#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1foc n ALA 5 N 0.00 0.00 0.07 4.61 0.00 -1.26 -3.88 120.51 120.05 1foc n ALA 5 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 1foc n ALA 5 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.36 1foc n ALA 5 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1foc h LYS 6 N 0.00 -0.19 -0.34 0.00 6.56 -2.02 -2.90 116.57 117.68 1foc h LYS 6 Ca 0.00 0.01 0.03 0.00 -1.06 0.00 0.00 60.65 59.64 1foc h LYS 6 Cb 0.00 0.04 -0.05 0.00 -0.57 0.00 0.00 32.23 31.65 1foc h LYS 6 CO 0.00 0.18 -0.28 0.82 -2.06 0.00 0.00 179.45 178.12 1foc h ILE 7 N -0.60 0.00 -0.32 1.86 2.04 -1.96 0.76 117.51 119.29 1foc h ILE 7 Ca -0.02 0.00 0.09 0.00 1.00 0.00 0.00 64.86 65.93 1foc h ILE 7 Cb 0.46 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.52 1foc h ILE 7 CO 0.03 0.00 0.89 0.22 0.00 0.00 0.00 178.15 179.29 1foc h TYR 8 N -0.10 0.00 0.03 1.37 3.20 -1.88 1.39 116.97 120.99 1foc h TYR 8 Ca 0.06 0.00 -0.28 0.00 3.14 0.00 0.00 58.73 61.65 1foc h TYR 8 Cb 0.24 0.00 -0.04 0.00 1.54 0.00 0.00 36.73 38.48 1foc h TYR 8 CO -0.82 0.00 -1.52 0.00 -1.64 0.00 0.00 178.16 174.18 1foc h ALA 9 N 0.52 0.56 -1.34 1.82 0.00 0.73 -3.38 119.26 118.16 1foc h ALA 9 Ca 0.15 -1.26 0.40 0.00 0.00 0.00 0.00 54.91 54.20 1foc h ALA 9 Cb 1.94 0.30 -0.08 0.00 0.00 0.00 0.00 17.79 19.95 1foc h ALA 9 CO -0.00 1.41 0.92 -0.56 0.00 0.00 0.00 179.25 181.02 1foc h GLN 10 N 0.02 0.10 -4.57 0.00 3.07 0.26 -2.99 115.11 110.99 1foc h GLN 10 Ca -0.22 -0.01 -0.65 0.00 0.09 0.00 0.00 58.65 57.86 1foc h GLN 10 Cb 1.95 -0.02 -0.40 0.00 0.08 0.00 0.00 27.48 29.09 1foc h GLN 10 CO 0.11 0.07 -0.73 0.00 0.09 0.00 0.00 178.83 178.36 1foc s ALA 12 N 1.00 3.46 0.00 0.00 0.00 -1.13 -4.76 121.76 120.32 1foc s ALA 12 Ca 0.10 0.75 0.00 0.00 0.00 0.00 0.00 51.96 52.80 1foc s ALA 12 Cb -0.19 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.43 1foc s ALA 12 CO -0.10 -0.65 0.00 0.41 0.00 0.00 0.00 175.76 175.42 1foc n GLY 13 N 3.34 0.10 6.86 0.00 0.00 -1.26 -5.00 105.19 109.23 1foc n GLY 13 Ca 0.10 -1.81 0.00 0.00 0.00 0.00 0.00 46.02 44.31 1foc n GLY 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1foc n HIS 15 N 0.00 2.04 -1.37 0.00 -0.00 -1.26 -3.62 115.22 111.01 1foc n HIS 15 Ca 0.00 -0.86 0.01 0.00 -0.00 0.00 0.00 57.72 56.87 1foc n HIS 15 Cb 0.00 -0.55 -0.00 0.00 -0.00 0.00 0.00 29.99 29.43 1foc n HIS 15 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.34 177.38 1foc n GLN 16 N 0.26 -2.61 -0.30 -0.41 3.00 0.28 -1.08 117.38 116.52 1foc n GLN 16 Ca 0.30 2.03 0.26 0.00 -0.01 0.00 0.00 57.00 59.59 1foc n GLN 16 Cb 1.19 -2.75 0.60 0.00 0.00 0.00 0.00 30.24 29.28 1foc n GLN 16 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.06 177.43 1foc h GLN 17 N 0.02 0.24 0.00 -1.09 4.15 -1.88 -2.88 115.11 113.67 1foc h GLN 17 Ca -0.01 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.40 1foc h GLN 17 Cb 0.64 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.27 1foc h GLN 17 CO 0.00 0.16 0.00 -2.95 -1.93 0.00 0.00 178.83 174.11 1foc h ASN 18 N 0.25 0.00 0.00 -0.69 -1.07 -1.89 -3.48 115.58 108.70 1foc h ASN 18 Ca 0.56 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.93 1foc h ASN 18 Cb 1.70 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.95 1foc h ASN 18 CO -0.18 0.00 0.00 0.61 0.07 0.00 0.00 177.43 177.93 1foc n GLY 19 N 1.09 3.21 0.24 9.14 0.00 -1.09 -4.72 105.19 113.06 1foc n GLY 19 Ca 0.05 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.16 1foc n GLY 19 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1foc h GLN 20 N 1.82 0.00 0.00 1.61 4.15 -1.85 0.52 115.11 121.35 1foc h GLN 20 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 1foc h GLN 20 Cb 0.00 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.69 1foc h GLN 20 CO 0.00 0.19 0.00 0.41 -1.93 0.00 0.00 178.83 177.50 1foc n GLY 21 N -0.65 2.85 2.72 2.39 0.00 -0.24 -3.53 105.19 108.73 1foc n GLY 21 Ca -0.02 0.03 -0.08 0.00 0.00 0.00 0.00 46.02 45.95 1foc n GLY 21 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1foc n ILE 22 N 0.00 0.00 -0.23 -0.61 3.06 -1.24 -3.71 119.36 116.64 1foc n ILE 22 Ca 0.00 -1.38 -0.09 0.00 -2.50 0.00 0.00 62.75 58.78 1foc n ILE 22 Cb 0.00 1.41 -0.01 0.00 0.54 0.00 0.00 39.64 41.58 1foc n ILE 22 CO 0.00 0.00 0.00 -2.65 -2.50 0.00 0.00 176.55 171.40 1foc n PRO 23 N 0.31 0.00 0.00 9.51 -0.02 -1.19 -2.79 135.00 140.83 1foc n PRO 23 Ca 0.04 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.52 1foc n PRO 23 Cb 0.72 -0.22 0.00 0.00 -0.02 0.00 0.00 33.50 33.98 1foc n PRO 23 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1foc n GLY 24 N 0.23 1.90 0.00 -1.23 0.00 -1.26 -4.82 105.19 100.01 1foc n GLY 24 Ca 0.03 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.55 1foc n GLY 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1foc n ALA 25 N 0.00 1.28 -2.56 4.61 0.00 -1.12 -4.97 120.51 117.76 1foc n ALA 25 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.21 1foc n ALA 25 Cb 0.00 0.08 -0.15 0.00 0.00 0.00 0.00 19.45 19.38 1foc n ALA 25 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1foc s PHE 26 N -1.28 1.29 0.68 0.00 0.40 -1.25 -4.79 117.98 113.03 1foc s PHE 26 Ca 0.00 -0.25 -0.11 0.00 -0.60 0.00 0.00 56.93 55.98 1foc s PHE 26 Cb 0.00 -0.83 0.01 0.00 0.51 0.00 0.00 43.02 42.70 1foc s PHE 26 CO 0.00 -0.02 1.07 -1.25 0.70 0.00 0.00 175.22 175.72 1foc s PRO 27 N -0.35 2.96 -0.15 0.24 0.04 -1.26 -3.14 135.00 133.35 1foc s PRO 27 Ca 0.06 0.46 -0.29 0.00 0.04 0.00 0.00 61.00 61.27 1foc s PRO 27 Cb -0.06 -2.05 -0.05 0.00 0.04 0.00 0.00 34.50 32.39 1foc s PRO 27 CO -0.01 -0.95 1.85 -2.14 0.04 0.00 0.00 177.00 175.80 1foc s PRO 28 N -5.31 3.72 0.12 0.56 0.02 -1.26 -4.66 135.00 128.19 1foc s PRO 28 Ca 0.57 1.99 0.09 0.00 0.02 0.00 0.00 61.00 63.68 1foc s PRO 28 Cb -0.11 -4.15 -0.17 0.00 0.02 0.00 0.00 34.50 30.09 1foc s PRO 28 CO 0.51 -1.41 1.21 -0.07 -0.33 0.00 0.00 177.00 176.92 1foc h LEU 29 N 12.26 0.00 -7.35 -5.54 3.38 -0.73 -3.40 115.31 113.94 1foc h LEU 29 Ca -0.39 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.00 1foc h LEU 29 Cb 1.20 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.88 1foc h LEU 29 CO 0.98 0.92 1.43 0.00 0.09 0.00 0.00 178.44 181.86 1foc n ALA 30 N -2.36 0.24 0.00 1.53 0.00 0.14 0.26 120.51 120.32 1foc n ALA 30 Ca -0.02 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1foc n ALA 30 Cb 0.92 -2.01 0.00 0.00 0.00 0.00 0.00 19.45 18.37 1foc n ALA 30 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1foc n GLY 31 N 6.40 0.23 0.39 0.00 0.00 -1.26 -4.44 105.19 106.51 1foc n GLY 31 Ca 0.56 0.00 0.23 0.00 0.00 0.00 0.00 46.02 46.81 1foc n GLY 31 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 1foc h HIS 32 N 0.00 0.74 -0.83 1.61 -0.00 -1.42 2.94 115.15 118.19 1foc h HIS 32 Ca 0.00 0.03 0.24 0.00 -0.00 0.00 0.00 60.37 60.64 1foc h HIS 32 Cb 0.00 -0.21 -0.03 0.00 -0.00 0.00 0.00 27.41 27.17 1foc h HIS 32 CO 0.00 0.03 0.62 0.28 -0.00 0.00 0.00 177.93 178.86 1foc h VAL 33 N 0.41 0.54 0.46 5.26 2.07 0.33 -2.45 116.25 122.86 1foc h VAL 33 Ca 0.63 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 68.12 1foc h VAL 33 Cb 1.52 0.56 0.00 0.00 -1.52 0.00 0.00 31.29 31.86 1foc h VAL 33 CO -0.36 0.00 -0.22 0.00 0.02 0.00 0.00 177.57 177.01 1foc h ALA 34 N 1.54 -1.06 0.00 1.67 0.00 0.51 0.84 119.26 122.76 1foc h ALA 34 Ca 0.40 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1foc h ALA 34 Cb 1.63 0.24 0.00 0.00 0.00 0.00 0.00 17.79 19.66 1foc h ALA 34 CO -0.00 -1.01 0.60 -0.85 0.00 0.00 0.00 179.25 177.98 1foc n GLU 35 N -3.82 0.04 -0.01 0.00 0.28 -0.94 0.87 120.64 117.07 1foc n GLU 35 Ca -0.08 0.50 0.09 0.00 -0.16 0.00 0.00 57.16 57.51 1foc n GLU 35 Cb 0.24 -2.22 -0.13 0.00 1.43 0.00 0.00 31.44 30.76 1foc n GLU 35 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 177.13 176.08 1foc n ILE 36 N -1.84 0.00 0.19 3.84 5.41 -0.95 -4.17 119.36 121.84 1foc n ILE 36 Ca -0.00 -0.33 0.12 0.00 1.00 0.00 0.00 62.75 63.53 1foc n ILE 36 Cb 0.61 0.32 0.01 0.00 -0.71 0.00 0.00 39.64 39.88 1foc n ILE 36 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 176.55 176.44 1foc n LEU 37 N -1.94 0.78 0.00 1.39 0.00 5.12 -3.90 117.00 118.44 1foc n LEU 37 Ca -0.02 0.28 0.00 0.00 0.00 0.00 0.00 56.01 56.27 1foc n LEU 37 Cb 0.42 -0.07 0.00 0.00 0.00 0.00 0.00 43.42 43.77 1foc n LEU 37 CO 0.38 -0.15 0.00 0.00 0.00 0.00 0.00 177.39 177.62 1foc n ALA 38 N -2.12 0.00 0.00 1.96 0.00 0.27 -4.57 120.51 116.06 1foc n ALA 38 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1foc n ALA 38 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 1foc n ALA 38 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1foc n LYS 39 N 0.00 0.00 -1.62 0.00 5.02 -1.26 -4.60 118.16 115.70 1foc n LYS 39 Ca 0.00 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.86 1foc n LYS 39 Cb 0.00 0.00 -0.01 0.00 -0.02 0.00 0.00 35.03 35.00 1foc n LYS 39 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1foc n GLU 40 N 0.00 1.52 0.00 1.97 4.71 -1.26 -1.20 120.64 126.38 1foc n GLU 40 Ca 0.00 0.54 0.00 0.00 -0.01 0.00 0.00 57.16 57.69 1foc n GLU 40 Cb 0.00 -2.00 0.00 0.00 -1.01 0.00 0.00 31.44 28.43 1foc n GLU 40 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1foc n GLY 41 N 1.11 3.08 0.16 0.62 0.00 -1.26 -4.91 105.19 103.99 1foc n GLY 41 Ca 0.08 -0.86 0.08 0.00 0.00 0.00 0.00 46.02 45.32 1foc n GLY 41 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1foc n GLY 42 N 0.00 -0.58 0.16 -0.02 0.00 -0.34 0.50 105.19 104.91 1foc n GLY 42 Ca 0.00 0.44 0.13 0.00 0.00 0.00 0.00 46.02 46.59 1foc n GLY 42 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1foc h ARG 43 N 0.00 0.00 -0.02 1.61 0.11 -1.80 0.28 114.38 114.56 1foc h ARG 43 Ca 0.30 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.37 1foc h ARG 43 Cb 0.65 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.73 1foc h ARG 43 CO -0.42 0.00 -0.04 0.93 0.10 0.00 0.00 179.97 180.54 1foc h GLU 44 N 0.00 0.05 -0.40 0.08 5.08 1.13 -3.11 114.58 117.41 1foc h GLU 44 Ca 0.00 -0.04 0.02 0.00 -1.00 0.00 0.00 59.36 58.34 1foc h GLU 44 Cb 0.54 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.77 1foc h GLU 44 CO 0.00 0.63 0.24 -0.92 -1.00 0.00 0.00 179.01 177.95 1foc h TYR 45 N -0.51 0.44 0.16 4.33 3.20 0.11 -1.51 116.97 123.20 1foc h TYR 45 Ca 0.00 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.88 1foc h TYR 45 Cb 0.63 -0.14 -0.00 0.00 1.54 0.00 0.00 36.73 38.75 1foc h TYR 45 CO 0.13 0.26 -0.12 -0.07 -1.64 0.00 0.00 178.16 176.71 1foc h LEU 46 N 0.48 -0.31 -0.30 2.82 3.38 -0.66 -0.71 115.31 120.00 1foc h LEU 46 Ca 0.16 0.02 0.08 0.00 0.09 0.00 0.00 57.88 58.23 1foc h LEU 46 Cb 0.01 0.10 -0.06 0.00 0.09 0.00 0.00 40.66 40.80 1foc h LEU 46 CO -0.08 -0.17 -0.00 -0.38 0.09 0.00 0.00 178.44 177.90 1foc n ILE 47 N -2.98 -0.13 0.00 1.22 2.08 -1.17 -0.47 119.36 117.91 1foc n ILE 47 Ca -0.03 0.67 0.00 0.00 0.56 0.00 0.00 62.75 63.95 1foc n ILE 47 Cb 0.12 -0.97 0.00 0.00 -0.75 0.00 0.00 39.64 38.03 1foc n ILE 47 CO 0.00 0.00 0.00 0.18 0.56 0.00 0.00 176.55 177.29 1foc n LEU 48 N -4.24 0.00 -0.01 1.39 4.77 -0.38 -3.36 117.00 115.16 1foc n LEU 48 Ca 0.07 0.55 -0.00 0.00 -0.03 0.00 0.00 56.01 56.60 1foc n LEU 48 Cb 0.23 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.27 1foc n LEU 48 CO -0.02 -0.05 0.02 0.52 -1.33 0.00 0.00 177.39 176.52 1foc n VAL 49 N -0.80 -0.02 0.17 4.08 0.31 0.38 1.00 118.33 123.45 1foc n VAL 49 Ca 0.00 0.07 0.02 0.00 -0.01 0.00 0.00 64.34 64.42 1foc n VAL 49 Cb 0.00 -0.09 0.27 0.00 -0.91 0.00 0.00 33.84 33.11 1foc n VAL 49 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1foc h LEU 50 N 0.00 0.00 0.00 7.52 3.38 -1.64 0.36 115.31 124.94 1foc h LEU 50 Ca 0.01 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 1foc h LEU 50 Cb 0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.77 1foc h LEU 50 CO -0.03 0.48 -0.04 -0.07 0.09 0.00 0.00 178.44 178.88 1foc h LEU 51 N 0.00 0.03 0.00 1.67 3.38 0.64 4.57 115.31 125.60 1foc h LEU 51 Ca -0.00 -0.88 -0.33 0.00 0.09 0.00 0.00 57.88 56.75 1foc h LEU 51 Cb 0.95 -0.01 -0.06 0.00 0.09 0.00 0.00 40.66 41.63 1foc h LEU 51 CO 0.06 0.91 -2.25 -1.22 0.09 0.00 0.00 178.44 176.03 1foc n TYR 52 N -4.64 0.00 0.00 1.13 4.01 -0.42 -4.04 117.16 113.21 1foc n TYR 52 Ca -0.10 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.64 1foc n TYR 52 Cb 0.44 -0.88 0.00 0.00 -0.31 0.00 0.00 39.34 38.59 1foc n TYR 52 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1foc n GLY 53 N 2.05 2.23 3.29 2.72 0.00 0.13 -4.04 105.19 111.57 1foc n GLY 53 Ca -0.32 -1.99 -0.12 0.00 0.00 0.00 0.00 46.02 43.59 1foc n GLY 53 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1foc s LEU 54 N 0.00 0.60 0.00 0.99 2.96 -1.14 -4.14 118.68 117.94 1foc s LEU 54 Ca 0.00 -0.18 -0.09 0.00 -0.22 0.00 0.00 54.13 53.64 1foc s LEU 54 Cb 0.00 1.62 0.03 0.00 0.50 0.00 0.00 46.19 48.34 1foc s LEU 54 CO 0.00 -0.71 0.46 0.00 -1.32 0.00 0.00 176.35 174.78 1foc n GLN 55 N 0.29 0.58 -1.19 1.98 6.02 -0.65 -2.45 117.38 121.95 1foc n GLN 55 Ca -0.18 -1.15 0.00 0.00 -0.01 0.00 0.00 57.00 55.66 1foc n GLN 55 Cb 0.61 1.45 0.00 0.00 1.02 0.00 0.00 30.24 33.32 1foc n GLN 55 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1foc n GLY 56 N -0.31 -2.61 0.00 1.08 0.00 -1.24 -4.66 105.19 97.44 1foc n GLY 56 Ca -0.04 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.48 1foc n GLY 56 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1foc n GLN 57 N 0.15 0.00 -3.78 1.61 7.27 -1.23 -4.91 117.38 116.48 1foc n GLN 57 Ca 0.00 0.00 -0.10 0.00 0.07 0.00 0.00 57.00 56.97 1foc n GLN 57 Cb 0.00 0.00 -0.05 0.00 2.41 0.00 0.00 30.24 32.60 1foc n GLN 57 CO 0.00 0.00 0.00 0.96 0.07 0.00 0.00 177.06 178.09 1foc s ILE 58 N 0.00 0.04 -0.02 1.69 -4.36 -0.09 -4.94 121.20 113.53 1foc s ILE 58 Ca 0.00 -0.92 0.07 0.00 -0.26 0.00 0.00 60.65 59.55 1foc s ILE 58 Cb 0.00 -1.60 -0.02 0.00 1.25 0.00 0.00 42.46 42.10 1foc s ILE 58 CO 0.00 -0.19 -0.23 -0.70 0.24 0.00 0.00 174.94 174.05 1foc s GLU 59 N -3.89 1.89 -0.11 0.37 2.12 -1.26 0.12 118.70 117.93 1foc s GLU 59 Ca 0.10 -0.84 -0.05 0.00 0.36 0.00 0.00 54.97 54.55 1foc s GLU 59 Cb 0.00 -1.83 0.06 0.00 0.26 0.00 0.00 34.13 32.62 1foc s GLU 59 CO -0.03 0.50 0.24 0.08 -0.54 0.00 0.00 175.26 175.51 1foc s VAL 60 N -0.55 -0.30 -1.04 3.70 1.01 -1.04 -4.85 120.40 117.32 1foc s VAL 60 Ca 0.09 0.26 -0.19 0.00 0.00 0.00 0.00 61.98 62.15 1foc s VAL 60 Cb -0.09 -0.40 0.02 0.00 0.00 0.00 0.00 36.38 35.91 1foc s VAL 60 CO -0.01 0.11 0.67 0.29 0.00 0.00 0.00 175.10 176.16 1foc n LYS 61 N 5.09 -0.89 0.00 2.72 5.02 -1.26 -2.81 118.16 126.03 1foc n LYS 61 Ca -0.10 0.44 0.00 0.00 -2.02 0.00 0.00 58.31 56.62 1foc n LYS 61 Cb 0.50 -2.75 0.00 0.00 -0.02 0.00 0.00 35.03 32.76 1foc n LYS 61 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1foc n GLY 62 N -1.87 0.00 3.68 0.72 0.00 -1.26 -4.78 105.19 101.69 1foc n GLY 62 Ca -0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.42 1foc n GLY 62 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1foc s MET 63 N 0.00 4.15 0.49 1.61 0.00 -1.12 -4.91 119.30 119.52 1foc s MET 63 Ca 0.00 2.53 -0.02 0.00 0.00 0.00 0.00 55.69 58.20 1foc s MET 63 Cb 0.00 -3.73 -0.00 0.00 0.00 0.00 0.00 34.83 31.10 1foc s MET 63 CO 0.00 -0.84 0.75 0.15 0.00 0.00 0.00 175.02 175.07 1foc s LYS 64 N 3.12 3.04 0.24 4.11 1.02 -1.26 -2.51 119.74 127.50 1foc s LYS 64 Ca 0.81 -0.31 0.01 0.00 0.02 0.00 0.00 55.97 56.50 1foc s LYS 64 Cb -0.43 -2.46 -0.05 0.00 -0.52 0.00 0.00 37.83 34.36 1foc s LYS 64 CO 0.36 -0.40 0.10 0.71 -0.92 0.00 0.00 175.35 175.20 1foc s TYR 65 N -2.70 1.43 0.00 3.18 1.51 0.33 -4.94 117.35 116.16 1foc s TYR 65 Ca 0.50 -1.22 0.00 0.00 -1.01 0.00 0.00 57.07 55.34 1foc s TYR 65 Cb -0.10 -0.81 0.00 0.00 -0.11 0.00 0.00 41.96 40.94 1foc s TYR 65 CO 0.40 -0.40 0.00 -1.71 -1.11 0.00 0.00 175.55 172.74 1foc n ASN 66 N -0.40 0.00 -3.25 2.29 5.15 -1.26 -0.91 115.26 116.88 1foc n ASN 66 Ca -0.00 0.00 -0.03 0.00 -0.60 0.00 0.00 54.58 53.94 1foc n ASN 66 Cb 0.66 0.00 0.03 0.00 -0.53 0.00 0.00 39.78 39.94 1foc n ASN 66 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1foc n GLY 67 N 0.00 -1.06 3.59 8.20 0.00 -1.26 -3.56 105.19 111.09 1foc n GLY 67 Ca 0.00 -0.35 -0.26 0.00 0.00 0.00 0.00 46.02 45.41 1foc n GLY 67 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1foc s VAL 68 N -0.99 3.28 -0.10 1.61 -7.23 -1.26 -3.86 120.40 111.84 1foc s VAL 68 Ca 0.08 -1.67 -0.09 0.00 -1.81 0.00 0.00 61.98 58.48 1foc s VAL 68 Cb -0.01 -2.65 0.03 0.00 0.56 0.00 0.00 36.38 34.31 1foc s VAL 68 CO 0.06 -0.15 0.27 -0.32 -0.31 0.00 0.00 175.10 174.66 1foc s MET 69 N -2.96 0.31 0.82 4.82 -2.45 -1.03 -5.02 119.30 113.79 1foc s MET 69 Ca 0.26 0.40 -0.08 0.00 -1.25 0.00 0.00 55.69 55.02 1foc s MET 69 Cb -0.08 0.12 0.15 0.00 1.25 0.00 0.00 34.83 36.26 1foc s MET 69 CO 0.16 -0.05 1.14 0.45 1.05 0.00 0.00 175.02 177.77 1foc s SER 70 N 0.30 3.87 0.26 1.11 0.15 -1.26 -2.90 113.70 115.22 1foc s SER 70 Ca -0.01 0.02 0.10 0.00 0.70 0.00 0.00 55.95 56.75 1foc s SER 70 Cb -0.03 -0.28 -0.04 0.00 -1.71 0.00 0.00 66.02 63.95 1foc s SER 70 CO -0.01 -2.21 -0.03 -0.55 1.20 0.00 0.00 173.24 171.64 1foc s SER 71 N -4.78 4.42 -0.23 5.45 0.15 -1.26 -4.35 113.70 113.10 1foc s SER 71 Ca 0.69 -0.68 -0.08 0.00 0.70 0.00 0.00 55.95 56.58 1foc s SER 71 Cb -0.05 -0.78 -0.11 0.00 -1.71 0.00 0.00 66.02 63.36 1foc s SER 71 CO 0.48 0.01 -0.28 0.49 1.20 0.00 0.00 173.24 175.15 1foc n PHE 72 N -0.78 0.00 -2.29 3.44 3.01 1.49 -4.91 117.46 117.42 1foc n PHE 72 Ca -0.07 0.00 -0.10 0.00 1.01 0.00 0.00 57.45 58.29 1foc n PHE 72 Cb 0.59 -0.85 -0.02 0.00 -0.01 0.00 0.00 39.48 39.19 1foc n PHE 72 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1foc n ALA 73 N -3.83 -0.61 -0.00 4.37 0.00 -0.60 -4.51 120.51 115.33 1foc n ALA 73 Ca -0.45 -0.05 -0.02 0.00 0.00 0.00 0.00 53.44 52.92 1foc n ALA 73 Cb 0.85 -0.76 -0.01 0.00 0.00 0.00 0.00 19.45 19.54 1foc n ALA 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1foc n GLN 74 N -1.87 0.04 -1.52 0.00 10.64 -1.26 -4.97 117.38 118.45 1foc n GLN 74 Ca 0.03 0.02 -0.51 0.00 -1.83 0.00 0.00 57.00 54.71 1foc n GLN 74 Cb 0.27 -0.57 -0.05 0.00 -0.86 0.00 0.00 30.24 29.03 1foc n GLN 74 CO 0.00 0.00 0.00 1.28 -1.83 0.00 0.00 177.06 176.51 1foc n LEU 75 N -3.18 0.55 -4.76 2.61 4.77 -1.26 -4.82 117.00 110.90 1foc n LEU 75 Ca -0.04 1.14 -0.37 0.00 -0.03 0.00 0.00 56.01 56.71 1foc n LEU 75 Cb 0.44 -1.09 0.01 0.00 -2.33 0.00 0.00 43.42 40.45 1foc n LEU 75 CO 0.00 -1.82 0.87 -0.54 -1.33 0.00 0.00 177.39 174.58 1foc s LYS 76 N -0.45 3.56 0.20 3.23 3.01 -1.26 -4.54 119.74 123.48 1foc s LYS 76 Ca 0.75 1.91 0.13 0.00 -1.01 0.00 0.00 55.97 57.75 1foc s LYS 76 Cb -0.97 -2.35 0.68 0.00 -1.01 0.00 0.00 37.83 34.19 1foc s LYS 76 CO 0.54 -0.75 0.75 -0.25 0.51 0.00 0.00 175.35 176.14 1foc n ASP 77 N -0.67 0.13 0.00 2.83 8.00 -1.26 0.69 116.55 126.27 1foc n ASP 77 Ca 0.08 0.71 0.00 0.00 0.71 0.00 0.00 54.79 56.29 1foc n ASP 77 Cb 0.47 -0.35 0.00 0.00 -0.02 0.00 0.00 41.12 41.22 1foc n ASP 77 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1foc n GLU 78 N -3.79 0.00 0.00 -1.24 1.02 -1.26 -1.57 120.64 113.80 1foc n GLU 78 Ca 0.19 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.33 1foc n GLU 78 Cb 0.69 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 32.11 1foc n GLU 78 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1foc n GLU 79 N 0.00 0.00 0.00 3.49 1.02 0.22 -0.68 120.64 124.68 1foc n GLU 79 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1foc n GLU 79 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 1foc n GLU 79 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 1foc n ILE 80 N 0.00 0.00 0.00 -3.67 -0.00 -0.75 -3.73 119.36 111.21 1foc n ILE 80 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.75 1foc n ILE 80 Cb 0.00 -0.48 0.00 0.00 -0.00 0.00 0.00 39.64 39.16 1foc n ILE 80 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1foc n ALA 81 N -3.00 0.00 -0.00 -1.39 0.00 0.14 -2.57 120.51 113.69 1foc n ALA 81 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.44 1foc n ALA 81 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.45 1foc n ALA 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1foc n ALA 82 N 0.00 0.02 0.00 0.00 0.00 -1.24 -4.07 120.51 115.22 1foc n ALA 82 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.29 1foc n ALA 82 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1foc n ALA 82 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 1foc n VAL 83 N -2.36 0.00 0.09 0.00 3.14 -1.06 0.37 118.33 118.51 1foc n VAL 83 Ca -0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 1foc n VAL 83 Cb 0.01 -0.15 0.00 0.00 -1.06 0.00 0.00 33.84 32.64 1foc n VAL 83 CO 0.00 0.00 0.00 0.18 -6.46 0.00 0.00 176.83 170.55 1foc n LEU 84 N 0.58 0.28 0.14 6.55 4.77 -1.26 -4.08 117.00 123.98 1foc n LEU 84 Ca 0.00 0.30 0.09 0.00 -0.03 0.00 0.00 56.01 56.37 1foc n LEU 84 Cb 0.00 0.10 0.48 0.00 -2.33 0.00 0.00 43.42 41.67 1foc n LEU 84 CO 0.00 -0.74 0.78 0.59 -1.33 0.00 0.00 177.39 176.69 1foc n ASN 85 N -3.33 0.46 0.01 -1.43 4.13 0.16 0.24 115.26 115.49 1foc n ASN 85 Ca 0.00 0.70 -0.18 0.00 1.68 0.00 0.00 54.58 56.79 1foc n ASN 85 Cb 0.00 -0.76 -0.12 0.00 -1.54 0.00 0.00 39.78 37.36 1foc n ASN 85 CO 0.00 0.00 0.00 -0.74 0.28 0.00 0.00 177.26 176.80 1foc h HIS 86 N 0.00 0.49 -0.12 3.10 -0.00 -0.93 -1.95 115.15 115.75 1foc h HIS 86 Ca 0.00 -0.30 0.00 0.00 -0.00 0.00 0.00 60.37 60.07 1foc h HIS 86 Cb 0.05 -0.04 0.00 0.00 -0.00 0.00 0.00 27.41 27.42 1foc h HIS 86 CO 0.00 1.15 0.00 0.44 -0.00 0.00 0.00 177.93 179.52 1foc n ILE 87 N -4.26 0.15 0.26 6.26 -5.35 0.45 -1.23 119.36 115.62 1foc n ILE 87 Ca -0.11 -0.26 0.11 0.00 -0.27 0.00 0.00 62.75 62.22 1foc n ILE 87 Cb 0.68 0.22 -0.16 0.00 -1.74 0.00 0.00 39.64 38.64 1foc n ILE 87 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1foc n ALA 88 N 0.04 3.32 0.00 -1.28 0.00 0.66 -4.71 120.51 118.55 1foc n ALA 88 Ca 0.16 -0.54 0.00 0.00 0.00 0.00 0.00 53.44 53.06 1foc n ALA 88 Cb 0.27 -0.75 0.00 0.00 0.00 0.00 0.00 19.45 18.96 1foc n ALA 88 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1foc n THR 89 N -2.06 0.00 0.00 0.00 -2.24 -0.74 0.33 114.28 109.57 1foc n THR 89 Ca -0.02 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 1foc n THR 89 Cb 0.51 -1.29 0.00 0.00 -2.10 0.00 0.00 70.33 67.45 1foc n THR 89 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1foc n ALA 90 N -2.89 1.07 -0.84 6.98 0.00 -0.37 0.23 120.51 124.70 1foc n ALA 90 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1foc n ALA 90 Cb 0.41 -1.20 0.00 0.00 0.00 0.00 0.00 19.45 18.66 1foc n ALA 90 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 1foc n TRP 91 N 1.44 0.00 -1.50 0.00 8.01 -1.26 -4.97 117.44 119.16 1foc n TRP 91 Ca 0.00 0.00 -0.00 0.00 -1.31 0.00 0.00 57.50 56.19 1foc n TRP 91 Cb 0.00 0.11 -0.00 0.00 -2.01 0.00 0.00 31.31 29.41 1foc n TRP 91 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1foc n GLY 92 N 0.00 -2.93 2.06 6.99 0.00 0.64 -4.76 105.19 107.20 1foc n GLY 92 Ca 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.64 1foc n GLY 92 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1foc n ASP 93 N 0.00 -1.15 0.06 1.61 9.92 -1.22 -4.65 116.55 121.12 1foc n ASP 93 Ca -0.00 0.25 0.01 0.00 -0.53 0.00 0.00 54.79 54.52 1foc n ASP 93 Cb 0.00 1.43 0.07 0.00 -0.64 0.00 0.00 41.12 41.99 1foc n ASP 93 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1foc n ALA 94 N -2.76 0.31 -1.00 2.24 0.00 0.15 -2.64 120.51 116.81 1foc n ALA 94 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.46 1foc n ALA 94 Cb 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 19.45 19.10 1foc n ALA 94 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1foc n LYS 95 N -1.44 0.00 0.00 0.00 3.00 -1.26 -4.42 118.16 114.04 1foc n LYS 95 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 1foc n LYS 95 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.45 1foc n LYS 95 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 1foc n LYS 96 N 0.00 0.00 -2.29 1.64 5.02 -1.12 -4.09 118.16 117.32 1foc n LYS 96 Ca 0.00 0.00 -0.36 0.00 -2.02 0.00 0.00 58.31 55.93 1foc n LYS 96 Cb 0.00 0.00 -0.01 0.00 -0.02 0.00 0.00 35.03 35.00 1foc n LYS 96 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1foc s VAL 97 N 0.00 3.19 0.60 -0.18 1.01 -1.08 -4.99 120.40 118.94 1foc s VAL 97 Ca 0.00 0.82 -0.19 0.00 0.00 0.00 0.00 61.98 62.60 1foc s VAL 97 Cb 0.00 -3.37 -0.03 0.00 0.00 0.00 0.00 36.38 32.98 1foc s VAL 97 CO 0.00 -0.09 1.28 -0.54 0.00 0.00 0.00 175.10 175.75 1foc s LYS 98 N -2.99 2.89 -0.02 2.72 1.02 -1.26 -4.65 119.74 117.46 1foc s LYS 98 Ca 0.68 2.03 -0.04 0.00 0.02 0.00 0.00 55.97 58.66 1foc s LYS 98 Cb -0.25 -2.00 -0.04 0.00 -0.52 0.00 0.00 37.83 35.01 1foc s LYS 98 CO 0.30 -1.33 0.70 0.41 -0.92 0.00 0.00 175.35 174.51 1foc n GLY 99 N 0.72 0.05 3.76 -3.33 0.00 -1.26 -4.78 105.19 100.35 1foc n GLY 99 Ca 0.13 -0.10 -0.38 0.00 0.00 0.00 0.00 46.02 45.67 1foc n GLY 99 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1foc s PHE 100 N 3.31 2.72 0.27 1.61 -0.12 -1.26 -4.94 117.98 119.56 1foc s PHE 100 Ca 0.09 1.45 -0.30 0.00 -0.05 0.00 0.00 56.93 58.11 1foc s PHE 100 Cb 0.02 -3.60 -0.10 0.00 -0.63 0.00 0.00 43.02 38.71 1foc s PHE 100 CO 0.04 -2.07 1.44 0.21 -0.05 0.00 0.00 175.22 174.80 1foc s LYS 101 N -2.55 4.25 0.00 1.99 2.20 -1.26 -5.00 119.74 119.37 1foc s LYS 101 Ca 0.63 2.33 0.00 0.00 -0.36 0.00 0.00 55.97 58.57 1foc s LYS 101 Cb -0.35 -3.09 0.00 0.00 -1.51 0.00 0.00 37.83 32.88 1foc s LYS 101 CO 0.44 -0.42 0.00 -2.30 -0.36 0.00 0.00 175.35 172.70 1foc n PRO 102 N 2.11 1.31 -3.45 4.03 -0.02 -1.26 -5.04 135.00 132.68 1foc n PRO 102 Ca 0.06 0.00 -0.23 0.00 -2.02 0.00 0.00 63.50 61.31 1foc n PRO 102 Cb 0.40 0.00 0.03 0.00 -0.02 0.00 0.00 33.50 33.91 1foc n PRO 102 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 1foc s PHE 103 N 0.00 1.59 -0.17 6.00 0.40 -1.26 -5.09 117.98 119.45 1foc s PHE 103 Ca 0.00 -0.76 -0.29 0.00 -0.60 0.00 0.00 56.93 55.28 1foc s PHE 103 Cb 0.00 -2.08 0.12 0.00 0.51 0.00 0.00 43.02 41.57 1foc s PHE 103 CO 0.00 -0.79 0.95 0.95 0.70 0.00 0.00 175.22 177.04 1foc s THR 104 N -2.70 0.00 0.40 0.64 -4.23 -1.26 -5.01 115.64 103.48 1foc s THR 104 Ca 0.48 0.00 0.09 0.00 -1.18 0.00 0.00 61.69 61.09 1foc s THR 104 Cb -0.04 -1.00 0.19 0.00 1.34 0.00 0.00 72.50 72.99 1foc s THR 104 CO 0.30 0.00 1.96 0.00 -0.54 0.00 0.00 174.62 176.35 1foc h ALA 105 N 2.97 1.59 -0.28 3.99 0.00 -1.92 -2.58 119.26 123.02 1foc h ALA 105 Ca -0.21 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.45 1foc h ALA 105 Cb 1.16 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 1foc h ALA 105 CO 0.28 0.30 -0.23 0.93 0.00 0.00 0.00 179.25 180.53 1foc h GLU 106 N 0.28 0.54 0.00 0.00 5.08 -1.98 0.94 114.58 119.43 1foc h GLU 106 Ca 0.06 -0.20 -0.04 0.00 -1.00 0.00 0.00 59.36 58.18 1foc h GLU 106 Cb 0.25 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 1foc h GLU 106 CO 0.01 0.73 -0.18 1.49 -1.00 0.00 0.00 179.01 180.06 1foc h GLU 107 N 0.48 0.00 0.01 2.33 4.81 -1.87 1.52 114.58 121.86 1foc h GLU 107 Ca 0.07 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.30 1foc h GLU 107 Cb 0.66 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.04 1foc h GLU 107 CO 0.05 0.18 -0.01 0.28 -0.73 0.00 0.00 179.01 178.79 1foc h VAL 108 N 0.00 1.52 0.00 0.32 2.07 -0.88 -3.19 116.25 116.09 1foc h VAL 108 Ca -0.00 -1.97 -0.04 0.00 0.82 0.00 0.00 66.70 65.51 1foc h VAL 108 Cb 0.62 2.79 -0.01 0.00 -1.52 0.00 0.00 31.29 33.17 1foc h VAL 108 CO 0.02 0.48 -0.20 0.50 0.02 0.00 0.00 177.57 178.40 1foc h LYS 109 N -0.91 0.00 0.00 1.57 3.64 -0.37 -2.16 116.57 118.34 1foc h LYS 109 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1foc h LYS 109 Cb 0.81 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.63 1foc h LYS 109 CO 0.00 0.20 0.31 -0.22 -2.27 0.00 0.00 179.45 177.47 1foc h LYS 110 N 0.00 0.00 0.00 1.90 3.64 0.22 -1.80 116.57 120.53 1foc h LYS 110 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1foc h LYS 110 Cb 0.73 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.55 1foc h LYS 110 CO 0.03 0.00 0.00 1.28 -2.27 0.00 0.00 179.45 178.49 1foc n LEU 111 N -2.18 0.03 0.14 5.20 4.77 -0.82 -4.46 117.00 119.69 1foc n LEU 111 Ca -0.01 -0.50 0.18 0.00 -0.03 0.00 0.00 56.01 55.65 1foc n LEU 111 Cb 0.33 0.00 0.77 0.00 -2.33 0.00 0.00 43.42 42.19 1foc n LEU 111 CO 0.07 0.01 1.16 0.03 -1.33 0.00 0.00 177.39 177.32 1foc h ARG 112 N 0.00 0.00 0.05 3.23 2.47 -1.28 -1.37 114.38 117.48 1foc h ARG 112 Ca 0.00 0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1foc h ARG 112 Cb 0.00 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.32 1foc h ARG 112 CO 0.00 0.00 -0.07 0.00 0.56 0.00 0.00 179.97 180.46 1foc h ALA 113 N 1.72 -0.73 -0.30 0.04 0.00 -1.78 -1.97 119.26 116.24 1foc h ALA 113 Ca 0.14 -0.02 0.12 0.00 0.00 0.00 0.00 54.91 55.15 1foc h ALA 113 Cb 0.70 0.39 -0.05 0.00 0.00 0.00 0.00 17.79 18.83 1foc h ALA 113 CO -0.00 -0.74 0.17 1.63 0.00 0.00 0.00 179.25 180.31 1foc n LYS 114 N -2.75 -0.01 -1.98 0.00 4.76 -0.51 -4.72 118.16 112.94 1foc n LYS 114 Ca -0.01 0.37 -0.05 0.00 -2.87 0.00 0.00 58.31 55.75 1foc n LYS 114 Cb 0.06 -0.68 0.00 0.00 -1.84 0.00 0.00 35.03 32.57 1foc n LYS 114 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1foc n LYS 115 N -3.52 -0.25 -0.59 1.97 5.02 -0.74 -4.94 118.16 115.11 1foc n LYS 115 Ca 0.11 0.16 0.00 0.00 -2.02 0.00 0.00 58.31 56.55 1foc n LYS 115 Cb 0.37 -0.30 0.00 0.00 -0.02 0.00 0.00 35.03 35.08 1foc n LYS 115 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1foc n LEU 116 N -0.39 0.00 -3.85 -0.35 4.77 -1.26 -5.17 117.00 110.75 1foc n LEU 116 Ca -0.03 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.83 1foc n LEU 116 Cb 0.10 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.08 1foc n LEU 116 CO 0.09 -0.25 -0.19 0.42 -1.33 0.00 0.00 177.39 176.12 1foc s THR 117 N 1.32 0.05 0.17 -5.08 -4.23 -1.26 -4.93 115.64 101.67 1foc s THR 117 Ca 0.00 -0.38 0.00 0.00 -1.18 0.00 0.00 61.69 60.13 1foc s THR 117 Cb 0.00 -0.32 0.00 0.00 1.34 0.00 0.00 72.50 73.52 1foc s THR 117 CO 0.00 -0.21 0.28 -2.65 -0.54 0.00 0.00 174.62 171.50 1foc n PRO 118 N 2.18 0.01 -0.07 3.99 -0.02 -1.26 0.66 135.00 140.49 1foc n PRO 118 Ca -0.18 0.24 -0.11 0.00 -2.02 0.00 0.00 63.50 61.43 1foc n PRO 118 Cb 0.57 -0.78 -0.06 0.00 -0.02 0.00 0.00 33.50 33.21 1foc n PRO 118 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1foc n GLN 119 N -0.96 0.31 -0.27 -0.52 3.00 -1.26 -1.64 117.38 116.04 1foc n GLN 119 Ca 0.00 0.09 -0.02 0.00 -0.01 0.00 0.00 57.00 57.06 1foc n GLN 119 Cb 0.28 -1.17 0.04 0.00 0.00 0.00 0.00 30.24 29.39 1foc n GLN 119 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.06 179.02 1foc h GLN 120 N -0.18 -0.08 -0.35 -1.09 1.08 2.03 1.70 115.11 118.22 1foc h GLN 120 Ca -0.31 0.01 -0.01 0.00 -1.45 0.00 0.00 58.65 56.89 1foc h GLN 120 Cb 1.40 0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 28.83 1foc h GLN 120 CO -0.10 -0.05 0.19 0.28 -0.95 0.00 0.00 178.83 178.20 1foc h VAL 121 N -0.08 1.11 -0.42 -0.54 2.07 0.12 0.69 116.25 119.19 1foc h VAL 121 Ca 0.30 -0.27 -0.10 0.00 0.82 0.00 0.00 66.70 67.45 1foc h VAL 121 Cb 0.57 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 1foc h VAL 121 CO -0.80 0.12 -0.11 0.25 0.02 0.00 0.00 177.57 177.05 1foc h LEU 122 N 0.48 0.83 -0.96 2.57 5.85 0.23 -2.78 115.31 121.52 1foc h LEU 122 Ca 0.13 -0.37 0.20 0.00 0.84 0.00 0.00 57.88 58.68 1foc h LEU 122 Cb 0.01 -0.23 -0.18 0.00 0.37 0.00 0.00 40.66 40.63 1foc h LEU 122 CO -0.02 1.00 -0.21 0.00 -0.34 0.00 0.00 178.44 178.87 1foc n ALA 123 N -2.46 0.27 0.41 1.25 0.00 0.54 0.49 120.51 121.00 1foc n ALA 123 Ca -0.01 1.06 0.11 0.00 0.00 0.00 0.00 53.44 54.60 1foc n ALA 123 Cb 0.37 -0.65 0.47 0.00 0.00 0.00 0.00 19.45 19.64 1foc n ALA 123 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1foc n GLU 124 N -5.55 0.17 0.13 0.00 -0.58 -1.04 -0.33 120.64 113.44 1foc n GLU 124 Ca 0.16 0.40 0.02 0.00 -0.42 0.00 0.00 57.16 57.33 1foc n GLU 124 Cb 0.52 -1.83 0.01 0.00 -0.57 0.00 0.00 31.44 29.58 1foc n GLU 124 CO 0.00 0.00 0.00 -0.09 -0.48 0.00 0.00 177.13 176.56 1foc h ARG 125 N 0.00 0.00 0.54 3.49 2.43 1.13 -3.28 114.38 118.69 1foc h ARG 125 Ca 0.00 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.14 1foc h ARG 125 Cb 0.35 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 29.90 1foc h ARG 125 CO 0.00 0.46 -0.26 -0.22 -1.51 0.00 0.00 179.97 178.44 1foc h LYS 126 N 0.00 -0.70 -0.88 0.20 3.64 0.53 -3.10 116.57 116.27 1foc h LYS 126 Ca -0.02 0.05 0.32 0.00 -1.27 0.00 0.00 60.65 59.73 1foc h LYS 126 Cb 1.39 0.16 -0.11 0.00 -0.41 0.00 0.00 32.23 33.27 1foc h LYS 126 CO 0.06 -0.41 0.54 1.63 -2.27 0.00 0.00 179.45 179.00 1foc n LYS 127 N -5.34 -0.03 0.00 1.90 5.02 -0.81 -0.81 118.16 118.09 1foc n LYS 127 Ca -0.12 0.92 -0.07 0.00 -2.02 0.00 0.00 58.31 57.02 1foc n LYS 127 Cb 0.33 -1.75 -0.12 0.00 -0.02 0.00 0.00 35.03 33.47 1foc n LYS 127 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1foc h LEU 128 N 0.00 0.00 0.00 -0.35 3.38 -1.68 -3.50 115.31 113.16 1foc h LEU 128 Ca 0.61 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.58 1foc h LEU 128 Cb 1.85 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.60 1foc h LEU 128 CO -0.41 0.92 0.00 0.61 0.09 0.00 0.00 178.44 179.65 1foc n GLY 129 N 1.50 1.97 0.00 0.83 0.00 0.01 -4.99 105.19 104.51 1foc n GLY 129 Ca -0.13 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.64 1foc n GLY 129 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1foc n LEU 130 N 0.00 0.00 0.00 0.99 4.77 -1.26 -5.02 117.00 116.48 1foc n LEU 130 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1foc n LEU 130 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1foc n LEU 130 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.39 176.35