.07 -1.77 -1.62 116.25 122.02 1x8c h VAL 42 Ca 0.28 -1.46 0.01 0.00 0.82 0.00 0.00 66.70 66.35 1x8c h VAL 42 Cb -0.09 1.64 -0.02 0.00 -1.52 0.00 0.00 31.29 31.30 1x8c h VAL 42 CO -0.06 0.46 -0.14 -0.07 0.02 0.00 0.00 177.57 177.78 1x8c h LEU 43 N 0.39 -0.39 -0.83 2.57 3.38 -0.90 -0.36 115.31 119.18 1x8c h LEU 43 Ca 0.04 0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.05 1x8c h LEU 43 Cb 0.86 0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.70 1x8c h LEU 43 CO 0.07 -0.22 0.51 0.11 0.09 0.00 0.00 178.44 179.00 1x8c h LYS 44 N -0.31 1.11 -0.63 1.13 1.57 -1.03 -1.62 116.57 116.79 1x8c h LYS 44 Ca 0.01 -0.09 0.05 0.00 -1.87 0.00 0.00 60.65 58.75 1x8c h LYS 44 Cb 0.30 -0.24 -0.05 0.00 0.08 0.00 0.00 32.23 32.32 1x8c h LYS 44 CO -0.05 0.77 0.35 1.03 -0.57 0.00 0.00 179.45 180.98 1x8c h SER 45 N 1.13 0.52 -0.24 0.86 0.87 -0.84 -1.69 113.55 114.15 1x8c h SER 45 Ca 0.30 0.03 -0.12 0.00 -1.23 0.00 0.00 61.79 60.76 1x8c h SER 45 Cb -0.07 -0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 61.81 1x8c h SER 45 CO -0.06 0.34 -0.27 0.58 -0.53 0.00 0.00 176.83 176.89 1x8c h VAL 46 N 0.65 1.28 -0.10 2.23 2.07 -0.58 -1.51 116.25 120.29 1x8c h VAL 46 Ca 0.28 -1.40 -0.06 0.00 0.82 0.00 0.00 66.70 66.34 1x8c h VAL 46 Cb 0.16 1.30 -0.01 0.00 -1.52 0.00 0.00 31.29 31.22 1x8c h VAL 46 CO -0.17 0.46 -0.20 0.03 0.02 0.00 0.00 177.57 177.71 1x8c h ARG 47 N 0.63 0.16 0.00 1.57 2.47 -0.77 0.24 114.38 118.68 1x8c h ARG 47 Ca 0.08 -0.04 -0.13 0.00 -1.26 0.00 0.00 59.98 58.62 1x8c h ARG 47 Cb 0.79 -0.02 -0.02 0.00 -1.65 0.00 0.00 29.97 29.07 1x8c h ARG 47 CO 0.06 0.36 -0.80 1.96 0.56 0.00 0.00 179.97 182.12 1x8c h GLN 48 N 0.15 0.00 0.00 0.04 4.20 -1.08 -3.40 115.11 115.02 1x8c h GLN 48 Ca 0.03 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.70 1x8c h GLN 48 Cb 0.45 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.22 1x8c h GLN 48 CO 0.03 0.50 -1.49 0.54 -0.67 0.00 0.00 178.83 177.75 1x8c n ARG 49 N -3.15 0.72 -4.19 1.46 5.12 -0.59 -5.00 116.66 111.03 1x8c n ARG 49 Ca -0.01 -0.07 -0.34 0.00 -1.93 0.00 0.00 57.85 55.49 1x8c n ARG 49 Cb 0.79 -1.24 -0.12 0.00 -1.16 0.00 0.00 32.46 30.73 1x8c n ARG 49 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1x8c s VAL 50 N -2.60 4.07 -0.13 1.55 1.01 0.81 -4.97 120.40 120.14 1x8c s VAL 50 Ca -0.04 -0.29 0.00 0.00 0.00 0.00 0.00 61.98 61.66 1x8c s VAL 50 Cb 0.06 -2.82 -0.24 0.00 0.00 0.00 0.00 36.38 33.38 1x8c s VAL 50 CO 0.41 0.46 0.34 0.41 0.00 0.00 0.00 175.10 176.71 1x8c n THR 51 N 3.85 1.68 -1.04 3.92 -1.04 -1.26 -4.76 114.28 115.64 1x8c n THR 51 Ca -0.17 -0.69 -0.30 0.00 -2.04 0.00 0.00 64.05 60.85 1x8c n THR 51 Cb 0.52 -1.47 0.14 0.00 -1.82 0.00 0.00 70.33 67.71 1x8c n THR 51 CO 0.00 0.00 0.00 0.27 -0.64 0.00 0.00 175.07 174.70 1x8c s ILE 52 N -2.56 2.64 0.15 12.58 -4.36 -1.26 -4.89 121.20 123.50 1x8c s ILE 52 Ca -0.19 0.21 -0.34 0.00 -0.26 0.00 0.00 60.65 60.07 1x8c s ILE 52 Cb 0.07 -2.55 -0.14 0.00 1.25 0.00 0.00 42.46 41.09 1x8c s ILE 52 CO 0.76 -0.27 1.61 -2.65 0.24 0.00 0.00 174.94 174.63 1x8c n PRO 53 N -3.98 2.22 -4.86 0.37 -0.02 -1.26 -4.87 135.00 122.60 1x8c n PRO 53 Ca 0.08 0.80 -0.30 0.00 -2.02 0.00 0.00 63.50 62.06 1x8c n PRO 53 Cb 0.54 -2.58 -0.17 0.00 -0.02 0.00 0.00 33.50 31.27 1x8c n PRO 53 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1x8c s VAL 54 N 1.09 1.77 -0.34 -1.45 1.01 -1.26 -1.08 120.40 120.14 1x8c s VAL 54 Ca 0.79 -0.83 0.01 0.00 0.00 0.00 0.00 61.98 61.95 1x8c s VAL 54 Cb -0.66 -1.56 0.09 0.00 0.00 0.00 0.00 36.38 34.25 1x8c s VAL 54 CO 0.38 0.49 0.05 -1.00 0.00 0.00 0.00 175.10 175.03 1x8c s HIS 55 N 0.60 3.57 0.37 5.22 3.76 0.41 -4.04 115.29 125.18 1x8c s HIS 55 Ca -0.14 -2.58 -0.26 0.00 -0.15 0.00 0.00 55.06 51.93 1x8c s HIS 55 Cb -0.17 -2.72 -0.09 0.00 1.11 0.00 0.00 32.58 30.72 1x8c s HIS 55 CO 0.04 -0.92 1.14 -2.14 -0.85 0.00 0.00 174.74 172.01 1x8c s PRO 56 N 1.04 4.22 0.23 8.40 0.02 -1.25 -1.59 135.00 146.08 1x8c s PRO 56 Ca 0.05 1.79 -0.22 0.00 0.02 0.00 0.00 61.00 62.63 1x8c s PRO 56 Cb -0.20 -2.78 -0.08 0.00 0.02 0.00 0.00 34.50 31.45 1x8c s PRO 56 CO -0.06 -0.16 0.78 -1.50 -0.33 0.00 0.00 177.00 175.73 1x8c s ILE 57 N -1.39 4.45 -0.36 2.83 2.07 -0.38 -0.87 121.20 127.55 1x8c s ILE 57 Ca 0.54 1.49 0.01 0.00 -1.41 0.00 0.00 60.65 61.28 1x8c s ILE 57 Cb -0.30 -3.95 0.10 0.00 0.13 0.00 0.00 42.46 38.44 1x8c s ILE 57 CO 0.38 0.27 0.10 -0.63 -1.91 0.00 0.00 174.94 173.15 1x8c s ILE 58 N -1.45 2.69 -0.27 2.00 -1.09 0.13 -3.91 121.20 119.30 1x8c s ILE 58 Ca 0.43 -2.18 -0.02 0.00 -2.23 0.00 0.00 60.65 56.65 1x8c s ILE 58 Cb -0.19 -2.89 0.16 0.00 -1.58 0.00 0.00 42.46 37.96 1x8c s ILE 58 CO 0.23 -0.60 0.47 -0.60 -1.23 0.00 0.00 174.94 173.21 1x8c s ARG 59 N 1.01 0.44 0.47 2.79 3.52 -1.26 -4.59 118.95 121.33 1x8c s ARG 59 Ca 0.09 0.72 0.25 0.00 -0.13 0.00 0.00 55.73 56.66 1x8c s ARG 59 Cb -0.21 -0.05 1.09 0.00 -1.56 0.00 0.00 34.95 34.23 1x8c s ARG 59 CO -0.06 -0.64 1.90 -1.00 -0.81 0.00 0.00 175.30 174.69 1x8c h PRO 60 N 8.11 0.00 -3.08 5.12 0.13 -1.93 -0.95 132.00 139.40 1x8c h PRO 60 Ca -0.21 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 64.94 1x8c h PRO 60 Cb 1.16 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.20 1x8c h PRO 60 CO 0.27 0.19 0.18 -0.98 -0.23 0.00 0.00 178.00 177.42 1x8c s ARG 61 N -3.80 1.54 0.00 0.86 1.70 -1.26 -4.90 118.95 113.08 1x8c s ARG 61 Ca -0.00 -0.80 0.00 0.00 -0.47 0.00 0.00 55.73 54.45 1x8c s ARG 61 Cb 0.11 0.58 0.00 0.00 -0.57 0.00 0.00 34.95 35.07 1x8c s ARG 61 CO 0.62 -0.68 0.00 0.41 -1.08 0.00 0.00 175.30 174.56 1x8c n GLY 62 N -0.41 -1.02 6.61 3.88 0.00 -1.26 -4.91 105.19 108.08 1x8c n GLY 62 Ca -0.09 -1.67 0.00 0.00 0.00 0.00 0.00 46.02 44.26 1x8c n GLY 62 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x8c n GLY 63 N 5.00 -0.35 3.57 -0.02 0.00 -1.26 -4.92 105.19 107.20 1x8c n GLY 63 Ca 0.00 -1.15 -0.29 0.00 0.00 0.00 0.00 46.02 44.58 1x8c n GLY 63 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1x8c s ASP 64 N -4.00 1.21 -0.28 1.61 1.47 -1.26 -4.98 116.67 110.44 1x8c s ASP 64 Ca 0.00 0.94 0.09 0.00 1.18 0.00 0.00 52.55 54.77 1x8c s ASP 64 Cb 0.00 -1.42 0.51 0.00 -0.34 0.00 0.00 42.92 41.67 1x8c s ASP 64 CO 0.00 -3.98 1.46 0.49 0.68 0.00 0.00 175.17 173.82 1x8c n PHE 65 N -4.71 1.05 -3.33 2.11 3.01 -1.26 -4.80 117.46 109.53 1x8c n PHE 65 Ca 0.09 -1.56 -0.42 0.00 1.01 0.00 0.00 57.45 56.57 1x8c n PHE 65 Cb 0.58 -0.48 -0.02 0.00 -0.01 0.00 0.00 39.48 39.56 1x8c n PHE 65 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1x8c s TYR 67 N -1.74 2.81 0.87 0.00 1.51 -1.26 -5.06 117.35 114.49 1x8c s TYR 67 Ca 0.31 1.54 -0.13 0.00 -1.01 0.00 0.00 57.07 57.77 1x8c s TYR 67 Cb -0.05 -3.12 0.14 0.00 -0.11 0.00 0.00 41.96 38.82 1x8c s TYR 67 CO -0.04 -1.35 1.24 -1.54 -1.11 0.00 0.00 175.55 172.74 1x8c s SER 68 N -2.41 3.88 0.32 2.29 1.04 -1.26 -4.81 113.70 112.75 1x8c s SER 68 Ca 0.67 0.51 0.06 0.00 0.48 0.00 0.00 55.95 57.67 1x8c s SER 68 Cb -0.19 -0.80 0.56 0.00 0.10 0.00 0.00 66.02 65.70 1x8c s SER 68 CO 0.34 -2.27 1.80 0.44 0.98 0.00 0.00 173.24 174.52 1x8c h ASP 69 N -1.30 0.33 -0.30 7.02 3.32 -1.98 0.69 116.42 124.21 1x8c h ASP 69 Ca -0.45 -0.10 -0.06 0.00 0.02 0.00 0.00 57.03 56.44 1x8c h ASP 69 Cb 1.28 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.73 1x8c h ASP 69 CO 0.52 0.57 -0.06 1.23 -1.72 0.00 0.00 179.24 179.79 1x8c h GLY 70 N 0.97 0.61 1.28 2.75 0.00 -1.99 0.59 103.07 107.29 1x8c h GLY 70 Ca 0.05 -0.50 -0.11 0.00 0.00 0.00 0.00 47.33 46.77 1x8c h GLY 70 CO 0.04 0.45 -0.18 0.83 0.00 0.00 0.00 176.54 177.68 1x8c h GLU 71 N 0.34 0.83 -0.42 4.80 5.08 -1.87 -2.76 114.58 120.57 1x8c h GLU 71 Ca 0.08 -0.32 -0.08 0.00 -1.00 0.00 0.00 59.36 58.03 1x8c h GLU 71 Cb 0.53 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.72 1x8c h GLU 71 CO 0.03 0.95 -0.08 0.35 -1.00 0.00 0.00 179.01 179.25 1x8c h PHE 72 N 0.73 0.78 -0.89 4.33 3.57 -0.67 -0.62 116.94 124.17 1x8c h PHE 72 Ca 0.11 -0.13 -0.01 0.00 3.53 0.00 0.00 57.97 61.46 1x8c h PHE 72 Cb 0.70 -0.21 -0.04 0.00 2.79 0.00 0.00 35.95 39.19 1x8c h PHE 72 CO 0.04 0.78 0.50 0.00 -2.23 0.00 0.00 178.31 177.40 1x8c h ALA 73 N 1.25 1.20 -0.36 2.41 0.00 -0.66 -1.00 119.26 122.10 1x8c h ALA 73 Ca 0.12 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 1x8c h ALA 73 Cb 0.53 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1x8c h ALA 73 CO 0.03 0.65 -0.13 0.00 0.00 0.00 0.00 179.25 179.80 1x8c h ALA 74 N 1.31 0.51 -0.58 0.00 0.00 -1.17 -2.61 119.26 116.71 1x8c h ALA 74 Ca 0.32 -0.33 0.04 0.00 0.00 0.00 0.00 54.91 54.94 1x8c h ALA 74 Cb 0.01 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.62 1x8c h ALA 74 CO -0.05 0.40 0.33 0.82 0.00 0.00 0.00 179.25 180.75 1x8c h ILE 75 N 0.52 1.01 -0.63 0.00 2.04 -0.54 0.12 117.51 120.03 1x8c h ILE 75 Ca 0.09 -0.22 -0.04 0.00 1.00 0.00 0.00 64.86 65.69 1x8c h ILE 75 Cb 0.66 0.32 -0.03 0.00 -0.74 0.00 0.00 36.82 37.03 1x8c h ILE 75 CO 0.04 0.12 0.24 -0.07 0.00 0.00 0.00 178.15 178.48 1x8c h LEU 76 N 0.63 0.88 -0.97 1.44 3.38 -1.14 -0.51 115.31 119.02 1x8c h LEU 76 Ca 0.25 -0.18 -0.07 0.00 0.09 0.00 0.00 57.88 57.97 1x8c h LEU 76 Cb 0.10 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 1x8c h LEU 76 CO -0.14 0.82 0.02 -0.08 0.09 0.00 0.00 178.44 179.15 1x8c h GLU 77 N 0.89 0.76 -0.25 1.13 4.57 -1.02 -1.26 114.58 119.39 1x8c h GLU 77 Ca 0.21 -0.19 -0.11 0.00 -1.18 0.00 0.00 59.36 58.09 1x8c h GLU 77 Cb 0.22 -0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 28.70 1x8c h GLU 77 CO -0.02 0.76 -0.31 -0.44 -1.18 0.00 0.00 179.01 177.83 1x8c h ASP 78 N 0.72 0.53 -0.14 1.04 3.32 -0.28 -0.18 116.42 121.43 1x8c h ASP 78 Ca 0.14 -0.20 -0.02 0.00 0.02 0.00 0.00 57.03 56.98 1x8c h ASP 78 Cb 0.41 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.81 1x8c h ASP 78 CO 0.02 0.81 0.02 0.58 -1.72 0.00 0.00 179.24 178.95 1x8c h VAL 79 N 0.45 1.22 -0.93 -1.35 2.07 -0.65 -0.02 116.25 117.04 1x8c h VAL 79 Ca 0.06 -0.72 0.01 0.00 0.82 0.00 0.00 66.70 66.87 1x8c h VAL 79 Cb 0.76 1.44 -0.05 0.00 -1.52 0.00 0.00 31.29 31.92 1x8c h VAL 79 CO 0.06 0.21 0.62 0.03 0.02 0.00 0.00 177.57 178.51 1x8c h ARG 80 N 0.00 1.21 -0.30 1.57 3.08 -1.06 -1.60 114.38 117.28 1x8c h ARG 80 Ca 0.04 -0.07 -0.03 0.00 0.07 0.00 0.00 59.98 59.99 1x8c h ARG 80 Cb 0.31 -0.27 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 1x8c h ARG 80 CO 0.00 0.80 0.09 1.15 -1.07 0.00 0.00 179.97 180.94 1x8c h THR 81 N 1.25 1.21 -0.48 2.04 2.02 -0.79 -0.63 112.91 117.53 1x8c h THR 81 Ca 0.35 -0.67 -0.05 0.00 0.77 0.00 0.00 66.41 66.80 1x8c h THR 81 Cb -0.12 1.08 -0.02 0.00 -1.74 0.00 0.00 68.15 67.34 1x8c h THR 81 CO -0.08 0.22 0.07 0.58 0.37 0.00 0.00 175.52 176.68 1x8c h VAL 82 N 0.32 1.22 -0.03 3.16 2.07 -0.75 -0.51 116.25 121.74 1x8c h VAL 82 Ca 0.10 -0.85 -0.00 0.00 0.82 0.00 0.00 66.70 66.77 1x8c h VAL 82 Cb 0.26 0.78 -0.00 0.00 -1.52 0.00 0.00 31.29 30.81 1x8c h VAL 82 CO -0.00 0.30 0.00 -0.09 0.02 0.00 0.00 177.57 177.81 1x8c h ARG 83 N 0.71 0.05 -0.14 1.57 2.43 -1.08 -2.76 114.38 115.17 1x8c h ARG 83 Ca 0.15 -0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.28 1x8c h ARG 83 Cb 0.34 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.87 1x8c h ARG 83 CO 0.01 0.30 -0.05 1.49 -1.51 0.00 0.00 179.97 180.21 1x8c h GLU 84 N -0.21 0.20 0.00 0.20 4.57 -0.76 -1.19 114.58 117.40 1x8c h GLU 84 Ca 0.01 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.16 1x8c h GLU 84 Cb 0.28 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 28.83 1x8c h GLU 84 CO 0.00 0.27 0.00 1.28 -1.18 0.00 0.00 179.01 179.38 1x8c n LEU 85 N -4.36 0.10 0.00 1.64 4.77 -0.23 -4.90 117.00 114.02 1x8c n LEU 85 Ca -0.01 0.52 0.00 0.00 -0.03 0.00 0.00 56.01 56.49 1x8c n LEU 85 Cb 0.20 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 40.78 1x8c n LEU 85 CO 0.37 -0.24 0.00 0.61 -1.33 0.00 0.00 177.39 176.80 1x8c n GLY 86 N 0.31 0.87 3.76 -0.72 0.00 -0.45 -5.01 105.19 103.96 1x8c n GLY 86 Ca 0.04 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.68 1x8c n GLY 86 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1x8c s PHE 87 N -2.02 2.68 -1.05 1.61 0.40 -1.05 -4.91 117.98 113.64 1x8c s PHE 87 Ca 0.00 1.46 0.29 0.00 -0.60 0.00 0.00 56.93 58.08 1x8c s PHE 87 Cb 0.00 -3.56 1.22 0.00 0.51 0.00 0.00 43.02 41.19 1x8c s PHE 87 CO 0.00 -2.04 1.91 -0.35 0.70 0.00 0.00 175.22 175.44 1x8c n PRO 88 N -0.54 0.05 -3.85 0.24 -0.04 -1.26 -4.78 135.00 124.83 1x8c n PRO 88 Ca 0.08 -0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.51 1x8c n PRO 88 Cb 0.46 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 32.43 1x8c n PRO 88 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1x8c s GLY 89 N -2.95 0.01 0.19 0.55 0.00 -1.26 -1.32 107.32 102.55 1x8c s GLY 89 Ca 0.16 -0.18 -0.14 0.00 0.00 0.00 0.00 44.72 44.55 1x8c s GLY 89 CO 0.53 2.02 0.45 0.48 0.00 0.00 0.00 173.10 176.58 1x8c s LEU 90 N -3.32 0.38 -0.09 0.66 0.05 -0.85 -3.79 118.68 111.72 1x8c s LEU 90 Ca 0.20 -0.65 0.03 0.00 0.05 0.00 0.00 54.13 53.76 1x8c s LEU 90 Cb -0.02 1.82 0.01 0.00 -2.05 0.00 0.00 46.19 45.95 1x8c s LEU 90 CO 0.04 -1.02 -0.18 -0.69 -0.55 0.00 0.00 176.35 173.95 1x8c s VAL 91 N -3.92 1.61 0.23 1.48 1.01 -0.05 -0.44 120.40 120.33 1x8c s VAL 91 Ca 0.13 -0.75 -0.13 0.00 0.00 0.00 0.00 61.98 61.23 1x8c s VAL 91 Cb 0.00 -1.43 0.05 0.00 0.00 0.00 0.00 36.38 35.01 1x8c s VAL 91 CO -0.01 0.46 0.68 1.07 0.00 0.00 0.00 175.10 177.31 1x8c n THR 92 N 3.76 0.00 0.00 3.92 5.66 -0.38 0.18 114.28 127.42 1x8c n THR 92 Ca -0.21 -0.62 0.00 0.00 -3.05 0.00 0.00 64.05 60.18 1x8c n THR 92 Cb 0.52 0.68 0.00 0.00 -1.55 0.00 0.00 70.33 69.99 1x8c n THR 92 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1x8c n GLY 93 N -0.47 1.44 2.85 1.09 0.00 -1.26 -1.33 105.19 107.50 1x8c n GLY 93 Ca -0.05 0.15 -0.18 0.00 0.00 0.00 0.00 46.02 45.95 1x8c n GLY 93 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1x8c s VAL 94 N -0.62 0.31 0.19 1.61 1.01 -1.26 -4.87 120.40 116.78 1x8c s VAL 94 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 61.98 62.07 1x8c s VAL 94 Cb 0.00 -0.38 -0.04 0.00 0.00 0.00 0.00 36.38 35.95 1x8c s VAL 94 CO 0.00 0.17 -0.18 -0.76 0.00 0.00 0.00 175.10 174.34 1x8c s LEU 95 N 0.95 2.49 0.79 3.92 1.43 -0.62 -1.22 118.68 126.43 1x8c s LEU 95 Ca -0.11 -0.93 -0.05 0.00 -1.03 0.00 0.00 54.13 52.01 1x8c s LEU 95 Cb -0.14 -0.85 0.15 0.00 0.03 0.00 0.00 46.19 45.38 1x8c s LEU 95 CO -0.01 -0.05 1.09 1.51 0.23 0.00 0.00 176.35 179.12 1x8c s ASP 96 N -2.97 4.00 0.39 2.29 1.47 0.53 -3.94 116.67 118.44 1x8c s ASP 96 Ca 0.20 -0.17 0.27 0.00 1.18 0.00 0.00 52.55 54.03 1x8c s ASP 96 Cb -0.04 -0.11 1.41 0.00 -0.34 0.00 0.00 42.92 43.83 1x8c s ASP 96 CO 0.08 -2.11 1.82 -0.37 0.68 0.00 0.00 175.17 175.27 1x8c h VAL 97 N -0.85 0.00 -0.26 2.11 -1.51 -1.97 -2.06 116.25 111.71 1x8c h VAL 97 Ca -0.39 -0.04 0.00 0.00 -1.23 0.00 0.00 66.70 65.04 1x8c h VAL 97 Cb 1.26 0.67 0.00 0.00 -2.13 0.00 0.00 31.29 31.09 1x8c h VAL 97 CO 0.40 0.00 0.00 0.47 -1.23 0.00 0.00 177.57 177.21 1x8c n ASP 98 N -2.45 3.12 0.00 4.19 8.00 -1.26 -4.94 116.55 123.21 1x8c n ASP 98 Ca -0.01 -1.96 0.00 0.00 0.71 0.00 0.00 54.79 53.53 1x8c n ASP 98 Cb 0.07 -0.16 0.00 0.00 -0.02 0.00 0.00 41.12 41.01 1x8c n ASP 98 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1x8c n GLY 99 N 1.42 0.71 3.89 0.44 0.00 -0.77 -4.67 105.19 106.21 1x8c n GLY 99 Ca 0.18 -0.20 -0.32 0.00 0.00 0.00 0.00 46.02 45.67 1x8c n GLY 99 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1x8c s ASN 100 N -2.19 6.53 0.25 1.61 0.01 -1.26 -1.56 114.94 118.33 1x8c s ASN 100 Ca 0.00 0.64 -0.31 0.00 -0.71 0.00 0.00 52.86 52.48 1x8c s ASN 100 Cb 0.00 -2.11 -0.11 0.00 0.41 0.00 0.00 41.25 39.44 1x8c s ASN 100 CO 0.00 0.10 1.57 -0.69 -1.51 0.00 0.00 177.10 176.57 1x8c s VAL 101 N -1.57 2.31 0.62 1.60 1.01 -1.26 -0.34 120.40 122.77 1x8c s VAL 101 Ca 0.38 0.25 -0.10 0.00 0.00 0.00 0.00 61.98 62.51 1x8c s VAL 101 Cb -0.13 -3.16 -0.02 0.00 0.00 0.00 0.00 36.38 33.08 1x8c s VAL 101 CO 0.22 0.03 1.01 -0.62 0.00 0.00 0.00 175.10 175.74 1x8c s ASP 102 N 0.67 5.95 0.00 3.32 -1.08 -0.36 -4.70 116.67 120.47 1x8c s ASP 102 Ca 0.65 1.21 0.00 0.00 -0.52 0.00 0.00 52.55 53.89 1x8c s ASP 102 Cb -0.46 -2.21 0.00 0.00 -1.46 0.00 0.00 42.92 38.79 1x8c s ASP 102 CO 0.41 -0.99 0.00 -2.65 0.52 0.00 0.00 175.17 172.47 1x8c n PRO 104 N -2.75 0.00 0.00 4.34 -0.02 -1.26 -4.62 135.00 130.69 1x8c n PRO 104 Ca 0.05 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.53 1x8c n PRO 104 Cb 0.55 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.03 1x8c n PRO 104 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1x8c n ARG 105 N 0.00 0.31 0.00 -0.52 1.74 -1.26 -2.44 116.66 114.49 1x8c n ARG 105 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1x8c n ARG 105 Cb 0.00 -1.28 0.00 0.00 -1.02 0.00 0.00 32.46 30.16 1x8c n ARG 105 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1x8c n GLU 107 N 0.68 0.00 -0.00 5.56 1.02 -1.26 -1.96 120.64 124.67 1x8c n GLU 107 Ca 0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 57.16 57.09 1x8c n GLU 107 Cb 0.13 0.00 0.15 0.00 -0.02 0.00 0.00 31.44 31.69 1x8c n GLU 107 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 1x8c h LYS 108 N 0.00 0.53 -1.16 3.49 1.57 -1.88 -1.24 116.57 117.88 1x8c h LYS 108 Ca 0.00 -0.24 0.00 0.00 -1.87 0.00 0.00 60.65 58.54 1x8c h LYS 108 Cb 0.00 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.30 1x8c h LYS 108 CO 0.00 0.79 0.00 -0.89 -0.57 0.00 0.00 179.45 178.78 1x8c n ILE 109 N -4.07 0.25 0.00 1.86 5.41 -0.83 -1.72 119.36 120.26 1x8c n ILE 109 Ca -0.01 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.74 1x8c n ILE 109 Cb 0.46 -0.51 0.00 0.00 -0.71 0.00 0.00 39.64 38.88 1x8c n ILE 109 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1x8c n ALA 111 N 0.62 0.00 0.16 -1.39 0.00 -0.47 -0.63 120.51 118.79 1x8c n ALA 111 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.45 1x8c n ALA 111 Cb 0.16 0.00 0.23 0.00 0.00 0.00 0.00 19.45 19.84 1x8c n ALA 111 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1x8c h ALA 112 N 0.00 0.99 0.00 0.00 0.00 -1.60 -3.07 119.26 115.58 1x8c h ALA 112 Ca 0.00 -0.48 -0.01 0.00 0.00 0.00 0.00 54.91 54.42 1x8c h ALA 112 Cb 0.00 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 1x8c h ALA 112 CO 0.00 0.66 -0.04 0.00 0.00 0.00 0.00 179.25 179.87 1x8c h ALA 113 N 1.47 1.00 -0.94 0.00 0.00 -1.14 -3.39 119.26 116.26 1x8c h ALA 113 Ca -0.01 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1x8c h ALA 113 Cb 1.02 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.80 1x8c h ALA 113 CO 0.07 0.05 0.00 0.41 0.00 0.00 0.00 179.25 179.78 1x8c n GLY 114 N 0.31 3.77 0.00 0.00 0.00 -1.16 -1.97 105.19 106.14 1x8c n GLY 114 Ca 0.01 -0.02 0.15 0.00 0.00 0.00 0.00 46.02 46.17 1x8c n GLY 114 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1x8c n PRO 115 N 14.00 0.79 -1.88 1.61 -0.04 -1.26 -4.92 135.00 143.30 1x8c n PRO 115 Ca 0.00 0.00 -0.39 0.00 -0.04 0.00 0.00 63.50 63.07 1x8c n PRO 115 Cb 0.00 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 31.98 1x8c n PRO 115 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1x8c s LEU 116 N -2.20 4.08 -0.49 1.53 1.02 -0.83 -4.94 118.68 116.84 1x8c s LEU 116 Ca 0.40 2.79 -0.27 0.00 0.02 0.00 0.00 54.13 57.07 1x8c s LEU 116 Cb 0.21 -4.01 0.03 0.00 0.02 0.00 0.00 46.19 42.44 1x8c s LEU 116 CO 0.39 -1.16 1.06 0.00 0.02 0.00 0.00 176.35 176.66 1x8c s ALA 117 N -1.26 3.16 -0.13 4.21 0.00 -0.43 -4.91 121.76 122.40 1x8c s ALA 117 Ca 0.62 -0.70 -0.17 0.00 0.00 0.00 0.00 51.96 51.71 1x8c s ALA 117 Cb -0.41 -3.82 -0.04 0.00 0.00 0.00 0.00 23.12 18.85 1x8c s ALA 117 CO 0.52 -2.27 0.45 0.08 0.00 0.00 0.00 175.76 174.54 1x8c s VAL 118 N 4.26 5.21 -0.21 0.00 1.01 -1.26 -2.00 120.40 127.40 1x8c s VAL 118 Ca 0.42 0.89 -0.08 0.00 0.00 0.00 0.00 61.98 63.20 1x8c s VAL 118 Cb -0.09 -3.79 -0.04 0.00 0.00 0.00 0.00 36.38 32.47 1x8c s VAL 118 CO 0.28 0.33 0.10 -0.89 0.00 0.00 0.00 175.10 174.92 1x8c s THR 119 N 0.63 4.92 -0.26 3.92 2.01 0.41 -1.22 115.64 126.06 1x8c s THR 119 Ca 0.24 0.02 -0.21 0.00 0.31 0.00 0.00 61.69 62.05 1x8c s THR 119 Cb -0.15 -3.26 -0.01 0.00 0.01 0.00 0.00 72.50 69.09 1x8c s THR 119 CO 0.09 0.41 0.66 0.12 -0.69 0.00 0.00 174.62 175.21 1x8c s PHE 120 N 0.75 3.27 0.00 4.92 5.36 -0.34 -1.25 117.98 130.68 1x8c s PHE 120 Ca 0.05 0.82 0.00 0.00 -0.96 0.00 0.00 56.93 56.84 1x8c s PHE 120 Cb -0.13 -2.91 0.00 0.00 -0.34 0.00 0.00 43.02 39.64 1x8c s PHE 120 CO 0.02 -0.37 0.00 -2.39 -1.46 0.00 0.00 175.22 171.02 1x8c n HIS 121 N 5.80 -0.85 0.19 10.12 1.44 -0.44 -1.22 115.22 130.26 1x8c n HIS 121 Ca 0.00 0.00 0.01 0.00 -2.01 0.00 0.00 57.72 55.72 1x8c n HIS 121 Cb 0.49 0.00 0.04 0.00 0.12 0.00 0.00 29.99 30.64 1x8c n HIS 121 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 1x8c n ARG 122 N -0.22 0.10 0.25 -1.40 1.74 -1.19 -1.22 116.66 114.72 1x8c n ARG 122 Ca 0.00 0.00 0.09 0.00 -0.77 0.00 0.00 57.85 57.17 1x8c n ARG 122 Cb 0.00 -1.24 0.66 0.00 -1.02 0.00 0.00 32.46 30.86 1x8c n ARG 122 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1x8c h ALA 123 N 1.67 1.59 -0.81 7.54 0.00 -1.89 0.13 119.26 127.50 1x8c h ALA 123 Ca 0.00 -0.10 0.09 0.00 0.00 0.00 0.00 54.91 54.90 1x8c h ALA 123 Cb 0.00 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.72 1x8c h ALA 123 CO 0.00 0.14 0.53 0.35 0.00 0.00 0.00 179.25 180.26 1x8c h PHE 124 N 0.00 0.83 0.00 0.00 3.04 -1.45 -2.72 116.94 116.64 1x8c h PHE 124 Ca -0.00 0.02 -0.01 0.00 3.98 0.00 0.00 57.97 61.96 1x8c h PHE 124 Cb 0.23 -0.27 -0.00 0.00 2.56 0.00 0.00 35.95 38.46 1x8c h PHE 124 CO 0.00 0.40 -0.00 -0.25 -2.02 0.00 0.00 178.31 176.43 1x8c n ASP 125 N -4.50 3.38 -0.62 0.41 8.00 0.03 -4.80 116.55 118.45 1x8c n ASP 125 Ca 0.13 -1.91 0.01 0.00 0.71 0.00 0.00 54.79 53.74 1x8c n ASP 125 Cb 0.30 -0.73 -0.01 0.00 -0.02 0.00 0.00 41.12 40.66 1x8c n ASP 125 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1x8c s ALA 128 N -4.89 3.80 -0.60 0.00 0.00 -0.60 -4.70 121.76 114.77 1x8c s ALA 128 Ca 0.00 -0.73 -0.03 0.00 0.00 0.00 0.00 51.96 51.20 1x8c s ALA 128 Cb 0.00 -2.06 0.00 0.00 0.00 0.00 0.00 23.12 21.06 1x8c s ALA 128 CO 0.00 0.49 0.61 0.09 0.00 0.00 0.00 175.76 176.95 1x8c n ASN 129 N -0.46 -7.28 -0.13 0.00 3.02 -1.26 -4.69 115.26 104.47 1x8c n ASN 129 Ca -0.04 0.07 -0.05 0.00 -0.03 0.00 0.00 54.58 54.53 1x8c n ASN 129 Cb 0.53 -4.92 0.01 0.00 -0.61 0.00 0.00 39.78 34.80 1x8c n ASN 129 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 1x8c h PRO 130 N 0.75 -0.10 -0.16 3.52 0.11 -1.94 0.16 132.00 134.33 1x8c h PRO 130 Ca 0.00 0.01 -0.03 0.00 0.11 0.00 0.00 66.00 66.08 1x8c h PRO 130 Cb 0.98 0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.10 1x8c h PRO 130 CO 0.25 -0.07 -0.03 -0.07 -0.21 0.00 0.00 178.00 177.87 1x8c h LEU 131 N -0.10 0.31 -0.95 2.35 3.38 -1.99 0.31 115.31 118.62 1x8c h LEU 131 Ca 0.21 -0.36 0.05 0.00 0.09 0.00 0.00 57.88 57.86 1x8c h LEU 131 Cb 0.42 -0.09 -0.06 0.00 0.09 0.00 0.00 40.66 41.03 1x8c h LEU 131 CO -0.49 0.60 0.61 0.22 0.09 0.00 0.00 178.44 179.47 1x8c h TYR 132 N 0.02 1.14 -0.23 1.13 3.20 -1.88 -0.51 116.97 119.84 1x8c h TYR 132 Ca 0.04 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.91 1x8c h TYR 132 Cb 0.46 -0.38 -0.01 0.00 1.54 0.00 0.00 36.73 38.35 1x8c h TYR 132 CO 0.05 0.63 0.01 1.15 -1.64 0.00 0.00 178.16 178.36 1x8c h THR 133 N 1.15 1.25 -0.46 1.81 2.02 -0.48 -1.99 112.91 116.22 1x8c h THR 133 Ca 0.39 -0.85 0.05 0.00 0.77 0.00 0.00 66.41 66.77 1x8c h THR 133 Cb 0.07 1.36 -0.04 0.00 -1.74 0.00 0.00 68.15 67.79 1x8c h THR 133 CO -0.14 0.27 0.20 -0.07 0.37 0.00 0.00 175.52 176.14 1x8c h LEU 134 N 0.17 0.26 -0.68 2.58 3.38 -0.35 0.11 115.31 120.78 1x8c h LEU 134 Ca 0.07 0.04 0.07 0.00 0.09 0.00 0.00 57.88 58.15 1x8c h LEU 134 Cb 0.38 -0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.07 1x8c h LEU 134 CO 0.01 0.18 0.36 0.78 0.09 0.00 0.00 178.44 179.87 1x8c h ASN 135 N 0.40 0.51 0.36 -0.43 2.35 -0.97 -0.40 115.58 117.41 1x8c h ASN 135 Ca 0.21 0.04 -0.12 0.00 -0.55 0.00 0.00 56.30 55.88 1x8c h ASN 135 Cb 0.16 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 38.46 1x8c h ASN 135 CO -0.18 0.32 -0.49 0.78 -1.65 0.00 0.00 177.43 176.21 1x8c h ASN 136 N 0.65 0.16 -0.37 5.81 2.35 -0.53 -1.79 115.58 121.87 1x8c h ASN 136 Ca 0.32 -0.08 -0.12 0.00 -0.55 0.00 0.00 56.30 55.87 1x8c h ASN 136 Cb 0.26 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 38.57 1x8c h ASN 136 CO -0.22 0.63 -0.23 -0.07 -1.65 0.00 0.00 177.43 175.89 1x8c h LEU 137 N 0.12 0.89 -0.91 1.61 3.38 0.20 -1.43 115.31 119.17 1x8c h LEU 137 Ca 0.00 -0.33 -0.03 0.00 0.09 0.00 0.00 57.88 57.61 1x8c h LEU 137 Cb 0.91 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 41.38 1x8c h LEU 137 CO 0.07 1.08 0.37 0.00 0.09 0.00 0.00 178.44 180.05 1x8c h ALA 138 N 0.99 1.15 -0.52 1.53 0.00 -0.88 -1.24 119.26 120.28 1x8c h ALA 138 Ca 0.10 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 1x8c h ALA 138 Cb 0.77 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 1x8c h ALA 138 CO 0.06 0.64 0.13 1.49 0.00 0.00 0.00 179.25 181.57 1x8c h GLU 139 N 1.15 0.79 0.00 0.00 4.81 -0.85 -2.13 114.58 118.34 1x8c h GLU 139 Ca 0.28 -0.15 -0.06 0.00 -0.13 0.00 0.00 59.36 59.29 1x8c h GLU 139 Cb 0.13 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.38 1x8c h GLU 139 CO -0.03 0.71 -0.27 -0.07 -0.73 0.00 0.00 179.01 178.61 1x8c h LEU 140 N 0.76 0.00 0.00 1.64 3.38 -0.60 -3.47 115.31 117.02 1x8c h LEU 140 Ca 0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.14 1x8c h LEU 140 Cb 0.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1x8c h LEU 140 CO -0.00 0.27 0.00 0.61 0.09 0.00 0.00 178.44 179.41 1x8c n GLY 141 N 0.27 0.97 3.73 0.83 0.00 -0.70 -5.03 105.19 105.26 1x8c n GLY 141 Ca 0.00 -0.04 -0.42 0.00 0.00 0.00 0.00 46.02 45.56 1x8c n GLY 141 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1x8c s ILE 142 N -2.00 2.14 0.07 -0.61 -1.09 -0.56 -4.77 121.20 114.38 1x8c s ILE 142 Ca 0.00 0.10 -0.14 0.00 -2.23 0.00 0.00 60.65 58.38 1x8c s ILE 142 Cb 0.00 -3.06 -0.24 0.00 -1.58 0.00 0.00 42.46 37.58 1x8c s ILE 142 CO 0.00 0.01 1.19 0.00 -1.23 0.00 0.00 174.94 174.91 1x8c h ALA 143 N 6.39 0.12 -2.85 9.38 0.00 -1.50 -3.39 119.26 127.41 1x8c h ALA 143 Ca -0.44 -0.70 -0.03 0.00 0.00 0.00 0.00 54.91 53.74 1x8c h ALA 143 Cb 1.20 0.06 -0.12 0.00 0.00 0.00 0.00 17.79 18.94 1x8c h ALA 143 CO 0.92 0.68 0.02 -0.98 0.00 0.00 0.00 179.25 179.90 1x8c s ARG 144 N -3.30 1.21 -0.08 0.00 1.70 -1.19 -1.48 118.95 115.81 1x8c s ARG 144 Ca -0.10 -0.70 0.03 0.00 -0.47 0.00 0.00 55.73 54.49 1x8c s ARG 144 Cb 0.07 0.51 0.01 0.00 -0.57 0.00 0.00 34.95 34.97 1x8c s ARG 144 CO 0.92 -0.50 -0.17 0.08 -1.08 0.00 0.00 175.30 174.55 1x8c s VAL 145 N -3.81 1.49 -0.28 4.99 1.01 0.09 -1.20 120.40 122.69 1x8c s VAL 145 Ca 0.04 -0.69 -0.19 0.00 0.00 0.00 0.00 61.98 61.14 1x8c s VAL 145 Cb 0.00 -1.32 -0.02 0.00 0.00 0.00 0.00 36.38 35.04 1x8c s VAL 145 CO -0.09 0.43 0.58 -0.22 0.00 0.00 0.00 175.10 175.80 1x8c s LEU 146 N 0.54 4.11 0.02 3.92 0.20 -0.36 -4.58 118.68 122.53 1x8c s LEU 146 Ca -0.16 0.50 -0.14 0.00 0.69 0.00 0.00 54.13 55.01 1x8c s LEU 146 Cb -0.17 -2.76 0.02 0.00 -0.43 0.00 0.00 46.19 42.86 1x8c s LEU 146 CO 0.06 -0.39 0.31 0.28 -0.29 0.00 0.00 176.35 176.32 1x8c s THR 147 N 2.47 0.07 -0.23 3.68 -1.32 -1.26 -3.17 115.64 115.87 1x8c s THR 147 Ca 0.24 -0.58 0.13 0.00 -1.21 0.00 0.00 61.69 60.27 1x8c s THR 147 Cb -0.15 -0.79 0.54 0.00 -1.51 0.00 0.00 72.50 70.58 1x8c s THR 147 CO 0.10 -0.32 1.48 -1.54 -2.21 0.00 0.00 174.62 172.13 1x8c n SER 148 N 0.90 3.45 -1.07 8.08 3.41 -1.23 -1.66 113.62 125.49 1x8c n SER 148 Ca -0.20 -3.31 -0.14 0.00 -0.26 0.00 0.00 58.87 54.96 1x8c n SER 148 Cb 0.58 -0.60 -0.06 0.00 -0.26 0.00 0.00 64.21 63.87 1x8c n SER 148 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1x8c n GLY 149 N -0.73 1.45 2.24 5.00 0.00 -1.26 -2.18 105.19 109.70 1x8c n GLY 149 Ca 0.28 -0.37 -0.12 0.00 0.00 0.00 0.00 46.02 45.81 1x8c n GLY 149 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1x8c n GLN 150 N -2.59 -1.04 -4.69 1.61 6.02 -1.26 -4.74 117.38 110.68 1x8c n GLN 150 Ca -0.14 0.59 -0.31 0.00 -0.01 0.00 0.00 57.00 57.14 1x8c n GLN 150 Cb 0.46 -4.77 -0.09 0.00 1.02 0.00 0.00 30.24 26.86 1x8c n GLN 150 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 1x8c s LYS 151 N -4.63 2.09 0.49 -1.09 -0.14 -0.93 -5.03 119.74 110.50 1x8c s LYS 151 Ca 0.01 -2.28 0.15 0.00 -1.36 0.00 0.00 55.97 52.49 1x8c s LYS 151 Cb -0.00 -1.53 1.18 0.00 -1.68 0.00 0.00 37.83 35.80 1x8c s LYS 151 CO 0.01 -0.25 2.09 0.77 -0.76 0.00 0.00 175.35 177.21 1x8c h SER 152 N 1.54 0.14 -5.03 2.83 0.02 -1.96 -3.43 113.55 107.66 1x8c h SER 152 Ca -0.44 -0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.40 1x8c h SER 152 Cb 1.28 -0.03 -0.18 0.00 0.14 0.00 0.00 62.40 63.61 1x8c h SER 152 CO 0.76 0.09 -0.31 1.51 -1.14 0.00 0.00 176.83 177.74 1x8c s ASP 153 N -6.79 -0.10 0.41 3.07 1.47 -1.26 -4.88 116.67 108.59 1x8c s ASP 153 Ca -0.06 -0.13 0.13 0.00 1.18 0.00 0.00 52.55 53.67 1x8c s ASP 153 Cb 0.18 0.31 0.96 0.00 -0.34 0.00 0.00 42.92 44.03 1x8c s ASP 153 CO 0.70 -0.52 1.92 0.00 0.68 0.00 0.00 175.17 177.95 1x8c h ALA 154 N 3.60 2.00 -0.80 2.11 0.00 -1.14 -2.12 119.26 122.91 1x8c h ALA 154 Ca -0.31 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.56 1x8c h ALA 154 Cb 1.19 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.85 1x8c h ALA 154 CO 0.44 -0.19 0.32 1.25 0.00 0.00 0.00 179.25 181.07 1x8c h LEU 155 N 0.51 1.10 -0.94 0.00 5.85 -1.87 -0.90 115.31 119.06 1x8c h LEU 155 Ca 0.37 -0.17 -0.09 0.00 0.84 0.00 0.00 57.88 58.83 1x8c h LEU 155 Cb 0.71 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.45 1x8c h LEU 155 CO -0.13 0.97 -0.20 1.56 -0.34 0.00 0.00 178.44 180.30 1x8c h GLN 156 N 1.16 0.54 -0.78 1.25 4.20 -1.72 -2.64 115.11 117.13 1x8c h GLN 156 Ca 0.27 -0.19 -0.08 0.00 0.06 0.00 0.00 58.65 58.71 1x8c h GLN 156 Cb 0.21 -0.04 -0.05 0.00 0.30 0.00 0.00 27.48 27.90 1x8c h GLN 156 CO -0.02 0.71 0.10 0.41 -0.67 0.00 0.00 178.83 179.36 1x8c n GLY 157 N -0.44 2.77 0.30 3.46 0.00 -0.75 -4.50 105.19 106.03 1x8c n GLY 157 Ca 0.00 -0.65 -0.04 0.00 0.00 0.00 0.00 46.02 45.33 1x8c n GLY 157 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1x8c h LEU 158 N 2.34 0.87 -0.78 0.99 5.85 -0.81 0.14 115.31 123.90 1x8c h LEU 158 Ca 0.10 -0.02 -0.08 0.00 0.84 0.00 0.00 57.88 58.72 1x8c h LEU 158 Cb 1.68 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 42.48 1x8c h LEU 158 CO 0.43 0.62 0.02 0.77 -0.34 0.00 0.00 178.44 179.94 1x8c h SER 159 N 1.03 0.91 -0.19 1.25 4.64 -1.84 -2.82 113.55 116.52 1x8c h SER 159 Ca 0.29 -0.23 -0.04 0.00 -0.47 0.00 0.00 61.79 61.34 1x8c h SER 159 Cb -0.08 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 61.76 1x8c h SER 159 CO -0.08 0.96 -0.02 0.50 -0.87 0.00 0.00 176.83 177.32 1x8c h LYS 160 N 0.87 0.36 -0.82 4.77 1.63 -1.74 -2.12 116.57 119.52 1x8c h LYS 160 Ca 0.16 -0.13 0.00 0.00 -0.85 0.00 0.00 60.65 59.84 1x8c h LYS 160 Cb 0.49 -0.03 0.00 0.00 -0.60 0.00 0.00 32.23 32.09 1x8c h LYS 160 CO 0.02 0.59 0.00 -0.89 -3.45 0.00 0.00 179.45 175.72 1x8c n ILE 161 N -4.67 0.00 0.00 2.00 5.41 0.43 -1.14 119.36 121.39 1x8c n ILE 161 Ca -0.05 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.70 1x8c n ILE 161 Cb 0.25 -0.16 0.00 0.00 -0.71 0.00 0.00 39.64 39.02 1x8c n ILE 161 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 1x8c n GLU 163 N 0.57 0.00 -0.19 0.38 2.13 -0.80 -1.62 120.64 121.11 1x8c n GLU 163 Ca 0.00 0.00 -0.08 0.00 0.66 0.00 0.00 57.16 57.74 1x8c n GLU 163 Cb 0.00 0.00 0.02 0.00 0.27 0.00 0.00 31.44 31.73 1x8c n GLU 163 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 1x8c h LEU 164 N 0.00 0.70 -0.44 4.31 3.38 -1.42 -1.29 115.31 120.55 1x8c h LEU 164 Ca 0.00 -0.13 -0.00 0.00 0.09 0.00 0.00 57.88 57.83 1x8c h LEU 164 Cb 0.00 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 1x8c h LEU 164 CO 0.00 0.64 0.27 0.40 0.09 0.00 0.00 178.44 179.83 1x8c h ILE 165 N 0.71 1.13 0.00 1.22 2.04 -1.56 -2.38 117.51 118.67 1x8c h ILE 165 Ca 0.18 -0.30 0.00 0.00 1.00 0.00 0.00 64.86 65.75 1x8c h ILE 165 Cb 0.13 0.55 0.00 0.00 -0.74 0.00 0.00 36.82 36.75 1x8c h ILE 165 CO -0.02 0.13 0.00 0.00 0.00 0.00 0.00 178.15 178.26 1x8c n ALA 166 N -2.24 2.20 0.02 1.87 0.00 -1.09 -3.57 120.51 117.69 1x8c n ALA 166 Ca 0.01 -0.10 -0.22 0.00 0.00 0.00 0.00 53.44 53.13 1x8c n ALA 166 Cb 0.05 -1.40 -0.14 0.00 0.00 0.00 0.00 19.45 17.96 1x8c n ALA 166 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1x8c h HIS 167 N 0.00 0.48 -3.56 0.00 -0.00 -0.70 -3.48 115.15 107.89 1x8c h HIS 167 Ca 0.00 -0.35 -0.10 0.00 -0.00 0.00 0.00 60.37 59.92 1x8c h HIS 167 Cb 0.29 -0.02 -0.16 0.00 -0.00 0.00 0.00 27.41 27.52 1x8c h HIS 167 CO 0.00 1.58 -0.35 0.50 -0.00 0.00 0.00 177.93 179.66 1x8c s ARG 168 N -2.50 0.75 0.05 5.26 3.52 -1.17 -5.04 118.95 119.83 1x8c s ARG 168 Ca -0.19 -0.68 0.11 0.00 -0.13 0.00 0.00 55.73 54.84 1x8c s ARG 168 Cb 0.05 0.31 -0.20 0.00 -1.56 0.00 0.00 34.95 33.55 1x8c s ARG 168 CO 0.78 -0.23 0.96 0.22 -0.81 0.00 0.00 175.30 176.22 1x8c h ASP 169 N 3.24 0.00 -4.27 -2.12 1.82 -1.89 -3.42 116.42 109.78 1x8c h ASP 169 Ca -0.32 0.00 -0.51 0.00 -0.39 0.00 0.00 57.03 55.80 1x8c h ASP 169 Cb 1.20 0.00 -0.29 0.00 0.68 0.00 0.00 39.33 40.92 1x8c h ASP 169 CO 0.49 0.94 -0.82 0.00 -1.61 0.00 0.00 179.24 178.24 1x8c s ALA 170 N -2.69 1.32 0.80 -0.78 0.00 -1.26 -3.91 121.76 115.24 1x8c s ALA 170 Ca -0.02 -0.71 -0.11 0.00 0.00 0.00 0.00 51.96 51.12 1x8c s ALA 170 Cb 0.09 -0.32 0.07 0.00 0.00 0.00 0.00 23.12 22.96 1x8c s ALA 170 CO 0.82 0.32 1.09 -2.14 0.00 0.00 0.00 175.76 175.84 1x8c s PRO 171 N -0.48 2.08 0.33 0.00 0.02 -1.26 -4.66 135.00 131.03 1x8c s PRO 171 Ca 0.06 0.93 -0.29 0.00 0.02 0.00 0.00 61.00 61.72 1x8c s PRO 171 Cb -0.06 -1.90 -0.10 0.00 0.02 0.00 0.00 34.50 32.46 1x8c s PRO 171 CO -0.00 -1.69 1.25 0.42 -0.33 0.00 0.00 177.00 176.65 1x8c s ILE 172 N -2.99 2.91 0.60 2.83 1.01 -0.55 -4.78 121.20 120.23 1x8c s ILE 172 Ca 0.61 0.90 0.02 0.00 0.00 0.00 0.00 60.65 62.18 1x8c s ILE 172 Cb -0.16 -3.57 0.12 0.00 0.01 0.00 0.00 42.46 38.85 1x8c s ILE 172 CO 0.56 0.21 0.83 -0.38 0.00 0.00 0.00 174.94 176.15 1x8c n ILE 173 N 0.83 0.00 -3.75 2.92 2.08 -1.26 -0.73 119.36 119.44 1x8c n ILE 173 Ca 0.00 -1.42 -0.13 0.00 0.56 0.00 0.00 62.75 61.75 1x8c n ILE 173 Cb 0.43 -0.88 -0.14 0.00 -0.75 0.00 0.00 39.64 38.30 1x8c n ILE 173 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1x8c s ALA 175 N -3.01 -0.32 0.03 -1.39 0.00 -0.57 -3.95 121.76 112.55 1x8c s ALA 175 Ca 0.56 0.70 -0.16 0.00 0.00 0.00 0.00 51.96 53.07 1x8c s ALA 175 Cb -0.03 -0.46 0.03 0.00 0.00 0.00 0.00 23.12 22.65 1x8c s ALA 175 CO 0.37 -0.15 0.35 0.20 0.00 0.00 0.00 175.76 176.52 1x8c s GLY 176 N 1.08 -0.18 0.00 0.00 0.00 -0.66 -0.16 107.32 107.39 1x8c s GLY 176 Ca -0.08 0.18 0.00 0.00 0.00 0.00 0.00 44.72 44.82 1x8c s GLY 176 CO -0.06 -0.05 0.00 0.00 0.00 0.00 0.00 173.10 172.99 1x8c n ALA 177 N 0.67 0.00 -1.00 3.20 0.00 -1.26 -3.58 120.51 118.54 1x8c n ALA 177 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.25 1x8c n ALA 177 Cb 0.59 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.04 1x8c n ALA 177 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1x8c n GLY 178 N 1.59 0.66 3.66 0.00 0.00 -1.26 -0.93 105.19 108.91 1x8c n GLY 178 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1x8c n GLY 178 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1x8c s VAL 179 N -2.64 4.34 0.26 1.61 1.01 -1.26 -4.93 120.40 118.79 1x8c s VAL 179 Ca 0.00 1.63 -0.03 0.00 0.00 0.00 0.00 61.98 63.58 1x8c s VAL 179 Cb 0.00 -4.05 -0.02 0.00 0.00 0.00 0.00 36.38 32.31 1x8c s VAL 179 CO 0.00 -0.13 0.31 0.00 0.00 0.00 0.00 175.10 175.29 1x8c s ARG 180 N 3.30 1.53 0.29 2.72 1.70 -1.26 -4.58 118.95 122.65 1x8c s ARG 180 Ca 0.53 -1.64 0.04 0.00 -0.47 0.00 0.00 55.73 54.19 1x8c s ARG 180 Cb -0.21 0.36 0.68 0.00 -0.57 0.00 0.00 34.95 35.21 1x8c s ARG 180 CO 0.14 -0.58 1.77 0.00 -1.08 0.00 0.00 175.30 175.55 1x8c h ALA 181 N 2.34 1.54 0.00 7.88 0.00 -1.94 -0.52 119.26 128.57 1x8c h ALA 181 Ca -0.30 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 1x8c h ALA 181 Cb 1.24 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.98 1x8c h ALA 181 CO 0.43 -0.07 -0.05 0.93 0.00 0.00 0.00 179.25 180.50 1x8c h GLU 182 N 0.71 0.00 0.00 0.00 3.07 -1.97 -3.14 114.58 113.25 1x8c h GLU 182 Ca 0.54 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.40 1x8c h GLU 182 Cb 0.83 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.74 1x8c h GLU 182 CO -0.38 0.05 0.00 0.27 -1.40 0.00 0.00 179.01 177.54 1x8c n ASN 183 N -4.35 1.70 -0.29 1.42 0.23 -0.70 -4.76 115.26 108.51 1x8c n ASN 183 Ca -0.03 -1.74 0.02 0.00 -0.53 0.00 0.00 54.58 52.31 1x8c n ASN 183 Cb 0.13 0.00 0.16 0.00 -2.08 0.00 0.00 39.78 37.99 1x8c n ASN 183 CO 0.00 0.00 0.00 0.25 -0.93 0.00 0.00 177.26 176.58 1x8c h LEU 184 N 0.00 0.71 -1.68 -4.53 6.46 -1.08 -2.42 115.31 112.77 1x8c h LEU 184 Ca 0.00 0.04 0.14 0.00 -0.12 0.00 0.00 57.88 57.94 1x8c h LEU 184 Cb 0.40 -0.10 -0.04 0.00 -0.73 0.00 0.00 40.66 40.20 1x8c h LEU 184 CO 0.00 0.41 0.46 1.12 -0.62 0.00 0.00 178.44 179.81 1x8c h HIS 185 N 0.83 0.37 -0.44 1.25 2.07 -1.86 -1.72 115.15 115.66 1x8c h HIS 185 Ca 0.39 0.01 0.04 0.00 -2.85 0.00 0.00 60.37 57.96 1x8c h HIS 185 Cb 0.32 -0.12 -0.04 0.00 2.57 0.00 0.00 27.41 30.15 1x8c h HIS 185 CO -0.05 0.15 0.22 0.45 -3.07 0.00 0.00 177.93 175.62 1x8c h HIS 186 N 0.33 0.40 -0.33 6.12 3.86 -1.80 0.74 115.15 124.47 1x8c h HIS 186 Ca 0.33 0.02 -0.15 0.00 -1.16 0.00 0.00 60.37 59.40 1x8c h HIS 186 Cb 0.82 -0.12 -0.00 0.00 1.06 0.00 0.00 27.41 29.17 1x8c h HIS 186 CO -0.00 0.20 -0.40 0.74 0.86 0.00 0.00 177.93 179.33 1x8c h PHE 187 N 0.43 1.03 -0.31 2.45 -1.00 -1.44 -2.49 116.94 115.60 1x8c h PHE 187 Ca 0.19 -0.33 -0.03 0.00 2.81 0.00 0.00 57.97 60.61 1x8c h PHE 187 Cb 0.10 -0.21 -0.01 0.00 3.61 0.00 0.00 35.95 39.43 1x8c h PHE 187 CO -0.10 1.13 0.08 -0.07 -1.61 0.00 0.00 178.31 177.74 1x8c h LEU 188 N 0.63 0.47 -2.04 1.54 3.38 -1.20 -1.66 115.31 116.43 1x8c h LEU 188 Ca 0.04 -0.23 -0.02 0.00 0.09 0.00 0.00 57.88 57.76 1x8c h LEU 188 Cb 0.99 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.61 1x8c h LEU 188 CO 0.09 0.58 -0.09 0.44 0.09 0.00 0.00 178.44 179.55 1x8c h ASP 189 N 0.34 0.00 0.35 -0.43 3.32 -0.86 -1.31 116.42 117.83 1x8c h ASP 189 Ca 0.10 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.15 1x8c h ASP 189 Cb 0.29 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.84 1x8c h ASP 189 CO 0.00 0.09 -0.08 0.00 -1.72 0.00 0.00 179.24 177.53 1x8c n ALA 190 N -2.35 2.70 -0.65 3.45 0.00 -0.92 -4.92 120.51 117.83 1x8c n ALA 190 Ca -0.02 -0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.17 1x8c n ALA 190 Cb 0.18 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.27 1x8c n ALA 190 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1x8c n GLY 191 N 1.25 0.62 3.71 0.00 0.00 -0.49 -5.03 105.19 105.24 1x8c n GLY 191 Ca 0.15 -0.55 -0.42 0.00 0.00 0.00 0.00 46.02 45.21 1x8c n GLY 191 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1x8c s VAL 192 N -2.00 3.32 -0.15 1.61 1.01 -0.67 -4.92 120.40 118.61 1x8c s VAL 192 Ca 0.00 0.89 0.16 0.00 0.00 0.00 0.00 61.98 63.03 1x8c s VAL 192 Cb 0.00 -3.57 -0.03 0.00 0.00 0.00 0.00 36.38 32.77 1x8c s VAL 192 CO 0.00 0.05 1.12 -0.07 0.00 0.00 0.00 175.10 176.20 1x8c h LEU 193 N 7.35 0.00 -7.77 3.92 3.38 -1.90 -3.43 115.31 116.86 1x8c h LEU 193 Ca -0.41 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.25 1x8c h LEU 193 Cb 1.20 0.00 -0.30 0.00 0.09 0.00 0.00 40.66 41.65 1x8c h LEU 193 CO 0.88 0.50 -0.74 -1.61 0.09 0.00 0.00 178.44 177.56 1x8c s GLU 194 N -2.97 0.31 0.03 1.13 2.02 -1.25 -0.31 118.70 117.65 1x8c s GLU 194 Ca 0.00 -0.06 0.06 0.00 0.02 0.00 0.00 54.97 55.00 1x8c s GLU 194 Cb 0.08 -0.35 -0.02 0.00 0.10 0.00 0.00 34.13 33.94 1x8c s GLU 194 CO 0.78 0.00 -0.19 0.14 0.02 0.00 0.00 175.26 176.02 1x8c s VAL 195 N 0.29 1.49 -0.10 2.63 -7.23 -0.25 -1.51 120.40 115.73 1x8c s VAL 195 Ca -0.03 -1.04 0.03 0.00 -1.81 0.00 0.00 61.98 59.13 1x8c s VAL 195 Cb -0.06 -1.29 -0.01 0.00 0.56 0.00 0.00 36.38 35.59 1x8c s VAL 195 CO -0.01 0.22 -0.21 -2.28 -0.31 0.00 0.00 175.10 172.52 1x8c s HIS 196 N -0.70 2.62 0.00 2.82 2.46 0.77 -0.82 115.29 122.44 1x8c s HIS 196 Ca 0.06 -0.87 -0.05 0.00 0.47 0.00 0.00 55.06 54.67 1x8c s HIS 196 Cb -0.08 -1.73 -0.00 0.00 -0.13 0.00 0.00 32.58 30.64 1x8c s HIS 196 CO 0.01 -0.32 0.09 0.45 -2.47 0.00 0.00 174.74 172.51 1x8c s SER 197 N 0.24 0.07 0.13 9.88 0.15 -0.42 -4.26 113.70 119.50 1x8c s SER 197 Ca -0.14 -0.25 0.17 0.00 0.70 0.00 0.00 55.95 56.43 1x8c s SER 197 Cb -0.17 0.18 -0.07 0.00 -1.71 0.00 0.00 66.02 64.26 1x8c s SER 197 CO 0.07 -0.33 1.01 0.77 1.20 0.00 0.00 173.24 175.96 1x8c h SER 198 N 4.49 0.00 -6.16 5.45 4.64 -1.84 -0.64 113.55 119.49 1x8c h SER 198 Ca -0.31 0.00 -0.45 0.00 -0.47 0.00 0.00 61.79 60.56 1x8c h SER 198 Cb 1.20 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 63.12 1x8c h SER 198 CO 0.41 0.49 -0.67 0.00 -0.87 0.00 0.00 176.83 176.20 1x8c n ALA 199 N -2.33 -1.15 -1.73 5.18 0.00 -1.26 -4.63 120.51 114.59 1x8c n ALA 199 Ca -0.06 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.06 1x8c n ALA 199 Cb 0.78 -2.85 -0.01 0.00 0.00 0.00 0.00 19.45 17.38 1x8c n ALA 199 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1x8c s GLY 200 N -2.95 2.11 0.17 0.00 0.00 -1.26 0.02 107.32 105.41 1x8c s GLY 200 Ca 0.57 0.32 -0.19 0.00 0.00 0.00 0.00 44.72 45.41 1x8c s GLY 200 CO 0.70 0.62 0.53 0.00 0.00 0.00 0.00 173.10 174.95 1x8c s ALA 201 N -2.51 -1.20 -0.18 3.20 0.00 -0.39 -4.74 121.76 115.94 1x8c s ALA 201 Ca 0.62 0.09 -0.04 0.00 0.00 0.00 0.00 51.96 52.63 1x8c s ALA 201 Cb -0.14 0.82 -0.02 0.00 0.00 0.00 0.00 23.12 23.78 1x8c s ALA 201 CO 0.35 -0.76 -0.03 -1.58 0.00 0.00 0.00 175.76 173.74 1x8c s TRP 202 N -3.81 3.01 -0.19 0.00 0.52 -1.26 -1.36 118.94 115.84 1x8c s TRP 202 Ca 0.04 -0.48 -0.05 0.00 0.02 0.00 0.00 56.10 55.64 1x8c s TRP 202 Cb -0.00 -2.03 -0.02 0.00 -1.15 0.00 0.00 33.47 30.26 1x8c s TRP 202 CO -0.09 -0.21 -0.01 1.14 0.02 0.00 0.00 176.95 177.80 1x8c s GLN 203 N 0.81 3.60 0.67 4.98 -2.07 -0.37 -4.93 119.66 122.35 1x8c s GLN 203 Ca -0.01 -0.54 -0.17 0.00 -1.82 0.00 0.00 55.36 52.83 1x8c s GLN 203 Cb -0.14 -3.03 0.00 0.00 -1.09 0.00 0.00 33.01 28.74 1x8c s GLN 203 CO 0.02 0.03 1.25 0.00 -1.32 0.00 0.00 175.29 175.27 1x8c n ALA 204 N 4.17 0.89 -1.86 2.60 0.00 -1.26 -0.88 120.51 124.16 1x8c n ALA 204 Ca -0.17 -0.05 -0.41 0.00 0.00 0.00 0.00 53.44 52.81 1x8c n ALA 204 Cb 0.52 -2.30 -0.03 0.00 0.00 0.00 0.00 19.45 17.64 1x8c n ALA 204 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1x8c s SER 205 N -1.48 7.06 -0.59 0.00 0.15 -1.26 -4.78 113.70 112.81 1x8c s SER 205 Ca 0.81 2.37 -0.28 0.00 0.70 0.00 0.00 55.95 59.55 1x8c s SER 205 Cb -0.37 -2.63 0.03 0.00 -1.71 0.00 0.00 66.02 61.35 1x8c s SER 205 CO 0.42 -0.34 1.20 -2.16 1.20 0.00 0.00 173.24 173.57 1x8c s PRO 206 N -1.07 3.48 0.00 5.44 0.04 -1.26 -5.06 135.00 136.58 1x8c s PRO 206 Ca 0.49 0.20 0.00 0.00 0.04 0.00 0.00 61.00 61.73 1x8c s PRO 206 Cb -0.34 -4.03 0.00 0.00 0.04 0.00 0.00 34.50 30.17 1x8c s PRO 206 CO 0.42 -1.72 0.00 0.54 0.04 0.00 0.00 177.00 176.28 1x8c n ARG 208 N 8.53 0.65 -5.04 4.56 1.74 -1.26 -5.20 116.66 120.63 1x8c n ARG 208 Ca 0.08 0.00 -0.32 0.00 -0.77 0.00 0.00 57.85 56.84 1x8c n ARG 208 Cb 0.49 -0.09 -0.14 0.00 -1.02 0.00 0.00 32.46 31.70 1x8c n ARG 208 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 1x8c s TYR 209 N -0.39 2.52 0.09 -1.55 5.04 -1.26 -5.13 117.35 116.67 1x8c s TYR 209 Ca 0.00 -0.29 -0.04 0.00 -2.44 0.00 0.00 57.07 54.30 1x8c s TYR 209 Cb 0.00 -1.55 -0.02 0.00 0.35 0.00 0.00 41.96 40.73 1x8c s TYR 209 CO 0.00 0.10 0.09 1.03 -1.34 0.00 0.00 175.55 175.43 1x8c s ARG 210 N -0.76 0.80 -1.17 4.97 0.52 -1.26 -5.28 118.95 116.77 1x8c s ARG 210 Ca 0.11 -1.16 -0.27 0.00 -0.52 0.00 0.00 55.73 53.89 1x8c s ARG 210 Cb -0.10 0.28 0.02 0.00 0.52 0.00 0.00 34.95 35.66 1x8c s ARG 210 CO 0.00 -0.22 0.74 0.27 0.02 0.00 0.00 175.30 176.12 1x8c n ASN 211 N -0.02 -4.78 0.00 0.23 0.23 -1.26 -5.37 115.26 104.29 1x8c n ASN 211 Ca -0.12 -1.15 0.00 0.00 -0.53 0.00 0.00 54.58 52.78 1x8c n ASN 211 Cb 0.62 -2.60 0.00 0.00 -2.08 0.00 0.00 39.78 35.72 1x8c n ASN 211 CO 0.00 0.00 0.00 -1.84 -0.93 0.00 0.00 177.26 174.49 1x8c n GLU 224 N -4.59 0.00 0.00 -3.83 -0.00 -1.26 -5.35 120.64 105.61 1x8c n GLU 224 Ca -0.10 0.00 0.06 0.00 -0.00 0.00 0.00 57.16 57.12 1x8c n GLU 224 Cb 0.58 0.00 0.04 0.00 -0.00 0.00 0.00 31.44 32.06 1x8c n GLU 224 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 1x8c n TYR 225 N 0.00 0.00 -2.16 -1.84 4.02 -1.26 -5.00 117.16 110.92 1x8c n TYR 225 Ca 0.00 0.00 -0.34 0.00 -0.01 0.00 0.00 57.90 57.55 1x8c n TYR 225 Cb 0.00 0.00 0.01 0.00 -0.02 0.00 0.00 39.34 39.33 1x8c n TYR 225 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 176.86 174.73 1x8c s SER 226 N -1.17 5.63 -0.12 7.72 0.01 -1.26 -4.01 113.70 120.50 1x8c s SER 226 Ca 0.14 2.12 -0.05 0.00 1.31 0.00 0.00 55.95 59.47 1x8c s SER 226 Cb 0.11 -2.57 -0.04 0.00 0.21 0.00 0.00 66.02 63.73 1x8c s SER 226 CO 0.19 -1.28 0.05 -0.13 0.41 0.00 0.00 173.24 172.48 1x8c s ARG 227 N -3.47 3.39 -0.32 12.44 3.00 -0.06 -4.92 118.95 129.00 1x8c s ARG 227 Ca 0.71 -0.33 -0.20 0.00 0.00 0.00 0.00 55.73 55.90 1x8c s ARG 227 Cb -0.23 -3.00 -0.01 0.00 0.00 0.00 0.00 34.95 31.72 1x8c s ARG 227 CO 0.30 0.58 0.64 -0.47 0.00 0.00 0.00 175.30 176.35 1x8c s TYR 228 N -0.52 3.20 0.37 -0.53 6.14 -1.26 -1.23 117.35 123.51 1x8c s TYR 228 Ca 0.10 0.53 0.04 0.00 0.64 0.00 0.00 57.07 58.38 1x8c s TYR 228 Cb -0.12 -3.04 -0.04 0.00 0.42 0.00 0.00 41.96 39.19 1x8c s TYR 228 CO 0.02 -0.52 0.11 0.96 0.64 0.00 0.00 175.55 176.76 1x8c s ILE 229 N 2.65 0.76 -0.09 3.14 -4.36 -0.47 -4.87 121.20 117.96 1x8c s ILE 229 Ca 0.25 -2.00 -0.19 0.00 -0.26 0.00 0.00 60.65 58.46 1x8c s ILE 229 Cb -0.15 -2.49 -0.04 0.00 1.25 0.00 0.00 42.46 41.02 1x8c s ILE 229 CO 0.13 0.00 0.51 0.54 0.24 0.00 0.00 174.94 176.35 1x8c s VAL 230 N -3.28 5.13 -0.50 8.37 0.11 -1.26 -1.26 120.40 127.71 1x8c s VAL 230 Ca 0.28 1.03 -0.24 0.00 -2.93 0.00 0.00 61.98 60.12 1x8c s VAL 230 Cb 0.05 -3.84 0.03 0.00 -1.53 0.00 0.00 36.38 31.09 1x8c s VAL 230 CO 0.15 0.35 0.90 -0.62 -3.33 0.00 0.00 175.10 172.54 1x8c s ASP 231 N 0.42 6.41 0.27 3.54 -1.08 0.10 -4.91 116.67 121.42 1x8c s ASP 231 Ca 0.28 -0.15 -0.02 0.00 -0.52 0.00 0.00 52.55 52.14 1x8c s ASP 231 Cb -0.16 -2.43 0.46 0.00 -1.46 0.00 0.00 42.92 39.33 1x8c s ASP 231 CO 0.12 -1.09 1.84 1.23 0.52 0.00 0.00 175.17 177.79 1x8c h GLY 232 N 10.63 1.50 1.23 2.66 0.00 -1.89 -1.44 103.07 115.76 1x8c h GLY 232 Ca -0.25 -0.41 -0.05 0.00 0.00 0.00 0.00 47.33 46.62 1x8c h GLY 232 CO 1.04 0.21 0.19 0.00 0.00 0.00 0.00 176.54 177.98 1x8c h ALA 233 N 1.48 1.14 -0.65 3.60 0.00 -1.96 -1.95 119.26 120.93 1x8c h ALA 233 Ca 0.45 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 55.12 1x8c h ALA 233 Cb 0.34 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 1x8c h ALA 233 CO -0.23 0.59 0.28 0.00 0.00 0.00 0.00 179.25 179.89 1x8c h ALA 234 N 1.27 0.84 -0.09 0.00 0.00 -1.63 -0.89 119.26 118.77 1x8c h ALA 234 Ca 0.21 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1x8c h ALA 234 Cb 0.28 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1x8c h ALA 234 CO -0.01 0.44 0.05 0.28 0.00 0.00 0.00 179.25 180.02 1x8c h VAL 235 N 0.91 1.05 -0.76 0.00 2.07 -1.01 -2.91 116.25 115.60 1x8c h VAL 235 Ca 0.22 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 67.63 1x8c h VAL 235 Cb 0.18 0.97 -0.04 0.00 -1.52 0.00 0.00 31.29 30.88 1x8c h VAL 235 CO -0.02 0.04 0.48 0.00 0.02 0.00 0.00 177.57 178.09 1x8c h ALA 236 N 1.00 0.96 0.00 1.67 0.00 -1.12 -1.24 119.26 120.53 1x8c h ALA 236 Ca 0.03 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1x8c h ALA 236 Cb 0.02 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.51 1x8c h ALA 236 CO -0.01 0.40 0.00 -1.91 0.00 0.00 0.00 179.25 177.73 1x8c n GLU 237 N -4.54 0.06 0.00 0.00 2.13 -0.36 -0.39 120.64 117.54 1x8c n GLU 237 Ca 0.07 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.89 1x8c n GLU 237 Cb 0.03 -1.18 0.00 0.00 0.27 0.00 0.00 31.44 30.57 1x8c n GLU 237 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 1x8c n LYS 239 N 0.64 0.00 -0.06 5.31 3.00 -0.47 -0.95 118.16 125.63 1x8c n LYS 239 Ca 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 58.31 58.20 1x8c n LYS 239 Cb 0.02 0.00 -0.05 0.00 0.00 0.00 0.00 35.03 35.00 1x8c n LYS 239 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.40 178.18 1x8c h GLY 240 N 0.00 0.34 0.93 3.14 0.00 -0.97 -0.48 103.07 106.02 1x8c h GLY 240 Ca 0.00 -0.21 0.04 0.00 0.00 0.00 0.00 47.33 47.15 1x8c h GLY 240 CO 0.00 0.20 0.62 -2.22 0.00 0.00 0.00 176.54 175.14 1x8c h ILE 241 N 0.12 1.16 -0.43 2.60 2.04 -1.30 -1.06 117.51 120.64 1x8c h ILE 241 Ca 0.06 -0.41 -0.05 0.00 1.00 0.00 0.00 64.86 65.46 1x8c h ILE 241 Cb 0.28 -0.14 -0.02 0.00 -0.74 0.00 0.00 36.82 36.20 1x8c h ILE 241 CO 0.00 0.22 0.06 0.40 0.00 0.00 0.00 178.15 178.83 1x8c h ILE 242 N 1.19 1.25 -0.34 -0.67 2.04 -1.74 -1.49 117.51 117.75 1x8c h ILE 242 Ca 0.38 -0.91 -0.05 0.00 1.00 0.00 0.00 64.86 65.28 1x8c h ILE 242 Cb 0.02 1.01 -0.01 0.00 -0.74 0.00 0.00 36.82 37.10 1x8c h ILE 242 CO -0.12 0.31 0.00 -0.33 0.00 0.00 0.00 178.15 178.02 1x8c h GLU 243 N 0.57 0.60 -0.68 2.37 5.08 -0.57 -2.09 114.58 119.86 1x8c h GLU 243 Ca 0.13 -0.19 -0.07 0.00 -1.00 0.00 0.00 59.36 58.23 1x8c h GLU 243 Cb 0.39 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.56 1x8c h GLU 243 CO 0.01 0.72 0.16 0.00 -1.00 0.00 0.00 179.01 178.89 1x8c h ARG 244 N 0.41 1.10 -0.34 2.33 3.08 -1.19 -1.08 114.38 118.69 1x8c h ARG 244 Ca 0.10 -0.27 -0.01 0.00 0.07 0.00 0.00 59.98 59.87 1x8c h ARG 244 Cb 0.44 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.34 1x8c h ARG 244 CO 0.02 0.98 0.18 1.25 -1.07 0.00 0.00 179.97 181.33 1x8c h HIS 245 N 1.03 0.47 0.00 3.04 2.76 -1.19 0.85 115.15 122.11 1x8c h HIS 245 Ca 0.21 -0.01 -0.04 0.00 -2.20 0.00 0.00 60.37 58.33 1x8c h HIS 245 Cb 0.38 -0.15 -0.01 0.00 1.55 0.00 0.00 27.41 29.19 1x8c h HIS 245 CO 0.03 0.38 -0.20 0.37 -1.30 0.00 0.00 177.93 177.22 1x8c h GLN 246 N 0.43 0.00 0.01 5.26 -0.00 -1.23 -1.71 115.11 117.86 1x8c h GLN 246 Ca 0.12 0.00 -0.03 0.00 -0.00 0.00 0.00 58.65 58.74 1x8c h GLN 246 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 27.48 27.56 1x8c h GLN 246 CO -0.02 0.20 -0.14 0.00 0.00 0.00 0.00 178.83 178.87 1x8c h ALA 247 N 1.80 0.00 -0.47 3.38 0.00 -0.11 -3.22 119.26 120.65 1x8c h ALA 247 Ca -0.00 -0.47 0.14 0.00 0.00 0.00 0.00 54.91 54.57 1x8c h ALA 247 Cb 0.39 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 1x8c h ALA 247 CO 0.03 0.02 0.35 0.87 0.00 0.00 0.00 179.25 180.51 1x8c h LYS 248 N -0.74 0.00 -0.24 0.00 6.56 0.96 0.23 116.57 123.34 1x8c h LYS 248 Ca -0.02 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.57 1x8c h LYS 248 Cb 0.98 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.64 1x8c h LYS 248 CO 0.03 0.00 0.00 1.28 -2.06 0.00 0.00 179.45 178.70 1x8c n LEU 249 N -4.32 0.24 0.00 2.94 4.32 -0.67 -5.09 117.00 114.43 1x8c n LEU 249 Ca 0.08 -0.12 0.00 0.00 -0.02 0.00 0.00 56.01 55.95 1x8c n LEU 249 Cb 0.56 -0.12 0.00 0.00 -1.62 0.00 0.00 43.42 42.24 1x8c n LEU 249 CO 0.36 0.06 0.00 -0.62 -1.22 0.00 0.00 177.39 175.97