#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hay n PRO 5 N 0.00 -0.44 0.18 1.97 -0.02 -1.26 -4.95 135.00 130.48 3hay n PRO 5 Ca 0.00 -0.10 0.11 0.00 -2.02 0.00 0.00 63.50 61.49 3hay n PRO 5 Cb 0.00 -1.69 0.11 0.00 -0.02 0.00 0.00 33.50 31.91 3hay n PRO 5 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3hay h SER 6 N -1.54 0.00 1.60 2.55 4.64 -2.01 -3.25 113.55 115.54 3hay h SER 6 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 3hay h SER 6 Cb 1.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 3hay h SER 6 CO 0.33 0.05 0.00 0.10 -0.87 0.00 0.00 176.83 176.44 3hay h TYR 7 N 0.00 0.00 -3.16 4.77 -0.00 -1.95 -3.41 116.97 113.22 3hay h TYR 7 Ca -0.00 0.00 -0.57 0.00 0.00 0.00 0.00 58.73 58.16 3hay h TYR 7 Cb 1.04 0.00 -0.05 0.00 0.00 0.00 0.00 36.73 37.72 3hay h TYR 7 CO 0.00 0.00 1.11 0.08 -0.00 0.00 0.00 178.16 179.35 3hay s VAL 8 N -3.35 3.83 -0.64 -0.90 1.01 -1.23 -4.88 120.40 114.24 3hay s VAL 8 Ca 0.05 0.84 0.24 0.00 0.00 0.00 0.00 61.98 63.11 3hay s VAL 8 Cb 0.07 -4.13 -0.01 0.00 0.00 0.00 0.00 36.38 32.31 3hay s VAL 8 CO 0.61 -0.73 1.22 0.29 0.00 0.00 0.00 175.10 176.49 3hay n LYS 9 N 8.17 0.28 -3.73 2.72 5.02 -1.26 -4.95 118.16 124.41 3hay n LYS 9 Ca 0.17 0.05 -0.13 0.00 -2.02 0.00 0.00 58.31 56.38 3hay n LYS 9 Cb 0.48 -1.65 -0.08 0.00 -0.02 0.00 0.00 35.03 33.76 3hay n LYS 9 CO 0.00 0.00 0.00 -0.59 -0.52 0.00 0.00 177.40 176.29 3hay s PHE 10 N -3.17 -0.21 0.29 2.13 -0.12 -1.26 -5.10 117.98 110.54 3hay s PHE 10 Ca 0.05 0.27 -0.29 0.00 -0.05 0.00 0.00 56.93 56.91 3hay s PHE 10 Cb 0.14 0.13 -0.10 0.00 -0.63 0.00 0.00 43.02 42.56 3hay s PHE 10 CO 0.75 -0.45 1.16 -2.00 -0.05 0.00 0.00 175.22 174.64 3hay s GLU 11 N -1.65 4.55 -0.35 1.99 2.56 -1.26 -5.01 118.70 119.54 3hay s GLU 11 Ca -0.11 1.93 -0.08 0.00 0.00 0.00 0.00 54.97 56.71 3hay s GLU 11 Cb -0.04 -3.16 0.03 0.00 2.00 0.00 0.00 34.13 32.97 3hay s GLU 11 CO 0.03 0.08 0.13 0.08 -0.56 0.00 0.00 175.26 175.03 3hay s VAL 12 N -1.11 4.04 0.35 3.70 1.01 -1.26 -5.08 120.40 122.04 3hay s VAL 12 Ca 0.46 -1.02 -0.28 0.00 0.00 0.00 0.00 61.98 61.14 3hay s VAL 12 Cb -0.34 -3.26 -0.12 0.00 0.00 0.00 0.00 36.38 32.65 3hay s VAL 12 CO 0.44 -0.18 1.33 -2.65 0.00 0.00 0.00 175.10 174.04 3hay n PRO 13 N 4.87 2.24 0.28 2.72 -0.02 -1.26 -4.89 135.00 138.95 3hay n PRO 13 Ca -0.12 0.79 0.15 0.00 -2.02 0.00 0.00 63.50 62.29 3hay n PRO 13 Cb 0.45 -2.40 0.83 0.00 -0.02 0.00 0.00 33.50 32.36 3hay n PRO 13 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 3hay h LYS 14 N 2.63 0.00 -0.00 -0.52 3.64 -2.01 -2.37 116.57 117.93 3hay h LYS 14 Ca -0.47 0.00 -0.23 0.00 -1.27 0.00 0.00 60.65 58.68 3hay h LYS 14 Cb 1.27 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 33.11 3hay h LYS 14 CO 0.63 0.07 -0.89 0.93 -2.27 0.00 0.00 179.45 177.92 3hay h GLU 15 N 0.00 0.61 -0.39 1.90 3.07 -2.01 -3.28 114.58 114.49 3hay h GLU 15 Ca -0.00 -0.65 -0.07 0.00 -0.50 0.00 0.00 59.36 58.13 3hay h GLU 15 Cb 0.25 0.18 -0.02 0.00 -0.84 0.00 0.00 28.75 28.33 3hay h GLU 15 CO 0.01 1.25 -0.06 1.25 -1.40 0.00 0.00 179.01 180.06 3hay h LEU 16 N 0.23 0.63 -0.86 1.33 5.85 -1.81 -1.70 115.31 118.98 3hay h LEU 16 Ca -0.11 -0.16 -0.04 0.00 0.84 0.00 0.00 57.88 58.41 3hay h LEU 16 Cb 1.56 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 42.39 3hay h LEU 16 CO 0.18 0.74 0.36 0.00 -0.34 0.00 0.00 178.44 179.37 3hay h ALA 17 N 1.33 1.10 -0.58 1.25 0.00 -1.63 -0.40 119.26 120.32 3hay h ALA 17 Ca 0.11 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.75 3hay h ALA 17 Cb 0.47 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 3hay h ALA 17 CO 0.02 0.66 -0.00 0.93 0.00 0.00 0.00 179.25 180.86 3hay h GLU 18 N 1.16 1.02 -1.00 0.00 4.39 -1.50 -1.51 114.58 117.14 3hay h GLU 18 Ca 0.27 -0.32 0.02 0.00 0.34 0.00 0.00 59.36 59.68 3hay h GLU 18 Cb 0.16 -0.10 -0.05 0.00 -0.10 0.00 0.00 28.75 28.66 3hay h GLU 18 CO -0.03 1.00 0.66 0.87 -1.16 0.00 0.00 179.01 180.35 3hay h LYS 19 N 0.93 1.27 -0.52 2.33 1.57 -0.75 0.23 116.57 121.63 3hay h LYS 19 Ca 0.17 -0.08 -0.10 0.00 -1.87 0.00 0.00 60.65 58.77 3hay h LYS 19 Cb 0.55 -0.29 -0.02 0.00 0.08 0.00 0.00 32.23 32.55 3hay h LYS 19 CO 0.03 0.84 -0.09 0.00 -0.57 0.00 0.00 179.45 179.67 3hay h ALA 20 N 1.40 0.87 -0.61 3.86 0.00 -0.74 -1.96 119.26 122.08 3hay h ALA 20 Ca 0.38 -0.33 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 3hay h ALA 20 Cb -0.09 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 3hay h ALA 20 CO -0.10 0.65 0.09 -0.07 0.00 0.00 0.00 179.25 179.81 3hay h LEU 21 N 0.85 0.99 -2.04 0.00 3.38 -0.72 -2.57 115.31 115.19 3hay h LEU 21 Ca 0.14 -0.27 0.06 0.00 0.09 0.00 0.00 57.88 57.90 3hay h LEU 21 Cb 0.62 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 3hay h LEU 21 CO 0.04 1.00 0.15 1.56 0.09 0.00 0.00 178.44 181.28 3hay h GLN 22 N 0.93 0.00 0.58 1.13 4.20 -0.18 -1.97 115.11 119.79 3hay h GLN 22 Ca 0.18 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.87 3hay h GLN 22 Cb 0.44 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.23 3hay h GLN 22 CO 0.01 0.00 -0.28 0.00 -0.67 0.00 0.00 178.83 177.90 3hay h ALA 23 N 1.89 -0.78 -0.13 3.87 0.00 -0.95 -3.00 119.26 120.16 3hay h ALA 23 Ca 0.10 -0.19 0.02 0.00 0.00 0.00 0.00 54.91 54.83 3hay h ALA 23 Cb 0.40 0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 3hay h ALA 23 CO -0.00 -0.77 0.01 0.28 0.00 0.00 0.00 179.25 178.77 3hay h VAL 24 N -1.12 0.92 -0.61 0.00 2.07 -1.42 0.33 116.25 116.42 3hay h VAL 24 Ca -0.08 -0.02 0.12 0.00 0.82 0.00 0.00 66.70 67.54 3hay h VAL 24 Cb 0.64 0.86 -0.12 0.00 -1.52 0.00 0.00 31.29 31.15 3hay h VAL 24 CO 0.13 0.01 -0.21 -0.33 0.02 0.00 0.00 177.57 177.19 3hay h GLU 25 N 0.06 -0.05 0.05 1.57 5.08 -1.38 -0.59 114.58 119.31 3hay h GLU 25 Ca 0.06 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 58.15 3hay h GLU 25 Cb 0.06 0.01 0.02 0.00 0.50 0.00 0.00 28.75 29.35 3hay h GLU 25 CO -0.09 -0.04 -1.12 0.82 -1.00 0.00 0.00 179.01 177.58 3hay h ILE 26 N -0.06 1.29 -0.94 3.13 2.04 -1.35 -3.26 117.51 118.36 3hay h ILE 26 Ca 0.28 -2.34 0.17 0.00 1.00 0.00 0.00 64.86 63.98 3hay h ILE 26 Cb 0.50 2.50 -0.08 0.00 -0.74 0.00 0.00 36.82 38.99 3hay h ILE 26 CO -0.66 0.72 0.60 0.00 0.00 0.00 0.00 178.15 178.81 3hay h ALA 27 N 0.38 1.86 -0.99 1.87 0.00 0.43 -2.18 119.26 120.63 3hay h ALA 27 Ca -0.15 0.04 0.20 0.00 0.00 0.00 0.00 54.91 54.99 3hay h ALA 27 Cb 1.78 -0.09 -0.11 0.00 0.00 0.00 0.00 17.79 19.37 3hay h ALA 27 CO 0.22 -0.15 0.59 -0.09 0.00 0.00 0.00 179.25 179.82 3hay h ARG 28 N 0.67 0.70 0.04 0.00 2.43 -1.18 -0.56 114.38 116.48 3hay h ARG 28 Ca 0.50 -0.04 -0.35 0.00 -0.81 0.00 0.00 59.98 59.28 3hay h ARG 28 Cb 0.88 -0.16 -0.05 0.00 -0.42 0.00 0.00 29.97 30.23 3hay h ARG 28 CO -0.26 0.46 -2.07 -0.25 -1.51 0.00 0.00 179.97 176.34 3hay n ASP 29 N -4.80 1.33 -0.08 -3.80 8.00 -0.83 -4.59 116.55 111.78 3hay n ASP 29 Ca 0.24 0.17 -0.14 0.00 0.71 0.00 0.00 54.79 55.76 3hay n ASP 29 Cb 0.59 -0.19 -0.14 0.00 -0.02 0.00 0.00 41.12 41.36 3hay n ASP 29 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 3hay n THR 30 N -3.17 1.51 0.00 -3.53 -2.24 -1.13 -5.00 114.28 100.71 3hay n THR 30 Ca -0.30 -0.73 0.00 0.00 -2.27 0.00 0.00 64.05 60.75 3hay n THR 30 Cb 1.06 -1.03 0.00 0.00 -2.10 0.00 0.00 70.33 68.26 3hay n THR 30 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hay n GLY 31 N 1.92 3.47 3.16 3.38 0.00 -0.23 -4.56 105.19 112.34 3hay n GLY 31 Ca -0.35 -1.39 -0.11 0.00 0.00 0.00 0.00 46.02 44.17 3hay n GLY 31 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3hay s LYS 32 N 4.84 0.63 0.07 1.61 2.20 -1.08 -4.82 119.74 123.19 3hay s LYS 32 Ca 0.00 -0.57 -0.02 0.00 -0.36 0.00 0.00 55.97 55.03 3hay s LYS 32 Cb 0.00 0.26 -0.04 0.00 -1.51 0.00 0.00 37.83 36.54 3hay s LYS 32 CO 0.00 -0.17 0.00 0.96 -0.36 0.00 0.00 175.35 175.78 3hay s ILE 33 N -2.23 0.19 -0.26 5.43 -4.36 -1.26 -2.55 121.20 116.15 3hay s ILE 33 Ca -0.08 -1.78 -0.01 0.00 -0.26 0.00 0.00 60.65 58.52 3hay s ILE 33 Cb -0.03 -1.60 0.04 0.00 1.25 0.00 0.00 42.46 42.12 3hay s ILE 33 CO -0.02 -0.88 -0.06 -0.13 0.24 0.00 0.00 174.94 174.09 3hay s ARG 34 N -3.94 2.61 -0.23 0.37 1.81 0.13 -4.93 118.95 114.78 3hay s ARG 34 Ca 0.10 -1.13 -0.07 0.00 -1.72 0.00 0.00 55.73 52.91 3hay s ARG 34 Cb 0.08 -3.01 -0.03 0.00 -0.45 0.00 0.00 34.95 31.53 3hay s ARG 34 CO -0.08 -0.49 0.06 -1.59 -0.68 0.00 0.00 175.30 172.52 3hay s LYS 35 N 1.26 3.74 0.00 3.54 0.00 -1.26 -1.57 119.74 125.45 3hay s LYS 35 Ca -0.03 -0.44 0.00 0.00 0.00 0.00 0.00 55.97 55.50 3hay s LYS 35 Cb -0.18 -3.27 0.00 0.00 0.00 0.00 0.00 37.83 34.38 3hay s LYS 35 CO -0.04 -0.04 0.00 0.41 0.00 0.00 0.00 175.35 175.68 3hay n GLY 36 N 4.46 3.31 0.30 0.59 0.00 -1.13 -4.74 105.19 107.98 3hay n GLY 36 Ca -0.16 -1.41 -0.09 0.00 0.00 0.00 0.00 46.02 44.36 3hay n GLY 36 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3hay h THR 37 N 0.00 0.34 -0.24 2.61 2.02 -1.94 0.64 112.91 116.34 3hay h THR 37 Ca 0.00 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.23 3hay h THR 37 Cb 0.00 0.34 -0.05 0.00 -1.74 0.00 0.00 68.15 66.70 3hay h THR 37 CO 0.00 0.00 -0.10 -1.13 0.37 0.00 0.00 175.52 174.66 3hay h ASN 38 N -0.28 -0.34 -0.23 4.18 -1.24 -1.93 0.23 115.58 115.97 3hay h ASN 38 Ca 0.13 0.09 0.00 0.00 0.71 0.00 0.00 56.30 57.23 3hay h ASN 38 Cb 0.49 0.20 -0.01 0.00 0.73 0.00 0.00 38.32 39.73 3hay h ASN 38 CO -0.40 -0.13 0.15 -0.33 -1.29 0.00 0.00 177.43 175.43 3hay h GLU 39 N -0.06 0.31 -0.23 6.67 5.08 -1.65 -2.21 114.58 122.48 3hay h GLU 39 Ca 0.13 -0.02 0.06 0.00 -1.00 0.00 0.00 59.36 58.52 3hay h GLU 39 Cb 0.25 -0.07 -0.07 0.00 0.50 0.00 0.00 28.75 29.37 3hay h GLU 39 CO -0.28 0.22 -0.23 1.15 -1.00 0.00 0.00 179.01 178.86 3hay h THR 40 N 0.31 0.41 -0.62 1.13 2.02 0.80 0.12 112.91 117.08 3hay h THR 40 Ca 0.09 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.31 3hay h THR 40 Cb -0.02 0.41 -0.05 0.00 -1.74 0.00 0.00 68.15 66.76 3hay h THR 40 CO -0.02 0.00 0.36 0.74 0.37 0.00 0.00 175.52 176.97 3hay h THR 41 N -0.24 1.01 -0.89 3.16 2.02 -0.85 0.47 112.91 117.59 3hay h THR 41 Ca 0.13 -0.24 0.07 0.00 0.77 0.00 0.00 66.41 67.15 3hay h THR 41 Cb 0.44 0.27 -0.07 0.00 -1.74 0.00 0.00 68.15 67.05 3hay h THR 41 CO -0.37 0.13 0.56 0.11 0.37 0.00 0.00 175.52 176.31 3hay h LYS 42 N 0.69 0.97 0.00 6.66 1.79 -0.69 -0.53 116.57 125.46 3hay h LYS 42 Ca 0.27 -0.06 -0.02 0.00 -2.18 0.00 0.00 60.65 58.66 3hay h LYS 42 Cb 0.11 -0.22 -0.00 0.00 -1.58 0.00 0.00 32.23 30.54 3hay h LYS 42 CO -0.14 0.64 -0.09 0.00 -1.08 0.00 0.00 179.45 178.78 3hay h ALA 43 N 1.43 1.13 0.00 3.86 0.00 0.13 -2.91 119.26 122.90 3hay h ALA 43 Ca 0.40 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.21 3hay h ALA 43 Cb 0.21 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 3hay h ALA 43 CO -0.19 0.11 -0.10 0.28 0.00 0.00 0.00 179.25 179.35 3hay h VAL 44 N 0.00 0.93 -0.07 0.00 2.07 0.05 0.39 116.25 119.62 3hay h VAL 44 Ca -0.00 -1.72 -0.05 0.00 0.82 0.00 0.00 66.70 65.75 3hay h VAL 44 Cb 0.39 1.78 -0.01 0.00 -1.52 0.00 0.00 31.29 31.93 3hay h VAL 44 CO 0.01 0.31 -0.18 1.05 0.02 0.00 0.00 177.57 178.79 3hay h GLU 45 N -1.00 0.11 0.00 1.57 4.11 -1.39 0.12 114.58 118.10 3hay h GLU 45 Ca -0.02 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 59.38 3hay h GLU 45 Cb 0.59 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.82 3hay h GLU 45 CO -0.01 0.29 0.00 0.54 0.07 0.00 0.00 179.01 179.90 3hay n ARG 46 N -4.28 0.99 -0.84 1.06 1.74 -1.10 -4.87 116.66 109.35 3hay n ARG 46 Ca -0.02 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.06 3hay n ARG 46 Cb 0.27 -1.29 0.00 0.00 -1.02 0.00 0.00 32.46 30.42 3hay n ARG 46 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3hay n GLY 47 N 0.77 0.18 0.18 -0.13 0.00 0.43 -4.84 105.19 101.79 3hay n GLY 47 Ca 0.14 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.17 3hay n GLY 47 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3hay h GLN 48 N 0.48 0.05 -7.22 1.61 4.20 -1.61 -3.46 115.11 109.16 3hay h GLN 48 Ca 0.00 -0.02 -0.49 0.00 0.06 0.00 0.00 58.65 58.20 3hay h GLN 48 Cb 0.43 -0.00 0.21 0.00 0.30 0.00 0.00 27.48 28.41 3hay h GLN 48 CO 0.00 0.45 0.14 0.00 -0.67 0.00 0.00 178.83 178.75 3hay s ALA 49 N -4.10 0.67 0.00 3.87 0.00 0.08 -4.66 121.76 117.62 3hay s ALA 49 Ca -0.03 0.35 0.00 0.00 0.00 0.00 0.00 51.96 52.28 3hay s ALA 49 Cb 0.14 -3.39 0.00 0.00 0.00 0.00 0.00 23.12 19.87 3hay s ALA 49 CO 0.74 -3.24 0.00 1.63 0.00 0.00 0.00 175.76 174.89 3hay n LYS 50 N -4.54 2.43 -3.67 0.00 4.76 0.20 -4.94 118.16 112.40 3hay n LYS 50 Ca 0.09 0.00 -0.11 0.00 -2.87 0.00 0.00 58.31 55.42 3hay n LYS 50 Cb 0.53 -0.68 -0.08 0.00 -1.84 0.00 0.00 35.03 32.96 3hay n LYS 50 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 3hay s LEU 51 N -1.66 -0.45 -0.12 -0.35 2.96 -1.21 -4.63 118.68 113.22 3hay s LEU 51 Ca 0.00 1.24 -0.03 0.00 -0.22 0.00 0.00 54.13 55.12 3hay s LEU 51 Cb 0.00 2.02 -0.03 0.00 0.50 0.00 0.00 46.19 48.68 3hay s LEU 51 CO 0.00 -0.22 0.00 -0.69 -1.32 0.00 0.00 176.35 174.13 3hay s VAL 52 N 0.92 4.29 -0.29 1.68 1.01 -1.12 -1.43 120.40 125.47 3hay s VAL 52 Ca -0.05 -0.24 0.01 0.00 0.00 0.00 0.00 61.98 61.70 3hay s VAL 52 Cb -0.05 -2.84 0.09 0.00 0.00 0.00 0.00 36.38 33.57 3hay s VAL 52 CO -0.08 0.56 0.04 -0.63 0.00 0.00 0.00 175.10 174.99 3hay s ILE 53 N -0.38 1.35 0.06 2.22 1.09 0.24 -0.21 121.20 125.57 3hay s ILE 53 Ca 0.07 -1.52 0.02 0.00 -1.10 0.00 0.00 60.65 58.12 3hay s ILE 53 Cb -0.12 -1.90 -0.04 0.00 -1.06 0.00 0.00 42.46 39.34 3hay s ILE 53 CO 0.02 -0.47 0.12 -0.63 -0.10 0.00 0.00 174.94 173.87 3hay s ILE 54 N 1.41 4.80 0.42 2.92 1.01 0.47 -0.19 121.20 132.03 3hay s ILE 54 Ca 0.05 -0.61 -0.13 0.00 0.00 0.00 0.00 60.65 59.95 3hay s ILE 54 Cb -0.18 -3.31 -0.07 0.00 0.01 0.00 0.00 42.46 38.91 3hay s ILE 54 CO -0.15 0.16 0.83 0.00 0.00 0.00 0.00 174.94 175.77 3hay s ALA 55 N -1.40 3.26 -0.67 9.38 0.00 0.39 0.11 121.76 132.83 3hay s ALA 55 Ca 0.30 -0.03 0.25 0.00 0.00 0.00 0.00 51.96 52.48 3hay s ALA 55 Cb -0.12 -2.84 0.59 0.00 0.00 0.00 0.00 23.12 20.75 3hay s ALA 55 CO 0.23 0.01 1.58 0.93 0.00 0.00 0.00 175.76 178.51 3hay h GLU 56 N 1.39 0.00 -1.22 0.00 5.08 0.14 -3.38 114.58 116.60 3hay h GLU 56 Ca -0.47 0.00 -0.62 0.00 -1.00 0.00 0.00 59.36 57.27 3hay h GLU 56 Cb 1.18 0.00 -0.38 0.00 0.50 0.00 0.00 28.75 30.05 3hay h GLU 56 CO 0.63 0.00 -0.22 -0.40 -1.00 0.00 0.00 179.01 178.02 3hay n ASP 57 N -2.26 5.73 -4.73 1.42 5.75 -1.20 -4.81 116.55 116.45 3hay n ASP 57 Ca 0.05 -3.76 -0.38 0.00 -0.01 0.00 0.00 54.79 50.69 3hay n ASP 57 Cb 0.44 -0.59 -0.06 0.00 -1.03 0.00 0.00 41.12 39.88 3hay n ASP 57 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 3hay s VAL 58 N -5.00 5.20 -0.04 2.12 1.01 -1.26 -4.81 120.40 117.62 3hay s VAL 58 Ca 0.53 0.91 0.00 0.00 0.00 0.00 0.00 61.98 63.42 3hay s VAL 58 Cb 0.43 -3.79 0.03 0.00 0.00 0.00 0.00 36.38 33.04 3hay s VAL 58 CO -0.11 0.34 -0.01 -0.62 0.00 0.00 0.00 175.10 174.70 3hay s ASP 59 N 0.56 0.73 1.04 3.32 2.15 -1.26 -4.11 116.67 119.10 3hay s ASP 59 Ca 0.25 -0.06 -0.16 0.00 0.43 0.00 0.00 52.55 53.01 3hay s ASP 59 Cb -0.15 -0.31 0.21 0.00 -0.30 0.00 0.00 42.92 42.38 3hay s ASP 59 CO 0.10 -0.10 1.17 -2.16 -0.17 0.00 0.00 175.17 174.00 3hay s PRO 60 N 1.13 0.08 0.40 4.34 0.04 -1.26 -5.02 135.00 134.71 3hay s PRO 60 Ca -0.08 -0.00 0.13 0.00 0.04 0.00 0.00 61.00 61.09 3hay s PRO 60 Cb -0.14 -1.74 0.84 0.00 0.04 0.00 0.00 34.50 33.51 3hay s PRO 60 CO -0.02 -2.86 1.91 0.93 0.04 0.00 0.00 177.00 177.00 3hay h GLU 61 N -1.97 0.04 0.00 4.56 5.08 -2.02 -3.29 114.58 116.97 3hay h GLU 61 Ca -0.47 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 57.85 3hay h GLU 61 Cb 1.29 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.54 3hay h GLU 61 CO 0.45 0.30 -0.14 0.93 -1.00 0.00 0.00 179.01 179.55 3hay h GLU 62 N 0.03 0.00 -0.53 2.33 3.07 -1.97 -2.94 114.58 114.58 3hay h GLU 62 Ca 0.00 0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 58.83 3hay h GLU 62 Cb 0.48 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 28.36 3hay h GLU 62 CO 0.03 0.14 0.17 0.82 -1.40 0.00 0.00 179.01 178.77 3hay h ILE 63 N 0.00 1.21 0.00 3.13 5.03 -1.96 -3.24 117.51 121.68 3hay h ILE 63 Ca -0.00 -0.69 0.00 0.00 -0.12 0.00 0.00 64.86 64.05 3hay h ILE 63 Cb 0.42 0.62 0.00 0.00 -3.03 0.00 0.00 36.82 34.83 3hay h ILE 63 CO 0.02 0.26 -0.92 1.33 -0.68 0.00 0.00 178.15 178.16 3hay n VAL 64 N -4.31 0.00 -0.31 1.67 0.24 -1.23 -4.77 118.33 109.62 3hay n VAL 64 Ca 0.04 -0.24 0.31 0.00 -2.04 0.00 0.00 64.34 62.40 3hay n VAL 64 Cb 0.19 0.62 0.56 0.00 -1.47 0.00 0.00 33.84 33.73 3hay n VAL 64 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3hay n ALA 65 N -1.52 0.98 0.26 2.33 0.00 -1.11 -0.17 120.51 121.29 3hay n ALA 65 Ca -0.00 0.96 0.13 0.00 0.00 0.00 0.00 53.44 54.52 3hay n ALA 65 Cb 0.17 -0.96 0.70 0.00 0.00 0.00 0.00 19.45 19.35 3hay n ALA 65 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.50 178.62 3hay h HIS 66 N 0.00 0.00 0.78 0.00 2.07 -1.86 -3.31 115.15 112.83 3hay h HIS 66 Ca 0.80 0.00 -0.03 0.00 -2.85 0.00 0.00 60.37 58.29 3hay h HIS 66 Cb 2.15 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 32.12 3hay h HIS 66 CO -0.01 0.13 -0.47 -0.07 -3.07 0.00 0.00 177.93 174.44 3hay h LEU 67 N 0.00 -1.17 -0.77 6.12 3.38 -0.93 -2.56 115.31 119.38 3hay h LEU 67 Ca -0.00 0.06 0.15 0.00 0.09 0.00 0.00 57.88 58.18 3hay h LEU 67 Cb 0.40 0.34 -0.14 0.00 0.09 0.00 0.00 40.66 41.34 3hay h LEU 67 CO 0.02 -0.72 -0.23 -0.65 0.09 0.00 0.00 178.44 176.94 3hay h PRO 68 N -1.16 -0.03 0.00 1.13 0.11 -1.77 0.30 132.00 130.58 3hay h PRO 68 Ca -0.11 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.93 3hay h PRO 68 Cb 0.93 0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.03 3hay h PRO 68 CO 0.11 -0.02 -0.35 -1.35 -0.21 0.00 0.00 178.00 176.19 3hay h PRO 69 N -0.03 0.00 0.00 1.05 0.11 -1.78 -2.71 132.00 128.65 3hay h PRO 69 Ca 0.35 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.41 3hay h PRO 69 Cb 0.57 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.67 3hay h PRO 69 CO -0.80 0.35 -0.26 1.25 -0.21 0.00 0.00 178.00 178.33 3hay h LEU 70 N 0.00 0.00 -0.06 2.35 6.46 -0.14 -2.31 115.31 121.61 3hay h LEU 70 Ca -0.00 0.00 -0.23 0.00 -0.12 0.00 0.00 57.88 57.52 3hay h LEU 70 Cb 0.69 0.00 0.02 0.00 -0.73 0.00 0.00 40.66 40.63 3hay h LEU 70 CO 0.04 0.26 -0.88 0.00 -0.62 0.00 0.00 178.44 177.25 3hay h GLU 72 N 0.37 0.00 0.80 0.00 5.08 -1.51 0.14 114.58 119.46 3hay h GLU 72 Ca -0.09 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.23 3hay h GLU 72 Cb 1.53 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.79 3hay h GLU 72 CO 0.18 0.26 -0.38 1.49 -1.00 0.00 0.00 179.01 179.55 3hay h GLU 73 N 0.00 -1.03 -0.86 2.33 4.57 -1.36 -3.24 114.58 114.99 3hay h GLU 73 Ca -0.00 0.07 -0.14 0.00 -1.18 0.00 0.00 59.36 58.11 3hay h GLU 73 Cb 0.88 0.24 -0.08 0.00 -0.16 0.00 0.00 28.75 29.62 3hay h GLU 73 CO 0.03 -0.69 0.17 1.63 -1.18 0.00 0.00 179.01 178.98 3hay n LYS 74 N -5.30 2.65 0.00 1.92 4.76 -1.01 -4.91 118.16 116.27 3hay n LYS 74 Ca -0.13 -1.86 0.00 0.00 -2.87 0.00 0.00 58.31 53.45 3hay n LYS 74 Cb 0.42 -1.85 0.00 0.00 -1.84 0.00 0.00 35.03 31.76 3hay n LYS 74 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 3hay n GLU 75 N -0.00 0.00 -1.79 1.97 -0.58 -0.75 -4.96 120.64 114.53 3hay n GLU 75 Ca 0.25 0.00 -0.42 0.00 -0.42 0.00 0.00 57.16 56.57 3hay n GLU 75 Cb 0.99 -2.43 -0.03 0.00 -0.57 0.00 0.00 31.44 29.40 3hay n GLU 75 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 3hay s ILE 76 N -1.88 2.21 0.36 -3.67 1.01 0.40 -4.87 121.20 114.77 3hay s ILE 76 Ca 0.00 0.14 -0.26 0.00 0.00 0.00 0.00 60.65 60.53 3hay s ILE 76 Cb 0.00 -3.09 -0.09 0.00 0.01 0.00 0.00 42.46 39.29 3hay s ILE 76 CO 0.00 0.01 1.13 -2.16 0.00 0.00 0.00 174.94 173.92 3hay s PRO 77 N 1.22 4.26 0.04 2.79 0.04 -1.26 -4.24 135.00 137.85 3hay s PRO 77 Ca 0.74 1.78 0.01 0.00 0.04 0.00 0.00 61.00 63.57 3hay s PRO 77 Cb -0.48 -2.82 -0.03 0.00 0.04 0.00 0.00 34.50 31.22 3hay s PRO 77 CO 0.32 -0.12 -0.06 1.52 0.04 0.00 0.00 177.00 178.70 3hay s TYR 78 N -1.38 0.55 0.03 0.56 -0.85 -1.26 -2.79 117.35 112.21 3hay s TYR 78 Ca 0.53 -0.58 0.01 0.00 -0.52 0.00 0.00 57.07 56.52 3hay s TYR 78 Cb -0.30 -0.34 -0.02 0.00 0.38 0.00 0.00 41.96 41.68 3hay s TYR 78 CO 0.38 -0.14 -0.05 -1.50 -1.52 0.00 0.00 175.55 172.72 3hay s ILE 79 N -1.74 0.31 0.11 -3.49 1.10 0.71 -4.95 121.20 113.25 3hay s ILE 79 Ca -0.09 -0.93 -0.00 0.00 -0.51 0.00 0.00 60.65 59.12 3hay s ILE 79 Cb -0.08 -0.41 -0.04 0.00 0.15 0.00 0.00 42.46 42.08 3hay s ILE 79 CO -0.01 -0.40 0.27 -0.31 -2.11 0.00 0.00 174.94 172.38 3hay s TYR 80 N -1.32 3.50 0.05 3.50 1.51 -1.26 -0.40 117.35 122.94 3hay s TYR 80 Ca -0.12 0.27 0.03 0.00 -1.01 0.00 0.00 57.07 56.24 3hay s TYR 80 Cb -0.09 -1.78 -0.02 0.00 -0.11 0.00 0.00 41.96 39.95 3hay s TYR 80 CO -0.00 0.52 -0.10 0.14 -1.11 0.00 0.00 175.55 175.00 3hay s VAL 81 N -1.63 0.76 0.00 0.71 -7.23 0.12 -4.80 120.40 108.32 3hay s VAL 81 Ca 0.36 -1.12 0.00 0.00 -1.81 0.00 0.00 61.98 59.41 3hay s VAL 81 Cb -0.12 -0.77 0.00 0.00 0.56 0.00 0.00 36.38 36.04 3hay s VAL 81 CO 0.28 -0.29 0.72 -0.81 -0.31 0.00 0.00 175.10 174.69 3hay n PRO 82 N 1.48 0.00 -3.27 4.82 -0.04 -1.26 0.13 135.00 136.87 3hay n PRO 82 Ca -0.22 0.45 -0.30 0.00 -0.04 0.00 0.00 63.50 63.39 3hay n PRO 82 Cb 0.55 -1.22 -0.04 0.00 -0.04 0.00 0.00 33.50 32.74 3hay n PRO 82 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3hay s SER 83 N -2.45 6.54 -0.12 3.54 0.15 -1.26 -2.55 113.70 117.56 3hay s SER 83 Ca 0.00 0.90 -0.02 0.00 0.70 0.00 0.00 55.95 57.53 3hay s SER 83 Cb 0.00 -2.22 -0.25 0.00 -1.71 0.00 0.00 66.02 61.84 3hay s SER 83 CO 0.00 -0.19 0.37 2.29 1.20 0.00 0.00 173.24 176.92 3hay n LYS 84 N -0.67 0.73 0.05 5.44 2.85 -1.26 -3.16 118.16 122.13 3hay n LYS 84 Ca 0.00 0.26 0.00 0.00 -1.05 0.00 0.00 58.31 57.52 3hay n LYS 84 Cb 0.53 -1.71 0.31 0.00 -0.65 0.00 0.00 35.03 33.52 3hay n LYS 84 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 177.40 177.13 3hay h LYS 85 N 0.05 0.41 0.00 -1.58 1.63 -1.93 -2.37 116.57 112.78 3hay h LYS 85 Ca -0.41 -0.10 -0.18 0.00 -0.85 0.00 0.00 60.65 59.11 3hay h LYS 85 Cb 2.03 -0.05 -0.02 0.00 -0.60 0.00 0.00 32.23 33.58 3hay h LYS 85 CO 0.07 0.52 -0.82 1.49 -3.45 0.00 0.00 179.45 177.26 3hay h GLU 86 N 0.39 0.06 -0.58 1.90 4.81 -1.95 -3.21 114.58 116.00 3hay h GLU 86 Ca 0.08 -0.07 -0.08 0.00 -0.13 0.00 0.00 59.36 59.16 3hay h GLU 86 Cb 0.41 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.79 3hay h GLU 86 CO 0.02 0.85 0.05 1.25 -0.73 0.00 0.00 179.01 180.44 3hay h LEU 87 N 0.04 0.96 -0.08 1.64 5.85 -1.39 -2.65 115.31 119.68 3hay h LEU 87 Ca -0.02 -0.29 -0.00 0.00 0.84 0.00 0.00 57.88 58.41 3hay h LEU 87 Cb 1.44 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 42.21 3hay h LEU 87 CO 0.11 1.01 0.04 1.23 -0.34 0.00 0.00 178.44 180.49 3hay h GLY 88 N 0.89 0.12 1.51 3.75 0.00 -1.53 -1.74 103.07 106.07 3hay h GLY 88 Ca 0.17 -0.06 -0.01 0.00 0.00 0.00 0.00 47.33 47.43 3hay h GLY 88 CO 0.02 0.06 0.24 0.00 0.00 0.00 0.00 176.54 176.86 3hay h ALA 89 N 0.91 1.55 0.00 3.60 0.00 -1.55 0.43 119.26 124.19 3hay h ALA 89 Ca 0.03 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 3hay h ALA 89 Cb 0.12 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3hay h ALA 89 CO -0.00 0.37 -0.35 0.00 0.00 0.00 0.00 179.25 179.27 3hay h ALA 90 N 1.62 0.90 0.00 0.00 0.00 -1.38 -2.84 119.26 117.56 3hay h ALA 90 Ca 0.16 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3hay h ALA 90 Cb 0.05 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3hay h ALA 90 CO -0.02 0.43 -0.60 0.00 0.00 0.00 0.00 179.25 179.06 3hay n ALA 91 N -2.24 3.45 -1.15 0.00 0.00 -0.35 -3.43 120.51 116.79 3hay n ALA 91 Ca 0.01 -0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.10 3hay n ALA 91 Cb 0.55 -1.10 0.00 0.00 0.00 0.00 0.00 19.45 18.90 3hay n ALA 91 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hay n GLY 92 N 1.45 0.58 3.10 0.00 0.00 0.14 -5.02 105.19 105.44 3hay n GLY 92 Ca 0.05 -0.35 -0.07 0.00 0.00 0.00 0.00 46.02 45.65 3hay n GLY 92 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3hay s ILE 93 N -2.33 0.21 0.09 -0.61 -4.36 -0.75 -5.00 121.20 108.45 3hay s ILE 93 Ca 0.00 -1.71 -0.29 0.00 -0.26 0.00 0.00 60.65 58.40 3hay s ILE 93 Cb 0.00 -1.44 -0.14 0.00 1.25 0.00 0.00 42.46 42.13 3hay s ILE 93 CO 0.00 -0.94 1.65 -0.08 0.24 0.00 0.00 174.94 175.81 3hay h GLU 94 N 3.18 -0.56 0.00 0.37 4.57 -1.98 -3.34 114.58 116.82 3hay h GLU 94 Ca -0.34 0.04 0.00 0.00 -1.18 0.00 0.00 59.36 57.88 3hay h GLU 94 Cb 1.15 0.13 0.00 0.00 -0.16 0.00 0.00 28.75 29.87 3hay h GLU 94 CO 0.64 -0.37 0.00 1.33 -1.18 0.00 0.00 179.01 179.42 3hay n VAL 95 N -5.38 0.00 -3.14 0.32 0.24 -1.26 -4.84 118.33 104.27 3hay n VAL 95 Ca -0.10 0.00 -0.30 0.00 -2.04 0.00 0.00 64.34 61.91 3hay n VAL 95 Cb 0.28 -1.21 -0.03 0.00 -1.47 0.00 0.00 33.84 31.41 3hay n VAL 95 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3hay s ALA 96 N -2.41 3.49 -0.04 2.33 0.00 -1.26 -4.38 121.76 119.49 3hay s ALA 96 Ca 0.00 -0.36 0.05 0.00 0.00 0.00 0.00 51.96 51.65 3hay s ALA 96 Cb 0.00 -2.50 -0.01 0.00 0.00 0.00 0.00 23.12 20.61 3hay s ALA 96 CO 0.00 0.17 -0.19 0.00 0.00 0.00 0.00 175.76 175.74 3hay s ALA 97 N -2.17 1.61 -0.00 0.00 0.00 -1.18 -4.86 121.76 115.17 3hay s ALA 97 Ca 0.48 -0.77 -0.08 0.00 0.00 0.00 0.00 51.96 51.58 3hay s ALA 97 Cb -0.11 -0.49 -0.30 0.00 0.00 0.00 0.00 23.12 22.22 3hay s ALA 97 CO 0.29 0.33 0.85 0.00 0.00 0.00 0.00 175.76 177.23 3hay h ALA 98 N 6.05 0.13 -3.00 0.00 0.00 -1.94 -3.40 119.26 117.10 3hay h ALA 98 Ca -0.34 -1.05 -0.16 0.00 0.00 0.00 0.00 54.91 53.36 3hay h ALA 98 Cb 1.16 0.29 -0.27 0.00 0.00 0.00 0.00 17.79 18.98 3hay h ALA 98 CO 0.48 0.99 -0.40 -1.54 0.00 0.00 0.00 179.25 178.78 3hay s SER 99 N -7.22 -0.31 0.04 0.00 1.04 -1.26 -0.46 113.70 105.52 3hay s SER 99 Ca -0.11 0.59 0.05 0.00 0.48 0.00 0.00 55.95 56.96 3hay s SER 99 Cb 0.06 0.55 -0.02 0.00 0.10 0.00 0.00 66.02 66.71 3hay s SER 99 CO 0.88 -0.13 -0.15 -0.69 0.98 0.00 0.00 173.24 174.13 3hay s VAL 100 N 0.57 1.15 0.03 5.02 1.01 0.73 -2.83 120.40 126.08 3hay s VAL 100 Ca -0.03 -0.99 0.05 0.00 0.00 0.00 0.00 61.98 61.01 3hay s VAL 100 Cb -0.05 -1.04 -0.02 0.00 0.00 0.00 0.00 36.38 35.28 3hay s VAL 100 CO -0.03 0.04 -0.16 0.00 0.00 0.00 0.00 175.10 174.95 3hay s ALA 101 N -0.81 1.33 -0.18 5.51 0.00 -0.61 0.80 121.76 127.79 3hay s ALA 101 Ca 0.02 -0.83 -0.07 0.00 0.00 0.00 0.00 51.96 51.08 3hay s ALA 101 Cb -0.08 -0.26 -0.04 0.00 0.00 0.00 0.00 23.12 22.75 3hay s ALA 101 CO 0.01 0.29 0.06 0.42 0.00 0.00 0.00 175.76 176.53 3hay s ILE 102 N -0.70 4.72 0.00 0.00 1.01 -0.51 0.22 121.20 125.94 3hay s ILE 102 Ca 0.04 -0.06 0.00 0.00 0.00 0.00 0.00 60.65 60.63 3hay s ILE 102 Cb -0.07 -3.13 0.00 0.00 0.01 0.00 0.00 42.46 39.27 3hay s ILE 102 CO 0.01 0.46 0.00 -0.38 0.00 0.00 0.00 174.94 175.03 3hay n ILE 103 N 3.56 0.00 -3.27 2.92 2.08 -1.11 -0.63 119.36 122.91 3hay n ILE 103 Ca -0.17 0.42 -0.40 0.00 0.56 0.00 0.00 62.75 63.16 3hay n ILE 103 Cb 0.52 -1.35 -0.08 0.00 -0.75 0.00 0.00 39.64 37.98 3hay n ILE 103 CO 0.00 0.00 0.00 -1.61 0.56 0.00 0.00 176.55 175.50 3hay s GLU 104 N -0.84 3.93 0.51 0.38 0.41 -1.06 -4.59 118.70 117.45 3hay s GLU 104 Ca 0.00 0.12 0.27 0.00 -0.41 0.00 0.00 54.97 54.95 3hay s GLU 104 Cb 0.00 -3.70 1.39 0.00 -1.78 0.00 0.00 34.13 30.04 3hay s GLU 104 CO 0.00 -0.42 2.04 -1.00 -0.49 0.00 0.00 175.26 175.40 3hay h PRO 105 N 8.18 0.00 0.00 0.39 0.13 -1.91 -2.86 132.00 135.93 3hay h PRO 105 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 3hay h PRO 105 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 3hay h PRO 105 CO 0.71 0.13 0.00 0.41 -0.23 0.00 0.00 178.00 179.02 3hay n GLY 106 N -0.58 3.34 0.21 1.56 0.00 -1.26 -1.44 105.19 107.01 3hay n GLY 106 Ca -0.02 -0.15 0.10 0.00 0.00 0.00 0.00 46.02 45.95 3hay n GLY 106 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hay h LYS 107 N 0.00 0.00 0.00 1.61 1.79 -1.89 -3.30 116.57 114.77 3hay h LYS 107 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 3hay h LYS 107 Cb 0.00 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 3hay h LYS 107 CO 0.00 0.20 0.00 0.00 -1.08 0.00 0.00 179.45 178.57 3hay n ALA 108 N -2.17 2.06 -0.26 3.86 0.00 -0.52 -4.33 120.51 119.15 3hay n ALA 108 Ca 0.02 -0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.38 3hay n ALA 108 Cb 0.52 -1.01 -0.06 0.00 0.00 0.00 0.00 19.45 18.90 3hay n ALA 108 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3hay n ARG 109 N -0.52 -0.27 -0.22 0.00 0.63 -1.25 -0.16 116.66 114.86 3hay n ARG 109 Ca 0.01 1.28 -0.06 0.00 -0.92 0.00 0.00 57.85 58.16 3hay n ARG 109 Cb 0.00 -1.89 0.09 0.00 0.45 0.00 0.00 32.46 31.11 3hay n ARG 109 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 3hay h ASP 110 N 0.00 1.00 -0.55 6.15 3.32 -1.94 0.13 116.42 124.53 3hay h ASP 110 Ca 0.10 -0.20 -0.04 0.00 0.02 0.00 0.00 57.03 56.90 3hay h ASP 110 Cb 0.26 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.52 3hay h ASP 110 CO -0.59 0.96 0.19 0.25 -1.72 0.00 0.00 179.24 178.33 3hay h LEU 111 N 1.01 0.82 -0.04 1.55 5.85 -1.61 -1.11 115.31 121.77 3hay h LEU 111 Ca 0.21 -0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.78 3hay h LEU 111 Cb 0.35 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 41.16 3hay h LEU 111 CO -0.00 0.76 -0.06 0.58 -0.34 0.00 0.00 178.44 179.38 3hay h VAL 112 N 0.86 1.42 0.00 1.05 2.07 -0.10 -2.91 116.25 118.63 3hay h VAL 112 Ca 0.20 -1.34 -0.01 0.00 0.82 0.00 0.00 66.70 66.37 3hay h VAL 112 Cb 0.24 2.22 -0.00 0.00 -1.52 0.00 0.00 31.29 32.22 3hay h VAL 112 CO -0.01 0.36 -0.03 -0.33 0.02 0.00 0.00 177.57 177.58 3hay h GLU 113 N -0.39 0.00 -0.00 1.57 5.08 -0.81 -1.61 114.58 118.42 3hay h GLU 113 Ca 0.00 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 58.15 3hay h GLU 113 Cb 0.62 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.89 3hay h GLU 113 CO 0.01 0.03 -0.82 1.49 -1.00 0.00 0.00 179.01 178.73 3hay h GLU 114 N 0.00 0.56 -0.89 2.33 4.81 -1.22 -3.12 114.58 117.04 3hay h GLU 114 Ca -0.00 -0.60 0.01 0.00 -0.13 0.00 0.00 59.36 58.64 3hay h GLU 114 Cb 0.06 0.17 -0.04 0.00 0.63 0.00 0.00 28.75 29.57 3hay h GLU 114 CO 0.00 1.21 0.59 0.82 -0.73 0.00 0.00 179.01 180.91 3hay h ILE 115 N 0.14 1.22 -0.55 2.32 2.04 -1.23 -2.41 117.51 119.04 3hay h ILE 115 Ca -0.10 -0.41 0.04 0.00 1.00 0.00 0.00 64.86 65.39 3hay h ILE 115 Cb 1.50 -0.08 -0.03 0.00 -0.74 0.00 0.00 36.82 37.46 3hay h ILE 115 CO 0.16 0.22 0.37 0.00 0.00 0.00 0.00 178.15 178.90 3hay h ALA 116 N 1.45 1.76 0.00 1.87 0.00 -1.31 -2.48 119.26 120.55 3hay h ALA 116 Ca 0.33 -0.02 -0.23 0.00 0.00 0.00 0.00 54.91 54.98 3hay h ALA 116 Cb -0.13 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.46 3hay h ALA 116 CO -0.07 0.17 -1.22 0.52 0.00 0.00 0.00 179.25 178.64 3hay h MET 117 N 0.60 0.00 0.00 0.00 2.86 -1.38 -3.28 114.93 113.73 3hay h MET 117 Ca 0.23 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.87 3hay h MET 117 Cb 0.15 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.81 3hay h MET 117 CO -0.06 0.81 0.00 1.63 1.06 0.00 0.00 176.91 180.35 3hay n LYS 118 N -3.24 0.26 0.13 1.72 5.02 -1.03 -3.02 118.16 118.00 3hay n LYS 118 Ca -0.06 0.22 0.12 0.00 -2.02 0.00 0.00 58.31 56.57 3hay n LYS 118 Cb 0.97 -1.81 0.14 0.00 -0.02 0.00 0.00 35.03 34.31 3hay n LYS 118 CO 0.00 0.00 0.00 -0.39 -0.52 0.00 0.00 177.40 176.49 3hay h VAL 119 N 0.00 0.00 -0.08 -0.18 -1.51 -1.52 -3.29 116.25 109.67 3hay h VAL 119 Ca 0.00 -0.84 -0.00 0.00 -1.23 0.00 0.00 66.70 64.63 3hay h VAL 119 Cb 0.74 1.57 -0.00 0.00 -2.13 0.00 0.00 31.29 31.47 3hay h VAL 119 CO 0.00 0.00 0.04 0.11 -1.23 0.00 0.00 177.57 176.49 3hay h LYS 120 N 0.00 0.11 -0.15 5.19 1.57 -1.59 -2.76 116.57 118.93 3hay h LYS 120 Ca 0.00 -0.01 -0.13 0.00 -1.87 0.00 0.00 60.65 58.63 3hay h LYS 120 Cb 0.92 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.20 3hay h LYS 120 CO 0.00 0.17 -0.47 1.05 -0.57 0.00 0.00 179.45 179.63 3hay h GLU 121 N 0.02 0.39 0.00 3.15 4.11 -1.69 -2.95 114.58 117.61 3hay h GLU 121 Ca 0.03 -0.22 0.00 0.00 0.07 0.00 0.00 59.36 59.24 3hay h GLU 121 Cb 0.09 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.36 3hay h GLU 121 CO -0.00 0.78 0.00 1.28 0.07 0.00 0.00 179.01 181.14 3hay n LEU 122 N -3.98 0.70 0.00 3.06 4.77 -1.21 -4.05 117.00 116.28 3hay n LEU 122 Ca -0.02 0.62 0.00 0.00 -0.03 0.00 0.00 56.01 56.58 3hay n LEU 122 Cb 0.54 -0.46 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 3hay n LEU 122 CO 0.44 -0.37 0.03 0.23 -1.33 0.00 0.00 177.39 176.39 3hay n MET 123 N -2.21 0.00 0.00 3.23 2.81 -1.04 -4.89 117.12 115.02 3hay n MET 123 Ca 0.04 0.00 0.13 0.00 -1.81 0.00 0.00 57.70 56.06 3hay n MET 123 Cb 0.32 -0.44 0.37 0.00 -0.71 0.00 0.00 33.22 32.76 3hay n MET 123 CO 0.00 0.00 0.00 0.36 1.51 0.00 0.00 175.97 177.84