#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n89 n GLN 3 N -3.44 0.00 -1.49 0.00 -0.06 -1.26 -5.03 117.38 106.10 1n89 n GLN 3 Ca 0.00 0.00 -0.10 0.00 -2.00 0.00 0.00 57.00 54.90 1n89 n GLN 3 Cb 0.00 0.00 -0.03 0.00 -4.06 0.00 0.00 30.24 26.15 1n89 n GLN 3 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1n89 n ALA 4 N -1.73 -0.18 0.00 1.69 0.00 -1.26 -4.85 120.51 114.17 1n89 n ALA 4 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.58 1n89 n ALA 4 Cb 0.00 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.19 1n89 n ALA 4 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1n89 n SER 5 N 0.32 4.46 0.00 0.00 2.88 -1.26 -4.43 113.62 115.59 1n89 n SER 5 Ca -0.10 -0.01 0.11 0.00 -1.33 0.00 0.00 58.87 57.54 1n89 n SER 5 Cb 0.39 0.91 0.55 0.00 -0.75 0.00 0.00 64.21 65.31 1n89 n SER 5 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1n89 n GLN 6 N -1.35 0.23 -0.00 -1.46 1.13 -1.26 -3.21 117.38 111.46 1n89 n GLN 6 Ca 0.00 0.08 0.02 0.00 -1.94 0.00 0.00 57.00 55.16 1n89 n GLN 6 Cb 0.00 -1.50 -0.03 0.00 0.11 0.00 0.00 30.24 28.82 1n89 n GLN 6 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 1n89 n LEU 7 N -1.35 0.00 -0.17 1.08 4.77 -1.26 -3.98 117.00 116.10 1n89 n LEU 7 Ca 0.09 0.00 -0.03 0.00 -0.03 0.00 0.00 56.01 56.04 1n89 n LEU 7 Cb 0.21 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.34 1n89 n LEU 7 CO 0.19 0.00 0.74 0.00 -1.33 0.00 0.00 177.39 176.99 1n89 h ALA 8 N 0.38 0.30 -0.08 -1.18 0.00 -1.76 0.45 119.26 117.37 1n89 h ALA 8 Ca -0.00 0.20 0.02 0.00 0.00 0.00 0.00 54.91 55.13 1n89 h ALA 8 Cb 0.23 0.44 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 1n89 h ALA 8 CO 0.00 -0.47 0.16 -0.24 0.00 0.00 0.00 179.25 178.70 1n89 h VAL 9 N -0.03 0.24 0.08 0.00 3.04 -1.84 0.08 116.25 117.82 1n89 h VAL 9 Ca 0.25 0.00 -0.26 0.00 -1.01 0.00 0.00 66.70 65.67 1n89 h VAL 9 Cb 0.41 0.86 -0.01 0.00 -2.01 0.00 0.00 31.29 30.54 1n89 h VAL 9 CO -0.55 0.00 -1.28 0.00 -1.01 0.00 0.00 177.57 174.73 1n89 h ALA 11 N 0.71 3.26 -0.59 0.00 0.00 -0.13 0.30 119.26 122.82 1n89 h ALA 11 Ca -0.13 -0.05 0.08 0.00 0.00 0.00 0.00 54.91 54.81 1n89 h ALA 11 Cb 1.93 0.10 -0.06 0.00 0.00 0.00 0.00 17.79 19.75 1n89 h ALA 11 CO 0.16 -1.74 0.25 0.77 0.00 0.00 0.00 179.25 178.69 1n89 h SER 12 N 0.00 0.29 1.15 0.00 0.02 -1.67 0.21 113.55 113.54 1n89 h SER 12 Ca 0.64 0.06 -0.16 0.00 -0.84 0.00 0.00 61.79 61.49 1n89 h SER 12 Cb 2.72 0.02 -0.02 0.00 0.14 0.00 0.00 62.40 65.26 1n89 h SER 12 CO -0.01 0.18 -0.78 0.00 -1.14 0.00 0.00 176.83 175.09 1n89 h ALA 13 N 1.38 0.52 0.34 3.77 0.00 -0.63 -1.40 119.26 123.24 1n89 h ALA 13 Ca 0.29 -0.71 -0.02 0.00 0.00 0.00 0.00 54.91 54.47 1n89 h ALA 13 Cb 0.30 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1n89 h ALA 13 CO -0.26 0.97 -0.16 0.82 0.00 0.00 0.00 179.25 180.62 1n89 h ILE 14 N 0.00 0.00 0.00 0.00 5.03 -0.98 -2.97 117.51 118.59 1n89 h ILE 14 Ca -0.01 -0.35 0.00 0.00 -0.12 0.00 0.00 64.86 64.39 1n89 h ILE 14 Cb 1.56 0.00 0.00 0.00 -3.03 0.00 0.00 36.82 35.35 1n89 h ILE 14 CO 0.10 0.00 0.00 0.18 -0.68 0.00 0.00 178.15 177.75 1n89 n LEU 15 N -4.19 0.74 0.12 1.44 4.77 0.64 -4.39 117.00 116.14 1n89 n LEU 15 Ca -0.06 0.50 -0.10 0.00 -0.03 0.00 0.00 56.01 56.32 1n89 n LEU 15 Cb 0.18 -0.25 -0.06 0.00 -2.33 0.00 0.00 43.42 40.96 1n89 n LEU 15 CO 0.14 -0.25 0.51 0.28 -1.33 0.00 0.00 177.39 176.74 1n89 h SER 16 N 0.00 -0.89 -0.07 -1.43 0.02 -1.63 -3.48 113.55 106.07 1n89 h SER 16 Ca 0.00 0.08 0.00 0.00 -0.84 0.00 0.00 61.79 61.03 1n89 h SER 16 Cb 0.00 0.31 0.00 0.00 0.14 0.00 0.00 62.40 62.85 1n89 h SER 16 CO 0.00 -0.36 0.00 0.61 -1.14 0.00 0.00 176.83 175.94 1n89 n GLY 17 N -1.31 1.42 0.18 -3.77 0.00 -0.55 -5.00 105.19 96.15 1n89 n GLY 17 Ca -0.06 -0.21 -0.14 0.00 0.00 0.00 0.00 46.02 45.61 1n89 n GLY 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n89 h ALA 18 N 0.00 -0.37 0.00 4.61 0.00 -1.79 -3.49 119.26 118.22 1n89 h ALA 18 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1n89 h ALA 18 Cb 0.25 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1n89 h ALA 18 CO 0.00 -0.57 0.00 0.36 0.00 0.00 0.00 179.25 179.04 1n89 n LYS 19 N -5.13 0.00 -0.94 0.00 -0.00 -1.26 -5.10 118.16 105.73 1n89 n LYS 19 Ca -0.09 0.00 -0.28 0.00 -0.00 0.00 0.00 58.31 57.93 1n89 n LYS 19 Cb 0.24 0.00 0.24 0.00 -0.00 0.00 0.00 35.03 35.51 1n89 n LYS 19 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.40 177.05 1n89 n PRO 20 N -0.07 -3.11 -3.64 -1.58 -0.04 -1.26 -4.49 135.00 120.81 1n89 n PRO 20 Ca 0.00 -1.63 -0.05 0.00 -0.04 0.00 0.00 63.50 61.78 1n89 n PRO 20 Cb 0.00 -1.55 -0.07 0.00 -0.04 0.00 0.00 33.50 31.84 1n89 n PRO 20 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1n89 s SER 21 N -4.20 -0.81 0.54 3.54 0.01 -1.26 -5.03 113.70 106.49 1n89 s SER 21 Ca 0.66 1.30 0.23 0.00 1.31 0.00 0.00 55.95 59.45 1n89 s SER 21 Cb -0.07 1.35 1.42 0.00 0.21 0.00 0.00 66.02 68.93 1n89 s SER 21 CO 0.51 -0.20 2.08 1.23 0.41 0.00 0.00 173.24 177.27 1n89 h GLY 22 N 6.73 0.00 0.49 3.44 0.00 -2.01 -2.08 103.07 109.65 1n89 h GLY 22 Ca -0.29 0.00 0.07 0.00 0.00 0.00 0.00 47.33 47.11 1n89 h GLY 22 CO 0.17 0.00 0.13 -2.09 0.00 0.00 0.00 176.54 174.75 1n89 h GLU 23 N 0.00 0.28 -0.55 4.80 4.81 -1.99 -0.17 114.58 121.76 1n89 h GLU 23 Ca 0.12 -0.02 0.16 0.00 -0.13 0.00 0.00 59.36 59.49 1n89 h GLU 23 Cb 0.52 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.82 1n89 h GLU 23 CO -0.00 0.18 0.39 0.00 -0.73 0.00 0.00 179.01 178.86 1n89 h GLY 26 N 1.15 0.13 0.65 0.00 0.00 -0.12 -3.22 103.07 101.65 1n89 h GLY 26 Ca -0.10 -0.32 -0.03 0.00 0.00 0.00 0.00 47.33 46.87 1n89 h GLY 26 CO 0.18 0.28 -0.31 3.43 0.00 0.00 0.00 176.54 180.12 1n89 h ASN 27 N 0.03 -0.74 -0.70 0.19 4.21 -0.12 -2.91 115.58 115.55 1n89 h ASN 27 Ca -0.06 0.03 0.20 0.00 1.21 0.00 0.00 56.30 57.68 1n89 h ASN 27 Cb 1.85 0.19 -0.03 0.00 -1.12 0.00 0.00 38.32 39.22 1n89 h ASN 27 CO 0.16 -0.40 0.62 0.17 -1.29 0.00 0.00 177.43 176.70 1n89 h LEU 28 N -1.13 0.00 -0.73 1.61 8.10 -1.65 0.11 115.31 121.62 1n89 h LEU 28 Ca -0.09 0.00 0.12 0.00 0.11 0.00 0.00 57.88 58.02 1n89 h LEU 28 Cb 0.67 0.00 -0.08 0.00 -0.44 0.00 0.00 40.66 40.81 1n89 h LEU 28 CO 0.15 0.00 0.33 -0.09 -4.11 0.00 0.00 178.44 174.72 1n89 h ARG 29 N 0.00 0.51 -0.17 0.17 2.43 -1.52 0.64 114.38 116.44 1n89 h ARG 29 Ca 0.33 -0.03 0.05 0.00 -0.81 0.00 0.00 59.98 59.52 1n89 h ARG 29 Cb 1.58 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 31.00 1n89 h ARG 29 CO -0.00 0.34 0.26 0.00 -1.51 0.00 0.00 179.97 179.06 1n89 h ALA 30 N 1.48 1.69 -0.52 2.80 0.00 -0.83 -3.01 119.26 120.87 1n89 h ALA 30 Ca 0.38 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.28 1n89 h ALA 30 Cb 0.49 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1n89 h ALA 30 CO -0.33 -0.35 0.00 1.04 0.00 0.00 0.00 179.25 179.61 1n89 n GLN 31 N -3.51 0.00 -1.23 0.00 1.13 0.22 -4.89 117.38 109.11 1n89 n GLN 31 Ca 0.02 0.39 -0.09 0.00 -1.94 0.00 0.00 57.00 55.37 1n89 n GLN 31 Cb 0.37 -0.89 -0.04 0.00 0.11 0.00 0.00 30.24 29.80 1n89 n GLN 31 CO 0.00 0.00 0.00 0.94 -1.44 0.00 0.00 177.06 176.56 1n89 n GLN 32 N -1.77 -1.30 0.00 -1.09 -0.06 -0.76 -4.28 117.38 108.13 1n89 n GLN 32 Ca 0.00 0.58 0.00 0.00 -2.00 0.00 0.00 57.00 55.58 1n89 n GLN 32 Cb 0.00 -4.70 0.00 0.00 -4.06 0.00 0.00 30.24 21.48 1n89 n GLN 32 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1n89 n GLY 33 N -0.13 0.00 0.00 1.69 0.00 -1.26 -5.01 105.19 100.48 1n89 n GLY 33 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1n89 n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n89 h PHE 35 N 0.00 -0.48 -0.99 0.00 -5.15 -1.92 -1.48 116.94 106.93 1n89 h PHE 35 Ca 0.00 0.03 0.19 0.00 -0.20 0.00 0.00 57.97 57.99 1n89 h PHE 35 Cb 0.13 0.24 -0.10 0.00 0.22 0.00 0.00 35.95 36.44 1n89 h PHE 35 CO 0.00 -0.26 0.61 0.00 -2.00 0.00 0.00 178.31 176.66 1n89 h GLN 37 N 0.71 0.00 0.00 0.00 4.20 -1.59 0.89 115.11 119.32 1n89 h GLN 37 Ca 0.55 0.00 -0.15 0.00 0.06 0.00 0.00 58.65 59.12 1n89 h GLN 37 Cb 0.93 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.69 1n89 h GLN 37 CO -0.33 0.00 -0.70 1.88 -0.67 0.00 0.00 178.83 179.01 1n89 h TYR 38 N 0.00 0.00 -0.33 2.96 0.05 -0.59 -3.12 116.97 115.94 1n89 h TYR 38 Ca 0.14 0.00 0.10 0.00 0.05 0.00 0.00 58.73 59.02 1n89 h TYR 38 Cb 0.63 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.35 1n89 h TYR 38 CO 0.00 0.70 0.44 0.00 -1.05 0.00 0.00 178.16 178.26 1n89 h ALA 39 N 1.30 1.97 0.00 3.88 0.00 -0.75 0.47 119.26 126.13 1n89 h ALA 39 Ca -0.01 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.78 1n89 h ALA 39 Cb 1.40 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.19 1n89 h ALA 39 CO 0.09 -0.61 -1.93 1.17 0.00 0.00 0.00 179.25 177.97 1n89 n LYS 40 N -3.52 0.83 -1.56 0.00 3.00 -1.21 -4.83 118.16 110.86 1n89 n LYS 40 Ca 0.06 -0.10 -0.44 0.00 -0.00 0.00 0.00 58.31 57.82 1n89 n LYS 40 Cb 0.59 -1.42 -0.04 0.00 0.00 0.00 0.00 35.03 34.16 1n89 n LYS 40 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 1n89 n ASP 41 N -2.30 2.94 -4.51 3.14 2.03 0.16 -4.90 116.55 113.10 1n89 n ASP 41 Ca -0.12 0.19 -0.42 0.00 0.52 0.00 0.00 54.79 54.96 1n89 n ASP 41 Cb 0.68 -1.49 -0.03 0.00 -0.72 0.00 0.00 41.12 39.55 1n89 n ASP 41 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1n89 s PRO 42 N 6.50 3.24 0.00 -0.67 0.04 -1.26 -4.38 135.00 138.47 1n89 s PRO 42 Ca 1.03 -0.69 0.00 0.00 0.04 0.00 0.00 61.00 61.37 1n89 s PRO 42 Cb -0.44 -4.40 0.00 0.00 0.04 0.00 0.00 34.50 29.70 1n89 s PRO 42 CO 0.37 -2.00 0.00 0.25 0.04 0.00 0.00 177.00 175.66 1n89 n THR 43 N 6.20 0.00 -0.05 1.26 -2.24 -1.26 -5.01 114.28 113.17 1n89 n THR 43 Ca 0.06 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.81 1n89 n THR 43 Cb 0.48 -0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.70 1n89 n THR 43 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1n89 n TYR 44 N -2.04 0.70 0.00 4.78 4.01 -1.26 -4.95 117.16 118.40 1n89 n TYR 44 Ca 0.00 0.30 0.00 0.00 -0.16 0.00 0.00 57.90 58.04 1n89 n TYR 44 Cb 0.00 -0.64 0.00 0.00 -0.31 0.00 0.00 39.34 38.39 1n89 n TYR 44 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1n89 n GLY 45 N 1.65 1.35 0.10 2.72 0.00 -1.26 -4.39 105.19 105.35 1n89 n GLY 45 Ca -0.05 -0.02 0.11 0.00 0.00 0.00 0.00 46.02 46.05 1n89 n GLY 45 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1n89 n GLN 46 N 0.00 0.15 -0.06 1.61 7.27 -1.26 -2.12 117.38 122.96 1n89 n GLN 46 Ca 0.00 0.39 -0.06 0.00 0.07 0.00 0.00 57.00 57.40 1n89 n GLN 46 Cb 0.00 -1.79 -0.06 0.00 2.41 0.00 0.00 30.24 30.81 1n89 n GLN 46 CO 0.00 0.00 0.00 -0.92 0.07 0.00 0.00 177.06 176.21 1n89 h TYR 47 N 0.00 0.00 0.39 3.69 5.03 -1.94 -3.13 116.97 121.00 1n89 h TYR 47 Ca 0.00 0.00 -0.02 0.00 2.58 0.00 0.00 58.73 61.29 1n89 h TYR 47 Cb 0.32 0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.61 1n89 h TYR 47 CO 0.00 0.44 -0.19 0.82 -1.32 0.00 0.00 178.16 177.91 1n89 h ILE 48 N -1.00 0.53 -0.03 1.81 1.08 -1.93 -3.05 117.51 114.93 1n89 h ILE 48 Ca -0.00 -0.53 -0.02 0.00 -0.39 0.00 0.00 64.86 63.92 1n89 h ILE 48 Cb 0.44 0.76 -0.01 0.00 -3.07 0.00 0.00 36.82 34.94 1n89 h ILE 48 CO -0.00 0.09 0.02 0.54 -0.69 0.00 0.00 178.15 178.11 1n89 n ARG 49 N -5.19 1.04 -1.94 2.37 1.74 -0.90 -4.75 116.66 109.03 1n89 n ARG 49 Ca -0.10 -0.10 -0.31 0.00 -0.77 0.00 0.00 57.85 56.58 1n89 n ARG 49 Cb 0.28 -1.04 0.01 0.00 -1.02 0.00 0.00 32.46 30.70 1n89 n ARG 49 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1n89 s SER 50 N 0.98 6.14 -0.05 0.55 0.15 -1.15 -4.92 113.70 115.40 1n89 s SER 50 Ca 0.02 1.34 -0.21 0.00 0.70 0.00 0.00 55.95 57.80 1n89 s SER 50 Cb 0.02 -2.38 -0.31 0.00 -1.71 0.00 0.00 66.02 61.63 1n89 s SER 50 CO 0.00 -0.90 0.84 1.55 1.20 0.00 0.00 173.24 175.94 1n89 h PRO 51 N -0.31 0.30 0.00 5.44 0.13 -1.90 -3.35 132.00 132.32 1n89 h PRO 51 Ca -0.44 -0.52 -0.10 0.00 -0.87 0.00 0.00 66.00 64.07 1n89 h PRO 51 Cb 1.20 0.19 -0.01 0.00 0.13 0.00 0.00 31.00 32.51 1n89 h PRO 51 CO 0.62 1.25 -0.52 0.45 -0.23 0.00 0.00 178.00 179.57 1n89 h HIS 52 N -0.34 0.00 -0.20 1.56 3.86 -1.90 -3.34 115.15 114.80 1n89 h HIS 52 Ca -0.18 0.00 0.04 0.00 -1.16 0.00 0.00 60.37 59.08 1n89 h HIS 52 Cb 1.69 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 30.12 1n89 h HIS 52 CO 0.18 0.45 -0.06 0.00 0.86 0.00 0.00 177.93 179.36 1n89 h ALA 53 N 1.55 0.11 -0.49 2.45 0.00 -1.84 -1.34 119.26 119.70 1n89 h ALA 53 Ca -0.01 0.08 0.09 0.00 0.00 0.00 0.00 54.91 55.06 1n89 h ALA 53 Cb 1.36 0.17 -0.03 0.00 0.00 0.00 0.00 17.79 19.30 1n89 h ALA 53 CO 0.06 -0.49 0.34 0.00 0.00 0.00 0.00 179.25 179.15 1n89 h ARG 54 N -0.02 0.28 -0.50 0.00 3.08 -1.70 -1.05 114.38 114.46 1n89 h ARG 54 Ca 0.10 -0.02 -0.13 0.00 0.07 0.00 0.00 59.98 60.00 1n89 h ARG 54 Cb 0.17 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.15 1n89 h ARG 54 CO -0.22 0.18 -0.19 0.22 -1.07 0.00 0.00 179.97 178.89 1n89 h ASP 55 N 0.29 1.03 0.03 7.04 3.58 -1.42 -2.60 116.42 124.36 1n89 h ASP 55 Ca 0.23 -0.39 0.01 0.00 0.42 0.00 0.00 57.03 57.30 1n89 h ASP 55 Cb 0.52 -0.28 -0.01 0.00 1.72 0.00 0.00 39.33 41.27 1n89 h ASP 55 CO -0.05 1.19 -0.06 0.74 -2.88 0.00 0.00 179.24 178.18 1n89 h THR 56 N 0.87 0.85 -0.28 2.25 2.02 -0.63 0.38 112.91 118.38 1n89 h THR 56 Ca 0.12 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.34 1n89 h THR 56 Cb 0.78 0.85 -0.04 0.00 -1.74 0.00 0.00 68.15 68.00 1n89 h THR 56 CO 0.06 0.00 0.04 -0.07 0.37 0.00 0.00 175.52 175.92 1n89 h LEU 57 N -0.12 -0.02 -0.73 2.58 4.07 -1.46 -1.92 115.31 117.71 1n89 h LEU 57 Ca 0.02 0.05 -0.04 0.00 0.08 0.00 0.00 57.88 57.98 1n89 h LEU 57 Cb 0.13 0.07 -0.03 0.00 1.08 0.00 0.00 40.66 41.92 1n89 h LEU 57 CO -0.04 0.02 0.30 0.74 -1.08 0.00 0.00 178.44 178.37 1n89 h THR 58 N 0.13 1.25 -0.89 0.22 2.02 -1.23 0.25 112.91 114.66 1n89 h THR 58 Ca 0.13 -0.77 0.17 0.00 0.77 0.00 0.00 66.41 66.71 1n89 h THR 58 Cb 0.15 0.40 -0.07 0.00 -1.74 0.00 0.00 68.15 66.88 1n89 h THR 58 CO -0.18 0.31 0.58 -1.28 0.37 0.00 0.00 175.52 175.32 1n89 h SER 59 N 1.04 0.53 0.82 4.18 0.87 0.47 0.29 113.55 121.75 1n89 h SER 59 Ca 0.24 0.04 -0.24 0.00 -1.23 0.00 0.00 61.79 60.61 1n89 h SER 59 Cb 0.20 -0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 62.09 1n89 h SER 59 CO -0.02 0.24 -1.13 0.00 -0.53 0.00 0.00 176.83 175.39 1n89 n GLY 61 N 1.44 -0.29 0.07 0.00 0.00 0.10 -5.01 105.19 101.51 1n89 n GLY 61 Ca -0.04 0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1n89 n GLY 61 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1n89 n LEU 62 N -3.07 0.00 0.00 0.99 -0.00 -1.25 -5.07 117.00 108.60 1n89 n LEU 62 Ca -0.15 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.86 1n89 n LEU 62 Cb 0.61 -0.02 0.00 0.00 -0.00 0.00 0.00 43.42 44.01 1n89 n LEU 62 CO 0.43 -0.06 0.00 0.00 -0.00 0.00 0.00 177.39 177.76 1n89 n ALA 63 N -1.35 0.00 -2.86 1.47 0.00 -1.26 -5.14 120.51 111.37 1n89 n ALA 63 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.29 1n89 n ALA 63 Cb 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.31 1n89 n ALA 63 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1n89 s VAL 64 N -2.27 0.29 0.00 0.00 1.01 -1.26 -4.77 120.40 113.41 1n89 s VAL 64 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 61.98 61.84 1n89 s VAL 64 Cb 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 36.38 36.12 1n89 s VAL 64 CO 0.00 0.09 0.00 -0.81 0.00 0.00 0.00 175.10 174.38 1n89 n PRO 65 N 3.08 1.30 -3.09 2.72 -0.04 -1.26 -4.62 135.00 133.09 1n89 n PRO 65 Ca -0.14 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.19 1n89 n PRO 65 Cb 0.58 0.00 0.05 0.00 -0.04 0.00 0.00 33.50 34.09 1n89 n PRO 65 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1n89 n HIS 66 N -0.85 -1.66 0.00 0.54 8.25 -1.26 -5.08 115.22 115.15 1n89 n HIS 66 Ca 0.00 0.62 0.00 0.00 -0.26 0.00 0.00 57.72 58.08 1n89 n HIS 66 Cb 0.00 -3.67 0.00 0.00 1.12 0.00 0.00 29.99 27.44 1n89 n HIS 66 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98