#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 5.12 0.12 -5.58 0.01 -1.26 -4.96 113.70 107.15 1n65 s SER 2 Ca 0.00 1.11 -0.08 0.00 1.31 0.00 0.00 55.95 58.29 1n65 s SER 2 Cb 0.00 -1.85 -0.12 0.00 0.21 0.00 0.00 66.02 64.26 1n65 s SER 2 CO 0.00 -1.54 1.30 1.55 0.41 0.00 0.00 173.24 174.95 1n65 h PRO 3 N -0.80 0.56 -0.11 12.44 0.13 -2.03 -2.61 132.00 139.58 1n65 h PRO 3 Ca -0.46 -0.55 0.02 0.00 -0.87 0.00 0.00 66.00 64.14 1n65 h PRO 3 Cb 1.27 0.14 -0.02 0.00 0.13 0.00 0.00 31.00 32.52 1n65 h PRO 3 CO 0.63 1.17 -0.01 0.93 -0.23 0.00 0.00 178.00 180.50 1n65 h GLU 4 N 0.34 0.02 0.35 0.86 5.08 -1.99 0.18 114.58 119.43 1n65 h GLU 4 Ca -0.08 -0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.26 1n65 h GLU 4 Cb 1.53 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.78 1n65 h GLU 4 CO 0.17 0.02 -0.17 0.93 -1.00 0.00 0.00 179.01 178.96 1n65 h GLU 5 N 0.02 -0.45 -0.52 2.33 5.08 -1.97 -1.54 114.58 117.54 1n65 h GLU 5 Ca 0.05 0.03 0.10 0.00 -1.00 0.00 0.00 59.36 58.55 1n65 h GLU 5 Cb 0.07 0.10 -0.09 0.00 0.50 0.00 0.00 28.75 29.33 1n65 h GLU 5 CO -0.10 -0.28 -0.06 -0.07 -1.00 0.00 0.00 179.01 177.50 1n65 h LEU 6 N -0.49 -0.35 -0.30 1.33 3.38 -1.27 0.17 115.31 117.78 1n65 h LEU 6 Ca -0.05 0.14 0.07 0.00 0.09 0.00 0.00 57.88 58.13 1n65 h LEU 6 Cb 0.38 0.27 -0.07 0.00 0.09 0.00 0.00 40.66 41.32 1n65 h LEU 6 CO 0.08 -0.13 -0.21 0.50 0.09 0.00 0.00 178.44 178.77 1n65 h LYS 7 N 0.06 -0.18 -0.49 1.13 3.64 -0.36 0.13 116.57 120.49 1n65 h LYS 7 Ca 0.26 0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.71 1n65 h LYS 7 Cb 0.40 0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 32.21 1n65 h LYS 7 CO -0.48 -0.12 0.20 0.78 -2.27 0.00 0.00 179.45 177.56 1n65 h GLY 8 N -0.18 0.67 0.47 5.01 0.00 -0.01 -1.49 103.07 107.53 1n65 h GLY 8 Ca 0.16 -0.12 0.04 0.00 0.00 0.00 0.00 47.33 47.40 1n65 h GLY 8 CO -0.41 0.04 -0.19 -2.22 0.00 0.00 0.00 176.54 173.76 1n65 h ILE 9 N 0.40 0.54 -0.42 2.60 2.04 0.63 0.43 117.51 123.72 1n65 h ILE 9 Ca 0.23 0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.18 1n65 h ILE 9 Cb 0.21 0.54 -0.09 0.00 -0.74 0.00 0.00 36.82 36.74 1n65 h ILE 9 CO -0.21 0.00 -0.18 0.15 0.00 0.00 0.00 178.15 177.91 1n65 h PHE 10 N -0.27 -0.45 -0.05 1.37 3.04 -0.21 -1.64 116.94 118.73 1n65 h PHE 10 Ca 0.08 0.04 -0.00 0.00 3.98 0.00 0.00 57.97 62.07 1n65 h PHE 10 Cb 0.38 0.26 -0.00 0.00 2.56 0.00 0.00 35.95 39.15 1n65 h PHE 10 CO -0.27 -0.26 0.03 0.93 -2.02 0.00 0.00 178.31 176.72 1n65 h GLU 11 N -0.10 0.07 -1.93 1.11 5.08 -0.67 0.27 114.58 118.41 1n65 h GLU 11 Ca 0.20 -0.01 0.57 0.00 -1.00 0.00 0.00 59.36 59.12 1n65 h GLU 11 Cb 0.41 -0.01 -0.08 0.00 0.50 0.00 0.00 28.75 29.57 1n65 h GLU 11 CO -0.48 0.09 1.38 -0.22 -1.00 0.00 0.00 179.01 178.78 1n65 h LYS 12 N 0.02 0.00 0.00 2.33 3.11 0.80 0.74 116.57 123.57 1n65 h LYS 12 Ca 0.02 -0.00 -0.36 0.00 -2.81 0.00 0.00 60.65 57.50 1n65 h LYS 12 Cb 0.04 -0.00 -0.05 0.00 -1.00 0.00 0.00 32.23 31.22 1n65 h LYS 12 CO -0.00 0.00 -1.98 0.66 -2.81 0.00 0.00 179.45 175.32 1n65 n TYR 13 N -4.00 0.43 -0.33 1.91 4.01 -0.65 -3.89 117.16 114.64 1n65 n TYR 13 Ca 0.44 0.19 0.25 0.00 -0.16 0.00 0.00 57.90 58.62 1n65 n TYR 13 Cb 1.98 -1.03 0.55 0.00 -0.31 0.00 0.00 39.34 40.53 1n65 n TYR 13 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1n65 h ALA 14 N -0.79 2.37 -0.38 -0.72 0.00 0.29 1.38 119.26 121.41 1n65 h ALA 14 Ca -0.54 0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.32 1n65 h ALA 14 Cb 1.47 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.30 1n65 h ALA 14 CO -0.33 -0.79 -0.20 0.00 0.00 0.00 0.00 179.25 177.92 1n65 h ALA 15 N 1.60 0.93 0.40 0.00 0.00 0.17 -3.13 119.26 119.23 1n65 h ALA 15 Ca 0.62 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 1n65 h ALA 15 Cb 1.69 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 19.30 1n65 h ALA 15 CO -0.28 0.61 -0.46 0.87 0.00 0.00 0.00 179.25 179.99 1n65 h LYS 16 N 0.65 -0.86 -5.29 0.00 1.57 0.17 -3.41 116.57 109.40 1n65 h LYS 16 Ca 0.10 0.06 -0.66 0.00 -1.87 0.00 0.00 60.65 58.27 1n65 h LYS 16 Cb 0.69 0.19 -0.29 0.00 0.08 0.00 0.00 32.23 32.91 1n65 h LYS 16 CO 0.05 -0.57 -0.80 -1.21 -0.57 0.00 0.00 179.45 176.35 1n65 s GLU 17 N -5.90 3.26 0.30 3.15 2.02 -0.92 -5.04 118.70 115.58 1n65 s GLU 17 Ca -0.17 -0.75 0.00 0.00 0.02 0.00 0.00 54.97 54.07 1n65 s GLU 17 Cb 0.05 -2.55 0.00 0.00 0.10 0.00 0.00 34.13 31.73 1n65 s GLU 17 CO 0.62 0.16 0.00 0.41 0.02 0.00 0.00 175.26 176.46 1n65 n GLY 18 N 3.66 -1.96 3.12 -1.39 0.00 -1.25 -4.52 105.19 102.84 1n65 n GLY 18 Ca -0.19 -1.23 -0.24 0.00 0.00 0.00 0.00 46.02 44.37 1n65 n GLY 18 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1n65 n ASP 19 N -3.59 -3.02 0.20 1.61 9.92 -1.26 -4.25 116.55 116.17 1n65 n ASP 19 Ca 0.01 -0.40 0.14 0.00 -0.53 0.00 0.00 54.79 54.00 1n65 n ASP 19 Cb 0.52 -0.86 0.44 0.00 -0.64 0.00 0.00 41.12 40.58 1n65 n ASP 19 CO 0.00 0.00 0.00 1.55 0.13 0.00 0.00 177.20 178.88 1n65 h PRO 20 N -2.71 0.00 -0.51 -0.24 0.13 -1.89 -2.55 132.00 124.23 1n65 h PRO 20 Ca -0.35 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 1n65 h PRO 20 Cb 1.02 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.15 1n65 h PRO 20 CO 0.23 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.09 1n65 n ASN 21 N -2.80 3.51 -4.31 1.44 3.02 -1.26 -4.59 115.26 110.26 1n65 n ASN 21 Ca 0.03 -1.97 -0.32 0.00 -0.03 0.00 0.00 54.58 52.29 1n65 n ASN 21 Cb 0.39 -0.34 -0.16 0.00 -0.61 0.00 0.00 39.78 39.06 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 -1.15 2.96 0.48 3.52 -0.21 -0.96 0.90 119.66 125.20 1n65 s GLN 22 Ca 0.39 -0.81 0.05 0.00 0.02 0.00 0.00 55.36 55.02 1n65 s GLN 22 Cb 0.21 -2.37 -0.01 0.00 1.00 0.00 0.00 33.01 31.84 1n65 s GLN 22 CO 0.28 0.29 0.24 -0.51 -2.12 0.00 0.00 175.29 173.48 1n65 s LEU 23 N 0.10 2.82 0.03 2.90 2.01 0.50 -4.37 118.68 122.67 1n65 s LEU 23 Ca -0.09 -1.23 0.00 0.00 0.01 0.00 0.00 54.13 52.82 1n65 s LEU 23 Cb -0.15 -1.25 -0.02 0.00 0.01 0.00 0.00 46.19 44.78 1n65 s LEU 23 CO 0.06 -0.82 -0.04 -0.44 1.01 0.00 0.00 176.35 176.12 1n65 s SER 24 N -4.06 0.33 0.14 2.29 0.01 -1.26 -2.83 113.70 108.33 1n65 s SER 24 Ca 0.32 -0.55 -0.27 0.00 1.31 0.00 0.00 55.95 56.77 1n65 s SER 24 Cb 0.01 0.10 -0.01 0.00 0.21 0.00 0.00 66.02 66.32 1n65 s SER 24 CO 0.19 -0.31 1.59 0.50 0.41 0.00 0.00 173.24 175.62 1n65 h LYS 25 N 4.51 -0.38 -0.59 12.44 3.64 -1.97 1.12 116.57 135.34 1n65 h LYS 25 Ca -0.33 0.03 0.04 0.00 -1.27 0.00 0.00 60.65 59.12 1n65 h LYS 25 Cb 1.20 0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 33.07 1n65 h LYS 25 CO 0.43 -0.25 0.34 1.49 -2.27 0.00 0.00 179.45 179.19 1n65 h GLU 26 N -0.39 0.64 0.46 1.90 4.22 -1.99 0.18 114.58 119.61 1n65 h GLU 26 Ca 0.11 -0.04 -0.02 0.00 0.08 0.00 0.00 59.36 59.49 1n65 h GLU 26 Cb 0.58 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.69 1n65 h GLU 26 CO -0.45 0.42 -0.22 0.93 -2.18 0.00 0.00 179.01 177.51 1n65 h GLU 27 N 0.66 -0.60 -0.68 1.92 5.08 -1.50 -2.49 114.58 116.96 1n65 h GLU 27 Ca 0.25 0.04 0.14 0.00 -1.00 0.00 0.00 59.36 58.79 1n65 h GLU 27 Cb 0.09 0.14 -0.13 0.00 0.50 0.00 0.00 28.75 29.35 1n65 h GLU 27 CO -0.14 -0.40 -0.19 1.25 -1.00 0.00 0.00 179.01 178.54 1n65 h LEU 28 N -0.63 -0.68 -0.96 1.33 5.85 0.13 0.89 115.31 121.24 1n65 h LEU 28 Ca -0.06 0.21 0.12 0.00 0.84 0.00 0.00 57.88 58.98 1n65 h LEU 28 Cb 0.48 0.44 -0.14 0.00 0.37 0.00 0.00 40.66 41.81 1n65 h LEU 28 CO 0.10 -0.23 -0.50 0.50 -0.34 0.00 0.00 178.44 177.97 1n65 h LYS 29 N -0.01 -0.02 0.22 1.25 3.64 -0.53 1.13 116.57 122.25 1n65 h LYS 29 Ca 0.32 0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.71 1n65 h LYS 29 Cb 0.51 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.30 1n65 h LYS 29 CO -0.71 -0.01 -0.40 -0.07 -2.27 0.00 0.00 179.45 175.99 1n65 h LEU 30 N -0.02 -1.13 -0.07 5.20 3.38 -0.40 0.30 115.31 122.57 1n65 h LEU 30 Ca 0.24 0.12 0.01 0.00 0.09 0.00 0.00 57.88 58.34 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 -0.94 -0.50 -0.24 0.25 0.09 0.00 0.00 178.44 177.10 1n65 h LEU 31 N -0.70 -0.76 -1.56 1.67 5.85 0.34 0.78 115.31 120.93 1n65 h LEU 31 Ca 0.00 0.09 0.08 0.00 0.84 0.00 0.00 57.88 58.89 1n65 h LEU 31 Cb 0.68 0.30 -0.01 0.00 0.37 0.00 0.00 40.66 42.00 1n65 h LEU 31 CO -0.17 -0.21 0.59 -0.07 -0.34 0.00 0.00 178.44 178.24 1n65 h LEU 32 N -0.25 0.00 0.36 2.25 3.38 0.13 2.67 115.31 123.85 1n65 h LEU 32 Ca 0.01 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1n65 h LEU 32 Cb 0.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1n65 h LEU 32 CO -0.20 0.00 -0.17 -0.61 0.09 0.00 0.00 178.44 177.55 1n65 h GLN 33 N 0.00 -0.47 0.00 1.13 4.15 0.43 0.95 115.11 121.31 1n65 h GLN 33 Ca 0.13 0.03 -0.14 0.00 0.77 0.00 0.00 58.65 59.44 1n65 h GLN 33 Cb 1.31 0.11 -0.02 0.00 0.21 0.00 0.00 27.48 29.09 1n65 h GLN 33 CO -0.00 -0.18 -0.80 1.15 -1.93 0.00 0.00 178.83 177.07 1n65 h THR 34 N -1.02 1.08 -0.10 2.39 2.02 0.13 -3.19 112.91 114.22 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 2.34 -0.03 0.00 -1.74 0.00 0.00 68.15 69.22 1n65 h THR 34 CO 0.08 0.37 -0.26 -0.08 0.37 0.00 0.00 175.52 176.00 1n65 h GLU 35 N -1.00 -0.24 -1.94 6.66 4.81 0.43 -3.39 114.58 119.91 1n65 h GLU 35 Ca -0.21 0.02 -0.34 0.00 -0.13 0.00 0.00 59.36 58.69 1n65 h GLU 35 Cb 1.12 0.05 -0.31 0.00 0.63 0.00 0.00 28.75 30.24 1n65 h GLU 35 CO -0.13 -0.16 -0.66 -0.06 -0.73 0.00 0.00 179.01 177.27 1n65 s PHE 36 N -4.25 -0.40 -0.68 0.92 0.08 -1.12 -4.97 117.98 107.56 1n65 s PHE 36 Ca -0.07 -0.63 0.24 0.00 0.12 0.00 0.00 56.93 56.59 1n65 s PHE 36 Cb 0.03 -0.38 0.91 0.00 -0.57 0.00 0.00 43.02 43.01 1n65 s PHE 36 CO 0.28 -0.97 1.74 -0.35 -0.10 0.00 0.00 175.22 175.82 1n65 n PRO 37 N 4.48 0.19 0.21 0.24 -0.04 0.31 -2.74 135.00 137.65 1n65 n PRO 37 Ca 0.08 0.28 0.06 0.00 -0.04 0.00 0.00 63.50 63.89 1n65 n PRO 37 Cb 0.46 -1.78 0.48 0.00 -0.04 0.00 0.00 33.50 32.62 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 0.00 0.87 3.54 0.87 -1.90 -1.10 113.55 115.84 1n65 h SER 38 Ca 0.00 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.53 1n65 h SER 38 Cb 0.52 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.47 1n65 h SER 38 CO 0.00 0.27 -0.16 -0.07 -0.53 0.00 0.00 176.83 176.33 1n65 h LEU 39 N 0.00 0.00 -0.03 2.23 -0.00 -1.81 -0.44 115.31 115.26 1n65 h LEU 39 Ca -0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 57.88 57.78 1n65 h LEU 39 Cb 0.52 0.00 0.01 0.00 -0.00 0.00 0.00 40.66 41.19 1n65 h LEU 39 CO 0.03 0.16 -0.35 -0.07 -0.00 0.00 0.00 178.44 178.22 1n65 h LEU 40 N 0.00 0.35 -1.04 1.67 3.38 -1.37 -3.21 115.31 115.11 1n65 h LEU 40 Ca -0.00 -0.72 -0.09 0.00 0.09 0.00 0.00 57.88 57.15 1n65 h LEU 40 Cb 0.65 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 1n65 h LEU 40 CO 0.02 1.02 -0.31 0.07 0.09 0.00 0.00 178.44 179.34 1n65 h LYS 41 N -0.29 0.31 -6.53 1.13 2.10 -1.30 -3.40 116.57 108.59 1n65 h LYS 41 Ca -0.04 -0.12 -0.38 0.00 -2.00 0.00 0.00 60.65 58.11 1n65 h LYS 41 Cb 1.06 -0.02 0.20 0.00 -0.90 0.00 0.00 32.23 32.57 1n65 h LYS 41 CO 0.07 0.59 -0.78 0.41 -2.00 0.00 0.00 179.45 177.74 1n65 n GLY 42 N -0.38 -2.61 0.11 0.07 0.00 -0.19 -4.79 105.19 97.40 1n65 n GLY 42 Ca -0.01 -0.88 0.10 0.00 0.00 0.00 0.00 46.02 45.23 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 -2.36 0.13 -3.34 1.61 2.81 -1.26 -4.19 117.12 110.52 1n65 n MET 43 Ca 0.03 0.50 -0.46 0.00 -1.81 0.00 0.00 57.70 55.96 1n65 n MET 43 Cb 0.55 -1.82 -0.05 0.00 -0.71 0.00 0.00 33.22 31.19 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 -3.87 6.22 0.80 7.83 0.01 -1.26 -5.05 113.70 118.38 1n65 s SER 44 Ca 0.01 -1.94 -0.12 0.00 1.31 0.00 0.00 55.95 55.22 1n65 s SER 44 Cb 0.07 -2.19 0.07 0.00 0.21 0.00 0.00 66.02 64.19 1n65 s SER 44 CO 0.25 -0.80 1.14 0.42 0.41 0.00 0.00 173.24 174.66 1n65 s THR 45 N 1.36 2.54 0.06 1.44 -4.23 -1.26 -4.31 115.64 111.24 1n65 s THR 45 Ca 0.05 0.17 -0.18 0.00 -1.18 0.00 0.00 61.69 60.56 1n65 s THR 45 Cb -0.27 -3.08 -0.07 0.00 1.34 0.00 0.00 72.50 70.42 1n65 s THR 45 CO 0.01 -0.23 1.28 0.25 -0.54 0.00 0.00 174.62 175.40 1n65 h LEU 46 N -1.06 -0.86 -0.83 4.79 7.12 -1.87 0.77 115.31 123.37 1n65 h LEU 46 Ca -0.47 0.10 0.20 0.00 0.13 0.00 0.00 57.88 57.84 1n65 h LEU 46 Cb 1.30 0.33 -0.15 0.00 -0.53 0.00 0.00 40.66 41.61 1n65 h LEU 46 CO 0.64 -0.27 0.04 0.44 -0.13 0.00 0.00 178.44 179.16 1n65 h ASP 47 N -0.34 -0.33 -0.52 1.25 3.32 -1.98 0.79 116.42 118.61 1n65 h ASP 47 Ca 0.01 0.22 0.03 0.00 0.02 0.00 0.00 57.03 57.30 1n65 h ASP 47 Cb 0.37 0.37 -0.04 0.00 0.22 0.00 0.00 39.33 40.25 1n65 h ASP 47 CO -0.19 -0.21 0.30 -0.33 -1.72 0.00 0.00 179.24 177.09 1n65 h GLU 48 N 0.10 0.59 0.64 3.56 5.08 -1.52 -1.94 114.58 121.09 1n65 h GLU 48 Ca 0.48 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.77 1n65 h GLU 48 Cb 0.89 -0.13 0.01 0.00 0.50 0.00 0.00 28.75 30.02 1n65 h GLU 48 CO -0.73 0.39 -0.31 1.25 -1.00 0.00 0.00 179.01 178.61 1n65 h LEU 49 N 0.60 -0.73 -0.99 1.33 5.85 0.64 0.97 115.31 122.98 1n65 h LEU 49 Ca 0.21 -0.01 0.19 0.00 0.84 0.00 0.00 57.88 59.11 1n65 h LEU 49 Cb 0.03 0.19 -0.19 0.00 0.37 0.00 0.00 40.66 41.07 1n65 h LEU 49 CO -0.10 -0.43 -0.26 0.33 -0.34 0.00 0.00 178.44 177.63 1n65 n PHE 50 N -5.41 0.33 0.00 1.25 7.35 0.19 0.19 117.46 121.36 1n65 n PHE 50 Ca -0.13 1.21 -0.18 0.00 -0.76 0.00 0.00 57.45 57.59 1n65 n PHE 50 Cb 0.36 -1.05 -0.10 0.00 0.35 0.00 0.00 39.48 39.04 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 0.51 0.42 -4.13 4.81 -1.22 -2.36 114.58 112.61 1n65 h GLU 51 Ca 0.46 -0.51 -0.01 0.00 -0.13 0.00 0.00 59.36 59.18 1n65 h GLU 51 Cb 0.71 0.13 -0.02 0.00 0.63 0.00 0.00 28.75 30.20 1n65 h GLU 51 CO -1.02 1.14 -0.41 1.49 -0.73 0.00 0.00 179.01 179.49 1n65 h GLU 52 N 0.07 -0.82 -0.04 1.92 4.81 0.50 -2.83 114.58 118.19 1n65 h GLU 52 Ca -0.08 0.06 0.04 0.00 -0.13 0.00 0.00 59.36 59.25 1n65 h GLU 52 Cb 1.36 0.19 -0.05 0.00 0.63 0.00 0.00 28.75 30.87 1n65 h GLU 52 CO 0.13 -0.55 -0.24 -0.07 -0.73 0.00 0.00 179.01 177.56 1n65 h LEU 53 N -0.85 -0.71 -8.34 1.64 3.38 0.20 -3.33 115.31 107.31 1n65 h LEU 53 Ca -0.04 0.10 -0.43 0.00 0.09 0.00 0.00 57.88 57.60 1n65 h LEU 53 Cb 0.75 0.30 -0.05 0.00 0.09 0.00 0.00 40.66 41.75 1n65 h LEU 53 CO -0.06 -0.30 1.10 -0.62 0.09 0.00 0.00 178.44 178.65 1n65 s ASP 54 N -4.93 5.41 -0.04 -0.43 2.15 -0.89 -4.77 116.67 113.18 1n65 s ASP 54 Ca -0.15 -0.30 -0.01 0.00 0.43 0.00 0.00 52.55 52.52 1n65 s ASP 54 Cb 0.10 -2.55 -0.00 0.00 -0.30 0.00 0.00 42.92 40.16 1n65 s ASP 54 CO 0.66 -2.40 -0.03 0.50 -0.17 0.00 0.00 175.17 173.74 1n65 h LYS 55 N 12.60 0.00 0.14 4.34 3.64 -1.72 -3.40 116.57 132.17 1n65 h LYS 55 Ca -0.08 0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.31 1n65 h LYS 55 Cb 1.08 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 32.85 1n65 h LYS 55 CO 1.24 0.00 -0.50 -2.95 -2.27 0.00 0.00 179.45 174.97 1n65 h ASN 56 N -0.29 -1.48 0.00 4.20 -1.07 -1.94 -3.49 115.58 111.51 1n65 h ASN 56 Ca 0.00 0.16 0.00 0.00 0.07 0.00 0.00 56.30 56.53 1n65 h ASN 56 Cb 0.08 0.55 0.00 0.00 -2.07 0.00 0.00 38.32 36.87 1n65 h ASN 56 CO 0.00 -0.55 0.00 0.61 0.07 0.00 0.00 177.43 177.56 1n65 n GLY 57 N -1.49 0.42 2.75 9.14 0.00 -1.26 -4.98 105.19 109.76 1n65 n GLY 57 Ca -0.08 -0.34 -0.13 0.00 0.00 0.00 0.00 46.02 45.47 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 0.00 -5.65 -3.95 1.61 8.00 -1.26 -3.09 116.55 112.21 1n65 n ASP 58 Ca 0.00 0.31 -0.36 0.00 0.71 0.00 0.00 54.79 55.45 1n65 n ASP 58 Cb 0.00 -4.29 0.01 0.00 -0.02 0.00 0.00 41.12 36.82 1n65 n ASP 58 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1n65 n GLY 59 N 0.15 -0.78 0.00 0.44 0.00 -1.26 -4.87 105.19 98.87 1n65 n GLY 59 Ca -0.13 0.32 0.00 0.00 0.00 0.00 0.00 46.02 46.22 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 -4.02 0.00 -3.75 1.61 1.02 -1.18 -5.05 120.64 109.26 1n65 n GLU 60 Ca -0.13 0.00 -0.27 0.00 -0.02 0.00 0.00 57.16 56.74 1n65 n GLU 60 Cb 0.49 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.88 1n65 n GLU 60 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1n65 s VAL 61 N -2.00 5.23 0.14 2.62 1.01 -1.13 -4.67 120.40 121.60 1n65 s VAL 61 Ca 0.00 -0.47 0.05 0.00 0.00 0.00 0.00 61.98 61.56 1n65 s VAL 61 Cb 0.00 -3.75 -0.04 0.00 0.00 0.00 0.00 36.38 32.59 1n65 s VAL 61 CO 0.00 -0.18 -0.12 -0.94 0.00 0.00 0.00 175.10 173.86 1n65 s SER 62 N -3.26 1.94 0.16 3.32 1.04 -1.26 0.19 113.70 115.83 1n65 s SER 62 Ca 0.37 -0.91 -0.23 0.00 0.48 0.00 0.00 55.95 55.67 1n65 s SER 62 Cb -0.11 -0.05 0.04 0.00 0.10 0.00 0.00 66.02 66.01 1n65 s SER 62 CO 0.29 -0.22 1.61 0.15 0.98 0.00 0.00 173.24 176.05 1n65 h PHE 63 N 3.15 -0.79 0.19 5.02 3.57 0.19 1.16 116.94 129.43 1n65 h PHE 63 Ca -0.38 0.05 0.01 0.00 3.53 0.00 0.00 57.97 61.18 1n65 h PHE 63 Cb 1.20 0.39 -0.03 0.00 2.79 0.00 0.00 35.95 40.30 1n65 h PHE 63 CO 0.66 -0.36 -0.27 1.05 -2.23 0.00 0.00 178.31 177.15 1n65 h GLU 64 N -0.26 -0.51 -0.15 1.11 4.11 -1.97 1.25 114.58 118.16 1n65 h GLU 64 Ca 0.15 0.03 0.03 0.00 0.07 0.00 0.00 59.36 59.65 1n65 h GLU 64 Cb 0.51 0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.87 1n65 h GLU 64 CO -0.47 -0.34 0.10 0.93 0.07 0.00 0.00 179.01 179.31 1n65 h GLU 65 N -0.53 0.05 0.12 1.06 5.08 -1.71 -1.61 114.58 117.05 1n65 h GLU 65 Ca 0.01 -0.00 -0.30 0.00 -1.00 0.00 0.00 59.36 58.07 1n65 h GLU 65 Cb 0.52 -0.01 0.03 0.00 0.50 0.00 0.00 28.75 29.79 1n65 h GLU 65 CO -0.11 0.03 -1.25 0.35 -1.00 0.00 0.00 179.01 177.03 1n65 h PHE 66 N 0.05 1.01 -0.95 4.33 3.57 0.27 -3.20 116.94 122.01 1n65 h PHE 66 Ca 0.07 -0.64 0.28 0.00 3.53 0.00 0.00 57.97 61.21 1n65 h PHE 66 Cb 0.21 -0.08 -0.04 0.00 2.79 0.00 0.00 35.95 38.83 1n65 h PHE 66 CO -0.00 1.48 0.84 1.96 -2.23 0.00 0.00 178.31 180.36 1n65 h GLN 67 N 0.28 0.00 -0.50 1.11 4.20 0.25 1.47 115.11 121.92 1n65 h GLN 67 Ca -0.19 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.51 1n65 h GLN 67 Cb 1.92 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 29.68 1n65 h GLN 67 CO 0.24 0.00 0.28 0.28 -0.67 0.00 0.00 178.83 178.96 1n65 h VAL 68 N 0.00 1.15 0.19 -0.54 2.07 -1.54 0.25 116.25 117.83 1n65 h VAL 68 Ca 0.45 -0.37 -0.25 0.00 0.82 0.00 0.00 66.70 67.36 1n65 h VAL 68 Cb 2.14 0.46 0.03 0.00 -1.52 0.00 0.00 31.29 32.40 1n65 h VAL 68 CO -0.00 0.17 -1.09 0.25 0.02 0.00 0.00 177.57 176.91 1n65 h LEU 69 N 0.70 0.63 -0.60 2.57 5.85 0.18 -3.20 115.31 121.43 1n65 h LEU 69 Ca 0.18 -0.94 0.11 0.00 0.84 0.00 0.00 57.88 58.07 1n65 h LEU 69 Cb 0.01 -0.20 -0.08 0.00 0.37 0.00 0.00 40.66 40.75 1n65 h LEU 69 CO -0.03 1.52 0.16 0.58 -0.34 0.00 0.00 178.44 180.33 1n65 h VAL 70 N -0.16 0.68 -0.75 1.05 2.07 -0.85 0.64 116.25 118.93 1n65 h VAL 70 Ca -0.19 -0.10 0.09 0.00 0.82 0.00 0.00 66.70 67.32 1n65 h VAL 70 Cb 1.86 0.35 -0.07 0.00 -1.52 0.00 0.00 31.29 31.91 1n65 h VAL 70 CO 0.20 0.06 0.40 0.50 0.02 0.00 0.00 177.57 178.75 1n65 h LYS 71 N 0.31 0.65 0.00 1.57 3.64 -1.04 1.48 116.57 123.17 1n65 h LYS 71 Ca 0.31 -0.04 -0.09 0.00 -1.27 0.00 0.00 60.65 59.56 1n65 h LYS 71 Cb 0.44 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.10 1n65 h LYS 71 CO -0.37 0.43 -0.45 0.87 -2.27 0.00 0.00 179.45 177.66 1n65 h LYS 72 N 0.67 0.00 -0.02 1.90 1.79 -0.76 0.99 116.57 121.13 1n65 h LYS 72 Ca 0.37 0.00 -0.09 0.00 -2.18 0.00 0.00 60.65 58.75 1n65 h LYS 72 Cb 0.37 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.03 1n65 h LYS 72 CO -0.26 0.45 -0.32 0.82 -1.08 0.00 0.00 179.45 179.06 1n65 h ILE 73 N 0.00 1.49 0.17 1.86 2.04 0.37 -3.35 117.51 120.09 1n65 h ILE 73 Ca -0.00 -1.89 -0.01 0.00 1.00 0.00 0.00 64.86 63.96 1n65 h ILE 73 Cb 0.88 2.60 0.00 0.00 -0.74 0.00 0.00 36.82 39.56 1n65 h ILE 73 CO 0.06 0.53 -0.08 -1.28 0.00 0.00 0.00 178.15 177.38 1n65 h SER 74 N -0.34 -0.19 0.00 1.72 0.87 0.20 -3.50 113.55 112.30 1n65 h SER 74 Ca -0.03 -0.33 0.00 0.00 -1.23 0.00 0.00 61.79 60.20 1n65 h SER 74 Cb 1.04 0.05 0.00 0.00 -0.44 0.00 0.00 62.40 63.05 1n65 h SER 74 CO 0.06 0.36 0.00 1.67 -0.53 0.00 0.00 176.83 178.39