#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1f9h s VAL 2 N 0.00 5.05 -0.09 12.58 1.01 -1.26 -0.91 120.40 136.77 1f9h s VAL 2 Ca 0.00 0.64 -0.11 0.00 0.00 0.00 0.00 61.98 62.51 1f9h s VAL 2 Cb 0.00 -3.88 -0.05 0.00 0.00 0.00 0.00 36.38 32.45 1f9h s VAL 2 CO 0.00 -0.04 0.27 0.00 0.00 0.00 0.00 175.10 175.33 1f9h s ALA 3 N 2.34 3.74 -0.22 5.51 0.00 0.10 -0.35 121.76 132.88 1f9h s ALA 3 Ca 0.20 -0.45 -0.06 0.00 0.00 0.00 0.00 51.96 51.65 1f9h s ALA 3 Cb -0.15 -2.22 -0.02 0.00 0.00 0.00 0.00 23.12 20.72 1f9h s ALA 3 CO 0.11 0.42 0.01 0.71 0.00 0.00 0.00 175.76 177.02 1f9h s TYR 4 N -0.62 3.03 -0.13 0.00 2.02 0.11 -0.21 117.35 121.56 1f9h s TYR 4 Ca 0.18 -0.59 0.02 0.00 -0.37 0.00 0.00 57.07 56.31 1f9h s TYR 4 Cb -0.14 -2.15 -0.00 0.00 -0.40 0.00 0.00 41.96 39.27 1f9h s TYR 4 CO 0.07 -0.38 -0.19 0.42 -1.57 0.00 0.00 175.55 173.90 1f9h s ILE 5 N 1.38 2.40 0.07 2.71 1.01 -0.06 -0.70 121.20 128.00 1f9h s ILE 5 Ca 0.05 -0.88 -0.20 0.00 0.00 0.00 0.00 60.65 59.61 1f9h s ILE 5 Cb -0.15 -1.97 -0.07 0.00 0.01 0.00 0.00 42.46 40.29 1f9h s ILE 5 CO 0.01 0.54 0.60 0.00 0.00 0.00 0.00 174.94 176.09 1f9h s ALA 6 N 0.54 3.55 -0.13 9.38 0.00 0.67 -0.97 121.76 134.81 1f9h s ALA 6 Ca -0.12 0.08 0.03 0.00 0.00 0.00 0.00 51.96 51.95 1f9h s ALA 6 Cb -0.17 -2.70 0.00 0.00 0.00 0.00 0.00 23.12 20.26 1f9h s ALA 6 CO 0.04 0.34 -0.22 0.42 0.00 0.00 0.00 175.76 176.34 1f9h s ILE 7 N -0.92 2.14 0.03 0.00 1.01 -0.11 -1.48 121.20 121.87 1f9h s ILE 7 Ca 0.30 -0.97 0.03 0.00 0.00 0.00 0.00 60.65 60.02 1f9h s ILE 7 Cb -0.20 -1.85 -0.02 0.00 0.01 0.00 0.00 42.46 40.41 1f9h s ILE 7 CO 0.20 0.55 -0.10 -0.83 0.00 0.00 0.00 174.94 174.75 1f9h s GLY 8 N 0.62 0.59 -0.17 6.18 0.00 -0.11 -1.31 107.32 113.12 1f9h s GLY 8 Ca -0.12 -0.68 -0.11 0.00 0.00 0.00 0.00 44.72 43.81 1f9h s GLY 8 CO 0.03 -0.67 0.43 -0.45 0.00 0.00 0.00 173.10 172.43 1f9h s SER 9 N -1.04 -0.52 -0.01 1.64 0.15 -0.52 -0.48 113.70 112.92 1f9h s SER 9 Ca -0.02 0.91 0.02 0.00 0.70 0.00 0.00 55.95 57.57 1f9h s SER 9 Cb -0.07 0.83 0.03 0.00 -1.71 0.00 0.00 66.02 65.10 1f9h s SER 9 CO 0.01 -0.18 0.81 -0.46 1.20 0.00 0.00 173.24 174.61 1f9h n ASN 10 N 3.88 0.47 -4.22 5.45 6.94 -0.35 -0.52 115.26 126.91 1f9h n ASN 10 Ca -0.21 -1.69 -0.17 0.00 -0.02 0.00 0.00 54.58 52.50 1f9h n ASN 10 Cb 0.56 -0.12 -0.11 0.00 -2.36 0.00 0.00 39.78 37.75 1f9h n ASN 10 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 1f9h s LEU 11 N -0.41 2.41 -1.26 -4.53 1.43 -1.12 -4.52 118.68 110.69 1f9h s LEU 11 Ca 0.03 -0.82 -0.02 0.00 -1.03 0.00 0.00 54.13 52.29 1f9h s LEU 11 Cb 0.03 -0.46 0.01 0.00 0.03 0.00 0.00 46.19 45.79 1f9h s LEU 11 CO 0.00 -0.19 0.97 0.00 0.23 0.00 0.00 176.35 177.36 1f9h n ALA 12 N 0.49 -1.89 -2.61 4.21 0.00 -1.26 -3.94 120.51 115.52 1f9h n ALA 12 Ca -0.15 -0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.22 1f9h n ALA 12 Cb 0.57 -2.86 0.01 0.00 0.00 0.00 0.00 19.45 17.17 1f9h n ALA 12 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1f9h n SER 13 N -3.09 -6.87 -0.22 0.00 7.64 -1.26 -4.62 113.62 105.20 1f9h n SER 13 Ca -0.24 0.41 0.18 0.00 1.01 0.00 0.00 58.87 60.23 1f9h n SER 13 Cb 0.65 -4.60 0.51 0.00 -1.01 0.00 0.00 64.21 59.76 1f9h n SER 13 CO 0.00 0.00 0.00 -0.65 -3.01 0.00 0.00 175.04 171.38 1f9h h PRO 14 N 1.56 0.41 -0.50 1.43 0.11 -1.86 -1.24 132.00 131.91 1f9h h PRO 14 Ca 0.00 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 66.02 1f9h h PRO 14 Cb 0.83 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 31.83 1f9h h PRO 14 CO 0.17 0.27 0.06 1.25 -0.21 0.00 0.00 178.00 179.53 1f9h h LEU 15 N 0.42 0.81 -0.76 2.35 5.85 -1.93 0.99 115.31 123.04 1f9h h LEU 15 Ca 0.44 -0.27 -0.02 0.00 0.84 0.00 0.00 57.88 58.86 1f9h h LEU 15 Cb 1.06 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.84 1f9h h LEU 15 CO -0.16 0.88 0.38 -0.33 -0.34 0.00 0.00 178.44 178.87 1f9h h GLU 16 N 0.71 1.08 -0.54 1.25 5.08 -1.59 -1.30 114.58 119.27 1f9h h GLU 16 Ca 0.15 -0.15 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1f9h h GLU 16 Cb 0.43 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.46 1f9h h GLU 16 CO 0.01 0.83 0.32 1.96 -1.00 0.00 0.00 179.01 181.14 1f9h h GLN 17 N 1.06 0.73 -0.20 2.33 1.08 -0.83 -0.59 115.11 118.69 1f9h h GLN 17 Ca 0.26 -0.07 -0.16 0.00 -1.45 0.00 0.00 58.65 57.23 1f9h h GLN 17 Cb 0.10 -0.15 -0.01 0.00 -0.05 0.00 0.00 27.48 27.37 1f9h h GLN 17 CO -0.04 0.53 -0.55 0.28 -0.95 0.00 0.00 178.83 178.11 1f9h h VAL 18 N 0.72 1.32 -0.70 -0.54 2.07 -0.54 0.03 116.25 118.61 1f9h h VAL 18 Ca 0.19 -1.79 -0.01 0.00 0.82 0.00 0.00 66.70 65.91 1f9h h VAL 18 Cb -0.01 1.75 -0.03 0.00 -1.52 0.00 0.00 31.29 31.48 1f9h h VAL 18 CO -0.04 0.56 0.40 0.78 0.02 0.00 0.00 177.57 179.29 1f9h h ASN 19 N 0.45 0.86 -0.77 0.57 2.35 -1.13 -0.85 115.58 117.06 1f9h h ASN 19 Ca 0.01 -0.08 -0.04 0.00 -0.55 0.00 0.00 56.30 55.64 1f9h h ASN 19 Cb 1.10 -0.22 -0.04 0.00 0.05 0.00 0.00 38.32 39.22 1f9h h ASN 19 CO 0.11 0.69 0.33 0.00 -1.65 0.00 0.00 177.43 176.90 1f9h h ALA 20 N 1.20 1.11 -0.69 -0.83 0.00 -0.88 -2.36 119.26 116.82 1f9h h ALA 20 Ca 0.25 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 1f9h h ALA 20 Cb 0.01 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.46 1f9h h ALA 20 CO -0.04 0.64 0.15 0.00 0.00 0.00 0.00 179.25 180.00 1f9h h ALA 21 N 1.23 0.91 -0.73 0.00 0.00 -0.58 -1.37 119.26 118.72 1f9h h ALA 21 Ca 0.26 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 1f9h h ALA 21 Cb 0.18 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 1f9h h ALA 21 CO -0.03 0.64 0.33 -0.07 0.00 0.00 0.00 179.25 180.13 1f9h h LEU 22 N 1.04 0.98 -0.36 0.00 3.38 -0.92 0.18 115.31 119.61 1f9h h LEU 22 Ca 0.21 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 1f9h h LEU 22 Cb 0.40 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 1f9h h LEU 22 CO 0.01 0.85 0.20 0.50 0.09 0.00 0.00 178.44 180.09 1f9h h LYS 23 N 1.04 0.49 -0.54 1.13 3.64 -1.17 -2.12 116.57 119.04 1f9h h LYS 23 Ca 0.25 -0.05 -0.10 0.00 -1.27 0.00 0.00 60.65 59.48 1f9h h LYS 23 Cb 0.15 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 31.85 1f9h h LYS 23 CO -0.03 0.40 -0.06 0.00 -2.27 0.00 0.00 179.45 177.49 1f9h h ALA 24 N 1.07 0.87 -1.00 5.00 0.00 -0.91 -2.37 119.26 121.92 1f9h h ALA 24 Ca 0.13 -0.32 0.09 0.00 0.00 0.00 0.00 54.91 54.80 1f9h h ALA 24 Cb 0.04 -0.20 -0.07 0.00 0.00 0.00 0.00 17.79 17.55 1f9h h ALA 24 CO -0.02 0.65 0.64 -0.07 0.00 0.00 0.00 179.25 180.45 1f9h h LEU 25 N 0.88 1.00 -0.28 0.00 3.38 -0.48 -1.29 115.31 118.52 1f9h h LEU 25 Ca 0.15 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.14 1f9h h LEU 25 Cb 0.60 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.16 1f9h h LEU 25 CO 0.04 0.60 0.00 0.61 0.09 0.00 0.00 178.44 179.77 1f9h n GLY 26 N -1.36 -1.15 0.62 0.83 0.00 -0.81 -2.37 105.19 100.95 1f9h n GLY 26 Ca 0.17 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.31 1f9h n GLY 26 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1f9h n ASP 27 N -1.82 2.20 -4.73 1.61 8.00 -0.51 -4.84 116.55 116.47 1f9h n ASP 27 Ca 0.03 -1.61 -0.42 0.00 0.71 0.00 0.00 54.79 53.51 1f9h n ASP 27 Cb 0.21 0.25 -0.03 0.00 -0.02 0.00 0.00 41.12 41.53 1f9h n ASP 27 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1f9h s ILE 28 N -2.29 2.82 0.72 0.53 1.01 -1.00 -4.96 121.20 118.03 1f9h s ILE 28 Ca 0.24 0.62 -0.15 0.00 0.00 0.00 0.00 60.65 61.36 1f9h s ILE 28 Cb 0.19 -3.39 0.03 0.00 0.01 0.00 0.00 42.46 39.30 1f9h s ILE 28 CO 0.46 0.06 1.18 -2.84 0.00 0.00 0.00 174.94 173.81 1f9h s PRO 29 N 0.65 2.25 -1.57 2.79 0.02 -1.26 -3.33 135.00 134.54 1f9h s PRO 29 Ca 0.65 1.66 -0.00 0.00 0.02 0.00 0.00 61.00 63.32 1f9h s PRO 29 Cb -0.41 -1.86 0.00 0.00 0.02 0.00 0.00 34.50 32.25 1f9h s PRO 29 CO 0.35 -1.73 0.02 0.39 -0.33 0.00 0.00 177.00 175.70 1f9h n GLU 30 N -2.72 -1.94 -3.84 5.54 -0.58 -1.26 -4.82 120.64 111.03 1f9h n GLU 30 Ca 0.13 0.89 -0.09 0.00 -0.42 0.00 0.00 57.16 57.66 1f9h n GLU 30 Cb 0.51 -5.54 -0.07 0.00 -0.57 0.00 0.00 31.44 25.76 1f9h n GLU 30 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 1f9h s SER 31 N -2.07 0.08 -0.12 1.62 0.01 -1.21 -1.33 113.70 110.68 1f9h s SER 31 Ca 0.01 -0.58 -0.25 0.00 1.31 0.00 0.00 55.95 56.44 1f9h s SER 31 Cb -0.01 0.34 0.06 0.00 0.21 0.00 0.00 66.02 66.63 1f9h s SER 31 CO 0.01 -0.72 0.61 -1.38 0.41 0.00 0.00 173.24 172.18 1f9h s HIS 32 N -3.69 -0.61 0.22 2.43 -3.43 0.10 -4.83 115.29 105.48 1f9h s HIS 32 Ca 0.03 1.25 -0.30 0.00 -0.80 0.00 0.00 55.06 55.24 1f9h s HIS 32 Cb 0.04 0.30 -0.09 0.00 -1.43 0.00 0.00 32.58 31.39 1f9h s HIS 32 CO -0.10 -0.47 1.32 0.42 -2.00 0.00 0.00 174.74 173.91 1f9h s ILE 33 N -0.58 3.11 -0.28 -5.38 1.01 -1.26 -0.35 121.20 117.47 1f9h s ILE 33 Ca -0.07 0.93 -0.12 0.00 0.00 0.00 0.00 60.65 61.40 1f9h s ILE 33 Cb -0.03 -3.60 -0.13 0.00 0.01 0.00 0.00 42.46 38.72 1f9h s ILE 33 CO 0.05 0.15 -0.33 0.18 0.00 0.00 0.00 174.94 174.99 1f9h n LEU 34 N 2.37 2.09 -3.75 2.97 4.77 0.76 -4.87 117.00 121.34 1f9h n LEU 34 Ca 0.05 0.28 -0.13 0.00 -0.03 0.00 0.00 56.01 56.18 1f9h n LEU 34 Cb 0.42 -0.83 -0.10 0.00 -2.33 0.00 0.00 43.42 40.58 1f9h n LEU 34 CO 0.58 0.62 0.02 -0.89 -1.33 0.00 0.00 177.39 176.39 1f9h s THR 35 N -2.51 0.01 0.03 -5.08 2.01 -1.17 -4.99 115.64 103.94 1f9h s THR 35 Ca -0.38 -0.05 0.08 0.00 0.31 0.00 0.00 61.69 61.65 1f9h s THR 35 Cb 0.14 -0.50 -0.02 0.00 0.01 0.00 0.00 72.50 72.13 1f9h s THR 35 CO 0.51 -0.03 -0.23 -0.69 -0.69 0.00 0.00 174.62 173.49 1f9h s VAL 36 N 0.03 1.86 0.89 3.82 1.01 -1.26 -0.92 120.40 125.83 1f9h s VAL 36 Ca -0.01 -1.21 -0.13 0.00 0.00 0.00 0.00 61.98 60.63 1f9h s VAL 36 Cb -0.03 -1.59 0.16 0.00 0.00 0.00 0.00 36.38 34.92 1f9h s VAL 36 CO 0.01 0.34 1.24 -0.94 0.00 0.00 0.00 175.10 175.75 1f9h s SER 37 N -1.04 3.60 1.02 3.32 1.04 -0.20 -4.93 113.70 116.52 1f9h s SER 37 Ca 0.09 0.29 -0.13 0.00 0.48 0.00 0.00 55.95 56.68 1f9h s SER 37 Cb -0.09 -0.48 0.20 0.00 0.10 0.00 0.00 66.02 65.75 1f9h s SER 37 CO 0.01 -2.42 1.10 -0.44 0.98 0.00 0.00 173.24 172.47 1f9h s SER 38 N -4.80 2.42 -0.17 7.02 0.01 -1.26 -4.83 113.70 112.09 1f9h s SER 38 Ca 0.70 1.08 -0.07 0.00 1.31 0.00 0.00 55.95 58.97 1f9h s SER 38 Cb -0.06 -1.68 -0.04 0.00 0.21 0.00 0.00 66.02 64.45 1f9h s SER 38 CO 0.51 -3.24 0.06 -0.36 0.41 0.00 0.00 173.24 170.61 1f9h s PHE 39 N -3.01 3.26 0.04 2.43 0.08 -1.26 -4.56 117.98 114.96 1f9h s PHE 39 Ca 0.66 0.10 0.08 0.00 0.12 0.00 0.00 56.93 57.90 1f9h s PHE 39 Cb -0.17 -2.05 -0.03 0.00 -0.57 0.00 0.00 43.02 40.20 1f9h s PHE 39 CO 0.57 0.21 -0.24 0.71 -0.10 0.00 0.00 175.22 176.38 1f9h s TYR 40 N 0.19 2.07 -0.31 0.36 2.02 -0.68 -0.55 117.35 120.45 1f9h s TYR 40 Ca 0.04 -0.39 -0.12 0.00 -0.37 0.00 0.00 57.07 56.23 1f9h s TYR 40 Cb -0.12 -1.25 -0.03 0.00 -0.40 0.00 0.00 41.96 40.16 1f9h s TYR 40 CO 0.00 0.09 0.23 0.50 -1.57 0.00 0.00 175.55 174.81 1f9h s ARG 41 N -1.14 3.74 0.01 -0.62 3.52 -0.16 -0.83 118.95 123.47 1f9h s ARG 41 Ca 0.10 -0.44 0.06 0.00 -0.13 0.00 0.00 55.73 55.31 1f9h s ARG 41 Cb -0.09 -3.73 -0.02 0.00 -1.56 0.00 0.00 34.95 29.55 1f9h s ARG 41 CO 0.02 -0.32 -0.17 0.95 -0.81 0.00 0.00 175.30 174.97 1f9h s THR 42 N 1.78 1.36 0.47 4.11 -4.23 0.01 -4.28 115.64 114.86 1f9h s THR 42 Ca 0.07 -0.85 -0.23 0.00 -1.18 0.00 0.00 61.69 59.50 1f9h s THR 42 Cb -0.17 -1.16 -0.07 0.00 1.34 0.00 0.00 72.50 72.44 1f9h s THR 42 CO 0.11 0.29 1.18 -2.84 -0.54 0.00 0.00 174.62 172.82 1f9h s PRO 43 N -0.65 3.68 0.28 3.99 0.02 -1.26 -1.04 135.00 140.01 1f9h s PRO 43 Ca 0.06 1.81 -0.29 0.00 0.02 0.00 0.00 61.00 62.60 1f9h s PRO 43 Cb -0.07 -2.38 -0.10 0.00 0.02 0.00 0.00 34.50 31.97 1f9h s PRO 43 CO 0.00 -0.62 1.36 -1.25 -0.33 0.00 0.00 177.00 176.15 1f9h s PRO 44 N -2.74 4.33 -0.15 5.54 0.04 -1.26 -4.83 135.00 135.93 1f9h s PRO 44 Ca 0.65 2.22 -0.24 0.00 0.04 0.00 0.00 61.00 63.67 1f9h s PRO 44 Cb -0.29 -3.11 -0.02 0.00 0.04 0.00 0.00 34.50 31.12 1f9h s PRO 44 CO 0.36 -0.29 0.77 -1.17 0.04 0.00 0.00 177.00 176.71 1f9h s LEU 45 N -0.97 4.20 0.00 -3.56 2.96 -1.26 -4.85 118.68 115.20 1f9h s LEU 45 Ca 0.54 1.12 0.00 0.00 -0.22 0.00 0.00 54.13 55.57 1f9h s LEU 45 Cb -0.40 -3.15 0.00 0.00 0.50 0.00 0.00 46.19 43.14 1f9h s LEU 45 CO 0.47 -0.32 0.00 0.61 -1.32 0.00 0.00 176.35 175.79 1f9h n GLY 46 N 3.45 0.64 3.72 7.98 0.00 -1.26 -4.92 105.19 114.80 1f9h n GLY 46 Ca 0.02 -1.69 -0.42 0.00 0.00 0.00 0.00 46.02 43.93 1f9h n GLY 46 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1f9h n PRO 47 N 0.00 2.33 -0.04 1.61 -0.02 -1.26 -4.90 135.00 132.72 1f9h n PRO 47 Ca 0.00 0.82 0.12 0.00 -2.02 0.00 0.00 63.50 62.42 1f9h n PRO 47 Cb 0.00 -2.47 0.18 0.00 -0.02 0.00 0.00 33.50 31.19 1f9h n PRO 47 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1f9h n GLN 48 N 0.72 2.28 -1.51 -0.52 1.13 -1.26 -4.27 117.38 113.96 1f9h n GLN 48 Ca 0.04 -1.88 -0.27 0.00 -1.94 0.00 0.00 57.00 52.95 1f9h n GLN 48 Cb 0.37 -1.47 -0.06 0.00 0.11 0.00 0.00 30.24 29.19 1f9h n GLN 48 CO 0.00 0.00 0.00 -0.40 -1.44 0.00 0.00 177.06 175.22 1f9h n ASP 49 N 1.22 6.52 -3.71 1.08 5.75 -1.26 -4.87 116.55 121.27 1f9h n ASP 49 Ca 0.16 -3.19 -0.11 0.00 -0.01 0.00 0.00 54.79 51.64 1f9h n ASP 49 Cb 0.57 -1.24 -0.06 0.00 -1.03 0.00 0.00 41.12 39.35 1f9h n ASP 49 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1f9h s GLN 50 N -1.64 0.94 0.85 0.11 -2.07 -1.26 -5.00 119.66 111.59 1f9h s GLN 50 Ca 0.59 -0.67 -0.12 0.00 -1.82 0.00 0.00 55.36 53.34 1f9h s GLN 50 Cb 0.37 0.41 0.10 0.00 -1.09 0.00 0.00 33.01 32.80 1f9h s GLN 50 CO -0.21 -0.33 1.10 -2.14 -1.32 0.00 0.00 175.29 172.38 1f9h s PRO 51 N -3.37 1.61 0.56 9.60 0.02 -1.26 -4.83 135.00 137.34 1f9h s PRO 51 Ca 0.01 0.68 -0.21 0.00 0.02 0.00 0.00 61.00 61.50 1f9h s PRO 51 Cb 0.02 -1.86 -0.04 0.00 0.02 0.00 0.00 34.50 32.63 1f9h s PRO 51 CO -0.09 -1.96 1.29 -0.51 -0.33 0.00 0.00 177.00 175.41 1f9h s ASP 52 N -3.71 5.24 0.26 2.53 1.01 -1.26 -4.51 116.67 116.22 1f9h s ASP 52 Ca 0.62 2.60 -0.09 0.00 0.71 0.00 0.00 52.55 56.39 1f9h s ASP 52 Cb -0.16 -2.62 -0.07 0.00 1.01 0.00 0.00 42.92 41.08 1f9h s ASP 52 CO 0.55 -1.58 0.57 -0.31 0.21 0.00 0.00 175.17 174.62 1f9h s TYR 53 N -1.41 3.43 -0.20 4.23 1.51 -0.21 -4.57 117.35 120.13 1f9h s TYR 53 Ca 0.74 0.86 -0.18 0.00 -1.01 0.00 0.00 57.07 57.48 1f9h s TYR 53 Cb -0.36 -2.26 -0.03 0.00 -0.11 0.00 0.00 41.96 39.20 1f9h s TYR 53 CO 0.41 0.22 0.49 -1.17 -1.11 0.00 0.00 175.55 174.39 1f9h s LEU 54 N -3.02 4.14 0.03 -1.29 0.20 0.32 -0.81 118.68 118.25 1f9h s LEU 54 Ca 0.47 0.63 0.09 0.00 0.69 0.00 0.00 54.13 56.01 1f9h s LEU 54 Cb -0.11 -2.66 -0.03 0.00 -0.43 0.00 0.00 46.19 42.97 1f9h s LEU 54 CO 0.23 -0.16 -0.26 0.20 -0.29 0.00 0.00 176.35 176.07 1f9h s ASN 55 N 1.15 3.09 0.28 3.68 -0.87 -0.01 -1.44 114.94 120.82 1f9h s ASN 55 Ca 0.23 -0.56 -0.12 0.00 -1.57 0.00 0.00 52.86 50.84 1f9h s ASN 55 Cb -0.15 -0.29 0.01 0.00 -0.02 0.00 0.00 41.25 40.79 1f9h s ASN 55 CO 0.09 0.27 0.54 0.00 -2.57 0.00 0.00 177.10 175.43 1f9h s ALA 56 N -0.76 -0.22 0.02 0.60 0.00 -0.43 -1.69 121.76 119.28 1f9h s ALA 56 Ca 0.11 -0.92 -0.00 0.00 0.00 0.00 0.00 51.96 51.15 1f9h s ALA 56 Cb -0.10 1.01 -0.02 0.00 0.00 0.00 0.00 23.12 24.02 1f9h s ALA 56 CO 0.01 -0.88 -0.02 0.00 0.00 0.00 0.00 175.76 174.87 1f9h s ALA 57 N -3.63 0.10 0.01 0.00 0.00 -1.26 -0.94 121.76 116.04 1f9h s ALA 57 Ca 0.22 -0.56 0.03 0.00 0.00 0.00 0.00 51.96 51.64 1f9h s ALA 57 Cb -0.02 0.15 -0.01 0.00 0.00 0.00 0.00 23.12 23.24 1f9h s ALA 57 CO 0.11 -0.16 -0.10 0.08 0.00 0.00 0.00 175.76 175.69 1f9h s VAL 58 N -1.45 0.76 -0.23 0.00 1.01 -0.14 -1.03 120.40 119.31 1f9h s VAL 58 Ca -0.16 -0.56 -0.12 0.00 0.00 0.00 0.00 61.98 61.13 1f9h s VAL 58 Cb -0.10 -0.67 -0.05 0.00 0.00 0.00 0.00 36.38 35.57 1f9h s VAL 58 CO -0.01 0.10 0.24 0.00 0.00 0.00 0.00 175.10 175.44 1f9h s ALA 59 N -0.45 3.59 -0.16 5.51 0.00 -0.09 -0.88 121.76 129.27 1f9h s ALA 59 Ca 0.02 -0.78 0.00 0.00 0.00 0.00 0.00 51.96 51.20 1f9h s ALA 59 Cb -0.05 -2.44 0.03 0.00 0.00 0.00 0.00 23.12 20.67 1f9h s ALA 59 CO 0.00 -0.25 -0.11 -1.17 0.00 0.00 0.00 175.76 174.24 1f9h s LEU 60 N 1.18 1.81 0.04 0.00 2.96 0.71 -0.17 118.68 125.21 1f9h s LEU 60 Ca 0.11 -0.63 -0.30 0.00 -0.22 0.00 0.00 54.13 53.09 1f9h s LEU 60 Cb -0.14 -1.11 -0.04 0.00 0.50 0.00 0.00 46.19 45.39 1f9h s LEU 60 CO 0.06 -0.11 1.08 -0.70 -1.32 0.00 0.00 176.35 175.35 1f9h s GLU 61 N 1.51 4.51 -0.02 1.98 2.56 0.52 0.00 118.70 129.77 1f9h s GLU 61 Ca 0.02 1.58 -0.15 0.00 0.00 0.00 0.00 54.97 56.43 1f9h s GLU 61 Cb -0.14 -3.40 0.02 0.00 2.00 0.00 0.00 34.13 32.61 1f9h s GLU 61 CO -0.09 -0.12 0.31 -0.08 -0.56 0.00 0.00 175.26 174.72 1f9h s THR 62 N 0.93 0.06 -2.13 -1.70 -1.32 -0.09 -0.72 115.64 110.67 1f9h s THR 62 Ca 0.55 -0.46 0.19 0.00 -1.21 0.00 0.00 61.69 60.76 1f9h s THR 62 Cb -0.25 -0.62 0.31 0.00 -1.51 0.00 0.00 72.50 70.44 1f9h s THR 62 CO 0.29 -0.25 1.26 -1.20 -2.21 0.00 0.00 174.62 172.50 1f9h n SER 63 N 1.29 3.05 -4.78 8.08 7.64 -0.44 -1.43 113.62 127.03 1f9h n SER 63 Ca -0.21 -1.89 -0.33 0.00 1.01 0.00 0.00 58.87 57.44 1f9h n SER 63 Cb 0.56 -0.17 0.02 0.00 -1.01 0.00 0.00 64.21 63.62 1f9h n SER 63 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1f9h s LEU 64 N -1.38 3.51 0.57 -3.43 1.43 -1.26 -5.01 118.68 113.11 1f9h s LEU 64 Ca 0.30 1.96 -0.19 0.00 -1.03 0.00 0.00 54.13 55.17 1f9h s LEU 64 Cb 0.18 -4.55 -0.05 0.00 0.03 0.00 0.00 46.19 41.81 1f9h s LEU 64 CO 0.26 -1.35 1.16 0.00 0.23 0.00 0.00 176.35 176.65 1f9h s ALA 65 N -2.27 2.62 0.25 4.21 0.00 -1.26 -4.81 121.76 120.50 1f9h s ALA 65 Ca 0.67 0.90 -0.03 0.00 0.00 0.00 0.00 51.96 53.50 1f9h s ALA 65 Cb -0.19 -3.40 0.46 0.00 0.00 0.00 0.00 23.12 19.99 1f9h s ALA 65 CO 0.36 -0.97 1.79 -1.35 0.00 0.00 0.00 175.76 175.60 1f9h h PRO 66 N 1.01 0.72 0.00 0.00 0.11 -1.99 -0.53 132.00 131.32 1f9h h PRO 66 Ca -0.50 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 65.48 1f9h h PRO 66 Cb 1.28 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 1f9h h PRO 66 CO 0.56 0.48 -0.43 1.49 -0.21 0.00 0.00 178.00 179.88 1f9h h GLU 67 N 0.74 0.00 -0.31 1.05 4.81 -1.99 -0.68 114.58 118.20 1f9h h GLU 67 Ca 0.43 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 59.51 1f9h h GLU 67 Cb 0.48 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.85 1f9h h GLU 67 CO -0.29 0.43 -0.42 0.93 -0.73 0.00 0.00 179.01 178.93 1f9h h GLU 68 N 0.00 0.76 -0.56 1.92 4.39 -1.60 -0.45 114.58 119.04 1f9h h GLU 68 Ca -0.00 -0.41 -0.02 0.00 0.34 0.00 0.00 59.36 59.27 1f9h h GLU 68 Cb 0.81 0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 29.46 1f9h h GLU 68 CO 0.06 1.03 0.29 1.25 -1.16 0.00 0.00 179.01 180.48 1f9h h LEU 69 N 0.62 0.72 -0.90 1.33 5.85 -0.73 -2.28 115.31 119.91 1f9h h LEU 69 Ca 0.05 -0.11 0.06 0.00 0.84 0.00 0.00 57.88 58.71 1f9h h LEU 69 Cb 0.98 -0.18 -0.06 0.00 0.37 0.00 0.00 40.66 41.76 1f9h h LEU 69 CO 0.09 0.63 0.57 0.25 -0.34 0.00 0.00 178.44 179.64 1f9h h LEU 70 N 0.76 0.90 -0.88 2.25 5.85 -0.89 1.00 115.31 124.30 1f9h h LEU 70 Ca 0.20 0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.99 1f9h h LEU 70 Cb 0.09 -0.18 -0.06 0.00 0.37 0.00 0.00 40.66 40.88 1f9h h LEU 70 CO -0.03 0.58 0.55 0.78 -0.34 0.00 0.00 178.44 179.98 1f9h h ASN 71 N 1.04 0.87 -0.20 1.25 2.35 -0.67 0.60 115.58 120.82 1f9h h ASN 71 Ca 0.39 0.01 -0.19 0.00 -0.55 0.00 0.00 56.30 55.96 1f9h h ASN 71 Cb 0.17 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 38.37 1f9h h ASN 71 CO -0.17 0.56 -0.62 0.45 -1.65 0.00 0.00 177.43 176.00 1f9h h HIS 72 N 1.00 1.04 -0.42 1.19 3.86 -0.71 -1.20 115.15 119.91 1f9h h HIS 72 Ca 0.38 -0.39 -0.09 0.00 -1.16 0.00 0.00 60.37 59.11 1f9h h HIS 72 Cb 0.16 -0.18 -0.02 0.00 1.06 0.00 0.00 27.41 28.43 1f9h h HIS 72 CO -0.03 1.22 -0.10 1.79 0.86 0.00 0.00 177.93 181.66 1f9h h THR 73 N 0.60 1.25 -0.28 2.45 1.35 -0.46 -2.09 112.91 115.74 1f9h h THR 73 Ca -0.01 -1.14 -0.10 0.00 -0.55 0.00 0.00 66.41 64.62 1f9h h THR 73 Cb 1.22 1.05 -0.01 0.00 -1.73 0.00 0.00 68.15 68.68 1f9h h THR 73 CO 0.13 0.39 -0.26 1.56 -0.25 0.00 0.00 175.52 177.08 1f9h h GLN 74 N 0.67 0.54 -0.69 4.72 4.20 -0.83 -1.84 115.11 121.89 1f9h h GLN 74 Ca 0.12 -0.21 -0.03 0.00 0.06 0.00 0.00 58.65 58.58 1f9h h GLN 74 Cb 0.56 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.29 1f9h h GLN 74 CO 0.04 0.76 0.32 -0.09 -0.67 0.00 0.00 178.83 179.18 1f9h h ARG 75 N 0.48 1.00 -0.86 1.46 2.43 -0.94 -2.19 114.38 115.75 1f9h h ARG 75 Ca 0.07 -0.16 -0.02 0.00 -0.81 0.00 0.00 59.98 59.06 1f9h h ARG 75 Cb 0.71 -0.18 -0.04 0.00 -0.42 0.00 0.00 29.97 30.04 1f9h h ARG 75 CO 0.05 0.80 0.45 0.82 -1.51 0.00 0.00 179.97 180.58 1f9h h ILE 76 N 0.96 1.26 -0.46 1.20 2.04 -0.90 0.61 117.51 122.22 1f9h h ILE 76 Ca 0.23 -0.68 0.07 0.00 1.00 0.00 0.00 64.86 65.49 1f9h h ILE 76 Cb 0.14 0.12 -0.06 0.00 -0.74 0.00 0.00 36.82 36.27 1f9h h ILE 76 CO -0.03 0.30 0.09 -0.33 0.00 0.00 0.00 178.15 178.19 1f9h h GLU 77 N 1.22 0.22 -0.13 2.37 5.08 -1.06 -1.54 114.58 120.74 1f9h h GLU 77 Ca 0.30 -0.01 -0.11 0.00 -1.00 0.00 0.00 59.36 58.53 1f9h h GLU 77 Cb 0.07 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 1f9h h GLU 77 CO -0.04 0.15 -0.42 -0.07 -1.00 0.00 0.00 179.01 177.62 1f9h h LEU 78 N 0.23 0.31 -1.71 1.33 3.38 -0.83 -1.57 115.31 116.46 1f9h h LEU 78 Ca 0.23 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1f9h h LEU 78 Cb 0.29 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.95 1f9h h LEU 78 CO -0.29 0.70 0.00 1.56 0.09 0.00 0.00 178.44 180.50 1f9h h GLN 79 N 0.25 0.00 -0.61 1.13 4.20 -0.18 -1.87 115.11 118.03 1f9h h GLN 79 Ca 0.02 0.00 -0.20 0.00 0.06 0.00 0.00 58.65 58.53 1f9h h GLN 79 Cb 0.85 0.00 -0.12 0.00 0.30 0.00 0.00 27.48 28.51 1f9h h GLN 79 CO 0.07 0.00 0.20 1.04 -0.67 0.00 0.00 178.83 179.47 1f9h n GLN 80 N -2.89 3.15 -0.98 1.46 6.02 -0.65 -4.96 117.38 118.52 1f9h n GLN 80 Ca -0.00 -3.06 0.00 0.00 -0.01 0.00 0.00 57.00 53.93 1f9h n GLN 80 Cb 0.22 -2.08 0.00 0.00 1.02 0.00 0.00 30.24 29.39 1f9h n GLN 80 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1f9h n GLY 81 N -0.47 0.46 3.74 1.08 0.00 -0.70 -4.61 105.19 104.68 1f9h n GLY 81 Ca 0.38 -0.48 -0.42 0.00 0.00 0.00 0.00 46.02 45.50 1f9h n GLY 81 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1f9h s ARG 82 N -0.89 4.16 0.17 1.61 6.06 -0.68 -4.80 118.95 124.58 1f9h s ARG 82 Ca 0.00 2.51 0.10 0.00 -2.50 0.00 0.00 55.73 55.84 1f9h s ARG 82 Cb 0.00 -3.06 -0.04 0.00 0.06 0.00 0.00 34.95 31.91 1f9h s ARG 82 CO 0.00 -0.61 -0.21 0.14 -2.50 0.00 0.00 175.30 172.12 1f9h s VAL 83 N 0.31 2.00 -0.01 7.11 -7.23 -1.26 -4.78 120.40 116.54 1f9h s VAL 83 Ca 0.65 -1.92 0.06 0.00 -1.81 0.00 0.00 61.98 58.97 1f9h s VAL 83 Cb -0.47 -1.92 -0.02 0.00 0.56 0.00 0.00 36.38 34.54 1f9h s VAL 83 CO 0.43 -0.21 -0.20 -0.13 -0.31 0.00 0.00 175.10 174.67 1f9h s ARG 84 N -2.65 1.63 0.45 4.82 0.52 -1.26 -4.88 118.95 117.57 1f9h s ARG 84 Ca 0.17 -0.75 0.03 0.00 -0.52 0.00 0.00 55.73 54.65 1f9h s ARG 84 Cb -0.07 -1.59 -0.02 0.00 0.52 0.00 0.00 34.95 33.79 1f9h s ARG 84 CO 0.07 0.43 0.06 0.15 0.02 0.00 0.00 175.30 176.04 1f9h s LYS 85 N -0.55 2.04 0.25 3.54 1.02 -1.26 -5.05 119.74 119.72 1f9h s LYS 85 Ca 0.08 -2.26 -0.04 0.00 0.02 0.00 0.00 55.97 53.77 1f9h s LYS 85 Cb -0.08 -1.08 0.28 0.00 -0.52 0.00 0.00 37.83 36.43 1f9h s LYS 85 CO -0.01 -0.39 1.77 0.00 -0.92 0.00 0.00 175.35 175.80 1f9h h ALA 86 N 1.61 1.09 -2.50 5.17 0.00 -2.04 -3.43 119.26 119.16 1f9h h ALA 86 Ca -0.40 -0.24 -0.53 0.00 0.00 0.00 0.00 54.91 53.74 1f9h h ALA 86 Cb 1.29 -0.23 0.02 0.00 0.00 0.00 0.00 17.79 18.87 1f9h h ALA 86 CO 0.66 0.60 0.84 -2.00 0.00 0.00 0.00 179.25 179.35 1f9h s GLU 87 N -5.20 4.27 0.31 0.00 2.12 -1.26 -4.93 118.70 114.01 1f9h s GLU 87 Ca -0.11 2.16 -0.29 0.00 0.36 0.00 0.00 54.97 57.09 1f9h s GLU 87 Cb 0.15 -3.38 -0.10 0.00 0.26 0.00 0.00 34.13 31.06 1f9h s GLU 87 CO 0.82 -0.56 1.30 0.50 -0.54 0.00 0.00 175.26 176.78 1f9h s ARG 88 N 1.74 4.37 -1.47 4.30 3.52 -1.26 -3.30 118.95 126.85 1f9h s ARG 88 Ca 0.67 2.18 -0.01 0.00 -0.13 0.00 0.00 55.73 58.44 1f9h s ARG 88 Cb -0.38 -3.09 0.00 0.00 -1.56 0.00 0.00 34.95 29.92 1f9h s ARG 88 CO 0.30 -0.18 0.14 0.91 -0.81 0.00 0.00 175.30 175.66 1f9h n TRP 89 N 1.12 -1.08 -1.17 5.12 8.01 -1.26 -4.63 117.44 123.55 1f9h n TRP 89 Ca 0.01 0.12 -0.29 0.00 -1.31 0.00 0.00 57.50 56.03 1f9h n TRP 89 Cb 0.42 -3.66 0.20 0.00 -2.01 0.00 0.00 31.31 26.26 1f9h n TRP 89 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1f9h s GLY 90 N -2.35 1.57 0.94 6.99 0.00 -1.21 -4.32 107.32 108.94 1f9h s GLY 90 Ca 0.07 -0.64 -0.12 0.00 0.00 0.00 0.00 44.72 44.03 1f9h s GLY 90 CO 0.09 0.09 1.10 2.56 0.00 0.00 0.00 173.10 176.93 1f9h s PRO 91 N -5.18 0.91 -0.17 2.90 0.04 -1.26 -5.09 135.00 127.15 1f9h s PRO 91 Ca 0.68 0.60 -0.13 0.00 0.04 0.00 0.00 61.00 62.19 1f9h s PRO 91 Cb -0.15 -1.79 0.05 0.00 0.04 0.00 0.00 34.50 32.66 1f9h s PRO 91 CO 0.57 -2.43 0.44 0.00 0.04 0.00 0.00 177.00 175.62 1f9h s ALA 92 N -3.00 -1.12 0.29 8.56 0.00 -1.26 -4.94 121.76 120.29 1f9h s ALA 92 Ca 0.64 1.42 -0.02 0.00 0.00 0.00 0.00 51.96 53.99 1f9h s ALA 92 Cb -0.18 -0.84 0.42 0.00 0.00 0.00 0.00 23.12 22.52 1f9h s ALA 92 CO 0.57 -0.24 1.96 1.79 0.00 0.00 0.00 175.76 179.84 1f9h h THR 93 N 4.89 1.22 -2.27 0.00 1.35 -1.86 -0.88 112.91 115.36 1f9h h THR 93 Ca -0.31 -0.41 -0.04 0.00 -0.55 0.00 0.00 66.41 65.11 1f9h h THR 93 Cb 1.18 -0.01 -0.23 0.00 -1.73 0.00 0.00 68.15 67.36 1f9h h THR 93 CO 0.25 0.21 -0.12 -0.22 -0.25 0.00 0.00 175.52 175.40 1f9h s LEU 94 N -9.93 -0.59 -0.17 3.87 2.96 -1.26 -4.51 118.68 109.04 1f9h s LEU 94 Ca -0.12 1.26 0.00 0.00 -0.22 0.00 0.00 54.13 55.05 1f9h s LEU 94 Cb 0.18 1.95 0.04 0.00 0.50 0.00 0.00 46.19 48.85 1f9h s LEU 94 CO 0.80 -0.22 -0.08 -0.62 -1.32 0.00 0.00 176.35 174.90 1f9h s ASP 95 N 1.55 2.95 -0.30 3.68 2.15 0.37 -4.81 116.67 122.26 1f9h s ASP 95 Ca -0.10 -0.69 -0.05 0.00 0.43 0.00 0.00 52.55 52.14 1f9h s ASP 95 Cb -0.06 -1.04 0.03 0.00 -0.30 0.00 0.00 42.92 41.54 1f9h s ASP 95 CO -0.17 -0.15 0.04 -0.76 -0.17 0.00 0.00 175.17 173.96 1f9h s LEU 96 N 1.54 3.89 -0.08 -1.34 1.43 -1.26 -0.93 118.68 121.93 1f9h s LEU 96 Ca 0.01 -1.00 0.02 0.00 -1.03 0.00 0.00 54.13 52.14 1f9h s LEU 96 Cb -0.15 -1.80 -0.02 0.00 0.03 0.00 0.00 46.19 44.25 1f9h s LEU 96 CO -0.08 -0.24 -0.15 -1.81 0.23 0.00 0.00 176.35 174.30 1f9h s ASP 97 N 1.38 3.89 -0.47 2.29 1.01 -0.55 -4.90 116.67 119.33 1f9h s ASP 97 Ca -0.01 -0.29 -0.27 0.00 0.71 0.00 0.00 52.55 52.69 1f9h s ASP 97 Cb -0.18 -1.16 0.03 0.00 1.01 0.00 0.00 42.92 42.61 1f9h s ASP 97 CO 0.01 0.26 1.01 -0.63 0.21 0.00 0.00 175.17 176.03 1f9h s ILE 98 N -0.21 4.36 -0.07 0.77 1.01 -1.26 -0.23 121.20 125.56 1f9h s ILE 98 Ca 0.00 0.91 -0.22 0.00 0.00 0.00 0.00 60.65 61.34 1f9h s ILE 98 Cb -0.13 -4.51 -0.17 0.00 0.01 0.00 0.00 42.46 37.65 1f9h s ILE 98 CO 0.03 -0.93 0.81 0.24 0.00 0.00 0.00 174.94 175.10 1f9h h MET 99 N 9.16 -0.11 -3.84 2.79 2.86 -1.28 -3.34 114.93 121.18 1f9h h MET 99 Ca -0.24 0.01 -0.20 0.00 -2.06 0.00 0.00 59.70 57.21 1f9h h MET 99 Cb 1.07 0.02 -0.25 0.00 0.06 0.00 0.00 31.60 32.50 1f9h h MET 99 CO 1.07 0.43 -0.71 -0.51 1.06 0.00 0.00 176.91 178.25 1f9h s LEU 100 N -8.78 2.10 -0.48 1.22 1.43 -1.09 -0.85 118.68 112.24 1f9h s LEU 100 Ca -0.13 -0.22 0.04 0.00 -1.03 0.00 0.00 54.13 52.79 1f9h s LEU 100 Cb -0.00 0.04 0.12 0.00 0.03 0.00 0.00 46.19 46.38 1f9h s LEU 100 CO 0.51 -0.13 0.22 0.12 0.23 0.00 0.00 176.35 177.30 1f9h s PHE 101 N -0.63 3.14 0.00 0.29 2.19 -1.26 -0.71 117.98 121.00 1f9h s PHE 101 Ca -0.07 -3.05 0.00 0.00 0.33 0.00 0.00 56.93 54.14 1f9h s PHE 101 Cb -0.04 -2.73 0.00 0.00 -1.31 0.00 0.00 43.02 38.94 1f9h s PHE 101 CO -0.00 -0.79 0.00 0.41 1.83 0.00 0.00 175.22 176.67 1f9h n GLY 102 N 3.39 2.61 1.84 13.12 0.00 0.52 -1.04 105.19 125.63 1f9h n GLY 102 Ca 0.05 -0.30 0.07 0.00 0.00 0.00 0.00 46.02 45.84 1f9h n GLY 102 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1f9h n ASN 103 N 0.70 5.54 -4.82 1.61 5.15 -1.26 -4.93 115.26 117.24 1f9h n ASN 103 Ca 0.00 -2.87 -0.32 0.00 -0.60 0.00 0.00 54.58 50.79 1f9h n ASN 103 Cb 0.00 -0.67 -0.01 0.00 -0.53 0.00 0.00 39.78 38.57 1f9h n ASN 103 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 1f9h s GLU 104 N -2.64 3.62 -0.19 1.20 2.02 -0.20 -4.67 118.70 117.83 1f9h s GLU 104 Ca 0.53 1.08 -0.02 0.00 0.02 0.00 0.00 54.97 56.58 1f9h s GLU 104 Cb 0.40 -2.08 -0.00 0.00 0.10 0.00 0.00 34.13 32.54 1f9h s GLU 104 CO 0.16 -0.55 -0.09 0.08 0.02 0.00 0.00 175.26 174.87 1f9h s VAL 105 N -2.55 3.04 -0.10 2.63 1.01 -1.26 -4.29 120.40 118.88 1f9h s VAL 105 Ca 0.61 -0.62 0.03 0.00 0.00 0.00 0.00 61.98 62.00 1f9h s VAL 105 Cb -0.13 -2.34 0.01 0.00 0.00 0.00 0.00 36.38 33.92 1f9h s VAL 105 CO 0.35 0.47 -0.18 -0.63 0.00 0.00 0.00 175.10 175.11 1f9h s ILE 106 N 1.17 1.66 -0.44 2.22 1.01 -0.08 -4.99 121.20 121.75 1f9h s ILE 106 Ca 0.02 -0.77 0.02 0.00 0.00 0.00 0.00 60.65 59.92 1f9h s ILE 106 Cb -0.14 -1.48 0.13 0.00 0.01 0.00 0.00 42.46 40.98 1f9h s ILE 106 CO -0.03 0.47 0.23 0.20 0.00 0.00 0.00 174.94 175.82 1f9h s ASN 107 N 0.71 3.73 0.29 3.58 -0.87 -1.26 -1.26 114.94 119.86 1f9h s ASN 107 Ca -0.12 -2.62 0.02 0.00 -1.57 0.00 0.00 52.86 48.57 1f9h s ASN 107 Cb -0.16 -1.09 -0.05 0.00 -0.02 0.00 0.00 41.25 39.93 1f9h s ASN 107 CO 0.03 -0.27 0.10 0.42 -2.57 0.00 0.00 177.10 174.81 1f9h s THR 108 N 0.35 0.65 0.20 1.60 -4.23 -0.04 -5.03 115.64 109.13 1f9h s THR 108 Ca 0.17 -2.00 -0.11 0.00 -1.18 0.00 0.00 61.69 58.57 1f9h s THR 108 Cb -0.24 -2.63 0.12 0.00 1.34 0.00 0.00 72.50 71.09 1f9h s THR 108 CO -0.00 0.00 1.85 -0.08 -0.54 0.00 0.00 174.62 175.85 1f9h h GLU 109 N 2.26 0.83 0.00 3.99 4.81 -2.05 -3.13 114.58 121.29 1f9h h GLU 109 Ca -0.38 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.80 1f9h h GLU 109 Cb 1.25 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 30.44 1f9h h GLU 109 CO 0.61 0.55 -0.22 0.00 -0.73 0.00 0.00 179.01 179.22 1f9h h ARG 110 N 0.85 0.00 -2.68 1.92 3.08 -2.03 -3.46 114.38 112.07 1f9h h ARG 110 Ca 0.25 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 60.15 1f9h h ARG 110 Cb -0.05 0.00 -0.30 0.00 0.08 0.00 0.00 29.97 29.70 1f9h h ARG 110 CO -0.07 0.00 -0.44 -1.17 -1.07 0.00 0.00 179.97 177.21 1f9h s LEU 111 N -5.58 -0.48 -0.17 3.04 2.96 -1.18 -5.12 118.68 112.15 1f9h s LEU 111 Ca 0.06 0.81 0.01 0.00 -0.22 0.00 0.00 54.13 54.79 1f9h s LEU 111 Cb 0.08 1.05 0.03 0.00 0.50 0.00 0.00 46.19 47.85 1f9h s LEU 111 CO 0.68 -0.23 -0.14 -0.89 -1.32 0.00 0.00 176.35 174.45 1f9h s THR 112 N 2.50 1.68 -0.04 3.68 2.01 -1.26 -0.86 115.64 123.36 1f9h s THR 112 Ca -0.01 -0.84 0.01 0.00 0.31 0.00 0.00 61.69 61.17 1f9h s THR 112 Cb -0.12 -1.64 0.02 0.00 0.01 0.00 0.00 72.50 70.77 1f9h s THR 112 CO -0.11 0.36 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.43 1f9h s VAL 113 N 1.42 0.60 0.41 3.82 1.01 -0.39 -3.80 120.40 123.46 1f9h s VAL 113 Ca 0.02 -0.19 -0.25 0.00 0.00 0.00 0.00 61.98 61.57 1f9h s VAL 113 Cb -0.14 -0.59 -0.11 0.00 0.00 0.00 0.00 36.38 35.54 1f9h s VAL 113 CO -0.10 0.23 1.06 -2.65 0.00 0.00 0.00 175.10 173.64 1f9h n PRO 114 N 3.82 1.47 -1.58 2.72 -0.02 -1.26 -0.91 135.00 139.24 1f9h n PRO 114 Ca -0.23 0.52 -0.49 0.00 -2.02 0.00 0.00 63.50 61.28 1f9h n PRO 114 Cb 0.52 -2.09 -0.04 0.00 -0.02 0.00 0.00 33.50 31.87 1f9h n PRO 114 CO 0.00 0.00 0.00 1.58 1.98 0.00 0.00 175.50 179.06 1f9h n HIS 115 N -0.35 1.33 0.21 6.00 -0.00 -0.03 -4.81 115.22 117.57 1f9h n HIS 115 Ca 0.09 0.67 0.12 0.00 -0.00 0.00 0.00 57.72 58.60 1f9h n HIS 115 Cb 0.38 -2.29 0.70 0.00 -0.00 0.00 0.00 29.99 28.79 1f9h n HIS 115 CO 0.00 0.00 0.00 0.10 -0.00 0.00 0.00 176.34 176.44 1f9h h TYR 116 N 3.59 0.00 -0.02 1.57 -0.00 -1.93 -3.06 116.97 117.12 1f9h h TYR 116 Ca -0.44 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.29 1f9h h TYR 116 Cb 1.34 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 38.07 1f9h h TYR 116 CO 0.55 0.00 0.00 -3.47 -0.00 0.00 0.00 178.16 175.24 1f9h n ASP 117 N -4.35 1.41 0.16 0.10 2.03 -1.26 -4.80 116.55 109.84 1f9h n ASP 117 Ca -0.00 -1.28 0.05 0.00 0.52 0.00 0.00 54.79 54.09 1f9h n ASP 117 Cb 0.21 -0.01 0.51 0.00 -0.72 0.00 0.00 41.12 41.11 1f9h n ASP 117 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1f9h h MET 118 N 0.52 0.17 0.00 -0.67 -0.00 -1.91 -1.26 114.93 111.78 1f9h h MET 118 Ca 0.00 -0.02 0.00 0.00 -0.00 0.00 0.00 59.70 59.68 1f9h h MET 118 Cb 0.19 -0.03 0.00 0.00 -0.00 0.00 0.00 31.60 31.76 1f9h h MET 118 CO 0.00 0.20 0.00 1.63 -0.00 0.00 0.00 176.91 178.74 1f9h n LYS 119 N -4.42 0.02 -0.04 -0.10 5.02 -1.26 -2.00 118.16 115.37 1f9h n LYS 119 Ca -0.01 0.22 0.12 0.00 -2.02 0.00 0.00 58.31 56.62 1f9h n LYS 119 Cb 0.15 -1.54 0.19 0.00 -0.02 0.00 0.00 35.03 33.81 1f9h n LYS 119 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1f9h n ASN 120 N -1.59 2.87 -3.97 4.39 3.02 -0.48 -4.92 115.26 114.59 1f9h n ASN 120 Ca 0.04 -1.93 -0.31 0.00 -0.03 0.00 0.00 54.58 52.35 1f9h n ASN 120 Cb 0.21 -0.06 -0.15 0.00 -0.61 0.00 0.00 39.78 39.17 1f9h n ASN 120 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1f9h s ARG 121 N -1.88 1.69 0.45 3.52 0.52 -0.85 -4.97 118.95 117.43 1f9h s ARG 121 Ca 0.32 -1.19 0.14 0.00 -0.52 0.00 0.00 55.73 54.48 1f9h s ARG 121 Cb 0.21 -2.70 1.06 0.00 0.52 0.00 0.00 34.95 34.03 1f9h s ARG 121 CO 0.31 -0.66 2.03 0.78 0.02 0.00 0.00 175.30 177.78 1f9h h GLY 122 N 7.88 0.44 2.00 -3.53 0.00 -1.91 0.11 103.07 108.06 1f9h h GLY 122 Ca -0.16 -0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.03 1f9h h GLY 122 CO 0.44 0.10 0.00 1.97 0.00 0.00 0.00 176.54 179.05 1f9h n PHE 123 N -4.47 0.72 -0.13 5.60 1.16 -1.26 -1.07 117.46 118.02 1f9h n PHE 123 Ca 0.06 0.29 -0.24 0.00 -1.87 0.00 0.00 57.45 55.69 1f9h n PHE 123 Cb 0.28 -0.97 -0.11 0.00 -1.61 0.00 0.00 39.48 37.06 1f9h n PHE 123 CO 0.00 0.00 0.00 -1.33 -1.87 0.00 0.00 176.76 173.56 1f9h n MET 124 N -2.17 0.62 0.03 3.97 2.81 -0.67 -4.59 117.12 117.13 1f9h n MET 124 Ca 0.02 0.23 -0.13 0.00 -1.81 0.00 0.00 57.70 56.01 1f9h n MET 124 Cb 0.20 -1.53 -0.02 0.00 -0.71 0.00 0.00 33.22 31.17 1f9h n MET 124 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 1f9h h LEU 125 N -0.54 0.65 -0.09 4.03 3.38 -0.75 -2.71 115.31 119.28 1f9h h LEU 125 Ca -0.62 -0.44 -0.02 0.00 0.09 0.00 0.00 57.88 56.89 1f9h h LEU 125 Cb 1.74 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 42.29 1f9h h LEU 125 CO -0.26 1.21 -0.00 -0.50 0.09 0.00 0.00 178.44 178.98 1f9h h TRP 126 N 0.36 0.18 -0.58 1.13 4.06 -1.34 0.70 115.95 120.46 1f9h h TRP 126 Ca -0.05 -0.03 -0.01 0.00 2.06 0.00 0.00 58.89 60.86 1f9h h TRP 126 Cb 1.39 -0.05 -0.03 0.00 -1.00 0.00 0.00 29.16 29.48 1f9h h TRP 126 CO 0.06 0.43 0.32 -1.35 -3.56 0.00 0.00 178.44 174.34 1f9h h PRO 127 N -0.12 0.80 -0.65 0.49 0.11 -1.77 -1.42 132.00 129.45 1f9h h PRO 127 Ca 0.03 -0.08 -0.06 0.00 0.11 0.00 0.00 66.00 66.00 1f9h h PRO 127 Cb 0.36 -0.16 -0.03 0.00 0.11 0.00 0.00 31.00 31.28 1f9h h PRO 127 CO 0.01 0.59 0.19 1.25 -0.21 0.00 0.00 178.00 179.82 1f9h h LEU 128 N 0.81 0.95 -1.14 2.35 5.85 -1.16 -2.74 115.31 120.23 1f9h h LEU 128 Ca 0.21 -0.22 -0.07 0.00 0.84 0.00 0.00 57.88 58.64 1f9h h LEU 128 Cb 0.02 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 40.78 1f9h h LEU 128 CO -0.03 0.92 -0.18 0.15 -0.34 0.00 0.00 178.44 178.96 1f9h h PHE 129 N 0.94 0.42 -0.72 1.25 3.57 -0.47 0.27 116.94 122.20 1f9h h PHE 129 Ca 0.21 -0.07 0.02 0.00 3.53 0.00 0.00 57.97 61.66 1f9h h PHE 129 Cb 0.32 -0.11 -0.04 0.00 2.79 0.00 0.00 35.95 38.91 1f9h h PHE 129 CO 0.02 0.55 0.48 1.49 -2.23 0.00 0.00 178.31 178.62 1f9h h GLU 130 N 0.35 0.92 0.00 1.11 4.81 -0.97 -2.51 114.58 118.29 1f9h h GLU 130 Ca 0.06 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1f9h h GLU 130 Cb 0.52 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 29.69 1f9h h GLU 130 CO 0.03 0.61 -1.28 0.44 -0.73 0.00 0.00 179.01 178.08 1f9h n ILE 131 N -4.44 0.04 -3.08 2.32 -5.35 -0.77 -4.66 119.36 103.41 1f9h n ILE 131 Ca 0.08 -0.20 -0.19 0.00 -0.27 0.00 0.00 62.75 62.17 1f9h n ILE 131 Cb 0.06 0.50 -0.03 0.00 -1.74 0.00 0.00 39.64 38.44 1f9h n ILE 131 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1f9h n ALA 132 N -1.80 1.47 0.29 -1.28 0.00 0.86 -4.99 120.51 115.07 1f9h n ALA 132 Ca 0.01 -2.93 0.15 0.00 0.00 0.00 0.00 53.44 50.67 1f9h n ALA 132 Cb 0.42 -0.95 0.88 0.00 0.00 0.00 0.00 19.45 19.80 1f9h n ALA 132 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1f9h h PRO 133 N 3.73 0.00 -0.22 0.00 0.13 -1.67 -1.94 132.00 132.03 1f9h h PRO 133 Ca 0.03 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.16 1f9h h PRO 133 Cb 0.94 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.07 1f9h h PRO 133 CO 0.42 0.04 0.00 0.39 -0.23 0.00 0.00 178.00 178.62 1f9h n GLU 134 N -3.72 1.85 -1.83 0.86 -0.58 -1.26 -4.38 120.64 111.57 1f9h n GLU 134 Ca -0.03 -1.28 -0.40 0.00 -0.42 0.00 0.00 57.16 55.03 1f9h n GLU 134 Cb 0.13 -1.40 0.01 0.00 -0.57 0.00 0.00 31.44 29.61 1f9h n GLU 134 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 1f9h s LEU 135 N -1.48 4.22 -0.11 -4.62 0.20 -0.73 -4.90 118.68 111.27 1f9h s LEU 135 Ca 0.32 2.94 0.03 0.00 0.69 0.00 0.00 54.13 58.11 1f9h s LEU 135 Cb 0.17 -3.81 0.01 0.00 -0.43 0.00 0.00 46.19 42.13 1f9h s LEU 135 CO 0.26 -1.00 -0.21 -0.69 -0.29 0.00 0.00 176.35 174.41 1f9h s VAL 136 N -1.17 1.89 0.72 1.68 1.01 -1.26 -1.48 120.40 121.79 1f9h s VAL 136 Ca 0.57 -0.91 -0.11 0.00 0.00 0.00 0.00 61.98 61.54 1f9h s VAL 136 Cb -0.44 -1.66 0.02 0.00 0.00 0.00 0.00 36.38 34.30 1f9h s VAL 136 CO 0.58 0.52 1.07 -0.36 0.00 0.00 0.00 175.10 176.91 1f9h s PHE 137 N 0.56 2.95 0.52 5.22 0.40 0.56 -4.94 117.98 123.26 1f9h s PHE 137 Ca -0.14 1.46 0.22 0.00 -0.60 0.00 0.00 56.93 57.87 1f9h s PHE 137 Cb -0.17 -2.93 1.34 0.00 0.51 0.00 0.00 43.02 41.77 1f9h s PHE 137 CO 0.05 -1.41 2.04 -1.35 0.70 0.00 0.00 175.22 175.25 1f9h h PRO 138 N -0.85 0.03 0.00 0.24 0.11 -1.88 -1.07 132.00 128.58 1f9h h PRO 138 Ca -0.44 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1f9h h PRO 138 Cb 1.22 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1f9h h PRO 138 CO 0.55 0.02 0.00 -0.40 -0.21 0.00 0.00 178.00 177.96 1f9h n ASP 139 N -4.43 0.00 0.00 -2.05 5.75 -1.26 -4.88 116.55 109.68 1f9h n ASP 139 Ca 0.06 -0.67 0.00 0.00 -0.01 0.00 0.00 54.79 54.17 1f9h n ASP 139 Cb 0.45 -0.08 0.00 0.00 -1.03 0.00 0.00 41.12 40.45 1f9h n ASP 139 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1f9h n GLY 140 N 0.88 0.69 3.77 6.12 0.00 -0.40 -5.07 105.19 111.18 1f9h n GLY 140 Ca 0.19 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.84 1f9h n GLY 140 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1f9h s GLU 141 N -0.87 4.34 -0.05 1.61 2.02 -1.26 -4.75 118.70 119.74 1f9h s GLU 141 Ca 0.00 1.58 -0.20 0.00 0.02 0.00 0.00 54.97 56.37 1f9h s GLU 141 Cb 0.00 -2.75 -0.05 0.00 0.10 0.00 0.00 34.13 31.43 1f9h s GLU 141 CO 0.00 0.00 0.56 -1.64 0.02 0.00 0.00 175.26 174.20 1f9h s MET 142 N -2.14 4.31 0.20 1.61 -1.94 -1.26 -0.32 119.30 119.76 1f9h s MET 142 Ca 0.53 0.65 -0.11 0.00 -1.71 0.00 0.00 55.69 55.05 1f9h s MET 142 Cb -0.25 -3.38 0.26 0.00 2.01 0.00 0.00 34.83 33.47 1f9h s MET 142 CO 0.31 0.28 1.72 1.25 -0.01 0.00 0.00 175.02 178.57 1f9h h LEU 143 N 6.06 0.04 -0.67 -0.03 5.85 -1.59 -0.84 115.31 124.14 1f9h h LEU 143 Ca -0.44 0.10 0.05 0.00 0.84 0.00 0.00 57.88 58.43 1f9h h LEU 143 Cb 1.19 0.12 -0.05 0.00 0.37 0.00 0.00 40.66 42.30 1f9h h LEU 143 CO 0.72 0.04 0.39 -0.09 -0.34 0.00 0.00 178.44 179.16 1f9h h ARG 144 N 0.28 0.72 -0.32 1.25 2.43 -1.79 -0.84 114.38 116.11 1f9h h ARG 144 Ca 0.29 -0.04 -0.07 0.00 -0.81 0.00 0.00 59.98 59.35 1f9h h ARG 144 Cb 0.41 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.78 1f9h h ARG 144 CO -0.36 0.48 -0.05 0.37 -1.51 0.00 0.00 179.97 178.90 1f9h h GLN 145 N 0.75 0.61 -0.84 0.20 4.15 -1.77 -2.20 115.11 116.01 1f9h h GLN 145 Ca 0.29 -0.22 0.06 0.00 0.77 0.00 0.00 58.65 59.55 1f9h h GLN 145 Cb 0.12 -0.04 -0.06 0.00 0.21 0.00 0.00 27.48 27.70 1f9h h GLN 145 CO -0.15 0.77 0.51 0.82 -1.93 0.00 0.00 178.83 178.86 1f9h h ILE 146 N 0.39 1.03 -0.58 2.39 2.04 -0.76 -0.51 117.51 121.51 1f9h h ILE 146 Ca 0.09 -0.32 -0.09 0.00 1.00 0.00 0.00 64.86 65.54 1f9h h ILE 146 Cb 0.53 0.01 -0.02 0.00 -0.74 0.00 0.00 36.82 36.60 1f9h h ILE 146 CO 0.03 0.17 0.01 -0.07 0.00 0.00 0.00 178.15 178.29 1f9h h LEU 147 N 0.93 0.97 -0.93 1.44 3.38 -1.00 -0.41 115.31 119.69 1f9h h LEU 147 Ca 0.37 -0.26 -0.11 0.00 0.09 0.00 0.00 57.88 57.96 1f9h h LEU 147 Cb 0.18 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 1f9h h LEU 147 CO -0.18 1.02 -0.49 0.45 0.09 0.00 0.00 178.44 179.33 1f9h h HIS 148 N 0.92 0.13 0.00 1.13 3.86 -0.78 -1.32 115.15 119.09 1f9h h HIS 148 Ca 0.17 -0.04 -0.00 0.00 -1.16 0.00 0.00 60.37 59.34 1f9h h HIS 148 Cb 0.52 -0.03 0.00 0.00 1.06 0.00 0.00 27.41 28.96 1f9h h HIS 148 CO 0.03 0.58 -0.00 1.15 0.86 0.00 0.00 177.93 180.55 1f9h h THR 149 N 0.09 1.60 0.00 2.45 2.02 -0.89 -3.31 112.91 114.86 1f9h h THR 149 Ca 0.00 -2.12 -0.06 0.00 0.77 0.00 0.00 66.41 65.00 1f9h h THR 149 Cb 0.90 2.98 -0.01 0.00 -1.74 0.00 0.00 68.15 70.29 1f9h h THR 149 CO 0.07 0.53 -0.29 0.03 0.37 0.00 0.00 175.52 176.22 1f9h h ARG 150 N -0.96 0.00 -6.13 6.66 2.47 -1.16 -3.47 114.38 111.79 1f9h h ARG 150 Ca -0.00 0.00 -0.43 0.00 -1.26 0.00 0.00 59.98 58.29 1f9h h ARG 150 Cb 0.87 0.00 0.03 0.00 -1.65 0.00 0.00 29.97 29.22 1f9h h ARG 150 CO 0.00 0.29 -0.79 0.00 0.56 0.00 0.00 179.97 180.03 1f9h n ALA 151 N -2.31 -1.72 -1.77 0.04 0.00 -0.50 -4.92 120.51 109.34 1f9h n ALA 151 Ca -0.01 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.04 1f9h n ALA 151 Cb 0.41 -3.08 0.00 0.00 0.00 0.00 0.00 19.45 16.79 1f9h n ALA 151 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1f9h s PHE 152 N -3.51 2.75 0.26 0.00 0.08 -1.26 -4.92 117.98 111.38 1f9h s PHE 152 Ca 0.27 1.43 -0.30 0.00 0.12 0.00 0.00 56.93 58.45 1f9h s PHE 152 Cb -0.13 -3.64 -0.14 0.00 -0.57 0.00 0.00 43.02 38.53 1f9h s PHE 152 CO 0.81 -2.10 1.10 -0.25 -0.10 0.00 0.00 175.22 174.67 1f9h n ASP 153 N -0.14 1.50 -4.73 1.36 8.00 -1.26 -4.94 116.55 116.34 1f9h n ASP 153 Ca 0.05 1.17 -0.35 0.00 0.71 0.00 0.00 54.79 56.37 1f9h n ASP 153 Cb 0.44 -1.29 0.07 0.00 -0.02 0.00 0.00 41.12 40.33 1f9h n ASP 153 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1f9h s LYS 154 N -1.16 2.42 0.27 -1.24 -0.14 -1.26 -4.95 119.74 113.68 1f9h s LYS 154 Ca 0.63 1.81 -0.05 0.00 -1.36 0.00 0.00 55.97 57.00 1f9h s LYS 154 Cb -0.73 -1.86 -0.05 0.00 -1.68 0.00 0.00 37.83 33.51 1f9h s LYS 154 CO 0.57 -1.64 0.54 -0.51 -0.76 0.00 0.00 175.35 173.55 1f9h s LEU 155 N -4.77 4.08 -0.03 3.17 1.43 -1.26 -5.10 118.68 116.21 1f9h s LEU 155 Ca 0.76 0.71 -0.10 0.00 -1.03 0.00 0.00 54.13 54.47 1f9h s LEU 155 Cb -0.31 -3.51 -0.05 0.00 0.03 0.00 0.00 46.19 42.35 1f9h s LEU 155 CO 0.41 -0.17 0.29 0.20 0.23 0.00 0.00 176.35 177.32 1f9h s ASN 156 N -3.08 6.58 0.42 2.29 0.01 -1.26 -5.03 114.94 114.88 1f9h s ASN 156 Ca 0.44 0.69 -0.25 0.00 -0.71 0.00 0.00 52.86 53.02 1f9h s ASN 156 Cb -0.11 -2.15 -0.08 0.00 0.41 0.00 0.00 41.25 39.32 1f9h s ASN 156 CO 0.29 0.32 1.28 -0.54 -1.51 0.00 0.00 177.10 176.94 1f9h s LYS 157 N -1.33 3.91 0.00 -0.60 -0.14 -1.26 -0.99 119.74 119.33 1f9h s LYS 157 Ca 0.23 2.10 0.00 0.00 -1.36 0.00 0.00 55.97 56.94 1f9h s LYS 157 Cb -0.14 -2.69 0.00 0.00 -1.68 0.00 0.00 37.83 33.32 1f9h s LYS 157 CO 0.12 -0.52 0.46 1.87 -0.76 0.00 0.00 175.35 176.52