#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2f0x n THR 5 N 0.00 0.00 -0.09 2.46 -1.04 -1.26 -0.78 114.28 113.57 2f0x n THR 5 Ca 0.00 0.00 -0.09 0.00 -2.04 0.00 0.00 64.05 61.92 2f0x n THR 5 Cb 0.00 0.00 -0.02 0.00 -1.82 0.00 0.00 70.33 68.49 2f0x n THR 5 CO 0.00 0.00 0.00 1.56 -0.64 0.00 0.00 175.07 175.99 2f0x h GLN 6 N 0.00 0.43 -0.82 -2.82 4.20 -2.01 0.15 115.11 114.23 2f0x h GLN 6 Ca 0.00 -0.04 0.01 0.00 0.06 0.00 0.00 58.65 58.68 2f0x h GLN 6 Cb 0.00 -0.09 -0.04 0.00 0.30 0.00 0.00 27.48 27.65 2f0x h GLN 6 CO 0.00 0.34 0.54 1.03 -0.67 0.00 0.00 178.83 180.07 2f0x h SER 7 N 0.39 0.94 -0.09 1.46 0.87 -1.41 -2.32 113.55 113.40 2f0x h SER 7 Ca 0.11 -0.02 -0.14 0.00 -1.23 0.00 0.00 61.79 60.51 2f0x h SER 7 Cb 0.03 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 61.75 2f0x h SER 7 CO -0.02 0.68 -0.42 0.25 -0.53 0.00 0.00 176.83 176.79 2f0x h LEU 8 N 1.11 0.66 -1.35 2.23 5.85 -1.72 -2.13 115.31 119.96 2f0x h LEU 8 Ca 0.30 -0.30 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 2f0x h LEU 8 Cb -0.12 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 40.70 2f0x h LEU 8 CO -0.07 1.00 0.25 0.03 -0.34 0.00 0.00 178.44 179.31 2f0x h ARG 9 N 0.51 0.69 0.12 1.25 3.08 -0.50 -0.85 114.38 118.67 2f0x h ARG 9 Ca 0.04 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 2f0x h ARG 9 Cb 0.94 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.85 2f0x h ARG 9 CO 0.08 0.53 -0.06 0.93 -1.07 0.00 0.00 179.97 180.39 2f0x h GLU 10 N 0.69 -0.15 -0.90 0.04 5.08 -1.18 -0.40 114.58 117.76 2f0x h GLU 10 Ca 0.18 0.01 0.23 0.00 -1.00 0.00 0.00 59.36 58.77 2f0x h GLU 10 Cb 0.06 0.03 -0.13 0.00 0.50 0.00 0.00 28.75 29.22 2f0x h GLU 10 CO -0.03 0.24 0.39 0.28 -1.00 0.00 0.00 179.01 178.90 2f0x h VAL 11 N -0.59 0.46 -0.32 3.13 2.07 -0.96 0.25 116.25 120.29 2f0x h VAL 11 Ca -0.02 -0.13 -0.16 0.00 0.82 0.00 0.00 66.70 67.21 2f0x h VAL 11 Cb 0.47 0.04 -0.00 0.00 -1.52 0.00 0.00 31.29 30.27 2f0x h VAL 11 CO 0.03 0.07 -0.42 0.40 0.02 0.00 0.00 177.57 177.66 2f0x h ILE 12 N 0.39 1.28 -0.93 4.57 2.04 -1.06 -3.10 117.51 120.70 2f0x h ILE 12 Ca 0.57 -1.61 -0.01 0.00 1.00 0.00 0.00 64.86 64.81 2f0x h ILE 12 Cb 1.09 1.55 -0.04 0.00 -0.74 0.00 0.00 36.82 38.67 2f0x h ILE 12 CO -0.54 0.53 0.56 0.50 0.00 0.00 0.00 178.15 179.19 2f0x h LYS 13 N 0.63 1.27 -2.26 2.37 3.64 0.11 -3.20 116.57 119.14 2f0x h LYS 13 Ca 0.04 -0.12 -0.01 0.00 -1.27 0.00 0.00 60.65 59.29 2f0x h LYS 13 Cb 1.02 -0.26 -0.00 0.00 -0.41 0.00 0.00 32.23 32.58 2f0x h LYS 13 CO 0.10 0.89 0.11 0.00 -2.27 0.00 0.00 179.45 178.28 2f0x n ALA 14 N -2.40 1.88 0.00 5.00 0.00 0.52 -3.91 120.51 121.60 2f0x n ALA 14 Ca 0.10 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.46 2f0x n ALA 14 Cb 0.06 -1.97 0.00 0.00 0.00 0.00 0.00 19.45 17.54 2f0x n ALA 14 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2f0x n THR 16 N 2.23 0.00 0.00 0.00 -2.24 -1.21 -1.76 114.28 111.30 2f0x n THR 16 Ca 0.02 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 2f0x n THR 16 Cb 0.10 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.33 2f0x n THR 16 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2f0x n LYS 17 N 0.02 5.17 -1.34 -0.78 5.02 -1.25 -5.03 118.16 119.97 2f0x n LYS 17 Ca 0.00 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 55.92 2f0x n LYS 17 Cb 0.00 -0.57 0.06 0.00 -0.02 0.00 0.00 35.03 34.50 2f0x n LYS 17 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2f0x n ALA 18 N -1.03 -1.18 0.04 7.82 0.00 -0.72 -4.94 120.51 120.50 2f0x n ALA 18 Ca 0.00 -0.18 0.06 0.00 0.00 0.00 0.00 53.44 53.33 2f0x n ALA 18 Cb 0.00 -1.90 -0.10 0.00 0.00 0.00 0.00 19.45 17.45 2f0x n ALA 18 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2f0x n ARG 19 N -0.76 0.57 -1.29 0.00 1.74 -1.26 -4.62 116.66 111.03 2f0x n ARG 19 Ca 0.11 -0.11 -0.21 0.00 -0.77 0.00 0.00 57.85 56.87 2f0x n ARG 19 Cb 0.49 -1.29 0.15 0.00 -1.02 0.00 0.00 32.46 30.79 2f0x n ARG 19 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 2f0x n ASN 20 N -1.90 -0.05 0.12 0.55 0.23 -1.26 -4.89 115.26 108.05 2f0x n ASN 20 Ca -0.02 -1.31 0.18 0.00 -0.53 0.00 0.00 54.58 52.90 2f0x n ASN 20 Cb 0.33 -0.71 0.76 0.00 -2.08 0.00 0.00 39.78 38.07 2f0x n ASN 20 CO 0.00 0.00 0.00 0.15 -0.93 0.00 0.00 177.26 176.48 2f0x h PHE 21 N -1.60 0.00 0.00 -2.53 3.57 -2.05 -2.13 116.94 112.21 2f0x h PHE 21 Ca -0.30 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.20 2f0x h PHE 21 Cb 0.84 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.58 2f0x h PHE 21 CO 0.00 0.00 0.00 0.39 -2.23 0.00 0.00 178.31 176.47 2f0x n GLU 22 N -4.02 0.02 0.26 1.11 1.02 -1.26 -1.73 120.64 116.05 2f0x n GLU 22 Ca 0.05 0.51 0.12 0.00 -0.02 0.00 0.00 57.16 57.81 2f0x n GLU 22 Cb 0.46 -1.57 0.73 0.00 -0.02 0.00 0.00 31.44 31.04 2f0x n GLU 22 CO 0.00 0.00 0.00 0.07 1.18 0.00 0.00 177.13 178.38 2f0x h ARG 23 N 0.00 0.00 0.00 3.49 0.11 -1.64 -2.48 114.38 113.87 2f0x h ARG 23 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2f0x h ARG 23 Cb 0.01 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.09 2f0x h ARG 23 CO 0.00 0.10 0.00 1.33 0.10 0.00 0.00 179.97 181.50 2f0x n VAL 24 N -3.88 1.04 -0.23 0.08 0.24 -0.71 -1.75 118.33 113.12 2f0x n VAL 24 Ca -0.02 0.26 0.05 0.00 -2.04 0.00 0.00 64.34 62.58 2f0x n VAL 24 Cb 0.19 -1.12 0.13 0.00 -1.47 0.00 0.00 33.84 31.57 2f0x n VAL 24 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 2f0x n LEU 25 N -1.36 2.78 0.26 1.34 4.77 -0.93 -4.70 117.00 119.16 2f0x n LEU 25 Ca 0.03 -2.12 0.12 0.00 -0.03 0.00 0.00 56.01 54.01 2f0x n LEU 25 Cb 0.08 -0.21 0.63 0.00 -2.33 0.00 0.00 43.42 41.59 2f0x n LEU 25 CO 0.07 0.67 0.99 1.23 -1.33 0.00 0.00 177.39 179.02 2f0x h GLY 26 N 1.48 0.00 0.69 -0.72 0.00 -1.48 -1.38 103.07 101.67 2f0x h GLY 26 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2f0x h GLY 26 CO 0.02 0.00 -0.61 0.28 0.00 0.00 0.00 176.54 176.23 2f0x n LYS 27 N -2.54 0.06 -2.35 4.80 4.76 -1.26 -4.63 118.16 117.00 2f0x n LYS 27 Ca -0.02 -0.04 -0.35 0.00 -2.87 0.00 0.00 58.31 55.03 2f0x n LYS 27 Cb 0.34 -1.50 -0.01 0.00 -1.84 0.00 0.00 35.03 32.02 2f0x n LYS 27 CO 0.00 0.00 0.00 0.96 -1.37 0.00 0.00 177.40 176.99 2f0x s ILE 28 N -2.97 3.34 0.09 -0.18 -4.36 -0.52 -4.70 121.20 111.91 2f0x s ILE 28 Ca 0.11 0.86 0.08 0.00 -0.26 0.00 0.00 60.65 61.44 2f0x s ILE 28 Cb 0.17 -3.36 -0.03 0.00 1.25 0.00 0.00 42.46 40.49 2f0x s ILE 28 CO 0.73 -0.16 -0.20 0.42 0.24 0.00 0.00 174.94 175.97 2f0x s THR 29 N -1.80 1.66 -0.09 8.37 -4.23 0.16 -4.96 115.64 114.75 2f0x s THR 29 Ca 0.70 -1.48 -0.26 0.00 -1.18 0.00 0.00 61.69 59.47 2f0x s THR 29 Cb -0.22 -1.50 -0.03 0.00 1.34 0.00 0.00 72.50 72.09 2f0x s THR 29 CO 0.26 -0.04 0.82 -0.22 -0.54 0.00 0.00 174.62 174.90 2f0x s LEU 30 N -1.80 4.28 -0.23 4.79 2.96 -1.26 -0.76 118.68 126.66 2f0x s LEU 30 Ca 0.06 1.31 -0.13 0.00 -0.22 0.00 0.00 54.13 55.15 2f0x s LEU 30 Cb -0.10 -3.27 -0.17 0.00 0.50 0.00 0.00 46.19 43.15 2f0x s LEU 30 CO 0.04 -0.26 -0.04 0.52 -1.32 0.00 0.00 176.35 175.29 2f0x n VAL 31 N 4.16 1.57 -3.53 1.68 0.31 0.79 -4.93 118.33 118.37 2f0x n VAL 31 Ca 0.03 -0.35 -0.10 0.00 -0.01 0.00 0.00 64.34 63.91 2f0x n VAL 31 Cb 0.50 -1.83 -0.04 0.00 -0.91 0.00 0.00 33.84 31.56 2f0x n VAL 31 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 2f0x s SER 32 N -7.06 -0.40 -0.03 4.52 1.04 -0.95 -4.99 113.70 105.83 2f0x s SER 32 Ca -0.32 0.24 0.02 0.00 0.48 0.00 0.00 55.95 56.37 2f0x s SER 32 Cb 0.10 0.37 0.00 0.00 0.10 0.00 0.00 66.02 66.59 2f0x s SER 32 CO 0.59 -0.52 -0.09 0.00 0.98 0.00 0.00 173.24 174.20 2f0x s ALA 33 N -2.14 0.83 0.18 5.32 0.00 -1.26 -0.90 121.76 123.79 2f0x s ALA 33 Ca 0.01 -0.31 -0.11 0.00 0.00 0.00 0.00 51.96 51.54 2f0x s ALA 33 Cb -0.01 -0.31 -0.00 0.00 0.00 0.00 0.00 23.12 22.80 2f0x s ALA 33 CO -0.03 0.13 0.34 0.00 0.00 0.00 0.00 175.76 176.21 2f0x s ALA 34 N 0.21 -0.19 -0.12 0.00 0.00 0.67 -4.84 121.76 117.48 2f0x s ALA 34 Ca -0.03 -0.76 -0.36 0.00 0.00 0.00 0.00 51.96 50.81 2f0x s ALA 34 Cb -0.08 0.88 -0.13 0.00 0.00 0.00 0.00 23.12 23.78 2f0x s ALA 34 CO 0.00 -0.69 1.80 -2.30 0.00 0.00 0.00 175.76 174.57 2f0x n PRO 35 N -0.25 1.83 -0.92 0.00 -0.02 -1.26 -0.97 135.00 133.41 2f0x n PRO 35 Ca -0.07 0.67 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 2f0x n PRO 35 Cb 0.63 -2.45 0.00 0.00 -0.02 0.00 0.00 33.50 31.65 2f0x n PRO 35 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2f0x n GLY 36 N 4.21 0.18 2.87 -1.23 0.00 -0.19 -4.96 105.19 106.07 2f0x n GLY 36 Ca 0.23 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.09 2f0x n GLY 36 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2f0x s LYS 37 N -1.25 0.08 -0.05 1.61 2.20 -0.14 -0.20 119.74 121.99 2f0x s LYS 37 Ca 0.00 0.57 0.04 0.00 -0.36 0.00 0.00 55.97 56.22 2f0x s LYS 37 Cb 0.00 -0.32 0.00 0.00 -1.51 0.00 0.00 37.83 36.00 2f0x s LYS 37 CO 0.00 -0.34 -0.16 0.08 -0.36 0.00 0.00 175.35 174.57 2f0x s VAL 38 N 2.33 1.39 -0.12 4.02 1.01 -0.87 -0.23 120.40 127.92 2f0x s VAL 38 Ca 0.03 -0.67 0.03 0.00 0.00 0.00 0.00 61.98 61.37 2f0x s VAL 38 Cb -0.12 -1.21 0.00 0.00 0.00 0.00 0.00 36.38 35.05 2f0x s VAL 38 CO -0.07 0.40 -0.22 -0.63 0.00 0.00 0.00 175.10 174.58 2f0x s ILE 39 N 0.23 2.16 0.24 2.22 1.01 -0.08 -1.40 121.20 125.58 2f0x s ILE 39 Ca -0.08 -0.97 0.06 0.00 0.00 0.00 0.00 60.65 59.66 2f0x s ILE 39 Cb -0.13 -1.85 -0.05 0.00 0.01 0.00 0.00 42.46 40.44 2f0x s ILE 39 CO 0.03 0.55 -0.06 0.00 0.00 0.00 0.00 174.94 175.47 2f0x n GLU 41 N -0.47 0.49 -4.18 0.00 1.02 0.06 0.09 120.64 117.64 2f0x n GLU 41 Ca -0.06 -2.06 -0.20 0.00 -0.02 0.00 0.00 57.16 54.81 2f0x n GLU 41 Cb 0.63 1.39 -0.16 0.00 -0.02 0.00 0.00 31.44 33.28 2f0x n GLU 41 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 2f0x s LYS 43 N -2.89 0.89 -0.22 3.49 2.20 -1.26 -0.67 119.74 121.28 2f0x s LYS 43 Ca 0.18 -0.12 -0.29 0.00 -0.36 0.00 0.00 55.97 55.38 2f0x s LYS 43 Cb 0.01 -0.88 -0.01 0.00 -1.51 0.00 0.00 37.83 35.44 2f0x s LYS 43 CO 0.13 -0.08 1.30 0.08 -0.36 0.00 0.00 175.35 176.42 2f0x s VAL 44 N 0.91 4.18 0.46 4.02 1.01 -0.21 -4.94 120.40 125.84 2f0x s VAL 44 Ca -0.11 1.39 0.06 0.00 0.00 0.00 0.00 61.98 63.32 2f0x s VAL 44 Cb -0.14 -4.04 -0.03 0.00 0.00 0.00 0.00 36.38 32.16 2f0x s VAL 44 CO 0.00 -0.29 0.20 -1.61 0.00 0.00 0.00 175.10 173.41 2f0x s GLU 45 N 3.85 2.23 0.29 2.72 0.41 -1.26 -0.11 118.70 126.82 2f0x s GLU 45 Ca 0.56 -1.96 0.03 0.00 -0.41 0.00 0.00 54.97 53.19 2f0x s GLU 45 Cb -0.20 -1.94 0.63 0.00 -1.78 0.00 0.00 34.13 30.84 2f0x s GLU 45 CO 0.19 -0.26 1.80 1.49 -0.49 0.00 0.00 175.26 177.99 2f0x h GLU 46 N 1.27 0.80 0.00 1.61 4.81 -1.96 0.17 114.58 121.28 2f0x h GLU 46 Ca -0.42 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 2f0x h GLU 46 Cb 1.27 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 30.47 2f0x h GLU 46 CO 0.68 0.53 0.00 -0.85 -0.73 0.00 0.00 179.01 178.64 2f0x n GLU 47 N -4.73 0.03 0.00 1.92 0.28 -1.26 -1.47 120.64 115.42 2f0x n GLU 47 Ca 0.21 0.47 0.09 0.00 -0.16 0.00 0.00 57.16 57.77 2f0x n GLU 47 Cb 0.47 -1.59 -0.06 0.00 1.43 0.00 0.00 31.44 31.68 2f0x n GLU 47 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 2f0x n HIS 48 N -1.65 0.00 -3.61 -1.84 8.25 0.59 -5.01 115.22 111.95 2f0x n HIS 48 Ca 0.01 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.24 2f0x n HIS 48 Cb 0.05 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.14 2f0x n HIS 48 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 2f0x s THR 49 N -2.56 5.17 0.00 1.59 -4.23 -0.54 -1.23 115.64 113.84 2f0x s THR 49 Ca 0.11 -0.66 0.00 0.00 -1.18 0.00 0.00 61.69 59.96 2f0x s THR 49 Cb 0.15 -3.86 0.00 0.00 1.34 0.00 0.00 72.50 70.13 2f0x s THR 49 CO 0.66 -0.46 0.00 -0.46 -0.54 0.00 0.00 174.62 173.82 2f0x n ASN 50 N -1.62 0.00 0.04 3.99 0.23 -0.04 -4.65 115.26 113.20 2f0x n ASN 50 Ca -0.06 -0.37 -0.04 0.00 -0.53 0.00 0.00 54.58 53.58 2f0x n ASN 50 Cb 0.56 0.00 0.19 0.00 -2.08 0.00 0.00 39.78 38.45 2f0x n ASN 50 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2f0x h ALA 51 N -1.45 1.05 -0.28 -2.53 0.00 -2.00 -3.07 119.26 110.99 2f0x h ALA 51 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.52 2f0x h ALA 51 Cb 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.68 2f0x h ALA 51 CO 0.00 0.59 0.00 0.44 0.00 0.00 0.00 179.25 180.28 2f0x n ILE 52 N -4.07 0.37 -0.68 0.00 -5.35 -1.26 -4.93 119.36 103.44 2f0x n ILE 52 Ca -0.01 -0.39 0.00 0.00 -0.27 0.00 0.00 62.75 62.08 2f0x n ILE 52 Cb 0.46 0.22 0.00 0.00 -1.74 0.00 0.00 39.64 38.58 2f0x n ILE 52 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2f0x n GLY 53 N 1.01 0.62 3.54 3.28 0.00 -1.16 -5.08 105.19 107.41 2f0x n GLY 53 Ca 0.12 -0.34 -0.25 0.00 0.00 0.00 0.00 46.02 45.55 2f0x n GLY 53 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2f0x s THR 54 N -2.00 2.55 -0.13 2.61 -4.23 -1.26 -3.40 115.64 109.78 2f0x s THR 54 Ca 0.00 -2.22 -0.39 0.00 -1.18 0.00 0.00 61.69 57.91 2f0x s THR 54 Cb 0.00 -2.55 -0.16 0.00 1.34 0.00 0.00 72.50 71.13 2f0x s THR 54 CO 0.00 -0.30 1.60 -0.11 -0.54 0.00 0.00 174.62 175.26 2f0x n LEU 55 N -0.76 2.17 -4.72 4.79 7.94 0.07 -0.86 117.00 125.62 2f0x n LEU 55 Ca -0.05 1.09 -0.42 0.00 -1.11 0.00 0.00 56.01 55.52 2f0x n LEU 55 Cb 0.61 -1.17 -0.03 0.00 0.53 0.00 0.00 43.42 43.36 2f0x n LEU 55 CO 0.41 -0.64 1.17 -2.28 -1.11 0.00 0.00 177.39 174.94 2f0x s HIS 56 N 2.40 3.10 0.54 1.96 5.65 -0.36 -4.70 115.29 123.88 2f0x s HIS 56 Ca 0.93 0.76 0.27 0.00 0.25 0.00 0.00 55.06 57.27 2f0x s HIS 56 Cb -1.01 -3.86 1.44 0.00 -1.18 0.00 0.00 32.58 27.98 2f0x s HIS 56 CO 0.58 -3.08 1.98 0.78 -0.65 0.00 0.00 174.74 174.35 2f0x h GLY 57 N 6.51 0.00 1.94 1.59 0.00 -1.91 0.28 103.07 111.47 2f0x h GLY 57 Ca -0.43 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 46.73 2f0x h GLY 57 CO 0.88 0.00 -0.78 -1.33 0.00 0.00 0.00 176.54 175.31 2f0x h GLY 58 N 0.00 0.06 1.28 4.60 0.00 -1.97 -1.81 103.07 105.23 2f0x h GLY 58 Ca 0.25 -0.10 -0.26 0.00 0.00 0.00 0.00 47.33 47.23 2f0x h GLY 58 CO -0.00 0.09 -1.01 -2.00 0.00 0.00 0.00 176.54 173.61 2f0x h LEU 59 N 0.03 0.84 -0.23 3.11 5.85 -1.33 -0.71 115.31 122.88 2f0x h LEU 59 Ca -0.01 -0.66 0.03 0.00 0.84 0.00 0.00 57.88 58.07 2f0x h LEU 59 Cb 1.37 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 42.11 2f0x h LEU 59 CO 0.11 1.47 0.06 0.74 -0.34 0.00 0.00 178.44 180.47 2f0x h THR 60 N 0.37 0.92 -0.98 1.05 2.02 -1.27 0.45 112.91 115.46 2f0x h THR 60 Ca -0.12 -0.05 0.04 0.00 0.77 0.00 0.00 66.41 67.05 2f0x h THR 60 Cb 1.66 0.75 -0.06 0.00 -1.74 0.00 0.00 68.15 68.76 2f0x h THR 60 CO 0.19 0.03 0.64 0.00 0.37 0.00 0.00 175.52 176.75 2f0x h ALA 61 N 1.15 1.30 -0.42 6.16 0.00 -1.24 -0.55 119.26 125.66 2f0x h ALA 61 Ca 0.10 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.84 2f0x h ALA 61 Cb 0.09 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 2f0x h ALA 61 CO -0.12 0.53 -0.22 1.15 0.00 0.00 0.00 179.25 180.59 2f0x h THR 62 N 1.24 1.27 -0.71 0.00 2.02 -0.01 -1.73 112.91 114.99 2f0x h THR 62 Ca 0.39 -1.35 -0.02 0.00 0.77 0.00 0.00 66.41 66.20 2f0x h THR 62 Cb -0.00 1.18 -0.03 0.00 -1.74 0.00 0.00 68.15 67.56 2f0x h THR 62 CO -0.12 0.46 0.37 -0.07 0.37 0.00 0.00 175.52 176.53 2f0x h LEU 63 N 0.74 0.91 0.24 2.58 3.38 0.62 -1.84 115.31 121.93 2f0x h LEU 63 Ca 0.10 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 2f0x h LEU 63 Cb 0.76 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.28 2f0x h LEU 63 CO 0.06 0.76 -0.12 0.58 0.09 0.00 0.00 178.44 179.82 2f0x h VAL 64 N 0.99 0.79 -0.05 1.22 2.07 -0.89 -1.03 116.25 119.35 2f0x h VAL 64 Ca 0.25 -0.14 0.04 0.00 0.82 0.00 0.00 66.70 67.66 2f0x h VAL 64 Cb 0.07 0.88 -0.05 0.00 -1.52 0.00 0.00 31.29 30.66 2f0x h VAL 64 CO -0.04 0.03 -0.30 -0.78 0.02 0.00 0.00 177.57 176.51 2f0x h ASP 65 N -0.39 -0.91 -0.03 0.57 1.82 -1.15 -1.05 116.42 115.28 2f0x h ASP 65 Ca -0.03 0.13 -0.02 0.00 -0.39 0.00 0.00 57.03 56.71 2f0x h ASP 65 Cb 0.30 0.38 0.00 0.00 0.68 0.00 0.00 39.33 40.69 2f0x h ASP 65 CO 0.05 -0.36 -0.05 0.78 -1.61 0.00 0.00 179.24 178.05 2f0x h ASN 66 N -0.42 0.10 0.43 2.28 2.35 -1.34 -2.46 115.58 116.51 2f0x h ASN 66 Ca 0.07 -0.57 -0.06 0.00 -0.55 0.00 0.00 56.30 55.20 2f0x h ASN 66 Cb 0.53 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.87 2f0x h ASN 66 CO -0.29 0.64 -0.28 0.40 -1.65 0.00 0.00 177.43 176.26 2f0x h ILE 67 N -0.45 0.99 -0.36 2.81 2.04 -1.24 -0.27 117.51 121.04 2f0x h ILE 67 Ca 0.00 -1.03 -0.11 0.00 1.00 0.00 0.00 64.86 64.72 2f0x h ILE 67 Cb 0.63 1.59 -0.01 0.00 -0.74 0.00 0.00 36.82 38.28 2f0x h ILE 67 CO 0.01 0.27 -0.23 -1.28 0.00 0.00 0.00 178.15 176.93 2f0x h SER 68 N 0.00 0.71 0.00 1.72 0.87 -1.21 -2.51 113.55 113.13 2f0x h SER 68 Ca -0.00 -0.25 0.00 0.00 -1.23 0.00 0.00 61.79 60.31 2f0x h SER 68 Cb 0.57 -0.19 0.00 0.00 -0.44 0.00 0.00 62.40 62.33 2f0x h SER 68 CO 0.04 0.92 0.00 0.41 -0.53 0.00 0.00 176.83 177.67 2f0x n THR 69 N -4.11 0.29 0.00 2.23 -1.04 -0.11 -2.14 114.28 109.39 2f0x n THR 69 Ca 0.00 -0.02 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 2f0x n THR 69 Cb 0.43 -0.72 0.00 0.00 -1.82 0.00 0.00 70.33 68.22 2f0x n THR 69 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2f0x n ALA 71 N 1.07 0.00 0.22 2.41 0.00 -0.95 -1.82 120.51 121.45 2f0x n ALA 71 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.49 2f0x n ALA 71 Cb 0.12 0.00 0.49 0.00 0.00 0.00 0.00 19.45 20.06 2f0x n ALA 71 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2f0x h LEU 72 N 0.00 0.00 -0.66 0.00 5.85 -1.72 -1.67 115.31 117.11 2f0x h LEU 72 Ca 0.00 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.58 2f0x h LEU 72 Cb 0.00 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.01 2f0x h LEU 72 CO 0.00 0.19 -0.65 -0.07 -0.34 0.00 0.00 178.44 177.58 2f0x h LEU 73 N 0.00 0.00 -4.15 2.25 3.38 -1.60 -3.20 115.31 111.99 2f0x h LEU 73 Ca -0.00 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.65 2f0x h LEU 73 Cb 0.35 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 40.98 2f0x h LEU 73 CO 0.03 0.65 0.01 0.00 0.09 0.00 0.00 178.44 179.22 2f0x s THR 75 N -0.65 0.65 0.17 0.00 2.01 -1.21 -1.02 115.64 115.60 2f0x s THR 75 Ca 0.58 -1.98 -0.14 0.00 0.31 0.00 0.00 61.69 60.46 2f0x s THR 75 Cb 0.33 -2.13 0.06 0.00 0.01 0.00 0.00 72.50 70.77 2f0x s THR 75 CO -0.10 -0.46 1.78 -0.33 -0.69 0.00 0.00 174.62 174.82 2f0x h GLU 76 N 2.69 0.43 -0.12 4.92 5.08 -1.88 -2.19 114.58 123.51 2f0x h GLU 76 Ca -0.37 -0.03 -0.17 0.00 -1.00 0.00 0.00 59.36 57.79 2f0x h GLU 76 Cb 1.21 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 30.35 2f0x h GLU 76 CO 0.62 0.28 -0.65 -0.09 -1.00 0.00 0.00 179.01 178.18 2f0x h ARG 77 N 0.44 0.46 -3.22 2.33 2.43 -1.93 -3.47 114.38 111.42 2f0x h ARG 77 Ca 0.21 -0.34 -0.40 0.00 -0.81 0.00 0.00 59.98 58.64 2f0x h ARG 77 Cb 0.14 0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 29.74 2f0x h ARG 77 CO -0.16 0.96 -0.54 0.41 -1.51 0.00 0.00 179.97 179.13 2f0x n GLY 78 N 0.42 -0.47 3.67 2.80 0.00 -0.83 -4.97 105.19 105.81 2f0x n GLY 78 Ca -0.04 -0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.59 2f0x n GLY 78 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2f0x s ALA 79 N -3.04 3.54 0.13 4.61 0.00 -1.25 -4.75 121.76 120.99 2f0x s ALA 79 Ca 0.07 -0.44 -0.14 0.00 0.00 0.00 0.00 51.96 51.45 2f0x s ALA 79 Cb -0.03 -2.71 -0.03 0.00 0.00 0.00 0.00 23.12 20.36 2f0x s ALA 79 CO 0.08 -0.33 1.54 -1.00 0.00 0.00 0.00 175.76 176.05 2f0x h PRO 80 N 7.35 0.77 -0.73 0.00 0.13 -1.88 -3.41 132.00 134.22 2f0x h PRO 80 Ca -0.36 -0.29 0.08 0.00 -0.87 0.00 0.00 66.00 64.57 2f0x h PRO 80 Cb 1.16 -0.05 -0.03 0.00 0.13 0.00 0.00 31.00 32.21 2f0x h PRO 80 CO 0.73 0.89 -0.22 0.41 -0.23 0.00 0.00 178.00 179.58 2f0x n GLY 81 N -0.22 -2.31 3.37 1.56 0.00 -1.26 -4.87 105.19 101.47 2f0x n GLY 81 Ca -0.01 -1.40 -0.31 0.00 0.00 0.00 0.00 46.02 44.30 2f0x n GLY 81 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2f0x s VAL 82 N -2.58 2.41 0.36 1.61 1.01 0.14 -4.90 120.40 118.45 2f0x s VAL 82 Ca 0.00 -1.04 -0.28 0.00 0.00 0.00 0.00 61.98 60.66 2f0x s VAL 82 Cb 0.00 -1.89 -0.12 0.00 0.00 0.00 0.00 36.38 34.37 2f0x s VAL 82 CO 0.00 0.54 1.40 -1.20 0.00 0.00 0.00 175.10 175.84 2f0x n SER 83 N 2.26 3.32 0.00 3.32 7.64 -1.26 -0.42 113.62 128.48 2f0x n SER 83 Ca -0.16 1.22 0.00 0.00 1.01 0.00 0.00 58.87 60.93 2f0x n SER 83 Cb 0.52 -1.56 0.00 0.00 -1.01 0.00 0.00 64.21 62.16 2f0x n SER 83 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 2f0x n VAL 84 N 0.40 0.00 -4.18 0.44 0.31 -0.47 -4.78 118.33 110.06 2f0x n VAL 84 Ca 0.03 0.00 -0.16 0.00 -0.01 0.00 0.00 64.34 64.20 2f0x n VAL 84 Cb 0.37 -1.26 -0.06 0.00 -0.91 0.00 0.00 33.84 31.99 2f0x n VAL 84 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 2f0x n ASP 85 N -2.88 -0.79 -3.65 4.52 8.00 -0.96 -5.00 116.55 115.78 2f0x n ASP 85 Ca 0.00 -2.85 0.01 0.00 0.71 0.00 0.00 54.79 52.67 2f0x n ASP 85 Cb 0.38 1.70 -0.06 0.00 -0.02 0.00 0.00 41.12 43.11 2f0x n ASP 85 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 2f0x s ASN 87 N -3.00 -0.10 -0.04 -2.24 2.47 -0.85 -1.33 114.94 109.85 2f0x s ASN 87 Ca 0.32 0.16 0.03 0.00 0.42 0.00 0.00 52.86 53.79 2f0x s ASN 87 Cb 0.01 0.94 0.00 0.00 -1.45 0.00 0.00 41.25 40.76 2f0x s ASN 87 CO 0.23 -0.03 -0.12 -0.63 -3.72 0.00 0.00 177.10 172.83 2f0x s ILE 88 N 0.96 1.08 -0.15 -5.21 1.01 -1.26 -1.66 121.20 115.96 2f0x s ILE 88 Ca -0.07 -0.50 -0.01 0.00 0.00 0.00 0.00 60.65 60.08 2f0x s ILE 88 Cb -0.03 -0.96 -0.01 0.00 0.01 0.00 0.00 42.46 41.48 2f0x s ILE 88 CO -0.11 0.33 -0.12 -0.89 0.00 0.00 0.00 174.94 174.15 2f0x s THR 89 N 0.30 3.00 0.16 2.92 2.01 -0.57 -4.97 115.64 118.49 2f0x s THR 89 Ca -0.07 -0.66 0.05 0.00 0.31 0.00 0.00 61.69 61.32 2f0x s THR 89 Cb -0.12 -2.28 -0.04 0.00 0.01 0.00 0.00 72.50 70.08 2f0x s THR 89 CO 0.02 0.51 0.16 -0.31 -0.69 0.00 0.00 174.62 174.30 2f0x s TYR 90 N 0.66 3.20 0.30 4.92 1.51 -1.26 -1.20 117.35 125.47 2f0x s TYR 90 Ca -0.06 -0.00 -0.29 0.00 -1.01 0.00 0.00 57.07 55.71 2f0x s TYR 90 Cb -0.15 -1.53 -0.10 0.00 -0.11 0.00 0.00 41.96 40.06 2f0x s TYR 90 CO 0.02 0.52 1.31 -1.54 -1.11 0.00 0.00 175.55 174.75 2f0x s SER 92 N -3.14 6.80 0.72 2.29 1.04 -0.93 -5.01 113.70 115.47 2f0x s SER 92 Ca 0.31 2.63 -0.15 0.00 0.48 0.00 0.00 55.95 59.23 2f0x s SER 92 Cb -0.10 -2.64 0.03 0.00 0.10 0.00 0.00 66.02 63.41 2f0x s SER 92 CO 0.24 -0.53 1.18 -2.84 0.98 0.00 0.00 173.24 172.27 2f0x s PRO 93 N -1.41 2.27 -0.22 4.02 0.02 -1.26 -4.54 135.00 133.87 2f0x s PRO 93 Ca 0.51 1.65 -0.02 0.00 0.02 0.00 0.00 61.00 63.16 2f0x s PRO 93 Cb -0.39 -1.86 0.01 0.00 0.02 0.00 0.00 34.50 32.27 2f0x s PRO 93 CO 0.49 -1.71 -0.08 0.00 -0.33 0.00 0.00 177.00 175.38 2f0x s ALA 94 N -2.10 2.69 0.34 -1.55 0.00 -1.26 -5.00 121.76 114.88 2f0x s ALA 94 Ca 0.72 -1.24 -0.05 0.00 0.00 0.00 0.00 51.96 51.39 2f0x s ALA 94 Cb -0.27 -1.60 -0.05 0.00 0.00 0.00 0.00 23.12 21.21 2f0x s ALA 94 CO 0.45 -0.50 0.62 0.15 0.00 0.00 0.00 175.76 176.48 2f0x s LYS 95 N 1.41 3.63 0.21 0.00 3.01 -1.26 -0.75 119.74 125.98 2f0x s LYS 95 Ca 0.04 0.07 -0.31 0.00 -1.01 0.00 0.00 55.97 54.76 2f0x s LYS 95 Cb -0.14 -2.57 -0.15 0.00 -1.01 0.00 0.00 37.83 33.96 2f0x s LYS 95 CO -0.06 0.10 1.18 -0.11 0.51 0.00 0.00 175.35 176.98 2f0x n LEU 96 N -1.29 1.91 0.00 3.17 7.94 -1.22 -0.47 117.00 127.04 2f0x n LEU 96 Ca -0.01 1.15 0.00 0.00 -1.11 0.00 0.00 56.01 56.04 2f0x n LEU 96 Cb 0.54 -1.28 0.00 0.00 0.53 0.00 0.00 43.42 43.22 2f0x n LEU 96 CO 0.49 -1.16 0.00 0.61 -1.11 0.00 0.00 177.39 176.22 2f0x n GLY 97 N 1.86 2.75 3.77 -3.96 0.00 0.84 -4.99 105.19 105.45 2f0x n GLY 97 Ca 0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.76 2f0x n GLY 97 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2f0x s GLU 98 N -0.40 4.31 -0.20 1.61 2.12 0.39 -4.67 118.70 121.85 2f0x s GLU 98 Ca 0.00 1.91 -0.15 0.00 0.36 0.00 0.00 54.97 57.09 2f0x s GLU 98 Cb 0.00 -2.92 -0.04 0.00 0.26 0.00 0.00 34.13 31.43 2f0x s GLU 98 CO 0.00 -0.12 0.37 -0.51 -0.54 0.00 0.00 175.26 174.46 2f0x s ASP 99 N -0.91 6.41 0.16 -1.70 1.01 -1.26 -1.04 116.67 119.34 2f0x s ASP 99 Ca 0.51 0.48 0.10 0.00 0.71 0.00 0.00 52.55 54.35 2f0x s ASP 99 Cb -0.33 -2.22 -0.04 0.00 1.01 0.00 0.00 42.92 41.34 2f0x s ASP 99 CO 0.43 -0.05 -0.21 0.27 0.21 0.00 0.00 175.17 175.82 2f0x s ILE 100 N 1.24 2.59 -0.14 0.77 -4.36 -1.26 -1.40 121.20 118.64 2f0x s ILE 100 Ca 0.18 -1.81 -0.00 0.00 -0.26 0.00 0.00 60.65 58.76 2f0x s ILE 100 Cb -0.15 -2.23 -0.01 0.00 1.25 0.00 0.00 42.46 41.33 2f0x s ILE 100 CO 0.07 -0.03 -0.13 -0.69 0.24 0.00 0.00 174.94 174.40 2f0x s VAL 101 N -1.46 3.05 -0.32 8.37 1.01 0.23 -4.40 120.40 126.87 2f0x s VAL 101 Ca 0.20 -0.66 -0.04 0.00 0.00 0.00 0.00 61.98 61.48 2f0x s VAL 101 Cb -0.09 -2.29 0.05 0.00 0.00 0.00 0.00 36.38 34.05 2f0x s VAL 101 CO 0.10 0.52 0.06 -0.63 0.00 0.00 0.00 175.10 175.15 2f0x s ILE 102 N 0.46 3.39 -0.16 2.22 1.09 0.11 -1.46 121.20 126.85 2f0x s ILE 102 Ca -0.09 -1.29 -0.03 0.00 -1.10 0.00 0.00 60.65 58.13 2f0x s ILE 102 Cb -0.16 -2.95 -0.03 0.00 -1.06 0.00 0.00 42.46 38.27 2f0x s ILE 102 CO 0.05 -0.17 -0.04 -0.89 -0.10 0.00 0.00 174.94 173.78 2f0x s THR 103 N 1.32 3.80 -0.05 2.92 2.01 -0.10 -1.04 115.64 124.51 2f0x s THR 103 Ca -0.03 -0.39 0.05 0.00 0.31 0.00 0.00 61.69 61.64 2f0x s THR 103 Cb -0.20 -2.67 -0.01 0.00 0.01 0.00 0.00 72.50 69.64 2f0x s THR 103 CO 0.01 0.49 -0.21 0.00 -0.69 0.00 0.00 174.62 174.21 2f0x s ALA 104 N 0.44 1.84 -0.02 7.40 0.00 -0.49 -0.02 121.76 130.91 2f0x s ALA 104 Ca -0.04 -0.88 0.05 0.00 0.00 0.00 0.00 51.96 51.09 2f0x s ALA 104 Cb -0.14 -0.57 -0.01 0.00 0.00 0.00 0.00 23.12 22.39 2f0x s ALA 104 CO 0.03 0.36 -0.18 -1.01 0.00 0.00 0.00 175.76 174.96 2f0x s HIS 105 N -0.13 1.62 -0.36 0.00 3.76 0.15 -2.05 115.29 118.28 2f0x s HIS 105 Ca -0.02 -0.33 -0.24 0.00 -0.15 0.00 0.00 55.06 54.32 2f0x s HIS 105 Cb -0.12 -1.05 0.01 0.00 1.11 0.00 0.00 32.58 32.53 2f0x s HIS 105 CO 0.02 -0.05 0.81 0.08 -0.85 0.00 0.00 174.74 174.75 2f0x s VAL 106 N -0.35 4.71 0.07 -0.90 1.01 0.72 -0.45 120.40 125.21 2f0x s VAL 106 Ca 0.05 0.95 -0.07 0.00 0.00 0.00 0.00 61.98 62.92 2f0x s VAL 106 Cb -0.08 -4.23 -0.29 0.00 0.00 0.00 0.00 36.38 31.79 2f0x s VAL 106 CO -0.00 -0.44 1.13 -0.07 0.00 0.00 0.00 175.10 175.72 2f0x h LEU 107 N 9.77 0.53 -7.00 3.92 3.38 -0.24 -3.48 115.31 122.19 2f0x h LEU 107 Ca -0.24 -0.55 0.16 0.00 0.09 0.00 0.00 57.88 57.34 2f0x h LEU 107 Cb 1.09 -0.17 -0.22 0.00 0.09 0.00 0.00 40.66 41.45 2f0x h LEU 107 CO 0.92 1.42 0.70 -0.75 0.09 0.00 0.00 178.44 180.81 2f0x s LYS 108 N -2.73 0.43 -0.16 1.13 2.47 -1.04 -5.00 119.74 114.84 2f0x s LYS 108 Ca -0.05 -0.00 -0.08 0.00 -1.56 0.00 0.00 55.97 54.27 2f0x s LYS 108 Cb 0.07 0.20 0.06 0.00 -1.46 0.00 0.00 37.83 36.70 2f0x s LYS 108 CO 0.90 -0.16 0.39 1.14 0.16 0.00 0.00 175.35 177.78 2f0x s GLN 109 N -1.66 0.35 0.00 4.03 -2.07 -1.26 -0.24 119.66 118.81 2f0x s GLN 109 Ca 0.04 0.79 0.00 0.00 -1.82 0.00 0.00 55.36 54.37 2f0x s GLN 109 Cb -0.01 0.00 0.00 0.00 -1.09 0.00 0.00 33.01 31.92 2f0x s GLN 109 CO -0.03 -0.17 0.00 0.41 -1.32 0.00 0.00 175.29 174.17 2f0x n GLY 110 N 4.43 4.37 0.20 2.60 0.00 0.10 -5.00 105.19 111.89 2f0x n GLY 110 Ca -0.21 -1.96 -0.10 0.00 0.00 0.00 0.00 46.02 43.75 2f0x n GLY 110 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2f0x h LYS 111 N 0.00 0.62 0.00 1.61 1.79 -2.01 -3.38 116.57 115.20 2f0x h LYS 111 Ca 0.00 -0.16 0.00 0.00 -2.18 0.00 0.00 60.65 58.31 2f0x h LYS 111 Cb 0.00 -0.07 0.00 0.00 -1.58 0.00 0.00 32.23 30.58 2f0x h LYS 111 CO 0.00 0.68 -0.15 0.25 -1.08 0.00 0.00 179.45 179.15 2f0x n THR 112 N -4.55 0.00 -5.20 -0.16 -2.24 -1.26 -4.80 114.28 96.07 2f0x n THR 112 Ca -0.01 -0.34 -0.30 0.00 -2.27 0.00 0.00 64.05 61.12 2f0x n THR 112 Cb 0.22 0.90 -0.16 0.00 -2.10 0.00 0.00 70.33 69.19 2f0x n THR 112 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2f0x s LEU 113 N -1.82 2.04 0.03 3.22 1.02 -1.26 0.13 118.68 122.03 2f0x s LEU 113 Ca 0.00 -0.48 0.07 0.00 0.02 0.00 0.00 54.13 53.75 2f0x s LEU 113 Cb 0.00 -1.30 -0.02 0.00 0.02 0.00 0.00 46.19 44.89 2f0x s LEU 113 CO 0.00 0.25 -0.21 0.00 0.02 0.00 0.00 176.35 176.41 2f0x s ALA 114 N -0.23 1.78 -0.07 4.21 0.00 0.60 0.02 121.76 128.06 2f0x s ALA 114 Ca -0.01 -1.03 0.02 0.00 0.00 0.00 0.00 51.96 50.95 2f0x s ALA 114 Cb -0.12 -0.38 0.01 0.00 0.00 0.00 0.00 23.12 22.63 2f0x s ALA 114 CO 0.02 0.41 -0.13 -0.06 0.00 0.00 0.00 175.76 176.00 2f0x s PHE 115 N -0.72 1.57 0.30 0.00 0.40 0.66 -0.31 117.98 119.89 2f0x s PHE 115 Ca 0.08 -0.61 0.05 0.00 -0.60 0.00 0.00 56.93 55.84 2f0x s PHE 115 Cb -0.09 -1.15 -0.06 0.00 0.51 0.00 0.00 43.02 42.23 2f0x s PHE 115 CO 0.01 -0.32 0.01 0.95 0.70 0.00 0.00 175.22 176.57 2f0x s THR 116 N 0.73 1.35 -0.02 0.64 -4.23 0.87 0.53 115.64 115.52 2f0x s THR 116 Ca -0.13 -2.04 0.02 0.00 -1.18 0.00 0.00 61.69 58.35 2f0x s THR 116 Cb -0.16 -2.63 0.00 0.00 1.34 0.00 0.00 72.50 71.06 2f0x s THR 116 CO 0.03 -0.15 -0.05 -0.55 -0.54 0.00 0.00 174.62 173.36 2f0x s SER 117 N -3.46 0.73 -0.06 3.99 0.15 0.40 -1.17 113.70 114.29 2f0x s SER 117 Ca 0.33 -0.11 -0.01 0.00 0.70 0.00 0.00 55.95 56.86 2f0x s SER 117 Cb 0.07 -0.18 0.03 0.00 -1.71 0.00 0.00 66.02 64.23 2f0x s SER 117 CO 0.13 0.03 0.00 -0.69 1.20 0.00 0.00 173.24 173.91 2f0x s VAL 118 N 0.20 0.33 -0.19 4.45 1.01 0.06 0.29 120.40 126.56 2f0x s VAL 118 Ca -0.02 0.11 -0.05 0.00 0.00 0.00 0.00 61.98 62.02 2f0x s VAL 118 Cb -0.06 -0.47 -0.03 0.00 0.00 0.00 0.00 36.38 35.82 2f0x s VAL 118 CO -0.00 0.23 -0.01 -1.81 0.00 0.00 0.00 175.10 173.52 2f0x s ASP 119 N 1.73 4.89 -0.19 3.32 1.11 0.97 -0.50 116.67 128.00 2f0x s ASP 119 Ca 0.01 -0.16 -0.10 0.00 0.18 0.00 0.00 52.55 52.48 2f0x s ASP 119 Cb -0.13 -1.82 -0.05 0.00 1.07 0.00 0.00 42.92 41.99 2f0x s ASP 119 CO -0.04 0.10 0.15 -0.76 1.18 0.00 0.00 175.17 175.80 2f0x s LEU 120 N 0.76 4.22 0.04 1.23 1.02 -0.17 -0.92 118.68 124.86 2f0x s LEU 120 Ca -0.00 0.27 0.00 0.00 0.02 0.00 0.00 54.13 54.42 2f0x s LEU 120 Cb -0.14 -2.12 -0.03 0.00 0.02 0.00 0.00 46.19 43.92 2f0x s LEU 120 CO 0.02 0.18 -0.04 0.42 0.02 0.00 0.00 176.35 176.95 2f0x s THR 121 N 0.31 0.28 -0.09 5.49 -4.23 -0.54 0.14 115.64 117.01 2f0x s THR 121 Ca 0.09 -1.24 -0.30 0.00 -1.18 0.00 0.00 61.69 59.07 2f0x s THR 121 Cb -0.11 -0.75 -0.04 0.00 1.34 0.00 0.00 72.50 72.95 2f0x s THR 121 CO -0.01 -0.62 1.40 0.21 -0.54 0.00 0.00 174.62 175.06 2f0x s ASN 122 N -1.95 6.85 0.23 3.99 3.84 0.25 -0.60 114.94 127.54 2f0x s ASN 122 Ca -0.07 1.94 -0.07 0.00 0.21 0.00 0.00 52.86 54.88 2f0x s ASN 122 Cb -0.05 -2.54 0.33 0.00 -0.55 0.00 0.00 41.25 38.44 2f0x s ASN 122 CO -0.03 -0.79 1.80 0.50 -2.79 0.00 0.00 177.10 175.79 2f0x h LYS 123 N 8.45 0.68 0.05 0.43 3.64 -1.55 1.10 116.57 129.38 2f0x h LYS 123 Ca -0.33 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.01 2f0x h LYS 123 Cb 1.14 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.81 2f0x h LYS 123 CO 0.95 0.45 -0.02 0.00 -2.27 0.00 0.00 179.45 178.55 2f0x h ALA 124 N 1.42 -0.07 -0.01 5.00 0.00 -1.91 -3.33 119.26 120.36 2f0x h ALA 124 Ca 0.35 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2f0x h ALA 124 Cb 0.31 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2f0x h ALA 124 CO -0.24 -0.31 -0.38 0.25 0.00 0.00 0.00 179.25 178.57 2f0x n THR 125 N -4.91 0.00 -0.74 0.00 -2.24 -1.20 -4.95 114.28 100.24 2f0x n THR 125 Ca -0.08 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.45 2f0x n THR 125 Cb 0.24 1.06 0.00 0.00 -2.10 0.00 0.00 70.33 69.53 2f0x n THR 125 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2f0x n GLY 126 N 1.39 0.17 3.74 3.38 0.00 0.38 -4.92 105.19 109.32 2f0x n GLY 126 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 2f0x n GLY 126 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2f0x s LYS 127 N -1.08 4.33 0.12 1.61 2.20 -1.23 -4.54 119.74 121.15 2f0x s LYS 127 Ca 0.00 2.17 -0.31 0.00 -0.36 0.00 0.00 55.97 57.47 2f0x s LYS 127 Cb 0.00 -3.16 -0.08 0.00 -1.51 0.00 0.00 37.83 33.08 2f0x s LYS 127 CO 0.00 -0.35 1.43 -1.17 -0.36 0.00 0.00 175.35 174.90 2f0x s LEU 128 N -0.11 4.37 -0.26 5.43 2.96 -1.26 0.85 118.68 130.66 2f0x s LEU 128 Ca 0.59 2.38 -0.14 0.00 -0.22 0.00 0.00 54.13 56.74 2f0x s LEU 128 Cb -0.39 -3.59 -0.14 0.00 0.50 0.00 0.00 46.19 42.57 2f0x s LEU 128 CO 0.40 -0.69 -0.21 -0.38 -1.32 0.00 0.00 176.35 174.15 2f0x n ILE 129 N 3.97 1.53 -3.56 6.68 5.41 0.38 -4.14 119.36 129.63 2f0x n ILE 129 Ca 0.12 -0.33 -0.11 0.00 1.00 0.00 0.00 62.75 63.43 2f0x n ILE 129 Cb 0.42 -1.88 -0.03 0.00 -0.71 0.00 0.00 39.64 37.44 2f0x n ILE 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2f0x s ALA 130 N -2.48 -1.29 -0.02 -1.39 0.00 -1.07 -2.19 121.76 113.31 2f0x s ALA 130 Ca -0.36 0.17 -0.00 0.00 0.00 0.00 0.00 51.96 51.77 2f0x s ALA 130 Cb 0.12 0.83 0.03 0.00 0.00 0.00 0.00 23.12 24.11 2f0x s ALA 130 CO 0.53 -0.77 0.03 -1.14 0.00 0.00 0.00 175.76 174.41 2f0x s GLN 131 N -3.80 0.01 0.06 0.00 0.74 -0.34 -0.99 119.66 115.33 2f0x s GLN 131 Ca 0.04 0.18 0.09 0.00 0.05 0.00 0.00 55.36 55.72 2f0x s GLN 131 Cb -0.01 -0.30 -0.03 0.00 1.10 0.00 0.00 33.01 33.78 2f0x s GLN 131 CO -0.09 -0.17 -0.26 0.20 -0.55 0.00 0.00 175.29 174.41 2f0x s GLY 132 N 1.12 1.42 -0.13 2.59 0.00 0.34 -1.51 107.32 111.15 2f0x s GLY 132 Ca -0.09 -1.30 0.02 0.00 0.00 0.00 0.00 44.72 43.35 2f0x s GLY 132 CO -0.03 -1.20 -0.18 0.50 0.00 0.00 0.00 173.10 172.19 2f0x s ARG 133 N -1.38 3.19 -0.09 2.90 1.81 -0.67 -0.76 118.95 123.94 2f0x s ARG 133 Ca 0.12 -0.79 0.03 0.00 -1.72 0.00 0.00 55.73 53.37 2f0x s ARG 133 Cb -0.10 -2.50 0.01 0.00 -0.45 0.00 0.00 34.95 31.91 2f0x s ARG 133 CO 0.03 0.12 -0.17 -1.58 -0.68 0.00 0.00 175.30 173.02 2f0x s HIS 134 N 0.53 2.02 -0.16 -0.53 2.46 -0.31 -2.00 115.29 117.29 2f0x s HIS 134 Ca -0.11 -0.87 -0.02 0.00 0.47 0.00 0.00 55.06 54.53 2f0x s HIS 134 Cb -0.16 -1.42 -0.01 0.00 -0.13 0.00 0.00 32.58 30.85 2f0x s HIS 134 CO 0.04 -0.41 -0.09 0.99 -2.47 0.00 0.00 174.74 172.80 2f0x s THR 135 N 0.69 3.23 0.05 0.89 2.01 -0.44 -0.09 115.64 121.99 2f0x s THR 135 Ca -0.13 -0.58 0.06 0.00 0.31 0.00 0.00 61.69 61.36 2f0x s THR 135 Cb -0.16 -2.40 -0.02 0.00 0.01 0.00 0.00 72.50 69.92 2f0x s THR 135 CO 0.03 0.49 -0.17 -0.54 -0.69 0.00 0.00 174.62 173.74 2f0x s LYS 136 N 0.76 1.10 -0.13 4.92 1.02 0.57 -1.37 119.74 126.60 2f0x s LYS 136 Ca -0.04 -0.86 -0.15 0.00 0.02 0.00 0.00 55.97 54.94 2f0x s LYS 136 Cb -0.15 -1.16 -0.05 0.00 -0.52 0.00 0.00 37.83 35.95 2f0x s LYS 136 CO 0.02 0.29 0.36 -1.58 -0.92 0.00 0.00 175.35 173.52 2f0x s HIS 137 N -0.87 3.50 -1.72 3.18 5.65 0.44 -0.29 115.29 125.18 2f0x s HIS 137 Ca 0.04 0.72 0.14 0.00 0.25 0.00 0.00 55.06 56.21 2f0x s HIS 137 Cb -0.08 -2.40 0.11 0.00 -1.18 0.00 0.00 32.58 29.02 2f0x s HIS 137 CO 0.02 0.25 0.94 1.28 -0.65 0.00 0.00 174.74 176.58