#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1f5m h THR 5 N 0.00 0.91 0.00 2.46 1.35 -2.12 -3.46 112.91 112.05 1f5m h THR 5 Ca 0.00 -0.57 0.00 0.00 -0.55 0.00 0.00 66.41 65.29 1f5m h THR 5 Cb 0.00 1.32 0.00 0.00 -1.73 0.00 0.00 68.15 67.74 1f5m h THR 5 CO 0.00 0.15 0.00 0.61 -0.25 0.00 0.00 175.52 176.03 1f5m n GLY 6 N -0.92 1.37 3.94 5.82 0.00 -1.26 -5.05 105.19 109.09 1f5m n GLY 6 Ca -0.02 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.76 1f5m n GLY 6 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1f5m s PHE 7 N -2.51 3.33 0.07 1.61 0.40 -1.26 -5.13 117.98 114.49 1f5m s PHE 7 Ca 0.00 0.36 0.02 0.00 -0.60 0.00 0.00 56.93 56.71 1f5m s PHE 7 Cb 0.00 -2.25 -0.03 0.00 0.51 0.00 0.00 43.02 41.24 1f5m s PHE 7 CO 0.00 -0.28 -0.07 -1.01 0.70 0.00 0.00 175.22 174.55 1f5m s HIS 8 N -2.56 0.79 0.28 0.36 3.76 -1.26 -5.04 115.29 111.62 1f5m s HIS 8 Ca 0.47 -0.70 0.01 0.00 -0.15 0.00 0.00 55.06 54.69 1f5m s HIS 8 Cb -0.10 -0.46 0.67 0.00 1.11 0.00 0.00 32.58 33.80 1f5m s HIS 8 CO 0.39 -0.11 1.67 0.45 -0.85 0.00 0.00 174.74 176.29 1f5m h HIS 9 N 3.76 0.41 -0.77 1.40 3.86 -2.05 -1.22 115.15 120.53 1f5m h HIS 9 Ca -0.36 0.05 0.20 0.00 -1.16 0.00 0.00 60.37 59.10 1f5m h HIS 9 Cb 1.18 -0.04 -0.04 0.00 1.06 0.00 0.00 27.41 29.57 1f5m h HIS 9 CO 0.62 -0.15 0.54 0.00 0.86 0.00 0.00 177.93 179.80 1f5m h ALA 10 N 1.73 2.49 -0.04 2.45 0.00 -2.03 -2.67 119.26 121.20 1f5m h ALA 10 Ca 0.53 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.44 1f5m h ALA 10 Cb 1.03 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.83 1f5m h ALA 10 CO -0.60 -0.72 0.16 -0.44 0.00 0.00 0.00 179.25 177.65 1f5m h ASP 11 N 0.16 0.00 -0.01 0.00 3.45 -1.63 -1.64 116.42 116.75 1f5m h ASP 11 Ca 0.38 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.84 1f5m h ASP 11 Cb 1.26 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 40.03 1f5m h ASP 11 CO -0.06 0.00 0.02 0.45 -1.57 0.00 0.00 179.24 178.08 1f5m h HIS 12 N 0.00 0.00 -0.97 4.55 3.86 -1.67 -2.93 115.15 118.00 1f5m h HIS 12 Ca 0.02 0.00 -0.66 0.00 -1.16 0.00 0.00 60.37 58.57 1f5m h HIS 12 Cb 0.34 0.00 -0.30 0.00 1.06 0.00 0.00 27.41 28.51 1f5m h HIS 12 CO 0.00 0.00 0.70 1.33 0.86 0.00 0.00 177.93 180.82 1f5m n VAL 13 N -3.35 3.50 -4.00 2.45 0.24 -0.62 -4.89 118.33 111.66 1f5m n VAL 13 Ca -0.03 -3.01 -0.35 0.00 -2.04 0.00 0.00 64.34 58.91 1f5m n VAL 13 Cb 0.09 -1.12 -0.12 0.00 -1.47 0.00 0.00 33.84 31.22 1f5m n VAL 13 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 1f5m s ASN 14 N -1.98 5.02 -0.16 -1.34 -0.87 -1.11 -4.95 114.94 109.55 1f5m s ASN 14 Ca 0.63 -0.16 -0.04 0.00 -1.57 0.00 0.00 52.86 51.72 1f5m s ASN 14 Cb 0.50 -1.87 0.07 0.00 -0.02 0.00 0.00 41.25 39.93 1f5m s ASN 14 CO 0.00 0.06 0.17 -0.31 -2.57 0.00 0.00 177.10 174.45 1f5m s TYR 15 N 1.03 -0.12 0.64 2.20 1.51 -1.26 -5.14 117.35 116.21 1f5m s TYR 15 Ca 0.03 0.20 -0.16 0.00 -1.01 0.00 0.00 57.07 56.12 1f5m s TYR 15 Cb -0.14 -0.42 -0.01 0.00 -0.11 0.00 0.00 41.96 41.28 1f5m s TYR 15 CO 0.02 -0.48 1.15 -1.54 -1.11 0.00 0.00 175.55 173.59 1f5m s SER 16 N 2.27 5.03 0.11 2.29 1.04 -1.26 -4.85 113.70 118.32 1f5m s SER 16 Ca 0.04 2.17 0.17 0.00 0.48 0.00 0.00 55.95 58.81 1f5m s SER 16 Cb -0.15 -2.57 0.73 0.00 0.10 0.00 0.00 66.02 64.13 1f5m s SER 16 CO -0.09 -1.69 1.52 -1.54 0.98 0.00 0.00 173.24 172.42 1f5m n SER 17 N -2.16 0.27 -0.00 7.02 3.41 -1.26 -1.74 113.62 119.16 1f5m n SER 17 Ca 0.12 0.57 0.13 0.00 -0.26 0.00 0.00 58.87 59.43 1f5m n SER 17 Cb 0.51 -0.63 0.40 0.00 -0.26 0.00 0.00 64.21 64.24 1f5m n SER 17 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1f5m n ASN 18 N -1.80 0.30 -4.82 4.04 3.02 -1.26 -4.85 115.26 109.89 1f5m n ASN 18 Ca 0.02 0.04 -0.33 0.00 -0.03 0.00 0.00 54.58 54.28 1f5m n ASN 18 Cb 0.17 -0.05 -0.07 0.00 -0.61 0.00 0.00 39.78 39.22 1f5m n ASN 18 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1f5m s LEU 19 N -2.99 3.92 0.46 3.41 1.43 -0.71 -5.07 118.68 119.13 1f5m s LEU 19 Ca 0.13 1.71 0.06 0.00 -1.03 0.00 0.00 54.13 54.99 1f5m s LEU 19 Cb 0.18 -4.54 0.02 0.00 0.03 0.00 0.00 46.19 41.88 1f5m s LEU 19 CO 0.63 -0.41 0.63 0.54 0.23 0.00 0.00 176.35 177.97 1f5m s ASN 20 N -2.20 5.54 0.20 2.29 6.03 -1.26 -4.93 114.94 120.62 1f5m s ASN 20 Ca 0.62 -0.29 -0.11 0.00 -1.03 0.00 0.00 52.86 52.05 1f5m s ASN 20 Cb -0.10 -0.73 0.22 0.00 -3.03 0.00 0.00 41.25 37.61 1f5m s ASN 20 CO 0.14 -0.87 1.76 0.50 -2.03 0.00 0.00 177.10 176.60 1f5m h LYS 21 N 0.47 0.42 -0.86 3.55 3.64 -1.99 -1.82 116.57 119.98 1f5m h LYS 21 Ca -0.41 -0.03 0.03 0.00 -1.27 0.00 0.00 60.65 58.98 1f5m h LYS 21 Cb 1.28 -0.10 -0.05 0.00 -0.41 0.00 0.00 32.23 32.96 1f5m h LYS 21 CO 0.47 0.28 0.55 1.49 -2.27 0.00 0.00 179.45 179.97 1f5m h GLU 22 N 0.43 1.04 0.22 1.90 4.81 -1.99 -1.64 114.58 119.35 1f5m h GLU 22 Ca 0.27 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.43 1f5m h GLU 22 Cb 0.28 -0.24 0.00 0.00 0.63 0.00 0.00 28.75 29.43 1f5m h GLU 22 CO -0.25 0.69 -0.10 0.93 -0.73 0.00 0.00 179.01 179.55 1f5m h GLU 23 N 1.08 -0.28 -0.40 1.92 5.08 -1.84 -0.56 114.58 119.59 1f5m h GLU 23 Ca 0.34 0.02 0.08 0.00 -1.00 0.00 0.00 59.36 58.80 1f5m h GLU 23 Cb 0.01 0.06 -0.07 0.00 0.50 0.00 0.00 28.75 29.25 1f5m h GLU 23 CO -0.12 -0.02 -0.04 0.82 -1.00 0.00 0.00 179.01 178.65 1f5m h ILE 24 N -0.52 0.66 -0.11 3.13 2.04 -1.25 0.12 117.51 121.58 1f5m h ILE 24 Ca -0.03 -0.02 -0.10 0.00 1.00 0.00 0.00 64.86 65.71 1f5m h ILE 24 Cb 0.39 0.59 -0.01 0.00 -0.74 0.00 0.00 36.82 37.05 1f5m h ILE 24 CO 0.05 0.01 -0.37 -0.07 0.00 0.00 0.00 178.15 177.77 1f5m h LEU 25 N 0.06 0.23 -0.41 1.44 3.38 -1.28 -0.89 115.31 117.83 1f5m h LEU 25 Ca 0.19 -0.09 -0.08 0.00 0.09 0.00 0.00 57.88 58.00 1f5m h LEU 25 Cb 0.29 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1f5m h LEU 25 CO -0.36 0.58 -0.04 -0.08 0.09 0.00 0.00 178.44 178.63 1f5m h GLU 26 N 0.19 0.76 -0.41 1.13 4.57 -0.36 -2.59 114.58 117.87 1f5m h GLU 26 Ca 0.02 -0.26 -0.05 0.00 -1.18 0.00 0.00 59.36 57.89 1f5m h GLU 26 Cb 0.75 -0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 29.26 1f5m h GLU 26 CO 0.06 0.86 0.05 1.96 -1.18 0.00 0.00 179.01 180.76 1f5m h GLN 27 N 0.58 0.63 -0.25 1.92 4.20 -0.44 -2.43 115.11 119.33 1f5m h GLN 27 Ca 0.11 -0.13 -0.01 0.00 0.06 0.00 0.00 58.65 58.69 1f5m h GLN 27 Cb 0.55 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.22 1f5m h GLN 27 CO 0.03 0.61 0.13 1.25 -0.67 0.00 0.00 178.83 180.18 1f5m h LEU 28 N 0.60 0.31 -0.62 1.46 6.46 -0.89 0.21 115.31 122.84 1f5m h LEU 28 Ca 0.13 -0.09 0.01 0.00 -0.12 0.00 0.00 57.88 57.81 1f5m h LEU 28 Cb 0.30 -0.08 -0.03 0.00 -0.73 0.00 0.00 40.66 40.12 1f5m h LEU 28 CO 0.00 0.31 0.40 -0.07 -0.62 0.00 0.00 178.44 178.47 1f5m h LEU 29 N 0.28 0.69 -0.44 2.25 3.38 -1.27 0.64 115.31 120.85 1f5m h LEU 29 Ca 0.09 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 1f5m h LEU 29 Cb 0.07 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 1f5m h LEU 29 CO -0.01 0.49 0.19 -0.07 0.09 0.00 0.00 178.44 179.13 1f5m h LEU 30 N 0.82 0.60 -0.79 1.67 3.38 -1.21 -1.23 115.31 118.55 1f5m h LEU 30 Ca 0.23 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 1f5m h LEU 30 Cb -0.06 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.50 1f5m h LEU 30 CO -0.06 0.59 0.39 0.28 0.09 0.00 0.00 178.44 179.72 1f5m h SER 31 N 0.57 1.02 -0.31 -0.43 0.02 0.08 -0.49 113.55 114.01 1f5m h SER 31 Ca 0.15 -0.13 -0.03 0.00 -0.84 0.00 0.00 61.79 60.94 1f5m h SER 31 Cb 0.16 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.42 1f5m h SER 31 CO -0.01 0.86 0.10 0.22 -1.14 0.00 0.00 176.83 176.85 1f5m h TYR 32 N 1.11 0.57 -0.14 3.45 3.20 -0.71 0.14 116.97 124.58 1f5m h TYR 32 Ca 0.27 -0.03 -0.07 0.00 3.14 0.00 0.00 58.73 62.04 1f5m h TYR 32 Cb 0.10 -0.17 -0.00 0.00 1.54 0.00 0.00 36.73 38.20 1f5m h TYR 32 CO 0.01 0.49 -0.18 1.49 -1.64 0.00 0.00 178.16 178.33 1f5m h GLU 33 N 0.55 0.36 -0.62 1.82 4.81 -0.50 -1.84 114.58 119.17 1f5m h GLU 33 Ca 0.13 -0.21 -0.02 0.00 -0.13 0.00 0.00 59.36 59.13 1f5m h GLU 33 Cb 0.21 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.57 1f5m h GLU 33 CO -0.00 0.78 0.32 0.78 -0.73 0.00 0.00 179.01 180.15 1f5m h GLY 34 N -0.03 0.94 2.00 1.92 0.00 -0.50 -2.22 103.07 105.18 1f5m h GLY 34 Ca 0.02 -0.45 -0.13 0.00 0.00 0.00 0.00 47.33 46.77 1f5m h GLY 34 CO 0.04 0.43 -0.63 1.41 0.00 0.00 0.00 176.54 177.78 1f5m h LEU 35 N 0.84 0.00 -0.48 3.11 3.38 -0.75 -3.23 115.31 118.18 1f5m h LEU 35 Ca 0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.18 1f5m h LEU 35 Cb 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 1f5m h LEU 35 CO -0.03 0.63 -0.50 -1.54 0.09 0.00 0.00 178.44 177.09 1f5m n SER 36 N -3.69 1.25 -0.22 -0.43 3.41 -0.70 -4.41 113.62 108.83 1f5m n SER 36 Ca -0.01 -1.00 0.01 0.00 -0.26 0.00 0.00 58.87 57.61 1f5m n SER 36 Cb 0.65 0.42 0.12 0.00 -0.26 0.00 0.00 64.21 65.14 1f5m n SER 36 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 1f5m h ASP 37 N 1.17 0.35 0.89 4.04 3.58 -1.42 -3.16 116.42 121.86 1f5m h ASP 37 Ca 0.00 0.07 0.00 0.00 0.42 0.00 0.00 57.03 57.52 1f5m h ASP 37 Cb 0.58 0.02 0.00 0.00 1.72 0.00 0.00 39.33 41.65 1f5m h ASP 37 CO 0.00 0.20 0.00 1.23 -2.88 0.00 0.00 179.24 177.79 1f5m h GLY 38 N 0.51 0.00 -4.03 -0.78 0.00 -1.80 -3.46 103.07 93.50 1f5m h GLY 38 Ca 0.33 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.54 1f5m h GLY 38 CO -0.28 0.00 -0.41 1.20 0.00 0.00 0.00 176.54 177.05 1f5m s GLN 39 N -3.73 0.67 0.00 4.80 1.11 -1.20 -5.03 119.66 116.28 1f5m s GLN 39 Ca 0.00 -0.61 0.22 0.00 0.01 0.00 0.00 55.36 54.99 1f5m s GLN 39 Cb 0.09 0.28 0.15 0.00 -1.01 0.00 0.00 33.01 32.52 1f5m s GLN 39 CO 0.52 -0.19 1.19 1.33 0.01 0.00 0.00 175.29 178.15 1f5m n VAL 40 N 0.77 0.00 -1.55 1.09 0.24 -1.26 -4.86 118.33 112.76 1f5m n VAL 40 Ca -0.19 -0.47 -0.47 0.00 -2.04 0.00 0.00 64.34 61.17 1f5m n VAL 40 Cb 0.58 1.44 -0.05 0.00 -1.47 0.00 0.00 33.84 34.35 1f5m n VAL 40 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 1f5m n ASN 41 N 1.10 2.88 0.04 -1.34 5.15 -1.26 -0.86 115.26 120.96 1f5m n ASN 41 Ca 0.13 0.42 -0.04 0.00 -0.60 0.00 0.00 54.58 54.48 1f5m n ASN 41 Cb 0.54 -1.41 0.19 0.00 -0.53 0.00 0.00 39.78 38.57 1f5m n ASN 41 CO 0.00 0.00 0.00 4.11 1.40 0.00 0.00 177.26 182.77 1f5m h TRP 42 N 13.06 0.49 -0.19 1.20 5.08 -1.92 -1.99 115.95 131.67 1f5m h TRP 42 Ca -0.37 -0.12 0.00 0.00 1.08 0.00 0.00 58.89 59.48 1f5m h TRP 42 Cb 1.28 -0.11 -0.01 0.00 -3.00 0.00 0.00 29.16 27.31 1f5m h TRP 42 CO 0.94 0.71 0.12 0.28 -1.28 0.00 0.00 178.44 179.21 1f5m h VAL 43 N 0.36 1.04 -0.16 0.12 2.07 -1.93 0.13 116.25 117.88 1f5m h VAL 43 Ca 0.04 -0.08 0.04 0.00 0.82 0.00 0.00 66.70 67.52 1f5m h VAL 43 Cb 0.77 0.77 -0.04 0.00 -1.52 0.00 0.00 31.29 31.27 1f5m h VAL 43 CO 0.06 0.04 -0.08 0.00 0.02 0.00 0.00 177.57 177.62 1f5m h ASN 45 N -0.06 1.00 0.41 0.00 2.35 -1.07 -2.63 115.58 115.58 1f5m h ASN 45 Ca 0.09 -0.37 -0.13 0.00 -0.55 0.00 0.00 56.30 55.34 1f5m h ASN 45 Cb 0.20 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.28 1f5m h ASN 45 CO -0.20 1.16 -0.56 -0.07 -1.65 0.00 0.00 177.43 176.11 1f5m h LEU 46 N 0.86 0.18 -0.04 1.61 3.38 -0.54 0.77 115.31 121.52 1f5m h LEU 46 Ca 0.12 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 1f5m h LEU 46 Cb 0.76 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.46 1f5m h LEU 46 CO 0.06 0.70 0.01 0.28 0.09 0.00 0.00 178.44 179.58 1f5m h SER 47 N 0.12 0.06 -0.17 -0.43 0.02 -0.97 0.16 113.55 112.33 1f5m h SER 47 Ca -0.00 -0.21 -0.10 0.00 -0.84 0.00 0.00 61.79 60.64 1f5m h SER 47 Cb 1.02 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 63.53 1f5m h SER 47 CO 0.08 0.25 -0.23 0.78 -1.14 0.00 0.00 176.83 176.58 1f5m h ASN 48 N -0.14 0.62 -0.94 3.07 2.35 -1.35 -2.67 115.58 116.51 1f5m h ASN 48 Ca 0.01 -0.21 0.03 0.00 -0.55 0.00 0.00 56.30 55.58 1f5m h ASN 48 Cb 0.21 -0.17 -0.05 0.00 0.05 0.00 0.00 38.32 38.36 1f5m h ASN 48 CO -0.00 0.84 0.62 0.00 -1.65 0.00 0.00 177.43 177.24 1f5m h ALA 49 N 1.21 1.24 -0.29 -0.83 0.00 -0.47 -1.39 119.26 118.73 1f5m h ALA 49 Ca 0.08 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 1f5m h ALA 49 Cb 0.68 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1f5m h ALA 49 CO 0.05 0.51 -0.02 0.66 0.00 0.00 0.00 179.25 180.45 1f5m h SER 50 N 1.21 0.41 -0.15 0.00 4.64 -0.34 -1.26 113.55 118.06 1f5m h SER 50 Ca 0.37 -0.07 -0.08 0.00 -0.47 0.00 0.00 61.79 61.54 1f5m h SER 50 Cb -0.03 -0.11 -0.00 0.00 -0.31 0.00 0.00 62.40 61.96 1f5m h SER 50 CO -0.11 0.49 -0.21 -1.28 -0.87 0.00 0.00 176.83 174.85 1f5m h SER 51 N 0.43 0.44 -0.12 4.97 0.87 -1.41 -1.05 113.55 117.68 1f5m h SER 51 Ca 0.09 -0.52 0.04 0.00 -1.23 0.00 0.00 61.79 60.18 1f5m h SER 51 Cb 0.31 -0.13 -0.05 0.00 -0.44 0.00 0.00 62.40 62.10 1f5m h SER 51 CO 0.01 0.87 -0.19 -0.07 -0.53 0.00 0.00 176.83 176.92 1f5m h LEU 52 N 0.02 -0.59 -0.35 2.23 3.38 -0.88 -0.89 115.31 118.23 1f5m h LEU 52 Ca 0.02 0.10 0.01 0.00 0.09 0.00 0.00 57.88 58.10 1f5m h LEU 52 Cb 0.78 0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.78 1f5m h LEU 52 CO 0.05 -0.24 0.20 0.40 0.09 0.00 0.00 178.44 178.94 1f5m h ILE 53 N -0.25 1.04 -0.04 1.22 2.04 -1.20 0.25 117.51 120.58 1f5m h ILE 53 Ca 0.10 -0.14 0.02 0.00 1.00 0.00 0.00 64.86 65.83 1f5m h ILE 53 Cb 0.39 0.59 -0.02 0.00 -0.74 0.00 0.00 36.82 37.04 1f5m h ILE 53 CO -0.27 0.08 -0.06 -0.25 0.00 0.00 0.00 178.15 177.65 1f5m h TRP 54 N 0.41 -0.14 -0.21 1.37 2.91 -1.02 -1.04 115.95 118.23 1f5m h TRP 54 Ca 0.14 0.01 -0.15 0.00 1.13 0.00 0.00 58.89 60.01 1f5m h TRP 54 Cb 0.00 0.07 -0.01 0.00 -0.51 0.00 0.00 29.16 28.72 1f5m h TRP 54 CO -0.08 -0.09 -0.51 0.45 -1.03 0.00 0.00 178.44 177.18 1f5m h HIS 55 N -0.09 0.71 -0.51 2.65 3.86 -1.01 -1.47 115.15 119.30 1f5m h HIS 55 Ca 0.04 -0.24 0.02 0.00 -1.16 0.00 0.00 60.37 59.03 1f5m h HIS 55 Cb 0.14 -0.14 -0.03 0.00 1.06 0.00 0.00 27.41 28.44 1f5m h HIS 55 CO -0.15 0.97 0.31 0.00 0.86 0.00 0.00 177.93 179.92 1f5m h ALA 56 N 0.99 0.65 0.00 2.45 0.00 -0.65 -1.55 119.26 121.15 1f5m h ALA 56 Ca 0.02 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.80 1f5m h ALA 56 Cb 1.04 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 1f5m h ALA 56 CO 0.10 0.03 -0.51 1.88 0.00 0.00 0.00 179.25 180.75 1f5m h TYR 57 N 0.63 0.00 -0.26 0.00 -1.99 -0.98 -1.88 116.97 112.48 1f5m h TYR 57 Ca 0.20 0.00 -0.11 0.00 2.00 0.00 0.00 58.73 60.82 1f5m h TYR 57 Cb -0.01 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 38.71 1f5m h TYR 57 CO -0.06 0.51 -0.30 -0.22 -0.00 0.00 0.00 178.16 178.09 1f5m h LYS 58 N 0.00 0.53 -0.11 4.88 3.64 -0.89 -2.33 116.57 122.28 1f5m h LYS 58 Ca -0.01 -0.22 -0.14 0.00 -1.27 0.00 0.00 60.65 59.02 1f5m h LYS 58 Cb 0.93 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.72 1f5m h LYS 58 CO 0.07 0.77 -0.53 1.03 -2.27 0.00 0.00 179.45 178.52 1f5m h SER 59 N 0.46 0.33 0.25 4.20 0.87 -0.89 -2.66 113.55 116.11 1f5m h SER 59 Ca 0.06 -0.17 0.00 0.00 -1.23 0.00 0.00 61.79 60.45 1f5m h SER 59 Cb 0.75 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 62.62 1f5m h SER 59 CO 0.06 0.80 0.00 0.18 -0.53 0.00 0.00 176.83 177.34 1f5m n LEU 60 N -3.94 0.00 -1.19 2.23 4.77 -0.74 -4.87 117.00 113.25 1f5m n LEU 60 Ca -0.02 0.21 -0.14 0.00 -0.03 0.00 0.00 56.01 56.03 1f5m n LEU 60 Cb 0.57 -0.21 -0.05 0.00 -2.33 0.00 0.00 43.42 41.39 1f5m n LEU 60 CO 0.44 -0.09 -0.15 0.00 -1.33 0.00 0.00 177.39 176.27 1f5m n ALA 61 N -1.21 -0.25 -2.70 -1.18 0.00 -1.00 -4.97 120.51 109.19 1f5m n ALA 61 Ca 0.10 0.21 -0.40 0.00 0.00 0.00 0.00 53.44 53.35 1f5m n ALA 61 Cb 0.12 -1.59 -0.05 0.00 0.00 0.00 0.00 19.45 17.93 1f5m n ALA 61 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1f5m s VAL 62 N -2.57 5.04 -1.27 0.00 1.01 -1.13 -4.95 120.40 116.53 1f5m s VAL 62 Ca 0.00 1.37 -0.17 0.00 0.00 0.00 0.00 61.98 63.17 1f5m s VAL 62 Cb 0.00 -4.01 0.00 0.00 0.00 0.00 0.00 36.38 32.37 1f5m s VAL 62 CO 0.00 0.21 2.00 -0.67 0.00 0.00 0.00 175.10 176.65 1f5m n ASP 63 N 4.14 3.89 -4.81 3.32 2.03 -1.26 -4.54 116.55 119.32 1f5m n ASP 63 Ca -0.01 -2.82 -0.35 0.00 0.52 0.00 0.00 54.79 52.13 1f5m n ASP 63 Cb 0.51 -1.61 -0.07 0.00 -0.72 0.00 0.00 41.12 39.24 1f5m n ASP 63 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 1f5m s ILE 64 N 4.59 4.36 0.00 5.18 -4.36 -1.26 -0.66 121.20 129.05 1f5m s ILE 64 Ca 0.53 1.55 0.00 0.00 -0.26 0.00 0.00 60.65 62.47 1f5m s ILE 64 Cb 0.10 -3.77 0.00 0.00 1.25 0.00 0.00 42.46 40.04 1f5m s ILE 64 CO 0.02 -0.10 0.18 -0.46 0.24 0.00 0.00 174.94 174.82 1f5m n ASN 65 N -0.08 0.36 -3.69 4.36 6.94 -0.82 -4.85 115.26 117.49 1f5m n ASN 65 Ca 0.04 -0.68 -0.13 0.00 -0.02 0.00 0.00 54.58 53.79 1f5m n ASN 65 Cb 0.52 0.62 -0.09 0.00 -2.36 0.00 0.00 39.78 38.48 1f5m n ASN 65 CO 0.00 0.00 0.00 0.86 -1.03 0.00 0.00 177.26 177.09 1f5m s TRP 66 N -0.62 -0.63 -0.20 -2.53 -0.00 -1.23 -4.03 118.94 109.70 1f5m s TRP 66 Ca 0.00 1.49 -0.04 0.00 -0.00 0.00 0.00 56.10 57.55 1f5m s TRP 66 Cb 0.00 0.24 0.09 0.00 -0.00 0.00 0.00 33.47 33.79 1f5m s TRP 66 CO 0.00 -0.31 0.20 0.00 -0.00 0.00 0.00 176.95 176.84 1f5m s ALA 67 N 0.45 -0.12 0.00 5.86 0.00 0.13 -1.29 121.76 126.79 1f5m s ALA 67 Ca -0.01 0.09 0.00 0.00 0.00 0.00 0.00 51.96 52.04 1f5m s ALA 67 Cb -0.04 -1.29 0.00 0.00 0.00 0.00 0.00 23.12 21.79 1f5m s ALA 67 CO -0.01 -1.23 0.00 0.41 0.00 0.00 0.00 175.76 174.92 1f5m n GLY 68 N 5.31 2.11 3.09 0.00 0.00 -0.18 -0.01 105.19 115.51 1f5m n GLY 68 Ca -0.06 -0.76 -0.14 0.00 0.00 0.00 0.00 46.02 45.06 1f5m n GLY 68 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1f5m s PHE 69 N -3.55 0.80 0.16 1.61 0.40 -0.61 0.64 117.98 117.43 1f5m s PHE 69 Ca 0.00 -0.48 0.11 0.00 -0.60 0.00 0.00 56.93 55.96 1f5m s PHE 69 Cb 0.00 -0.47 -0.04 0.00 0.51 0.00 0.00 43.02 43.02 1f5m s PHE 69 CO 0.00 -0.05 -0.25 0.71 0.70 0.00 0.00 175.22 176.33 1f5m s TYR 70 N -1.33 2.28 0.02 0.36 1.51 -0.91 -0.92 117.35 118.35 1f5m s TYR 70 Ca -0.08 -0.37 0.07 0.00 -1.01 0.00 0.00 57.07 55.68 1f5m s TYR 70 Cb -0.10 -1.18 -0.02 0.00 -0.11 0.00 0.00 41.96 40.55 1f5m s TYR 70 CO 0.01 0.41 -0.20 0.08 -1.11 0.00 0.00 175.55 174.74 1f5m s VAL 71 N -1.38 1.63 0.10 0.71 1.01 0.51 -1.02 120.40 121.96 1f5m s VAL 71 Ca 0.17 -1.04 -0.31 0.00 0.00 0.00 0.00 61.98 60.80 1f5m s VAL 71 Cb -0.09 -1.39 -0.09 0.00 0.00 0.00 0.00 36.38 34.81 1f5m s VAL 71 CO 0.08 0.32 1.75 -0.89 0.00 0.00 0.00 175.10 176.36 1f5m s THR 72 N -0.64 2.76 0.29 3.92 2.01 0.07 -0.04 115.64 124.00 1f5m s THR 72 Ca 0.08 0.24 -0.30 0.00 0.31 0.00 0.00 61.69 62.02 1f5m s THR 72 Cb -0.08 -3.16 -0.10 0.00 0.01 0.00 0.00 72.50 69.17 1f5m s THR 72 CO 0.01 -0.00 1.46 -1.58 -0.69 0.00 0.00 174.62 173.81 1f5m s GLN 73 N 2.70 4.23 0.48 4.92 0.74 0.11 -4.86 119.66 127.98 1f5m s GLN 73 Ca 0.78 2.39 0.19 0.00 0.05 0.00 0.00 55.36 58.76 1f5m s GLN 73 Cb -0.43 -3.06 1.19 0.00 1.10 0.00 0.00 33.01 31.81 1f5m s GLN 73 CO 0.35 -0.45 2.04 0.00 -0.55 0.00 0.00 175.29 176.68 1f5m h ALA 74 N 4.45 1.60 -3.00 1.58 0.00 -1.90 -3.43 119.26 118.56 1f5m h ALA 74 Ca -0.47 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.31 1f5m h ALA 74 Cb 1.22 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1f5m h ALA 74 CO 0.74 0.18 0.00 0.45 0.00 0.00 0.00 179.25 180.62 1f5m n SER 75 N -4.13 0.00 -3.11 0.00 2.88 -1.26 -5.04 113.62 102.95 1f5m n SER 75 Ca -0.02 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.52 1f5m n SER 75 Cb 0.22 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.68 1f5m n SER 75 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1f5m n GLU 76 N 0.00 1.75 -0.50 -1.46 1.02 -1.26 -4.91 120.64 115.28 1f5m n GLU 76 Ca 0.00 0.00 -0.21 0.00 -0.02 0.00 0.00 57.16 56.93 1f5m n GLU 76 Cb 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 31.44 31.38 1f5m n GLU 76 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1f5m n GLU 77 N 0.00 0.00 -0.63 3.49 2.13 -1.26 -4.44 120.64 119.93 1f5m n GLU 77 Ca 0.00 0.00 -0.28 0.00 0.66 0.00 0.00 57.16 57.54 1f5m n GLU 77 Cb 0.00 -0.49 -0.05 0.00 0.27 0.00 0.00 31.44 31.17 1f5m n GLU 77 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1f5m n ASN 78 N 1.78 0.40 -4.00 4.31 3.02 -1.26 -4.95 115.26 114.56 1f5m n ASN 78 Ca 0.13 0.37 -0.17 0.00 -0.03 0.00 0.00 54.58 54.88 1f5m n ASN 78 Cb -0.02 -0.41 -0.15 0.00 -0.61 0.00 0.00 39.78 38.60 1f5m n ASN 78 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1f5m s THR 79 N 2.38 0.60 -0.06 3.41 2.01 -1.26 -2.49 115.64 120.22 1f5m s THR 79 Ca 0.53 -0.33 -0.13 0.00 0.31 0.00 0.00 61.69 62.07 1f5m s THR 79 Cb -0.69 -0.50 -0.05 0.00 0.01 0.00 0.00 72.50 71.27 1f5m s THR 79 CO 0.32 0.16 0.34 -0.76 -0.69 0.00 0.00 174.62 173.99 1f5m s LEU 80 N -0.20 4.41 -0.05 4.42 2.01 0.30 0.03 118.68 129.61 1f5m s LEU 80 Ca 0.03 0.77 0.06 0.00 0.01 0.00 0.00 54.13 55.00 1f5m s LEU 80 Cb -0.03 -2.45 -0.01 0.00 0.01 0.00 0.00 46.19 43.71 1f5m s LEU 80 CO -0.00 0.28 -0.25 -0.51 1.01 0.00 0.00 176.35 176.88 1f5m s ILE 81 N -0.69 2.02 0.13 -0.59 1.10 0.95 -0.93 121.20 123.18 1f5m s ILE 81 Ca 0.21 -1.06 -0.34 0.00 -0.51 0.00 0.00 60.65 58.95 1f5m s ILE 81 Cb -0.15 -1.70 -0.17 0.00 0.15 0.00 0.00 42.46 40.59 1f5m s ILE 81 CO 0.10 0.56 1.11 -0.11 -2.11 0.00 0.00 174.94 174.49 1f5m n LEU 82 N 2.86 0.97 0.00 8.50 0.00 -0.47 -0.36 117.00 128.50 1f5m n LEU 82 Ca -0.17 1.14 0.00 0.00 0.00 0.00 0.00 56.01 56.98 1f5m n LEU 82 Cb 0.52 -1.13 0.00 0.00 0.00 0.00 0.00 43.42 42.81 1f5m n LEU 82 CO 0.25 -1.55 0.00 0.61 0.00 0.00 0.00 177.39 176.70 1f5m n GLY 83 N 1.99 4.78 3.71 -3.96 0.00 -0.10 -4.74 105.19 106.88 1f5m n GLY 83 Ca 0.17 -2.01 -0.38 0.00 0.00 0.00 0.00 46.02 43.79 1f5m n GLY 83 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1f5m n PRO 84 N 0.00 1.44 -3.43 1.61 -0.02 -1.26 -4.57 135.00 128.77 1f5m n PRO 84 Ca 0.00 0.54 -0.12 0.00 -2.02 0.00 0.00 63.50 61.90 1f5m n PRO 84 Cb 0.00 -2.47 -0.02 0.00 -0.02 0.00 0.00 33.50 30.99 1f5m n PRO 84 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 1f5m s PHE 85 N -1.34 -0.53 -0.15 6.00 -0.12 -1.26 -1.57 117.98 119.00 1f5m s PHE 85 Ca 0.74 0.32 -0.02 0.00 -0.05 0.00 0.00 56.93 57.93 1f5m s PHE 85 Cb -0.42 0.55 -0.02 0.00 -0.63 0.00 0.00 43.02 42.51 1f5m s PHE 85 CO 0.48 -0.84 -0.09 -0.65 -0.05 0.00 0.00 175.22 174.06 1f5m s GLN 86 N -3.73 3.45 0.00 1.99 -1.52 0.98 -4.97 119.66 115.86 1f5m s GLN 86 Ca 0.01 -0.63 0.00 0.00 -1.95 0.00 0.00 55.36 52.79 1f5m s GLN 86 Cb -0.01 -2.77 0.00 0.00 -0.22 0.00 0.00 33.01 30.01 1f5m s GLN 86 CO -0.13 0.14 0.00 0.41 -0.25 0.00 0.00 175.29 175.46 1f5m n GLY 87 N 3.78 0.93 3.94 3.09 0.00 -1.26 -0.69 105.19 114.97 1f5m n GLY 87 Ca -0.18 -1.82 -0.24 0.00 0.00 0.00 0.00 46.02 43.78 1f5m n GLY 87 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1f5m s LYS 88 N -1.99 3.10 0.24 1.61 1.02 -1.26 -5.02 119.74 117.45 1f5m s LYS 88 Ca 0.00 -0.31 -0.30 0.00 0.02 0.00 0.00 55.97 55.38 1f5m s LYS 88 Cb 0.00 -2.49 -0.15 0.00 -0.52 0.00 0.00 37.83 34.68 1f5m s LYS 88 CO 0.00 -0.33 1.06 0.28 -0.92 0.00 0.00 175.35 175.44 1f5m n VAL 89 N -2.18 1.58 -4.42 3.17 0.31 -1.26 -4.98 118.33 110.54 1f5m n VAL 89 Ca 0.02 -0.39 -0.21 0.00 -0.01 0.00 0.00 64.34 63.74 1f5m n VAL 89 Cb 0.57 -0.92 -0.10 0.00 -0.91 0.00 0.00 33.84 32.48 1f5m n VAL 89 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1f5m s ALA 90 N -0.72 2.29 0.33 3.52 0.00 -1.26 -4.78 121.76 121.15 1f5m s ALA 90 Ca 0.64 -1.91 -0.29 0.00 0.00 0.00 0.00 51.96 50.41 1f5m s ALA 90 Cb -0.76 0.28 -0.12 0.00 0.00 0.00 0.00 23.12 22.52 1f5m s ALA 90 CO 0.57 -0.12 1.41 0.00 0.00 0.00 0.00 175.76 177.61 1f5m h GLN 92 N 3.19 0.07 -2.71 0.00 7.50 -1.99 -3.41 115.11 117.76 1f5m h GLN 92 Ca -0.47 -0.09 -0.11 0.00 0.50 0.00 0.00 58.65 58.47 1f5m h GLN 92 Cb 1.26 0.03 -0.22 0.00 0.05 0.00 0.00 27.48 28.60 1f5m h GLN 92 CO 0.67 0.94 -0.18 1.41 -1.50 0.00 0.00 178.83 180.17 1f5m s MET 93 N -2.98 0.61 -0.04 1.46 -2.45 -1.26 -1.36 119.30 113.28 1f5m s MET 93 Ca -0.01 0.34 0.01 0.00 -1.25 0.00 0.00 55.69 54.79 1f5m s MET 93 Cb 0.10 0.29 0.02 0.00 1.25 0.00 0.00 34.83 36.49 1f5m s MET 93 CO 0.82 -0.12 -0.05 0.42 1.05 0.00 0.00 175.02 177.14 1f5m s ILE 94 N -0.35 0.53 0.34 10.11 1.01 -0.11 -4.99 121.20 127.74 1f5m s ILE 94 Ca -0.05 -0.13 -0.25 0.00 0.00 0.00 0.00 60.65 60.21 1f5m s ILE 94 Cb -0.03 -0.54 -0.10 0.00 0.01 0.00 0.00 42.46 41.80 1f5m s ILE 94 CO 0.03 0.21 0.95 -1.10 0.00 0.00 0.00 174.94 175.03 1f5m s GLN 95 N 0.80 4.52 0.44 2.79 -1.52 -1.26 0.11 119.66 125.53 1f5m s GLN 95 Ca -0.11 1.32 -0.25 0.00 -1.95 0.00 0.00 55.36 54.37 1f5m s GLN 95 Cb -0.13 -2.71 -0.09 0.00 -0.22 0.00 0.00 33.01 29.85 1f5m s GLN 95 CO 0.00 0.22 1.24 1.19 -0.25 0.00 0.00 175.29 177.69 1f5m n PHE 96 N 0.38 2.01 0.00 0.91 3.01 -1.04 -1.85 117.46 120.88 1f5m n PHE 96 Ca 0.03 0.50 0.00 0.00 1.01 0.00 0.00 57.45 58.99 1f5m n PHE 96 Cb 0.50 -2.35 0.00 0.00 -0.01 0.00 0.00 39.48 37.62 1f5m n PHE 96 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1f5m n GLY 97 N 0.86 1.81 3.51 1.37 0.00 0.17 -4.95 105.19 107.96 1f5m n GLY 97 Ca 0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.74 1f5m n GLY 97 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1f5m s LYS 98 N -0.49 3.74 0.37 1.61 -0.14 -0.77 -4.50 119.74 119.57 1f5m s LYS 98 Ca 0.00 -0.45 0.00 0.00 -1.36 0.00 0.00 55.97 54.16 1f5m s LYS 98 Cb 0.00 -3.18 0.00 0.00 -1.68 0.00 0.00 37.83 32.97 1f5m s LYS 98 CO 0.00 0.05 0.00 0.41 -0.76 0.00 0.00 175.35 175.05 1f5m n GLY 99 N 4.17 -1.99 0.25 -3.33 0.00 -1.15 -1.95 105.19 101.19 1f5m n GLY 99 Ca -0.17 -1.31 -0.07 0.00 0.00 0.00 0.00 46.02 44.47 1f5m n GLY 99 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1f5m h VAL 100 N -0.62 1.20 -0.23 1.61 2.07 -1.91 0.25 116.25 118.62 1f5m h VAL 100 Ca 0.01 -0.55 -0.03 0.00 0.82 0.00 0.00 66.70 66.95 1f5m h VAL 100 Cb 0.61 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 1f5m h VAL 100 CO 0.00 0.23 0.02 0.00 0.02 0.00 0.00 177.57 177.84 1f5m h GLY 102 N 0.18 0.00 1.26 0.00 0.00 -1.24 -1.09 103.07 102.17 1f5m h GLY 102 Ca 0.07 0.00 -0.22 0.00 0.00 0.00 0.00 47.33 47.17 1f5m h GLY 102 CO 0.01 0.00 -0.82 -0.84 0.00 0.00 0.00 176.54 174.89 1f5m h THR 103 N 0.00 1.30 -0.46 4.70 2.02 -0.73 0.53 112.91 120.26 1f5m h THR 103 Ca -0.00 -2.05 -0.07 0.00 0.77 0.00 0.00 66.41 65.05 1f5m h THR 103 Cb 0.45 2.07 -0.02 0.00 -1.74 0.00 0.00 68.15 68.91 1f5m h THR 103 CO 0.03 0.64 -0.01 0.00 0.37 0.00 0.00 175.52 176.55 1f5m h ALA 104 N 0.60 1.11 -0.37 6.16 0.00 -0.76 -1.35 119.26 124.65 1f5m h ALA 104 Ca -0.06 -0.26 -0.14 0.00 0.00 0.00 0.00 54.91 54.44 1f5m h ALA 104 Cb 1.44 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 19.04 1f5m h ALA 104 CO 0.16 0.56 -0.33 0.00 0.00 0.00 0.00 179.25 179.65 1f5m h ALA 105 N 1.27 0.54 0.03 0.00 0.00 -0.94 -1.11 119.26 119.05 1f5m h ALA 105 Ca 0.14 -0.43 -0.22 0.00 0.00 0.00 0.00 54.91 54.40 1f5m h ALA 105 Cb 0.45 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1f5m h ALA 105 CO 0.02 0.60 -1.00 0.66 0.00 0.00 0.00 179.25 179.53 1f5m h SER 106 N 0.68 0.20 1.19 0.00 4.64 -1.15 -3.32 113.55 115.80 1f5m h SER 106 Ca 0.06 -0.19 -0.03 0.00 -0.47 0.00 0.00 61.79 61.16 1f5m h SER 106 Cb 0.91 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.93 1f5m h SER 106 CO 0.08 1.08 -0.83 0.71 -0.87 0.00 0.00 176.83 177.01 1f5m h THR 107 N 0.06 0.12 -3.71 2.95 1.35 -1.31 -3.47 112.91 108.90 1f5m h THR 107 Ca -0.05 -1.21 -0.36 0.00 -0.55 0.00 0.00 66.41 64.23 1f5m h THR 107 Cb 1.70 1.73 0.04 0.00 -1.73 0.00 0.00 68.15 69.89 1f5m h THR 107 CO 0.15 0.07 -0.52 0.29 -0.25 0.00 0.00 175.52 175.25 1f5m n LYS 108 N -2.83 -3.76 -4.19 4.72 5.02 -0.42 -4.99 118.16 111.72 1f5m n LYS 108 Ca -0.00 0.83 -0.14 0.00 -2.02 0.00 0.00 58.31 56.97 1f5m n LYS 108 Cb 0.60 -5.45 -0.11 0.00 -0.02 0.00 0.00 35.03 30.06 1f5m n LYS 108 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 1f5m s GLU 109 N -5.43 0.87 0.30 1.97 2.56 -1.22 -4.92 118.70 112.84 1f5m s GLU 109 Ca 0.21 -1.21 -0.29 0.00 0.00 0.00 0.00 54.97 53.68 1f5m s GLU 109 Cb -0.09 -0.52 -0.10 0.00 2.00 0.00 0.00 34.13 35.42 1f5m s GLU 109 CO 0.26 0.07 1.17 0.99 -0.56 0.00 0.00 175.26 177.20 1f5m s THR 110 N -2.64 3.22 -0.11 -1.70 2.01 -1.26 -4.46 115.64 110.70 1f5m s THR 110 Ca 0.07 1.23 0.03 0.00 0.31 0.00 0.00 61.69 63.33 1f5m s THR 110 Cb -0.02 -3.78 0.00 0.00 0.01 0.00 0.00 72.50 68.72 1f5m s THR 110 CO -0.00 0.29 -0.22 -1.10 -0.69 0.00 0.00 174.62 172.89 1f5m s GLN 111 N -1.59 3.08 -0.24 4.92 -1.52 0.32 -5.00 119.66 119.64 1f5m s GLN 111 Ca 0.46 -0.85 0.02 0.00 -1.95 0.00 0.00 55.36 53.05 1f5m s GLN 111 Cb -0.34 -2.38 0.05 0.00 -0.22 0.00 0.00 33.01 30.12 1f5m s GLN 111 CO 0.45 0.13 -0.13 0.42 -0.25 0.00 0.00 175.29 175.91 1f5m s ILE 112 N 0.48 2.10 -0.30 1.08 1.01 -1.26 -0.89 121.20 123.42 1f5m s ILE 112 Ca -0.15 -1.45 -0.05 0.00 0.00 0.00 0.00 60.65 59.01 1f5m s ILE 112 Cb -0.17 -2.15 0.03 0.00 0.01 0.00 0.00 42.46 40.18 1f5m s ILE 112 CO 0.06 0.10 0.05 -0.69 0.00 0.00 0.00 174.94 174.45 1f5m s VAL 113 N 1.16 3.49 0.09 2.92 1.01 -0.03 -4.99 120.40 124.05 1f5m s VAL 113 Ca -0.06 -1.07 0.24 0.00 0.00 0.00 0.00 61.98 61.09 1f5m s VAL 113 Cb -0.18 -2.91 0.24 0.00 0.00 0.00 0.00 36.38 33.53 1f5m s VAL 113 CO -0.07 -0.04 1.81 1.55 0.00 0.00 0.00 175.10 178.35 1f5m h PRO 114 N 8.14 0.00 -1.49 2.72 0.13 -1.88 -1.49 132.00 138.12 1f5m h PRO 114 Ca -0.26 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.79 1f5m h PRO 114 Cb 1.09 0.00 -0.26 0.00 0.13 0.00 0.00 31.00 31.96 1f5m h PRO 114 CO 0.58 0.21 -0.44 0.34 -0.23 0.00 0.00 178.00 178.46 1f5m s ASP 115 N -6.16 -0.37 0.06 1.44 -1.08 -1.24 0.09 116.67 109.41 1f5m s ASP 115 Ca 0.01 0.16 0.19 0.00 -0.52 0.00 0.00 52.55 52.39 1f5m s ASP 115 Cb 0.10 1.49 0.81 0.00 -1.46 0.00 0.00 42.92 43.86 1f5m s ASP 115 CO 0.64 -0.31 1.61 1.33 0.52 0.00 0.00 175.17 178.96 1f5m n VAL 116 N 5.38 0.77 1.34 1.11 0.24 -0.27 -1.86 118.33 125.04 1f5m n VAL 116 Ca -0.00 0.17 0.14 0.00 -2.04 0.00 0.00 64.34 62.61 1f5m n VAL 116 Cb 0.51 -0.92 0.59 0.00 -1.47 0.00 0.00 33.84 32.54 1f5m n VAL 116 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1f5m n ASN 117 N -1.69 0.43 -0.70 -1.34 3.02 -1.26 -2.75 115.26 110.96 1f5m n ASN 117 Ca 0.04 -0.45 0.08 0.00 -0.03 0.00 0.00 54.58 54.22 1f5m n ASN 117 Cb 0.23 -0.09 0.21 0.00 -0.61 0.00 0.00 39.78 39.52 1f5m n ASN 117 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1f5m n LYS 118 N -1.04 2.71 -3.69 3.52 5.02 -0.78 -4.91 118.16 118.98 1f5m n LYS 118 Ca 0.13 -2.61 -0.39 0.00 -2.02 0.00 0.00 58.31 53.43 1f5m n LYS 118 Cb 0.29 -1.66 -0.11 0.00 -0.02 0.00 0.00 35.03 33.53 1f5m n LYS 118 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 1f5m s TYR 119 N -2.42 3.34 0.13 2.13 5.04 -1.11 -5.04 117.35 119.42 1f5m s TYR 119 Ca 0.36 -1.64 -0.33 0.00 -2.44 0.00 0.00 57.07 53.01 1f5m s TYR 119 Cb 0.28 -2.73 -0.13 0.00 0.35 0.00 0.00 41.96 39.73 1f5m s TYR 119 CO 0.09 -0.83 1.65 -2.30 -1.34 0.00 0.00 175.55 172.83 1f5m n PRO 120 N 4.82 2.28 -0.51 4.97 -0.02 -1.26 -1.78 135.00 143.50 1f5m n PRO 120 Ca -0.10 0.82 0.00 0.00 -2.02 0.00 0.00 63.50 62.21 1f5m n PRO 120 Cb 0.43 -2.62 0.00 0.00 -0.02 0.00 0.00 33.50 31.29 1f5m n PRO 120 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1f5m n GLY 121 N 3.66 0.75 3.67 -1.23 0.00 -1.26 -4.83 105.19 105.95 1f5m n GLY 121 Ca 0.18 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.76 1f5m n GLY 121 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1f5m n HIS 122 N -2.25 2.08 -3.88 1.61 -0.00 -0.73 -2.95 115.22 109.10 1f5m n HIS 122 Ca 0.00 0.51 -0.34 0.00 -0.00 0.00 0.00 57.72 57.89 1f5m n HIS 122 Cb 0.00 -2.42 -0.13 0.00 -0.00 0.00 0.00 29.99 27.44 1f5m n HIS 122 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.34 176.76 1f5m s ILE 123 N -0.53 2.87 -0.08 3.57 1.01 -1.26 -4.93 121.20 121.85 1f5m s ILE 123 Ca 0.63 -2.13 -0.24 0.00 0.00 0.00 0.00 60.65 58.91 1f5m s ILE 123 Cb -0.63 -3.00 -0.03 0.00 0.01 0.00 0.00 42.46 38.80 1f5m s ILE 123 CO 0.55 -0.62 0.74 0.00 0.00 0.00 0.00 174.94 175.62 1f5m s ALA 124 N 1.05 3.35 -0.19 9.38 0.00 -1.26 -4.91 121.76 129.18 1f5m s ALA 124 Ca 0.08 0.15 0.18 0.00 0.00 0.00 0.00 51.96 52.37 1f5m s ALA 124 Cb -0.21 -3.03 -0.25 0.00 0.00 0.00 0.00 23.12 19.63 1f5m s ALA 124 CO -0.06 -0.20 0.09 0.00 0.00 0.00 0.00 175.76 175.60 1f5m s ASP 126 N -5.39 2.88 0.60 0.00 -1.08 -1.26 -4.80 116.67 107.62 1f5m s ASP 126 Ca -0.10 -0.57 0.33 0.00 -0.52 0.00 0.00 52.55 51.69 1f5m s ASP 126 Cb 0.06 -1.26 1.92 0.00 -1.46 0.00 0.00 42.92 42.18 1f5m s ASP 126 CO 0.82 -0.05 2.26 1.23 0.52 0.00 0.00 175.17 179.95 1f5m h GLY 127 N 8.01 0.00 1.33 2.66 0.00 -1.99 -2.53 103.07 110.56 1f5m h GLY 127 Ca -0.39 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.94 1f5m h GLY 127 CO 0.55 0.00 -0.18 1.18 0.00 0.00 0.00 176.54 178.10 1f5m n GLU 128 N -3.64 0.25 -1.99 4.80 1.02 -1.26 -4.88 120.64 114.94 1f5m n GLU 128 Ca -0.03 -0.08 -0.42 0.00 -0.02 0.00 0.00 57.16 56.61 1f5m n GLU 128 Cb 0.10 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 29.99 1f5m n GLU 128 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1f5m s THR 129 N -2.81 2.81 -0.14 2.62 2.01 -0.95 -4.63 115.64 114.55 1f5m s THR 129 Ca 0.19 0.57 0.04 0.00 0.31 0.00 0.00 61.69 62.80 1f5m s THR 129 Cb 0.19 -3.37 -0.11 0.00 0.01 0.00 0.00 72.50 69.22 1f5m s THR 129 CO 0.56 0.04 -0.07 0.29 -0.69 0.00 0.00 174.62 174.75 1f5m n LYS 130 N 4.05 1.02 -4.22 4.92 5.02 0.36 -4.82 118.16 124.48 1f5m n LYS 130 Ca 0.13 0.05 -0.13 0.00 -2.02 0.00 0.00 58.31 56.35 1f5m n LYS 130 Cb 0.39 -1.30 -0.10 0.00 -0.02 0.00 0.00 35.03 34.01 1f5m n LYS 130 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1f5m s SER 131 N -5.06 1.34 -0.07 4.39 1.04 -0.95 -1.12 113.70 113.28 1f5m s SER 131 Ca -0.15 -1.08 -0.26 0.00 0.48 0.00 0.00 55.95 54.95 1f5m s SER 131 Cb 0.04 0.08 0.06 0.00 0.10 0.00 0.00 66.02 66.30 1f5m s SER 131 CO 0.39 -0.47 0.59 -0.70 0.98 0.00 0.00 173.24 174.02 1f5m s GLU 132 N -3.85 0.91 -0.04 4.02 2.12 -0.56 -0.33 118.70 120.98 1f5m s GLU 132 Ca 0.18 0.27 0.02 0.00 0.36 0.00 0.00 54.97 55.80 1f5m s GLU 132 Cb 0.05 0.43 0.01 0.00 0.26 0.00 0.00 34.13 34.88 1f5m s GLU 132 CO 0.00 -0.25 -0.09 -1.50 -0.54 0.00 0.00 175.26 172.88 1f5m s ILE 133 N -0.95 0.83 -0.08 -3.70 2.07 -0.62 -0.85 121.20 117.90 1f5m s ILE 133 Ca -0.10 -0.36 0.01 0.00 -1.41 0.00 0.00 60.65 58.79 1f5m s ILE 133 Cb -0.02 -0.76 0.02 0.00 0.13 0.00 0.00 42.46 41.83 1f5m s ILE 133 CO 0.07 0.27 -0.08 -0.69 -1.91 0.00 0.00 174.94 172.60 1f5m s VAL 134 N 0.40 0.95 -0.15 4.00 1.01 -0.06 -1.02 120.40 125.52 1f5m s VAL 134 Ca -0.07 -0.30 0.02 0.00 0.00 0.00 0.00 61.98 61.63 1f5m s VAL 134 Cb -0.11 -0.94 0.01 0.00 0.00 0.00 0.00 36.38 35.34 1f5m s VAL 134 CO 0.01 0.34 -0.20 -0.69 0.00 0.00 0.00 175.10 174.56 1f5m s VAL 135 N 1.25 2.26 0.48 2.92 1.01 0.11 -0.52 120.40 127.90 1f5m s VAL 135 Ca -0.04 -0.91 -0.20 0.00 0.00 0.00 0.00 61.98 60.83 1f5m s VAL 135 Cb -0.14 -1.92 -0.09 0.00 0.00 0.00 0.00 36.38 34.23 1f5m s VAL 135 CO -0.03 0.54 1.01 -2.16 0.00 0.00 0.00 175.10 174.46 1f5m s PRO 136 N 0.83 3.91 -0.35 2.72 0.04 -1.26 0.37 135.00 141.26 1f5m s PRO 136 Ca -0.06 1.25 -0.09 0.00 0.04 0.00 0.00 61.00 62.14 1f5m s PRO 136 Cb -0.15 -2.12 0.03 0.00 0.04 0.00 0.00 34.50 32.29 1f5m s PRO 136 CO -0.02 -0.32 0.16 0.42 0.04 0.00 0.00 177.00 177.28 1f5m s ILE 137 N -2.12 4.29 -0.14 0.56 1.01 0.12 -4.86 121.20 120.05 1f5m s ILE 137 Ca 0.65 -0.89 -0.12 0.00 0.00 0.00 0.00 60.65 60.29 1f5m s ILE 137 Cb -0.14 -3.37 -0.05 0.00 0.01 0.00 0.00 42.46 38.92 1f5m s ILE 137 CO 0.20 -0.17 0.24 -0.63 0.00 0.00 0.00 174.94 174.57 1f5m s ILE 138 N 1.51 5.34 0.96 2.92 -1.09 -1.26 0.76 121.20 130.33 1f5m s ILE 138 Ca 0.01 0.43 -0.16 0.00 -2.23 0.00 0.00 60.65 58.70 1f5m s ILE 138 Cb -0.19 -3.55 0.20 0.00 -1.58 0.00 0.00 42.46 37.34 1f5m s ILE 138 CO 0.05 0.47 1.32 -0.94 -1.23 0.00 0.00 174.94 174.61 1f5m s SER 139 N -0.06 3.11 0.30 3.58 1.04 -0.06 -4.82 113.70 116.80 1f5m s SER 139 Ca 0.15 0.22 -0.01 0.00 0.48 0.00 0.00 55.95 56.78 1f5m s SER 139 Cb -0.13 -0.25 0.47 0.00 0.10 0.00 0.00 66.02 66.20 1f5m s SER 139 CO 0.04 -2.73 1.97 0.78 0.98 0.00 0.00 173.24 174.27 1f5m h ASN 140 N -1.62 0.91 -0.10 7.02 2.35 -1.93 -1.41 115.58 120.80 1f5m h ASN 140 Ca -0.44 -0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.28 1f5m h ASN 140 Cb 1.23 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 39.37 1f5m h ASN 140 CO 0.37 0.67 0.00 0.47 -1.65 0.00 0.00 177.43 177.29 1f5m n ASP 141 N -4.41 0.57 -0.14 5.81 8.00 -1.26 -4.90 116.55 120.23 1f5m n ASP 141 Ca 0.09 -1.93 -0.02 0.00 0.71 0.00 0.00 54.79 53.64 1f5m n ASP 141 Cb 0.04 -0.07 -0.01 0.00 -0.02 0.00 0.00 41.12 41.07 1f5m n ASP 141 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1f5m n GLY 142 N 0.71 0.47 3.92 0.44 0.00 -0.53 -5.05 105.19 105.15 1f5m n GLY 142 Ca 0.05 -0.98 -0.28 0.00 0.00 0.00 0.00 46.02 44.82 1f5m n GLY 142 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1f5m s LYS 143 N -2.50 3.38 -0.09 1.61 -0.14 -1.26 -4.81 119.74 115.94 1f5m s LYS 143 Ca 0.00 -0.57 -0.30 0.00 -1.36 0.00 0.00 55.97 53.74 1f5m s LYS 143 Cb 0.00 -2.96 -0.02 0.00 -1.68 0.00 0.00 37.83 33.17 1f5m s LYS 143 CO 0.00 0.55 1.17 0.99 -0.76 0.00 0.00 175.35 177.30 1f5m s THR 144 N -1.66 4.37 -0.20 2.17 2.01 -1.26 -0.88 115.64 120.18 1f5m s THR 144 Ca 0.34 1.67 0.22 0.00 0.31 0.00 0.00 61.69 64.24 1f5m s THR 144 Cb -0.12 -4.08 -0.25 0.00 0.01 0.00 0.00 72.50 68.07 1f5m s THR 144 CO 0.28 -0.03 0.67 0.18 -0.69 0.00 0.00 174.62 175.02 1f5m n LEU 145 N 5.46 0.29 0.00 4.42 4.77 0.23 -4.75 117.00 127.42 1f5m n LEU 145 Ca 0.11 0.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 1f5m n LEU 145 Cb 0.46 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.53 1f5m n LEU 145 CO 0.55 -0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.20 1f5m n GLY 146 N 1.27 -2.07 3.17 -0.72 0.00 -1.22 -0.76 105.19 104.87 1f5m n GLY 146 Ca -0.02 -1.23 -0.11 0.00 0.00 0.00 0.00 46.02 44.66 1f5m n GLY 146 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1f5m s VAL 147 N -2.47 0.71 -0.17 1.61 -7.23 -0.18 0.11 120.40 112.77 1f5m s VAL 147 Ca 0.00 -1.89 -0.05 0.00 -1.81 0.00 0.00 61.98 58.23 1f5m s VAL 147 Cb 0.00 -1.62 -0.03 0.00 0.56 0.00 0.00 36.38 35.29 1f5m s VAL 147 CO 0.00 -0.83 0.01 -0.63 -0.31 0.00 0.00 175.10 173.33 1f5m s ILE 148 N -3.46 4.28 -0.07 -0.62 1.01 0.16 -2.15 121.20 120.35 1f5m s ILE 148 Ca 0.11 -0.22 0.01 0.00 0.00 0.00 0.00 60.65 60.54 1f5m s ILE 148 Cb 0.04 -2.90 0.02 0.00 0.01 0.00 0.00 42.46 39.63 1f5m s ILE 148 CO -0.04 0.48 -0.06 -0.62 0.00 0.00 0.00 174.94 174.69 1f5m s ASP 149 N 0.39 1.55 -0.07 3.58 2.15 0.21 -0.72 116.67 123.75 1f5m s ASP 149 Ca -0.01 -0.20 0.03 0.00 0.43 0.00 0.00 52.55 52.80 1f5m s ASP 149 Cb -0.13 -0.63 0.01 0.00 -0.30 0.00 0.00 42.92 41.86 1f5m s ASP 149 CO 0.02 -0.07 -0.17 -0.63 -0.17 0.00 0.00 175.17 174.15 1f5m s ILE 150 N 1.22 1.48 0.12 4.11 1.01 -0.19 -1.01 121.20 127.95 1f5m s ILE 150 Ca -0.05 -0.69 0.05 0.00 0.00 0.00 0.00 60.65 59.96 1f5m s ILE 150 Cb -0.14 -1.31 -0.04 0.00 0.01 0.00 0.00 42.46 40.98 1f5m s ILE 150 CO -0.02 0.43 0.04 -1.81 0.00 0.00 0.00 174.94 173.58 1f5m s ASP 151 N 0.48 5.16 0.02 3.58 1.01 -0.41 -1.59 116.67 124.91 1f5m s ASP 151 Ca -0.15 -0.19 0.05 0.00 0.71 0.00 0.00 52.55 52.98 1f5m s ASP 151 Cb -0.16 -1.26 -0.02 0.00 1.01 0.00 0.00 42.92 42.50 1f5m s ASP 151 CO 0.05 0.13 -0.15 0.00 0.21 0.00 0.00 175.17 175.41 1f5m n LEU 153 N 2.24 0.03 -4.50 0.00 4.77 0.17 -0.49 117.00 119.23 1f5m n LEU 153 Ca -0.16 0.17 -0.26 0.00 -0.03 0.00 0.00 56.01 55.73 1f5m n LEU 153 Cb 0.55 -0.19 -0.10 0.00 -2.33 0.00 0.00 43.42 41.35 1f5m n LEU 153 CO 0.23 0.01 -0.47 -1.81 -1.33 0.00 0.00 177.39 174.02 1f5m s ASP 154 N -2.38 3.81 0.69 -1.43 1.01 -1.26 -4.48 116.67 112.63 1f5m s ASP 154 Ca 0.35 -0.78 -0.15 0.00 0.71 0.00 0.00 52.55 52.68 1f5m s ASP 154 Cb 0.21 -0.46 0.02 0.00 1.01 0.00 0.00 42.92 43.69 1f5m s ASP 154 CO 0.43 0.09 1.13 -0.31 0.21 0.00 0.00 175.17 176.73 1f5m s TYR 155 N -1.87 2.46 -1.40 4.23 1.51 -1.26 -3.06 117.35 117.95 1f5m s TYR 155 Ca 0.24 1.57 -0.09 0.00 -1.01 0.00 0.00 57.07 57.79 1f5m s TYR 155 Cb -0.08 -3.24 0.01 0.00 -0.11 0.00 0.00 41.96 38.54 1f5m s TYR 155 CO 0.13 -1.93 0.33 -1.91 -1.11 0.00 0.00 175.55 171.06 1f5m n GLU 156 N -2.58 -1.57 0.19 -0.62 2.13 0.11 -4.89 120.64 113.42 1f5m n GLU 156 Ca 0.11 0.22 0.09 0.00 0.66 0.00 0.00 57.16 58.24 1f5m n GLU 156 Cb 0.52 -3.73 0.13 0.00 0.27 0.00 0.00 31.44 28.63 1f5m n GLU 156 CO 0.00 0.00 0.00 0.78 -0.41 0.00 0.00 177.13 177.50 1f5m h GLY 157 N -1.98 0.00 -3.74 8.31 0.00 -1.85 -3.47 103.07 100.35 1f5m h GLY 157 Ca -0.66 0.00 -0.67 0.00 0.00 0.00 0.00 47.33 46.00 1f5m h GLY 157 CO 0.63 0.00 -0.82 -1.36 0.00 0.00 0.00 176.54 174.99 1f5m s PHE 158 N -3.14 2.43 0.00 5.60 0.40 -1.26 -5.04 117.98 116.97 1f5m s PHE 158 Ca 0.06 -0.31 0.00 0.00 -0.60 0.00 0.00 56.93 56.07 1f5m s PHE 158 Cb 0.06 -1.26 0.00 0.00 0.51 0.00 0.00 43.02 42.33 1f5m s PHE 158 CO 0.69 0.42 0.00 -0.40 0.70 0.00 0.00 175.22 176.63 1f5m n ASP 159 N 0.60 0.00 0.28 1.36 5.68 -1.26 -4.97 116.55 118.25 1f5m n ASP 159 Ca -0.15 -0.87 0.18 0.00 -0.50 0.00 0.00 54.79 53.45 1f5m n ASP 159 Cb 0.54 0.00 0.96 0.00 -1.14 0.00 0.00 41.12 41.48 1f5m n ASP 159 CO 0.00 0.00 0.00 1.12 -1.33 0.00 0.00 177.20 176.99 1f5m h HIS 160 N 0.87 0.00 -0.28 2.11 2.07 -2.01 -1.86 115.15 116.05 1f5m h HIS 160 Ca 0.00 0.00 -0.08 0.00 -2.85 0.00 0.00 60.37 57.44 1f5m h HIS 160 Cb 0.00 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 29.97 1f5m h HIS 160 CO 0.00 0.00 -0.12 0.28 -3.07 0.00 0.00 177.93 175.02 1f5m h VAL 161 N 0.00 1.29 -0.51 6.12 2.07 -1.99 -0.44 116.25 122.80 1f5m h VAL 161 Ca 0.02 -1.20 -0.08 0.00 0.82 0.00 0.00 66.70 66.26 1f5m h VAL 161 Cb 0.19 1.48 -0.02 0.00 -1.52 0.00 0.00 31.29 31.42 1f5m h VAL 161 CO -0.00 0.38 -0.02 0.44 0.02 0.00 0.00 177.57 178.39 1f5m h ASP 162 N 0.32 0.84 -0.51 0.57 3.32 -1.75 -1.53 116.42 117.68 1f5m h ASP 162 Ca 0.06 -0.22 -0.04 0.00 0.02 0.00 0.00 57.03 56.85 1f5m h ASP 162 Cb 0.63 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.94 1f5m h ASP 162 CO 0.04 0.92 0.15 0.50 -1.72 0.00 0.00 179.24 179.12 1f5m h LYS 163 N 0.80 0.80 -0.45 3.56 3.64 -1.33 0.24 116.57 123.82 1f5m h LYS 163 Ca 0.15 -0.18 -0.07 0.00 -1.27 0.00 0.00 60.65 59.28 1f5m h LYS 163 Cb 0.51 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.20 1f5m h LYS 163 CO 0.03 0.75 0.02 0.93 -2.27 0.00 0.00 179.45 178.90 1f5m h GLU 164 N 0.69 0.79 -0.19 1.90 5.08 -0.79 0.06 114.58 122.12 1f5m h GLU 164 Ca 0.16 -0.24 -0.05 0.00 -1.00 0.00 0.00 59.36 58.23 1f5m h GLU 164 Cb 0.29 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 1f5m h GLU 164 CO -0.00 0.84 -0.06 0.35 -1.00 0.00 0.00 179.01 179.13 1f5m h PHE 165 N 0.64 0.43 -0.55 4.33 3.57 -1.21 -2.87 116.94 121.29 1f5m h PHE 165 Ca 0.13 -0.10 -0.07 0.00 3.53 0.00 0.00 57.97 61.47 1f5m h PHE 165 Cb 0.47 -0.10 -0.02 0.00 2.79 0.00 0.00 35.95 39.09 1f5m h PHE 165 CO 0.04 0.65 0.07 -0.07 -2.23 0.00 0.00 178.31 176.77 1f5m h LEU 166 N 0.09 0.83 -1.20 0.59 3.38 -0.84 -0.42 115.31 117.74 1f5m h LEU 166 Ca 0.05 -0.18 -0.06 0.00 0.09 0.00 0.00 57.88 57.78 1f5m h LEU 166 Cb 0.52 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 1f5m h LEU 166 CO 0.02 0.85 -0.05 -0.33 0.09 0.00 0.00 178.44 179.03 1f5m h GLU 167 N 0.83 0.49 -0.21 1.13 5.08 -0.97 0.19 114.58 121.12 1f5m h GLU 167 Ca 0.17 -0.12 -0.06 0.00 -1.00 0.00 0.00 59.36 58.35 1f5m h GLU 167 Cb 0.39 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 1f5m h GLU 167 CO 0.01 0.56 -0.12 0.87 -1.00 0.00 0.00 179.01 179.33 1f5m h LYS 168 N 0.47 0.45 -0.63 2.33 1.57 -1.14 -2.48 116.57 117.13 1f5m h LYS 168 Ca 0.10 -0.20 -0.01 0.00 -1.87 0.00 0.00 60.65 58.67 1f5m h LYS 168 Cb 0.38 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.65 1f5m h LYS 168 CO 0.02 0.74 0.37 1.25 -0.57 0.00 0.00 179.45 181.26 1f5m h LEU 169 N 0.14 0.76 -1.01 2.94 5.85 -0.58 -1.36 115.31 122.06 1f5m h LEU 169 Ca 0.04 -0.05 -0.07 0.00 0.84 0.00 0.00 57.88 58.65 1f5m h LEU 169 Cb 0.62 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.44 1f5m h LEU 169 CO 0.03 0.60 -0.01 0.00 -0.34 0.00 0.00 178.44 178.73 1f5m h ALA 170 N 1.53 1.18 -0.02 1.25 0.00 -0.76 -0.40 119.26 122.04 1f5m h ALA 170 Ca 0.23 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1f5m h ALA 170 Cb -0.01 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 1f5m h ALA 170 CO -0.04 0.53 0.01 0.87 0.00 0.00 0.00 179.25 180.62 1f5m h LYS 171 N 0.66 0.03 -0.62 0.00 1.57 -0.83 -1.50 116.57 115.89 1f5m h LYS 171 Ca 0.13 -0.00 0.08 0.00 -1.87 0.00 0.00 60.65 58.98 1f5m h LYS 171 Cb 0.42 -0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.66 1f5m h LYS 171 CO 0.02 0.18 0.28 -0.07 -0.57 0.00 0.00 179.45 179.29 1f5m h LEU 172 N -0.13 0.36 -0.38 2.94 3.38 -0.92 -1.15 115.31 119.40 1f5m h LEU 172 Ca 0.01 0.06 0.02 0.00 0.09 0.00 0.00 57.88 58.05 1f5m h LEU 172 Cb 0.16 -0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 1f5m h LEU 172 CO -0.00 0.22 0.21 0.40 0.09 0.00 0.00 178.44 179.36 1f5m h ILE 173 N 0.51 1.01 -0.47 1.22 2.04 -0.86 -0.74 117.51 120.22 1f5m h ILE 173 Ca 0.30 -0.15 -0.05 0.00 1.00 0.00 0.00 64.86 65.96 1f5m h ILE 173 Cb 0.29 0.55 -0.02 0.00 -0.74 0.00 0.00 36.82 36.90 1f5m h ILE 173 CO -0.24 0.08 0.10 -1.13 0.00 0.00 0.00 178.15 176.95 1f5m h ASN 174 N 0.43 0.67 1.32 1.72 -0.73 -0.51 0.02 115.58 118.50 1f5m h ASN 174 Ca 0.16 -0.12 -0.07 0.00 1.87 0.00 0.00 56.30 58.14 1f5m h ASN 174 Cb 0.03 -0.17 -0.01 0.00 0.27 0.00 0.00 38.32 38.44 1f5m h ASN 174 CO -0.09 0.68 -0.32 0.11 -0.37 0.00 0.00 177.43 177.44 1f5m h LYS 175 N 0.70 0.00 -0.01 6.67 1.79 -0.89 -3.31 116.57 121.52 1f5m h LYS 175 Ca 0.15 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.62 1f5m h LYS 175 Cb 0.29 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.94 1f5m h LYS 175 CO 0.00 0.32 -0.40 -1.13 -1.08 0.00 0.00 179.45 177.16 1f5m n SER 176 N -3.28 1.46 -4.32 0.86 3.41 -0.31 -4.99 113.62 106.45 1f5m n SER 176 Ca 0.01 -1.23 -0.24 0.00 -0.26 0.00 0.00 58.87 57.16 1f5m n SER 176 Cb 0.58 0.56 -0.12 0.00 -0.26 0.00 0.00 64.21 64.97 1f5m n SER 176 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1f5m s VAL 178 N -1.51 3.39 -2.65 0.00 1.01 -0.04 -4.82 120.40 115.77 1f5m s VAL 178 Ca 0.11 -0.99 0.27 0.00 0.00 0.00 0.00 61.98 61.37 1f5m s VAL 178 Cb -0.08 -2.80 0.44 0.00 0.00 0.00 0.00 36.38 33.94 1f5m s VAL 178 CO 0.06 0.05 1.60 0.49 0.00 0.00 0.00 175.10 177.29