#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hkz n LEU 2 N 0.00 -0.54 -4.82 4.03 4.77 -1.26 -4.89 117.00 114.29 3hkz n LEU 2 Ca 0.00 1.24 -0.33 0.00 -0.03 0.00 0.00 56.01 56.89 3hkz n LEU 2 Cb 0.00 -2.92 -0.07 0.00 -2.33 0.00 0.00 43.42 38.10 3hkz n LEU 2 CO 0.00 -1.95 0.59 -0.63 -1.33 0.00 0.00 177.39 174.07 3hkz s ILE 3 N -2.71 4.45 -0.08 -0.08 1.09 -1.26 -4.72 121.20 117.89 3hkz s ILE 3 Ca 0.00 1.39 -0.30 0.00 -1.10 0.00 0.00 60.65 60.64 3hkz s ILE 3 Cb 0.00 -3.65 -0.02 0.00 -1.06 0.00 0.00 42.46 37.73 3hkz s ILE 3 CO 0.00 -0.22 1.02 -2.84 -0.10 0.00 0.00 174.94 172.79 3hkz s PRO 4 N -2.98 4.45 0.03 2.79 0.02 -1.26 -4.84 135.00 133.20 3hkz s PRO 4 Ca 0.58 1.42 -0.30 0.00 0.02 0.00 0.00 61.00 62.72 3hkz s PRO 4 Cb -0.10 -3.52 -0.08 0.00 0.02 0.00 0.00 34.50 30.81 3hkz s PRO 4 CO 0.15 -0.27 1.89 -1.50 -0.33 0.00 0.00 177.00 176.95 3hkz s ILE 5 N 1.81 3.10 0.22 2.83 1.10 -1.26 -3.68 121.20 125.33 3hkz s ILE 5 Ca 0.50 0.17 0.00 0.00 -0.51 0.00 0.00 60.65 60.80 3hkz s ILE 5 Cb -0.19 -3.11 0.00 0.00 0.15 0.00 0.00 42.46 39.31 3hkz s ILE 5 CO 0.20 -0.01 0.00 0.54 -2.11 0.00 0.00 174.94 173.56 3hkz n ARG 6 N 7.32 -2.30 -2.45 3.50 1.74 -1.26 -4.89 116.66 118.32 3hkz n ARG 6 Ca 0.19 1.69 -0.42 0.00 -0.77 0.00 0.00 57.85 58.54 3hkz n ARG 6 Cb 0.41 -1.89 -0.03 0.00 -1.02 0.00 0.00 32.46 29.94 3hkz n ARG 6 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3hkz h PHE 8 N 6.47 -0.56 0.00 0.00 0.05 -1.91 0.21 116.94 121.21 3hkz h PHE 8 Ca -0.42 0.06 0.00 0.00 3.82 0.00 0.00 57.97 61.43 3hkz h PHE 8 Cb 1.21 0.34 0.00 0.00 2.00 0.00 0.00 35.95 39.51 3hkz h PHE 8 CO 0.66 -0.32 0.00 2.41 -0.18 0.00 0.00 178.31 180.88 3hkz n THR 9 N -5.45 0.00 0.06 -1.55 -1.04 -1.26 -4.43 114.28 100.62 3hkz n THR 9 Ca 0.07 1.15 -0.02 0.00 -2.04 0.00 0.00 64.05 63.21 3hkz n THR 9 Cb 0.35 -2.09 -0.07 0.00 -1.82 0.00 0.00 70.33 66.70 3hkz n THR 9 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3hkz n GLY 11 N 1.36 0.77 3.52 0.00 0.00 0.06 -5.00 105.19 105.91 3hkz n GLY 11 Ca -0.06 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.66 3hkz n GLY 11 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3hkz s SER 12 N -2.62 0.53 0.53 1.61 1.04 -1.26 -4.67 113.70 108.86 3hkz s SER 12 Ca 0.00 0.76 -0.16 0.00 0.48 0.00 0.00 55.95 57.03 3hkz s SER 12 Cb 0.00 -1.08 -0.07 0.00 0.10 0.00 0.00 66.02 64.97 3hkz s SER 12 CO 0.00 -4.38 1.00 -0.76 0.98 0.00 0.00 173.24 170.08 3hkz s LEU 13 N -7.15 3.58 0.00 2.42 1.02 -1.26 -2.31 118.68 114.98 3hkz s LEU 13 Ca 0.70 1.59 0.00 0.00 0.02 0.00 0.00 54.13 56.44 3hkz s LEU 13 Cb -0.12 -4.51 0.00 0.00 0.02 0.00 0.00 46.19 41.58 3hkz s LEU 13 CO 0.57 -0.68 0.00 -0.38 0.02 0.00 0.00 176.35 175.88 3hkz n ILE 14 N -1.72 0.00 -0.29 -0.59 2.08 -1.26 -4.71 119.36 112.86 3hkz n ILE 14 Ca 0.07 0.00 -0.03 0.00 0.56 0.00 0.00 62.75 63.35 3hkz n ILE 14 Cb 0.54 -0.24 0.03 0.00 -0.75 0.00 0.00 39.64 39.22 3hkz n ILE 14 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 3hkz h ALA 15 N 0.00 0.11 -0.99 -1.39 0.00 -1.88 -2.33 119.26 112.77 3hkz h ALA 15 Ca 0.00 0.23 0.34 0.00 0.00 0.00 0.00 54.91 55.48 3hkz h ALA 15 Cb 0.00 0.87 -0.18 0.00 0.00 0.00 0.00 17.79 18.48 3hkz h ALA 15 CO 0.00 -0.63 0.28 0.38 0.00 0.00 0.00 179.25 179.28 3hkz h ASP 16 N -0.08 -0.08 0.95 0.00 2.03 -1.93 0.20 116.42 117.51 3hkz h ASP 16 Ca 0.30 0.27 0.00 0.00 -0.73 0.00 0.00 57.03 56.87 3hkz h ASP 16 Cb 0.58 0.38 0.00 0.00 -0.83 0.00 0.00 39.33 39.45 3hkz h ASP 16 CO -0.83 -0.38 -0.53 0.29 -1.03 0.00 0.00 179.24 176.75 3hkz n LYS 17 N -5.37 0.29 -0.09 4.15 5.02 -0.88 -4.48 118.16 116.80 3hkz n LYS 17 Ca 0.30 0.10 -0.06 0.00 -2.02 0.00 0.00 58.31 56.63 3hkz n LYS 17 Cb 1.00 -1.70 0.00 0.00 -0.02 0.00 0.00 35.03 34.31 3hkz n LYS 17 CO 0.00 0.00 0.00 2.35 -0.52 0.00 0.00 177.40 179.23 3hkz h TRP 18 N 0.00 -0.43 0.00 2.13 7.01 -0.65 -3.21 115.95 120.81 3hkz h TRP 18 Ca 0.00 0.04 0.00 0.00 2.11 0.00 0.00 58.89 61.04 3hkz h TRP 18 Cb 0.74 0.24 0.00 0.00 -2.10 0.00 0.00 29.16 28.04 3hkz h TRP 18 CO 0.00 -0.25 0.00 1.04 -2.79 0.00 0.00 178.44 176.44 3hkz n GLN 19 N -5.35 0.46 0.00 2.65 6.02 -1.26 -0.31 117.38 119.59 3hkz n GLN 19 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.00 3hkz n GLN 19 Cb 0.26 -1.27 0.00 0.00 1.02 0.00 0.00 30.24 30.25 3hkz n GLN 19 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 3hkz n SER 20 N 1.09 0.00 0.00 1.08 3.41 -1.21 -4.71 113.62 113.28 3hkz n SER 20 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3hkz n SER 20 Cb 0.23 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.18 3hkz n SER 20 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 3hkz n PHE 21 N 0.00 0.00 0.26 7.33 3.01 0.58 -2.30 117.46 126.33 3hkz n PHE 21 Ca 0.00 0.00 0.11 0.00 1.01 0.00 0.00 57.45 58.57 3hkz n PHE 21 Cb 0.00 -0.38 0.70 0.00 -0.01 0.00 0.00 39.48 39.79 3hkz n PHE 21 CO 0.00 0.00 0.00 -0.84 1.01 0.00 0.00 176.76 176.93 3hkz h ILE 22 N 0.00 0.76 0.00 4.37 -2.65 -1.92 0.22 117.51 118.28 3hkz h ILE 22 Ca 0.00 -0.41 0.00 0.00 1.03 0.00 0.00 64.86 65.48 3hkz h ILE 22 Cb 0.00 1.25 0.00 0.00 -2.05 0.00 0.00 36.82 36.02 3hkz h ILE 22 CO 0.00 0.10 0.00 0.41 0.03 0.00 0.00 178.15 178.69 3hkz n THR 23 N -3.95 0.00 -0.06 0.16 -1.04 -1.26 -1.91 114.28 106.23 3hkz n THR 23 Ca -0.02 1.48 -0.08 0.00 -2.04 0.00 0.00 64.05 63.39 3hkz n THR 23 Cb 0.20 -2.34 -0.01 0.00 -1.82 0.00 0.00 70.33 66.36 3hkz n THR 23 CO 0.00 0.00 0.00 0.03 -0.64 0.00 0.00 175.07 174.46 3hkz h ARG 24 N 0.00 -0.15 -0.76 -2.82 3.08 -1.15 -3.07 114.38 109.51 3hkz h ARG 24 Ca 0.00 0.01 0.14 0.00 0.07 0.00 0.00 59.98 60.20 3hkz h ARG 24 Cb 0.00 0.04 -0.09 0.00 0.08 0.00 0.00 29.97 29.99 3hkz h ARG 24 CO 0.00 -0.10 0.30 0.28 -1.07 0.00 0.00 179.97 179.38 3hkz h VAL 25 N -0.16 0.66 0.00 2.04 2.07 -0.57 0.19 116.25 120.48 3hkz h VAL 25 Ca 0.14 -0.15 -0.05 0.00 0.82 0.00 0.00 66.70 67.46 3hkz h VAL 25 Cb 0.37 0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 3hkz h VAL 25 CO -0.35 0.08 -0.23 0.78 0.02 0.00 0.00 177.57 177.87 3hkz h ASN 26 N 0.45 0.00 -1.46 0.57 2.35 -1.33 -2.86 115.58 113.29 3hkz h ASN 26 Ca 0.41 0.00 -0.65 0.00 -0.55 0.00 0.00 56.30 55.52 3hkz h ASN 26 Cb 0.62 0.00 -0.20 0.00 0.05 0.00 0.00 38.32 38.79 3hkz h ASN 26 CO -0.40 0.23 0.97 0.00 -1.65 0.00 0.00 177.43 176.58 3hkz n ALA 27 N -2.21 6.50 -0.11 -0.83 0.00 0.65 -5.00 120.51 119.51 3hkz n ALA 27 Ca 0.01 -3.67 0.00 0.00 0.00 0.00 0.00 53.44 49.77 3hkz n ALA 27 Cb 0.47 -2.21 0.00 0.00 0.00 0.00 0.00 19.45 17.70 3hkz n ALA 27 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hkz n GLY 28 N 0.53 2.23 0.65 0.00 0.00 -1.08 -4.93 105.19 102.59 3hkz n GLY 28 Ca 0.52 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 46.20 3hkz n GLY 28 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3hkz n GLU 29 N 8.75 0.00 -1.56 1.61 1.02 -1.26 -4.26 120.64 124.95 3hkz n GLU 29 Ca 0.00 0.00 -0.52 0.00 -0.02 0.00 0.00 57.16 56.62 3hkz n GLU 29 Cb 0.00 -0.17 -0.07 0.00 -0.02 0.00 0.00 31.44 31.18 3hkz n GLU 29 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 3hkz n ASN 30 N 1.49 2.43 -0.33 1.62 2.85 -1.26 -4.30 115.26 117.76 3hkz n ASN 30 Ca 0.00 0.69 0.07 0.00 -0.11 0.00 0.00 54.58 55.23 3hkz n ASN 30 Cb 0.00 -1.25 0.16 0.00 1.24 0.00 0.00 39.78 39.93 3hkz n ASN 30 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 3hkz h PRO 31 N 10.41 0.01 0.09 1.20 0.11 -1.93 -2.01 132.00 139.88 3hkz h PRO 31 Ca -0.36 -0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.76 3hkz h PRO 31 Cb 1.31 -0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.40 3hkz h PRO 31 CO 0.99 0.01 -0.15 0.78 -0.21 0.00 0.00 178.00 179.41 3hkz h GLY 32 N 0.01 -0.27 2.00 -0.55 0.00 -2.01 -2.47 103.07 99.78 3hkz h GLY 32 Ca 0.48 0.18 -0.02 0.00 0.00 0.00 0.00 47.33 47.97 3hkz h GLY 32 CO -0.93 -0.15 -0.08 0.50 0.00 0.00 0.00 176.54 175.87 3hkz h LYS 33 N -0.30 0.00 -0.43 4.80 1.57 -1.78 -0.45 116.57 119.98 3hkz h LYS 33 Ca 0.02 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.76 3hkz h LYS 33 Cb 0.32 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.61 3hkz h LYS 33 CO -0.08 0.08 0.10 0.28 -0.57 0.00 0.00 179.45 179.26 3hkz h VAL 34 N 0.00 1.19 -0.13 0.50 2.07 -0.96 1.80 116.25 120.72 3hkz h VAL 34 Ca -0.00 -0.69 -0.10 0.00 0.82 0.00 0.00 66.70 66.73 3hkz h VAL 34 Cb 0.15 0.76 0.00 0.00 -1.52 0.00 0.00 31.29 30.68 3hkz h VAL 34 CO 0.01 0.25 -0.29 -0.07 0.02 0.00 0.00 177.57 177.49 3hkz h LEU 35 N 0.63 0.49 -0.10 2.57 3.38 -1.09 -0.87 115.31 120.31 3hkz h LEU 35 Ca 0.14 -0.57 0.03 0.00 0.09 0.00 0.00 57.88 57.58 3hkz h LEU 35 Cb 0.24 -0.14 -0.06 0.00 0.09 0.00 0.00 40.66 40.79 3hkz h LEU 35 CO -0.00 0.96 -0.54 0.44 0.09 0.00 0.00 178.44 179.39 3hkz h ASP 36 N 0.03 -1.69 -0.46 -0.43 3.32 -0.07 -1.49 116.42 115.62 3hkz h ASP 36 Ca 0.00 0.20 0.11 0.00 0.02 0.00 0.00 57.03 57.36 3hkz h ASP 36 Cb 0.89 0.66 -0.02 0.00 0.22 0.00 0.00 39.33 41.07 3hkz h ASP 36 CO 0.06 -0.49 0.33 -0.78 -1.72 0.00 0.00 179.24 176.64 3hkz h ASP 37 N -0.60 0.11 -1.49 6.45 3.58 0.27 -3.42 116.42 121.31 3hkz h ASP 37 Ca 0.03 0.00 -0.43 0.00 0.42 0.00 0.00 57.03 57.06 3hkz h ASP 37 Cb 0.69 -0.02 0.01 0.00 1.72 0.00 0.00 39.33 41.74 3hkz h ASP 37 CO -0.42 0.06 -0.28 -0.22 -2.88 0.00 0.00 179.24 175.51 3hkz s LEU 38 N -8.98 3.68 -0.57 2.28 0.20 -0.33 -5.01 118.68 109.95 3hkz s LEU 38 Ca -0.06 -0.41 -0.26 0.00 0.69 0.00 0.00 54.13 54.09 3hkz s LEU 38 Cb 0.19 -2.63 -0.04 0.00 -0.43 0.00 0.00 46.19 43.28 3hkz s LEU 38 CO 0.73 -0.71 2.04 -0.83 -0.29 0.00 0.00 176.35 177.29 3hkz s GLY 39 N -4.31 -0.01 -0.12 7.98 0.00 -1.26 -4.81 107.32 104.78 3hkz s GLY 39 Ca 0.53 -0.42 -0.07 0.00 0.00 0.00 0.00 44.72 44.76 3hkz s GLY 39 CO 0.32 3.66 0.30 0.14 0.00 0.00 0.00 173.10 177.52 3hkz s VAL 40 N 10.12 -0.03 0.00 1.40 1.01 -1.26 -5.08 120.40 126.57 3hkz s VAL 40 Ca 0.77 0.12 0.00 0.00 0.00 0.00 0.00 61.98 62.87 3hkz s VAL 40 Cb -0.14 -0.45 0.00 0.00 0.00 0.00 0.00 36.38 35.79 3hkz s VAL 40 CO 0.22 0.05 0.00 0.29 0.00 0.00 0.00 175.10 175.66 3hkz n LYS 41 N 4.12 0.00 -0.28 2.72 4.76 -1.26 -4.91 118.16 123.30 3hkz n LYS 41 Ca -0.24 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.20 3hkz n LYS 41 Cb 0.54 -0.01 0.00 0.00 -1.84 0.00 0.00 35.03 33.72 3hkz n LYS 41 CO 0.00 0.00 0.00 -2.13 -1.37 0.00 0.00 177.40 173.90 3hkz n ARG 42 N -0.16 1.74 -0.07 1.97 3.00 -1.26 -5.04 116.66 116.84 3hkz n ARG 42 Ca 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 57.85 57.71 3hkz n ARG 42 Cb 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 32.46 32.32 3hkz n ARG 42 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.63 180.11 3hkz n TYR 43 N -0.51 0.47 -0.29 -0.14 0.18 -1.26 -3.40 117.16 112.21 3hkz n TYR 43 Ca 0.00 0.13 0.23 0.00 1.88 0.00 0.00 57.90 60.15 3hkz n TYR 43 Cb 0.00 -1.07 0.43 0.00 -0.38 0.00 0.00 39.34 38.32 3hkz n TYR 43 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 3hkz n ARG 46 N 0.80 0.66 0.33 0.00 0.63 0.26 -4.22 116.66 115.12 3hkz n ARG 46 Ca 0.10 0.16 -0.19 0.00 -0.92 0.00 0.00 57.85 57.00 3hkz n ARG 46 Cb 0.43 -1.67 -0.10 0.00 0.45 0.00 0.00 32.46 31.57 3hkz n ARG 46 CO 0.00 0.00 0.00 -0.09 -2.51 0.00 0.00 177.63 175.03 3hkz h ARG 47 N 0.00 -1.01 -0.98 -0.14 9.65 0.25 -3.16 114.38 118.99 3hkz h ARG 47 Ca -0.40 0.07 0.28 0.00 -1.10 0.00 0.00 59.98 58.83 3hkz h ARG 47 Cb 2.11 0.23 -0.18 0.00 -1.39 0.00 0.00 29.97 30.74 3hkz h ARG 47 CO 0.06 -0.67 0.10 0.52 2.80 0.00 0.00 179.97 182.77 3hkz h MET 48 N -1.05 0.02 0.02 0.20 2.86 -1.73 -1.77 114.93 113.48 3hkz h MET 48 Ca -0.07 -0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.54 3hkz h MET 48 Cb 0.89 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.55 3hkz h MET 48 CO -0.02 0.02 -0.10 -0.07 1.06 0.00 0.00 176.91 177.79 3hkz h LEU 49 N 0.02 0.06 -2.27 1.22 3.38 -1.77 -3.21 115.31 112.75 3hkz h LEU 49 Ca 0.62 -0.97 0.04 0.00 0.09 0.00 0.00 57.88 57.66 3hkz h LEU 49 Cb 1.32 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 42.04 3hkz h LEU 49 CO -0.88 1.03 0.22 -0.07 0.09 0.00 0.00 178.44 178.83 3hkz h LEU 50 N -0.90 0.00 -3.13 1.67 3.38 -1.30 -0.74 115.31 114.30 3hkz h LEU 50 Ca -0.02 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 3hkz h LEU 50 Cb 1.06 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.81 3hkz h LEU 50 CO 0.02 0.00 -0.02 -1.54 0.09 0.00 0.00 178.44 176.99 3hkz n SER 51 N -3.52 3.03 -4.52 -0.43 3.41 -1.00 -4.99 113.62 105.59 3hkz n SER 51 Ca 0.01 -3.12 -0.42 0.00 -0.26 0.00 0.00 58.87 55.07 3hkz n SER 51 Cb 0.33 -0.50 -0.08 0.00 -0.26 0.00 0.00 64.21 63.70 3hkz n SER 51 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 3hkz s HIS 52 N -2.89 3.14 0.16 7.33 5.65 -0.29 -4.94 115.29 123.46 3hkz s HIS 52 Ca 0.37 -0.06 0.10 0.00 0.25 0.00 0.00 55.06 55.73 3hkz s HIS 52 Cb 0.32 -3.03 0.14 0.00 -1.18 0.00 0.00 32.58 28.83 3hkz s HIS 52 CO 0.05 -0.68 1.48 -0.39 -0.65 0.00 0.00 174.74 174.55 3hkz h VAL 53 N 5.72 1.44 -5.77 0.89 -1.51 -1.92 -3.49 116.25 111.61 3hkz h VAL 53 Ca -0.27 -2.58 -0.14 0.00 -1.23 0.00 0.00 66.70 62.48 3hkz h VAL 53 Cb 1.11 2.42 0.01 0.00 -2.13 0.00 0.00 31.29 32.70 3hkz h VAL 53 CO 0.81 0.72 -0.81 -0.67 -1.23 0.00 0.00 177.57 176.39 3hkz n ASP 54 N -3.54 -7.03 -1.40 4.19 4.64 -1.26 -4.88 116.55 107.26 3hkz n ASP 54 Ca -0.00 0.34 0.05 0.00 -1.38 0.00 0.00 54.79 53.79 3hkz n ASP 54 Cb 0.74 -3.91 0.27 0.00 -1.04 0.00 0.00 41.12 37.18 3hkz n ASP 54 CO 0.00 0.00 0.00 2.30 -0.82 0.00 0.00 177.20 178.68 3hkz n ILE 55 N -0.14 1.76 0.23 5.18 -0.00 -1.26 -4.16 119.36 120.97 3hkz n ILE 55 Ca 0.03 -0.92 0.10 0.00 -0.00 0.00 0.00 62.75 61.96 3hkz n ILE 55 Cb 0.52 -0.29 0.51 0.00 -0.00 0.00 0.00 39.64 40.37 3hkz n ILE 55 CO 0.00 0.00 0.00 -0.29 -0.00 0.00 0.00 176.55 176.26 3hkz h ILE 56 N 2.71 0.63 -0.03 7.28 2.10 -1.91 -3.24 117.51 125.05 3hkz h ILE 56 Ca 0.00 -1.03 -0.09 0.00 1.08 0.00 0.00 64.86 64.82 3hkz h ILE 56 Cb 1.43 1.67 -0.01 0.00 -1.09 0.00 0.00 36.82 38.82 3hkz h ILE 56 CO 0.30 0.22 -0.40 0.78 -1.08 0.00 0.00 178.15 177.97 3hkz h ASN 57 N 0.00 0.07 0.68 2.19 -0.26 -1.96 -0.60 115.58 115.69 3hkz h ASN 57 Ca -0.00 -0.03 -0.22 0.00 -0.56 0.00 0.00 56.30 55.49 3hkz h ASN 57 Cb 0.65 -0.02 -0.04 0.00 -1.06 0.00 0.00 38.32 37.86 3hkz h ASN 57 CO 0.03 0.47 -1.46 -0.33 -1.06 0.00 0.00 177.43 175.08 3hkz h GLU 58 N 0.06 0.00 0.00 0.81 5.08 -1.88 -3.39 114.58 115.25 3hkz h GLU 58 Ca 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 3hkz h GLU 58 Cb 0.74 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.98 3hkz h GLU 58 CO 0.05 0.42 -1.45 0.28 -1.00 0.00 0.00 179.01 177.32 3hkz n VAL 59 N -3.00 0.40 0.12 3.13 0.31 -1.15 -4.53 118.33 113.61 3hkz n VAL 59 Ca -0.11 -0.54 -0.15 0.00 -0.01 0.00 0.00 64.34 63.53 3hkz n VAL 59 Cb 0.93 -0.22 -0.08 0.00 -0.91 0.00 0.00 33.84 33.56 3hkz n VAL 59 CO 0.00 0.00 0.00 -0.29 -1.32 0.00 0.00 176.83 175.22 3hkz h ILE 60 N 0.00 0.12 0.00 2.52 6.09 -1.30 -3.29 117.51 121.64 3hkz h ILE 60 Ca -0.01 0.00 -0.59 0.00 -1.37 0.00 0.00 64.86 62.89 3hkz h ILE 60 Cb 1.04 0.12 0.05 0.00 0.47 0.00 0.00 36.82 38.50 3hkz h ILE 60 CO 0.00 0.00 2.26 0.00 -3.07 0.00 0.00 178.15 177.35 3hkz n HIS 61 N -5.47 1.62 0.00 2.19 1.44 -1.26 -3.90 115.22 109.83 3hkz n HIS 61 Ca -0.07 -1.72 0.00 0.00 -2.01 0.00 0.00 57.72 53.92 3hkz n HIS 61 Cb 0.39 -1.61 0.00 0.00 0.12 0.00 0.00 29.99 28.89 3hkz n HIS 61 CO 0.00 0.00 0.00 0.66 -2.81 0.00 0.00 176.34 174.19 3hkz n TYR 62 N 6.95 -1.29 0.00 -1.40 4.01 -1.24 -5.16 117.16 119.03 3hkz n TYR 62 Ca 0.47 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 58.21 3hkz n TYR 62 Cb 0.35 0.39 0.00 0.00 -0.31 0.00 0.00 39.34 39.77 3hkz n TYR 62 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 3hkz n THR 63 N -2.17 0.00 -1.60 -0.72 -2.24 -1.25 -5.25 114.28 101.05 3hkz n THR 63 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 3hkz n THR 63 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 3hkz n THR 63 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39