#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hpj s LYS 2 N 0.00 0.35 -0.50 0.00 1.02 -1.25 -2.12 119.74 117.25 1hpj s LYS 2 Ca 0.00 -0.67 -0.27 0.00 0.02 0.00 0.00 55.97 55.05 1hpj s LYS 2 Cb 0.00 0.07 -0.03 0.00 -0.52 0.00 0.00 37.83 37.35 1hpj s LYS 2 CO 0.00 -0.04 1.98 0.95 -0.92 0.00 0.00 175.35 177.32 1hpj s THR 3 N -1.62 3.29 0.00 2.17 -4.23 -1.26 -2.90 115.64 111.09 1hpj s THR 3 Ca -0.14 0.22 0.00 0.00 -1.18 0.00 0.00 61.69 60.59 1hpj s THR 3 Cb -0.09 -3.62 0.00 0.00 1.34 0.00 0.00 72.50 70.13 1hpj s THR 3 CO -0.01 -0.55 0.00 0.61 -0.54 0.00 0.00 174.62 174.13 1hpj n GLY 4 N 5.70 0.62 0.98 3.99 0.00 -1.26 -4.57 105.19 110.65 1hpj n GLY 4 Ca 0.25 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.37 1hpj n GLY 4 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1hpj n ASN 5 N 0.00 2.88 0.00 1.61 3.02 -1.21 -4.07 115.26 117.49 1hpj n ASN 5 Ca 0.00 -1.94 0.00 0.00 -0.03 0.00 0.00 54.58 52.61 1hpj n ASN 5 Cb 0.00 -0.28 0.00 0.00 -0.61 0.00 0.00 39.78 38.89 1hpj n ASN 5 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1hpj n GLY 6 N 1.38 -0.98 2.15 7.41 0.00 -1.14 -4.75 105.19 109.26 1hpj n GLY 6 Ca 0.18 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.14 1hpj n GLY 6 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1hpj n LYS 7 N -0.05 -2.11 -3.66 1.61 5.02 -1.26 -4.52 118.16 113.19 1hpj n LYS 7 Ca 0.00 0.34 -0.07 0.00 -2.02 0.00 0.00 58.31 56.56 1hpj n LYS 7 Cb 0.36 -4.76 -0.09 0.00 -0.02 0.00 0.00 35.03 30.53 1hpj n LYS 7 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 1hpj s ASN 8 N -1.87 -0.46 0.36 4.39 0.02 -1.26 -4.96 114.94 111.16 1hpj s ASN 8 Ca 0.00 1.11 -0.17 0.00 -1.02 0.00 0.00 52.86 52.78 1hpj s ASN 8 Cb 0.00 1.48 0.05 0.00 0.02 0.00 0.00 41.25 42.80 1hpj s ASN 8 CO 0.00 -0.23 0.77 -0.72 0.02 0.00 0.00 177.10 176.94 1hpj s TYR 9 N 2.54 0.05 0.26 2.20 -0.85 -1.26 0.21 117.35 120.50 1hpj s TYR 9 Ca -0.03 -0.67 0.00 0.00 -0.52 0.00 0.00 57.07 55.85 1hpj s TYR 9 Cb -0.11 0.80 0.00 0.00 0.38 0.00 0.00 41.96 43.02 1hpj s TYR 9 CO -0.14 -1.48 0.00 -2.13 -1.52 0.00 0.00 175.55 170.27 1hpj n ARG 10 N -0.51 0.00 -0.12 -3.49 0.63 -1.26 -4.90 116.66 107.00 1hpj n ARG 10 Ca -0.07 0.00 0.27 0.00 -0.92 0.00 0.00 57.85 57.13 1hpj n ARG 10 Cb 0.60 0.00 0.69 0.00 0.45 0.00 0.00 32.46 34.20 1hpj n ARG 10 CO 0.00 0.00 0.00 0.78 -2.51 0.00 0.00 177.63 175.90 1hpj h GLY 11 N 0.00 0.00 0.82 5.14 0.00 -1.64 0.35 103.07 107.74 1hpj h GLY 11 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1hpj h GLY 11 CO 0.00 0.00 0.52 0.00 0.00 0.00 0.00 176.54 177.06 1hpj h THR 12 N 0.00 0.00 -0.85 4.70 1.03 -1.84 -2.25 112.91 113.70 1hpj h THR 12 Ca 0.39 0.00 0.21 0.00 -0.01 0.00 0.00 66.41 67.00 1hpj h THR 12 Cb 1.87 0.31 -0.16 0.00 -1.07 0.00 0.00 68.15 69.10 1hpj h THR 12 CO -0.00 0.00 -0.09 0.23 -0.01 0.00 0.00 175.52 175.65 1hpj n MET 13 N -2.36 -0.07 0.00 0.00 2.81 0.11 -3.72 117.12 113.89 1hpj n MET 13 Ca -0.01 1.30 0.00 0.00 -1.81 0.00 0.00 57.70 57.18 1hpj n MET 13 Cb 0.54 -2.01 0.00 0.00 -0.71 0.00 0.00 33.22 31.04 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 -5.31 0.00 -4.53 7.83 3.41 -0.89 -4.64 113.62 109.49 1hpj n SER 14 Ca 0.17 0.00 -0.23 0.00 -0.26 0.00 0.00 58.87 58.55 1hpj n SER 14 Cb 0.55 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 64.50 1hpj n SER 14 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1hpj n LYS 15 N 0.00 0.77 -3.69 4.33 4.01 -0.94 0.47 118.16 123.11 1hpj n LYS 15 Ca 0.00 -3.08 -0.14 0.00 -0.51 0.00 0.00 58.31 54.57 1hpj n LYS 15 Cb 0.00 0.34 -0.14 0.00 -0.51 0.00 0.00 35.03 34.72 1hpj n LYS 15 CO 0.00 0.00 0.00 0.99 -1.11 0.00 0.00 177.40 177.28 1hpj s THR 16 N -2.45 -0.23 0.00 -0.18 2.01 0.29 -3.11 115.64 111.98 1hpj s THR 16 Ca 0.27 0.26 0.00 0.00 0.31 0.00 0.00 61.69 62.54 1hpj s THR 16 Cb -0.02 -0.34 0.00 0.00 0.01 0.00 0.00 72.50 72.15 1hpj s THR 16 CO 0.17 0.11 0.00 1.17 -0.69 0.00 0.00 174.62 175.38 1hpj n LYS 17 N 4.92 0.00 -0.05 4.92 3.00 0.41 -1.48 118.16 129.88 1hpj n LYS 17 Ca -0.13 0.00 -0.11 0.00 -0.00 0.00 0.00 58.31 58.07 1hpj n LYS 17 Cb 0.51 0.00 -0.04 0.00 0.00 0.00 0.00 35.03 35.50 1hpj n LYS 17 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1hpj n ASN 18 N 0.00 0.85 -0.08 3.14 3.02 -1.26 -3.37 115.26 117.55 1hpj n ASN 18 Ca 0.00 0.14 0.00 0.00 -0.03 0.00 0.00 54.58 54.69 1hpj n ASN 18 Cb 0.00 -0.34 0.00 0.00 -0.61 0.00 0.00 39.78 38.83 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 2.34 0.48 3.75 7.41 0.00 -0.75 -4.13 105.19 114.29 1hpj n GLY 19 Ca -0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.40 1hpj n GLY 19 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1hpj n ILE 20 N 0.00 1.50 -2.30 -0.61 5.41 -0.55 -4.42 119.36 118.39 1hpj n ILE 20 Ca 0.00 -0.37 -0.42 0.00 1.00 0.00 0.00 62.75 62.95 1hpj n ILE 20 Cb 0.24 -1.89 -0.03 0.00 -0.71 0.00 0.00 39.64 37.26 1hpj n ILE 20 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 176.55 175.66 1hpj s THR 21 N -0.55 3.88 0.00 1.39 2.01 -1.26 0.11 115.64 121.21 1hpj s THR 21 Ca 0.59 1.24 0.00 0.00 0.31 0.00 0.00 61.69 63.84 1hpj s THR 21 Cb -0.51 -3.80 0.00 0.00 0.01 0.00 0.00 72.50 68.20 1hpj s THR 21 CO 0.56 -0.00 0.00 0.00 -0.69 0.00 0.00 174.62 174.49 1hpj n GLN 23 N 0.00 0.00 -0.41 0.00 10.64 -1.13 -3.23 117.38 123.25 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 0.00 0.00 -0.86 0.00 0.00 30.24 29.38 1hpj n GLN 23 CO 0.00 0.00 0.00 0.36 -1.83 0.00 0.00 177.06 175.59 1hpj n LYS 24 N 0.00 0.00 -1.34 2.61 2.85 -1.23 -4.45 118.16 116.60 1hpj n LYS 24 Ca 0.00 0.00 -0.13 0.00 -1.05 0.00 0.00 58.31 57.13 1hpj n LYS 24 Cb 0.00 0.00 -0.06 0.00 -0.65 0.00 0.00 35.03 34.32 1hpj n LYS 24 CO 0.00 0.00 0.00 0.91 -0.05 0.00 0.00 177.40 178.26 1hpj n TRP 25 N 0.00 -0.23 0.33 5.58 5.03 0.49 -4.61 117.44 124.03 1hpj n TRP 25 Ca 0.00 0.00 0.00 0.00 3.03 0.00 0.00 57.50 60.53 1hpj n TRP 25 Cb 0.47 -2.64 0.00 0.00 -1.03 0.00 0.00 31.31 28.10 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 -0.62 0.21 -0.53 -0.99 7.64 -1.26 -4.92 113.62 113.14 1hpj n SER 26 Ca -0.13 -0.54 0.00 0.00 1.01 0.00 0.00 58.87 59.21 1hpj n SER 26 Cb 0.48 -0.10 0.00 0.00 -1.01 0.00 0.00 64.21 63.58 1hpj n SER 26 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1hpj n SER 27 N 0.17 -3.94 -4.47 6.43 2.88 -1.26 -4.53 113.62 108.90 1hpj n SER 27 Ca 0.00 0.00 -0.49 0.00 -1.33 0.00 0.00 58.87 57.05 1hpj n SER 27 Cb 0.05 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.45 1hpj n SER 27 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 1hpj n THR 28 N -1.07 0.19 0.00 2.46 -1.04 1.12 -4.31 114.28 111.63 1hpj n THR 28 Ca 0.00 -0.30 0.00 0.00 -2.04 0.00 0.00 64.05 61.71 1hpj n THR 28 Cb 0.00 -1.78 0.00 0.00 -1.82 0.00 0.00 70.33 66.73 1hpj n THR 28 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 1hpj n SER 29 N 10.39 0.00 -0.05 8.00 2.88 -1.26 -4.58 113.62 129.00 1hpj n SER 29 Ca 0.40 0.00 0.14 0.00 -1.33 0.00 0.00 58.87 58.08 1hpj n SER 29 Cb 0.26 0.00 0.78 0.00 -0.75 0.00 0.00 64.21 64.50 1hpj n SER 29 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1hpj n PRO 30 N 0.00 1.07 -3.99 -1.46 -0.04 -1.24 -4.95 135.00 124.39 1hpj n PRO 30 Ca 0.00 -0.10 -0.13 0.00 -0.04 0.00 0.00 63.50 63.23 1hpj n PRO 30 Cb 0.00 -1.43 -0.02 0.00 -0.04 0.00 0.00 33.50 32.01 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 -1.99 0.72 0.00 0.54 5.65 -1.24 -4.87 115.29 114.10 1hpj s HIS 31 Ca 0.40 -1.11 0.00 0.00 0.25 0.00 0.00 55.06 54.60 1hpj s HIS 31 Cb 0.19 0.25 0.00 0.00 -1.18 0.00 0.00 32.58 31.84 1hpj s HIS 31 CO 0.31 -1.30 0.00 -2.13 -0.65 0.00 0.00 174.74 170.98 1hpj n ARG 32 N -0.55 0.00 0.00 2.88 0.63 -1.26 -3.15 116.66 115.21 1hpj n ARG 32 Ca -0.02 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.91 1hpj n ARG 32 Cb 0.61 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.52 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 2.45 0.83 -1.09 -0.14 -0.04 -1.26 0.36 135.00 136.11 1hpj n PRO 33 Ca 0.00 0.00 -0.25 0.00 -0.04 0.00 0.00 63.50 63.21 1hpj n PRO 33 Cb 0.00 0.00 0.08 0.00 -0.04 0.00 0.00 33.50 33.54 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 -0.12 2.21 -1.07 0.54 0.00 -1.26 -4.20 116.66 112.76 1hpj n ARG 34 Ca 0.00 -2.49 -0.27 0.00 -0.00 0.00 0.00 57.85 55.08 1hpj n ARG 34 Cb 0.00 -1.98 -0.12 0.00 -0.00 0.00 0.00 32.46 30.37 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 -0.49 0.46 -2.54 2.89 -0.00 -1.26 -4.24 117.46 112.28 1hpj n PHE 35 Ca 0.48 -0.31 -0.03 0.00 -0.00 0.00 0.00 57.45 57.60 1hpj n PHE 35 Cb 0.85 -1.69 0.07 0.00 -0.00 0.00 0.00 39.48 38.71 1hpj n PHE 35 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 1hpj n SER 36 N 14.50 -0.85 -4.80 -2.13 2.88 -1.26 -5.06 113.62 116.90 1hpj n SER 36 Ca 0.42 -2.14 -0.31 0.00 -1.33 0.00 0.00 58.87 55.51 1hpj n SER 36 Cb 0.44 0.40 0.05 0.00 -0.75 0.00 0.00 64.21 64.36 1hpj n SER 36 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 1hpj s PRO 37 N -0.43 2.82 0.00 -1.46 0.04 -1.26 -4.96 135.00 129.75 1hpj s PRO 37 Ca 0.11 1.08 0.24 0.00 0.04 0.00 0.00 61.00 62.47 1hpj s PRO 37 Cb 0.33 -1.97 0.29 0.00 0.04 0.00 0.00 34.50 33.20 1hpj s PRO 37 CO -0.09 -1.20 1.27 0.00 0.04 0.00 0.00 177.00 177.02 1hpj n ALA 38 N -3.00 3.65 -1.11 8.56 0.00 -1.26 -4.05 120.51 123.31 1hpj n ALA 38 Ca 0.08 -0.50 -0.24 0.00 0.00 0.00 0.00 53.44 52.79 1hpj n ALA 38 Cb 0.53 -0.96 0.16 0.00 0.00 0.00 0.00 19.45 19.18 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 -0.81 3.12 -5.00 0.00 5.66 -1.26 -4.92 114.28 111.07 1hpj n THR 39 Ca 0.08 -1.91 -0.32 0.00 -3.05 0.00 0.00 64.05 58.85 1hpj n THR 39 Cb 0.38 -0.59 -0.15 0.00 -1.55 0.00 0.00 70.33 68.42 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 -3.14 2.65 0.95 1.09 4.02 -1.26 -5.11 115.29 114.50 1hpj s HIS 40 Ca 0.54 -0.66 -0.11 0.00 1.02 0.00 0.00 55.06 55.85 1hpj s HIS 40 Cb 0.45 -1.72 0.11 0.00 -1.02 0.00 0.00 32.58 30.40 1hpj s HIS 40 CO 0.09 -0.19 0.83 -2.30 1.02 0.00 0.00 174.74 174.19 1hpj n PRO 41 N 3.17 -0.53 -3.78 8.40 -0.02 -1.25 -3.34 135.00 137.66 1hpj n PRO 41 Ca -0.18 -0.10 -0.26 0.00 -2.02 0.00 0.00 63.50 60.94 1hpj n PRO 41 Cb 0.52 -2.15 0.01 0.00 -0.02 0.00 0.00 33.50 31.86 1hpj n PRO 41 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1hpj n SER 42 N -3.11 -2.68 -1.84 2.55 3.41 -1.26 -2.41 113.62 108.28 1hpj n SER 42 Ca 0.09 -0.77 -0.03 0.00 -0.26 0.00 0.00 58.87 57.91 1hpj n SER 42 Cb 0.53 -0.99 -0.04 0.00 -0.26 0.00 0.00 64.21 63.45 1hpj n SER 42 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 1hpj n GLU 43 N -3.06 0.92 0.00 4.33 0.00 -1.21 -3.64 120.64 117.98 1hpj n GLU 43 Ca -0.11 -0.25 0.00 0.00 0.00 0.00 0.00 57.16 56.81 1hpj n GLU 43 Cb 0.37 -1.41 0.00 0.00 0.00 0.00 0.00 31.44 30.41 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 2.02 1.58 2.72 -1.84 0.00 -1.26 -4.61 105.19 103.81 1hpj n GLY 44 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 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 0.59 5.49 -4.72 0.99 4.77 -1.26 -4.47 117.00 118.39 1hpj n LEU 45 Ca 0.00 -3.26 -0.40 0.00 -0.03 0.00 0.00 56.01 52.32 1hpj n LEU 45 Cb 0.39 -1.24 -0.05 0.00 -2.33 0.00 0.00 43.42 40.20 1hpj n LEU 45 CO 0.00 0.61 0.41 -1.83 -1.33 0.00 0.00 177.39 175.25 1hpj s GLU 46 N 3.67 4.44 0.00 3.23 -1.05 -1.26 -4.74 118.70 122.99 1hpj s GLU 46 Ca 0.50 0.91 0.00 0.00 -0.15 0.00 0.00 54.97 56.23 1hpj s GLU 46 Cb 0.13 -3.44 0.00 0.00 -0.44 0.00 0.00 34.13 30.38 1hpj s GLU 46 CO -0.00 0.08 0.00 0.39 0.95 0.00 0.00 175.26 176.68 1hpj n GLU 47 N 3.69 0.00 -2.78 -4.83 1.02 -1.26 -0.10 120.64 116.38 1hpj n GLU 47 Ca -0.01 0.00 -0.10 0.00 -0.02 0.00 0.00 57.16 57.03 1hpj n GLU 47 Cb 0.51 0.00 0.07 0.00 -0.02 0.00 0.00 31.44 32.00 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 0.05 -0.84 -3.03 1.62 2.04 -1.26 -0.38 115.26 113.46 1hpj n ASN 48 Ca 0.00 -2.95 -0.14 0.00 -0.44 0.00 0.00 54.58 51.05 1hpj n ASN 48 Cb 0.00 0.66 0.09 0.00 -2.53 0.00 0.00 39.78 38.00 1hpj n ASN 48 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1hpj n TYR 49 N -0.07 -3.77 -3.68 -2.53 9.36 0.86 -4.20 117.16 113.12 1hpj n TYR 49 Ca 0.07 -0.66 -0.18 0.00 3.32 0.00 0.00 57.90 60.44 1hpj n TYR 49 Cb 0.77 -0.47 -0.17 0.00 -0.63 0.00 0.00 39.34 38.84 1hpj n TYR 49 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1hpj n ARG 51 N 5.16 0.00 -2.80 0.00 3.00 -0.89 -4.79 116.66 116.34 1hpj n ARG 51 Ca -0.07 0.00 -0.02 0.00 -0.00 0.00 0.00 57.85 57.76 1hpj n ARG 51 Cb 0.50 0.00 0.05 0.00 0.00 0.00 0.00 32.46 33.01 1hpj n ARG 51 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 1hpj n ASN 52 N 0.00 1.49 -0.11 6.15 5.03 -1.24 -1.97 115.26 124.61 1hpj n ASN 52 Ca 0.00 -2.15 -0.12 0.00 0.87 0.00 0.00 54.58 53.18 1hpj n ASN 52 Cb 0.00 -0.47 -0.03 0.00 -1.02 0.00 0.00 39.78 38.26 1hpj n ASN 52 CO 0.00 0.00 0.00 1.55 -1.83 0.00 0.00 177.26 176.98 1hpj h PRO 53 N 2.66 0.74 0.00 3.52 0.14 -1.54 -1.87 132.00 135.64 1hpj h PRO 53 Ca -0.14 -0.35 0.00 0.00 0.14 0.00 0.00 66.00 65.65 1hpj h PRO 53 Cb 1.25 -0.01 0.00 0.00 0.14 0.00 0.00 31.00 32.39 1hpj h PRO 53 CO 0.23 0.97 0.00 -3.47 0.14 0.00 0.00 178.00 175.87 1hpj n ASP 54 N -4.28 0.00 -2.94 1.44 2.03 -1.26 -3.77 116.55 107.76 1hpj n ASP 54 Ca -0.03 -1.30 -0.06 0.00 0.52 0.00 0.00 54.79 53.92 1hpj n ASP 54 Cb 0.44 0.00 0.01 0.00 -0.72 0.00 0.00 41.12 40.84 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 -0.55 -7.85 -3.55 1.67 5.15 -0.70 -5.01 115.26 104.42 1hpj n ASN 55 Ca 0.02 0.30 -0.28 0.00 -0.60 0.00 0.00 54.58 54.02 1hpj n ASN 55 Cb 0.01 -5.28 -0.11 0.00 -0.53 0.00 0.00 39.78 33.86 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 -2.73 2.57 0.61 1.20 2.15 -1.26 -4.93 116.67 114.27 1hpj s ASP 56 Ca 0.16 -3.16 0.34 0.00 0.43 0.00 0.00 52.55 50.33 1hpj s ASP 56 Cb -0.04 -0.78 1.86 0.00 -0.30 0.00 0.00 42.92 43.65 1hpj s ASP 56 CO 0.77 -0.17 2.04 -0.65 -0.17 0.00 0.00 175.17 176.99 1hpj h PRO 57 N 5.78 0.00 -0.13 4.34 0.11 -1.94 -0.75 132.00 139.40 1hpj h PRO 57 Ca 0.20 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.28 1hpj h PRO 57 Cb 0.88 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.98 1hpj h PRO 57 CO 0.46 0.00 -0.03 -0.56 -0.21 0.00 0.00 178.00 177.65 1hpj h GLN 58 N 0.00 0.19 0.00 1.05 3.07 -2.00 -3.47 115.11 113.95 1hpj h GLN 58 Ca 0.00 -0.03 0.00 0.00 0.09 0.00 0.00 58.65 58.71 1hpj h GLN 58 Cb 0.31 -0.03 0.00 0.00 0.08 0.00 0.00 27.48 27.84 1hpj h GLN 58 CO 0.00 0.25 0.00 0.41 0.09 0.00 0.00 178.83 179.58 1hpj n GLY 59 N -1.17 1.74 3.56 0.06 0.00 -0.29 -5.06 105.19 104.03 1hpj n GLY 59 Ca -0.01 -0.70 -0.25 0.00 0.00 0.00 0.00 46.02 45.06 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 2.46 1.16 1.61 0.04 -1.26 -4.73 135.00 132.28 1hpj s PRO 60 Ca 0.00 -0.27 -0.17 0.00 0.04 0.00 0.00 61.00 60.60 1hpj s PRO 60 Cb 0.00 -5.05 0.21 0.00 0.04 0.00 0.00 34.50 29.70 1hpj s PRO 60 CO 0.00 -3.52 0.40 -2.67 0.04 0.00 0.00 177.00 171.25 1hpj n TRP 61 N 14.46 -2.26 0.00 0.56 4.27 -0.83 -1.45 117.44 132.18 1hpj n TRP 61 Ca 0.41 -0.15 0.00 0.00 -3.89 0.00 0.00 57.50 53.87 1hpj n TRP 61 Cb 0.47 -1.46 0.00 0.00 -1.36 0.00 0.00 31.31 28.96 1hpj n TRP 61 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1hpj s TYR 63 N -0.89 2.71 0.41 0.00 1.51 -1.25 -1.43 117.35 118.41 1hpj s TYR 63 Ca 0.00 -0.49 0.04 0.00 -1.01 0.00 0.00 57.07 55.61 1hpj s TYR 63 Cb 0.00 -2.18 -0.02 0.00 -0.11 0.00 0.00 41.96 39.64 1hpj s TYR 63 CO 0.00 -0.14 0.12 0.95 -1.11 0.00 0.00 175.55 175.37 1hpj s THR 64 N -2.47 0.64 -0.71 -0.71 -4.23 0.31 -2.85 115.64 105.62 1hpj s THR 64 Ca 0.48 -2.00 0.23 0.00 -1.18 0.00 0.00 61.69 59.22 1hpj s THR 64 Cb -0.03 -2.35 0.23 0.00 1.34 0.00 0.00 72.50 71.68 1hpj s THR 64 CO 0.28 0.00 1.70 0.35 -0.54 0.00 0.00 174.62 176.41 1hpj n THR 65 N -0.92 0.72 -4.26 3.99 -2.24 -1.20 -4.63 114.28 105.74 1hpj n THR 65 Ca -0.06 0.10 -0.34 0.00 -2.27 0.00 0.00 64.05 61.47 1hpj n THR 65 Cb 0.65 -0.93 -0.12 0.00 -2.10 0.00 0.00 70.33 67.84 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 -3.89 4.92 0.20 3.42 1.01 -1.26 -3.60 116.67 117.47 1hpj s ASP 66 Ca 0.07 -0.12 -0.10 0.00 0.71 0.00 0.00 52.55 53.11 1hpj s ASP 66 Cb 0.11 -1.82 0.24 0.00 1.01 0.00 0.00 42.92 42.47 1hpj s ASP 66 CO 0.42 0.14 1.75 1.55 0.21 0.00 0.00 175.17 179.25 1hpj h PRO 67 N 6.92 0.41 -0.44 8.23 0.13 -1.89 0.76 132.00 146.12 1hpj h PRO 67 Ca -0.33 -0.02 0.09 0.00 -0.87 0.00 0.00 66.00 64.86 1hpj h PRO 67 Cb 1.18 -0.09 -0.08 0.00 0.13 0.00 0.00 31.00 32.14 1hpj h PRO 67 CO 0.63 0.27 -0.07 0.93 -0.23 0.00 0.00 178.00 179.54 1hpj h GLU 68 N 0.43 0.04 -0.83 0.86 5.08 -1.98 0.52 114.58 118.69 1hpj h GLU 68 Ca 0.29 -0.00 -0.46 0.00 -1.00 0.00 0.00 59.36 58.18 1hpj h GLU 68 Cb 0.32 -0.01 -0.26 0.00 0.50 0.00 0.00 28.75 29.30 1hpj h GLU 68 CO -0.27 0.03 0.46 0.36 -1.00 0.00 0.00 179.01 178.58 1hpj n LYS 69 N -5.28 2.25 -0.48 2.33 2.85 -0.82 -4.77 118.16 114.23 1hpj n LYS 69 Ca 0.04 -3.13 0.37 0.00 -1.05 0.00 0.00 58.31 54.54 1hpj n LYS 69 Cb 0.24 -2.11 0.58 0.00 -0.65 0.00 0.00 35.03 33.09 1hpj n LYS 69 CO 0.00 0.00 0.00 2.89 -0.05 0.00 0.00 177.40 180.24 1hpj n ARG 70 N -1.10 -0.01 -2.44 -1.58 1.85 0.26 -4.11 116.66 109.54 1hpj n ARG 70 Ca 0.53 0.82 -0.01 0.00 -1.00 0.00 0.00 57.85 58.20 1hpj n ARG 70 Cb 1.36 -1.83 0.01 0.00 -1.05 0.00 0.00 32.46 30.95 1hpj n ARG 70 CO 0.00 0.00 0.00 2.48 -0.01 0.00 0.00 177.63 180.10 1hpj n TYR 71 N -3.58 -0.81 -3.65 2.89 4.11 -1.26 -0.53 117.16 114.34 1hpj n TYR 71 Ca 0.32 -0.48 0.00 0.00 -0.00 0.00 0.00 57.90 57.74 1hpj n TYR 71 Cb 1.41 0.23 0.00 0.00 -0.00 0.00 0.00 39.34 40.98 1hpj n TYR 71 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 176.86 176.61 1hpj n ASP 72 N -0.82 0.00 -4.07 9.48 8.00 -0.51 -4.90 116.55 123.72 1hpj n ASP 72 Ca -0.01 0.00 -0.33 0.00 0.71 0.00 0.00 54.79 55.17 1hpj n ASP 72 Cb 0.23 0.00 -0.14 0.00 -0.02 0.00 0.00 41.12 41.19 1hpj n ASP 72 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1hpj s TYR 73 N -3.00 3.55 0.07 1.24 1.51 -1.26 -0.19 117.35 119.27 1hpj s TYR 73 Ca 0.00 -2.57 -0.12 0.00 -1.01 0.00 0.00 57.07 53.37 1hpj s TYR 73 Cb 0.00 -2.64 -0.07 0.00 -0.11 0.00 0.00 41.96 39.14 1hpj s TYR 73 CO 0.00 -0.92 0.24 0.00 -1.11 0.00 0.00 175.55 173.76 1hpj s ASP 75 N -0.35 3.80 -0.03 0.00 2.15 -1.22 -4.46 116.67 116.56 1hpj s ASP 75 Ca 0.27 -0.32 0.06 0.00 0.43 0.00 0.00 52.55 52.98 1hpj s ASP 75 Cb -0.39 -2.57 -0.02 0.00 -0.30 0.00 0.00 42.92 39.64 1hpj s ASP 75 CO 0.23 -4.11 -0.19 -0.63 -0.17 0.00 0.00 175.17 170.30 1hpj s ILE 76 N 15.29 2.69 -0.60 4.11 1.01 -1.26 -1.71 121.20 140.73 1hpj s ILE 76 Ca 0.88 -0.92 -0.29 0.00 0.00 0.00 0.00 60.65 60.32 1hpj s ILE 76 Cb -0.10 -2.03 -0.12 0.00 0.01 0.00 0.00 42.46 40.22 1hpj s ILE 76 CO 0.11 0.55 2.45 0.18 0.00 0.00 0.00 174.94 178.23 1hpj n LEU 77 N 2.24 1.77 -4.55 2.97 4.77 -1.26 -4.86 117.00 118.08 1hpj n LEU 77 Ca -0.17 -0.15 -0.36 0.00 -0.03 0.00 0.00 56.01 55.30 1hpj n LEU 77 Cb 0.52 -1.35 0.08 0.00 -2.33 0.00 0.00 43.42 40.33 1hpj n LEU 77 CO 0.25 -1.18 0.32 -0.62 -1.33 0.00 0.00 177.39 174.83 1hpj n GLU 78 N 8.74 0.43 0.00 3.23 4.71 -1.26 -3.75 120.64 132.73 1hpj n GLU 78 Ca 0.45 0.19 0.00 0.00 -0.01 0.00 0.00 57.16 57.80 1hpj n GLU 78 Cb 0.35 -2.03 0.00 0.00 -1.01 0.00 0.00 31.44 28.75 1hpj n GLU 78 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22