#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hb4 s VAL 4 N 0.00 4.09 0.57 2.46 1.01 -1.26 -5.10 120.40 122.18 1hb4 s VAL 4 Ca 0.00 -0.25 -0.17 0.00 0.00 0.00 0.00 61.98 61.55 1hb4 s VAL 4 Cb 0.00 -2.89 -0.04 0.00 0.00 0.00 0.00 36.38 33.45 1hb4 s VAL 4 CO 0.00 0.38 1.08 -0.55 0.00 0.00 0.00 175.10 176.01 1hb4 s SER 5 N 1.37 5.76 0.09 3.32 0.15 -1.26 -4.76 113.70 118.36 1hb4 s SER 5 Ca 0.05 1.96 -0.28 0.00 0.70 0.00 0.00 55.95 58.39 1hb4 s SER 5 Cb -0.15 -2.55 -0.06 0.00 -1.71 0.00 0.00 66.02 61.55 1hb4 s SER 5 CO 0.02 -1.19 0.87 -0.75 1.20 0.00 0.00 173.24 173.40 1hb4 s LYS 6 N -3.70 4.62 0.40 5.44 2.20 -1.26 -1.63 119.74 125.81 1hb4 s LYS 6 Ca 0.67 1.29 -0.24 0.00 -0.36 0.00 0.00 55.97 57.33 1hb4 s LYS 6 Cb -0.19 -3.36 -0.09 0.00 -1.51 0.00 0.00 37.83 32.68 1hb4 s LYS 6 CO 0.32 0.26 1.07 0.00 -0.36 0.00 0.00 175.35 176.64 1hb4 s ALA 7 N -0.10 3.09 -0.56 3.13 0.00 0.16 -4.83 121.76 122.66 1hb4 s ALA 7 Ca 0.43 0.74 -0.28 0.00 0.00 0.00 0.00 51.96 52.85 1hb4 s ALA 7 Cb -0.22 -3.29 0.02 0.00 0.00 0.00 0.00 23.12 19.63 1hb4 s ALA 7 CO 0.27 -0.27 1.27 -0.80 0.00 0.00 0.00 175.76 176.23 1hb4 s ASN 8 N -1.50 6.35 -0.42 0.00 0.01 -1.26 -4.77 114.94 113.35 1hb4 s ASN 8 Ca 0.58 0.24 0.02 0.00 -0.71 0.00 0.00 52.86 52.98 1hb4 s ASN 8 Cb -0.23 -2.55 0.13 0.00 0.41 0.00 0.00 41.25 39.00 1hb4 s ASN 8 CO 0.29 -1.54 0.21 -0.69 -1.51 0.00 0.00 177.10 173.86 1hb4 s VAL 9 N 5.30 1.49 0.62 1.60 1.01 -1.26 -4.57 120.40 124.59 1hb4 s VAL 9 Ca 0.47 -2.44 -0.17 0.00 0.00 0.00 0.00 61.98 59.84 1hb4 s VAL 9 Cb -0.09 -2.06 -0.02 0.00 0.00 0.00 0.00 36.38 34.22 1hb4 s VAL 9 CO 0.26 -0.83 1.17 -2.16 0.00 0.00 0.00 175.10 173.54 1hb4 s PRO 10 N 0.52 2.85 -0.30 2.72 0.04 -1.26 -4.60 135.00 134.97 1hb4 s PRO 10 Ca 0.16 1.68 -0.13 0.00 0.04 0.00 0.00 61.00 62.75 1hb4 s PRO 10 Cb -0.23 -1.93 -0.03 0.00 0.04 0.00 0.00 34.50 32.34 1hb4 s PRO 10 CO -0.04 -1.27 0.29 0.15 0.04 0.00 0.00 177.00 176.18 1hb4 s LYS 11 N -3.59 3.83 -0.19 4.56 1.02 -1.26 -0.68 119.74 123.43 1hb4 s LYS 11 Ca 0.74 -0.26 -0.03 0.00 0.02 0.00 0.00 55.97 56.43 1hb4 s LYS 11 Cb -0.27 -3.71 -0.01 0.00 -0.52 0.00 0.00 37.83 33.32 1hb4 s LYS 11 CO 0.36 -0.32 -0.05 0.42 -0.92 0.00 0.00 175.35 174.84 1hb4 s ILE 12 N 1.91 3.46 -0.48 2.17 1.01 0.16 -4.96 121.20 124.47 1hb4 s ILE 12 Ca 0.10 -0.48 -0.28 0.00 0.00 0.00 0.00 60.65 59.99 1hb4 s ILE 12 Cb -0.16 -2.55 0.01 0.00 0.01 0.00 0.00 42.46 39.78 1hb4 s ILE 12 CO 0.11 0.45 1.39 -0.62 0.00 0.00 0.00 174.94 176.27 1hb4 s ASP 13 N 1.07 6.27 0.00 3.58 -1.08 -1.26 -1.13 116.67 124.12 1hb4 s ASP 13 Ca 0.01 0.58 0.19 0.00 -0.52 0.00 0.00 52.55 52.81 1hb4 s ASP 13 Cb -0.15 -2.54 0.57 0.00 -1.46 0.00 0.00 42.92 39.34 1hb4 s ASP 13 CO -0.00 -1.54 1.45 1.33 0.52 0.00 0.00 175.17 176.93 1hb4 n VAL 14 N 6.98 0.41 -0.17 1.11 0.24 -0.80 -4.48 118.33 121.62 1hb4 n VAL 14 Ca 0.15 -0.53 0.09 0.00 -2.04 0.00 0.00 64.34 62.00 1hb4 n VAL 14 Cb 0.49 0.51 0.40 0.00 -1.47 0.00 0.00 33.84 33.76 1hb4 n VAL 14 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 1hb4 h SER 15 N 2.94 0.58 0.04 -1.34 4.64 -1.74 -0.68 113.55 117.99 1hb4 h SER 15 Ca 0.00 0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1hb4 h SER 15 Cb 0.65 -0.11 -0.00 0.00 -0.31 0.00 0.00 62.40 62.63 1hb4 h SER 15 CO 0.00 0.36 -0.00 -0.65 -0.87 0.00 0.00 176.83 175.67 1hb4 h PRO 16 N 0.65 0.00 0.00 4.77 0.11 -1.93 -2.04 132.00 133.57 1hb4 h PRO 16 Ca 0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.43 1hb4 h PRO 16 Cb 0.40 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.51 1hb4 h PRO 16 CO -0.11 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 178.97 1hb4 n LEU 17 N -3.39 0.00 -0.09 2.35 4.77 -0.26 -1.60 117.00 118.78 1hb4 n LEU 17 Ca -0.03 0.49 0.12 0.00 -0.03 0.00 0.00 56.01 56.56 1hb4 n LEU 17 Cb 0.09 -0.49 0.19 0.00 -2.33 0.00 0.00 43.42 40.87 1hb4 n LEU 17 CO 0.23 -0.21 0.39 0.49 -1.33 0.00 0.00 177.39 176.96 1hb4 n PHE 18 N -1.49 0.00 -2.71 -1.77 3.01 -0.77 -4.79 117.46 108.95 1hb4 n PHE 18 Ca 0.04 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.50 1hb4 n PHE 18 Cb 0.19 -0.15 0.00 0.00 -0.01 0.00 0.00 39.48 39.51 1hb4 n PHE 18 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1hb4 n GLY 19 N 1.46 5.15 0.26 1.37 0.00 -0.62 -5.08 105.19 107.72 1hb4 n GLY 19 Ca 0.07 -2.05 0.09 0.00 0.00 0.00 0.00 46.02 44.13 1hb4 n GLY 19 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1hb4 n ASP 20 N -0.23 2.35 -4.44 1.61 3.85 -1.26 -4.91 116.55 113.52 1hb4 n ASP 20 Ca 0.00 -3.25 -0.44 0.00 -0.71 0.00 0.00 54.79 50.39 1hb4 n ASP 20 Cb 0.00 -0.46 -0.03 0.00 -1.35 0.00 0.00 41.12 39.28 1hb4 n ASP 20 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 1hb4 s ASP 21 N -2.86 6.41 0.21 -1.12 -1.08 -1.26 -4.91 116.67 112.05 1hb4 s ASP 21 Ca 0.34 -1.60 -0.10 0.00 -0.52 0.00 0.00 52.55 50.68 1hb4 s ASP 21 Cb 0.30 -2.39 0.17 0.00 -1.46 0.00 0.00 42.92 39.55 1hb4 s ASP 21 CO 0.02 -1.20 1.87 1.56 0.52 0.00 0.00 175.17 177.94 1hb4 h GLN 22 N 9.13 0.96 -0.65 4.34 1.08 -1.95 -1.34 115.11 126.69 1hb4 h GLN 22 Ca -0.06 -0.06 -0.02 0.00 -1.45 0.00 0.00 58.65 57.06 1hb4 h GLN 22 Cb 1.05 -0.22 -0.03 0.00 -0.05 0.00 0.00 27.48 28.23 1hb4 h GLN 22 CO 1.13 0.64 0.31 0.00 -0.95 0.00 0.00 178.83 179.95 1hb4 h ALA 23 N 1.29 0.84 -0.82 3.87 0.00 -2.00 -1.15 119.26 121.28 1hb4 h ALA 23 Ca 0.28 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 55.07 1hb4 h ALA 23 Cb -0.08 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 17.41 1hb4 h ALA 23 CO -0.08 0.40 0.54 0.00 0.00 0.00 0.00 179.25 180.12 1hb4 h ALA 24 N 1.14 1.06 -0.55 0.00 0.00 -1.89 -1.80 119.26 117.22 1hb4 h ALA 24 Ca 0.22 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 55.02 1hb4 h ALA 24 Cb 0.13 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1hb4 h ALA 24 CO -0.03 0.42 0.08 0.87 0.00 0.00 0.00 179.25 180.59 1hb4 h LYS 25 N 1.08 0.88 -0.51 0.00 1.57 -0.86 -1.99 116.57 116.74 1hb4 h LYS 25 Ca 0.31 -0.21 -0.05 0.00 -1.87 0.00 0.00 60.65 58.83 1hb4 h LYS 25 Cb -0.08 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.09 1hb4 h LYS 25 CO -0.08 0.83 0.13 0.52 -0.57 0.00 0.00 179.45 180.27 1hb4 h MET 26 N 0.83 0.78 -0.10 3.15 2.86 -0.42 -0.02 114.93 122.01 1hb4 h MET 26 Ca 0.17 -0.15 -0.09 0.00 -2.06 0.00 0.00 59.70 57.57 1hb4 h MET 26 Cb 0.39 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 31.92 1hb4 h MET 26 CO 0.01 0.70 -0.35 0.00 1.06 0.00 0.00 176.91 178.33 1hb4 h ARG 27 N 0.75 0.21 -0.28 1.72 3.08 -0.83 -0.67 114.38 118.36 1hb4 h ARG 27 Ca 0.17 -0.08 -0.12 0.00 0.07 0.00 0.00 59.98 60.01 1hb4 h ARG 27 Cb 0.27 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.31 1hb4 h ARG 27 CO -0.00 0.54 -0.30 0.28 -1.07 0.00 0.00 179.97 179.42 1hb4 h VAL 28 N 0.18 1.30 -0.98 2.04 2.07 -0.86 -2.95 116.25 117.06 1hb4 h VAL 28 Ca 0.02 -1.47 0.09 0.00 0.82 0.00 0.00 66.70 66.16 1hb4 h VAL 28 Cb 0.71 1.61 -0.07 0.00 -1.52 0.00 0.00 31.29 32.01 1hb4 h VAL 28 CO 0.05 0.47 0.62 0.00 0.02 0.00 0.00 177.57 178.73 1hb4 h ALA 29 N 0.69 1.41 -0.85 1.67 0.00 -0.52 -0.89 119.26 120.76 1hb4 h ALA 29 Ca 0.04 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1hb4 h ALA 29 Cb 0.87 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.37 1hb4 h ALA 29 CO 0.07 0.32 0.43 0.37 0.00 0.00 0.00 179.25 180.44 1hb4 h GLN 30 N 1.06 1.21 -0.61 0.00 -0.00 -1.05 0.12 115.11 115.84 1hb4 h GLN 30 Ca 0.45 -0.16 -0.07 0.00 -0.00 0.00 0.00 58.65 58.86 1hb4 h GLN 30 Cb 0.31 -0.23 -0.03 0.00 0.00 0.00 0.00 27.48 27.54 1hb4 h GLN 30 CO -0.22 0.91 0.09 1.96 0.00 0.00 0.00 178.83 181.57 1hb4 h GLN 31 N 1.21 1.00 -0.56 1.69 4.20 -1.06 -0.62 115.11 120.97 1hb4 h GLN 31 Ca 0.30 -0.26 -0.07 0.00 0.06 0.00 0.00 58.65 58.68 1hb4 h GLN 31 Cb 0.08 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 27.72 1hb4 h GLN 31 CO -0.04 0.93 0.08 0.82 -0.67 0.00 0.00 178.83 179.95 1hb4 h ILE 32 N 0.94 1.26 -0.28 2.54 2.04 -0.78 -1.17 117.51 122.06 1hb4 h ILE 32 Ca 0.19 -0.98 0.02 0.00 1.00 0.00 0.00 64.86 65.08 1hb4 h ILE 32 Cb 0.43 0.80 -0.02 0.00 -0.74 0.00 0.00 36.82 37.28 1hb4 h ILE 32 CO 0.01 0.36 0.14 -0.78 0.00 0.00 0.00 178.15 177.88 1hb4 h ASP 33 N 0.83 0.21 -0.20 1.72 3.58 -0.40 0.36 116.42 122.51 1hb4 h ASP 33 Ca 0.17 0.01 -0.00 0.00 0.42 0.00 0.00 57.03 57.63 1hb4 h ASP 33 Cb 0.42 -0.03 -0.01 0.00 1.72 0.00 0.00 39.33 41.44 1hb4 h ASP 33 CO 0.01 0.16 0.12 0.00 -2.88 0.00 0.00 179.24 176.65 1hb4 h ALA 34 N 1.14 0.26 -0.63 -0.78 0.00 -0.97 -1.19 119.26 117.10 1hb4 h ALA 34 Ca 0.12 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 1hb4 h ALA 34 Cb 0.04 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1hb4 h ALA 34 CO -0.08 -0.23 0.16 0.00 0.00 0.00 0.00 179.25 179.11 1hb4 h ALA 35 N 1.03 1.10 0.00 0.00 0.00 -1.02 -1.61 119.26 118.76 1hb4 h ALA 35 Ca 0.07 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.69 1hb4 h ALA 35 Cb 0.03 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1hb4 h ALA 35 CO -0.01 0.60 -0.35 0.77 0.00 0.00 0.00 179.25 180.26 1hb4 h SER 36 N 0.94 0.00 0.76 0.00 0.02 -0.60 -0.57 113.55 114.09 1hb4 h SER 36 Ca 0.20 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.15 1hb4 h SER 36 Cb 0.32 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.86 1hb4 h SER 36 CO -0.00 0.35 -0.46 0.54 -1.14 0.00 0.00 176.83 176.12 1hb4 n ARG 37 N -3.87 0.13 0.00 3.45 1.74 -0.48 -4.32 116.66 113.31 1hb4 n ARG 37 Ca -0.01 0.05 0.00 0.00 -0.77 0.00 0.00 57.85 57.11 1hb4 n ARG 37 Cb 0.42 -1.59 0.00 0.00 -1.02 0.00 0.00 32.46 30.27 1hb4 n ARG 37 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1hb4 n ASP 38 N -1.78 0.00 0.20 0.55 4.64 -0.63 -4.89 116.55 114.64 1hb4 n ASP 38 Ca 0.05 0.00 0.10 0.00 -1.38 0.00 0.00 54.79 53.55 1hb4 n ASP 38 Cb 0.38 0.00 0.22 0.00 -1.04 0.00 0.00 41.12 40.68 1hb4 n ASP 38 CO 0.00 0.00 0.00 0.71 -0.82 0.00 0.00 177.20 177.09 1hb4 h THR 39 N 0.00 0.31 0.00 5.18 1.35 -1.80 -3.47 112.91 114.48 1hb4 h THR 39 Ca 0.00 -1.31 0.00 0.00 -0.55 0.00 0.00 66.41 64.55 1hb4 h THR 39 Cb 0.00 2.04 0.00 0.00 -1.73 0.00 0.00 68.15 68.46 1hb4 h THR 39 CO 0.00 0.17 0.00 0.61 -0.25 0.00 0.00 175.52 176.05 1hb4 n GLY 40 N 0.92 0.70 3.20 5.82 0.00 -0.28 -4.80 105.19 110.75 1hb4 n GLY 40 Ca 0.03 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.84 1hb4 n GLY 40 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1hb4 s PHE 41 N -2.32 1.42 0.08 1.61 0.40 -1.26 -4.15 117.98 113.77 1hb4 s PHE 41 Ca 0.00 -0.41 -0.15 0.00 -0.60 0.00 0.00 56.93 55.77 1hb4 s PHE 41 Cb 0.00 -0.81 0.03 0.00 0.51 0.00 0.00 43.02 42.75 1hb4 s PHE 41 CO 0.00 0.09 0.35 -0.59 0.70 0.00 0.00 175.22 175.77 1hb4 s PHE 42 N -1.09 -0.15 -0.22 0.36 -0.12 -0.91 -4.22 117.98 111.63 1hb4 s PHE 42 Ca 0.02 -0.07 -0.12 0.00 -0.05 0.00 0.00 56.93 56.71 1hb4 s PHE 42 Cb -0.09 0.17 -0.05 0.00 -0.63 0.00 0.00 43.02 42.42 1hb4 s PHE 42 CO 0.02 -0.60 0.22 0.71 -0.05 0.00 0.00 175.22 175.52 1hb4 s TYR 43 N -3.19 3.34 -0.22 3.49 1.51 0.14 -0.57 117.35 121.86 1hb4 s TYR 43 Ca -0.01 0.34 -0.26 0.00 -1.01 0.00 0.00 57.07 56.13 1hb4 s TYR 43 Cb 0.01 -2.32 -0.00 0.00 -0.11 0.00 0.00 41.96 39.54 1hb4 s TYR 43 CO -0.07 0.08 0.88 0.00 -1.11 0.00 0.00 175.55 175.32 1hb4 s ALA 44 N 1.02 3.62 0.30 3.71 0.00 0.69 -0.67 121.76 130.43 1hb4 s ALA 44 Ca 0.10 -0.02 0.11 0.00 0.00 0.00 0.00 51.96 52.15 1hb4 s ALA 44 Cb -0.13 -3.33 -0.05 0.00 0.00 0.00 0.00 23.12 19.60 1hb4 s ALA 44 CO 0.05 -0.88 -0.12 0.14 0.00 0.00 0.00 175.76 174.94 1hb4 s VAL 45 N 2.74 2.62 -1.34 0.00 -7.23 -0.29 -1.84 120.40 115.07 1hb4 s VAL 45 Ca 0.38 -2.23 -0.08 0.00 -1.81 0.00 0.00 61.98 58.24 1hb4 s VAL 45 Cb -0.16 -2.52 0.01 0.00 0.56 0.00 0.00 36.38 34.27 1hb4 s VAL 45 CO 0.08 -0.33 1.13 0.59 -0.31 0.00 0.00 175.10 176.26 1hb4 n ASN 46 N -0.74 -5.34 0.03 4.85 3.02 -1.26 -1.91 115.26 113.90 1hb4 n ASN 46 Ca -0.05 -0.58 0.13 0.00 -0.03 0.00 0.00 54.58 54.04 1hb4 n ASN 46 Cb 0.61 -4.94 0.32 0.00 -0.61 0.00 0.00 39.78 35.16 1hb4 n ASN 46 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1hb4 n HIS 47 N -4.81 0.28 -0.67 3.10 1.44 -1.26 -3.70 115.22 109.59 1hb4 n HIS 47 Ca -0.05 0.08 0.00 0.00 -2.01 0.00 0.00 57.72 55.74 1hb4 n HIS 47 Cb 0.58 -0.51 0.00 0.00 0.12 0.00 0.00 29.99 30.18 1hb4 n HIS 47 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1hb4 n GLY 48 N 1.43 1.41 3.83 -1.39 0.00 -1.26 -4.90 105.19 104.30 1hb4 n GLY 48 Ca 0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.69 1hb4 n GLY 48 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1hb4 s ILE 49 N -3.58 4.99 -1.03 -0.61 1.01 -1.26 -5.01 121.20 115.71 1hb4 s ILE 49 Ca 0.00 0.90 -0.22 0.00 0.00 0.00 0.00 60.65 61.33 1hb4 s ILE 49 Cb 0.00 -3.74 0.06 0.00 0.01 0.00 0.00 42.46 38.79 1hb4 s ILE 49 CO 0.00 0.56 1.43 0.21 0.00 0.00 0.00 174.94 177.14 1hb4 s ASN 50 N -1.00 6.55 0.32 3.58 3.84 -1.26 -4.81 114.94 122.15 1hb4 s ASN 50 Ca 0.25 -1.62 0.17 0.00 0.21 0.00 0.00 52.86 51.87 1hb4 s ASN 50 Cb -0.17 -2.55 0.30 0.00 -0.55 0.00 0.00 41.25 38.28 1hb4 s ASN 50 CO 0.14 -1.42 1.55 -0.37 -2.79 0.00 0.00 177.10 174.21 1hb4 h VAL 51 N 6.56 0.86 -0.48 -5.21 -1.51 -1.94 -2.22 116.25 112.31 1hb4 h VAL 51 Ca 0.21 -1.97 -0.09 0.00 -1.23 0.00 0.00 66.70 63.63 1hb4 h VAL 51 Cb 1.00 2.25 -0.02 0.00 -2.13 0.00 0.00 31.29 32.39 1hb4 h VAL 51 CO 1.39 0.45 -0.06 -0.61 -1.23 0.00 0.00 177.57 177.51 1hb4 h GLN 52 N 0.00 0.89 -0.47 5.19 -0.00 -1.89 -0.83 115.11 118.00 1hb4 h GLN 52 Ca -0.00 -0.31 -0.12 0.00 -0.00 0.00 0.00 58.65 58.21 1hb4 h GLN 52 Cb 1.21 -0.07 -0.01 0.00 0.00 0.00 0.00 27.48 28.61 1hb4 h GLN 52 CO 0.06 0.96 -0.19 -0.09 0.00 0.00 0.00 178.83 179.57 1hb4 h ARG 53 N 0.75 0.96 -0.49 1.69 2.43 -1.95 -0.49 114.38 117.27 1hb4 h ARG 53 Ca 0.13 -0.40 0.07 0.00 -0.81 0.00 0.00 59.98 58.97 1hb4 h ARG 53 Cb 0.59 -0.04 -0.06 0.00 -0.42 0.00 0.00 29.97 30.04 1hb4 h ARG 53 CO 0.04 1.07 0.14 1.25 -1.51 0.00 0.00 179.97 180.96 1hb4 h LEU 54 N 0.80 0.11 -0.96 3.80 5.85 -1.23 -0.27 115.31 123.41 1hb4 h LEU 54 Ca 0.11 0.07 -0.07 0.00 0.84 0.00 0.00 57.88 58.83 1hb4 h LEU 54 Cb 0.76 0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.84 1hb4 h LEU 54 CO 0.06 0.09 -0.03 -1.28 -0.34 0.00 0.00 178.44 176.94 1hb4 h SER 55 N 0.30 0.69 -0.27 1.25 0.87 -0.81 -0.65 113.55 114.94 1hb4 h SER 55 Ca 0.24 -0.17 -0.09 0.00 -1.23 0.00 0.00 61.79 60.54 1hb4 h SER 55 Cb 0.28 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 62.05 1hb4 h SER 55 CO -0.27 0.78 -0.19 -0.61 -0.53 0.00 0.00 176.83 176.01 1hb4 h GLN 56 N 0.67 0.60 -0.48 2.24 5.75 -0.50 -0.36 115.11 123.03 1hb4 h GLN 56 Ca 0.13 -0.29 -0.10 0.00 -0.15 0.00 0.00 58.65 58.24 1hb4 h GLN 56 Cb 0.46 -0.00 -0.02 0.00 1.07 0.00 0.00 27.48 28.99 1hb4 h GLN 56 CO 0.02 0.87 -0.12 0.87 -2.65 0.00 0.00 178.83 177.83 1hb4 h LYS 57 N 0.33 0.89 -0.51 1.69 1.79 -0.93 -1.36 116.57 118.46 1hb4 h LYS 57 Ca 0.05 -0.32 -0.11 0.00 -2.18 0.00 0.00 60.65 58.10 1hb4 h LYS 57 Cb 0.72 -0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 31.29 1hb4 h LYS 57 CO 0.05 0.96 -0.11 1.15 -1.08 0.00 0.00 179.45 180.42 1hb4 h THR 58 N 0.80 1.27 -0.47 -0.16 2.02 -1.02 -2.37 112.91 112.98 1hb4 h THR 58 Ca 0.13 -1.24 -0.03 0.00 0.77 0.00 0.00 66.41 66.04 1hb4 h THR 58 Cb 0.64 0.99 -0.02 0.00 -1.74 0.00 0.00 68.15 68.02 1hb4 h THR 58 CO 0.04 0.43 0.19 0.50 0.37 0.00 0.00 175.52 177.05 1hb4 h LYS 59 N 0.85 0.70 -0.92 6.66 3.64 -0.83 -1.02 116.57 125.65 1hb4 h LYS 59 Ca 0.14 -0.13 0.04 0.00 -1.27 0.00 0.00 60.65 59.42 1hb4 h LYS 59 Cb 0.65 -0.11 -0.05 0.00 -0.41 0.00 0.00 32.23 32.30 1hb4 h LYS 59 CO 0.05 0.63 0.60 0.93 -2.27 0.00 0.00 179.45 179.39 1hb4 h GLU 60 N 0.61 1.12 0.32 1.90 5.08 -1.08 -1.15 114.58 121.38 1hb4 h GLU 60 Ca 0.16 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.43 1hb4 h GLU 60 Cb 0.20 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 29.20 1hb4 h GLU 60 CO -0.01 0.74 -0.15 0.35 -1.00 0.00 0.00 179.01 178.93 1hb4 h PHE 61 N 1.15 -0.40 -0.41 4.33 3.57 -1.02 -2.92 116.94 121.24 1hb4 h PHE 61 Ca 0.37 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.84 1hb4 h PHE 61 Cb 0.01 0.13 -0.02 0.00 2.79 0.00 0.00 35.95 38.86 1hb4 h PHE 61 CO -0.01 -0.11 0.17 0.45 -2.23 0.00 0.00 178.31 176.58 1hb4 h HIS 62 N -0.67 0.57 -0.01 0.41 3.86 -0.93 -1.68 115.15 116.71 1hb4 h HIS 62 Ca -0.04 -0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.15 1hb4 h HIS 62 Cb 0.47 -0.18 0.00 0.00 1.06 0.00 0.00 27.41 28.76 1hb4 h HIS 62 CO 0.00 0.45 -0.21 -1.33 0.86 0.00 0.00 177.93 177.70 1hb4 n MET 63 N -4.38 0.69 -0.01 2.45 2.81 -0.46 -4.03 117.12 114.19 1hb4 n MET 63 Ca 0.03 -0.34 0.03 0.00 -1.81 0.00 0.00 57.70 55.61 1hb4 n MET 63 Cb 0.14 -1.49 -0.07 0.00 -0.71 0.00 0.00 33.22 31.09 1hb4 n MET 63 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 1hb4 n SER 64 N -0.85 2.98 -4.78 7.83 3.41 -1.00 -5.00 113.62 116.21 1hb4 n SER 64 Ca 0.12 0.00 -0.41 0.00 -0.26 0.00 0.00 58.87 58.33 1hb4 n SER 64 Cb 0.32 1.31 -0.01 0.00 -0.26 0.00 0.00 64.21 65.58 1hb4 n SER 64 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 175.04 174.37 1hb4 s ILE 65 N -2.56 2.27 0.30 -1.33 2.07 -0.67 -5.00 121.20 116.29 1hb4 s ILE 65 Ca -0.03 0.27 0.07 0.00 -1.41 0.00 0.00 60.65 59.54 1hb4 s ILE 65 Cb 0.05 -3.17 -0.03 0.00 0.13 0.00 0.00 42.46 39.45 1hb4 s ILE 65 CO 0.36 0.06 0.31 0.42 -1.91 0.00 0.00 174.94 174.18 1hb4 s THR 66 N -1.13 4.04 0.34 4.00 -4.23 -1.26 -4.99 115.64 112.40 1hb4 s THR 66 Ca 0.52 -1.27 0.05 0.00 -1.18 0.00 0.00 61.69 59.81 1hb4 s THR 66 Cb -0.44 -3.35 0.30 0.00 1.34 0.00 0.00 72.50 70.35 1hb4 s THR 66 CO 0.60 -0.23 1.91 -0.65 -0.54 0.00 0.00 174.62 175.70 1hb4 h PRO 67 N 1.24 0.80 -0.37 3.99 0.11 -1.99 -1.16 132.00 134.61 1hb4 h PRO 67 Ca -0.47 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1hb4 h PRO 67 Cb 1.25 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 32.16 1hb4 h PRO 67 CO 0.58 0.53 0.24 1.49 -0.21 0.00 0.00 178.00 180.62 1hb4 h GLU 68 N 0.82 0.49 -0.65 1.05 4.81 -2.01 -2.45 114.58 116.65 1hb4 h GLU 68 Ca 0.39 -0.04 -0.07 0.00 -0.13 0.00 0.00 59.36 59.52 1hb4 h GLU 68 Cb 0.42 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.67 1hb4 h GLU 68 CO -0.16 0.34 0.15 0.93 -0.73 0.00 0.00 179.01 179.54 1hb4 h GLU 69 N 0.49 1.03 -0.75 1.92 5.08 -1.68 -2.12 114.58 118.56 1hb4 h GLU 69 Ca 0.13 -0.24 0.02 0.00 -1.00 0.00 0.00 59.36 58.27 1hb4 h GLU 69 Cb -0.03 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 29.04 1hb4 h GLU 69 CO -0.03 0.92 0.49 0.87 -1.00 0.00 0.00 179.01 180.26 1hb4 h LYS 70 N 0.98 0.95 -0.58 2.33 1.57 -0.98 -0.30 116.57 120.54 1hb4 h LYS 70 Ca 0.21 -0.06 -0.09 0.00 -1.87 0.00 0.00 60.65 58.84 1hb4 h LYS 70 Cb 0.36 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 32.44 1hb4 h LYS 70 CO 0.00 0.63 0.00 -1.49 -0.57 0.00 0.00 179.45 178.02 1hb4 h TRP 71 N 0.97 1.08 0.00 -1.35 -0.00 -1.19 -0.73 115.95 114.73 1hb4 h TRP 71 Ca 0.28 -0.18 0.00 0.00 -0.00 0.00 0.00 58.89 59.00 1hb4 h TRP 71 Cb -0.06 -0.28 0.00 0.00 -0.00 0.00 0.00 29.16 28.81 1hb4 h TRP 71 CO -0.03 0.96 0.00 -0.44 -0.00 0.00 0.00 178.44 178.93 1hb4 h ASP 72 N 0.91 0.00 -0.02 -3.49 3.32 -0.77 -2.68 116.42 113.70 1hb4 h ASP 72 Ca 0.17 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.22 1hb4 h ASP 72 Cb 0.53 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.08 1hb4 h ASP 72 CO 0.03 0.00 -0.00 0.18 -1.72 0.00 0.00 179.24 177.72 1hb4 n LEU 73 N -3.04 2.14 -4.77 1.55 4.77 -0.18 -5.06 117.00 112.41 1hb4 n LEU 73 Ca 0.00 -1.00 -0.40 0.00 -0.03 0.00 0.00 56.01 54.59 1hb4 n LEU 73 Cb 0.29 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.37 1hb4 n LEU 73 CO 0.26 0.39 1.00 0.00 -1.33 0.00 0.00 177.39 177.72 1hb4 s ALA 74 N -1.16 3.35 0.96 -1.18 0.00 -0.31 -0.95 121.76 122.47 1hb4 s ALA 74 Ca 0.16 1.32 -0.12 0.00 0.00 0.00 0.00 51.96 53.32 1hb4 s ALA 74 Cb 0.12 -3.52 0.17 0.00 0.00 0.00 0.00 23.12 19.88 1hb4 s ALA 74 CO 0.18 -0.87 1.09 0.96 0.00 0.00 0.00 175.76 177.11 1hb4 s ILE 75 N -1.21 2.39 0.48 0.00 -4.36 -0.67 -4.66 121.20 113.16 1hb4 s ILE 75 Ca 0.55 0.13 0.20 0.00 -0.26 0.00 0.00 60.65 61.27 1hb4 s ILE 75 Cb -0.40 -2.53 0.37 0.00 1.25 0.00 0.00 42.46 41.15 1hb4 s ILE 75 CO 0.53 -0.16 1.96 -0.09 0.24 0.00 0.00 174.94 177.42 1hb4 h ARG 76 N -1.80 0.22 0.00 0.37 2.43 -1.04 -0.70 114.38 113.85 1hb4 h ARG 76 Ca -0.52 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 58.62 1hb4 h ARG 76 Cb 1.30 -0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 30.80 1hb4 h ARG 76 CO 0.54 0.14 -0.06 0.00 -1.51 0.00 0.00 179.97 179.08 1hb4 h ALA 77 N 1.69 1.70 0.00 2.80 0.00 -1.92 -2.97 119.26 120.57 1hb4 h ALA 77 Ca 0.30 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.15 1hb4 h ALA 77 Cb 0.89 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.66 1hb4 h ALA 77 CO -0.06 0.08 -1.61 0.66 0.00 0.00 0.00 179.25 178.33 1hb4 n TYR 78 N -4.17 0.00 -3.60 0.00 4.02 -0.40 -4.93 117.16 108.07 1hb4 n TYR 78 Ca -0.03 0.00 -0.27 0.00 -0.01 0.00 0.00 57.90 57.59 1hb4 n TYR 78 Cb 0.15 -0.31 -0.16 0.00 -0.02 0.00 0.00 39.34 39.00 1hb4 n TYR 78 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 176.86 177.06 1hb4 s ASN 79 N -3.53 2.69 0.47 7.72 3.84 -0.43 -5.01 114.94 120.69 1hb4 s ASN 79 Ca -0.05 -0.80 0.32 0.00 0.21 0.00 0.00 52.86 52.54 1hb4 s ASN 79 Cb 0.08 -0.29 1.59 0.00 -0.55 0.00 0.00 41.25 42.08 1hb4 s ASN 79 CO 0.54 -0.37 1.97 0.11 -2.79 0.00 0.00 177.10 176.56 1hb4 h LYS 80 N 8.40 0.00 0.00 0.43 1.57 -1.86 -2.08 116.57 123.03 1hb4 h LYS 80 Ca -0.16 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.62 1hb4 h LYS 80 Cb 1.11 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.42 1hb4 h LYS 80 CO 0.33 0.00 0.00 0.93 -0.57 0.00 0.00 179.45 180.14 1hb4 h GLU 81 N 0.00 0.00 -2.35 3.15 5.08 -1.95 -3.34 114.58 115.17 1hb4 h GLU 81 Ca 0.00 0.00 -0.75 0.00 -1.00 0.00 0.00 59.36 57.61 1hb4 h GLU 81 Cb 0.18 0.00 -0.32 0.00 0.50 0.00 0.00 28.75 29.11 1hb4 h GLU 81 CO 0.00 0.00 0.51 0.72 -1.00 0.00 0.00 179.01 179.24 1hb4 n HIS 82 N -3.02 3.05 0.29 4.33 8.25 -0.78 -4.85 115.22 122.49 1hb4 n HIS 82 Ca 0.01 -3.00 0.16 0.00 -0.26 0.00 0.00 57.72 54.64 1hb4 n HIS 82 Cb 0.31 -1.00 0.89 0.00 1.12 0.00 0.00 29.99 31.31 1hb4 n HIS 82 CO 0.00 0.00 0.00 1.96 0.64 0.00 0.00 176.34 178.94 1hb4 h GLN 83 N 4.10 0.00 0.00 -0.41 1.08 -1.81 -1.29 115.11 116.78 1hb4 h GLN 83 Ca 0.37 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.57 1hb4 h GLN 83 Cb 0.43 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.86 1hb4 h GLN 83 CO 1.10 0.05 -0.03 -0.25 -0.95 0.00 0.00 178.83 178.75 1hb4 n ASP 84 N -3.49 0.52 -4.38 1.46 8.00 -1.26 -4.60 116.55 112.81 1hb4 n ASP 84 Ca -0.02 0.52 -0.46 0.00 0.71 0.00 0.00 54.79 55.54 1hb4 n ASP 84 Cb 0.17 -0.64 -0.02 0.00 -0.02 0.00 0.00 41.12 40.61 1hb4 n ASP 84 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1hb4 s GLN 85 N -3.07 3.59 -0.22 -1.24 -0.21 -0.49 -4.78 119.66 113.25 1hb4 s GLN 85 Ca 0.12 -2.16 -0.08 0.00 0.02 0.00 0.00 55.36 53.25 1hb4 s GLN 85 Cb 0.15 -4.62 -0.19 0.00 1.00 0.00 0.00 33.01 29.35 1hb4 s GLN 85 CO 0.58 -1.49 -0.02 0.28 -2.12 0.00 0.00 175.29 172.52 1hb4 n VAL 86 N 4.61 1.59 -0.13 1.09 0.31 -1.26 -0.77 118.33 123.76 1hb4 n VAL 86 Ca 0.17 -0.45 -0.28 0.00 -0.01 0.00 0.00 64.34 63.77 1hb4 n VAL 86 Cb 0.48 -1.72 -0.09 0.00 -0.91 0.00 0.00 33.84 31.59 1hb4 n VAL 86 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1hb4 n ARG 87 N -3.77 0.55 -3.17 5.55 1.74 -1.26 -4.80 116.66 111.51 1hb4 n ARG 87 Ca -0.42 0.24 -0.39 0.00 -0.77 0.00 0.00 57.85 56.51 1hb4 n ARG 87 Cb 0.93 -1.42 -0.05 0.00 -1.02 0.00 0.00 32.46 30.89 1hb4 n ARG 87 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1hb4 s ALA 88 N -2.48 3.45 0.00 7.54 0.00 -1.26 -4.67 121.76 124.34 1hb4 s ALA 88 Ca -0.36 0.06 0.00 0.00 0.00 0.00 0.00 51.96 51.66 1hb4 s ALA 88 Cb 0.14 -2.79 0.00 0.00 0.00 0.00 0.00 23.12 20.47 1hb4 s ALA 88 CO 0.46 0.11 0.00 0.41 0.00 0.00 0.00 175.76 176.74 1hb4 n GLY 89 N 2.57 0.85 3.79 0.00 0.00 -0.24 -4.66 105.19 107.50 1hb4 n GLY 89 Ca -0.06 -1.99 -0.38 0.00 0.00 0.00 0.00 46.02 43.59 1hb4 n GLY 89 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1hb4 s TYR 90 N -2.08 3.62 -0.40 1.61 5.04 -0.12 -1.10 117.35 123.91 1hb4 s TYR 90 Ca 0.00 0.87 -0.05 0.00 -2.44 0.00 0.00 57.07 55.45 1hb4 s TYR 90 Cb 0.00 -2.35 0.10 0.00 0.35 0.00 0.00 41.96 40.05 1hb4 s TYR 90 CO 0.00 0.44 0.21 0.71 -1.34 0.00 0.00 175.55 175.57 1hb4 s TYR 91 N -0.33 3.48 0.58 4.97 1.51 0.27 -1.68 117.35 126.16 1hb4 s TYR 91 Ca 0.23 -2.12 -0.16 0.00 -1.01 0.00 0.00 57.07 54.00 1hb4 s TYR 91 Cb -0.15 -3.07 -0.04 0.00 -0.11 0.00 0.00 41.96 38.58 1hb4 s TYR 91 CO 0.10 -0.93 1.06 -0.51 -1.11 0.00 0.00 175.55 174.16 1hb4 s LEU 92 N 1.23 3.54 0.68 -1.29 1.02 -1.26 -1.63 118.68 120.98 1hb4 s LEU 92 Ca 0.05 1.85 -0.08 0.00 0.02 0.00 0.00 54.13 55.97 1hb4 s LEU 92 Cb -0.23 -4.54 0.04 0.00 0.02 0.00 0.00 46.19 41.48 1hb4 s LEU 92 CO -0.02 -1.14 1.01 -0.94 0.02 0.00 0.00 176.35 175.28 1hb4 s SER 93 N -2.65 5.10 -0.38 2.29 1.04 -1.25 -4.79 113.70 113.05 1hb4 s SER 93 Ca 0.64 0.68 0.01 0.00 0.48 0.00 0.00 55.95 57.76 1hb4 s SER 93 Cb -0.16 -1.43 0.13 0.00 0.10 0.00 0.00 66.02 64.65 1hb4 s SER 93 CO 0.35 -1.44 0.20 -0.63 0.98 0.00 0.00 173.24 172.70 1hb4 s ILE 94 N -3.23 0.89 0.12 -1.02 1.01 -0.17 -4.97 121.20 113.82 1hb4 s ILE 94 Ca 0.58 -2.03 -0.35 0.00 0.00 0.00 0.00 60.65 58.85 1hb4 s ILE 94 Cb -0.11 -1.64 -0.16 0.00 0.01 0.00 0.00 42.46 40.56 1hb4 s ILE 94 CO 0.46 -0.87 1.29 -2.65 0.00 0.00 0.00 174.94 173.17 1hb4 n PRO 95 N 4.00 1.20 -0.10 2.79 -0.02 -1.26 -0.07 135.00 141.53 1hb4 n PRO 95 Ca 0.07 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 61.98 1hb4 n PRO 95 Cb 0.37 -2.03 0.00 0.00 -0.02 0.00 0.00 33.50 31.82 1hb4 n PRO 95 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1hb4 n GLY 96 N 2.37 1.77 0.34 -1.23 0.00 -1.26 -4.76 105.19 102.42 1hb4 n GLY 96 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1hb4 n GLY 96 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1hb4 n LYS 97 N -2.00 0.00 -3.74 1.61 4.76 0.90 -4.57 118.16 115.12 1hb4 n LYS 97 Ca 0.00 0.00 -0.22 0.00 -2.87 0.00 0.00 58.31 55.22 1hb4 n LYS 97 Cb 0.00 -0.52 -0.18 0.00 -1.84 0.00 0.00 35.03 32.50 1hb4 n LYS 97 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 1hb4 s LYS 98 N -1.37 0.42 -0.10 1.97 2.20 0.87 -2.93 119.74 120.79 1hb4 s LYS 98 Ca 0.00 0.16 -0.15 0.00 -0.36 0.00 0.00 55.97 55.62 1hb4 s LYS 98 Cb 0.00 -0.90 -0.27 0.00 -1.51 0.00 0.00 37.83 35.15 1hb4 s LYS 98 CO 0.00 -0.33 0.54 0.00 -0.36 0.00 0.00 175.35 175.20 1hb4 h ALA 99 N 8.36 0.20 -2.78 3.13 0.00 -1.85 -0.44 119.26 125.87 1hb4 h ALA 99 Ca -0.17 -1.12 -0.52 0.00 0.00 0.00 0.00 54.91 53.10 1hb4 h ALA 99 Cb 1.12 0.50 0.09 0.00 0.00 0.00 0.00 17.79 19.51 1hb4 h ALA 99 CO 0.23 0.87 0.50 0.54 0.00 0.00 0.00 179.25 181.40 1hb4 s VAL 100 N -2.49 2.80 0.05 0.00 0.11 -1.26 -4.56 120.40 115.06 1hb4 s VAL 100 Ca -0.20 0.57 -0.07 0.00 -2.93 0.00 0.00 61.98 59.35 1hb4 s VAL 100 Cb 0.05 -3.27 -0.01 0.00 -1.53 0.00 0.00 36.38 31.61 1hb4 s VAL 100 CO 0.77 -0.04 0.13 -1.83 -3.33 0.00 0.00 175.10 170.80 1hb4 s GLU 101 N -2.92 0.68 0.26 1.54 -1.05 -1.00 -3.81 118.70 112.41 1hb4 s GLU 101 Ca 0.69 -0.83 -0.21 0.00 -0.15 0.00 0.00 54.97 54.46 1hb4 s GLU 101 Cb -0.31 0.27 0.03 0.00 -0.44 0.00 0.00 34.13 33.68 1hb4 s GLU 101 CO 0.36 -0.19 0.77 -1.54 0.95 0.00 0.00 175.26 175.61 1hb4 s SER 102 N -2.40 -0.23 -0.08 0.83 1.04 -0.65 -0.60 113.70 111.61 1hb4 s SER 102 Ca -0.01 -0.60 -0.00 0.00 0.48 0.00 0.00 55.95 55.81 1hb4 s SER 102 Cb 0.01 0.69 0.02 0.00 0.10 0.00 0.00 66.02 66.85 1hb4 s SER 102 CO -0.07 -1.29 -0.05 0.12 0.98 0.00 0.00 173.24 172.93 1hb4 s PHE 103 N -3.71 1.05 -0.06 5.02 5.36 -0.68 -0.57 117.98 124.39 1hb4 s PHE 103 Ca 0.12 -0.41 0.03 0.00 -0.96 0.00 0.00 56.93 55.70 1hb4 s PHE 103 Cb -0.05 -0.94 -0.03 0.00 -0.34 0.00 0.00 43.02 41.66 1hb4 s PHE 103 CO 0.06 -0.35 -0.12 0.00 -1.46 0.00 0.00 175.22 173.35 1hb4 s TYR 105 N -0.68 0.64 0.11 0.00 -0.85 -0.64 -1.08 117.35 114.87 1hb4 s TYR 105 Ca 0.10 -0.72 0.01 0.00 -0.52 0.00 0.00 57.07 55.95 1hb4 s TYR 105 Cb -0.11 -0.40 0.01 0.00 0.38 0.00 0.00 41.96 41.84 1hb4 s TYR 105 CO 0.01 -0.17 0.08 1.28 -1.52 0.00 0.00 175.55 175.23 1hb4 n LEU 106 N 0.83 0.00 -4.67 -3.49 4.77 -1.26 -1.21 117.00 111.97 1hb4 n LEU 106 Ca -0.18 -0.59 -0.52 0.00 -0.03 0.00 0.00 56.01 54.68 1hb4 n LEU 106 Cb 0.57 -0.01 -0.06 0.00 -2.33 0.00 0.00 43.42 41.60 1hb4 n LEU 106 CO 0.24 -0.31 1.25 -3.20 -1.33 0.00 0.00 177.39 174.04 1hb4 n ASN 107 N -1.94 2.56 0.30 -1.43 2.85 -1.24 -4.84 115.26 111.51 1hb4 n ASN 107 Ca -0.01 1.06 0.20 0.00 -0.11 0.00 0.00 54.58 55.73 1hb4 n ASN 107 Cb 0.13 -1.25 1.05 0.00 1.24 0.00 0.00 39.78 40.95 1hb4 n ASN 107 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1hb4 h PRO 108 N 6.88 0.00 0.00 1.20 0.11 -1.94 -1.07 132.00 137.18 1hb4 h PRO 108 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1hb4 h PRO 108 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 1hb4 h PRO 108 CO 0.90 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 178.78 1hb4 n ASN 109 N -2.94 0.00 -4.57 -2.05 3.02 -1.26 -4.35 115.26 103.11 1hb4 n ASN 109 Ca -0.02 -0.13 -0.43 0.00 -0.03 0.00 0.00 54.58 53.97 1hb4 n ASN 109 Cb 0.10 -0.27 -0.01 0.00 -0.61 0.00 0.00 39.78 38.99 1hb4 n ASN 109 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1hb4 s PHE 110 N -2.55 2.78 0.43 3.10 0.08 -0.41 -4.74 117.98 116.68 1hb4 s PHE 110 Ca 0.26 -1.50 0.08 0.00 0.12 0.00 0.00 56.93 55.89 1hb4 s PHE 110 Cb 0.18 -4.71 0.01 0.00 -0.57 0.00 0.00 43.02 37.93 1hb4 s PHE 110 CO 0.40 -1.80 0.58 0.95 -0.10 0.00 0.00 175.22 175.25 1hb4 s THR 111 N 4.18 2.98 0.55 0.64 -4.23 -1.26 -4.25 115.64 114.25 1hb4 s THR 111 Ca 0.51 -0.98 0.26 0.00 -1.18 0.00 0.00 61.69 60.30 1hb4 s THR 111 Cb 0.03 -3.00 0.37 0.00 1.34 0.00 0.00 72.50 71.24 1hb4 s THR 111 CO 0.03 0.00 2.03 -0.65 -0.54 0.00 0.00 174.62 175.49 1hb4 h PRO 112 N 0.61 0.00 -0.01 3.99 0.11 -1.98 -0.89 132.00 133.83 1hb4 h PRO 112 Ca -0.40 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1hb4 h PRO 112 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 1hb4 h PRO 112 CO 0.45 0.00 -0.23 -0.40 -0.21 0.00 0.00 178.00 177.61 1hb4 n ASP 113 N -4.14 1.13 -4.77 -2.05 5.68 -1.26 -4.34 116.55 106.80 1hb4 n ASP 113 Ca 0.06 -0.99 -0.41 0.00 -0.50 0.00 0.00 54.79 52.95 1hb4 n ASP 113 Cb 0.49 0.13 -0.01 0.00 -1.14 0.00 0.00 41.12 40.58 1hb4 n ASP 113 CO 0.00 0.00 0.00 -2.28 -1.33 0.00 0.00 177.20 173.59 1hb4 s HIS 114 N -2.43 2.78 0.43 2.11 2.46 -0.34 -4.82 115.29 115.48 1hb4 s HIS 114 Ca 0.26 1.16 0.14 0.00 0.47 0.00 0.00 55.06 57.09 1hb4 s HIS 114 Cb 0.19 -3.92 1.03 0.00 -0.13 0.00 0.00 32.58 29.76 1hb4 s HIS 114 CO 0.50 -2.74 1.97 -1.35 -2.47 0.00 0.00 174.74 170.64 1hb4 h PRO 115 N 3.62 0.40 0.00 2.88 0.11 -1.91 -0.29 132.00 136.80 1hb4 h PRO 115 Ca -0.49 -0.02 -0.14 0.00 0.11 0.00 0.00 66.00 65.46 1hb4 h PRO 115 Cb 1.23 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.23 1hb4 h PRO 115 CO 0.68 0.26 -0.66 0.00 -0.21 0.00 0.00 178.00 178.07 1hb4 h ARG 116 N 0.41 0.00 -0.11 1.05 2.47 -1.95 -1.76 114.38 114.49 1hb4 h ARG 116 Ca 0.29 0.00 -0.20 0.00 -1.26 0.00 0.00 59.98 58.81 1hb4 h ARG 116 Cb 0.59 0.00 0.01 0.00 -1.65 0.00 0.00 29.97 28.92 1hb4 h ARG 116 CO -0.08 0.66 -0.73 0.82 0.56 0.00 0.00 179.97 181.20 1hb4 h ILE 117 N 0.00 1.31 -0.83 2.04 1.08 -1.54 -1.97 117.51 117.60 1hb4 h ILE 117 Ca -0.01 -1.98 -0.03 0.00 -0.39 0.00 0.00 64.86 62.45 1hb4 h ILE 117 Cb 1.37 2.14 -0.04 0.00 -3.07 0.00 0.00 36.82 37.22 1hb4 h ILE 117 CO 0.09 0.61 0.40 1.56 -0.69 0.00 0.00 178.15 180.12 1hb4 h GLN 118 N 0.36 1.18 0.00 2.37 1.08 -1.05 -1.97 115.11 117.09 1hb4 h GLN 118 Ca -0.06 -0.17 0.00 0.00 -1.45 0.00 0.00 58.65 56.97 1hb4 h GLN 118 Cb 1.38 -0.22 0.00 0.00 -0.05 0.00 0.00 27.48 28.59 1hb4 h GLN 118 CO 0.15 0.91 0.00 0.00 -0.95 0.00 0.00 178.83 178.94 1hb4 n ALA 119 N -2.42 2.30 -3.67 3.87 0.00 -0.67 -4.90 120.51 115.02 1hb4 n ALA 119 Ca 0.08 -0.11 -0.24 0.00 0.00 0.00 0.00 53.44 53.17 1hb4 n ALA 119 Cb 0.14 -1.44 0.06 0.00 0.00 0.00 0.00 19.45 18.21 1hb4 n ALA 119 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1hb4 n LYS 120 N -1.39 -6.90 -2.27 0.00 5.02 -0.74 -4.94 118.16 106.94 1hb4 n LYS 120 Ca 0.10 0.75 -0.42 0.00 -2.02 0.00 0.00 58.31 56.73 1hb4 n LYS 120 Cb 0.26 -5.72 -0.03 0.00 -0.02 0.00 0.00 35.03 29.52 1hb4 n LYS 120 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1hb4 s THR 121 N -3.35 3.50 0.55 -0.18 2.01 -0.79 -4.95 115.64 112.43 1hb4 s THR 121 Ca 0.48 1.13 -0.20 0.00 0.31 0.00 0.00 61.69 63.41 1hb4 s THR 121 Cb -0.22 -3.72 -0.07 0.00 0.01 0.00 0.00 72.50 68.50 1hb4 s THR 121 CO 0.76 0.12 0.88 -2.65 -0.69 0.00 0.00 174.62 173.04 1hb4 n PRO 122 N 3.45 0.92 -0.32 4.92 -0.02 -1.26 -2.64 135.00 140.04 1hb4 n PRO 122 Ca 0.09 0.35 0.00 0.00 -2.02 0.00 0.00 63.50 61.91 1hb4 n PRO 122 Cb 0.44 -2.04 0.00 0.00 -0.02 0.00 0.00 33.50 31.88 1hb4 n PRO 122 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1hb4 n THR 123 N -1.44 0.00 -3.95 3.45 -2.24 -1.26 -5.01 114.28 103.83 1hb4 n THR 123 Ca 0.12 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.56 1hb4 n THR 123 Cb 0.45 -0.01 -0.09 0.00 -2.10 0.00 0.00 70.33 68.58 1hb4 n THR 123 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1hb4 s HIS 124 N -3.16 3.30 0.05 4.78 3.76 -1.08 -5.03 115.29 117.92 1hb4 s HIS 124 Ca 0.00 0.16 -0.08 0.00 -0.15 0.00 0.00 55.06 54.99 1hb4 s HIS 124 Cb 0.00 -2.08 -0.00 0.00 1.11 0.00 0.00 32.58 31.61 1hb4 s HIS 124 CO 0.00 0.23 0.15 -1.21 -0.85 0.00 0.00 174.74 173.06 1hb4 s GLU 125 N 0.24 0.70 -0.12 1.40 2.02 -1.26 -4.81 118.70 116.86 1hb4 s GLU 125 Ca 0.05 -0.77 -0.23 0.00 0.02 0.00 0.00 54.97 54.04 1hb4 s GLU 125 Cb -0.12 0.28 -0.03 0.00 0.10 0.00 0.00 34.13 34.36 1hb4 s GLU 125 CO -0.00 -0.20 0.71 0.08 0.02 0.00 0.00 175.26 175.88 1hb4 s VAL 126 N -2.95 5.00 0.61 2.63 1.01 -1.26 -4.81 120.40 120.63 1hb4 s VAL 126 Ca -0.02 1.43 -0.19 0.00 0.00 0.00 0.00 61.98 63.20 1hb4 s VAL 126 Cb 0.01 -4.04 -0.03 0.00 0.00 0.00 0.00 36.38 32.31 1hb4 s VAL 126 CO -0.06 0.17 1.17 0.59 0.00 0.00 0.00 175.10 176.96 1hb4 n ASN 127 N 4.42 1.63 -4.56 3.32 3.02 -1.26 -4.99 115.26 116.83 1hb4 n ASN 127 Ca 0.00 0.85 -0.33 0.00 -0.03 0.00 0.00 54.58 55.07 1hb4 n ASN 127 Cb 0.50 -1.49 -0.11 0.00 -0.61 0.00 0.00 39.78 38.07 1hb4 n ASN 127 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 1hb4 s VAL 128 N -1.42 3.56 0.06 2.41 -7.23 -1.26 -5.11 120.40 111.41 1hb4 s VAL 128 Ca 0.78 -0.59 0.04 0.00 -1.81 0.00 0.00 61.98 60.40 1hb4 s VAL 128 Cb -0.40 -2.46 -0.03 0.00 0.56 0.00 0.00 36.38 34.05 1hb4 s VAL 128 CO 0.45 0.56 -0.12 0.26 -0.31 0.00 0.00 175.10 175.94 1hb4 s TRP 129 N -0.83 0.99 1.02 2.82 0.52 -1.26 -4.82 118.94 117.38 1hb4 s TRP 129 Ca 0.13 -0.46 -0.12 0.00 0.02 0.00 0.00 56.10 55.66 1hb4 s TRP 129 Cb -0.11 -0.57 0.20 0.00 -1.15 0.00 0.00 33.47 31.84 1hb4 s TRP 129 CO 0.02 -0.00 1.08 -1.25 0.02 0.00 0.00 176.95 176.83 1hb4 s PRO 130 N -1.61 0.23 0.25 4.98 0.04 -1.26 -4.95 135.00 132.68 1hb4 s PRO 130 Ca -0.05 0.59 -0.31 0.00 0.04 0.00 0.00 61.00 61.27 1hb4 s PRO 130 Cb -0.10 -1.71 -0.11 0.00 0.04 0.00 0.00 34.50 32.62 1hb4 s PRO 130 CO 0.01 -2.89 1.62 0.34 0.04 0.00 0.00 177.00 176.12 1hb4 s ASP 131 N -3.29 6.42 0.30 6.66 2.15 -1.26 -4.90 116.67 122.74 1hb4 s ASP 131 Ca 0.66 2.87 -0.02 0.00 0.43 0.00 0.00 52.55 56.49 1hb4 s ASP 131 Cb -0.20 -2.62 0.44 0.00 -0.30 0.00 0.00 42.92 40.25 1hb4 s ASP 131 CO 0.59 -0.90 1.96 -0.08 -0.17 0.00 0.00 175.17 176.57 1hb4 h GLU 132 N 5.63 1.08 0.00 4.34 4.57 -1.92 -1.36 114.58 126.92 1hb4 h GLU 132 Ca -0.45 -0.07 -0.07 0.00 -1.18 0.00 0.00 59.36 57.58 1hb4 h GLU 132 Cb 1.21 -0.24 -0.01 0.00 -0.16 0.00 0.00 28.75 29.55 1hb4 h GLU 132 CO 0.85 0.72 -0.35 1.79 -1.18 0.00 0.00 179.01 180.84 1hb4 h THR 133 N 1.11 0.99 0.02 0.32 1.35 -1.99 -1.76 112.91 112.94 1hb4 h THR 133 Ca 0.30 -1.33 -0.23 0.00 -0.55 0.00 0.00 66.41 64.59 1hb4 h THR 133 Cb -0.11 1.78 -0.03 0.00 -1.73 0.00 0.00 68.15 68.06 1hb4 h THR 133 CO -0.06 0.35 -1.14 0.11 -0.25 0.00 0.00 175.52 174.52 1hb4 h LYS 134 N 0.00 0.05 -2.12 4.72 1.57 -1.82 -3.39 116.57 115.58 1hb4 h LYS 134 Ca -0.00 -0.08 -0.56 0.00 -1.87 0.00 0.00 60.65 58.13 1hb4 h LYS 134 Cb 0.75 0.03 -0.41 0.00 0.08 0.00 0.00 32.23 32.68 1hb4 h LYS 134 CO 0.05 0.97 -0.86 0.72 -0.57 0.00 0.00 179.45 179.76 1hb4 n HIS 135 N -3.34 1.97 -1.67 -1.35 8.25 -0.56 -5.03 115.22 113.48 1hb4 n HIS 135 Ca -0.04 -3.89 -0.46 0.00 -0.26 0.00 0.00 57.72 53.06 1hb4 n HIS 135 Cb 0.97 -0.46 -0.04 0.00 1.12 0.00 0.00 29.99 31.58 1hb4 n HIS 135 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 1hb4 n PRO 136 N 0.67 2.20 -0.07 -0.41 -0.04 -0.68 -1.82 135.00 134.84 1hb4 n PRO 136 Ca 0.27 0.80 0.00 0.00 -0.04 0.00 0.00 63.50 64.52 1hb4 n PRO 136 Cb 0.49 -2.59 0.00 0.00 -0.04 0.00 0.00 33.50 31.35 1hb4 n PRO 136 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1hb4 n GLY 137 N 3.73 2.63 0.16 0.55 0.00 -1.26 -4.93 105.19 106.08 1hb4 n GLY 137 Ca 0.19 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.07 1hb4 n GLY 137 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1hb4 h PHE 138 N 0.00 -0.29 -0.47 1.61 3.57 -1.72 -0.76 116.94 118.87 1hb4 h PHE 138 Ca 0.00 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.54 1hb4 h PHE 138 Cb 0.00 0.10 -0.05 0.00 2.79 0.00 0.00 35.95 38.79 1hb4 h PHE 138 CO 0.00 -0.06 0.21 0.37 -2.23 0.00 0.00 178.31 176.60 1hb4 h GLN 139 N -0.48 0.40 -0.55 1.11 4.15 -1.92 0.14 115.11 117.95 1hb4 h GLN 139 Ca -0.03 -0.02 -0.02 0.00 0.77 0.00 0.00 58.65 59.35 1hb4 h GLN 139 Cb 0.36 -0.09 -0.03 0.00 0.21 0.00 0.00 27.48 27.94 1hb4 h GLN 139 CO 0.05 0.27 0.28 -0.44 -1.93 0.00 0.00 178.83 177.06 1hb4 h ASP 140 N 0.41 0.71 -0.36 -0.69 3.32 -1.93 -0.70 116.42 117.19 1hb4 h ASP 140 Ca 0.22 -0.12 -0.00 0.00 0.02 0.00 0.00 57.03 57.15 1hb4 h ASP 140 Cb 0.17 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.52 1hb4 h ASP 140 CO -0.18 0.63 0.22 0.15 -1.72 0.00 0.00 179.24 178.33 1hb4 h PHE 141 N 0.75 0.48 -0.57 4.55 3.57 -0.60 -1.75 116.94 123.36 1hb4 h PHE 141 Ca 0.19 -0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.61 1hb4 h PHE 141 Cb 0.09 -0.16 -0.02 0.00 2.79 0.00 0.00 35.95 38.66 1hb4 h PHE 141 CO -0.01 0.35 0.03 0.00 -2.23 0.00 0.00 178.31 176.45 1hb4 h ALA 142 N 1.09 0.97 -0.43 2.41 0.00 -0.46 0.92 119.26 123.76 1hb4 h ALA 142 Ca 0.13 -0.28 -0.10 0.00 0.00 0.00 0.00 54.91 54.66 1hb4 h ALA 142 Cb 0.01 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1hb4 h ALA 142 CO -0.02 0.63 -0.11 0.93 0.00 0.00 0.00 179.25 180.68 1hb4 h GLU 143 N 0.89 0.84 -0.45 0.00 5.08 -1.05 -1.34 114.58 118.54 1hb4 h GLU 143 Ca 0.17 -0.32 -0.05 0.00 -1.00 0.00 0.00 59.36 58.15 1hb4 h GLU 143 Cb 0.48 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.66 1hb4 h GLU 143 CO 0.02 0.95 0.06 0.37 -1.00 0.00 0.00 179.01 179.42 1hb4 h GLN 144 N 0.67 0.70 -0.68 2.33 5.75 -1.01 -2.44 115.11 120.43 1hb4 h GLN 144 Ca 0.11 -0.15 -0.06 0.00 -0.15 0.00 0.00 58.65 58.40 1hb4 h GLN 144 Cb 0.65 -0.10 -0.03 0.00 1.07 0.00 0.00 27.48 29.06 1hb4 h GLN 144 CO 0.04 0.67 0.18 -0.92 -2.65 0.00 0.00 178.83 176.16 1hb4 h TYR 145 N 0.67 1.13 -0.52 3.99 3.20 -0.47 -0.01 116.97 124.96 1hb4 h TYR 145 Ca 0.15 -0.13 0.10 0.00 3.14 0.00 0.00 58.73 61.99 1hb4 h TYR 145 Cb 0.32 -0.32 -0.09 0.00 1.54 0.00 0.00 36.73 38.19 1hb4 h TYR 145 CO 0.02 0.92 0.01 -0.92 -1.64 0.00 0.00 178.16 176.54 1hb4 h TYR 146 N 1.01 -0.02 -0.04 -3.82 3.20 -0.77 0.26 116.97 116.80 1hb4 h TYR 146 Ca 0.22 0.04 -0.12 0.00 3.14 0.00 0.00 58.73 62.00 1hb4 h TYR 146 Cb 0.34 0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.69 1hb4 h TYR 146 CO 0.03 -0.11 -0.54 -1.49 -1.64 0.00 0.00 178.16 174.40 1hb4 h TRP 147 N 0.13 0.15 -0.23 -3.82 -0.00 -1.12 0.36 115.95 111.42 1hb4 h TRP 147 Ca 0.26 -0.05 -0.04 0.00 -0.00 0.00 0.00 58.89 59.06 1hb4 h TRP 147 Cb 0.40 -0.03 -0.01 0.00 -0.00 0.00 0.00 29.16 29.52 1hb4 h TRP 147 CO -0.32 0.64 -0.01 -0.44 -0.00 0.00 0.00 178.44 178.31 1hb4 h ASP 148 N 0.09 0.41 1.08 -3.49 3.32 -0.08 -1.43 116.42 116.33 1hb4 h ASP 148 Ca -0.00 -0.32 -0.08 0.00 0.02 0.00 0.00 57.03 56.65 1hb4 h ASP 148 Cb 0.99 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.42 1hb4 h ASP 148 CO 0.08 0.63 -0.37 1.62 -1.72 0.00 0.00 179.24 179.48 1hb4 h VAL 149 N 0.18 0.78 -0.50 -1.35 3.04 -0.91 -2.23 116.25 115.26 1hb4 h VAL 149 Ca 0.06 -1.62 -0.05 0.00 -1.01 0.00 0.00 66.70 64.08 1hb4 h VAL 149 Cb 0.43 2.04 -0.02 0.00 -2.01 0.00 0.00 31.29 31.73 1hb4 h VAL 149 CO 0.01 0.36 0.10 0.15 -1.01 0.00 0.00 177.57 177.18 1hb4 h PHE 150 N 0.00 0.86 -0.55 3.17 3.57 -0.76 -0.05 116.94 123.19 1hb4 h PHE 150 Ca -0.00 -0.11 -0.02 0.00 3.53 0.00 0.00 57.97 61.36 1hb4 h PHE 150 Cb 1.01 -0.24 -0.02 0.00 2.79 0.00 0.00 35.95 39.48 1hb4 h PHE 150 CO 0.00 0.78 0.25 0.78 -2.23 0.00 0.00 178.31 177.89 1hb4 h GLY 151 N 0.70 0.85 0.99 2.40 0.00 -0.91 0.10 103.07 107.20 1hb4 h GLY 151 Ca 0.15 -0.43 0.01 0.00 0.00 0.00 0.00 47.33 47.06 1hb4 h GLY 151 CO 0.01 0.41 0.32 -2.00 0.00 0.00 0.00 176.54 175.28 1hb4 h LEU 152 N 0.74 0.55 -0.99 3.11 5.85 -1.23 -2.20 115.31 121.14 1hb4 h LEU 152 Ca 0.19 -0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.84 1hb4 h LEU 152 Cb 0.14 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.01 1hb4 h LEU 152 CO -0.02 0.39 0.12 0.28 -0.34 0.00 0.00 178.44 178.87 1hb4 h SER 153 N 0.65 0.80 -0.65 1.25 0.02 -0.60 -0.41 113.55 114.62 1hb4 h SER 153 Ca 0.18 -0.15 -0.03 0.00 -0.84 0.00 0.00 61.79 60.95 1hb4 h SER 153 Cb -0.06 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.24 1hb4 h SER 153 CO -0.05 0.79 0.27 0.28 -1.14 0.00 0.00 176.83 176.99 1hb4 h SER 154 N 0.82 0.89 -0.56 3.07 0.02 -0.75 0.74 113.55 117.78 1hb4 h SER 154 Ca 0.18 -0.16 -0.06 0.00 -0.84 0.00 0.00 61.79 60.91 1hb4 h SER 154 Cb 0.32 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.61 1hb4 h SER 154 CO 0.00 0.80 0.12 0.00 -1.14 0.00 0.00 176.83 176.62 1hb4 h ALA 155 N 1.12 0.74 -0.84 3.77 0.00 -0.76 -1.92 119.26 121.37 1hb4 h ALA 155 Ca 0.22 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1hb4 h ALA 155 Cb 0.19 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 1hb4 h ALA 155 CO -0.02 0.46 0.47 -0.07 0.00 0.00 0.00 179.25 180.09 1hb4 h LEU 156 N 0.80 1.03 -1.46 0.00 3.38 -0.71 -1.85 115.31 116.51 1hb4 h LEU 156 Ca 0.17 -0.08 -0.05 0.00 0.09 0.00 0.00 57.88 58.01 1hb4 h LEU 156 Cb 0.37 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1hb4 h LEU 156 CO 0.01 0.82 -0.22 -0.07 0.09 0.00 0.00 178.44 179.06 1hb4 h LEU 157 N 1.17 0.07 -0.61 1.67 3.38 -0.45 -0.52 115.31 120.01 1hb4 h LEU 157 Ca 0.30 -0.02 -0.06 0.00 0.09 0.00 0.00 57.88 58.19 1hb4 h LEU 157 Cb 0.00 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 1hb4 h LEU 157 CO -0.05 0.30 0.15 0.11 0.09 0.00 0.00 178.44 179.04 1hb4 h LYS 158 N 0.07 0.98 -0.57 1.13 1.57 -0.57 -1.65 116.57 117.53 1hb4 h LYS 158 Ca 0.01 -0.23 -0.05 0.00 -1.87 0.00 0.00 60.65 58.50 1hb4 h LYS 158 Cb 0.43 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.59 1hb4 h LYS 158 CO 0.03 0.89 0.14 0.78 -0.57 0.00 0.00 179.45 180.72 1hb4 h GLY 159 N 0.89 0.98 1.07 3.86 0.00 -0.71 -1.58 103.07 107.58 1hb4 h GLY 159 Ca 0.19 -0.61 -0.06 0.00 0.00 0.00 0.00 47.33 46.85 1hb4 h GLY 159 CO 0.00 0.57 0.22 -0.97 0.00 0.00 0.00 176.54 176.36 1hb4 h TYR 160 N 0.82 1.21 0.03 5.60 -1.99 -1.04 -0.57 116.97 121.04 1hb4 h TYR 160 Ca 0.18 -0.13 -0.00 0.00 2.00 0.00 0.00 58.73 60.78 1hb4 h TYR 160 Cb 0.34 -0.35 0.00 0.00 2.00 0.00 0.00 36.73 38.72 1hb4 h TYR 160 CO 0.02 0.96 -0.02 0.00 -0.00 0.00 0.00 178.16 179.13 1hb4 h ALA 161 N 1.12 -0.05 -0.80 3.88 0.00 -1.14 -2.18 119.26 120.09 1hb4 h ALA 161 Ca 0.24 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1hb4 h ALA 161 Cb 0.33 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.10 1hb4 h ALA 161 CO -0.00 -0.48 0.51 -0.07 0.00 0.00 0.00 179.25 179.21 1hb4 h LEU 162 N -0.14 0.94 -1.76 0.00 3.38 -1.18 -0.72 115.31 115.82 1hb4 h LEU 162 Ca -0.00 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 1hb4 h LEU 162 Cb 0.13 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1hb4 h LEU 162 CO 0.01 0.69 0.01 0.00 0.09 0.00 0.00 178.44 179.24 1hb4 h ALA 163 N 1.47 1.81 -0.44 1.53 0.00 -0.77 -2.08 119.26 120.78 1hb4 h ALA 163 Ca 0.29 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1hb4 h ALA 163 Cb -0.09 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.64 1hb4 h ALA 163 CO -0.06 0.15 0.00 1.28 0.00 0.00 0.00 179.25 180.62 1hb4 n LEU 164 N -4.45 2.51 0.00 0.00 4.77 -0.85 -4.89 117.00 114.09 1hb4 n LEU 164 Ca -0.01 -1.23 0.00 0.00 -0.03 0.00 0.00 56.01 54.74 1hb4 n LEU 164 Cb 0.14 -0.29 0.00 0.00 -2.33 0.00 0.00 43.42 40.93 1hb4 n LEU 164 CO 0.35 0.61 0.00 0.61 -1.33 0.00 0.00 177.39 177.64 1hb4 n GLY 165 N 1.26 0.42 3.90 -0.72 0.00 -0.78 -4.92 105.19 104.35 1hb4 n GLY 165 Ca 0.16 -1.02 -0.23 0.00 0.00 0.00 0.00 46.02 44.93 1hb4 n GLY 165 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hb4 s LYS 166 N -1.85 2.36 0.60 1.61 -0.14 -0.33 -5.02 119.74 116.97 1hb4 s LYS 166 Ca 0.00 -1.79 -0.17 0.00 -1.36 0.00 0.00 55.97 52.65 1hb4 s LYS 166 Cb 0.00 -2.25 -0.03 0.00 -1.68 0.00 0.00 37.83 33.87 1hb4 s LYS 166 CO 0.00 -0.46 1.10 -2.00 -0.76 0.00 0.00 175.35 173.24 1hb4 s GLU 167 N -4.24 3.12 0.59 1.68 2.12 -1.26 -3.87 118.70 116.85 1hb4 s GLU 167 Ca 0.43 1.43 0.36 0.00 0.36 0.00 0.00 54.97 57.55 1hb4 s GLU 167 Cb -0.02 -1.99 1.84 0.00 0.26 0.00 0.00 34.13 34.22 1hb4 s GLU 167 CO 0.26 -1.00 2.18 1.05 -0.54 0.00 0.00 175.26 177.20 1hb4 h GLU 168 N 0.56 0.00 -0.65 4.30 4.11 -1.89 -2.12 114.58 118.89 1hb4 h GLU 168 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.95 1hb4 h GLU 168 Cb 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 1hb4 h GLU 168 CO 0.56 0.03 0.00 0.09 0.07 0.00 0.00 179.01 179.76 1hb4 n ASN 169 N -3.27 3.61 -0.26 3.06 4.13 -1.26 -4.14 115.26 117.14 1hb4 n ASN 169 Ca -0.02 -2.41 0.02 0.00 1.68 0.00 0.00 54.58 53.85 1hb4 n ASN 169 Cb 0.18 -0.52 0.14 0.00 -1.54 0.00 0.00 39.78 38.04 1hb4 n ASN 169 CO 0.00 0.00 0.00 0.15 0.28 0.00 0.00 177.26 177.69 1hb4 h PHE 170 N 2.71 0.69 0.03 3.10 3.57 -1.73 -1.15 116.94 124.16 1hb4 h PHE 170 Ca 0.00 0.03 -0.37 0.00 3.53 0.00 0.00 57.97 61.16 1hb4 h PHE 170 Cb 1.20 -0.20 -0.05 0.00 2.79 0.00 0.00 35.95 39.69 1hb4 h PHE 170 CO 0.59 0.26 -2.13 1.19 -2.23 0.00 0.00 178.31 175.99 1hb4 n PHE 171 N -4.83 0.52 0.15 0.41 3.01 -1.26 -4.53 117.46 110.93 1hb4 n PHE 171 Ca 0.12 0.16 0.15 0.00 1.01 0.00 0.00 57.45 58.89 1hb4 n PHE 171 Cb 0.27 -1.06 0.72 0.00 -0.01 0.00 0.00 39.48 39.40 1hb4 n PHE 171 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1hb4 h ALA 172 N -0.35 2.11 0.00 4.37 0.00 -1.78 -0.90 119.26 122.71 1hb4 h ALA 172 Ca -0.53 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.37 1hb4 h ALA 172 Cb 1.73 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.54 1hb4 h ALA 172 CO -0.16 -0.32 0.00 0.07 0.00 0.00 0.00 179.25 178.84 1hb4 h ARG 173 N 0.00 0.00 -0.25 0.00 0.11 -1.44 -1.17 114.38 111.62 1hb4 h ARG 173 Ca 0.12 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.20 1hb4 h ARG 173 Cb 0.50 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.58 1hb4 h ARG 173 CO -0.00 0.00 0.00 0.72 0.10 0.00 0.00 179.97 180.79 1hb4 n HIS 174 N -2.97 0.31 -3.83 4.08 8.25 -0.34 -4.77 115.22 115.95 1hb4 n HIS 174 Ca -0.01 -0.16 -0.34 0.00 -0.26 0.00 0.00 57.72 56.95 1hb4 n HIS 174 Cb 0.17 -0.00 -0.12 0.00 1.12 0.00 0.00 29.99 31.16 1hb4 n HIS 174 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 1hb4 s PHE 175 N -1.67 3.44 0.04 4.41 5.99 -0.44 -3.18 117.98 126.58 1hb4 s PHE 175 Ca 0.35 -2.81 0.06 0.00 0.00 0.00 0.00 56.93 54.53 1hb4 s PHE 175 Cb 0.22 -3.07 -0.02 0.00 0.00 0.00 0.00 43.02 40.14 1hb4 s PHE 175 CO 0.31 -0.86 -0.18 0.15 -0.00 0.00 0.00 175.22 174.64 1hb4 s LYS 176 N 0.29 1.21 0.45 10.12 1.02 -1.26 -4.93 119.74 126.63 1hb4 s LYS 176 Ca 0.14 -0.88 0.15 0.00 0.02 0.00 0.00 55.97 55.40 1hb4 s LYS 176 Cb -0.22 -1.29 1.08 0.00 -0.52 0.00 0.00 37.83 36.87 1hb4 s LYS 176 CO -0.03 0.33 2.00 -1.35 -0.92 0.00 0.00 175.35 175.38 1hb4 h PRO 177 N 4.87 0.33 0.00 -1.68 0.11 -1.98 -1.06 132.00 132.59 1hb4 h PRO 177 Ca -0.41 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1hb4 h PRO 177 Cb 1.17 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1hb4 h PRO 177 CO 0.44 0.22 0.00 -0.25 -0.21 0.00 0.00 178.00 178.20 1hb4 n ASP 178 N -4.47 0.80 0.00 -2.05 8.00 -1.26 -4.34 116.55 113.23 1hb4 n ASP 178 Ca 0.08 0.60 0.00 0.00 0.71 0.00 0.00 54.79 56.18 1hb4 n ASP 178 Cb 0.34 -0.81 0.00 0.00 -0.02 0.00 0.00 41.12 40.63 1hb4 n ASP 178 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1hb4 n ASP 179 N -2.28 0.00 -4.78 -2.24 3.85 -0.91 -4.91 116.55 105.29 1hb4 n ASP 179 Ca 0.05 -1.00 -0.41 0.00 -0.71 0.00 0.00 54.79 52.72 1hb4 n ASP 179 Cb 0.38 0.00 -0.01 0.00 -1.35 0.00 0.00 41.12 40.14 1hb4 n ASP 179 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.20 176.47 1hb4 s THR 180 N 0.00 2.27 -2.00 2.12 -1.32 -0.45 -4.44 115.64 111.82 1hb4 s THR 180 Ca 0.00 0.27 0.11 0.00 -1.21 0.00 0.00 61.69 60.86 1hb4 s THR 180 Cb 0.00 -3.17 0.31 0.00 -1.51 0.00 0.00 72.50 68.13 1hb4 s THR 180 CO 0.00 0.06 1.26 0.18 -2.21 0.00 0.00 174.62 173.92 1hb4 n LEU 181 N 0.63 1.89 -4.72 9.08 4.77 -0.65 -4.51 117.00 123.50 1hb4 n LEU 181 Ca 0.01 -0.95 -0.39 0.00 -0.03 0.00 0.00 56.01 54.66 1hb4 n LEU 181 Cb 0.40 -0.24 0.04 0.00 -2.33 0.00 0.00 43.42 41.29 1hb4 n LEU 181 CO 0.62 0.47 0.91 0.00 -1.33 0.00 0.00 177.39 178.06 1hb4 n ALA 182 N 0.54 1.33 -2.62 -1.18 0.00 -1.24 -4.70 120.51 112.64 1hb4 n ALA 182 Ca 0.12 0.13 -0.19 0.00 0.00 0.00 0.00 53.44 53.50 1hb4 n ALA 182 Cb 0.30 -2.31 -0.12 0.00 0.00 0.00 0.00 19.45 17.32 1hb4 n ALA 182 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1hb4 s SER 183 N -0.92 1.87 -0.09 0.00 1.04 -1.07 -3.72 113.70 110.81 1hb4 s SER 183 Ca 0.71 -0.69 -0.01 0.00 0.48 0.00 0.00 55.95 56.44 1hb4 s SER 183 Cb -0.43 -0.06 -0.03 0.00 0.10 0.00 0.00 66.02 65.60 1hb4 s SER 183 CO 0.50 -0.09 -0.03 -0.69 0.98 0.00 0.00 173.24 173.91 1hb4 s VAL 184 N -1.55 4.03 -0.11 5.02 1.01 -0.35 -1.04 120.40 127.42 1hb4 s VAL 184 Ca 0.02 -0.34 0.02 0.00 0.00 0.00 0.00 61.98 61.68 1hb4 s VAL 184 Cb -0.08 -2.69 0.01 0.00 0.00 0.00 0.00 36.38 33.62 1hb4 s VAL 184 CO 0.03 0.58 -0.17 -0.69 0.00 0.00 0.00 175.10 174.85 1hb4 s VAL 185 N -0.61 1.60 -0.68 2.92 1.01 -0.69 -1.61 120.40 122.34 1hb4 s VAL 185 Ca 0.10 -0.71 -0.14 0.00 0.00 0.00 0.00 61.98 61.23 1hb4 s VAL 185 Cb -0.12 -1.45 0.17 0.00 0.00 0.00 0.00 36.38 34.99 1hb4 s VAL 185 CO 0.02 0.46 0.61 -0.76 0.00 0.00 0.00 175.10 175.43 1hb4 s LEU 186 N 0.91 6.37 -0.13 3.92 1.43 0.42 -3.25 118.68 128.35 1hb4 s LEU 186 Ca -0.08 -2.31 -0.13 0.00 -1.03 0.00 0.00 54.13 50.58 1hb4 s LEU 186 Cb -0.15 -2.17 -0.05 0.00 0.03 0.00 0.00 46.19 43.85 1hb4 s LEU 186 CO -0.01 -0.67 0.29 -0.63 0.23 0.00 0.00 176.35 175.56 1hb4 s ILE 187 N 0.78 5.28 -0.23 -0.59 1.01 -0.33 -1.68 121.20 125.43 1hb4 s ILE 187 Ca 0.11 0.56 -0.05 0.00 0.00 0.00 0.00 60.65 61.27 1hb4 s ILE 187 Cb -0.19 -3.62 -0.01 0.00 0.01 0.00 0.00 42.46 38.65 1hb4 s ILE 187 CO -0.04 0.45 -0.01 -0.60 0.00 0.00 0.00 174.94 174.75 1hb4 s ARG 188 N -0.02 3.46 -0.29 2.79 3.52 0.23 -1.80 118.95 126.84 1hb4 s ARG 188 Ca 0.18 -0.58 -0.07 0.00 -0.13 0.00 0.00 55.73 55.12 1hb4 s ARG 188 Cb -0.13 -3.09 -0.00 0.00 -1.56 0.00 0.00 34.95 30.16 1hb4 s ARG 188 CO 0.06 -0.19 0.09 0.71 -0.81 0.00 0.00 175.30 175.16 1hb4 s TYR 189 N 1.50 3.13 0.50 5.12 1.51 -0.67 -2.36 117.35 126.08 1hb4 s TYR 189 Ca 0.06 -0.77 -0.06 0.00 -1.01 0.00 0.00 57.07 55.29 1hb4 s TYR 189 Cb -0.14 -2.27 -0.04 0.00 -0.11 0.00 0.00 41.96 39.40 1hb4 s TYR 189 CO -0.01 -0.50 0.82 -1.25 -1.11 0.00 0.00 175.55 173.50 1hb4 s PRO 190 N 1.55 3.56 -0.14 -1.71 0.04 -1.26 -0.50 135.00 136.54 1hb4 s PRO 190 Ca 0.04 0.30 -0.19 0.00 0.04 0.00 0.00 61.00 61.19 1hb4 s PRO 190 Cb -0.17 -2.33 -0.04 0.00 0.04 0.00 0.00 34.50 32.01 1hb4 s PRO 190 CO 0.03 -0.25 0.51 -0.47 0.04 0.00 0.00 177.00 176.86 1hb4 s TYR 191 N -2.79 3.47 -0.02 0.56 5.04 -1.25 -4.08 117.35 118.27 1hb4 s TYR 191 Ca 0.49 0.88 0.02 0.00 -2.44 0.00 0.00 57.07 56.02 1hb4 s TYR 191 Cb -0.10 -2.61 0.00 0.00 0.35 0.00 0.00 41.96 39.59 1hb4 s TYR 191 CO 0.46 0.07 -0.08 -0.51 -1.34 0.00 0.00 175.55 174.14 1hb4 s LEU 192 N 0.99 1.80 -0.54 6.97 1.43 -1.26 -4.91 118.68 123.15 1hb4 s LEU 192 Ca 0.26 -0.17 0.06 0.00 -1.03 0.00 0.00 54.13 53.24 1hb4 s LEU 192 Cb -0.15 -0.52 0.20 0.00 0.03 0.00 0.00 46.19 45.75 1hb4 s LEU 192 CO 0.11 0.06 0.50 -0.67 0.23 0.00 0.00 176.35 176.58 1hb4 n ASP 193 N 3.27 1.48 -4.72 2.29 4.64 -1.26 -2.93 116.55 119.33 1hb4 n ASP 193 Ca -0.18 -2.89 -0.31 0.00 -1.38 0.00 0.00 54.79 50.03 1hb4 n ASP 193 Cb 0.55 -0.65 -0.08 0.00 -1.04 0.00 0.00 41.12 39.90 1hb4 n ASP 193 CO 0.00 0.00 0.00 -2.16 -0.82 0.00 0.00 177.20 174.22 1hb4 s PRO 194 N -1.13 2.75 -0.17 -0.67 0.04 -1.26 -5.13 135.00 129.43 1hb4 s PRO 194 Ca 0.32 -0.71 -0.23 0.00 0.04 0.00 0.00 61.00 60.43 1hb4 s PRO 194 Cb 0.07 -2.65 -0.02 0.00 0.04 0.00 0.00 34.50 31.93 1hb4 s PRO 194 CO -0.14 0.58 0.71 -0.47 0.04 0.00 0.00 177.00 177.72 1hb4 s TYR 195 N -1.27 3.43 0.10 0.56 5.04 -1.15 -5.00 117.35 119.05 1hb4 s TYR 195 Ca 0.25 1.09 -0.31 0.00 -2.44 0.00 0.00 57.07 55.66 1hb4 s TYR 195 Cb -0.12 -2.87 -0.10 0.00 0.35 0.00 0.00 41.96 39.22 1hb4 s TYR 195 CO 0.17 -0.15 1.86 -0.35 -1.34 0.00 0.00 175.55 175.75 1hb4 n PRO 196 N 4.88 2.78 0.17 4.97 -0.04 -1.26 -4.88 135.00 141.61 1hb4 n PRO 196 Ca 0.01 1.01 0.06 0.00 -0.04 0.00 0.00 63.50 64.53 1hb4 n PRO 196 Cb 0.50 -2.92 0.53 0.00 -0.04 0.00 0.00 33.50 31.57 1hb4 n PRO 196 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1hb4 h GLU 197 N 8.94 0.17 0.00 0.54 4.39 -1.93 -0.14 114.58 126.55 1hb4 h GLU 197 Ca -0.47 -0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.20 1hb4 h GLU 197 Cb 1.23 -0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 29.84 1hb4 h GLU 197 CO 0.95 0.17 -0.04 0.00 -1.16 0.00 0.00 179.01 178.93 1hb4 h ALA 198 N 1.85 1.27 -0.17 3.43 0.00 -1.86 -1.29 119.26 122.50 1hb4 h ALA 198 Ca 0.04 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1hb4 h ALA 198 Cb 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1hb4 h ALA 198 CO -0.00 0.05 0.00 0.00 0.00 0.00 0.00 179.25 179.30 1hb4 n ALA 199 N -2.23 2.51 -3.33 0.00 0.00 -0.07 -4.81 120.51 112.59 1hb4 n ALA 199 Ca -0.02 -0.58 -0.34 0.00 0.00 0.00 0.00 53.44 52.50 1hb4 n ALA 199 Cb 0.15 -1.06 -0.14 0.00 0.00 0.00 0.00 19.45 18.39 1hb4 n ALA 199 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1hb4 s ILE 200 N -1.79 3.05 0.29 0.00 1.01 -0.49 -4.74 121.20 118.54 1hb4 s ILE 200 Ca 0.34 -0.64 0.03 0.00 0.00 0.00 0.00 60.65 60.38 1hb4 s ILE 200 Cb 0.19 -2.32 -0.03 0.00 0.01 0.00 0.00 42.46 40.31 1hb4 s ILE 200 CO 0.28 0.49 0.45 -0.54 0.00 0.00 0.00 174.94 175.62 1hb4 s LYS 201 N 0.82 3.43 -0.13 2.79 1.02 -0.08 -4.92 119.74 122.67 1hb4 s LYS 201 Ca -0.04 -0.60 0.01 0.00 0.02 0.00 0.00 55.97 55.36 1hb4 s LYS 201 Cb -0.15 -2.79 0.02 0.00 -0.52 0.00 0.00 37.83 34.39 1hb4 s LYS 201 CO 0.01 0.28 -0.15 0.99 -0.92 0.00 0.00 175.35 175.56 1hb4 s THR 202 N -2.14 1.55 0.90 2.17 2.01 -1.26 -0.29 115.64 118.58 1hb4 s THR 202 Ca 0.37 -0.65 -0.12 0.00 0.31 0.00 0.00 61.69 61.61 1hb4 s THR 202 Cb -0.09 -1.43 0.13 0.00 0.01 0.00 0.00 72.50 71.11 1hb4 s THR 202 CO 0.32 0.45 1.11 0.00 -0.69 0.00 0.00 174.62 175.82 1hb4 s ALA 203 N 1.22 1.72 0.45 7.40 0.00 0.24 -4.90 121.76 127.89 1hb4 s ALA 203 Ca -0.01 -0.36 0.12 0.00 0.00 0.00 0.00 51.96 51.70 1hb4 s ALA 203 Cb -0.14 -3.08 1.00 0.00 0.00 0.00 0.00 23.12 20.89 1hb4 s ALA 203 CO -0.06 -2.25 2.04 0.00 0.00 0.00 0.00 175.76 175.49 1hb4 h ALA 204 N -1.47 1.75 -0.03 0.00 0.00 -2.01 -0.23 119.26 117.28 1hb4 h ALA 204 Ca -0.50 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.32 1hb4 h ALA 204 Cb 1.31 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1hb4 h ALA 204 CO 0.60 0.20 0.00 -0.40 0.00 0.00 0.00 179.25 179.64 1hb4 n ASP 205 N -4.42 0.39 0.00 0.00 5.68 -1.26 -4.89 116.55 112.05 1hb4 n ASP 205 Ca -0.01 -1.38 0.00 0.00 -0.50 0.00 0.00 54.79 52.90 1hb4 n ASP 205 Cb 0.15 -0.02 0.00 0.00 -1.14 0.00 0.00 41.12 40.12 1hb4 n ASP 205 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1hb4 n GLY 206 N 0.92 0.93 3.75 6.12 0.00 -0.10 -5.04 105.19 111.78 1hb4 n GLY 206 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 1hb4 n GLY 206 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1hb4 s THR 207 N -2.52 2.88 -0.02 2.61 2.01 -1.26 -4.65 115.64 114.68 1hb4 s THR 207 Ca 0.00 0.80 -0.28 0.00 0.31 0.00 0.00 61.69 62.52 1hb4 s THR 207 Cb 0.00 -3.51 -0.03 0.00 0.01 0.00 0.00 72.50 68.97 1hb4 s THR 207 CO 0.00 0.15 0.87 -0.54 -0.69 0.00 0.00 174.62 174.42 1hb4 s LYS 208 N -0.91 4.51 0.18 4.92 1.02 -1.26 -0.59 119.74 127.61 1hb4 s LYS 208 Ca 0.54 1.22 0.08 0.00 0.02 0.00 0.00 55.97 57.82 1hb4 s LYS 208 Cb -0.39 -3.46 -0.04 0.00 -0.52 0.00 0.00 37.83 33.42 1hb4 s LYS 208 CO 0.45 -0.01 -0.15 -0.51 -0.92 0.00 0.00 175.35 174.21 1hb4 s LEU 209 N 0.93 2.49 -0.15 3.17 1.43 0.61 -0.96 118.68 126.21 1hb4 s LEU 209 Ca 0.47 -0.94 0.19 0.00 -1.03 0.00 0.00 54.13 52.82 1hb4 s LEU 209 Cb -0.20 -0.70 -0.27 0.00 0.03 0.00 0.00 46.19 45.06 1hb4 s LEU 209 CO 0.24 -0.13 0.20 -1.20 0.23 0.00 0.00 176.35 175.70 1hb4 n SER 210 N -0.02 0.03 -3.71 2.29 7.64 0.42 -0.90 113.62 119.37 1hb4 n SER 210 Ca -0.11 0.01 -0.11 0.00 1.01 0.00 0.00 58.87 59.67 1hb4 n SER 210 Cb 0.59 1.22 -0.11 0.00 -1.01 0.00 0.00 64.21 64.89 1hb4 n SER 210 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 1hb4 s PHE 211 N -2.76 -0.49 0.95 1.43 5.36 -1.05 -4.87 117.98 116.55 1hb4 s PHE 211 Ca -0.09 1.08 -0.13 0.00 -0.96 0.00 0.00 56.93 56.83 1hb4 s PHE 211 Cb 0.08 0.18 0.16 0.00 -0.34 0.00 0.00 43.02 43.10 1hb4 s PHE 211 CO 0.85 -0.29 1.14 -1.21 -1.46 0.00 0.00 175.22 174.25 1hb4 s GLU 212 N 1.16 0.85 0.46 10.12 0.41 -1.26 -1.84 118.70 128.60 1hb4 s GLU 212 Ca -0.08 0.26 -0.23 0.00 -0.41 0.00 0.00 54.97 54.51 1hb4 s GLU 212 Cb -0.08 -1.81 -0.09 0.00 -1.78 0.00 0.00 34.13 30.37 1hb4 s GLU 212 CO -0.09 -2.39 1.05 -2.67 -0.49 0.00 0.00 175.26 170.67 1hb4 n TRP 213 N -3.89 1.29 -3.69 1.61 4.27 -1.26 -4.62 117.44 111.14 1hb4 n TRP 213 Ca 0.07 0.52 -0.02 0.00 -3.89 0.00 0.00 57.50 54.18 1hb4 n TRP 213 Cb 0.59 -2.24 -0.01 0.00 -1.36 0.00 0.00 31.31 28.29 1hb4 n TRP 213 CO 0.00 0.00 0.00 -3.38 -2.29 0.00 0.00 177.69 172.02 1hb4 s HIS 214 N -1.31 -0.10 0.03 -2.67 -3.43 -0.65 -4.95 115.29 102.20 1hb4 s HIS 214 Ca 0.65 -0.12 0.03 0.00 -0.80 0.00 0.00 55.06 54.83 1hb4 s HIS 214 Cb -0.51 0.60 -0.04 0.00 -1.43 0.00 0.00 32.58 31.20 1hb4 s HIS 214 CO 0.55 -0.60 -0.03 -1.21 -2.00 0.00 0.00 174.74 171.45 1hb4 s GLU 215 N -2.95 2.61 0.47 -0.38 2.02 -1.26 -1.85 118.70 117.37 1hb4 s GLU 215 Ca 0.13 -0.72 -0.21 0.00 0.02 0.00 0.00 54.97 54.18 1hb4 s GLU 215 Cb 0.01 -2.56 -0.08 0.00 0.10 0.00 0.00 34.13 31.60 1hb4 s GLU 215 CO -0.00 0.59 1.06 -0.51 0.02 0.00 0.00 175.26 176.41 1hb4 s ASP 216 N -1.72 6.34 -0.80 -0.19 1.01 -1.26 -4.89 116.67 115.16 1hb4 s ASP 216 Ca 0.20 2.00 -0.16 0.00 0.71 0.00 0.00 52.55 55.30 1hb4 s ASP 216 Cb -0.11 -2.57 0.18 0.00 1.01 0.00 0.00 42.92 41.42 1hb4 s ASP 216 CO 0.11 -0.78 0.83 -0.69 0.21 0.00 0.00 175.17 174.85 1hb4 s VAL 217 N -1.87 5.26 -0.02 -1.27 1.01 -1.26 -0.88 120.40 121.37 1hb4 s VAL 217 Ca 0.66 -1.98 -0.30 0.00 0.00 0.00 0.00 61.98 60.35 1hb4 s VAL 217 Cb -0.19 -4.54 0.12 0.00 0.00 0.00 0.00 36.38 31.77 1hb4 s VAL 217 CO 0.23 -1.15 1.28 -0.94 0.00 0.00 0.00 175.10 174.51 1hb4 s SER 218 N 2.83 -0.06 -0.10 3.32 1.04 -1.26 -4.94 113.70 114.52 1hb4 s SER 218 Ca 0.20 -0.14 -0.04 0.00 0.48 0.00 0.00 55.95 56.45 1hb4 s SER 218 Cb -0.12 0.17 -0.03 0.00 0.10 0.00 0.00 66.02 66.14 1hb4 s SER 218 CO -0.06 -0.32 0.09 0.25 0.98 0.00 0.00 173.24 174.19 1hb4 h LEU 219 N 2.00 0.00 -8.45 2.42 5.85 -1.40 -2.67 115.31 113.06 1hb4 h LEU 219 Ca -0.30 -0.12 -0.22 0.00 0.84 0.00 0.00 57.88 58.09 1hb4 h LEU 219 Cb 1.20 0.00 -0.15 0.00 0.37 0.00 0.00 40.66 42.08 1hb4 h LEU 219 CO 0.28 0.56 -0.68 0.27 -0.34 0.00 0.00 178.44 178.53 1hb4 s ILE 220 N -1.63 0.55 -0.10 4.05 -4.36 -1.23 -1.27 121.20 117.20 1hb4 s ILE 220 Ca -0.02 -1.92 0.04 0.00 -0.26 0.00 0.00 60.65 58.48 1hb4 s ILE 220 Cb -0.00 -1.79 0.00 0.00 1.25 0.00 0.00 42.46 41.92 1hb4 s ILE 220 CO 0.08 -0.76 -0.24 -0.89 0.24 0.00 0.00 174.94 173.37 1hb4 s THR 221 N -3.73 2.06 -0.32 8.37 2.01 0.47 -1.20 115.64 123.30 1hb4 s THR 221 Ca 0.15 -1.02 0.03 0.00 0.31 0.00 0.00 61.69 61.17 1hb4 s THR 221 Cb 0.06 -1.78 0.09 0.00 0.01 0.00 0.00 72.50 70.89 1hb4 s THR 221 CO -0.03 0.56 0.03 -0.69 -0.69 0.00 0.00 174.62 173.79 1hb4 s VAL 222 N 0.35 2.13 -0.09 3.82 1.01 -0.53 -2.42 120.40 124.68 1hb4 s VAL 222 Ca -0.19 -2.13 0.04 0.00 0.00 0.00 0.00 61.98 59.71 1hb4 s VAL 222 Cb -0.18 -2.51 -0.01 0.00 0.00 0.00 0.00 36.38 33.68 1hb4 s VAL 222 CO 0.09 -0.50 -0.21 -0.22 0.00 0.00 0.00 175.10 174.25 1hb4 s LEU 223 N 1.00 2.27 -0.12 3.92 2.96 -0.15 -1.25 118.68 127.31 1hb4 s LEU 223 Ca 0.07 -0.46 -0.03 0.00 -0.22 0.00 0.00 54.13 53.50 1hb4 s LEU 223 Cb -0.19 -1.45 -0.03 0.00 0.50 0.00 0.00 46.19 45.02 1hb4 s LEU 223 CO -0.09 0.21 -0.02 -0.47 -1.32 0.00 0.00 176.35 174.66 1hb4 s TYR 224 N 0.05 3.08 0.04 5.38 5.04 -1.03 -0.58 117.35 129.33 1hb4 s TYR 224 Ca -0.09 -0.04 0.00 0.00 -2.44 0.00 0.00 57.07 54.51 1hb4 s TYR 224 Cb -0.15 -1.87 -0.03 0.00 0.35 0.00 0.00 41.96 40.26 1hb4 s TYR 224 CO 0.05 0.22 -0.04 -0.65 -1.34 0.00 0.00 175.55 173.80 1hb4 s GLN 225 N -0.26 0.46 1.16 4.97 -0.21 -1.26 -0.24 119.66 124.27 1hb4 s GLN 225 Ca 0.05 -0.87 -0.13 0.00 0.02 0.00 0.00 55.36 54.43 1hb4 s GLN 225 Cb -0.12 0.08 0.26 0.00 1.00 0.00 0.00 33.01 34.23 1hb4 s GLN 225 CO 0.02 -0.06 0.93 0.43 -2.12 0.00 0.00 175.29 174.50 1hb4 n SER 226 N 1.00 -1.66 -3.42 5.90 7.64 -0.76 -4.26 113.62 118.05 1hb4 n SER 226 Ca -0.20 -0.12 -0.40 0.00 1.01 0.00 0.00 58.87 59.17 1hb4 n SER 226 Cb 0.57 -1.25 -0.02 0.00 -1.01 0.00 0.00 64.21 62.51 1hb4 n SER 226 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1hb4 n ASN 227 N -4.61 8.10 -3.77 6.43 5.15 -1.26 -4.73 115.26 120.57 1hb4 n ASN 227 Ca 0.03 -2.84 -0.27 0.00 -0.60 0.00 0.00 54.58 50.90 1hb4 n ASN 227 Cb 0.54 -1.48 -0.17 0.00 -0.53 0.00 0.00 39.78 38.15 1hb4 n ASN 227 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1hb4 s VAL 228 N 0.76 0.60 0.26 3.44 1.01 -1.26 -5.03 120.40 120.18 1hb4 s VAL 228 Ca 0.61 -0.48 -0.31 0.00 0.00 0.00 0.00 61.98 61.81 1hb4 s VAL 228 Cb 0.18 -1.00 -0.12 0.00 0.00 0.00 0.00 36.38 35.43 1hb4 s VAL 228 CO -0.07 -0.09 1.63 1.67 0.00 0.00 0.00 175.10 178.24 1hb4 n GLN 229 N 5.03 2.69 0.00 2.72 0.00 -1.26 -4.83 117.38 121.73 1hb4 n GLN 229 Ca -0.09 0.96 0.00 0.00 -0.00 0.00 0.00 57.00 57.87 1hb4 n GLN 229 Cb 0.48 -2.76 0.00 0.00 0.00 0.00 0.00 30.24 27.95 1hb4 n GLN 229 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.06 177.33 1hb4 n ASN 230 N 2.78 0.00 -4.82 1.69 0.23 -1.26 -4.96 115.26 108.91 1hb4 n ASN 230 Ca 0.11 0.00 -0.34 0.00 -0.53 0.00 0.00 54.58 53.82 1hb4 n ASN 230 Cb 0.36 0.00 -0.06 0.00 -2.08 0.00 0.00 39.78 37.99 1hb4 n ASN 230 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 1hb4 s LEU 231 N -0.80 4.18 0.02 -4.53 1.43 -1.26 -0.38 118.68 117.35 1hb4 s LEU 231 Ca 0.00 1.46 0.04 0.00 -1.03 0.00 0.00 54.13 54.60 1hb4 s LEU 231 Cb 0.00 -3.96 -0.02 0.00 0.03 0.00 0.00 46.19 42.25 1hb4 s LEU 231 CO 0.00 -0.12 -0.12 -1.10 0.23 0.00 0.00 176.35 175.24 1hb4 s GLN 232 N -2.53 0.84 -0.04 1.70 -0.21 -0.45 -0.96 119.66 118.01 1hb4 s GLN 232 Ca 0.51 -0.61 0.06 0.00 0.02 0.00 0.00 55.36 55.34 1hb4 s GLN 232 Cb -0.13 -0.81 -0.02 0.00 1.00 0.00 0.00 33.01 33.05 1hb4 s GLN 232 CO 0.19 0.20 -0.22 0.54 -2.12 0.00 0.00 175.29 173.88 1hb4 s VAL 233 N -0.69 2.36 -0.08 1.09 0.11 -0.27 -1.26 120.40 121.66 1hb4 s VAL 233 Ca 0.01 -0.98 -0.28 0.00 -2.93 0.00 0.00 61.98 57.80 1hb4 s VAL 233 Cb -0.07 -1.86 -0.02 0.00 -1.53 0.00 0.00 36.38 32.90 1hb4 s VAL 233 CO 0.01 0.58 0.90 -0.70 -3.33 0.00 0.00 175.10 172.56 1hb4 s GLU 234 N -0.53 4.44 0.29 1.54 2.12 -0.24 -0.29 118.70 126.03 1hb4 s GLU 234 Ca 0.07 1.22 0.02 0.00 0.36 0.00 0.00 54.97 56.64 1hb4 s GLU 234 Cb -0.11 -3.50 -0.01 0.00 0.26 0.00 0.00 34.13 30.77 1hb4 s GLU 234 CO 0.00 -0.16 0.07 0.25 -0.54 0.00 0.00 175.26 174.88 1hb4 n THR 235 N 4.23 0.00 0.10 -1.70 -2.24 -0.26 -4.65 114.28 109.76 1hb4 n THR 235 Ca 0.05 -1.58 0.01 0.00 -2.27 0.00 0.00 64.05 60.26 1hb4 n THR 235 Cb 0.50 0.49 0.34 0.00 -2.10 0.00 0.00 70.33 69.56 1hb4 n THR 235 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1hb4 h ALA 236 N 1.36 1.41 -0.27 6.98 0.00 -1.99 -2.06 119.26 124.69 1hb4 h ALA 236 Ca -0.23 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1hb4 h ALA 236 Cb 0.82 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1hb4 h ALA 236 CO 0.38 0.41 0.00 0.00 0.00 0.00 0.00 179.25 180.04 1hb4 n ALA 237 N -2.49 2.79 0.00 0.00 0.00 -1.26 -5.02 120.51 114.53 1hb4 n ALA 237 Ca -0.01 -0.67 0.00 0.00 0.00 0.00 0.00 53.44 52.76 1hb4 n ALA 237 Cb 0.31 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.74 1hb4 n ALA 237 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1hb4 n GLY 238 N 0.60 -2.03 3.73 0.00 0.00 -0.78 -4.93 105.19 101.78 1hb4 n GLY 238 Ca 0.11 -2.12 -0.42 0.00 0.00 0.00 0.00 46.02 43.60 1hb4 n GLY 238 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1hb4 s TYR 239 N -0.30 3.38 0.10 1.61 1.51 -1.26 -1.10 117.35 121.29 1hb4 s TYR 239 Ca 0.00 1.29 0.10 0.00 -1.01 0.00 0.00 57.07 57.45 1hb4 s TYR 239 Cb 0.00 -3.49 -0.04 0.00 -0.11 0.00 0.00 41.96 38.32 1hb4 s TYR 239 CO 0.00 -1.50 -0.24 -0.65 -1.11 0.00 0.00 175.55 172.05 1hb4 s GLN 240 N 0.31 1.35 0.05 -0.62 -0.21 0.60 -4.59 119.66 116.56 1hb4 s GLN 240 Ca 0.57 -1.22 -0.30 0.00 0.02 0.00 0.00 55.36 54.42 1hb4 s GLN 240 Cb -0.33 -1.70 -0.05 0.00 1.00 0.00 0.00 33.01 31.93 1hb4 s GLN 240 CO 0.34 0.41 1.02 -0.51 -2.12 0.00 0.00 175.29 174.43 1hb4 s ASP 241 N -1.84 7.34 -0.28 5.90 -0.00 -0.64 -1.11 116.67 126.05 1hb4 s ASP 241 Ca 0.11 1.79 -0.19 0.00 -0.00 0.00 0.00 52.55 54.25 1hb4 s ASP 241 Cb -0.10 -2.58 -0.02 0.00 -0.00 0.00 0.00 42.92 40.22 1hb4 s ASP 241 CO 0.05 -0.24 0.58 -0.63 -0.00 0.00 0.00 175.17 174.92 1hb4 s ILE 242 N 0.66 5.01 0.47 0.77 1.01 -0.13 -0.66 121.20 128.32 1hb4 s ILE 242 Ca 0.52 0.92 -0.24 0.00 0.00 0.00 0.00 60.65 61.84 1hb4 s ILE 242 Cb -0.24 -3.91 -0.07 0.00 0.01 0.00 0.00 42.46 38.25 1hb4 s ILE 242 CO 0.29 -0.01 1.38 -1.83 0.00 0.00 0.00 174.94 174.78 1hb4 s GLU 243 N 2.45 3.58 0.54 2.79 -1.05 -1.26 -4.42 118.70 121.33 1hb4 s GLU 243 Ca 0.24 2.31 -0.17 0.00 -0.15 0.00 0.00 54.97 57.20 1hb4 s GLU 243 Cb -0.15 -2.55 -0.06 0.00 -0.44 0.00 0.00 34.13 30.92 1hb4 s GLU 243 CO 0.10 -0.87 1.02 0.00 0.95 0.00 0.00 175.26 176.46 1hb4 s ALA 244 N -1.25 2.92 -0.34 -0.84 0.00 -1.26 -5.02 121.76 115.97 1hb4 s ALA 244 Ca 0.63 0.30 0.06 0.00 0.00 0.00 0.00 51.96 52.95 1hb4 s ALA 244 Cb -0.42 -3.17 0.18 0.00 0.00 0.00 0.00 23.12 19.71 1hb4 s ALA 244 CO 0.52 -0.47 0.56 0.34 0.00 0.00 0.00 175.76 176.71 1hb4 s ASP 245 N -2.87 -1.03 -0.04 0.00 3.68 -1.26 -5.01 116.67 110.13 1hb4 s ASP 245 Ca 0.61 -0.38 0.03 0.00 2.13 0.00 0.00 52.55 54.94 1hb4 s ASP 245 Cb -0.13 1.74 0.15 0.00 -1.45 0.00 0.00 42.92 43.23 1hb4 s ASP 245 CO 0.33 -0.26 0.80 -0.90 0.13 0.00 0.00 175.17 175.27 1hb4 n ASP 246 N 4.98 1.73 -0.00 -0.34 3.85 -1.26 -2.84 116.55 122.66 1hb4 n ASP 246 Ca 0.07 -2.15 0.05 0.00 -0.71 0.00 0.00 54.79 52.04 1hb4 n ASP 246 Cb 0.53 -0.46 -0.07 0.00 -1.35 0.00 0.00 41.12 39.77 1hb4 n ASP 246 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.20 176.54 1hb4 n THR 247 N 0.09 0.00 -4.29 2.12 -2.24 -1.26 -4.87 114.28 103.83 1hb4 n THR 247 Ca 0.05 -0.24 -0.27 0.00 -2.27 0.00 0.00 64.05 61.32 1hb4 n THR 247 Cb 0.38 0.50 -0.07 0.00 -2.10 0.00 0.00 70.33 69.04 1hb4 n THR 247 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1hb4 s GLY 248 N -2.74 2.52 -0.17 3.38 0.00 -1.13 -4.87 107.32 104.30 1hb4 s GLY 248 Ca -0.01 -1.59 -0.06 0.00 0.00 0.00 0.00 44.72 43.06 1hb4 s GLY 248 CO 0.40 -2.01 0.03 -0.19 0.00 0.00 0.00 173.10 171.33 1hb4 s TYR 249 N -2.71 3.17 -0.19 1.90 1.51 -0.77 -4.72 117.35 115.54 1hb4 s TYR 249 Ca 0.31 -0.05 -0.24 0.00 -1.01 0.00 0.00 57.07 56.08 1hb4 s TYR 249 Cb 0.03 -2.04 -0.01 0.00 -0.11 0.00 0.00 41.96 39.83 1hb4 s TYR 249 CO 0.17 0.09 0.78 -1.17 -1.11 0.00 0.00 175.55 174.32 1hb4 s LEU 250 N 0.35 4.14 -0.04 -1.29 2.96 0.26 -0.22 118.68 124.84 1hb4 s LEU 250 Ca 0.01 1.06 0.03 0.00 -0.22 0.00 0.00 54.13 55.01 1hb4 s LEU 250 Cb -0.13 -3.14 -0.03 0.00 0.50 0.00 0.00 46.19 43.39 1hb4 s LEU 250 CO 0.01 -0.40 -0.13 -0.63 -1.32 0.00 0.00 176.35 173.88 1hb4 s ILE 251 N 2.27 3.17 0.13 6.68 -1.09 0.26 -0.98 121.20 131.64 1hb4 s ILE 251 Ca 0.35 -0.72 -0.12 0.00 -2.23 0.00 0.00 60.65 57.92 1hb4 s ILE 251 Cb -0.16 -2.27 0.01 0.00 -1.58 0.00 0.00 42.46 38.47 1hb4 s ILE 251 CO 0.11 0.56 0.33 0.54 -1.23 0.00 0.00 174.94 175.24 1hb4 s ASN 252 N -0.84 -0.07 0.35 3.58 4.22 -1.01 -2.13 114.94 119.04 1hb4 s ASN 252 Ca 0.12 -0.56 -0.16 0.00 -2.14 0.00 0.00 52.86 50.13 1hb4 s ASN 252 Cb -0.11 0.44 -0.09 0.00 1.28 0.00 0.00 41.25 42.77 1hb4 s ASN 252 CO 0.01 -0.85 0.78 0.00 -2.04 0.00 0.00 177.10 175.01 1hb4 s GLY 254 N -2.36 2.03 0.34 0.00 0.00 -0.39 -4.09 107.32 102.84 1hb4 s GLY 254 Ca 0.55 -1.75 0.26 0.00 0.00 0.00 0.00 44.72 43.78 1hb4 s GLY 254 CO 0.18 -1.77 1.79 1.48 0.00 0.00 0.00 173.10 174.78 1hb4 h SER 255 N 0.52 0.00 -0.20 1.64 4.64 -0.93 -1.78 113.55 117.44 1hb4 h SER 255 Ca -0.34 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 60.82 1hb4 h SER 255 Cb 1.29 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.37 1hb4 h SER 255 CO 0.49 0.00 -0.43 0.22 -0.87 0.00 0.00 176.83 176.24 1hb4 h TYR 256 N 0.00 0.90 -0.65 4.77 3.20 -1.74 -0.92 116.97 122.53 1hb4 h TYR 256 Ca 0.00 -0.28 -0.08 0.00 3.14 0.00 0.00 58.73 61.51 1hb4 h TYR 256 Cb 0.36 -0.19 -0.03 0.00 1.54 0.00 0.00 36.73 38.42 1hb4 h TYR 256 CO 0.00 1.05 0.09 1.98 -1.64 0.00 0.00 178.16 179.63 1hb4 h MET 257 N 0.60 1.09 -0.75 1.82 4.05 -1.48 -1.65 114.93 118.62 1hb4 h MET 257 Ca 0.04 -0.30 -0.00 0.00 -0.28 0.00 0.00 59.70 59.16 1hb4 h MET 257 Cb 0.99 -0.12 -0.04 0.00 -0.80 0.00 0.00 31.60 31.63 1hb4 h MET 257 CO 0.09 1.01 0.46 0.00 0.23 0.00 0.00 176.91 178.71 1hb4 h ALA 258 N 1.03 0.95 0.04 0.39 0.00 -1.32 -1.57 119.26 118.79 1hb4 h ALA 258 Ca 0.20 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1hb4 h ALA 258 Cb 0.46 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1hb4 h ALA 258 CO 0.02 0.41 -0.02 1.25 0.00 0.00 0.00 179.25 180.91 1hb4 h HIS 259 N 1.02 -0.05 -0.04 0.00 6.17 -0.82 0.16 115.15 121.59 1hb4 h HIS 259 Ca 0.27 -0.00 -0.04 0.00 0.71 0.00 0.00 60.37 61.31 1hb4 h HIS 259 Cb -0.05 0.02 -0.01 0.00 2.52 0.00 0.00 27.41 29.89 1hb4 h HIS 259 CO -0.01 0.08 -0.15 -0.07 0.71 0.00 0.00 177.93 178.48 1hb4 h LEU 260 N -0.16 0.05 -2.38 0.26 3.38 -1.08 -2.75 115.31 112.63 1hb4 h LEU 260 Ca -0.01 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1hb4 h LEU 260 Cb 0.15 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.88 1hb4 h LEU 260 CO 0.01 0.21 0.00 0.35 0.09 0.00 0.00 178.44 179.10 1hb4 n THR 261 N -4.33 0.56 -3.65 0.22 -2.24 -0.61 -0.35 114.28 103.87 1hb4 n THR 261 Ca -0.02 -0.78 -0.25 0.00 -2.27 0.00 0.00 64.05 60.73 1hb4 n THR 261 Cb 0.23 0.93 0.07 0.00 -2.10 0.00 0.00 70.33 69.47 1hb4 n THR 261 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1hb4 n ASN 262 N 1.47 -5.60 -0.48 3.42 5.15 -0.68 -1.88 115.26 116.67 1hb4 n ASN 262 Ca 0.19 -0.60 -0.06 0.00 -0.60 0.00 0.00 54.58 53.51 1hb4 n ASN 262 Cb 0.60 -4.79 -0.03 0.00 -0.53 0.00 0.00 39.78 35.03 1hb4 n ASN 262 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1hb4 n ASN 263 N -2.99 -4.60 -0.13 1.20 5.15 0.49 -4.87 115.26 109.50 1hb4 n ASN 263 Ca -0.02 0.15 -0.10 0.00 -0.60 0.00 0.00 54.58 54.02 1hb4 n ASN 263 Cb 0.57 -2.65 -0.02 0.00 -0.53 0.00 0.00 39.78 37.15 1hb4 n ASN 263 CO 0.00 0.00 0.00 0.22 1.40 0.00 0.00 177.26 178.88 1hb4 h TYR 264 N 0.00 0.64 -3.38 1.20 3.20 -1.63 -3.27 116.97 113.73 1hb4 h TYR 264 Ca -0.13 -0.09 -0.72 0.00 3.14 0.00 0.00 58.73 60.93 1hb4 h TYR 264 Cb 0.69 -0.18 -0.30 0.00 1.54 0.00 0.00 36.73 38.48 1hb4 h TYR 264 CO 0.35 0.65 -0.37 0.71 -1.64 0.00 0.00 178.16 177.87 1hb4 s TYR 265 N -5.20 3.46 0.62 -3.82 4.12 -1.26 -4.70 117.35 110.57 1hb4 s TYR 265 Ca -0.13 -2.03 -0.15 0.00 0.02 0.00 0.00 57.07 54.77 1hb4 s TYR 265 Cb 0.09 -3.47 -0.02 0.00 -1.52 0.00 0.00 41.96 37.05 1hb4 s TYR 265 CO 0.77 -0.98 1.09 0.15 0.02 0.00 0.00 175.55 176.60 1hb4 s LYS 266 N 1.09 3.07 -0.49 -0.62 1.02 -1.24 -3.38 119.74 119.18 1hb4 s LYS 266 Ca 0.08 1.31 -0.24 0.00 0.02 0.00 0.00 55.97 57.13 1hb4 s LYS 266 Cb -0.24 -1.99 0.03 0.00 -0.52 0.00 0.00 37.83 35.11 1hb4 s LYS 266 CO -0.02 -1.03 0.90 0.00 -0.92 0.00 0.00 175.35 174.28 1hb4 s ALA 267 N -2.38 3.22 0.34 5.17 0.00 -1.26 -4.65 121.76 122.20 1hb4 s ALA 267 Ca 0.65 -1.00 -0.29 0.00 0.00 0.00 0.00 51.96 51.33 1hb4 s ALA 267 Cb -0.18 -3.64 -0.10 0.00 0.00 0.00 0.00 23.12 19.19 1hb4 s ALA 267 CO 0.39 -2.15 1.38 -1.25 0.00 0.00 0.00 175.76 174.12 1hb4 s PRO 268 N 3.73 4.27 -0.01 0.00 0.04 -1.26 -4.88 135.00 136.89 1hb4 s PRO 268 Ca 0.33 2.34 -0.28 0.00 0.04 0.00 0.00 61.00 63.42 1hb4 s PRO 268 Cb -0.11 -3.04 -0.03 0.00 0.04 0.00 0.00 34.50 31.35 1hb4 s PRO 268 CO 0.23 -0.32 0.91 0.42 0.04 0.00 0.00 177.00 178.28 1hb4 s ILE 269 N -1.02 4.89 0.18 0.56 1.01 -1.26 -4.58 121.20 120.98 1hb4 s ILE 269 Ca 0.51 1.91 -0.08 0.00 0.00 0.00 0.00 60.65 62.99 1hb4 s ILE 269 Cb -0.42 -4.25 -0.01 0.00 0.01 0.00 0.00 42.46 37.79 1hb4 s ILE 269 CO 0.55 0.19 0.28 -1.38 0.00 0.00 0.00 174.94 174.59 1hb4 s HIS 270 N 0.89 0.50 0.18 3.97 -3.43 -0.77 -1.08 115.29 115.55 1hb4 s HIS 270 Ca 0.48 -0.85 -0.11 0.00 -0.80 0.00 0.00 55.06 53.78 1hb4 s HIS 270 Cb -0.20 -0.10 -0.00 0.00 -1.43 0.00 0.00 32.58 30.84 1hb4 s HIS 270 CO 0.26 -0.74 0.35 -0.98 -2.00 0.00 0.00 174.74 171.62 1hb4 s ARG 271 N -4.00 1.25 -0.29 -0.38 1.70 -0.39 -1.63 118.95 115.20 1hb4 s ARG 271 Ca 0.21 -1.14 -0.04 0.00 -0.47 0.00 0.00 55.73 54.29 1hb4 s ARG 271 Cb 0.03 0.41 0.03 0.00 -0.57 0.00 0.00 34.95 34.85 1hb4 s ARG 271 CO 0.03 -0.48 0.03 0.08 -1.08 0.00 0.00 175.30 173.87 1hb4 s VAL 272 N -3.96 3.41 0.54 4.99 1.01 -0.76 -1.34 120.40 124.28 1hb4 s VAL 272 Ca 0.17 -1.00 -0.20 0.00 0.00 0.00 0.00 61.98 60.95 1hb4 s VAL 272 Cb 0.02 -2.82 -0.06 0.00 0.00 0.00 0.00 36.38 33.52 1hb4 s VAL 272 CO 0.01 0.04 1.14 -0.54 0.00 0.00 0.00 175.10 175.74 1hb4 s LYS 273 N 1.38 3.39 -0.03 2.72 1.02 0.49 -0.44 119.74 128.27 1hb4 s LYS 273 Ca -0.00 1.64 -0.30 0.00 0.02 0.00 0.00 55.97 57.33 1hb4 s LYS 273 Cb -0.18 -2.05 -0.04 0.00 -0.52 0.00 0.00 37.83 35.05 1hb4 s LYS 273 CO -0.00 -0.83 1.22 -0.46 -0.92 0.00 0.00 175.35 174.36 1hb4 s TRP 274 N -1.74 3.19 -0.05 3.18 -0.00 -0.13 -4.10 118.94 119.29 1hb4 s TRP 274 Ca 0.72 1.19 0.01 0.00 -0.00 0.00 0.00 56.10 58.01 1hb4 s TRP 274 Cb -0.25 -3.45 0.02 0.00 -0.00 0.00 0.00 33.47 29.80 1hb4 s TRP 274 CO 0.28 -1.43 -0.04 0.08 -0.00 0.00 0.00 176.95 175.85 1hb4 s VAL 275 N 2.05 0.50 -1.10 5.86 1.01 -1.26 -4.86 120.40 122.60 1hb4 s VAL 275 Ca 0.57 -0.08 -0.17 0.00 0.00 0.00 0.00 61.98 62.30 1hb4 s VAL 275 Cb -0.26 -0.55 0.13 0.00 0.00 0.00 0.00 36.38 35.70 1hb4 s VAL 275 CO 0.24 0.23 1.37 0.21 0.00 0.00 0.00 175.10 177.15 1hb4 s ASN 276 N 1.08 6.82 -0.14 3.32 3.84 -1.26 -4.89 114.94 123.71 1hb4 s ASN 276 Ca -0.08 -2.41 -0.20 0.00 0.21 0.00 0.00 52.86 50.37 1hb4 s ASN 276 Cb -0.14 -2.45 0.05 0.00 -0.55 0.00 0.00 41.25 38.17 1hb4 s ASN 276 CO -0.01 -1.00 0.52 0.00 -2.79 0.00 0.00 177.10 173.82 1hb4 s ALA 277 N 2.73 -1.31 -0.38 1.71 0.00 -1.26 -4.87 121.76 118.38 1hb4 s ALA 277 Ca 0.41 1.25 -0.29 0.00 0.00 0.00 0.00 51.96 53.33 1hb4 s ALA 277 Cb -0.02 -0.52 0.01 0.00 0.00 0.00 0.00 23.12 22.59 1hb4 s ALA 277 CO -0.03 -0.28 1.33 -2.00 0.00 0.00 0.00 175.76 174.78 1hb4 s GLU 278 N -0.32 3.71 0.22 0.00 2.56 -1.26 -3.84 118.70 119.78 1hb4 s GLU 278 Ca -0.05 0.98 -0.12 0.00 0.00 0.00 0.00 54.97 55.79 1hb4 s GLU 278 Cb -0.03 -3.96 -0.00 0.00 2.00 0.00 0.00 34.13 32.14 1hb4 s GLU 278 CO 0.03 -1.38 0.42 -0.98 -0.56 0.00 0.00 175.26 172.79 1hb4 s ARG 279 N 4.59 1.44 0.09 4.30 1.70 0.34 -4.92 118.95 126.49 1hb4 s ARG 279 Ca 0.57 -1.22 0.10 0.00 -0.47 0.00 0.00 55.73 54.71 1hb4 s ARG 279 Cb -0.14 0.45 -0.03 0.00 -0.57 0.00 0.00 34.95 34.65 1hb4 s ARG 279 CO 0.29 -0.58 -0.27 -0.65 -1.08 0.00 0.00 175.30 173.01 1hb4 s GLN 280 N -4.00 1.56 -0.12 3.89 -0.21 -1.26 -1.66 119.66 117.85 1hb4 s GLN 280 Ca 0.21 -1.24 -0.03 0.00 0.02 0.00 0.00 55.36 54.32 1hb4 s GLN 280 Cb 0.01 -1.92 0.05 0.00 1.00 0.00 0.00 33.01 32.15 1hb4 s GLN 280 CO 0.06 0.47 0.06 0.45 -2.12 0.00 0.00 175.29 174.22 1hb4 s SER 281 N -1.70 1.94 -0.63 5.90 0.15 -0.74 -1.83 113.70 116.79 1hb4 s SER 281 Ca 0.13 -0.36 0.05 0.00 0.70 0.00 0.00 55.95 56.47 1hb4 s SER 281 Cb -0.10 -0.27 0.19 0.00 -1.71 0.00 0.00 66.02 64.13 1hb4 s SER 281 CO 0.04 -0.30 0.52 0.18 1.20 0.00 0.00 173.24 174.89 1hb4 n LEU 282 N 5.25 2.49 -4.81 3.45 4.77 0.66 -1.19 117.00 127.62 1hb4 n LEU 282 Ca -0.06 -5.10 -0.34 0.00 -0.03 0.00 0.00 56.01 50.48 1hb4 n LEU 282 Cb 0.49 -0.47 -0.06 0.00 -2.33 0.00 0.00 43.42 41.06 1hb4 n LEU 282 CO 0.09 1.85 0.67 -2.16 -1.33 0.00 0.00 177.39 176.51 1hb4 s PRO 283 N -1.42 4.17 -0.23 3.23 0.04 -1.20 -2.46 135.00 137.13 1hb4 s PRO 283 Ca 0.30 1.25 0.01 0.00 0.04 0.00 0.00 61.00 62.59 1hb4 s PRO 283 Cb 0.02 -2.28 0.04 0.00 0.04 0.00 0.00 34.50 32.31 1hb4 s PRO 283 CO -0.14 -0.09 -0.12 0.12 0.04 0.00 0.00 177.00 176.80 1hb4 s PHE 284 N -2.00 3.04 -0.37 0.56 5.36 -0.38 -1.71 117.98 122.49 1hb4 s PHE 284 Ca 0.61 -1.86 -0.21 0.00 -0.96 0.00 0.00 56.93 54.51 1hb4 s PHE 284 Cb -0.13 -1.97 0.01 0.00 -0.34 0.00 0.00 43.02 40.58 1hb4 s PHE 284 CO 0.18 -0.81 0.68 -0.06 -1.46 0.00 0.00 175.22 173.75 1hb4 s PHE 285 N 1.24 3.13 -0.71 10.12 0.40 -0.20 -1.45 117.98 130.50 1hb4 s PHE 285 Ca -0.01 0.37 -0.27 0.00 -0.60 0.00 0.00 56.93 56.41 1hb4 s PHE 285 Cb -0.17 -3.23 0.03 0.00 0.51 0.00 0.00 43.02 40.16 1hb4 s PHE 285 CO -0.07 -0.68 1.25 0.08 0.70 0.00 0.00 175.22 176.50 1hb4 s VAL 286 N 2.83 3.79 0.08 -0.44 1.01 -0.34 -2.58 120.40 124.75 1hb4 s VAL 286 Ca 0.26 0.45 0.06 0.00 0.00 0.00 0.00 61.98 62.76 1hb4 s VAL 286 Cb -0.14 -4.88 -0.04 0.00 0.00 0.00 0.00 36.38 31.32 1hb4 s VAL 286 CO 0.16 -1.76 -0.10 0.20 0.00 0.00 0.00 175.10 173.59 1hb4 s ASN 287 N 3.62 4.38 0.00 3.32 0.01 -1.26 -1.05 114.94 123.96 1hb4 s ASN 287 Ca 0.36 -0.34 0.00 0.00 -0.71 0.00 0.00 52.86 52.17 1hb4 s ASN 287 Cb -0.08 -0.86 0.00 0.00 0.41 0.00 0.00 41.25 40.71 1hb4 s ASN 287 CO 0.16 0.21 0.00 0.18 -1.51 0.00 0.00 177.10 176.14 1hb4 n LEU 288 N 0.97 0.00 -4.93 0.60 4.77 -1.26 -3.69 117.00 113.46 1hb4 n LEU 288 Ca -0.14 0.00 -0.26 0.00 -0.03 0.00 0.00 56.01 55.58 1hb4 n LEU 288 Cb 0.52 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.65 1hb4 n LEU 288 CO 0.32 0.00 0.50 -0.83 -1.33 0.00 0.00 177.39 176.05 1hb4 s GLY 289 N -0.82 1.63 0.26 -0.72 0.00 -1.19 -1.64 107.32 104.84 1hb4 s GLY 289 Ca 0.00 -0.83 -0.03 0.00 0.00 0.00 0.00 44.72 43.86 1hb4 s GLY 289 CO 0.00 -0.54 1.84 -1.82 0.00 0.00 0.00 173.10 172.57 1hb4 h TYR 290 N -0.16 1.01 -0.05 1.90 3.20 -1.94 -2.21 116.97 118.73 1hb4 h TYR 290 Ca -0.45 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.45 1hb4 h TYR 290 Cb 1.27 -0.32 0.00 0.00 1.54 0.00 0.00 36.73 39.22 1hb4 h TYR 290 CO 0.44 0.45 0.00 -0.25 -1.64 0.00 0.00 178.16 177.16 1hb4 n ASP 291 N -4.65 2.33 -4.69 -2.11 10.43 -1.26 -0.72 116.55 115.87 1hb4 n ASP 291 Ca 0.15 -1.77 -0.42 0.00 2.57 0.00 0.00 54.79 55.31 1hb4 n ASP 291 Cb 0.26 -0.02 -0.03 0.00 1.84 0.00 0.00 41.12 43.17 1hb4 n ASP 291 CO 0.00 0.00 0.00 -1.20 -1.07 0.00 0.00 177.20 174.93 1hb4 n SER 292 N 0.81 4.01 -3.86 -2.24 7.64 -0.83 -4.77 113.62 114.39 1hb4 n SER 292 Ca 0.16 0.99 -0.24 0.00 1.01 0.00 0.00 58.87 60.80 1hb4 n SER 292 Cb 0.48 -1.54 -0.17 0.00 -1.01 0.00 0.00 64.21 61.97 1hb4 n SER 292 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1hb4 s VAL 293 N 2.58 0.73 -0.16 0.44 1.01 -1.26 -0.25 120.40 123.49 1hb4 s VAL 293 Ca 0.81 -0.12 -0.04 0.00 0.00 0.00 0.00 61.98 62.63 1hb4 s VAL 293 Cb -0.49 -0.79 -0.03 0.00 0.00 0.00 0.00 36.38 35.07 1hb4 s VAL 293 CO 0.37 0.31 -0.03 -0.63 0.00 0.00 0.00 175.10 175.12 1hb4 s ILE 294 N 1.65 3.93 0.01 2.22 1.01 -1.26 -5.07 121.20 123.69 1hb4 s ILE 294 Ca 0.02 -0.34 -0.30 0.00 0.00 0.00 0.00 60.65 60.02 1hb4 s ILE 294 Cb -0.13 -2.72 -0.05 0.00 0.01 0.00 0.00 42.46 39.57 1hb4 s ILE 294 CO -0.05 0.49 1.25 -1.81 0.00 0.00 0.00 174.94 174.82 1hb4 s ASP 295 N 0.36 7.01 0.56 3.58 1.01 -1.26 -4.63 116.67 123.29 1hb4 s ASP 295 Ca -0.04 1.99 -0.21 0.00 0.71 0.00 0.00 52.55 55.00 1hb4 s ASP 295 Cb -0.14 -2.57 -0.05 0.00 1.01 0.00 0.00 42.92 41.17 1hb4 s ASP 295 CO 0.03 -0.57 1.31 -2.65 0.21 0.00 0.00 175.17 173.50 1hb4 n PRO 296 N 4.64 1.55 -4.14 8.23 -0.02 -1.26 -5.01 135.00 139.00 1hb4 n PRO 296 Ca 0.11 0.58 -0.15 0.00 -2.02 0.00 0.00 63.50 62.01 1hb4 n PRO 296 Cb 0.45 -2.53 -0.06 0.00 -0.02 0.00 0.00 33.50 31.35 1hb4 n PRO 296 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 1hb4 s PHE 297 N -1.31 1.16 -0.22 6.00 -0.12 0.52 -4.41 117.98 119.60 1hb4 s PHE 297 Ca 0.73 -1.33 -0.04 0.00 -0.05 0.00 0.00 56.93 56.24 1hb4 s PHE 297 Cb -0.42 -0.25 0.08 0.00 -0.63 0.00 0.00 43.02 41.81 1hb4 s PHE 297 CO 0.48 -1.01 0.15 0.34 -0.05 0.00 0.00 175.22 175.13 1hb4 s ASP 298 N -3.24 2.35 0.00 1.98 -1.08 -0.42 -3.23 116.67 113.04 1hb4 s ASP 298 Ca 0.33 -0.70 0.17 0.00 -0.52 0.00 0.00 52.55 51.83 1hb4 s ASP 298 Cb 0.01 -0.06 0.99 0.00 -1.46 0.00 0.00 42.92 42.40 1hb4 s ASP 298 CO 0.20 -0.37 1.43 -2.65 0.52 0.00 0.00 175.17 174.30 1hb4 n PRO 299 N 5.28 0.49 0.02 4.34 -0.02 -1.26 -1.72 135.00 142.13 1hb4 n PRO 299 Ca -0.06 0.02 0.11 0.00 -2.02 0.00 0.00 63.50 61.55 1hb4 n PRO 299 Cb 0.47 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.45 1hb4 n PRO 299 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1hb4 n ARG 300 N -1.05 0.27 -4.07 -0.52 1.74 -1.26 -4.93 116.66 106.83 1hb4 n ARG 300 Ca 0.12 -0.02 -0.35 0.00 -0.77 0.00 0.00 57.85 56.83 1hb4 n ARG 300 Cb 0.07 -1.57 -0.07 0.00 -1.02 0.00 0.00 32.46 29.86 1hb4 n ARG 300 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1hb4 s GLU 301 N -3.19 3.23 0.24 5.56 0.41 -0.70 -5.02 118.70 119.23 1hb4 s GLU 301 Ca 0.04 -0.29 -0.05 0.00 -0.41 0.00 0.00 54.97 54.25 1hb4 s GLU 301 Cb 0.15 -3.00 0.40 0.00 -1.78 0.00 0.00 34.13 29.90 1hb4 s GLU 301 CO 0.81 0.72 1.77 -1.35 -0.49 0.00 0.00 175.26 176.72 1hb4 h PRO 302 N 4.79 0.57 -0.01 0.39 0.11 -1.92 -0.43 132.00 135.50 1hb4 h PRO 302 Ca -0.52 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.55 1hb4 h PRO 302 Cb 1.21 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1hb4 h PRO 302 CO 0.58 0.38 -0.06 0.27 -0.21 0.00 0.00 178.00 178.96 1hb4 n ASN 303 N -4.88 1.26 -0.29 -2.05 0.23 -1.26 -4.93 115.26 103.34 1hb4 n ASN 303 Ca 0.13 -1.30 -0.04 0.00 -0.53 0.00 0.00 54.58 52.84 1hb4 n ASN 303 Cb 0.33 0.02 -0.02 0.00 -2.08 0.00 0.00 39.78 38.04 1hb4 n ASN 303 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1hb4 n GLY 304 N 1.20 0.49 3.83 4.83 0.00 -0.17 -4.98 105.19 110.39 1hb4 n GLY 304 Ca 0.18 -0.08 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 1hb4 n GLY 304 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hb4 s LYS 305 N -1.89 4.17 0.13 1.61 1.02 -1.26 -1.30 119.74 122.22 1hb4 s LYS 305 Ca 0.00 1.01 0.08 0.00 0.02 0.00 0.00 55.97 57.08 1hb4 s LYS 305 Cb 0.00 -2.23 -0.04 0.00 -0.52 0.00 0.00 37.83 35.04 1hb4 s LYS 305 CO 0.00 0.00 -0.19 0.45 -0.92 0.00 0.00 175.35 174.69 1hb4 s SER 306 N -2.24 2.53 -0.50 2.83 0.15 -1.26 -4.27 113.70 110.93 1hb4 s SER 306 Ca 0.60 -0.78 0.02 0.00 0.70 0.00 0.00 55.95 56.49 1hb4 s SER 306 Cb -0.09 -0.14 0.59 0.00 -1.71 0.00 0.00 66.02 64.66 1hb4 s SER 306 CO 0.15 -0.01 1.94 0.47 1.20 0.00 0.00 173.24 176.99 1hb4 n ASP 307 N 0.67 4.92 -4.70 5.45 8.00 -1.26 -4.92 116.55 124.71 1hb4 n ASP 307 Ca -0.16 -3.62 -0.32 0.00 0.71 0.00 0.00 54.79 51.40 1hb4 n ASP 307 Cb 0.55 -0.88 -0.08 0.00 -0.02 0.00 0.00 41.12 40.70 1hb4 n ASP 307 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1hb4 s ARG 308 N -3.36 2.75 0.16 -1.24 0.52 -1.26 -5.11 118.95 111.40 1hb4 s ARG 308 Ca 0.58 -0.68 -0.17 0.00 -0.52 0.00 0.00 55.73 54.93 1hb4 s ARG 308 Cb 0.47 -2.65 -0.07 0.00 0.52 0.00 0.00 34.95 33.22 1hb4 s ARG 308 CO 0.07 0.59 0.61 -1.21 0.02 0.00 0.00 175.30 175.39 1hb4 s GLU 309 N -1.91 4.13 0.41 3.54 0.41 -1.26 -4.75 118.70 119.26 1hb4 s GLU 309 Ca 0.23 0.68 -0.26 0.00 -0.41 0.00 0.00 54.97 55.20 1hb4 s GLU 309 Cb -0.12 -2.99 -0.10 0.00 -1.78 0.00 0.00 34.13 29.15 1hb4 s GLU 309 CO 0.15 0.49 1.39 -2.30 -0.49 0.00 0.00 175.26 174.49 1hb4 n PRO 310 N 0.99 2.28 -4.12 0.39 -0.02 -1.26 -4.89 135.00 128.36 1hb4 n PRO 310 Ca -0.05 0.80 -0.24 0.00 -2.02 0.00 0.00 63.50 61.99 1hb4 n PRO 310 Cb 0.51 -2.54 -0.17 0.00 -0.02 0.00 0.00 33.50 31.28 1hb4 n PRO 310 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1hb4 s LEU 311 N -2.04 1.25 0.45 2.45 2.96 -1.26 -5.10 118.68 117.38 1hb4 s LEU 311 Ca 0.58 -0.22 -0.22 0.00 -0.22 0.00 0.00 54.13 54.04 1hb4 s LEU 311 Cb -0.49 -0.68 -0.08 0.00 0.50 0.00 0.00 46.19 45.45 1hb4 s LEU 311 CO 0.60 -0.07 1.10 -0.94 -1.32 0.00 0.00 176.35 175.72 1hb4 s SER 312 N 1.28 6.33 0.32 3.68 1.04 -1.26 -4.53 113.70 120.56 1hb4 s SER 312 Ca -0.04 2.15 0.00 0.00 0.48 0.00 0.00 55.95 58.54 1hb4 s SER 312 Cb -0.14 -2.59 0.53 0.00 0.10 0.00 0.00 66.02 63.93 1hb4 s SER 312 CO -0.03 -0.80 1.95 0.22 0.98 0.00 0.00 173.24 175.57 1hb4 h TYR 313 N 2.01 0.86 -0.57 5.02 3.20 -0.74 -1.46 116.97 125.29 1hb4 h TYR 313 Ca -0.49 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.37 1hb4 h TYR 313 Cb 1.23 -0.28 -0.03 0.00 1.54 0.00 0.00 36.73 39.20 1hb4 h TYR 313 CO 0.55 0.59 0.34 0.78 -1.64 0.00 0.00 178.16 178.78 1hb4 h GLY 314 N 0.94 0.83 0.88 1.82 0.00 -1.07 0.13 103.07 106.60 1hb4 h GLY 314 Ca 0.23 -0.35 -0.01 0.00 0.00 0.00 0.00 47.33 47.20 1hb4 h GLY 314 CO -0.04 0.34 0.06 -0.55 0.00 0.00 0.00 176.54 176.35 1hb4 h ASP 315 N 0.76 0.21 -0.15 0.19 3.45 -1.71 -1.97 116.42 117.20 1hb4 h ASP 315 Ca 0.20 -0.16 0.04 0.00 0.43 0.00 0.00 57.03 57.54 1hb4 h ASP 315 Cb -0.01 -0.05 -0.04 0.00 -0.56 0.00 0.00 39.33 38.67 1hb4 h ASP 315 CO -0.04 0.31 -0.07 0.22 -1.57 0.00 0.00 179.24 178.09 1hb4 h TYR 316 N 0.09 -0.17 0.12 4.55 3.20 -0.85 -2.74 116.97 121.17 1hb4 h TYR 316 Ca 0.05 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.93 1hb4 h TYR 316 Cb 0.16 0.10 0.00 0.00 1.54 0.00 0.00 36.73 38.54 1hb4 h TYR 316 CO -0.02 -0.12 -0.06 1.25 -1.64 0.00 0.00 178.16 177.58 1hb4 h LEU 317 N -0.06 -0.13 -0.76 2.82 5.85 -0.66 -0.16 115.31 122.21 1hb4 h LEU 317 Ca 0.09 -0.24 -0.02 0.00 0.84 0.00 0.00 57.88 58.55 1hb4 h LEU 317 Cb 0.19 0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.21 1hb4 h LEU 317 CO -0.19 0.17 0.40 0.06 -0.34 0.00 0.00 178.44 178.54 1hb4 h GLN 318 N -0.45 1.07 -0.58 1.25 3.07 -1.40 -1.03 115.11 117.05 1hb4 h GLN 318 Ca -0.02 -0.14 -0.07 0.00 0.09 0.00 0.00 58.65 58.51 1hb4 h GLN 318 Cb 0.36 -0.20 -0.02 0.00 0.08 0.00 0.00 27.48 27.70 1hb4 h GLN 318 CO 0.03 0.81 0.08 -0.97 0.09 0.00 0.00 178.83 178.86 1hb4 h ASN 319 N 1.06 0.93 -0.49 0.06 -0.73 -1.51 -3.05 115.58 111.85 1hb4 h ASN 319 Ca 0.27 -0.27 -0.10 0.00 1.87 0.00 0.00 56.30 58.06 1hb4 h ASN 319 Cb 0.06 -0.25 -0.02 0.00 0.27 0.00 0.00 38.32 38.39 1hb4 h ASN 319 CO -0.04 0.97 -0.08 1.23 -0.37 0.00 0.00 177.43 179.14 1hb4 h GLY 320 N 0.86 1.03 1.28 1.57 0.00 -0.49 -2.12 103.07 105.21 1hb4 h GLY 320 Ca 0.17 -0.80 -0.13 0.00 0.00 0.00 0.00 47.33 46.58 1hb4 h GLY 320 CO 0.01 0.73 -0.26 1.41 0.00 0.00 0.00 176.54 178.43 1hb4 h LEU 321 N 0.86 0.84 -0.36 3.11 3.38 -1.17 -1.57 115.31 120.40 1hb4 h LEU 321 Ca 0.14 -0.32 -0.05 0.00 0.09 0.00 0.00 57.88 57.74 1hb4 h LEU 321 Cb 0.62 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 1hb4 h LEU 321 CO 0.04 1.06 0.05 0.58 0.09 0.00 0.00 178.44 180.25 1hb4 h VAL 322 N 0.70 1.24 -0.60 1.22 2.07 -1.51 -2.57 116.25 116.80 1hb4 h VAL 322 Ca 0.09 -0.87 -0.04 0.00 0.82 0.00 0.00 66.70 66.69 1hb4 h VAL 322 Cb 0.80 1.11 -0.03 0.00 -1.52 0.00 0.00 31.29 31.65 1hb4 h VAL 322 CO 0.07 0.29 0.21 0.28 0.02 0.00 0.00 177.57 178.44 1hb4 h SER 323 N 0.45 0.83 -0.29 0.57 0.02 -1.19 -0.92 113.55 113.01 1hb4 h SER 323 Ca 0.11 -0.13 -0.12 0.00 -0.84 0.00 0.00 61.79 60.81 1hb4 h SER 323 Cb 0.38 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.69 1hb4 h SER 323 CO 0.01 0.77 -0.25 0.25 -1.14 0.00 0.00 176.83 176.47 1hb4 h LEU 324 N 0.88 0.80 -0.69 5.07 5.85 -1.21 -0.95 115.31 125.06 1hb4 h LEU 324 Ca 0.20 -0.30 -0.09 0.00 0.84 0.00 0.00 57.88 58.53 1hb4 h LEU 324 Cb 0.23 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.01 1hb4 h LEU 324 CO -0.01 1.02 0.02 0.40 -0.34 0.00 0.00 178.44 179.52 1hb4 h ILE 325 N 0.68 1.26 -0.51 4.05 2.04 -1.08 -0.23 117.51 123.72 1hb4 h ILE 325 Ca 0.09 -1.11 -0.10 0.00 1.00 0.00 0.00 64.86 64.73 1hb4 h ILE 325 Cb 0.77 0.78 -0.02 0.00 -0.74 0.00 0.00 36.82 37.61 1hb4 h ILE 325 CO 0.06 0.41 -0.09 0.78 0.00 0.00 0.00 178.15 179.31 1hb4 h ASN 326 N 0.95 0.92 0.09 1.72 2.35 -0.95 0.13 115.58 120.79 1hb4 h ASN 326 Ca 0.17 -0.29 -0.00 0.00 -0.55 0.00 0.00 56.30 55.63 1hb4 h ASN 326 Cb 0.52 -0.25 0.00 0.00 0.05 0.00 0.00 38.32 38.64 1hb4 h ASN 326 CO 0.03 1.03 -0.04 0.50 -1.65 0.00 0.00 177.43 177.29 1hb4 h LYS 327 N 0.84 -0.12 -0.28 0.81 3.64 -1.02 -3.39 116.57 117.05 1hb4 h LYS 327 Ca 0.14 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.53 1hb4 h LYS 327 Cb 0.62 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.47 1hb4 h LYS 327 CO 0.04 0.41 0.00 0.09 -2.27 0.00 0.00 179.45 177.72 1hb4 n ASN 328 N -4.83 2.81 0.00 4.20 4.13 -0.11 -5.08 115.26 116.37 1hb4 n ASN 328 Ca -0.08 -1.84 0.00 0.00 1.68 0.00 0.00 54.58 54.34 1hb4 n ASN 328 Cb 0.29 -0.18 0.00 0.00 -1.54 0.00 0.00 39.78 38.35 1hb4 n ASN 328 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1hb4 n GLY 329 N 0.81 0.39 3.68 7.41 0.00 0.45 -4.84 105.19 113.09 1hb4 n GLY 329 Ca 0.12 -1.68 -0.42 0.00 0.00 0.00 0.00 46.02 44.05 1hb4 n GLY 329 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1hb4 s GLN 330 N -3.36 4.26 0.00 1.61 2.00 -1.26 -4.57 119.66 118.34 1hb4 s GLN 330 Ca 0.00 1.99 0.30 0.00 -2.00 0.00 0.00 55.36 55.65 1hb4 s GLN 330 Cb 0.00 -3.65 1.45 0.00 0.80 0.00 0.00 33.01 31.62 1hb4 s GLN 330 CO 0.00 -0.63 1.97 0.25 -0.50 0.00 0.00 175.29 176.38