#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hof s MET 2 N 0.00 1.80 -0.12 -0.52 1.75 -0.54 -1.07 119.30 120.60 3hof s MET 2 Ca 0.00 -0.37 0.03 0.00 -1.25 0.00 0.00 55.69 54.10 3hof s MET 2 Cb 0.00 -1.73 0.00 0.00 2.84 0.00 0.00 34.83 35.94 3hof s MET 2 CO 0.00 -0.22 -0.23 0.12 -0.65 0.00 0.00 175.02 174.05 3hof s PHE 3 N 1.50 2.57 -0.06 4.11 5.36 0.10 -1.20 117.98 130.36 3hof s PHE 3 Ca 0.02 -1.17 0.04 0.00 -0.96 0.00 0.00 56.93 54.87 3hof s PHE 3 Cb -0.13 -1.74 -0.00 0.00 -0.34 0.00 0.00 43.02 40.81 3hof s PHE 3 CO -0.07 -0.50 -0.20 0.42 -1.46 0.00 0.00 175.22 173.41 3hof s ILE 4 N 0.57 1.66 -0.10 3.12 1.01 -0.17 -1.21 121.20 126.08 3hof s ILE 4 Ca -0.13 -0.83 0.01 0.00 0.00 0.00 0.00 60.65 59.70 3hof s ILE 4 Cb -0.17 -1.43 0.02 0.00 0.01 0.00 0.00 42.46 40.89 3hof s ILE 4 CO 0.04 0.47 -0.13 0.54 0.00 0.00 0.00 174.94 175.86 3hof s VAL 5 N 0.10 1.30 -0.16 2.92 0.11 0.01 -1.22 120.40 123.47 3hof s VAL 5 Ca -0.07 -0.53 -0.04 0.00 -2.93 0.00 0.00 61.98 58.41 3hof s VAL 5 Cb -0.14 -1.21 -0.03 0.00 -1.53 0.00 0.00 36.38 33.47 3hof s VAL 5 CO 0.04 0.40 -0.03 0.20 -3.33 0.00 0.00 175.10 172.38 3hof s ASN 6 N 1.05 4.84 0.00 3.54 -0.87 -0.04 0.17 114.94 123.63 3hof s ASN 6 Ca -0.06 -0.12 -0.12 0.00 -1.57 0.00 0.00 52.86 50.98 3hof s ASN 6 Cb -0.15 -1.79 0.01 0.00 -0.02 0.00 0.00 41.25 39.31 3hof s ASN 6 CO -0.02 0.16 0.25 0.28 -2.57 0.00 0.00 177.10 175.21 3hof s THR 7 N 0.39 0.07 -1.77 1.60 -1.32 -0.04 -1.09 115.64 113.48 3hof s THR 7 Ca -0.04 -0.62 0.29 0.00 -1.21 0.00 0.00 61.69 60.12 3hof s THR 7 Cb -0.14 -0.65 0.52 0.00 -1.51 0.00 0.00 72.50 70.72 3hof s THR 7 CO 0.03 -0.34 1.90 -0.46 -2.21 0.00 0.00 174.62 173.54 3hof n ASN 8 N 1.15 0.51 -4.77 8.08 6.94 -1.24 -1.45 115.26 124.47 3hof n ASN 8 Ca -0.21 -0.71 -0.41 0.00 -0.02 0.00 0.00 54.58 53.23 3hof n ASN 8 Cb 0.57 -0.06 -0.01 0.00 -2.36 0.00 0.00 39.78 37.92 3hof n ASN 8 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 3hof s VAL 9 N -2.37 2.38 0.65 3.53 1.01 -1.26 -4.22 120.40 120.11 3hof s VAL 9 Ca 0.32 0.37 -0.15 0.00 0.00 0.00 0.00 61.98 62.52 3hof s VAL 9 Cb 0.20 -3.23 -0.01 0.00 0.00 0.00 0.00 36.38 33.34 3hof s VAL 9 CO 0.45 0.08 1.09 -2.84 0.00 0.00 0.00 175.10 173.88 3hof s PRO 10 N -2.04 2.95 0.25 2.72 0.02 -1.26 -0.88 135.00 136.76 3hof s PRO 10 Ca 0.53 1.29 -0.05 0.00 0.02 0.00 0.00 61.00 62.79 3hof s PRO 10 Cb -0.43 -1.98 0.36 0.00 0.02 0.00 0.00 34.50 32.48 3hof s PRO 10 CO 0.57 -1.12 1.85 -0.09 -0.33 0.00 0.00 177.00 177.88 3hof h ARG 11 N 0.06 0.94 -0.11 5.54 2.43 -1.93 -1.43 114.38 119.88 3hof h ARG 11 Ca -0.46 -0.06 0.03 0.00 -0.81 0.00 0.00 59.98 58.68 3hof h ARG 11 Cb 1.23 -0.21 -0.00 0.00 -0.42 0.00 0.00 29.97 30.57 3hof h ARG 11 CO 0.55 0.62 0.12 0.00 -1.51 0.00 0.00 179.97 179.75 3hof h ALA 12 N 1.42 1.69 -0.00 2.80 0.00 -2.03 -1.16 119.26 121.98 3hof h ALA 12 Ca 0.39 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.30 3hof h ALA 12 Cb 0.21 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3hof h ALA 12 CO -0.19 -0.18 -0.15 0.43 0.00 0.00 0.00 179.25 179.16 3hof n SER 13 N -3.81 0.47 -4.63 0.00 7.64 -0.54 -4.78 113.62 107.96 3hof n SER 13 Ca -0.00 -0.45 -0.43 0.00 1.01 0.00 0.00 58.87 59.00 3hof n SER 13 Cb 0.23 -0.07 -0.02 0.00 -1.01 0.00 0.00 64.21 63.34 3hof n SER 13 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3hof s VAL 14 N -2.59 4.38 0.48 0.44 1.01 -0.44 -4.76 120.40 118.91 3hof s VAL 14 Ca 0.25 1.55 -0.21 0.00 0.00 0.00 0.00 61.98 63.57 3hof s VAL 14 Cb 0.20 -4.41 -0.08 0.00 0.00 0.00 0.00 36.38 32.08 3hof s VAL 14 CO 0.51 -0.59 1.06 -2.16 0.00 0.00 0.00 175.10 173.92 3hof s PRO 15 N 3.92 3.78 0.17 2.72 0.04 -1.26 -4.96 135.00 139.41 3hof s PRO 15 Ca 0.48 1.46 -0.33 0.00 0.04 0.00 0.00 61.00 62.64 3hof s PRO 15 Cb -0.12 -2.18 -0.15 0.00 0.04 0.00 0.00 34.50 32.09 3hof s PRO 15 CO 0.20 -0.46 1.30 -0.25 0.04 0.00 0.00 177.00 177.84 3hof n ASP 16 N -0.83 1.92 0.00 6.66 8.00 -1.26 -2.21 116.55 128.83 3hof n ASP 16 Ca 0.09 1.13 0.00 0.00 0.71 0.00 0.00 54.79 56.72 3hof n ASP 16 Cb 0.51 -1.28 0.00 0.00 -0.02 0.00 0.00 41.12 40.33 3hof n ASP 16 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3hof n GLY 17 N 2.32 0.69 0.16 0.44 0.00 -1.26 -4.99 105.19 102.55 3hof n GLY 17 Ca 0.15 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.08 3hof n GLY 17 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3hof h PHE 18 N 0.00 0.46 -0.77 1.61 3.57 -1.82 -0.35 116.94 119.64 3hof h PHE 18 Ca 0.00 -0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.43 3hof h PHE 18 Cb 0.00 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 38.57 3hof h PHE 18 CO 0.00 0.43 0.35 -0.07 -2.23 0.00 0.00 178.31 176.79 3hof h LEU 19 N 0.35 1.03 -0.66 0.59 3.38 -1.94 -1.15 115.31 116.91 3hof h LEU 19 Ca 0.10 -0.15 -0.09 0.00 0.09 0.00 0.00 57.88 57.83 3hof h LEU 19 Cb 0.16 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 3hof h LEU 19 CO -0.01 0.90 -0.00 0.28 0.09 0.00 0.00 178.44 179.69 3hof h SER 20 N 1.10 1.02 -0.26 -0.43 0.02 -1.93 -1.32 113.55 111.75 3hof h SER 20 Ca 0.26 -0.29 -0.03 0.00 -0.84 0.00 0.00 61.79 60.89 3hof h SER 20 Cb 0.16 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.42 3hof h SER 20 CO -0.03 1.07 0.04 -0.08 -1.14 0.00 0.00 176.83 176.69 3hof h GLU 21 N 0.95 0.43 -0.56 3.45 4.81 -0.79 -0.99 114.58 121.87 3hof h GLU 21 Ca 0.17 -0.12 0.08 0.00 -0.13 0.00 0.00 59.36 59.36 3hof h GLU 21 Cb 0.55 -0.05 -0.06 0.00 0.63 0.00 0.00 28.75 29.82 3hof h GLU 21 CO 0.03 0.56 0.22 -0.07 -0.73 0.00 0.00 179.01 179.02 3hof h LEU 22 N 0.23 0.25 -0.03 1.64 3.38 -1.14 0.16 115.31 119.81 3hof h LEU 22 Ca 0.08 0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.11 3hof h LEU 22 Cb 0.34 0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.12 3hof h LEU 22 CO 0.01 0.16 0.01 0.74 0.09 0.00 0.00 178.44 179.45 3hof h THR 23 N 0.42 1.11 -0.38 0.22 2.02 -1.01 -0.03 112.91 115.25 3hof h THR 23 Ca 0.27 -0.32 -0.01 0.00 0.77 0.00 0.00 66.41 67.13 3hof h THR 23 Cb 0.30 1.27 -0.02 0.00 -1.74 0.00 0.00 68.15 67.96 3hof h THR 23 CO -0.26 0.09 0.21 -0.61 0.37 0.00 0.00 175.52 175.32 3hof h GLN 24 N -0.08 0.53 -0.04 6.66 4.15 -1.01 -1.36 115.11 123.97 3hof h GLN 24 Ca 0.01 -0.06 -0.15 0.00 0.77 0.00 0.00 58.65 59.21 3hof h GLN 24 Cb 0.13 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 27.70 3hof h GLN 24 CO -0.00 0.43 -0.67 1.96 -1.93 0.00 0.00 178.83 178.62 3hof h GLN 25 N 0.49 0.18 -0.39 1.69 1.08 -0.86 -1.05 115.11 116.25 3hof h GLN 25 Ca 0.13 -0.14 -0.15 0.00 -1.45 0.00 0.00 58.65 57.04 3hof h GLN 25 Cb 0.05 0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.50 3hof h GLN 25 CO -0.02 0.78 -0.36 -0.07 -0.95 0.00 0.00 178.83 178.20 3hof h LEU 26 N 0.12 0.97 -0.26 1.46 3.38 -0.88 -0.62 115.31 119.49 3hof h LEU 26 Ca -0.01 -0.43 0.03 0.00 0.09 0.00 0.00 57.88 57.55 3hof h LEU 26 Cb 1.20 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.64 3hof h LEU 26 CO 0.10 1.23 0.09 0.00 0.09 0.00 0.00 178.44 179.95 3hof h ALA 27 N 0.82 0.29 -0.23 1.53 0.00 -1.09 0.07 119.26 120.65 3hof h ALA 27 Ca 0.07 0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.02 3hof h ALA 27 Cb 0.95 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 3hof h ALA 27 CO 0.09 -0.32 0.12 0.37 0.00 0.00 0.00 179.25 179.52 3hof h GLN 28 N 0.21 0.25 -0.22 0.00 5.75 -1.03 -1.09 115.11 118.99 3hof h GLN 28 Ca 0.11 -0.02 -0.16 0.00 -0.15 0.00 0.00 58.65 58.43 3hof h GLN 28 Cb 0.08 -0.06 -0.00 0.00 1.07 0.00 0.00 27.48 28.57 3hof h GLN 28 CO -0.11 0.17 -0.53 0.00 -2.65 0.00 0.00 178.83 175.70 3hof h ALA 29 N 1.11 0.65 0.00 3.38 0.00 -0.86 -3.24 119.26 120.29 3hof h ALA 29 Ca 0.09 -0.51 0.00 0.00 0.00 0.00 0.00 54.91 54.49 3hof h ALA 29 Cb 0.01 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.71 3hof h ALA 29 CO -0.05 0.68 -0.80 0.25 0.00 0.00 0.00 179.25 179.33 3hof n THR 30 N -3.98 0.07 -0.15 0.00 -2.24 -0.01 -4.97 114.28 103.00 3hof n THR 30 Ca -0.03 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.66 3hof n THR 30 Cb 0.60 0.40 0.00 0.00 -2.10 0.00 0.00 70.33 69.24 3hof n THR 30 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hof n GLY 31 N 1.45 2.42 3.83 3.38 0.00 -0.42 -4.99 105.19 110.86 3hof n GLY 31 Ca 0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 3hof n GLY 31 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hof s LYS 32 N -0.02 3.80 0.31 1.61 1.02 -1.18 -4.96 119.74 120.32 3hof s LYS 32 Ca 0.00 1.05 -0.29 0.00 0.02 0.00 0.00 55.97 56.75 3hof s LYS 32 Cb 0.00 -2.11 -0.10 0.00 -0.52 0.00 0.00 37.83 35.10 3hof s LYS 32 CO 0.00 -0.40 1.24 -2.14 -0.92 0.00 0.00 175.35 173.13 3hof s PRO 33 N -3.98 4.45 0.56 -1.68 0.02 -1.26 -4.55 135.00 128.56 3hof s PRO 33 Ca 0.61 2.07 0.25 0.00 0.02 0.00 0.00 61.00 63.95 3hof s PRO 33 Cb -0.12 -3.11 1.61 0.00 0.02 0.00 0.00 34.50 32.90 3hof s PRO 33 CO 0.31 -0.05 2.20 -1.00 -0.33 0.00 0.00 177.00 178.12 3hof h PRO 34 N 3.58 0.00 -0.04 5.54 0.13 -1.92 -2.34 132.00 136.95 3hof h PRO 34 Ca -0.48 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.66 3hof h PRO 34 Cb 1.22 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.35 3hof h PRO 34 CO 0.66 0.03 0.09 -0.56 -0.23 0.00 0.00 178.00 177.99 3hof h GLN 35 N 0.00 0.00 -0.19 0.86 -0.00 -1.98 -2.59 115.11 111.21 3hof h GLN 35 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 3hof h GLN 35 Cb 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.54 3hof h GLN 35 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 178.83 179.49 3hof n TYR 36 N -3.34 0.24 -3.10 0.06 4.01 -0.88 -4.97 117.16 109.18 3hof n TYR 36 Ca -0.02 -0.17 -0.39 0.00 -0.16 0.00 0.00 57.90 57.16 3hof n TYR 36 Cb 0.17 -0.01 -0.05 0.00 -0.31 0.00 0.00 39.34 39.14 3hof n TYR 36 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 3hof s ILE 37 N -1.26 5.04 -0.11 -0.72 1.01 -0.98 -3.76 121.20 120.43 3hof s ILE 37 Ca 0.25 1.35 0.02 0.00 0.00 0.00 0.00 60.65 62.27 3hof s ILE 37 Cb 0.15 -4.00 -0.01 0.00 0.01 0.00 0.00 42.46 38.62 3hof s ILE 37 CO 0.22 0.28 -0.19 0.00 0.00 0.00 0.00 174.94 175.25 3hof s ALA 38 N 0.64 2.37 0.05 9.38 0.00 -0.23 -5.00 121.76 128.96 3hof s ALA 38 Ca 0.35 -0.94 0.06 0.00 0.00 0.00 0.00 51.96 51.42 3hof s ALA 38 Cb -0.17 -0.97 -0.02 0.00 0.00 0.00 0.00 23.12 21.96 3hof s ALA 38 CO 0.17 0.29 -0.16 0.14 0.00 0.00 0.00 175.76 176.21 3hof s VAL 39 N 0.26 1.25 -0.16 0.00 -7.23 -1.26 -0.72 120.40 112.54 3hof s VAL 39 Ca -0.13 -1.09 -0.06 0.00 -1.81 0.00 0.00 61.98 58.88 3hof s VAL 39 Cb -0.17 -1.13 0.07 0.00 0.56 0.00 0.00 36.38 35.72 3hof s VAL 39 CO 0.07 0.02 0.33 -2.28 -0.31 0.00 0.00 175.10 172.93 3hof s HIS 40 N -0.90 -0.57 -0.10 2.82 5.04 -0.35 -4.97 115.29 116.27 3hof s HIS 40 Ca 0.03 1.19 0.04 0.00 -1.54 0.00 0.00 55.06 54.77 3hof s HIS 40 Cb -0.08 0.12 0.00 0.00 0.04 0.00 0.00 32.58 32.66 3hof s HIS 40 CO 0.02 -0.39 -0.23 0.08 -2.34 0.00 0.00 174.74 171.88 3hof s VAL 41 N 2.32 1.97 -0.36 0.89 1.01 -1.26 -0.81 120.40 124.17 3hof s VAL 41 Ca -0.02 -0.96 0.02 0.00 0.00 0.00 0.00 61.98 61.02 3hof s VAL 41 Cb -0.12 -1.72 0.11 0.00 0.00 0.00 0.00 36.38 34.66 3hof s VAL 41 CO -0.10 0.54 0.11 -0.69 0.00 0.00 0.00 175.10 174.95 3hof s VAL 42 N 0.43 1.77 0.73 2.92 1.01 0.13 -4.97 120.40 122.41 3hof s VAL 42 Ca -0.17 -2.16 -0.03 0.00 0.00 0.00 0.00 61.98 59.62 3hof s VAL 42 Cb -0.18 -2.30 0.12 0.00 0.00 0.00 0.00 36.38 34.03 3hof s VAL 42 CO 0.07 -0.68 1.01 -2.16 0.00 0.00 0.00 175.10 173.34 3hof s PRO 43 N 0.95 1.69 -1.50 2.72 0.04 -1.26 -0.86 135.00 136.79 3hof s PRO 43 Ca 0.12 -0.94 0.00 0.00 0.04 0.00 0.00 61.00 60.21 3hof s PRO 43 Cb -0.20 -2.28 0.00 0.00 0.04 0.00 0.00 34.50 32.06 3hof s PRO 43 CO -0.12 -1.46 0.00 -0.25 0.04 0.00 0.00 177.00 175.21 3hof n ASP 44 N -2.89 -5.00 -4.82 6.66 8.00 -0.06 -4.83 116.55 113.62 3hof n ASP 44 Ca 0.14 0.05 -0.34 0.00 0.71 0.00 0.00 54.79 55.35 3hof n ASP 44 Cb 0.60 -4.08 -0.07 0.00 -0.02 0.00 0.00 41.12 37.56 3hof n ASP 44 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 3hof s GLN 45 N -4.64 4.22 -0.54 -1.24 -1.52 -0.53 -4.94 119.66 110.46 3hof s GLN 45 Ca 0.00 1.01 -0.25 0.00 -1.95 0.00 0.00 55.36 54.17 3hof s GLN 45 Cb 0.00 -2.38 0.04 0.00 -0.22 0.00 0.00 33.01 30.44 3hof s GLN 45 CO 0.00 0.09 0.98 -1.17 -0.25 0.00 0.00 175.29 174.95 3hof s LEU 46 N -2.88 3.98 0.02 2.90 2.96 -1.26 -4.06 118.68 120.35 3hof s LEU 46 Ca 0.57 -0.22 -0.10 0.00 -0.22 0.00 0.00 54.13 54.16 3hof s LEU 46 Cb -0.11 -2.93 0.01 0.00 0.50 0.00 0.00 46.19 43.65 3hof s LEU 46 CO 0.16 -1.25 0.21 -0.04 -1.32 0.00 0.00 176.35 174.12 3hof s MET 47 N 4.09 0.66 0.05 1.98 -1.94 -1.26 -5.06 119.30 117.82 3hof s MET 47 Ca 0.33 -0.51 0.02 0.00 -1.71 0.00 0.00 55.69 53.82 3hof s MET 47 Cb -0.11 0.28 -0.03 0.00 2.01 0.00 0.00 34.83 36.98 3hof s MET 47 CO 0.21 -0.19 -0.08 0.00 -0.01 0.00 0.00 175.02 174.96 3hof s ALA 48 N -2.16 0.62 -0.07 3.03 0.00 -1.26 -4.60 121.76 117.31 3hof s ALA 48 Ca -0.08 -0.83 -0.01 0.00 0.00 0.00 0.00 51.96 51.03 3hof s ALA 48 Cb -0.03 0.06 0.03 0.00 0.00 0.00 0.00 23.12 23.18 3hof s ALA 48 CO -0.02 -0.04 0.01 0.12 0.00 0.00 0.00 175.76 175.83 3hof s PHE 49 N -1.64 0.65 -1.72 0.00 2.19 -0.54 -4.73 117.98 112.19 3hof s PHE 49 Ca -0.08 -0.17 0.00 0.00 0.33 0.00 0.00 56.93 57.01 3hof s PHE 49 Cb -0.08 -0.79 0.00 0.00 -1.31 0.00 0.00 43.02 40.83 3hof s PHE 49 CO -0.00 -0.33 0.00 0.41 1.83 0.00 0.00 175.22 177.12 3hof n GLY 50 N 5.15 -0.12 2.25 13.12 0.00 -1.26 -2.08 105.19 122.26 3hof n GLY 50 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.95 3hof n GLY 50 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hof n GLY 51 N -0.88 0.70 3.40 -0.02 0.00 -1.26 -5.03 105.19 102.11 3hof n GLY 51 Ca -0.22 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.49 3hof n GLY 51 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3hof s SER 52 N -2.40 3.50 -0.27 1.61 0.15 -0.88 -5.04 113.70 110.38 3hof s SER 52 Ca 0.00 -0.51 0.12 0.00 0.70 0.00 0.00 55.95 56.25 3hof s SER 52 Cb 0.00 -0.45 0.77 0.00 -1.71 0.00 0.00 66.02 64.62 3hof s SER 52 CO 0.00 0.25 1.74 -1.54 1.20 0.00 0.00 173.24 174.89 3hof n SER 53 N 1.62 5.24 -4.61 5.45 3.41 -1.26 -1.46 113.62 122.01 3hof n SER 53 Ca -0.17 -3.02 -0.32 0.00 -0.26 0.00 0.00 58.87 55.11 3hof n SER 53 Cb 0.52 -0.71 0.15 0.00 -0.26 0.00 0.00 64.21 63.92 3hof n SER 53 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3hof n GLU 54 N 0.30 -0.37 -1.59 4.33 1.02 -1.26 -4.87 120.64 118.20 3hof n GLU 54 Ca 0.32 -0.05 -0.46 0.00 -0.02 0.00 0.00 57.16 56.96 3hof n GLU 54 Cb 1.25 -2.26 -0.03 0.00 -0.02 0.00 0.00 31.44 30.39 3hof n GLU 54 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 3hof n PRO 55 N -3.55 1.35 -3.83 3.49 -0.02 -1.26 -4.86 135.00 126.32 3hof n PRO 55 Ca 0.11 0.48 -0.09 0.00 -2.02 0.00 0.00 63.50 61.97 3hof n PRO 55 Cb 0.52 -1.92 -0.05 0.00 -0.02 0.00 0.00 33.50 32.04 3hof n PRO 55 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hof s ALA 57 N -3.91 -0.14 -0.20 0.00 0.00 -0.51 -3.69 121.76 113.31 3hof s ALA 57 Ca 0.13 0.32 -0.04 0.00 0.00 0.00 0.00 51.96 52.37 3hof s ALA 57 Cb -0.00 -0.21 -0.01 0.00 0.00 0.00 0.00 23.12 22.89 3hof s ALA 57 CO -0.00 -0.07 -0.05 -0.51 0.00 0.00 0.00 175.76 175.13 3hof s LEU 58 N 0.49 2.98 0.15 0.00 1.43 -0.25 -1.68 118.68 121.79 3hof s LEU 58 Ca -0.04 -0.31 0.06 0.00 -1.03 0.00 0.00 54.13 52.81 3hof s LEU 58 Cb -0.05 -1.74 -0.04 0.00 0.03 0.00 0.00 46.19 44.38 3hof s LEU 58 CO -0.02 0.04 -0.13 0.00 0.23 0.00 0.00 176.35 176.48 3hof s SER 60 N -2.86 0.93 -0.12 0.00 0.01 -0.36 -0.81 113.70 110.49 3hof s SER 60 Ca 0.14 -0.25 0.00 0.00 1.31 0.00 0.00 55.95 57.15 3hof s SER 60 Cb -0.02 -0.07 0.02 0.00 0.21 0.00 0.00 66.02 66.17 3hof s SER 60 CO 0.03 0.02 -0.10 -0.22 0.41 0.00 0.00 173.24 173.38 3hof s LEU 61 N -0.55 1.37 -0.10 2.44 2.96 -0.43 -1.00 118.68 123.36 3hof s LEU 61 Ca 0.00 -0.35 0.01 0.00 -0.22 0.00 0.00 54.13 53.57 3hof s LEU 61 Cb -0.05 -0.92 -0.02 0.00 0.50 0.00 0.00 46.19 45.70 3hof s LEU 61 CO 0.00 -0.08 -0.11 -1.00 -1.32 0.00 0.00 176.35 173.84 3hof s HIS 62 N 1.51 2.83 -0.08 5.38 3.76 -0.34 -0.81 115.29 127.53 3hof s HIS 62 Ca 0.02 -0.37 -0.14 0.00 -0.15 0.00 0.00 55.06 54.42 3hof s HIS 62 Cb -0.13 -1.78 0.03 0.00 1.11 0.00 0.00 32.58 31.81 3hof s HIS 62 CO -0.07 -0.00 0.35 0.45 -0.85 0.00 0.00 174.74 174.62 3hof s SER 63 N -0.11 -0.31 -0.67 1.40 0.15 -0.81 -1.47 113.70 111.88 3hof s SER 63 Ca -0.01 0.46 -0.26 0.00 0.70 0.00 0.00 55.95 56.84 3hof s SER 63 Cb -0.14 0.56 0.04 0.00 -1.71 0.00 0.00 66.02 64.77 3hof s SER 63 CO 0.03 -0.28 1.14 -0.63 1.20 0.00 0.00 173.24 174.71 3hof s ILE 64 N -0.50 4.00 0.03 6.45 1.01 -1.26 -0.61 121.20 130.31 3hof s ILE 64 Ca -0.06 0.26 0.00 0.00 0.00 0.00 0.00 60.65 60.85 3hof s ILE 64 Cb -0.04 -4.79 0.00 0.00 0.01 0.00 0.00 42.46 37.65 3hof s ILE 64 CO 0.02 -1.60 0.00 0.61 0.00 0.00 0.00 174.94 173.98 3hof n GLY 65 N 5.29 -2.03 2.53 6.18 0.00 -1.26 -4.93 105.19 110.97 3hof n GLY 65 Ca 0.02 -1.40 -0.13 0.00 0.00 0.00 0.00 46.02 44.50 3hof n GLY 65 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3hof n LYS 66 N -0.98 -1.22 -4.92 1.61 4.76 -1.26 -4.91 118.16 111.24 3hof n LYS 66 Ca 0.00 0.95 -0.33 0.00 -2.87 0.00 0.00 58.31 56.06 3hof n LYS 66 Cb 0.06 -5.14 -0.15 0.00 -1.84 0.00 0.00 35.03 27.96 3hof n LYS 66 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3hof s ILE 67 N -2.35 2.76 0.00 -0.18 -1.09 -1.26 -4.79 121.20 114.30 3hof s ILE 67 Ca 0.00 -0.77 0.00 0.00 -2.23 0.00 0.00 60.65 57.65 3hof s ILE 67 Cb 0.00 -2.13 0.00 0.00 -1.58 0.00 0.00 42.46 38.75 3hof s ILE 67 CO 0.00 0.54 0.00 0.61 -1.23 0.00 0.00 174.94 174.86 3hof n GLY 68 N 3.41 -0.56 0.10 6.18 0.00 -1.26 -4.99 105.19 108.06 3hof n GLY 68 Ca -0.18 -1.06 -0.03 0.00 0.00 0.00 0.00 46.02 44.74 3hof n GLY 68 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3hof h GLY 69 N 0.00 -1.60 1.03 -0.02 0.00 -1.99 0.23 103.07 100.72 3hof h GLY 69 Ca 0.00 0.74 -0.11 0.00 0.00 0.00 0.00 47.33 47.96 3hof h GLY 69 CO 0.00 -0.56 -0.17 0.00 0.00 0.00 0.00 176.54 175.81 3hof h ALA 70 N -1.12 0.58 -0.66 3.60 0.00 -2.00 -2.81 119.26 116.86 3hof h ALA 70 Ca 0.01 -0.36 -0.03 0.00 0.00 0.00 0.00 54.91 54.53 3hof h ALA 70 Cb 0.13 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 3hof h ALA 70 CO -0.11 0.52 0.29 1.96 0.00 0.00 0.00 179.25 181.91 3hof h GLN 71 N 0.67 0.97 -0.56 0.00 4.20 -1.87 -2.08 115.11 116.43 3hof h GLN 71 Ca 0.10 -0.16 -0.04 0.00 0.06 0.00 0.00 58.65 58.60 3hof h GLN 71 Cb 0.72 -0.16 -0.03 0.00 0.30 0.00 0.00 27.48 28.31 3hof h GLN 71 CO 0.05 0.79 0.17 -0.91 -0.67 0.00 0.00 178.83 178.27 3hof h ASN 72 N 0.92 0.78 -0.50 1.46 2.35 -0.49 0.65 115.58 120.74 3hof h ASN 72 Ca 0.22 -0.12 -0.03 0.00 -0.55 0.00 0.00 56.30 55.82 3hof h ASN 72 Cb 0.17 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.31 3hof h ASN 72 CO -0.02 0.74 0.20 0.03 -1.65 0.00 0.00 177.43 176.73 3hof h ARG 73 N 0.82 0.75 -0.74 0.81 3.08 -1.21 -0.92 114.38 116.98 3hof h ARG 73 Ca 0.19 -0.14 -0.05 0.00 0.07 0.00 0.00 59.98 60.05 3hof h ARG 73 Cb 0.24 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.14 3hof h ARG 73 CO -0.01 0.67 0.28 1.03 -1.07 0.00 0.00 179.97 180.87 3hof h SER 74 N 0.67 1.03 -0.88 7.04 0.87 -0.88 -1.22 113.55 120.18 3hof h SER 74 Ca 0.17 -0.18 -0.01 0.00 -1.23 0.00 0.00 61.79 60.53 3hof h SER 74 Cb 0.20 -0.27 -0.04 0.00 -0.44 0.00 0.00 62.40 61.85 3hof h SER 74 CO -0.01 0.94 0.51 1.88 -0.53 0.00 0.00 176.83 179.61 3hof h TYR 75 N 1.07 1.18 -0.64 2.24 0.05 -0.70 -2.11 116.97 118.06 3hof h TYR 75 Ca 0.24 -0.01 -0.08 0.00 0.05 0.00 0.00 58.73 58.93 3hof h TYR 75 Cb 0.24 -0.38 -0.02 0.00 1.01 0.00 0.00 36.73 37.57 3hof h TYR 75 CO 0.02 0.80 0.07 0.77 -1.05 0.00 0.00 178.16 178.77 3hof h SER 76 N 1.22 1.04 -0.38 3.88 0.02 -0.81 0.29 113.55 118.80 3hof h SER 76 Ca 0.31 -0.28 -0.03 0.00 -0.84 0.00 0.00 61.79 60.96 3hof h SER 76 Cb -0.02 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.22 3hof h SER 76 CO -0.06 1.06 0.12 0.50 -1.14 0.00 0.00 176.83 177.32 3hof h LYS 77 N 0.99 0.59 -0.07 3.45 3.64 -1.02 -0.17 116.57 123.98 3hof h LYS 77 Ca 0.19 -0.13 -0.00 0.00 -1.27 0.00 0.00 60.65 59.44 3hof h LYS 77 Cb 0.48 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.21 3hof h LYS 77 CO 0.02 0.60 0.03 1.25 -2.27 0.00 0.00 179.45 179.07 3hof h LEU 78 N 0.47 0.10 0.04 5.20 5.85 -1.12 -1.68 115.31 124.16 3hof h LEU 78 Ca 0.12 -0.16 -0.25 0.00 0.84 0.00 0.00 57.88 58.43 3hof h LEU 78 Cb 0.25 -0.03 0.02 0.00 0.37 0.00 0.00 40.66 41.27 3hof h LEU 78 CO -0.00 0.23 -1.00 -0.07 -0.34 0.00 0.00 178.44 177.26 3hof h LEU 79 N -0.04 0.80 -1.11 2.25 -0.00 -0.87 -2.09 115.31 114.26 3hof h LEU 79 Ca 0.02 -0.78 0.01 0.00 -0.00 0.00 0.00 57.88 57.14 3hof h LEU 79 Cb 0.17 -0.25 -0.05 0.00 -0.00 0.00 0.00 40.66 40.53 3hof h LEU 79 CO -0.00 1.49 0.61 0.00 -0.00 0.00 0.00 178.44 180.53 3hof h GLY 81 N 1.23 1.20 1.11 0.00 0.00 -1.09 0.14 103.07 105.67 3hof h GLY 81 Ca 0.34 -0.38 -0.21 0.00 0.00 0.00 0.00 47.33 47.08 3hof h GLY 81 CO -0.08 0.29 -0.76 1.41 0.00 0.00 0.00 176.54 177.41 3hof h LEU 82 N 0.96 0.87 -0.93 3.11 3.38 -0.97 -1.02 115.31 120.71 3hof h LEU 82 Ca 0.34 -0.65 -0.09 0.00 0.09 0.00 0.00 57.88 57.57 3hof h LEU 82 Cb 0.09 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 3hof h LEU 82 CO -0.14 1.38 -0.14 -0.07 0.09 0.00 0.00 178.44 179.56 3hof h LEU 83 N 0.42 0.62 0.05 1.67 3.38 -1.01 0.12 115.31 120.56 3hof h LEU 83 Ca -0.06 -0.18 -0.00 0.00 0.09 0.00 0.00 57.88 57.73 3hof h LEU 83 Cb 1.40 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.98 3hof h LEU 83 CO 0.15 0.78 -0.03 0.00 0.09 0.00 0.00 178.44 179.44 3hof h ALA 84 N 1.28 -0.07 -0.45 1.53 0.00 -0.59 -1.96 119.26 118.99 3hof h ALA 84 Ca 0.10 -0.19 -0.13 0.00 0.00 0.00 0.00 54.91 54.68 3hof h ALA 84 Cb 0.57 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 3hof h ALA 84 CO 0.04 -0.35 -0.24 1.49 0.00 0.00 0.00 179.25 180.19 3hof h GLU 85 N -0.46 0.96 0.04 0.00 4.81 -1.05 -2.04 114.58 116.85 3hof h GLU 85 Ca -0.01 -0.43 -0.37 0.00 -0.13 0.00 0.00 59.36 58.43 3hof h GLU 85 Cb 0.41 -0.02 -0.05 0.00 0.63 0.00 0.00 28.75 29.72 3hof h GLU 85 CO 0.01 1.10 -2.21 0.54 -0.73 0.00 0.00 179.01 177.72 3hof n ARG 86 N -4.13 0.69 0.00 1.92 5.12 0.40 -4.42 116.66 116.24 3hof n ARG 86 Ca -0.01 0.18 0.05 0.00 -1.93 0.00 0.00 57.85 56.14 3hof n ARG 86 Cb 0.47 -1.62 0.03 0.00 -1.16 0.00 0.00 32.46 30.18 3hof n ARG 86 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 3hof n LEU 87 N -3.23 1.67 -3.38 0.55 4.32 -0.80 -4.61 117.00 111.52 3hof n LEU 87 Ca -0.36 -0.95 -0.23 0.00 -0.02 0.00 0.00 56.01 54.44 3hof n LEU 87 Cb 1.04 0.00 0.06 0.00 -1.62 0.00 0.00 43.42 42.91 3hof n LEU 87 CO 0.37 0.33 0.16 0.54 -1.22 0.00 0.00 177.39 177.57 3hof n ARG 88 N 0.38 -6.92 -3.77 3.23 5.12 -0.76 -4.96 116.66 108.97 3hof n ARG 88 Ca 0.05 0.85 -0.36 0.00 -1.93 0.00 0.00 57.85 56.47 3hof n ARG 88 Cb 0.23 -5.83 -0.10 0.00 -1.16 0.00 0.00 32.46 25.60 3hof n ARG 88 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 3hof s ILE 89 N -3.27 5.10 0.26 0.55 1.01 -0.85 -4.90 121.20 119.10 3hof s ILE 89 Ca 0.49 0.09 -0.30 0.00 0.00 0.00 0.00 60.65 60.93 3hof s ILE 89 Cb -0.22 -3.36 -0.10 0.00 0.01 0.00 0.00 42.46 38.80 3hof s ILE 89 CO 0.61 0.38 1.46 -0.55 0.00 0.00 0.00 174.94 176.84 3hof s SER 90 N 0.87 6.61 0.53 3.58 0.15 -1.26 -3.40 113.70 120.77 3hof s SER 90 Ca 0.06 2.72 0.22 0.00 0.70 0.00 0.00 55.95 59.65 3hof s SER 90 Cb -0.13 -2.63 1.35 0.00 -1.71 0.00 0.00 66.02 62.90 3hof s SER 90 CO 0.03 -0.73 2.05 -0.65 1.20 0.00 0.00 173.24 175.14 3hof h PRO 91 N 4.89 0.00 0.00 5.44 0.11 -1.97 -0.07 132.00 140.41 3hof h PRO 91 Ca -0.46 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3hof h PRO 91 Cb 1.22 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3hof h PRO 91 CO 0.77 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 178.16 3hof n ASP 92 N -4.44 0.00 -0.87 -2.05 5.75 -1.26 -2.69 116.55 111.00 3hof n ASP 92 Ca 0.05 -1.34 0.02 0.00 -0.01 0.00 0.00 54.79 53.51 3hof n ASP 92 Cb 0.42 0.00 0.20 0.00 -1.03 0.00 0.00 41.12 40.71 3hof n ASP 92 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3hof n ARG 93 N -0.76 1.86 -4.92 0.11 1.74 -0.04 -4.99 116.66 109.66 3hof n ARG 93 Ca 0.12 -3.10 -0.28 0.00 -0.77 0.00 0.00 57.85 53.81 3hof n ARG 93 Cb 0.05 -1.74 -0.17 0.00 -1.02 0.00 0.00 32.46 29.59 3hof n ARG 93 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3hof s VAL 94 N -3.15 1.60 -0.03 1.55 1.01 -1.10 -1.43 120.40 118.86 3hof s VAL 94 Ca 0.41 -0.76 0.04 0.00 0.00 0.00 0.00 61.98 61.67 3hof s VAL 94 Cb 0.37 -1.40 -0.03 0.00 0.00 0.00 0.00 36.38 35.32 3hof s VAL 94 CO -0.00 0.46 -0.14 -0.31 0.00 0.00 0.00 175.10 175.10 3hof s TYR 95 N 0.40 2.69 -0.16 5.22 2.02 -0.68 -4.99 117.35 121.85 3hof s TYR 95 Ca -0.14 -0.17 -0.00 0.00 -0.37 0.00 0.00 57.07 56.39 3hof s TYR 95 Cb -0.16 -1.60 0.04 0.00 -0.40 0.00 0.00 41.96 39.84 3hof s TYR 95 CO 0.06 0.21 -0.07 0.42 -1.57 0.00 0.00 175.55 174.59 3hof s ILE 96 N -0.78 1.24 -0.16 2.71 1.01 -1.26 -0.72 121.20 123.25 3hof s ILE 96 Ca 0.12 -0.64 -0.22 0.00 0.00 0.00 0.00 60.65 59.91 3hof s ILE 96 Cb -0.11 -1.35 -0.03 0.00 0.01 0.00 0.00 42.46 40.99 3hof s ILE 96 CO 0.02 0.21 0.66 0.20 0.00 0.00 0.00 174.94 176.03 3hof s ASN 97 N 1.59 6.79 -0.19 3.58 0.02 0.01 -4.96 114.94 121.78 3hof s ASN 97 Ca 0.01 0.96 -0.09 0.00 -1.02 0.00 0.00 52.86 52.72 3hof s ASN 97 Cb -0.15 -2.37 -0.05 0.00 0.02 0.00 0.00 41.25 38.70 3hof s ASN 97 CO -0.08 -0.23 0.13 -0.31 0.02 0.00 0.00 177.10 176.62 3hof s TYR 98 N 1.58 3.42 -0.16 2.20 1.51 -1.26 -1.32 117.35 123.32 3hof s TYR 98 Ca 0.32 0.33 0.00 0.00 -1.01 0.00 0.00 57.07 56.72 3hof s TYR 98 Cb -0.16 -2.12 0.03 0.00 -0.11 0.00 0.00 41.96 39.59 3hof s TYR 98 CO 0.12 0.34 -0.14 0.71 -1.11 0.00 0.00 175.55 175.47 3hof s TYR 99 N 0.18 2.26 -0.57 2.71 1.51 0.01 -4.99 117.35 118.47 3hof s TYR 99 Ca 0.09 -1.32 -0.24 0.00 -1.01 0.00 0.00 57.07 54.58 3hof s TYR 99 Cb -0.11 -1.63 0.05 0.00 -0.11 0.00 0.00 41.96 40.15 3hof s TYR 99 CO -0.01 -0.70 0.94 0.34 -1.11 0.00 0.00 175.55 175.01 3hof s ASP 100 N 1.45 6.31 0.04 2.29 -1.08 -1.26 -1.92 116.67 122.51 3hof s ASP 100 Ca 0.04 -0.46 -0.22 0.00 -0.52 0.00 0.00 52.55 51.39 3hof s ASP 100 Cb -0.13 -2.43 -0.06 0.00 -1.46 0.00 0.00 42.92 38.84 3hof s ASP 100 CO -0.10 -1.26 0.65 -0.04 0.52 0.00 0.00 175.17 174.94 3hof s MET 101 N 3.95 4.36 0.22 4.34 -1.94 0.22 -4.92 119.30 125.53 3hof s MET 101 Ca 0.29 0.85 -0.30 0.00 -1.71 0.00 0.00 55.69 54.82 3hof s MET 101 Cb -0.13 -3.31 -0.09 0.00 2.01 0.00 0.00 34.83 33.30 3hof s MET 101 CO 0.18 0.43 1.25 1.21 -0.01 0.00 0.00 175.02 178.08 3hof s ASN 102 N -0.47 6.99 0.51 3.03 3.84 -1.26 -4.17 114.94 123.40 3hof s ASN 102 Ca 0.33 2.36 0.20 0.00 0.21 0.00 0.00 52.86 55.96 3hof s ASN 102 Cb -0.20 -2.62 1.28 0.00 -0.55 0.00 0.00 41.25 39.17 3hof s ASN 102 CO 0.20 -0.44 2.04 0.00 -2.79 0.00 0.00 177.10 176.11 3hof h ALA 103 N 4.94 2.25 0.00 1.71 0.00 -1.94 0.70 119.26 126.91 3hof h ALA 103 Ca -0.45 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.45 3hof h ALA 103 Cb 1.22 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 3hof h ALA 103 CO 0.74 -0.35 0.00 0.00 0.00 0.00 0.00 179.25 179.64 3hof n ALA 104 N -2.59 1.76 -0.80 0.00 0.00 -1.26 -2.21 120.51 115.41 3hof n ALA 104 Ca 0.06 0.01 0.08 0.00 0.00 0.00 0.00 53.44 53.59 3hof n ALA 104 Cb 0.40 -1.34 0.28 0.00 0.00 0.00 0.00 19.45 18.79 3hof n ALA 104 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3hof n ASN 105 N -1.90 4.16 -3.97 0.00 3.02 0.24 -4.85 115.26 111.95 3hof n ASN 105 Ca 0.03 -2.77 -0.30 0.00 -0.03 0.00 0.00 54.58 51.51 3hof n ASN 105 Cb 0.23 -0.52 -0.16 0.00 -0.61 0.00 0.00 39.78 38.72 3hof n ASN 105 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3hof s VAL 106 N -2.40 1.54 0.22 2.41 1.01 -1.14 -4.91 120.40 117.14 3hof s VAL 106 Ca 0.42 -1.00 -0.19 0.00 0.00 0.00 0.00 61.98 61.21 3hof s VAL 106 Cb 0.32 -1.68 -0.08 0.00 0.00 0.00 0.00 36.38 34.94 3hof s VAL 106 CO 0.13 0.10 0.71 -0.83 0.00 0.00 0.00 175.10 175.22 3hof s GLY 107 N 1.43 2.59 -0.29 4.51 0.00 -1.26 -2.31 107.32 111.99 3hof s GLY 107 Ca -0.02 0.14 -0.19 0.00 0.00 0.00 0.00 44.72 44.65 3hof s GLY 107 CO -0.08 0.48 0.96 0.86 0.00 0.00 0.00 173.10 175.32 3hof s TRP 108 N -1.55 -0.59 -1.27 1.90 -0.00 -0.38 -4.95 118.94 112.09 3hof s TRP 108 Ca 0.43 1.25 -0.01 0.00 -0.00 0.00 0.00 56.10 57.77 3hof s TRP 108 Cb -0.16 0.38 0.00 0.00 -0.00 0.00 0.00 33.47 33.69 3hof s TRP 108 CO 0.21 -0.29 0.83 -1.71 -0.00 0.00 0.00 176.95 175.99 3hof n ASN 109 N 3.32 -1.72 0.00 5.86 4.05 -1.26 -1.85 115.26 123.66 3hof n ASN 109 Ca -0.17 -0.73 0.00 0.00 0.45 0.00 0.00 54.58 54.13 3hof n ASN 109 Cb 0.57 -4.49 0.00 0.00 1.23 0.00 0.00 39.78 37.09 3hof n ASN 109 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 177.26 174.80 3hof n ASN 110 N -3.08 -4.01 0.00 1.20 5.03 -1.26 -4.90 115.26 108.24 3hof n ASN 110 Ca -0.28 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.17 3hof n ASN 110 Cb 0.67 -1.76 0.00 0.00 -1.02 0.00 0.00 39.78 37.67 3hof n ASN 110 CO 0.00 0.00 0.00 -0.24 -1.83 0.00 0.00 177.26 175.19 3hof n SER 111 N -0.41 0.00 -4.15 6.41 2.88 -0.77 -5.19 113.62 112.39 3hof n SER 111 Ca 0.00 0.00 -0.21 0.00 -1.33 0.00 0.00 58.87 57.33 3hof n SER 111 Cb 0.20 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.57 3hof n SER 111 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 3hof s THR 112 N -0.70 0.61 -1.36 2.46 -4.23 -1.26 -1.25 115.64 109.90 3hof s THR 112 Ca 0.00 -2.00 0.30 0.00 -1.18 0.00 0.00 61.69 58.81 3hof s THR 112 Cb 0.00 -2.53 0.44 0.00 1.34 0.00 0.00 72.50 71.75 3hof s THR 112 CO 0.00 0.00 1.98 0.49 -0.54 0.00 0.00 174.62 176.55 3hof n PHE 113 N -0.70 0.00 1.47 3.99 3.72 -0.94 -4.85 117.46 120.16 3hof n PHE 113 Ca -0.02 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.50 3hof n PHE 113 Cb 0.65 -0.31 0.70 0.00 -0.94 0.00 0.00 39.48 39.58 3hof n PHE 113 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71