#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n65 s SER 2 N 0.00 6.51 0.16 -5.58 0.15 -1.26 -4.97 113.70 108.70 1n65 s SER 2 Ca 0.00 1.75 -0.02 0.00 0.70 0.00 0.00 55.95 58.38 1n65 s SER 2 Cb 0.00 -2.54 -0.02 0.00 -1.71 0.00 0.00 66.02 61.76 1n65 s SER 2 CO 0.00 -0.66 1.37 1.55 1.20 0.00 0.00 173.24 176.70 1n65 h PRO 3 N 1.34 0.36 -0.47 5.44 0.13 -2.04 -3.07 132.00 133.69 1n65 h PRO 3 Ca -0.48 -0.35 0.05 0.00 -0.87 0.00 0.00 66.00 64.35 1n65 h PRO 3 Cb 1.20 0.09 -0.05 0.00 0.13 0.00 0.00 31.00 32.37 1n65 h PRO 3 CO 0.60 1.02 0.20 0.93 -0.23 0.00 0.00 178.00 180.52 1n65 h GLU 4 N 0.22 0.39 0.84 0.86 5.08 -1.98 0.41 114.58 120.40 1n65 h GLU 4 Ca -0.05 -0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.24 1n65 h GLU 4 Cb 1.46 -0.09 0.01 0.00 0.50 0.00 0.00 28.75 30.63 1n65 h GLU 4 CO 0.14 0.26 -0.40 0.93 -1.00 0.00 0.00 179.01 178.94 1n65 h GLU 5 N 0.40 -1.09 -0.32 2.33 5.08 -1.97 0.83 114.58 119.84 1n65 h GLU 5 Ca 0.21 0.07 0.07 0.00 -1.00 0.00 0.00 59.36 58.72 1n65 h GLU 5 Cb 0.17 0.25 -0.07 0.00 0.50 0.00 0.00 28.75 29.60 1n65 h GLU 5 CO -0.19 -0.73 -0.19 -0.07 -1.00 0.00 0.00 179.01 176.84 1n65 h LEU 6 N -1.14 -0.63 0.00 1.33 3.38 -1.40 1.45 115.31 118.31 1n65 h LEU 6 Ca -0.12 0.14 0.01 0.00 0.09 0.00 0.00 57.88 58.00 1n65 h LEU 6 Cb 0.87 0.33 -0.03 0.00 0.09 0.00 0.00 40.66 41.92 1n65 h LEU 6 CO 0.19 -0.22 -0.27 0.50 0.09 0.00 0.00 178.44 178.73 1n65 h LYS 7 N -0.15 -0.33 -0.49 1.13 3.64 -0.04 1.31 116.57 121.65 1n65 h LYS 7 Ca 0.16 0.02 0.08 0.00 -1.27 0.00 0.00 60.65 59.65 1n65 h LYS 7 Cb 0.40 0.07 -0.07 0.00 -0.41 0.00 0.00 32.23 32.23 1n65 h LYS 7 CO -0.41 -0.22 0.10 0.78 -2.27 0.00 0.00 179.45 177.44 1n65 h GLY 8 N -0.34 0.60 0.47 5.01 0.00 -0.35 0.19 103.07 108.64 1n65 h GLY 8 Ca 0.01 -0.03 0.01 0.00 0.00 0.00 0.00 47.33 47.31 1n65 h GLY 8 CO -0.18 -0.06 -0.37 -2.22 0.00 0.00 0.00 176.54 173.72 1n65 h ILE 9 N 0.24 0.25 -0.46 2.60 2.04 0.26 0.75 117.51 123.19 1n65 h ILE 9 Ca 0.24 0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.20 1n65 h ILE 9 Cb 0.31 0.25 -0.09 0.00 -0.74 0.00 0.00 36.82 36.55 1n65 h ILE 9 CO -0.31 0.00 -0.14 0.15 0.00 0.00 0.00 178.15 177.85 1n65 h PHE 10 N -0.67 -0.32 -0.07 1.37 3.04 0.23 -1.46 116.94 119.06 1n65 h PHE 10 Ca 0.00 0.04 -0.00 0.00 3.98 0.00 0.00 57.97 62.00 1n65 h PHE 10 Cb 0.65 0.21 -0.00 0.00 2.56 0.00 0.00 35.95 39.37 1n65 h PHE 10 CO -0.27 -0.23 0.04 1.49 -2.02 0.00 0.00 178.31 177.32 1n65 h GLU 11 N -0.03 0.10 -1.53 1.11 4.81 -0.46 0.44 114.58 119.01 1n65 h GLU 11 Ca 0.22 -0.01 0.45 0.00 -0.13 0.00 0.00 59.36 59.89 1n65 h GLU 11 Cb 0.37 -0.02 -0.06 0.00 0.63 0.00 0.00 28.75 29.67 1n65 h GLU 11 CO -0.50 0.10 1.19 -0.22 -0.73 0.00 0.00 179.01 178.86 1n65 h LYS 12 N 0.06 0.00 0.01 1.92 3.64 0.16 1.26 116.57 123.62 1n65 h LYS 12 Ca 0.03 0.00 -0.38 0.00 -1.27 0.00 0.00 60.65 59.03 1n65 h LYS 12 Cb 0.03 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 31.80 1n65 h LYS 12 CO -0.00 0.00 -2.06 0.66 -2.27 0.00 0.00 179.45 175.77 1n65 n TYR 13 N -3.88 0.42 -0.11 1.91 4.02 -0.57 -3.82 117.16 115.14 1n65 n TYR 13 Ca 0.34 0.17 0.18 0.00 -0.01 0.00 0.00 57.90 58.58 1n65 n TYR 13 Cb 1.66 -1.04 0.59 0.00 -0.02 0.00 0.00 39.34 40.52 1n65 n TYR 13 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1n65 h ALA 14 N -0.71 2.30 -0.26 -0.72 0.00 0.26 0.48 119.26 120.61 1n65 h ALA 14 Ca -0.56 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.21 1n65 h ALA 14 Cb 1.54 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.30 1n65 h ALA 14 CO -0.31 -0.49 -0.38 0.00 0.00 0.00 0.00 179.25 178.07 1n65 h ALA 15 N 1.67 0.85 0.37 0.00 0.00 0.13 -3.22 119.26 119.06 1n65 h ALA 15 Ca 0.33 -0.43 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1n65 h ALA 15 Cb 0.97 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 1n65 h ALA 15 CO -0.07 0.64 -0.39 0.87 0.00 0.00 0.00 179.25 180.30 1n65 h LYS 16 N 0.50 -0.73 -5.26 0.00 1.57 -0.15 -3.41 116.57 109.09 1n65 h LYS 16 Ca 0.05 0.05 -0.62 0.00 -1.87 0.00 0.00 60.65 58.25 1n65 h LYS 16 Cb 0.88 0.17 -0.18 0.00 0.08 0.00 0.00 32.23 33.18 1n65 h LYS 16 CO 0.08 -0.49 -0.59 -1.21 -0.57 0.00 0.00 179.45 176.67 1n65 s GLU 17 N -5.14 3.88 0.25 3.15 2.02 -1.03 -5.00 118.70 116.83 1n65 s GLU 17 Ca -0.13 -0.40 0.00 0.00 0.02 0.00 0.00 54.97 54.46 1n65 s GLU 17 Cb 0.03 -3.15 0.00 0.00 0.10 0.00 0.00 34.13 31.12 1n65 s GLU 17 CO 0.45 0.24 0.00 0.41 0.02 0.00 0.00 175.26 176.38 1n65 n GLY 18 N 3.62 -1.41 3.16 -1.39 0.00 -1.26 -4.62 105.19 103.30 1n65 n GLY 18 Ca -0.17 -0.85 -0.35 0.00 0.00 0.00 0.00 46.02 44.65 1n65 n GLY 18 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1n65 n ASP 19 N -4.35 -3.62 0.00 1.61 2.03 -1.26 -4.27 116.55 106.69 1n65 n ASP 19 Ca 0.01 0.11 0.11 0.00 0.52 0.00 0.00 54.79 55.54 1n65 n ASP 19 Cb 0.50 -0.85 0.56 0.00 -0.72 0.00 0.00 41.12 40.61 1n65 n ASP 19 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1n65 n PRO 20 N 0.55 0.29 -0.02 -0.67 -0.04 -1.24 -1.90 135.00 131.97 1n65 n PRO 20 Ca 0.01 0.08 0.08 0.00 -0.04 0.00 0.00 63.50 63.63 1n65 n PRO 20 Cb 0.61 -1.50 0.08 0.00 -0.04 0.00 0.00 33.50 32.66 1n65 n PRO 20 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1n65 n ASN 21 N -1.31 2.48 -4.38 3.54 3.02 -1.26 -4.50 115.26 112.84 1n65 n ASN 21 Ca 0.10 -1.72 -0.31 0.00 -0.03 0.00 0.00 54.58 52.62 1n65 n ASN 21 Cb 0.19 -0.03 -0.14 0.00 -0.61 0.00 0.00 39.78 39.18 1n65 n ASN 21 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1n65 s GLN 22 N -1.36 2.10 0.47 3.52 -0.21 -0.80 -2.77 119.66 120.62 1n65 s GLN 22 Ca 0.21 -0.94 0.06 0.00 0.02 0.00 0.00 55.36 54.71 1n65 s GLN 22 Cb 0.14 -2.12 -0.02 0.00 1.00 0.00 0.00 33.01 32.01 1n65 s GLN 22 CO 0.21 0.56 0.21 -0.51 -2.12 0.00 0.00 175.29 173.64 1n65 s LEU 23 N -0.96 2.85 0.04 2.90 2.01 0.52 -4.44 118.68 121.59 1n65 s LEU 23 Ca 0.12 -1.23 0.00 0.00 0.01 0.00 0.00 54.13 53.03 1n65 s LEU 23 Cb -0.10 -1.24 -0.03 0.00 0.01 0.00 0.00 46.19 44.83 1n65 s LEU 23 CO 0.01 -0.77 -0.04 -0.44 1.01 0.00 0.00 176.35 176.13 1n65 s SER 24 N -4.01 0.46 0.11 2.29 0.01 -1.26 -2.68 113.70 108.62 1n65 s SER 24 Ca 0.33 -0.64 -0.34 0.00 1.31 0.00 0.00 55.95 56.60 1n65 s SER 24 Cb 0.02 0.11 -0.13 0.00 0.21 0.00 0.00 66.02 66.23 1n65 s SER 24 CO 0.19 -0.35 1.56 0.50 0.41 0.00 0.00 173.24 175.54 1n65 h LYS 25 N 4.21 -0.62 -0.65 12.44 3.64 -1.97 1.28 116.57 134.89 1n65 h LYS 25 Ca -0.33 0.04 0.08 0.00 -1.27 0.00 0.00 60.65 59.17 1n65 h LYS 25 Cb 1.19 0.14 -0.07 0.00 -0.41 0.00 0.00 32.23 33.08 1n65 h LYS 25 CO 0.48 -0.41 0.31 1.49 -2.27 0.00 0.00 179.45 179.04 1n65 h GLU 26 N -0.64 0.52 0.48 1.90 4.22 -1.99 0.17 114.58 119.25 1n65 h GLU 26 Ca 0.02 -0.03 -0.02 0.00 0.08 0.00 0.00 59.36 59.41 1n65 h GLU 26 Cb 0.71 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.84 1n65 h GLU 26 CO -0.38 0.35 -0.23 0.93 -2.18 0.00 0.00 179.01 177.49 1n65 h GLU 27 N 0.54 -0.62 -0.72 1.92 5.08 -1.58 -2.47 114.58 116.72 1n65 h GLU 27 Ca 0.32 0.04 0.14 0.00 -1.00 0.00 0.00 59.36 58.86 1n65 h GLU 27 Cb 0.33 0.14 -0.14 0.00 0.50 0.00 0.00 28.75 29.58 1n65 h GLU 27 CO -0.26 -0.42 -0.24 1.25 -1.00 0.00 0.00 179.01 178.35 1n65 h LEU 28 N -0.65 -0.87 -0.93 1.33 5.85 0.18 0.15 115.31 120.37 1n65 h LEU 28 Ca -0.07 0.23 0.11 0.00 0.84 0.00 0.00 57.88 59.00 1n65 h LEU 28 Cb 0.50 0.51 -0.13 0.00 0.37 0.00 0.00 40.66 41.91 1n65 h LEU 28 CO 0.11 -0.27 -0.51 0.50 -0.34 0.00 0.00 178.44 177.93 1n65 h LYS 29 N -0.05 -0.04 0.25 1.25 3.64 -0.54 1.22 116.57 122.31 1n65 h LYS 29 Ca 0.33 0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.72 1n65 h LYS 29 Cb 0.55 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.35 1n65 h LYS 29 CO -0.76 -0.03 -0.41 -0.07 -2.27 0.00 0.00 179.45 175.91 1n65 h LEU 30 N -0.04 -1.15 -0.07 5.20 3.38 -0.28 0.28 115.31 122.63 1n65 h LEU 30 Ca 0.22 0.12 0.01 0.00 0.09 0.00 0.00 57.88 58.32 1n65 h LEU 30 Cb 0.50 0.41 -0.03 0.00 0.09 0.00 0.00 40.66 41.63 1n65 h LEU 30 CO -0.92 -0.51 -0.25 0.25 0.09 0.00 0.00 178.44 177.10 1n65 h LEU 31 N -0.72 -0.81 -1.57 1.67 5.85 0.55 0.81 115.31 121.08 1n65 h LEU 31 Ca -0.00 0.10 0.07 0.00 0.84 0.00 0.00 57.88 58.88 1n65 h LEU 31 Cb 0.70 0.32 -0.01 0.00 0.37 0.00 0.00 40.66 42.04 1n65 h LEU 31 CO -0.16 -0.22 0.57 -0.07 -0.34 0.00 0.00 178.44 178.22 1n65 h LEU 32 N -0.26 0.00 0.37 2.25 3.38 0.15 2.59 115.31 123.79 1n65 h LEU 32 Ca 0.02 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1n65 h LEU 32 Cb 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1n65 h LEU 32 CO -0.21 0.00 -0.18 -0.61 0.09 0.00 0.00 178.44 177.53 1n65 h GLN 33 N 0.00 -0.48 0.00 1.13 4.15 0.43 0.15 115.11 120.50 1n65 h GLN 33 Ca 0.11 0.03 -0.15 0.00 0.77 0.00 0.00 58.65 59.42 1n65 h GLN 33 Cb 1.26 0.11 -0.02 0.00 0.21 0.00 0.00 27.48 29.03 1n65 h GLN 33 CO -0.00 -0.20 -0.83 1.15 -1.93 0.00 0.00 178.83 177.02 1n65 h THR 34 N -1.03 1.06 -0.10 2.39 2.02 0.12 -3.19 112.91 114.19 1n65 h THR 34 Ca -0.05 -2.11 0.02 0.00 0.77 0.00 0.00 66.41 65.04 1n65 h THR 34 Cb 0.50 2.32 -0.03 0.00 -1.74 0.00 0.00 68.15 69.20 1n65 h THR 34 CO 0.08 0.36 -0.26 -0.08 0.37 0.00 0.00 175.52 175.99 1n65 h GLU 35 N -1.00 -0.25 -1.91 6.66 4.81 0.42 -3.39 114.58 119.92 1n65 h GLU 35 Ca -0.22 0.02 -0.34 0.00 -0.13 0.00 0.00 59.36 58.69 1n65 h GLU 35 Cb 1.13 0.06 -0.30 0.00 0.63 0.00 0.00 28.75 30.26 1n65 h GLU 35 CO -0.13 -0.17 -0.66 -0.06 -0.73 0.00 0.00 179.01 177.26 1n65 s PHE 36 N -4.29 -0.42 -0.80 0.92 0.08 -1.12 -4.97 117.98 107.38 1n65 s PHE 36 Ca -0.07 -0.65 0.23 0.00 0.12 0.00 0.00 56.93 56.57 1n65 s PHE 36 Cb 0.04 -0.36 0.92 0.00 -0.57 0.00 0.00 43.02 43.04 1n65 s PHE 36 CO 0.29 -0.98 1.73 -0.35 -0.10 0.00 0.00 175.22 175.81 1n65 n PRO 37 N 4.42 0.12 -0.12 0.24 -0.04 0.52 -2.95 135.00 137.18 1n65 n PRO 37 Ca 0.09 0.22 -0.04 0.00 -0.04 0.00 0.00 63.50 63.74 1n65 n PRO 37 Cb 0.46 -1.68 0.18 0.00 -0.04 0.00 0.00 33.50 32.42 1n65 n PRO 37 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1n65 h SER 38 N 0.00 0.77 0.42 3.54 0.87 -1.90 -1.07 113.55 116.18 1n65 h SER 38 Ca 0.00 -0.16 -0.02 0.00 -1.23 0.00 0.00 61.79 60.38 1n65 h SER 38 Cb 0.47 -0.20 -0.00 0.00 -0.44 0.00 0.00 62.40 62.22 1n65 h SER 38 CO 0.00 0.79 -0.09 -0.07 -0.53 0.00 0.00 176.83 176.93 1n65 h LEU 39 N 0.77 0.00 0.00 2.23 -0.00 -1.84 0.12 115.31 116.60 1n65 h LEU 39 Ca 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.04 1n65 h LEU 39 Cb 0.36 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.02 1n65 h LEU 39 CO 0.01 0.09 0.00 0.18 -0.00 0.00 0.00 178.44 178.72 1n65 n LEU 40 N -3.49 0.00 -0.11 1.67 4.77 -0.41 -2.97 117.00 116.46 1n65 n LEU 40 Ca -0.02 0.02 -0.14 0.00 -0.03 0.00 0.00 56.01 55.84 1n65 n LEU 40 Cb 0.23 -0.02 -0.10 0.00 -2.33 0.00 0.00 43.42 41.20 1n65 n LEU 40 CO 0.28 -0.00 -1.19 0.29 -1.33 0.00 0.00 177.39 175.44 1n65 n LYS 41 N -1.02 0.62 -0.62 3.23 5.02 0.41 -4.86 118.16 120.94 1n65 n LYS 41 Ca 0.21 0.11 -0.20 0.00 -2.02 0.00 0.00 58.31 56.42 1n65 n LYS 41 Cb 0.11 -1.43 0.12 0.00 -0.02 0.00 0.00 35.03 33.81 1n65 n LYS 41 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1n65 n GLY 42 N 2.41 -2.35 0.13 0.72 0.00 -1.07 -4.78 105.19 100.25 1n65 n GLY 42 Ca -0.37 -0.65 0.11 0.00 0.00 0.00 0.00 46.02 45.12 1n65 n GLY 42 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1n65 n MET 43 N -0.95 0.17 -3.34 1.61 2.81 -1.26 -4.28 117.12 111.89 1n65 n MET 43 Ca 0.04 0.45 -0.46 0.00 -1.81 0.00 0.00 57.70 55.92 1n65 n MET 43 Cb 0.38 -1.86 -0.05 0.00 -0.71 0.00 0.00 33.22 30.98 1n65 n MET 43 CO 0.00 0.00 0.00 -1.12 1.51 0.00 0.00 175.97 176.36 1n65 s SER 44 N -4.13 6.21 0.81 7.83 0.01 -1.26 -5.02 113.70 118.15 1n65 s SER 44 Ca 0.03 -1.93 -0.12 0.00 1.31 0.00 0.00 55.95 55.24 1n65 s SER 44 Cb 0.09 -2.19 0.08 0.00 0.21 0.00 0.00 66.02 64.21 1n65 s SER 44 CO 0.35 -0.80 1.17 0.42 0.41 0.00 0.00 173.24 174.79 1n65 s THR 45 N 1.37 2.11 0.07 1.44 -4.23 -1.26 -4.62 115.64 110.51 1n65 s THR 45 Ca 0.05 0.03 -0.16 0.00 -1.18 0.00 0.00 61.69 60.44 1n65 s THR 45 Cb -0.27 -3.03 -0.04 0.00 1.34 0.00 0.00 72.50 70.50 1n65 s THR 45 CO 0.01 -0.05 1.27 0.25 -0.54 0.00 0.00 174.62 175.56 1n65 h LEU 46 N -1.04 -1.00 -0.76 4.79 7.12 -1.89 1.12 115.31 123.64 1n65 h LEU 46 Ca -0.46 0.14 0.17 0.00 0.13 0.00 0.00 57.88 57.86 1n65 h LEU 46 Cb 1.32 0.43 -0.14 0.00 -0.53 0.00 0.00 40.66 41.75 1n65 h LEU 46 CO 0.66 -0.15 -0.07 -0.78 -0.13 0.00 0.00 178.44 177.96 1n65 h ASP 47 N -0.09 -0.49 -0.48 1.25 1.82 -1.97 0.58 116.42 117.03 1n65 h ASP 47 Ca 0.06 0.21 0.05 0.00 -0.39 0.00 0.00 57.03 56.95 1n65 h ASP 47 Cb 0.25 0.40 -0.04 0.00 0.68 0.00 0.00 39.33 40.61 1n65 h ASP 47 CO -0.38 -0.21 0.23 -0.33 -1.61 0.00 0.00 179.24 176.93 1n65 h GLU 48 N 0.06 0.44 0.79 0.28 5.08 -0.77 -1.93 114.58 118.53 1n65 h GLU 48 Ca 0.40 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.69 1n65 h GLU 48 Cb 0.68 -0.10 0.01 0.00 0.50 0.00 0.00 28.75 29.84 1n65 h GLU 48 CO -0.72 0.29 -0.38 1.25 -1.00 0.00 0.00 179.01 178.45 1n65 h LEU 49 N 0.45 -0.90 -1.00 1.33 5.85 0.58 0.78 115.31 122.40 1n65 h LEU 49 Ca 0.21 0.03 0.26 0.00 0.84 0.00 0.00 57.88 59.22 1n65 h LEU 49 Cb 0.14 0.23 -0.19 0.00 0.37 0.00 0.00 40.66 41.22 1n65 h LEU 49 CO -0.16 -0.63 -0.02 0.33 -0.34 0.00 0.00 178.44 177.62 1n65 n PHE 50 N -5.54 0.60 -0.02 1.25 7.35 0.15 0.19 117.46 121.44 1n65 n PHE 50 Ca -0.15 1.20 -0.15 0.00 -0.76 0.00 0.00 57.45 57.60 1n65 n PHE 50 Cb 0.43 -1.23 -0.11 0.00 0.35 0.00 0.00 39.48 38.92 1n65 n PHE 50 CO 0.00 0.00 0.00 1.49 -0.76 0.00 0.00 176.76 177.49 1n65 h GLU 51 N 0.00 0.23 0.24 -4.13 4.81 -1.08 -0.93 114.58 113.72 1n65 h GLU 51 Ca 0.59 -0.22 0.01 0.00 -0.13 0.00 0.00 59.36 59.60 1n65 h GLU 51 Cb 1.18 0.06 -0.03 0.00 0.63 0.00 0.00 28.75 30.59 1n65 h GLU 51 CO -0.95 0.93 -0.35 1.49 -0.73 0.00 0.00 179.01 179.40 1n65 h GLU 52 N -0.38 -0.63 0.92 1.92 4.81 0.45 -3.05 114.58 118.62 1n65 h GLU 52 Ca -0.03 0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 59.20 1n65 h GLU 52 Cb 1.02 0.14 0.01 0.00 0.63 0.00 0.00 28.75 30.55 1n65 h GLU 52 CO 0.06 -0.42 -0.45 -0.07 -0.73 0.00 0.00 179.01 177.40 1n65 h LEU 53 N -0.65 -1.06 0.00 1.64 3.38 0.19 -3.44 115.31 115.37 1n65 h LEU 53 Ca 0.00 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1n65 h LEU 53 Cb 0.63 0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.65 1n65 h LEU 53 CO -0.13 -0.76 0.00 -0.67 0.09 0.00 0.00 178.44 176.98 1n65 n ASP 54 N -5.63 -0.16 -1.45 -0.43 -0.08 -0.35 -4.87 116.55 103.57 1n65 n ASP 54 Ca -0.16 -0.24 0.00 0.00 -1.51 0.00 0.00 54.79 52.88 1n65 n ASP 54 Cb 0.49 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.95 1n65 n ASP 54 CO 0.00 0.00 0.00 1.17 0.12 0.00 0.00 177.20 178.49 1n65 n LYS 55 N -0.40 0.00 0.00 -0.67 4.81 -1.25 -4.77 118.16 115.88 1n65 n LYS 55 Ca 0.00 0.48 0.00 0.00 -0.87 0.00 0.00 58.31 57.92 1n65 n LYS 55 Cb 0.00 -1.45 0.00 0.00 0.02 0.00 0.00 35.03 33.60 1n65 n LYS 55 CO 0.00 0.00 0.00 0.27 1.17 0.00 0.00 177.40 178.84 1n65 n ASN 56 N -0.84 0.00 -3.55 3.14 0.23 -1.26 -5.01 115.26 107.97 1n65 n ASN 56 Ca 0.00 0.00 -0.19 0.00 -0.53 0.00 0.00 54.58 53.86 1n65 n ASN 56 Cb 0.35 0.00 0.01 0.00 -2.08 0.00 0.00 39.78 38.06 1n65 n ASN 56 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1n65 n GLY 57 N 0.00 -1.21 2.09 4.83 0.00 -1.26 -4.88 105.19 104.77 1n65 n GLY 57 Ca 0.00 0.52 0.00 0.00 0.00 0.00 0.00 46.02 46.54 1n65 n GLY 57 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1n65 n ASP 58 N -2.35 -1.78 0.00 1.61 9.92 -1.26 -5.06 116.55 117.63 1n65 n ASP 58 Ca -0.16 0.58 0.00 0.00 -0.53 0.00 0.00 54.79 54.67 1n65 n ASP 58 Cb 0.61 1.79 0.00 0.00 -0.64 0.00 0.00 41.12 42.88 1n65 n ASP 58 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1n65 n GLY 59 N 0.08 3.12 1.71 0.44 0.00 -1.26 -5.01 105.19 104.27 1n65 n GLY 59 Ca 0.00 -0.91 -0.14 0.00 0.00 0.00 0.00 46.02 44.97 1n65 n GLY 59 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1n65 n GLU 60 N 0.00 1.15 -2.85 1.61 4.71 -1.26 -4.90 120.64 119.10 1n65 n GLU 60 Ca 0.00 -1.75 -0.19 0.00 -0.01 0.00 0.00 57.16 55.22 1n65 n GLU 60 Cb 0.00 0.65 0.02 0.00 -1.01 0.00 0.00 31.44 31.10 1n65 n GLU 60 CO 0.00 0.00 0.00 0.08 0.09 0.00 0.00 177.13 177.30 1n65 s VAL 61 N -2.05 2.85 0.14 2.62 1.01 -1.09 -4.69 120.40 119.19 1n65 s VAL 61 Ca 0.04 -0.85 -0.15 0.00 0.00 0.00 0.00 61.98 61.02 1n65 s VAL 61 Cb 0.00 -3.00 0.03 0.00 0.00 0.00 0.00 36.38 33.41 1n65 s VAL 61 CO 0.03 0.00 0.40 -0.94 0.00 0.00 0.00 175.10 174.59 1n65 s SER 62 N -4.38 -0.19 0.23 3.32 1.04 -1.26 0.19 113.70 112.65 1n65 s SER 62 Ca 0.56 -0.42 -0.07 0.00 0.48 0.00 0.00 55.95 56.50 1n65 s SER 62 Cb -0.10 0.48 0.39 0.00 0.10 0.00 0.00 66.02 66.89 1n65 s SER 62 CO 0.35 -0.88 1.69 0.15 0.98 0.00 0.00 173.24 175.53 1n65 h PHE 63 N 2.38 0.20 0.32 5.02 3.04 -1.86 0.90 116.94 126.93 1n65 h PHE 63 Ca -0.33 0.04 -0.01 0.00 3.98 0.00 0.00 57.97 61.65 1n65 h PHE 63 Cb 1.25 0.02 -0.01 0.00 2.56 0.00 0.00 35.95 39.77 1n65 h PHE 63 CO 0.34 -0.09 -0.23 0.93 -2.02 0.00 0.00 178.31 177.25 1n65 h GLU 64 N 0.24 -0.51 -0.32 1.11 4.39 -1.97 1.14 114.58 118.66 1n65 h GLU 64 Ca 0.37 0.03 0.09 0.00 0.34 0.00 0.00 59.36 60.20 1n65 h GLU 64 Cb 0.61 0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 29.37 1n65 h GLU 64 CO -0.49 -0.34 0.29 0.93 -1.16 0.00 0.00 179.01 178.24 1n65 h GLU 65 N -0.53 0.00 0.00 2.33 5.08 -1.82 0.38 114.58 120.02 1n65 h GLU 65 Ca -0.04 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 58.06 1n65 h GLU 65 Cb 0.43 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.70 1n65 h GLU 65 CO 0.02 0.00 -1.03 0.35 -1.00 0.00 0.00 179.01 177.34 1n65 h PHE 66 N 0.00 1.00 -0.97 4.33 3.57 0.15 -3.15 116.94 121.87 1n65 h PHE 66 Ca 0.15 -0.54 0.28 0.00 3.53 0.00 0.00 57.97 61.39 1n65 h PHE 66 Cb 0.73 -0.11 -0.04 0.00 2.79 0.00 0.00 35.95 39.32 1n65 h PHE 66 CO 0.00 1.38 0.87 1.96 -2.23 0.00 0.00 178.31 180.29 1n65 h GLN 67 N 0.38 0.00 -0.61 1.11 4.20 0.36 1.45 115.11 121.99 1n65 h GLN 67 Ca -0.12 0.00 0.01 0.00 0.06 0.00 0.00 58.65 58.59 1n65 h GLN 67 Cb 1.69 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 29.43 1n65 h GLN 67 CO 0.20 0.00 0.41 0.28 -0.67 0.00 0.00 178.83 179.05 1n65 h VAL 68 N 0.00 1.15 -0.03 -0.54 2.07 -1.56 0.17 116.25 117.52 1n65 h VAL 68 Ca 0.46 -0.28 -0.19 0.00 0.82 0.00 0.00 66.70 67.51 1n65 h VAL 68 Cb 2.20 0.25 0.01 0.00 -1.52 0.00 0.00 31.29 32.24 1n65 h VAL 68 CO -0.00 0.15 -0.71 0.25 0.02 0.00 0.00 177.57 177.28 1n65 h LEU 69 N 0.83 0.68 -0.43 2.57 5.85 0.18 -2.99 115.31 121.99 1n65 h LEU 69 Ca 0.23 -0.72 0.05 0.00 0.84 0.00 0.00 57.88 58.27 1n65 h LEU 69 Cb -0.08 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 40.70 1n65 h LEU 69 CO -0.05 1.31 0.18 0.58 -0.34 0.00 0.00 178.44 180.11 1n65 h VAL 70 N 0.12 0.90 -0.78 1.05 2.07 -1.00 0.21 116.25 118.82 1n65 h VAL 70 Ca -0.08 -0.12 0.11 0.00 0.82 0.00 0.00 66.70 67.43 1n65 h VAL 70 Cb 1.38 0.51 -0.08 0.00 -1.52 0.00 0.00 31.29 31.58 1n65 h VAL 70 CO 0.14 0.07 0.40 0.50 0.02 0.00 0.00 177.57 178.69 1n65 h LYS 71 N 0.36 0.61 0.00 1.57 3.64 -0.71 0.85 116.57 122.88 1n65 h LYS 71 Ca 0.20 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.50 1n65 h LYS 71 Cb 0.16 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 1n65 h LYS 71 CO -0.18 0.40 -0.17 0.87 -2.27 0.00 0.00 179.45 178.11 1n65 h LYS 72 N 0.63 0.00 0.07 1.90 1.79 -1.03 0.64 116.57 120.57 1n65 h LYS 72 Ca 0.40 0.00 -0.17 0.00 -2.18 0.00 0.00 60.65 58.69 1n65 h LYS 72 Cb 0.47 0.00 0.02 0.00 -1.58 0.00 0.00 32.23 31.14 1n65 h LYS 72 CO -0.30 0.17 -0.72 0.82 -1.08 0.00 0.00 179.45 178.33 1n65 h ILE 73 N 0.00 1.46 0.12 1.86 2.04 0.34 -3.36 117.51 119.97 1n65 h ILE 73 Ca -0.00 -2.30 -0.01 0.00 1.00 0.00 0.00 64.86 63.55 1n65 h ILE 73 Cb 0.65 2.88 0.00 0.00 -0.74 0.00 0.00 36.82 39.62 1n65 h ILE 73 CO 0.02 0.66 -0.06 -1.28 0.00 0.00 0.00 178.15 177.50 1n65 h SER 74 N -0.22 -0.13 0.00 1.72 0.87 0.58 -3.51 113.55 112.86 1n65 h SER 74 Ca -0.11 -0.40 0.00 0.00 -1.23 0.00 0.00 61.79 60.05 1n65 h SER 74 Cb 1.49 0.03 0.00 0.00 -0.44 0.00 0.00 62.40 63.48 1n65 h SER 74 CO 0.14 0.48 0.00 1.67 -0.53 0.00 0.00 176.83 178.59