#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 5hpg s MET 2 N -3.86 1.98 -0.00 0.00 0.23 0.79 -4.74 119.30 113.70 5hpg s MET 2 Ca 0.08 -2.20 0.08 0.00 -1.03 0.00 0.00 55.69 52.62 5hpg s MET 2 Cb -0.03 -1.20 -0.02 0.00 -1.53 0.00 0.00 34.83 32.05 5hpg s MET 2 CO -0.01 -0.29 -0.24 -0.06 -2.03 0.00 0.00 175.02 172.38 5hpg s PHE 3 N -3.00 2.16 0.00 3.16 0.08 -1.26 -0.47 117.98 118.65 5hpg s PHE 3 Ca 0.22 -0.41 0.00 0.00 0.12 0.00 0.00 56.93 56.86 5hpg s PHE 3 Cb 0.05 -1.37 0.00 0.00 -0.57 0.00 0.00 43.02 41.13 5hpg s PHE 3 CO 0.11 -0.00 0.00 0.41 -0.10 0.00 0.00 175.22 175.64 5hpg n GLY 4 N 2.33 2.57 0.43 4.36 0.00 -1.26 -1.97 105.19 111.64 5hpg n GLY 4 Ca -0.16 -0.39 0.14 0.00 0.00 0.00 0.00 46.02 45.61 5hpg n GLY 4 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 5hpg n ASN 5 N 3.41 1.33 0.00 1.61 0.23 -1.26 -4.93 115.26 115.65 5hpg n ASN 5 Ca 0.00 -1.46 0.00 0.00 -0.53 0.00 0.00 54.58 52.59 5hpg n ASN 5 Cb 0.00 -0.01 0.00 0.00 -2.08 0.00 0.00 39.78 37.69 5hpg n ASN 5 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 5hpg n GLY 6 N 1.15 0.63 0.34 4.83 0.00 -0.83 -4.01 105.19 107.29 5hpg n GLY 6 Ca 0.19 -0.14 0.16 0.00 0.00 0.00 0.00 46.02 46.24 5hpg n GLY 6 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 5hpg h LYS 7 N 1.53 0.00 -0.32 1.61 3.64 -1.79 -1.69 116.57 119.55 5hpg h LYS 7 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 5hpg h LYS 7 Cb 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 5hpg h LYS 7 CO 0.00 0.00 0.00 0.41 -2.27 0.00 0.00 179.45 177.59 5hpg n GLY 8 N -1.55 1.49 3.71 5.01 0.00 -1.26 -4.70 105.19 107.88 5hpg n GLY 8 Ca 0.05 -0.70 -0.42 0.00 0.00 0.00 0.00 46.02 44.94 5hpg n GLY 8 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 5hpg s TYR 9 N -1.59 2.99 -0.13 1.61 5.04 -0.63 -4.89 117.35 119.75 5hpg s TYR 9 Ca 0.37 0.75 0.19 0.00 -2.44 0.00 0.00 57.07 55.93 5hpg s TYR 9 Cb 0.22 -3.78 0.44 0.00 0.35 0.00 0.00 41.96 39.19 5hpg s TYR 9 CO 0.31 -2.88 1.18 0.54 -1.34 0.00 0.00 175.55 173.37 5hpg n ARG 10 N 4.51 1.05 -0.68 4.97 5.12 -1.26 -4.80 116.66 125.56 5hpg n ARG 10 Ca 0.13 -2.81 -0.13 0.00 -1.93 0.00 0.00 57.85 53.11 5hpg n ARG 10 Cb 0.41 -0.94 0.10 0.00 -1.16 0.00 0.00 32.46 30.87 5hpg n ARG 10 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 5hpg n GLY 11 N -0.30 -1.85 0.67 -0.13 0.00 -1.26 -5.03 105.19 97.28 5hpg n GLY 11 Ca 0.14 -1.59 0.04 0.00 0.00 0.00 0.00 46.02 44.61 5hpg n GLY 11 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 5hpg n LYS 12 N -2.57 1.74 -2.24 1.61 5.02 -1.26 -4.71 118.16 115.76 5hpg n LYS 12 Ca 0.07 -3.05 -0.40 0.00 -2.02 0.00 0.00 58.31 52.90 5hpg n LYS 12 Cb 0.26 -1.67 -0.03 0.00 -0.02 0.00 0.00 35.03 33.57 5hpg n LYS 12 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 5hpg s ARG 13 N -3.11 4.43 0.00 1.97 0.52 -1.26 -4.92 118.95 116.57 5hpg s ARG 13 Ca 0.39 2.07 0.03 0.00 -0.52 0.00 0.00 55.73 57.70 5hpg s ARG 13 Cb 0.36 -3.09 0.06 0.00 0.52 0.00 0.00 34.95 32.80 5hpg s ARG 13 CO -0.01 -0.07 0.96 1.33 0.02 0.00 0.00 175.30 177.53 5hpg n VAL 14 N 0.88 0.00 -4.69 3.52 0.24 -1.26 -0.41 118.33 116.60 5hpg n VAL 14 Ca -0.00 -0.13 -0.23 0.00 -2.04 0.00 0.00 64.34 61.94 5hpg n VAL 14 Cb 0.43 0.51 -0.15 0.00 -1.47 0.00 0.00 33.84 33.15 5hpg n VAL 14 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 5hpg s THR 15 N 0.00 1.18 0.63 3.34 2.01 -1.26 -1.36 115.64 120.19 5hpg s THR 15 Ca 0.04 -0.62 -0.11 0.00 0.31 0.00 0.00 61.69 61.31 5hpg s THR 15 Cb 0.05 -1.00 0.15 0.00 0.01 0.00 0.00 72.50 71.71 5hpg s THR 15 CO -0.02 0.34 0.74 0.35 -0.69 0.00 0.00 174.62 175.34 5hpg n THR 16 N 2.85 0.00 0.56 -0.82 -2.24 0.20 -4.36 114.28 110.46 5hpg n THR 16 Ca -0.15 -0.47 0.07 0.00 -2.27 0.00 0.00 64.05 61.22 5hpg n THR 16 Cb 0.54 -1.50 0.31 0.00 -2.10 0.00 0.00 70.33 67.59 5hpg n THR 16 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 5hpg n VAL 17 N -3.38 0.84 0.86 2.28 0.24 0.97 -1.01 118.33 119.12 5hpg n VAL 17 Ca 0.10 0.21 0.09 0.00 -2.04 0.00 0.00 64.34 62.70 5hpg n VAL 17 Cb 0.34 -0.98 -0.04 0.00 -1.47 0.00 0.00 33.84 31.69 5hpg n VAL 17 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 5hpg n THR 18 N -1.38 0.00 -0.36 3.34 -2.24 -1.26 -4.95 114.28 107.42 5hpg n THR 18 Ca 0.05 -0.21 0.00 0.00 -2.27 0.00 0.00 64.05 61.62 5hpg n THR 18 Cb 0.13 1.14 0.00 0.00 -2.10 0.00 0.00 70.33 69.49 5hpg n THR 18 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 5hpg n GLY 19 N 1.34 0.80 3.73 3.38 0.00 -0.18 -5.06 105.19 109.20 5hpg n GLY 19 Ca 0.06 -0.17 -0.40 0.00 0.00 0.00 0.00 46.02 45.51 5hpg n GLY 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 5hpg s THR 20 N -2.00 4.89 0.24 2.61 2.01 -1.26 -4.71 115.64 117.42 5hpg s THR 20 Ca 0.00 1.63 -0.31 0.00 0.31 0.00 0.00 61.69 63.31 5hpg s THR 20 Cb 0.00 -4.12 -0.12 0.00 0.01 0.00 0.00 72.50 68.27 5hpg s THR 20 CO 0.00 0.28 1.61 -2.65 -0.69 0.00 0.00 174.62 173.17 5hpg n PRO 21 N 3.41 2.55 -1.85 4.92 -0.02 -1.26 -0.63 135.00 142.13 5hpg n PRO 21 Ca -0.00 0.91 -0.37 0.00 -2.02 0.00 0.00 63.50 62.02 5hpg n PRO 21 Cb 0.51 -2.70 0.05 0.00 -0.02 0.00 0.00 33.50 31.34 5hpg n PRO 21 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 5hpg s GLN 23 N -3.23 4.14 0.38 0.00 0.74 0.33 -4.66 119.66 117.36 5hpg s GLN 23 Ca 0.78 0.90 -0.27 0.00 0.05 0.00 0.00 55.36 56.82 5hpg s GLN 23 Cb -0.36 -2.35 -0.09 0.00 1.10 0.00 0.00 33.01 31.31 5hpg s GLN 23 CO 0.39 0.09 1.32 -0.51 -0.55 0.00 0.00 175.29 176.03 5hpg s ASP 24 N -2.18 6.43 0.32 6.67 1.11 -1.26 -4.53 116.67 123.23 5hpg s ASP 24 Ca 0.57 2.69 -0.00 0.00 0.18 0.00 0.00 52.55 55.99 5hpg s ASP 24 Cb -0.10 -2.64 0.51 0.00 1.07 0.00 0.00 42.92 41.76 5hpg s ASP 24 CO 0.16 -0.77 1.96 -0.50 1.18 0.00 0.00 175.17 177.20 5hpg h TRP 25 N 2.88 0.90 0.00 4.23 4.06 -1.59 -0.51 115.95 125.93 5hpg h TRP 25 Ca -0.50 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 60.43 5hpg h TRP 25 Cb 1.24 -0.30 -0.00 0.00 -1.00 0.00 0.00 29.16 29.10 5hpg h TRP 25 CO 0.54 0.60 -0.12 0.00 -3.56 0.00 0.00 178.44 175.90 5hpg h ALA 26 N 1.50 0.98 -2.36 1.49 0.00 -1.84 -3.41 119.26 115.63 5hpg h ALA 26 Ca 0.25 -0.11 -0.50 0.00 0.00 0.00 0.00 54.91 54.55 5hpg h ALA 26 Cb -0.03 -0.02 0.07 0.00 0.00 0.00 0.00 17.79 17.81 5hpg h ALA 26 CO -0.05 0.15 0.38 0.00 0.00 0.00 0.00 179.25 179.73 5hpg s ALA 27 N -3.53 2.71 -0.10 0.00 0.00 -0.20 -4.96 121.76 115.67 5hpg s ALA 27 Ca 0.02 0.39 0.15 0.00 0.00 0.00 0.00 51.96 52.52 5hpg s ALA 27 Cb 0.09 -3.24 0.23 0.00 0.00 0.00 0.00 23.12 20.20 5hpg s ALA 27 CO 0.62 -0.88 1.12 1.04 0.00 0.00 0.00 175.76 177.65 5hpg n GLN 28 N -2.13 1.09 -3.85 0.00 1.13 -1.26 -4.77 117.38 107.59 5hpg n GLN 28 Ca 0.09 -2.26 -0.12 0.00 -1.94 0.00 0.00 57.00 52.77 5hpg n GLN 28 Cb 0.53 -1.31 -0.11 0.00 0.11 0.00 0.00 30.24 29.47 5hpg n GLN 28 CO 0.00 0.00 0.00 -1.83 -1.44 0.00 0.00 177.06 173.79 5hpg s GLU 29 N -2.31 0.41 0.16 -1.09 4.04 -1.26 -2.99 118.70 115.66 5hpg s GLU 29 Ca 0.25 -0.19 0.17 0.00 0.04 0.00 0.00 54.97 55.24 5hpg s GLU 29 Cb 0.22 0.18 0.77 0.00 0.02 0.00 0.00 34.13 35.31 5hpg s GLU 29 CO 0.02 -0.09 1.52 -0.35 -1.84 0.00 0.00 175.26 174.53 5hpg n PRO 30 N 1.91 0.10 -4.55 -4.83 -0.04 -1.26 -4.83 135.00 121.50 5hpg n PRO 30 Ca -0.20 0.43 -0.33 0.00 -0.04 0.00 0.00 63.50 63.36 5hpg n PRO 30 Cb 0.57 -1.73 -0.16 0.00 -0.04 0.00 0.00 33.50 32.14 5hpg n PRO 30 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 5hpg s HIS 31 N -3.22 2.74 0.30 0.54 3.76 -1.26 -5.00 115.29 113.14 5hpg s HIS 31 Ca 0.03 -1.20 -0.29 0.00 -0.15 0.00 0.00 55.06 53.45 5hpg s HIS 31 Cb 0.07 -1.87 -0.10 0.00 1.11 0.00 0.00 32.58 31.80 5hpg s HIS 31 CO 0.26 -0.55 1.15 1.03 -0.85 0.00 0.00 174.74 175.77 5hpg s ARG 32 N 0.86 4.56 -0.25 1.40 0.52 -1.16 -4.36 118.95 120.52 5hpg s ARG 32 Ca -0.05 1.89 -0.07 0.00 -0.52 0.00 0.00 55.73 56.98 5hpg s ARG 32 Cb -0.15 -3.14 0.12 0.00 0.52 0.00 0.00 34.95 32.29 5hpg s ARG 32 CO -0.02 0.11 0.53 -3.38 0.02 0.00 0.00 175.30 172.56 5hpg s HIS 33 N -1.17 -1.09 -0.27 -0.53 -3.43 -1.26 -5.03 115.29 102.50 5hpg s HIS 33 Ca 0.46 1.83 0.20 0.00 -0.80 0.00 0.00 55.06 56.74 5hpg s HIS 33 Cb -0.33 0.51 0.13 0.00 -1.43 0.00 0.00 32.58 31.45 5hpg s HIS 33 CO 0.43 -0.61 1.34 1.03 -2.00 0.00 0.00 174.74 174.93 5hpg h SER 34 N 8.09 0.00 -1.87 7.38 0.87 -1.99 -3.46 113.55 122.56 5hpg h SER 34 Ca -0.17 0.00 -0.46 0.00 -1.23 0.00 0.00 61.79 59.92 5hpg h SER 34 Cb 1.11 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.06 5hpg h SER 34 CO 0.13 0.22 -0.39 0.27 -0.53 0.00 0.00 176.83 176.53 5hpg s ILE 35 N -3.14 4.05 -1.02 2.23 -4.36 -1.26 -4.73 121.20 112.98 5hpg s ILE 35 Ca 0.03 -1.13 -0.09 0.00 -0.26 0.00 0.00 60.65 59.20 5hpg s ILE 35 Cb 0.07 -3.39 -0.04 0.00 1.25 0.00 0.00 42.46 40.35 5hpg s ILE 35 CO 0.74 -0.19 0.84 0.49 0.24 0.00 0.00 174.94 177.06 5hpg n PHE 36 N -1.51 -2.37 -4.47 1.37 3.72 -1.26 -5.05 117.46 107.88 5hpg n PHE 36 Ca -0.02 0.78 -0.23 0.00 -0.05 0.00 0.00 57.45 57.94 5hpg n PHE 36 Cb 0.58 -3.88 -0.10 0.00 -0.94 0.00 0.00 39.48 35.14 5hpg n PHE 36 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 5hpg s THR 37 N -3.34 1.72 0.60 4.37 -4.23 -1.26 -4.88 115.64 108.62 5hpg s THR 37 Ca 0.38 -2.11 0.30 0.00 -1.18 0.00 0.00 61.69 59.08 5hpg s THR 37 Cb -0.08 -2.57 0.36 0.00 1.34 0.00 0.00 72.50 71.55 5hpg s THR 37 CO 0.78 -0.22 2.14 -0.65 -0.54 0.00 0.00 174.62 176.13 5hpg h PRO 38 N 2.17 0.00 -0.47 3.99 0.11 -1.79 -1.55 132.00 134.45 5hpg h PRO 38 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 5hpg h PRO 38 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 5hpg h PRO 38 CO 0.69 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.87 5hpg n GLU 39 N -3.71 2.27 -0.01 1.05 -0.58 -1.26 -3.09 120.64 115.31 5hpg n GLU 39 Ca 0.00 -1.96 -0.01 0.00 -0.42 0.00 0.00 57.16 54.77 5hpg n GLU 39 Cb 0.26 -1.45 -0.03 0.00 -0.57 0.00 0.00 31.44 29.66 5hpg n GLU 39 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 5hpg n THR 40 N 1.11 0.18 -3.20 2.62 -2.24 -0.64 -4.77 114.28 107.35 5hpg n THR 40 Ca 0.19 -0.14 -0.24 0.00 -2.27 0.00 0.00 64.05 61.60 5hpg n THR 40 Cb 0.48 -0.58 -0.06 0.00 -2.10 0.00 0.00 70.33 68.08 5hpg n THR 40 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 5hpg n ASN 41 N -2.01 1.81 0.23 3.42 3.02 -0.89 -4.93 115.26 115.92 5hpg n ASN 41 Ca -0.05 -3.10 0.16 0.00 -0.03 0.00 0.00 54.58 51.57 5hpg n ASN 41 Cb 0.49 -0.63 0.77 0.00 -0.61 0.00 0.00 39.78 39.80 5hpg n ASN 41 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 5hpg h PRO 42 N 3.61 0.00 -0.67 3.52 0.11 -1.80 -1.90 132.00 134.87 5hpg h PRO 42 Ca 0.12 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.23 5hpg h PRO 42 Cb 0.80 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.91 5hpg h PRO 42 CO 0.61 0.00 0.00 0.54 -0.21 0.00 0.00 178.00 178.94 5hpg n ARG 43 N -2.66 2.68 -0.03 1.05 1.74 -1.26 -4.42 116.66 113.75 5hpg n ARG 43 Ca -0.01 -2.44 0.10 0.00 -0.77 0.00 0.00 57.85 54.73 5hpg n ARG 43 Cb 0.15 -1.56 0.10 0.00 -1.02 0.00 0.00 32.46 30.13 5hpg n ARG 43 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 5hpg n ALA 44 N 1.41 2.45 -3.20 7.54 0.00 -0.72 -4.98 120.51 123.02 5hpg n ALA 44 Ca 0.23 -0.72 -0.18 0.00 0.00 0.00 0.00 53.44 52.76 5hpg n ALA 44 Cb 0.60 -0.69 0.05 0.00 0.00 0.00 0.00 19.45 19.41 5hpg n ALA 44 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 5hpg n GLY 45 N 1.15 -0.23 3.17 0.00 0.00 -1.26 -4.78 105.19 103.24 5hpg n GLY 45 Ca 0.13 0.02 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 5hpg n GLY 45 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 5hpg n LEU 46 N -3.78 5.20 -4.43 0.99 4.32 -1.26 -4.92 117.00 113.12 5hpg n LEU 46 Ca -0.02 -3.68 -0.30 0.00 -0.02 0.00 0.00 56.01 51.99 5hpg n LEU 46 Cb 0.56 -1.58 -0.13 0.00 -1.62 0.00 0.00 43.42 40.65 5hpg n LEU 46 CO 0.46 0.11 -0.51 -0.70 -1.22 0.00 0.00 177.39 175.53 5hpg s GLU 47 N 4.34 1.93 1.43 3.23 -6.30 -1.26 -3.97 118.70 118.09 5hpg s GLU 47 Ca 0.54 -1.06 0.00 0.00 -2.50 0.00 0.00 54.97 51.95 5hpg s GLU 47 Cb 0.09 -2.12 0.00 0.00 0.00 0.00 0.00 34.13 32.11 5hpg s GLU 47 CO 0.03 0.52 0.00 1.63 0.02 0.00 0.00 175.26 177.46 5hpg n LYS 48 N 1.44 0.00 -1.46 4.30 4.01 -1.26 -1.79 118.16 123.40 5hpg n LYS 48 Ca -0.16 0.00 -0.07 0.00 -0.51 0.00 0.00 58.31 57.57 5hpg n LYS 48 Cb 0.52 0.00 0.10 0.00 -0.51 0.00 0.00 35.03 35.14 5hpg n LYS 48 CO 0.00 0.00 0.00 0.27 -1.11 0.00 0.00 177.40 176.56 5hpg n ASN 49 N 1.40 2.94 -4.76 4.39 6.94 -1.26 -1.59 115.26 123.33 5hpg n ASN 49 Ca 0.00 -3.51 -0.40 0.00 -0.02 0.00 0.00 54.58 50.65 5hpg n ASN 49 Cb 0.00 -0.43 -0.04 0.00 -2.36 0.00 0.00 39.78 36.95 5hpg n ASN 49 CO 0.00 0.00 0.00 -0.31 -1.03 0.00 0.00 177.26 175.92 5hpg s TYR 50 N -3.14 3.63 0.16 -2.53 2.02 -0.74 -4.50 117.35 112.25 5hpg s TYR 50 Ca 0.42 1.73 -0.32 0.00 -0.37 0.00 0.00 57.07 58.53 5hpg s TYR 50 Cb 0.38 -3.25 -0.10 0.00 -0.40 0.00 0.00 41.96 38.59 5hpg s TYR 50 CO -0.03 -0.43 1.61 0.00 -1.57 0.00 0.00 175.55 175.13 5hpg s ARG 52 N 1.36 0.79 -0.56 0.00 1.81 -0.50 -4.78 118.95 117.07 5hpg s ARG 52 Ca 0.72 -1.31 0.07 0.00 -1.72 0.00 0.00 55.73 53.48 5hpg s ARG 52 Cb -0.44 0.24 0.26 0.00 -0.45 0.00 0.00 34.95 34.55 5hpg s ARG 52 CO 0.32 -0.20 0.70 -1.71 -0.68 0.00 0.00 175.30 173.72 5hpg n ASN 53 N -0.01 2.77 -0.01 0.23 5.15 -1.26 -0.85 115.26 121.28 5hpg n ASN 53 Ca -0.10 -3.24 0.05 0.00 -0.60 0.00 0.00 54.58 50.69 5hpg n ASN 53 Cb 0.62 -0.66 0.44 0.00 -0.53 0.00 0.00 39.78 39.66 5hpg n ASN 53 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 5hpg h PRO 54 N 4.04 0.51 -0.10 1.20 0.13 -1.88 -2.08 132.00 133.83 5hpg h PRO 54 Ca 0.16 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 5hpg h PRO 54 Cb 0.72 -0.12 0.00 0.00 0.13 0.00 0.00 31.00 31.73 5hpg h PRO 54 CO 0.73 0.34 0.00 -0.25 -0.23 0.00 0.00 178.00 178.59 5hpg n ASP 55 N -4.48 2.94 -3.34 1.44 9.92 -1.26 -4.99 116.55 116.79 5hpg n ASP 55 Ca 0.04 -1.92 -0.17 0.00 -0.53 0.00 0.00 54.79 52.20 5hpg n ASP 55 Cb 0.10 -0.05 0.07 0.00 -0.64 0.00 0.00 41.12 40.60 5hpg n ASP 55 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 5hpg n GLY 56 N 1.27 -0.97 3.76 0.44 0.00 -0.78 -4.96 105.19 103.94 5hpg n GLY 56 Ca 0.14 0.47 -0.39 0.00 0.00 0.00 0.00 46.02 46.24 5hpg n GLY 56 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 5hpg s ASP 57 N -3.61 7.44 0.43 1.61 -4.77 -1.26 -4.93 116.67 111.57 5hpg s ASP 57 Ca 0.36 2.03 0.26 0.00 -3.30 0.00 0.00 52.55 51.90 5hpg s ASP 57 Cb -0.06 -2.61 1.30 0.00 -1.09 0.00 0.00 42.92 40.47 5hpg s ASP 57 CO 0.75 -0.00 1.70 1.62 0.70 0.00 0.00 175.17 179.94 5hpg h VAL 58 N 2.99 0.32 0.00 2.11 3.04 -1.93 -1.61 116.25 121.17 5hpg h VAL 58 Ca -0.46 -0.07 0.00 0.00 -1.01 0.00 0.00 66.70 65.16 5hpg h VAL 58 Cb 1.20 0.09 0.00 0.00 -2.01 0.00 0.00 31.29 30.58 5hpg h VAL 58 CO 0.67 0.04 0.00 0.61 -1.01 0.00 0.00 177.57 177.88 5hpg n GLY 59 N -1.53 -1.06 6.63 3.17 0.00 -1.26 -5.00 105.19 106.13 5hpg n GLY 59 Ca 0.31 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.17 5hpg n GLY 59 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 5hpg n GLY 60 N 0.96 -2.03 3.55 -0.02 0.00 -0.61 -4.93 105.19 102.10 5hpg n GLY 60 Ca 0.18 -1.40 -0.41 0.00 0.00 0.00 0.00 46.02 44.39 5hpg n GLY 60 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 5hpg n PRO 61 N -0.21 0.95 -3.60 1.61 -0.02 -1.26 -4.74 135.00 127.72 5hpg n PRO 61 Ca 0.00 0.35 -0.12 0.00 -2.02 0.00 0.00 63.50 61.71 5hpg n PRO 61 Cb 0.00 -1.85 -0.01 0.00 -0.02 0.00 0.00 33.50 31.62 5hpg n PRO 61 CO 0.00 0.00 0.00 -2.67 1.98 0.00 0.00 175.50 174.81 5hpg n TRP 62 N -0.91 -1.53 -3.49 6.00 4.27 -0.03 -1.43 117.44 120.33 5hpg n TRP 62 Ca 0.11 -1.95 -0.11 0.00 -3.89 0.00 0.00 57.50 51.66 5hpg n TRP 62 Cb 0.41 0.56 -0.02 0.00 -1.36 0.00 0.00 31.31 30.90 5hpg n TRP 62 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 5hpg s TYR 64 N -3.71 2.29 0.21 0.00 2.02 -1.26 -1.39 117.35 115.51 5hpg s TYR 64 Ca 0.03 1.57 0.09 0.00 -0.37 0.00 0.00 57.07 58.39 5hpg s TYR 64 Cb -0.02 -3.38 -0.04 0.00 -0.40 0.00 0.00 41.96 38.12 5hpg s TYR 64 CO -0.10 -2.25 -0.06 0.95 -1.57 0.00 0.00 175.55 172.52 5hpg s THR 65 N -2.01 3.30 -1.24 -0.71 -4.23 -0.24 -0.51 115.64 110.00 5hpg s THR 65 Ca 0.73 -1.73 0.25 0.00 -1.18 0.00 0.00 61.69 59.76 5hpg s THR 65 Cb -0.27 -2.68 0.34 0.00 1.34 0.00 0.00 72.50 71.23 5hpg s THR 65 CO 0.42 -0.20 1.83 0.35 -0.54 0.00 0.00 174.62 176.48 5hpg n THR 66 N -0.28 0.23 -2.42 3.99 -2.24 -0.62 -4.52 114.28 108.44 5hpg n THR 66 Ca -0.09 0.06 -0.43 0.00 -2.27 0.00 0.00 64.05 61.32 5hpg n THR 66 Cb 0.57 -0.64 -0.02 0.00 -2.10 0.00 0.00 70.33 68.14 5hpg n THR 66 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 5hpg s ASN 67 N -2.76 6.59 0.61 3.42 3.84 -1.26 -4.85 114.94 120.53 5hpg s ASN 67 Ca 0.19 1.08 0.41 0.00 0.21 0.00 0.00 52.86 54.75 5hpg s ASN 67 Cb 0.17 -2.54 2.20 0.00 -0.55 0.00 0.00 41.25 40.52 5hpg s ASN 67 CO 0.42 -1.17 2.25 1.55 -2.79 0.00 0.00 177.10 177.36 5hpg h PRO 68 N 9.61 0.00 -0.13 0.43 0.13 -1.95 -0.84 132.00 139.26 5hpg h PRO 68 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 5hpg h PRO 68 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 5hpg h PRO 68 CO 1.05 0.00 0.00 0.54 -0.23 0.00 0.00 178.00 179.36 5hpg n ARG 69 N -2.96 2.29 -4.01 0.86 5.12 -1.26 -4.82 116.66 111.87 5hpg n ARG 69 Ca -0.03 -1.99 -0.31 0.00 -1.93 0.00 0.00 57.85 53.60 5hpg n ARG 69 Cb 0.08 -1.46 -0.16 0.00 -1.16 0.00 0.00 32.46 29.76 5hpg n ARG 69 CO 0.00 0.00 0.00 0.21 -1.93 0.00 0.00 177.63 175.91 5hpg s LYS 70 N -1.80 2.13 0.10 5.56 2.20 -0.32 -5.03 119.74 122.58 5hpg s LYS 70 Ca 0.30 -0.83 -0.23 0.00 -0.36 0.00 0.00 55.97 54.85 5hpg s LYS 70 Cb 0.20 -2.40 -0.12 0.00 -1.51 0.00 0.00 37.83 33.99 5hpg s LYS 70 CO 0.29 -0.40 1.72 1.25 -0.36 0.00 0.00 175.35 177.86 5hpg h LEU 71 N 7.97 -0.10 -8.08 5.43 5.85 -1.88 -3.34 115.31 121.16 5hpg h LEU 71 Ca -0.30 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.42 5hpg h LEU 71 Cb 1.10 0.05 -0.08 0.00 0.37 0.00 0.00 40.66 42.10 5hpg h LEU 71 CO 0.49 -0.06 0.00 -0.72 -0.34 0.00 0.00 178.44 177.82 5hpg s TYR 72 N -6.18 0.13 0.09 1.25 -0.85 -1.26 -1.07 117.35 109.45 5hpg s TYR 72 Ca -0.13 -0.51 -0.26 0.00 -0.52 0.00 0.00 57.07 55.65 5hpg s TYR 72 Cb 0.07 0.37 0.08 0.00 0.38 0.00 0.00 41.96 42.86 5hpg s TYR 72 CO 0.66 -1.05 0.80 0.34 -1.52 0.00 0.00 175.55 174.78 5hpg s ASP 73 N -2.97 -0.39 0.62 -0.18 -1.08 -0.48 -4.83 116.67 107.36 5hpg s ASP 73 Ca 0.17 -0.12 -0.14 0.00 -0.52 0.00 0.00 52.55 51.95 5hpg s ASP 73 Cb -0.02 0.50 -0.02 0.00 -1.46 0.00 0.00 42.92 41.91 5hpg s ASP 73 CO 0.06 -0.83 1.05 -0.31 0.52 0.00 0.00 175.17 175.66 5hpg s TYR 74 N -3.41 3.14 0.38 -5.34 2.02 -1.26 -1.28 117.35 111.60 5hpg s TYR 74 Ca 0.05 1.46 0.08 0.00 -0.37 0.00 0.00 57.07 58.29 5hpg s TYR 74 Cb -0.01 -2.91 -0.03 0.00 -0.40 0.00 0.00 41.96 38.61 5hpg s TYR 74 CO -0.07 -1.04 0.32 0.00 -1.57 0.00 0.00 175.55 173.19 5hpg s ASP 76 N -4.05 5.83 -0.25 0.00 -1.08 -1.26 -4.71 116.67 111.16 5hpg s ASP 76 Ca 0.44 -2.58 -0.04 0.00 -0.52 0.00 0.00 52.55 49.86 5hpg s ASP 76 Cb -0.04 -2.00 0.01 0.00 -1.46 0.00 0.00 42.92 39.42 5hpg s ASP 76 CO 0.27 -0.51 -0.01 0.68 0.52 0.00 0.00 175.17 176.12 5hpg s VAL 77 N 0.35 3.45 0.46 1.11 -7.23 -1.26 -5.07 120.40 112.22 5hpg s VAL 77 Ca 0.14 -0.69 -0.23 0.00 -1.81 0.00 0.00 61.98 59.40 5hpg s VAL 77 Cb -0.19 -2.69 -0.07 0.00 0.56 0.00 0.00 36.38 33.99 5hpg s VAL 77 CO -0.04 0.25 1.15 -2.16 -0.31 0.00 0.00 175.10 173.99 5hpg s PRO 78 N 1.45 3.74 0.44 4.82 0.04 -1.26 -4.68 135.00 139.55 5hpg s PRO 78 Ca 0.03 1.73 -0.25 0.00 0.04 0.00 0.00 61.00 62.55 5hpg s PRO 78 Cb -0.16 -2.37 -0.08 0.00 0.04 0.00 0.00 34.50 31.93 5hpg s PRO 78 CO -0.02 -0.55 1.36 -0.65 0.04 0.00 0.00 177.00 177.18 5hpg s GLN 79 N -2.75 3.73 0.56 4.56 -1.52 -1.26 -0.14 119.66 122.84 5hpg s GLN 79 Ca 0.64 2.27 -0.19 0.00 -1.95 0.00 0.00 55.36 56.13 5hpg s GLN 79 Cb -0.27 -2.64 -0.05 0.00 -0.22 0.00 0.00 33.01 29.83 5hpg s GLN 79 CO 0.33 -0.73 1.19 0.00 -0.25 0.00 0.00 175.29 175.83 5hpg n ALA 81 N -1.38 -0.67 -1.73 0.00 0.00 -1.26 -4.85 120.51 110.62 5hpg n ALA 81 Ca 0.12 0.46 -0.42 0.00 0.00 0.00 0.00 53.44 53.60 5hpg n ALA 81 Cb 0.50 -2.04 -0.02 0.00 0.00 0.00 0.00 19.45 17.89 5hpg n ALA 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 5hpg n ALA 82 N 1.46 2.30 1.34 0.00 0.00 -1.26 -5.19 120.51 119.15 5hpg n ALA 82 Ca 0.15 0.38 0.11 0.00 0.00 0.00 0.00 53.44 54.07 5hpg n ALA 82 Cb 0.25 -2.43 0.63 0.00 0.00 0.00 0.00 19.45 17.91 5hpg n ALA 82 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15