#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hpj n LYS 2 N 0.00 3.81 -0.57 0.00 -0.00 -1.26 -4.52 118.16 115.62 1hpj n LYS 2 Ca 0.00 -2.46 -0.04 0.00 -0.00 0.00 0.00 58.31 55.81 1hpj n LYS 2 Cb 0.00 -2.80 -0.05 0.00 -0.00 0.00 0.00 35.03 32.18 1hpj n LYS 2 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 1hpj n THR 3 N 3.34 1.98 0.00 0.58 -2.24 -1.26 -4.59 114.28 112.09 1hpj n THR 3 Ca 0.74 -0.73 0.00 0.00 -2.27 0.00 0.00 64.05 61.79 1hpj n THR 3 Cb 0.24 -1.60 0.00 0.00 -2.10 0.00 0.00 70.33 66.87 1hpj n THR 3 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1hpj n GLY 4 N 1.96 0.42 0.00 3.38 0.00 -1.26 -4.93 105.19 104.76 1hpj n GLY 4 Ca 0.13 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1hpj n GLY 4 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1hpj n ASN 5 N 0.00 0.00 0.00 1.61 2.85 -1.26 -4.90 115.26 113.56 1hpj n ASN 5 Ca 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 1hpj n ASN 5 Cb 0.00 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.02 1hpj n ASN 5 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1hpj n GLY 6 N 0.00 -0.39 2.68 8.20 0.00 -1.26 -4.85 105.19 109.57 1hpj n GLY 6 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.97 1hpj n GLY 6 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1hpj n LYS 7 N -1.76 0.25 -3.34 1.61 4.81 -1.26 -4.98 118.16 113.49 1hpj n LYS 7 Ca 0.00 -0.88 -0.13 0.00 -0.87 0.00 0.00 58.31 56.42 1hpj n LYS 7 Cb 0.00 -0.44 -0.07 0.00 0.02 0.00 0.00 35.03 34.54 1hpj n LYS 7 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 1hpj s ASN 8 N -0.51 0.87 0.06 3.14 2.20 -1.26 -5.14 114.94 114.29 1hpj s ASN 8 Ca 0.27 -0.98 -0.28 0.00 -0.94 0.00 0.00 52.86 50.93 1hpj s ASN 8 Cb 0.22 0.81 0.10 0.00 -2.00 0.00 0.00 41.25 40.37 1hpj s ASN 8 CO -0.12 -0.31 1.15 -0.72 -2.94 0.00 0.00 177.10 174.16 1hpj s TYR 9 N 2.01 -0.07 0.04 1.54 -0.85 -1.26 -3.10 117.35 115.66 1hpj s TYR 9 Ca 0.13 -0.12 0.00 0.00 -0.52 0.00 0.00 57.07 56.56 1hpj s TYR 9 Cb -0.13 0.59 0.00 0.00 0.38 0.00 0.00 41.96 42.79 1hpj s TYR 9 CO -0.19 -0.51 0.00 0.54 -1.52 0.00 0.00 175.55 173.88 1hpj n ARG 10 N -0.50 0.00 0.12 -3.49 1.74 -1.26 -4.73 116.66 108.54 1hpj n ARG 10 Ca -0.07 0.00 0.02 0.00 -0.77 0.00 0.00 57.85 57.03 1hpj n ARG 10 Cb 0.62 -0.18 0.10 0.00 -1.02 0.00 0.00 32.46 31.98 1hpj n ARG 10 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1hpj n GLY 11 N 3.38 -0.31 0.15 -0.13 0.00 -1.26 -1.09 105.19 105.94 1hpj n GLY 11 Ca 0.00 0.03 0.10 0.00 0.00 0.00 0.00 46.02 46.15 1hpj n GLY 11 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1hpj n THR 12 N -1.65 1.05 -0.15 2.61 5.66 -1.26 -3.33 114.28 117.21 1hpj n THR 12 Ca -0.00 0.72 0.01 0.00 -3.05 0.00 0.00 64.05 61.73 1hpj n THR 12 Cb 0.52 -1.72 0.03 0.00 -1.55 0.00 0.00 70.33 67.61 1hpj n THR 12 CO 0.00 0.00 0.00 0.23 -3.05 0.00 0.00 175.07 172.25 1hpj n MET 13 N -2.18 -0.07 0.00 1.09 2.81 -0.25 -4.33 117.12 114.19 1hpj n MET 13 Ca -0.01 0.60 0.00 0.00 -1.81 0.00 0.00 57.70 56.48 1hpj n MET 13 Cb 0.07 -0.90 0.00 0.00 -0.71 0.00 0.00 33.22 31.68 1hpj n MET 13 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 1hpj n SER 14 N -4.60 0.00 -4.78 7.83 3.41 -1.21 -4.86 113.62 109.41 1hpj n SER 14 Ca 0.05 0.00 -0.34 0.00 -0.26 0.00 0.00 58.87 58.32 1hpj n SER 14 Cb 0.17 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.05 1hpj n SER 14 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1hpj s LYS 15 N 0.00 2.22 -0.03 4.33 1.02 -1.24 -0.24 119.74 125.80 1hpj s LYS 15 Ca 0.00 -2.44 0.04 0.00 0.02 0.00 0.00 55.97 53.59 1hpj s LYS 15 Cb 0.00 -1.52 -0.00 0.00 -0.52 0.00 0.00 37.83 35.79 1hpj s LYS 15 CO 0.00 -0.40 -0.15 0.95 -0.92 0.00 0.00 175.35 174.83 1hpj s THR 16 N -2.90 1.28 0.00 2.17 -4.23 0.20 -3.28 115.64 108.88 1hpj s THR 16 Ca 0.02 -0.65 0.00 0.00 -1.18 0.00 0.00 61.69 59.89 1hpj s THR 16 Cb 0.01 -1.10 0.00 0.00 1.34 0.00 0.00 72.50 72.75 1hpj s THR 16 CO 0.01 0.37 0.00 1.17 -0.54 0.00 0.00 174.62 175.63 1hpj n LYS 17 N 3.07 -0.25 0.00 3.99 4.81 0.89 -1.40 118.16 129.26 1hpj n LYS 17 Ca -0.17 -0.13 0.00 0.00 -0.87 0.00 0.00 58.31 57.14 1hpj n LYS 17 Cb 0.53 0.23 0.00 0.00 0.02 0.00 0.00 35.03 35.81 1hpj n LYS 17 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1hpj n ASN 18 N 0.30 0.00 0.00 3.14 3.02 -1.26 -4.83 115.26 115.63 1hpj n ASN 18 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1hpj n ASN 18 Cb 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 1hpj n ASN 18 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1hpj n GLY 19 N 0.00 0.00 3.65 7.41 0.00 -0.49 -4.51 105.19 111.25 1hpj n GLY 19 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1hpj n GLY 19 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1hpj s ILE 20 N 0.00 3.64 -0.19 -0.61 1.01 -1.08 -4.56 121.20 119.40 1hpj s ILE 20 Ca 0.00 0.76 -0.38 0.00 0.00 0.00 0.00 60.65 61.03 1hpj s ILE 20 Cb 0.00 -3.52 -0.14 0.00 0.01 0.00 0.00 42.46 38.81 1hpj s ILE 20 CO 0.00 -0.10 1.80 0.41 0.00 0.00 0.00 174.94 177.05 1hpj n THR 21 N 5.65 0.42 0.00 2.92 -1.04 -1.26 -0.63 114.28 120.33 1hpj n THR 21 Ca 0.17 -0.07 0.00 0.00 -2.04 0.00 0.00 64.05 62.11 1hpj n THR 21 Cb 0.43 -1.50 0.00 0.00 -1.82 0.00 0.00 70.33 67.45 1hpj n THR 21 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1hpj n GLN 23 N 0.00 0.00 -3.57 0.00 10.64 -1.23 -1.33 117.38 121.89 1hpj n GLN 23 Ca 0.00 0.00 -0.00 0.00 -1.83 0.00 0.00 57.00 55.17 1hpj n GLN 23 Cb 0.00 0.00 -0.06 0.00 -0.86 0.00 0.00 30.24 29.32 1hpj n GLN 23 CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.06 175.44 1hpj s LYS 24 N 2.52 0.28 -0.54 2.61 2.20 -1.25 -3.86 119.74 121.70 1hpj s LYS 24 Ca 0.00 0.53 -0.20 0.00 -0.36 0.00 0.00 55.97 55.94 1hpj s LYS 24 Cb 0.00 0.14 -0.20 0.00 -1.51 0.00 0.00 37.83 36.26 1hpj s LYS 24 CO 0.00 -0.07 1.64 0.91 -0.36 0.00 0.00 175.35 177.47 1hpj n TRP 25 N 3.91 0.44 0.41 4.03 5.03 0.44 -4.23 117.44 127.48 1hpj n TRP 25 Ca -0.16 -0.19 0.05 0.00 3.03 0.00 0.00 57.50 60.23 1hpj n TRP 25 Cb 0.56 -1.59 0.01 0.00 -1.03 0.00 0.00 31.31 29.25 1hpj n TRP 25 CO 0.00 0.00 0.00 0.43 -0.03 0.00 0.00 177.69 178.09 1hpj n SER 26 N 13.14 1.27 -0.67 -0.99 7.64 -1.26 -4.95 113.62 127.80 1hpj n SER 26 Ca 0.31 -1.14 0.03 0.00 1.01 0.00 0.00 58.87 59.08 1hpj n SER 26 Cb 0.45 0.39 -0.01 0.00 -1.01 0.00 0.00 64.21 64.03 1hpj n SER 26 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1hpj n SER 27 N -0.13 -4.02 -4.44 6.43 7.64 -1.02 -4.66 113.62 113.42 1hpj n SER 27 Ca 0.04 0.23 -0.53 0.00 1.01 0.00 0.00 58.87 59.62 1hpj n SER 27 Cb 0.20 -0.63 -0.08 0.00 -1.01 0.00 0.00 64.21 62.69 1hpj n SER 27 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1hpj n THR 28 N -1.63 0.17 0.00 0.44 -1.04 0.67 -4.26 114.28 108.63 1hpj n THR 28 Ca 0.00 -0.19 0.00 0.00 -2.04 0.00 0.00 64.05 61.82 1hpj n THR 28 Cb 0.10 -1.40 0.00 0.00 -1.82 0.00 0.00 70.33 67.20 1hpj n THR 28 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1hpj n SER 29 N 8.94 0.00 -0.65 8.00 3.41 -1.26 -4.59 113.62 127.47 1hpj n SER 29 Ca 0.42 0.00 0.08 0.00 -0.26 0.00 0.00 58.87 59.11 1hpj n SER 29 Cb 0.17 0.00 0.25 0.00 -0.26 0.00 0.00 64.21 64.37 1hpj n SER 29 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 1hpj n PRO 30 N 0.00 1.83 -3.94 4.33 -0.04 -1.26 -5.03 135.00 130.89 1hpj n PRO 30 Ca 0.00 -1.28 -0.11 0.00 -0.04 0.00 0.00 63.50 62.08 1hpj n PRO 30 Cb 0.00 -1.34 -0.01 0.00 -0.04 0.00 0.00 33.50 32.11 1hpj n PRO 30 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 1hpj s HIS 31 N -1.61 0.46 0.00 0.54 5.65 -1.26 -4.93 115.29 114.13 1hpj s HIS 31 Ca 0.28 -0.91 0.00 0.00 0.25 0.00 0.00 55.06 54.68 1hpj s HIS 31 Cb 0.15 0.41 0.00 0.00 -1.18 0.00 0.00 32.58 31.96 1hpj s HIS 31 CO 0.21 -1.30 0.00 -2.13 -0.65 0.00 0.00 174.74 170.87 1hpj n ARG 32 N -0.51 0.00 -1.48 2.88 0.63 -1.26 -3.51 116.66 113.41 1hpj n ARG 32 Ca -0.04 0.00 -0.16 0.00 -0.92 0.00 0.00 57.85 56.73 1hpj n ARG 32 Cb 0.61 0.00 0.10 0.00 0.45 0.00 0.00 32.46 33.62 1hpj n ARG 32 CO 0.00 0.00 0.00 -0.35 -2.51 0.00 0.00 177.63 174.77 1hpj n PRO 33 N -0.60 -0.31 -0.07 -0.14 -0.04 -1.26 0.24 135.00 132.82 1hpj n PRO 33 Ca 0.00 -1.45 -0.12 0.00 -0.04 0.00 0.00 63.50 61.89 1hpj n PRO 33 Cb 0.00 -0.62 -0.15 0.00 -0.04 0.00 0.00 33.50 32.70 1hpj n PRO 33 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 1hpj n ARG 34 N -2.42 0.67 0.00 0.54 0.00 -1.26 -2.43 116.66 111.76 1hpj n ARG 34 Ca 0.10 0.13 0.00 0.00 -0.00 0.00 0.00 57.85 58.08 1hpj n ARG 34 Cb 0.35 -1.62 0.00 0.00 -0.00 0.00 0.00 32.46 31.19 1hpj n ARG 34 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 1hpj n PHE 35 N -2.98 -0.04 -3.72 2.89 7.35 -1.26 -4.88 117.46 114.81 1hpj n PHE 35 Ca -0.30 0.00 -0.25 0.00 -0.76 0.00 0.00 57.45 56.15 1hpj n PHE 35 Cb 1.09 0.07 0.05 0.00 0.35 0.00 0.00 39.48 41.05 1hpj n PHE 35 CO 0.00 0.00 0.00 0.43 -0.76 0.00 0.00 176.76 176.43 1hpj n SER 36 N -1.82 -3.75 -2.46 -2.13 7.64 -1.26 -4.99 113.62 104.84 1hpj n SER 36 Ca 0.00 -0.72 -0.05 0.00 1.01 0.00 0.00 58.87 59.11 1hpj n SER 36 Cb 0.00 -4.34 0.04 0.00 -1.01 0.00 0.00 64.21 58.89 1hpj n SER 36 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1hpj n PRO 37 N -4.57 -0.68 0.00 1.43 -0.04 -1.26 -5.01 135.00 124.86 1hpj n PRO 37 Ca -0.11 -0.31 0.02 0.00 -0.04 0.00 0.00 63.50 63.06 1hpj n PRO 37 Cb 0.60 -0.24 0.01 0.00 -0.04 0.00 0.00 33.50 33.83 1hpj n PRO 37 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1hpj n ALA 38 N -3.21 2.49 -1.94 0.55 0.00 -1.26 -4.64 120.51 112.49 1hpj n ALA 38 Ca -0.03 -0.49 -0.28 0.00 0.00 0.00 0.00 53.44 52.64 1hpj n ALA 38 Cb 0.09 -0.12 0.03 0.00 0.00 0.00 0.00 19.45 19.46 1hpj n ALA 38 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1hpj n THR 39 N 0.08 2.79 -4.36 0.00 5.66 -1.26 -5.02 114.28 112.18 1hpj n THR 39 Ca 0.02 -4.07 -0.25 0.00 -3.05 0.00 0.00 64.05 56.70 1hpj n THR 39 Cb 0.08 -1.17 -0.12 0.00 -1.55 0.00 0.00 70.33 67.58 1hpj n THR 39 CO 0.00 0.00 0.00 -1.00 -3.05 0.00 0.00 175.07 171.02 1hpj s HIS 40 N -3.66 2.03 0.22 1.09 4.02 -1.26 -5.04 115.29 112.68 1hpj s HIS 40 Ca 0.53 -0.41 -0.09 0.00 1.02 0.00 0.00 55.06 56.11 1hpj s HIS 40 Cb 0.43 -1.04 0.22 0.00 -1.02 0.00 0.00 32.58 31.17 1hpj s HIS 40 CO -0.03 0.36 1.85 -1.35 1.02 0.00 0.00 174.74 176.59 1hpj h PRO 41 N 3.49 0.87 0.00 8.40 0.11 -1.88 -3.46 132.00 139.53 1hpj h PRO 41 Ca -0.45 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1hpj h PRO 41 Cb 1.20 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 32.11 1hpj h PRO 41 CO 0.46 0.58 0.00 0.45 -0.21 0.00 0.00 178.00 179.28 1hpj n SER 42 N -4.65 0.21 -0.95 -2.05 2.88 -1.26 -5.06 113.62 102.74 1hpj n SER 42 Ca 0.09 -0.96 -0.04 0.00 -1.33 0.00 0.00 58.87 56.63 1hpj n SER 42 Cb 0.10 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.53 1hpj n SER 42 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 1hpj n GLU 43 N 0.00 0.09 0.00 -1.46 -0.00 -1.26 -4.67 120.64 113.34 1hpj n GLU 43 Ca 0.00 -0.61 0.03 0.00 -0.00 0.00 0.00 57.16 56.59 1hpj n GLU 43 Cb 0.00 0.47 0.21 0.00 -0.00 0.00 0.00 31.44 32.12 1hpj n GLU 43 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1hpj n GLY 44 N -0.10 -0.60 3.63 -1.84 0.00 -1.26 -4.82 105.19 100.19 1hpj n GLY 44 Ca -0.16 -0.04 -0.54 0.00 0.00 0.00 0.00 46.02 45.28 1hpj n GLY 44 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1hpj n LEU 45 N -0.68 2.48 -4.41 0.99 4.77 -1.26 -4.95 117.00 113.95 1hpj n LEU 45 Ca 0.05 0.87 -0.24 0.00 -0.03 0.00 0.00 56.01 56.67 1hpj n LEU 45 Cb 0.02 -1.21 -0.11 0.00 -2.33 0.00 0.00 43.42 39.80 1hpj n LEU 45 CO 0.04 -0.44 -0.49 -1.83 -1.33 0.00 0.00 177.39 173.34 1hpj s GLU 46 N 4.43 1.49 0.00 3.23 -1.05 -1.26 -4.97 118.70 120.57 1hpj s GLU 46 Ca 1.01 -1.59 0.00 0.00 -0.15 0.00 0.00 54.97 54.24 1hpj s GLU 46 Cb -0.96 -1.60 0.00 0.00 -0.44 0.00 0.00 34.13 31.13 1hpj s GLU 46 CO 0.59 0.32 0.00 0.39 0.95 0.00 0.00 175.26 177.51 1hpj n GLU 47 N -0.12 0.00 -3.37 -4.83 1.02 -1.26 0.30 120.64 112.38 1hpj n GLU 47 Ca -0.09 0.00 -0.27 0.00 -0.02 0.00 0.00 57.16 56.78 1hpj n GLU 47 Cb 0.58 0.00 -0.08 0.00 -0.02 0.00 0.00 31.44 31.93 1hpj n GLU 47 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 1hpj n ASN 48 N 0.00 3.74 -4.99 1.62 2.04 -1.25 0.17 115.26 116.58 1hpj n ASN 48 Ca 0.00 -3.45 -0.19 0.00 -0.44 0.00 0.00 54.58 50.50 1hpj n ASN 48 Cb 0.00 -0.66 0.03 0.00 -2.53 0.00 0.00 39.78 36.62 1hpj n ASN 48 CO 0.00 0.00 0.00 -0.31 -0.44 0.00 0.00 177.26 176.51 1hpj s TYR 49 N -2.54 2.33 -0.19 -2.53 1.51 0.15 -4.00 117.35 112.07 1hpj s TYR 49 Ca 0.41 -0.44 -0.02 0.00 -1.01 0.00 0.00 57.07 56.00 1hpj s TYR 49 Cb 0.16 -2.41 0.06 0.00 -0.11 0.00 0.00 41.96 39.66 1hpj s TYR 49 CO -0.02 -0.77 0.02 0.00 -1.11 0.00 0.00 175.55 173.67 1hpj n ARG 51 N 5.02 0.00 -0.73 0.00 3.00 -0.98 -4.75 116.66 118.22 1hpj n ARG 51 Ca -0.09 0.00 0.04 0.00 -0.00 0.00 0.00 57.85 57.80 1hpj n ARG 51 Cb 0.47 0.00 0.07 0.00 0.00 0.00 0.00 32.46 33.00 1hpj n ARG 51 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 1hpj n ASN 52 N 0.00 1.09 0.32 6.15 4.05 -1.26 -1.99 115.26 123.62 1hpj n ASN 52 Ca 0.00 -2.58 0.20 0.00 0.45 0.00 0.00 54.58 52.66 1hpj n ASN 52 Cb 0.00 -0.34 1.11 0.00 1.23 0.00 0.00 39.78 41.79 1hpj n ASN 52 CO 0.00 0.00 0.00 -0.65 -3.05 0.00 0.00 177.26 173.56 1hpj h PRO 53 N 0.49 0.00 0.00 1.20 0.11 -1.97 0.42 132.00 132.26 1hpj h PRO 53 Ca -0.07 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.04 1hpj h PRO 53 Cb 1.40 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.51 1hpj h PRO 53 CO 0.03 0.00 -0.17 -3.47 -0.21 0.00 0.00 178.00 174.18 1hpj n ASP 54 N -3.31 0.27 -1.62 -2.05 2.03 -1.26 -3.90 116.55 106.71 1hpj n ASP 54 Ca -0.03 0.29 -0.00 0.00 0.52 0.00 0.00 54.79 55.57 1hpj n ASP 54 Cb 0.10 -0.30 0.00 0.00 -0.72 0.00 0.00 41.12 40.20 1hpj n ASP 54 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 1hpj n ASN 55 N -1.63 -2.51 -3.56 1.67 5.15 0.15 -5.07 115.26 109.47 1hpj n ASN 55 Ca 0.06 0.03 -0.29 0.00 -0.60 0.00 0.00 54.58 53.78 1hpj n ASN 55 Cb 0.36 -1.37 -0.14 0.00 -0.53 0.00 0.00 39.78 38.09 1hpj n ASN 55 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1hpj s ASP 56 N -1.42 3.47 0.37 1.20 -1.08 -1.26 -4.99 116.67 112.97 1hpj s ASP 56 Ca 0.02 -1.67 0.07 0.00 -0.52 0.00 0.00 52.55 50.44 1hpj s ASP 56 Cb -0.00 -0.49 0.78 0.00 -1.46 0.00 0.00 42.92 41.74 1hpj s ASP 56 CO 0.07 -0.39 1.98 -0.65 0.52 0.00 0.00 175.17 176.69 1hpj h PRO 57 N 7.87 0.68 -1.09 4.34 0.11 -1.98 -2.22 132.00 139.73 1hpj h PRO 57 Ca -0.11 -0.04 0.30 0.00 0.11 0.00 0.00 66.00 66.26 1hpj h PRO 57 Cb 0.99 -0.15 -0.06 0.00 0.11 0.00 0.00 31.00 31.89 1hpj h PRO 57 CO 0.40 0.45 0.75 -0.56 -0.21 0.00 0.00 178.00 178.83 1hpj h GLN 58 N 0.70 0.15 0.00 1.05 -0.00 -2.03 -3.46 115.11 111.53 1hpj h GLN 58 Ca 0.28 -0.01 0.00 0.00 -0.00 0.00 0.00 58.65 58.92 1hpj h GLN 58 Cb 0.22 -0.03 0.00 0.00 -0.00 0.00 0.00 27.48 27.66 1hpj h GLN 58 CO -0.09 0.10 0.00 0.41 -0.00 0.00 0.00 178.83 179.26 1hpj n GLY 59 N -1.64 2.10 3.55 0.06 0.00 -0.83 -5.04 105.19 103.39 1hpj n GLY 59 Ca 0.24 -1.07 -0.35 0.00 0.00 0.00 0.00 46.02 44.84 1hpj n GLY 59 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1hpj s PRO 60 N -2.00 2.66 1.05 1.61 0.04 -1.26 -4.71 135.00 132.40 1hpj s PRO 60 Ca 0.00 0.26 -0.13 0.00 0.04 0.00 0.00 61.00 61.17 1hpj s PRO 60 Cb 0.00 -4.60 0.22 0.00 0.04 0.00 0.00 34.50 30.16 1hpj s PRO 60 CO 0.00 -2.87 1.09 1.67 0.04 0.00 0.00 177.00 176.92 1hpj s TRP 61 N 9.08 1.81 -0.30 0.56 1.48 -0.84 -1.29 118.94 129.44 1hpj s TRP 61 Ca 0.66 0.93 -0.19 0.00 -1.06 0.00 0.00 56.10 56.43 1hpj s TRP 61 Cb -0.10 -3.27 0.19 0.00 -1.16 0.00 0.00 33.47 29.13 1hpj s TRP 61 CO 0.13 -3.18 1.28 0.00 -4.06 0.00 0.00 176.95 171.12 1hpj s TYR 63 N 0.70 1.48 0.15 0.00 1.51 -1.26 -1.89 117.35 118.04 1hpj s TYR 63 Ca -0.03 -0.12 -0.01 0.00 -1.01 0.00 0.00 57.07 55.90 1hpj s TYR 63 Cb -0.03 -3.36 -0.04 0.00 -0.11 0.00 0.00 41.96 38.41 1hpj s TYR 63 CO -0.12 -2.07 0.07 0.95 -1.11 0.00 0.00 175.55 173.27 1hpj s THR 64 N -3.40 0.14 -1.94 -0.71 -4.23 0.18 -3.47 115.64 102.21 1hpj s THR 64 Ca 0.69 -1.94 0.00 0.00 -1.18 0.00 0.00 61.69 59.27 1hpj s THR 64 Cb -0.04 -2.16 0.00 0.00 1.34 0.00 0.00 72.50 71.63 1hpj s THR 64 CO 0.47 -0.36 0.37 0.35 -0.54 0.00 0.00 174.62 174.92 1hpj n THR 65 N -0.15 0.00 -3.87 3.99 -2.24 -0.45 -4.58 114.28 106.98 1hpj n THR 65 Ca -0.04 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.61 1hpj n THR 65 Cb 0.64 -0.88 -0.14 0.00 -2.10 0.00 0.00 70.33 67.85 1hpj n THR 65 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1hpj s ASP 66 N -1.97 0.06 0.17 3.42 1.01 -1.26 -4.46 116.67 113.65 1hpj s ASP 66 Ca 0.00 0.00 -0.14 0.00 0.71 0.00 0.00 52.55 53.12 1hpj s ASP 66 Cb 0.00 -0.02 0.10 0.00 1.01 0.00 0.00 42.92 44.01 1hpj s ASP 66 CO 0.00 -0.02 1.77 -0.65 0.21 0.00 0.00 175.17 176.47 1hpj h PRO 67 N 6.39 0.38 -0.98 8.23 0.10 -1.92 1.94 132.00 146.14 1hpj h PRO 67 Ca -0.29 -0.02 0.18 0.00 0.10 0.00 0.00 66.00 65.96 1hpj h PRO 67 Cb 1.19 -0.09 -0.09 0.00 0.10 0.00 0.00 31.00 32.11 1hpj h PRO 67 CO 0.50 0.25 0.61 0.93 0.10 0.00 0.00 178.00 180.40 1hpj h GLU 68 N 0.39 0.73 -0.60 1.05 4.39 -1.97 0.20 114.58 118.77 1hpj h GLU 68 Ca 0.20 -0.04 -0.43 0.00 0.34 0.00 0.00 59.36 59.42 1hpj h GLU 68 Cb 0.14 -0.16 -0.31 0.00 -0.10 0.00 0.00 28.75 28.31 1hpj h GLU 68 CO -0.16 0.48 -0.55 0.36 -1.16 0.00 0.00 179.01 177.98 1hpj n LYS 69 N -4.68 3.02 -0.38 2.33 2.85 -0.63 -4.85 118.16 115.82 1hpj n LYS 69 Ca 0.22 -3.86 0.30 0.00 -1.05 0.00 0.00 58.31 53.92 1hpj n LYS 69 Cb 0.55 -2.12 0.57 0.00 -0.65 0.00 0.00 35.03 33.37 1hpj n LYS 69 CO 0.00 0.00 0.00 0.07 -0.05 0.00 0.00 177.40 177.42 1hpj h ARG 70 N 1.85 0.20 0.00 -1.58 0.11 0.63 -3.33 114.38 112.26 1hpj h ARG 70 Ca 0.31 -0.01 0.26 0.00 0.10 0.00 0.00 59.98 60.64 1hpj h ARG 70 Cb 1.39 -0.05 -0.05 0.00 1.11 0.00 0.00 29.97 32.38 1hpj h ARG 70 CO 0.67 0.13 0.72 2.48 0.10 0.00 0.00 179.97 184.07 1hpj n TYR 71 N -4.83 -0.58 0.00 4.08 4.11 -1.26 0.51 117.16 119.19 1hpj n TYR 71 Ca 0.33 -0.75 0.00 0.00 -0.00 0.00 0.00 57.90 57.49 1hpj n TYR 71 Cb 1.18 0.35 0.00 0.00 -0.00 0.00 0.00 39.34 40.87 1hpj n TYR 71 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.86 173.39 1hpj n ASP 72 N -1.02 0.00 -4.56 9.48 -0.08 -0.79 -4.97 116.55 114.60 1hpj n ASP 72 Ca 0.02 0.00 -0.42 0.00 -1.51 0.00 0.00 54.79 52.88 1hpj n ASP 72 Cb 0.51 0.00 -0.06 0.00 2.34 0.00 0.00 41.12 43.90 1hpj n ASP 72 CO 0.00 0.00 0.00 -0.31 0.12 0.00 0.00 177.20 177.01 1hpj s TYR 73 N -2.00 3.12 0.55 -0.67 2.02 -1.26 -0.91 117.35 118.19 1hpj s TYR 73 Ca 0.00 0.27 -0.10 0.00 -0.37 0.00 0.00 57.07 56.87 1hpj s TYR 73 Cb 0.00 -3.24 -0.09 0.00 -0.40 0.00 0.00 41.96 38.23 1hpj s TYR 73 CO 0.00 -0.71 -0.42 0.00 -1.57 0.00 0.00 175.55 172.85 1hpj n ASP 75 N 1.98 4.09 -4.76 0.00 2.03 -1.26 -3.89 116.55 114.74 1hpj n ASP 75 Ca -0.00 -2.09 -0.41 0.00 0.52 0.00 0.00 54.79 52.81 1hpj n ASP 75 Cb 0.32 -0.88 -0.03 0.00 -0.72 0.00 0.00 41.12 39.81 1hpj n ASP 75 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1hpj s ILE 76 N 0.54 3.11 0.32 5.18 1.01 -1.26 -4.01 121.20 126.09 1hpj s ILE 76 Ca 0.03 1.11 -0.29 0.00 0.00 0.00 0.00 60.65 61.50 1hpj s ILE 76 Cb 0.02 -3.70 -0.12 0.00 0.01 0.00 0.00 42.46 38.67 1hpj s ILE 76 CO 0.00 0.26 1.48 0.18 0.00 0.00 0.00 174.94 176.86 1hpj n LEU 77 N 1.07 4.20 0.36 2.97 7.99 -1.26 -4.72 117.00 127.61 1hpj n LEU 77 Ca -0.00 1.18 -0.14 0.00 -0.01 0.00 0.00 56.01 57.04 1hpj n LEU 77 Cb 0.43 -1.56 -0.07 0.00 -0.11 0.00 0.00 43.42 42.11 1hpj n LEU 77 CO 0.57 -0.04 0.50 -0.33 -1.51 0.00 0.00 177.39 176.58 1hpj h GLU 78 N 3.69 -0.89 0.00 3.23 5.08 -1.97 -2.80 114.58 120.92 1hpj h GLU 78 Ca -0.48 0.06 0.00 0.00 -1.00 0.00 0.00 59.36 57.94 1hpj h GLU 78 Cb 1.25 0.20 0.00 0.00 0.50 0.00 0.00 28.75 30.70 1hpj h GLU 78 CO 0.71 -0.59 0.00 0.00 -1.00 0.00 0.00 179.01 178.12