#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n89 h GLN 3 N 3.49 0.43 -3.69 0.00 1.08 -2.01 -3.48 115.11 110.93 1n89 h GLN 3 Ca -0.23 -0.72 -0.41 0.00 -1.45 0.00 0.00 58.65 55.84 1n89 h GLN 3 Cb 0.52 0.27 0.02 0.00 -0.05 0.00 0.00 27.48 28.23 1n89 h GLN 3 CO 0.06 1.34 -0.57 0.00 -0.95 0.00 0.00 178.83 178.72 1n89 n ALA 4 N -2.69 -0.79 0.00 3.87 0.00 -1.26 -4.72 120.51 114.92 1n89 n ALA 4 Ca -0.15 0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.52 1n89 n ALA 4 Cb 0.96 -3.03 0.00 0.00 0.00 0.00 0.00 19.45 17.38 1n89 n ALA 4 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1n89 n SER 5 N -2.23 0.00 0.15 0.00 7.64 -1.26 -4.72 113.62 113.19 1n89 n SER 5 Ca -0.18 0.00 0.12 0.00 1.01 0.00 0.00 58.87 59.81 1n89 n SER 5 Cb 0.66 0.00 0.53 0.00 -1.01 0.00 0.00 64.21 64.39 1n89 n SER 5 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1n89 n GLN 6 N -1.10 0.18 -0.01 1.43 6.02 -1.26 -2.22 117.38 120.42 1n89 n GLN 6 Ca 0.00 0.51 0.06 0.00 -0.01 0.00 0.00 57.00 57.56 1n89 n GLN 6 Cb 0.00 -1.92 -0.10 0.00 1.02 0.00 0.00 30.24 29.25 1n89 n GLN 6 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1n89 n LEU 7 N -2.27 0.00 -0.29 1.08 4.77 -1.26 -4.58 117.00 114.45 1n89 n LEU 7 Ca 0.01 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 56.10 1n89 n LEU 7 Cb 0.16 0.01 0.27 0.00 -2.33 0.00 0.00 43.42 41.53 1n89 n LEU 7 CO 0.16 0.01 1.00 0.00 -1.33 0.00 0.00 177.39 177.23 1n89 h ALA 8 N 1.13 1.28 -0.19 -1.18 0.00 -1.73 0.74 119.26 119.31 1n89 h ALA 8 Ca -0.01 0.17 0.05 0.00 0.00 0.00 0.00 54.91 55.13 1n89 h ALA 8 Cb 0.60 0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 1n89 h ALA 8 CO 0.00 -0.36 0.22 -0.24 0.00 0.00 0.00 179.25 178.87 1n89 h VAL 9 N 0.34 0.43 0.01 0.00 3.04 -1.81 0.20 116.25 118.46 1n89 h VAL 9 Ca 0.52 0.00 -0.28 0.00 -1.01 0.00 0.00 66.70 65.93 1n89 h VAL 9 Cb 0.98 0.82 -0.04 0.00 -2.01 0.00 0.00 31.29 31.04 1n89 h VAL 9 CO -0.55 0.00 -1.62 0.00 -1.01 0.00 0.00 177.57 174.40 1n89 h ALA 11 N 0.93 3.50 -0.77 0.00 0.00 0.12 0.91 119.26 123.95 1n89 h ALA 11 Ca -0.25 -0.04 0.13 0.00 0.00 0.00 0.00 54.91 54.74 1n89 h ALA 11 Cb 1.98 0.13 -0.05 0.00 0.00 0.00 0.00 17.79 19.85 1n89 h ALA 11 CO 0.09 -1.99 0.51 0.77 0.00 0.00 0.00 179.25 178.63 1n89 h SER 12 N 0.01 0.51 0.14 0.00 0.02 -1.70 0.28 113.55 112.81 1n89 h SER 12 Ca 0.80 0.02 -0.27 0.00 -0.84 0.00 0.00 61.79 61.50 1n89 h SER 12 Cb 3.12 -0.08 0.01 0.00 0.14 0.00 0.00 62.40 65.59 1n89 h SER 12 CO -0.05 0.28 -1.33 0.00 -1.14 0.00 0.00 176.83 174.59 1n89 h ALA 13 N 1.63 0.10 0.33 3.77 0.00 0.57 0.17 119.26 125.83 1n89 h ALA 13 Ca 0.37 -1.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.27 1n89 h ALA 13 Cb 0.67 0.38 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1n89 h ALA 13 CO -0.14 0.75 -0.16 0.82 0.00 0.00 0.00 179.25 180.52 1n89 h ILE 14 N -0.25 0.68 0.00 0.00 5.03 -1.22 -2.87 117.51 118.88 1n89 h ILE 14 Ca -0.27 -0.09 0.00 0.00 -0.12 0.00 0.00 64.86 64.38 1n89 h ILE 14 Cb 1.79 0.73 0.00 0.00 -3.03 0.00 0.00 36.82 36.31 1n89 h ILE 14 CO 0.10 0.02 0.00 0.18 -0.68 0.00 0.00 178.15 177.77 1n89 n LEU 15 N -5.26 1.88 0.00 1.44 4.77 0.94 -4.69 117.00 116.09 1n89 n LEU 15 Ca -0.10 0.14 0.00 0.00 -0.03 0.00 0.00 56.01 56.02 1n89 n LEU 15 Cb 0.21 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.30 1n89 n LEU 15 CO 0.35 0.00 0.36 -0.24 -1.33 0.00 0.00 177.39 176.53 1n89 n SER 16 N -0.46 0.00 0.00 -1.43 2.88 -1.10 -5.00 113.62 108.51 1n89 n SER 16 Ca 0.00 0.73 0.00 0.00 -1.33 0.00 0.00 58.87 58.27 1n89 n SER 16 Cb 0.00 -0.23 0.00 0.00 -0.75 0.00 0.00 64.21 63.23 1n89 n SER 16 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1n89 n GLY 17 N -0.70 1.17 0.00 0.46 0.00 0.57 -4.96 105.19 101.73 1n89 n GLY 17 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1n89 n GLY 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n89 n ALA 18 N 0.00 -0.14 -3.64 4.61 0.00 -1.20 -4.95 120.51 115.19 1n89 n ALA 18 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.35 1n89 n ALA 18 Cb 0.00 0.03 -0.07 0.00 0.00 0.00 0.00 19.45 19.41 1n89 n ALA 18 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 1n89 s LYS 19 N -1.61 0.57 0.24 0.00 0.00 -1.26 -5.06 119.74 112.61 1n89 s LYS 19 Ca 0.00 0.73 -0.03 0.00 0.00 0.00 0.00 55.97 56.67 1n89 s LYS 19 Cb 0.00 0.25 0.05 0.00 0.00 0.00 0.00 37.83 38.13 1n89 s LYS 19 CO 0.00 -0.08 0.12 -2.30 0.00 0.00 0.00 175.35 173.09 1n89 n PRO 20 N 2.65 -1.15 -3.64 1.78 -0.02 -1.26 -4.76 135.00 128.60 1n89 n PRO 20 Ca -0.14 -0.20 -0.05 0.00 -2.02 0.00 0.00 63.50 61.08 1n89 n PRO 20 Cb 0.56 -0.33 -0.07 0.00 -0.02 0.00 0.00 33.50 33.65 1n89 n PRO 20 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 1n89 s SER 21 N -1.84 -0.21 0.12 2.55 0.01 -1.26 -5.05 113.70 108.02 1n89 s SER 21 Ca 0.09 0.39 -0.15 0.00 1.31 0.00 0.00 55.95 57.58 1n89 s SER 21 Cb -0.02 0.39 -0.02 0.00 0.21 0.00 0.00 66.02 66.58 1n89 s SER 21 CO 0.08 -0.08 1.59 1.23 0.41 0.00 0.00 173.24 176.47 1n89 h GLY 22 N 3.43 0.70 -0.16 3.44 0.00 -1.97 -2.90 103.07 105.60 1n89 h GLY 22 Ca -0.26 -0.48 0.27 0.00 0.00 0.00 0.00 47.33 46.86 1n89 h GLY 22 CO 0.16 0.44 0.67 -2.09 0.00 0.00 0.00 176.54 175.73 1n89 h GLU 23 N 0.49 0.37 0.26 4.80 4.81 -1.99 -2.02 114.58 121.29 1n89 h GLU 23 Ca 0.11 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.32 1n89 h GLU 23 Cb 0.39 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.67 1n89 h GLU 23 CO 0.01 0.24 -0.35 0.00 -0.73 0.00 0.00 179.01 178.18 1n89 h GLY 26 N 0.00 0.49 0.65 0.00 0.00 -0.96 -3.34 103.07 99.91 1n89 h GLY 26 Ca 0.16 -1.26 0.03 0.00 0.00 0.00 0.00 47.33 46.27 1n89 h GLY 26 CO -0.00 1.10 -0.06 3.43 0.00 0.00 0.00 176.54 181.01 1n89 h ASN 27 N 0.12 -0.20 -0.98 0.19 4.21 0.11 -2.13 115.58 116.91 1n89 h ASN 27 Ca -0.22 0.05 0.20 0.00 1.21 0.00 0.00 56.30 57.55 1n89 h ASN 27 Cb 2.10 0.12 -0.09 0.00 -1.12 0.00 0.00 38.32 39.32 1n89 h ASN 27 CO 0.24 -0.08 0.62 0.17 -1.29 0.00 0.00 177.43 177.09 1n89 h LEU 28 N -0.04 0.63 -0.49 1.61 8.10 -1.66 -0.98 115.31 122.47 1n89 h LEU 28 Ca 0.08 0.07 0.08 0.00 0.11 0.00 0.00 57.88 58.22 1n89 h LEU 28 Cb 0.15 -0.04 -0.06 0.00 -0.44 0.00 0.00 40.66 40.27 1n89 h LEU 28 CO -0.17 0.23 0.13 0.03 -4.11 0.00 0.00 178.44 174.54 1n89 h ARG 29 N 0.61 0.27 -0.72 0.17 2.47 -1.50 0.39 114.38 116.07 1n89 h ARG 29 Ca 0.54 -0.02 0.21 0.00 -1.26 0.00 0.00 59.98 59.45 1n89 h ARG 29 Cb 1.05 -0.06 -0.03 0.00 -1.65 0.00 0.00 29.97 29.28 1n89 h ARG 29 CO -0.30 0.18 0.59 0.00 0.56 0.00 0.00 179.97 181.00 1n89 h ALA 30 N 1.36 2.59 -1.25 0.04 0.00 -1.17 -2.92 119.26 117.91 1n89 h ALA 30 Ca 0.24 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1n89 h ALA 30 Cb 0.30 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1n89 h ALA 30 CO -0.29 -0.96 0.00 1.04 0.00 0.00 0.00 179.25 179.04 1n89 n GLN 31 N -4.05 0.00 -1.24 0.00 6.02 0.12 -4.88 117.38 113.34 1n89 n GLN 31 Ca 0.14 0.26 -0.09 0.00 -0.01 0.00 0.00 57.00 57.31 1n89 n GLN 31 Cb 0.85 -0.74 -0.04 0.00 1.02 0.00 0.00 30.24 31.33 1n89 n GLN 31 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 177.06 176.99 1n89 n GLN 32 N -1.44 -1.24 0.00 -1.09 7.27 0.03 -4.61 117.38 116.30 1n89 n GLN 32 Ca 0.00 0.55 0.00 0.00 0.07 0.00 0.00 57.00 57.62 1n89 n GLN 32 Cb 0.00 -4.69 0.00 0.00 2.41 0.00 0.00 30.24 27.96 1n89 n GLN 32 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1n89 n GLY 33 N -0.15 0.19 0.30 1.69 0.00 -1.26 -4.75 105.19 101.20 1n89 n GLY 33 Ca -0.09 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.95 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 0.59 0.85 0.05 0.00 3.57 -1.90 1.14 116.94 121.24 1n89 h PHE 35 Ca 0.15 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.67 1n89 h PHE 35 Cb 0.07 -0.28 0.00 0.00 2.79 0.00 0.00 35.95 38.53 1n89 h PHE 35 CO 0.00 0.40 -0.02 0.00 -2.23 0.00 0.00 178.31 176.46 1n89 h GLN 37 N -0.68 0.00 -0.14 0.00 3.07 -1.12 -2.88 115.11 113.36 1n89 h GLN 37 Ca -0.01 0.00 0.04 0.00 0.09 0.00 0.00 58.65 58.77 1n89 h GLN 37 Cb 0.58 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.14 1n89 h GLN 37 CO 0.01 0.16 0.30 1.88 0.09 0.00 0.00 178.83 181.28 1n89 h TYR 38 N 0.00 0.00 0.00 0.06 0.05 0.13 -0.40 116.97 116.81 1n89 h TYR 38 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1n89 h TYR 38 Cb 0.65 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.39 1n89 h TYR 38 CO 0.00 0.00 0.20 0.00 -1.05 0.00 0.00 178.16 177.31 1n89 h ALA 39 N 1.52 1.20 0.00 3.88 0.00 -1.64 0.18 119.26 124.39 1n89 h ALA 39 Ca 0.06 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.87 1n89 h ALA 39 Cb 0.67 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 1n89 h ALA 39 CO -0.00 -0.20 -1.64 1.17 0.00 0.00 0.00 179.25 178.58 1n89 n LYS 40 N -2.89 0.64 -1.63 0.00 4.81 -0.16 -4.90 118.16 114.03 1n89 n LYS 40 Ca -0.02 0.03 -0.45 0.00 -0.87 0.00 0.00 58.31 57.00 1n89 n LYS 40 Cb 0.26 -1.68 -0.04 0.00 0.02 0.00 0.00 35.03 33.58 1n89 n LYS 40 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 1n89 n ASP 41 N -2.62 3.48 0.00 3.14 -0.08 0.62 -4.88 116.55 116.21 1n89 n ASP 41 Ca -0.09 0.69 -0.17 0.00 -1.51 0.00 0.00 54.79 53.70 1n89 n ASP 41 Cb 0.73 -1.46 -0.11 0.00 2.34 0.00 0.00 41.12 42.63 1n89 n ASP 41 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1n89 h PRO 42 N 11.54 0.41 -0.90 -0.67 0.13 -1.91 -2.93 132.00 137.68 1n89 h PRO 42 Ca -0.45 -0.43 0.17 0.00 -0.87 0.00 0.00 66.00 64.42 1n89 h PRO 42 Cb 1.26 0.12 -0.10 0.00 0.13 0.00 0.00 31.00 32.41 1n89 h PRO 42 CO 0.96 1.10 0.48 1.79 -0.23 0.00 0.00 178.00 182.09 1n89 h THR 43 N -0.09 0.68 -0.52 1.56 1.35 -1.97 0.35 112.91 114.26 1n89 h THR 43 Ca -0.07 -0.21 0.00 0.00 -0.55 0.00 0.00 66.41 65.57 1n89 h THR 43 Cb 1.30 -0.00 0.00 0.00 -1.73 0.00 0.00 68.15 67.71 1n89 h THR 43 CO 0.12 0.11 0.00 -1.22 -0.25 0.00 0.00 175.52 174.28 1n89 n TYR 44 N -4.87 1.24 0.22 4.73 4.02 -1.24 -4.39 117.16 116.87 1n89 n TYR 44 Ca 0.20 -0.49 0.13 0.00 -0.01 0.00 0.00 57.90 57.73 1n89 n TYR 44 Cb 0.51 -0.22 0.76 0.00 -0.02 0.00 0.00 39.34 40.37 1n89 n TYR 44 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 1n89 h GLY 45 N 4.47 0.00 2.00 2.72 0.00 -0.09 0.10 103.07 112.27 1n89 h GLY 45 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.26 1n89 h GLY 45 CO 0.20 0.00 -0.34 -1.61 0.00 0.00 0.00 176.54 174.79 1n89 h GLN 46 N 0.00 0.00 0.04 4.80 4.15 -1.77 -0.47 115.11 121.87 1n89 h GLN 46 Ca 0.05 0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.47 1n89 h GLN 46 Cb 0.23 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.92 1n89 h GLN 46 CO -0.00 0.34 -0.02 -0.92 -1.93 0.00 0.00 178.83 176.30 1n89 h TYR 47 N 0.00 -0.05 -0.29 3.99 3.20 -1.31 -3.22 116.97 119.29 1n89 h TYR 47 Ca -0.00 -0.00 -0.12 0.00 3.14 0.00 0.00 58.73 61.75 1n89 h TYR 47 Cb 0.84 0.02 -0.00 0.00 1.54 0.00 0.00 36.73 39.12 1n89 h TYR 47 CO 0.00 0.59 -0.28 0.82 -1.64 0.00 0.00 178.16 177.66 1n89 h ILE 48 N -0.82 1.30 -0.04 1.81 2.04 -1.53 -3.06 117.51 117.21 1n89 h ILE 48 Ca -0.01 -1.44 -0.02 0.00 1.00 0.00 0.00 64.86 64.39 1n89 h ILE 48 Cb 0.67 1.58 -0.01 0.00 -0.74 0.00 0.00 36.82 38.32 1n89 h ILE 48 CO 0.01 0.46 0.02 0.54 0.00 0.00 0.00 178.15 179.18 1n89 n ARG 49 N -4.27 1.07 -1.95 2.37 1.74 -0.19 -4.60 116.66 110.83 1n89 n ARG 49 Ca -0.04 -0.12 -0.30 0.00 -0.77 0.00 0.00 57.85 56.62 1n89 n ARG 49 Cb 0.47 -1.15 0.04 0.00 -1.02 0.00 0.00 32.46 30.80 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 0.72 5.47 -0.10 0.55 0.15 -1.16 -4.94 113.70 114.38 1n89 s SER 50 Ca 0.02 1.07 -0.24 0.00 0.70 0.00 0.00 55.95 57.51 1n89 s SER 50 Cb 0.02 -1.90 -0.28 0.00 -1.71 0.00 0.00 66.02 62.15 1n89 s SER 50 CO 0.00 -1.30 0.78 1.55 1.20 0.00 0.00 173.24 175.47 1n89 h PRO 51 N -0.59 0.16 0.00 5.44 0.14 -1.90 -3.35 132.00 131.90 1n89 h PRO 51 Ca -0.45 -0.27 0.00 0.00 0.14 0.00 0.00 66.00 65.42 1n89 h PRO 51 Cb 1.25 0.10 0.00 0.00 0.14 0.00 0.00 31.00 32.50 1n89 h PRO 51 CO 0.63 1.13 -0.08 0.45 0.14 0.00 0.00 178.00 180.28 1n89 h HIS 52 N -0.65 0.00 0.85 1.56 3.86 -1.91 -3.33 115.15 115.52 1n89 h HIS 52 Ca -0.11 0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.06 1n89 h HIS 52 Cb 1.38 0.00 0.01 0.00 1.06 0.00 0.00 27.41 29.86 1n89 h HIS 52 CO 0.22 0.00 -0.41 0.00 0.86 0.00 0.00 177.93 178.60 1n89 h ALA 53 N 2.22 -1.14 -0.39 2.45 0.00 -1.86 -1.43 119.26 119.12 1n89 h ALA 53 Ca 0.00 -0.25 0.06 0.00 0.00 0.00 0.00 54.91 54.71 1n89 h ALA 53 Cb 0.89 0.44 -0.02 0.00 0.00 0.00 0.00 17.79 19.10 1n89 h ALA 53 CO 0.00 -1.10 0.26 0.00 0.00 0.00 0.00 179.25 178.41 1n89 h ARG 54 N -1.21 0.27 -0.32 0.00 3.08 -1.70 -1.80 114.38 112.70 1n89 h ARG 54 Ca -0.12 -0.02 -0.05 0.00 0.07 0.00 0.00 59.98 59.87 1n89 h ARG 54 Cb 0.88 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.86 1n89 h ARG 54 CO 0.19 0.18 -0.00 0.22 -1.07 0.00 0.00 179.97 179.49 1n89 h ASP 55 N 0.28 0.56 0.16 7.04 3.58 -1.62 0.16 116.42 126.57 1n89 h ASP 55 Ca 0.17 -0.31 -0.01 0.00 0.42 0.00 0.00 57.03 57.30 1n89 h ASP 55 Cb 0.32 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 41.22 1n89 h ASP 55 CO -0.03 0.73 -0.08 0.74 -2.88 0.00 0.00 179.24 177.72 1n89 h THR 56 N 0.36 0.85 -0.41 2.25 2.02 -0.42 0.65 112.91 118.21 1n89 h THR 56 Ca 0.09 -0.03 -0.03 0.00 0.77 0.00 0.00 66.41 67.21 1n89 h THR 56 Cb 0.45 0.87 -0.02 0.00 -1.74 0.00 0.00 68.15 67.71 1n89 h THR 56 CO 0.02 0.01 0.14 -0.07 0.37 0.00 0.00 175.52 175.98 1n89 h LEU 57 N -0.23 0.60 -0.64 2.58 4.07 -1.41 -2.80 115.31 117.48 1n89 h LEU 57 Ca -0.02 -0.19 -0.04 0.00 0.08 0.00 0.00 57.88 57.70 1n89 h LEU 57 Cb 0.17 -0.16 -0.03 0.00 1.08 0.00 0.00 40.66 41.73 1n89 h LEU 57 CO 0.04 0.63 0.23 0.74 -1.08 0.00 0.00 178.44 179.00 1n89 h THR 58 N 0.53 1.24 -0.98 0.22 2.02 -0.51 0.51 112.91 115.93 1n89 h THR 58 Ca 0.14 -0.79 0.19 0.00 0.77 0.00 0.00 66.41 66.72 1n89 h THR 58 Cb 0.24 0.56 -0.10 0.00 -1.74 0.00 0.00 68.15 67.11 1n89 h THR 58 CO -0.01 0.31 0.61 -1.28 0.37 0.00 0.00 175.52 175.52 1n89 h SER 59 N 0.90 0.69 0.24 4.18 0.87 0.54 0.22 113.55 121.19 1n89 h SER 59 Ca 0.21 0.08 -0.32 0.00 -1.23 0.00 0.00 61.79 60.53 1n89 h SER 59 Cb 0.24 -0.04 0.03 0.00 -0.44 0.00 0.00 62.40 62.19 1n89 h SER 59 CO -0.01 0.25 -1.43 0.00 -0.53 0.00 0.00 176.83 175.11 1n89 n GLY 61 N 1.73 -0.60 0.56 0.00 0.00 0.17 -4.98 105.19 102.07 1n89 n GLY 61 Ca -0.18 0.26 -0.05 0.00 0.00 0.00 0.00 46.02 46.06 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 -3.42 1.53 -3.71 0.99 -0.00 -1.25 -5.07 117.00 106.07 1n89 n LEU 62 Ca -0.16 0.24 -0.11 0.00 -0.00 0.00 0.00 56.01 55.97 1n89 n LEU 62 Cb 0.63 -0.54 -0.11 0.00 -0.00 0.00 0.00 43.42 43.40 1n89 n LEU 62 CO 0.53 -0.51 0.04 0.00 -0.00 0.00 0.00 177.39 177.45 1n89 s ALA 63 N -2.46 -0.97 -0.09 1.47 0.00 -1.26 -5.16 121.76 113.29 1n89 s ALA 63 Ca -0.15 1.36 -0.00 0.00 0.00 0.00 0.00 51.96 53.17 1n89 s ALA 63 Cb 0.02 -0.82 -0.03 0.00 0.00 0.00 0.00 23.12 22.29 1n89 s ALA 63 CO 0.22 -0.24 -0.06 0.54 0.00 0.00 0.00 175.76 176.23 1n89 s VAL 64 N 1.08 3.79 0.00 0.00 0.11 -1.26 -4.96 120.40 119.15 1n89 s VAL 64 Ca -0.07 -0.44 0.00 0.00 -2.93 0.00 0.00 61.98 58.54 1n89 s VAL 64 Cb -0.07 -2.57 0.00 0.00 -1.53 0.00 0.00 36.38 32.20 1n89 s VAL 64 CO -0.09 0.58 0.00 -0.81 -3.33 0.00 0.00 175.10 171.45 1n89 n PRO 65 N 2.51 1.17 -2.58 1.54 -0.04 -1.26 -4.42 135.00 131.92 1n89 n PRO 65 Ca -0.18 0.00 -0.19 0.00 -0.04 0.00 0.00 63.50 63.09 1n89 n PRO 65 Cb 0.53 0.00 0.01 0.00 -0.04 0.00 0.00 33.50 34.00 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 -0.94 -1.23 1.89 0.54 8.25 -1.26 -5.09 115.22 117.38 1n89 n HIS 66 Ca 0.00 0.18 0.16 0.00 -0.26 0.00 0.00 57.72 57.79 1n89 n HIS 66 Cb 0.00 -3.89 0.86 0.00 1.12 0.00 0.00 29.99 28.08 1n89 n HIS 66 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98