#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 4.67 0.17 4.39 0.15 -1.26 -4.97 113.70 116.85 1n65 s SER 2 Ca 0.00 0.99 0.01 0.00 0.70 0.00 0.00 55.95 57.65 1n65 s SER 2 Cb 0.00 -1.63 0.02 0.00 -1.71 0.00 0.00 66.02 62.70 1n65 s SER 2 CO 0.00 -1.82 1.40 1.55 1.20 0.00 0.00 173.24 175.56 1n65 h PRO 3 N -0.99 0.28 -0.11 5.44 0.13 -2.04 -2.90 132.00 131.80 1n65 h PRO 3 Ca -0.46 -0.28 0.02 0.00 -0.87 0.00 0.00 66.00 64.41 1n65 h PRO 3 Cb 1.30 0.07 -0.02 0.00 0.13 0.00 0.00 31.00 32.48 1n65 h PRO 3 CO 0.64 0.96 -0.03 0.93 -0.23 0.00 0.00 178.00 180.27 1n65 h GLU 4 N 0.17 -0.00 0.58 0.86 4.39 -1.98 0.29 114.58 118.89 1n65 h GLU 4 Ca -0.04 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.63 1n65 h GLU 4 Cb 1.43 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 30.09 1n65 h GLU 4 CO 0.13 -0.00 -0.28 0.93 -1.16 0.00 0.00 179.01 178.63 1n65 h GLU 5 N -0.00 -0.75 -0.32 2.33 5.08 -1.96 0.14 114.58 119.09 1n65 h GLU 5 Ca 0.05 0.05 0.07 0.00 -1.00 0.00 0.00 59.36 58.54 1n65 h GLU 5 Cb 0.08 0.17 -0.08 0.00 0.50 0.00 0.00 28.75 29.42 1n65 h GLU 5 CO -0.12 -0.50 -0.27 -0.07 -1.00 0.00 0.00 179.01 177.06 1n65 h LEU 6 N -0.78 -0.88 0.24 1.33 3.38 -1.34 0.85 115.31 118.10 1n65 h LEU 6 Ca -0.08 0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1n65 h LEU 6 Cb 0.60 0.42 -0.04 0.00 0.09 0.00 0.00 40.66 41.73 1n65 h LEU 6 CO 0.13 -0.29 -0.51 0.50 0.09 0.00 0.00 178.44 178.36 1n65 h LYS 7 N -0.24 -0.78 -0.35 1.13 3.11 -0.26 0.75 116.57 119.93 1n65 h LYS 7 Ca 0.16 0.05 0.08 0.00 -2.81 0.00 0.00 60.65 58.13 1n65 h LYS 7 Cb 0.49 0.18 -0.08 0.00 -1.00 0.00 0.00 32.23 31.82 1n65 h LYS 7 CO -0.46 -0.52 -0.23 0.78 -2.81 0.00 0.00 179.45 176.20 1n65 h GLY 8 N -0.81 -0.05 0.46 5.01 0.00 0.03 0.18 103.07 107.88 1n65 h GLY 8 Ca -0.02 0.29 0.03 0.00 0.00 0.00 0.00 47.33 47.63 1n65 h GLY 8 CO -0.21 -0.20 -0.22 -2.22 0.00 0.00 0.00 176.54 173.69 1n65 h ILE 9 N -0.19 0.49 -0.40 2.60 2.04 0.12 0.52 117.51 122.69 1n65 h ILE 9 Ca 0.17 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.12 1n65 h ILE 9 Cb 0.46 0.49 -0.09 0.00 -0.74 0.00 0.00 36.82 36.94 1n65 h ILE 9 CO -0.46 0.00 -0.19 0.15 0.00 0.00 0.00 178.15 177.65 1n65 h PHE 10 N -0.33 -0.48 -0.32 1.37 3.04 0.15 -1.30 116.94 119.07 1n65 h PHE 10 Ca 0.07 0.04 -0.00 0.00 3.98 0.00 0.00 57.97 62.06 1n65 h PHE 10 Cb 0.42 0.27 -0.02 0.00 2.56 0.00 0.00 35.95 39.19 1n65 h PHE 10 CO -0.27 -0.27 0.19 0.93 -2.02 0.00 0.00 178.31 176.87 1n65 h GLU 11 N -0.12 0.43 -1.65 1.11 5.08 -0.10 0.30 114.58 119.64 1n65 h GLU 11 Ca 0.19 -0.04 0.49 0.00 -1.00 0.00 0.00 59.36 59.00 1n65 h GLU 11 Cb 0.42 -0.09 -0.08 0.00 0.50 0.00 0.00 28.75 29.49 1n65 h GLU 11 CO -0.47 0.34 1.17 -0.22 -1.00 0.00 0.00 179.01 178.82 1n65 h LYS 12 N 0.41 0.02 0.01 2.33 3.64 0.12 0.90 116.57 124.00 1n65 h LYS 12 Ca 0.11 -0.00 -0.37 0.00 -1.27 0.00 0.00 60.65 59.12 1n65 h LYS 12 Cb 0.02 -0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 31.78 1n65 h LYS 12 CO -0.02 0.01 -2.04 0.66 -2.27 0.00 0.00 179.45 175.79 1n65 n TYR 13 N -4.17 0.47 -0.10 1.91 4.01 -0.62 -3.83 117.16 114.83 1n65 n TYR 13 Ca 0.39 0.18 0.26 0.00 -0.16 0.00 0.00 57.90 58.56 1n65 n TYR 13 Cb 1.71 -1.05 0.72 0.00 -0.31 0.00 0.00 39.34 40.41 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 -0.63 2.67 -0.03 -0.72 0.00 0.22 1.12 119.26 121.89 1n65 h ALA 14 Ca -0.54 -0.03 -0.19 0.00 0.00 0.00 0.00 54.91 54.15 1n65 h ALA 14 Cb 1.57 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.41 1n65 h ALA 14 CO -0.27 -0.97 -0.79 0.00 0.00 0.00 0.00 179.25 177.21 1n65 h ALA 15 N 1.55 0.59 0.37 0.00 0.00 0.52 -3.18 119.26 119.10 1n65 h ALA 15 Ca 0.36 -0.66 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 1n65 h ALA 15 Cb 1.52 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 19.22 1n65 h ALA 15 CO -0.00 0.83 -0.40 0.87 0.00 0.00 0.00 179.25 180.55 1n65 h LYS 16 N 0.17 -0.75 -5.26 0.00 1.57 0.12 -3.41 116.57 109.01 1n65 h LYS 16 Ca -0.04 0.05 -0.63 0.00 -1.87 0.00 0.00 60.65 58.17 1n65 h LYS 16 Cb 1.38 0.17 -0.19 0.00 0.08 0.00 0.00 32.23 33.68 1n65 h LYS 16 CO 0.13 -0.50 -0.61 -1.21 -0.57 0.00 0.00 179.45 176.69 1n65 s GLU 17 N -5.22 3.83 0.22 3.15 2.02 -1.06 -5.01 118.70 116.63 1n65 s GLU 17 Ca -0.14 -0.42 0.00 0.00 0.02 0.00 0.00 54.97 54.43 1n65 s GLU 17 Cb 0.03 -3.11 0.00 0.00 0.10 0.00 0.00 34.13 31.16 1n65 s GLU 17 CO 0.47 0.22 0.00 0.41 0.02 0.00 0.00 175.26 176.38 1n65 n GLY 18 N 3.65 -1.23 3.12 -1.39 0.00 -1.26 -4.69 105.19 103.39 1n65 n GLY 18 Ca -0.17 -0.67 -0.36 0.00 0.00 0.00 0.00 46.02 44.82 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 -4.34 -4.86 0.00 1.61 2.03 -1.26 -4.25 116.55 105.48 1n65 n ASP 19 Ca -0.00 0.30 0.12 0.00 0.52 0.00 0.00 54.79 55.73 1n65 n ASP 19 Cb 0.60 -0.86 0.71 0.00 -0.72 0.00 0.00 41.12 40.86 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 1.60 0.75 -0.00 -0.67 -0.04 -1.20 -1.86 135.00 133.58 1n65 n PRO 20 Ca 0.01 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.56 1n65 n PRO 20 Cb 0.54 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.39 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 -1.00 0.86 -4.52 3.54 3.02 -1.26 -4.55 115.26 111.35 1n65 n ASN 21 Ca 0.18 -0.89 -0.31 0.00 -0.03 0.00 0.00 54.58 53.53 1n65 n ASN 21 Cb 0.08 1.05 -0.12 0.00 -0.61 0.00 0.00 39.78 40.19 1n65 n ASN 21 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1n65 s GLN 22 N -2.79 2.20 0.47 3.52 -2.07 -0.78 0.73 119.66 120.95 1n65 s GLN 22 Ca 0.06 -0.93 0.05 0.00 -1.82 0.00 0.00 55.36 52.73 1n65 s GLN 22 Cb 0.14 -2.29 -0.02 0.00 -1.09 0.00 0.00 33.01 29.75 1n65 s GLN 22 CO 0.77 0.55 0.21 -0.51 -1.32 0.00 0.00 175.29 174.98 1n65 s LEU 23 N -1.59 2.81 0.03 2.60 2.01 -0.97 -4.51 118.68 119.06 1n65 s LEU 23 Ca 0.17 -1.26 -0.00 0.00 0.01 0.00 0.00 54.13 53.04 1n65 s LEU 23 Cb -0.11 -1.20 -0.02 0.00 0.01 0.00 0.00 46.19 44.87 1n65 s LEU 23 CO 0.07 -0.78 -0.03 -0.44 1.01 0.00 0.00 176.35 176.19 1n65 s SER 24 N -4.01 0.28 0.12 2.29 0.01 -1.26 -3.05 113.70 108.07 1n65 s SER 24 Ca 0.31 -0.58 -0.32 0.00 1.31 0.00 0.00 55.95 56.67 1n65 s SER 24 Cb 0.02 0.12 -0.11 0.00 0.21 0.00 0.00 66.02 66.26 1n65 s SER 24 CO 0.18 -0.35 1.56 0.50 0.41 0.00 0.00 173.24 175.54 1n65 h LYS 25 N 4.38 -0.57 -0.78 12.44 3.64 -1.98 1.10 116.57 134.80 1n65 h LYS 25 Ca -0.32 0.04 0.10 0.00 -1.27 0.00 0.00 60.65 59.19 1n65 h LYS 25 Cb 1.20 0.13 -0.07 0.00 -0.41 0.00 0.00 32.23 33.07 1n65 h LYS 25 CO 0.45 -0.38 0.42 1.49 -2.27 0.00 0.00 179.45 179.16 1n65 h GLU 26 N -0.59 0.68 0.46 1.90 4.81 -1.99 0.27 114.58 120.12 1n65 h GLU 26 Ca 0.04 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.21 1n65 h GLU 26 Cb 0.68 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.91 1n65 h GLU 26 CO -0.39 0.45 -0.22 0.93 -0.73 0.00 0.00 179.01 179.05 1n65 h GLU 27 N 0.70 -0.59 -0.71 1.92 5.08 -1.50 -2.67 114.58 116.81 1n65 h GLU 27 Ca 0.38 0.04 0.15 0.00 -1.00 0.00 0.00 59.36 58.93 1n65 h GLU 27 Cb 0.38 0.13 -0.13 0.00 0.50 0.00 0.00 28.75 29.63 1n65 h GLU 27 CO -0.26 -0.39 -0.11 1.25 -1.00 0.00 0.00 179.01 178.50 1n65 h LEU 28 N -0.64 -0.53 -0.96 1.33 5.85 0.14 0.91 115.31 121.40 1n65 h LEU 28 Ca -0.06 0.20 0.12 0.00 0.84 0.00 0.00 57.88 58.98 1n65 h LEU 28 Cb 0.47 0.40 -0.14 0.00 0.37 0.00 0.00 40.66 41.76 1n65 h LEU 28 CO 0.10 -0.21 -0.49 0.50 -0.34 0.00 0.00 178.44 178.00 1n65 h LYS 29 N 0.04 -0.02 0.21 1.25 3.64 -0.38 1.05 116.57 122.35 1n65 h LYS 29 Ca 0.36 0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.75 1n65 h LYS 29 Cb 0.59 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.37 1n65 h LYS 29 CO -0.69 -0.01 -0.38 -0.07 -2.27 0.00 0.00 179.45 176.02 1n65 h LEU 30 N -0.02 -1.09 -0.08 5.20 3.38 -0.50 0.26 115.31 122.46 1n65 h LEU 30 Ca 0.24 0.11 0.01 0.00 0.09 0.00 0.00 57.88 58.34 1n65 h LEU 30 Cb 0.50 0.40 -0.03 0.00 0.09 0.00 0.00 40.66 41.62 1n65 h LEU 30 CO -0.94 -0.48 -0.25 0.25 0.09 0.00 0.00 178.44 177.11 1n65 h LEU 31 N -0.67 -0.79 -1.57 1.67 5.85 0.21 0.83 115.31 120.84 1n65 h LEU 31 Ca 0.01 0.09 0.07 0.00 0.84 0.00 0.00 57.88 58.89 1n65 h LEU 31 Cb 0.66 0.31 -0.01 0.00 0.37 0.00 0.00 40.66 41.99 1n65 h LEU 31 CO -0.17 -0.21 0.57 -0.07 -0.34 0.00 0.00 178.44 178.21 1n65 h LEU 32 N -0.25 0.00 0.31 2.25 3.38 0.11 2.60 115.31 123.72 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 0.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1n65 h LEU 32 CO -0.21 0.00 -0.15 -0.61 0.09 0.00 0.00 178.44 177.56 1n65 h GLN 33 N 0.00 -0.41 0.00 1.13 4.15 0.42 0.17 115.11 120.58 1n65 h GLN 33 Ca 0.11 0.03 -0.16 0.00 0.77 0.00 0.00 58.65 59.40 1n65 h GLN 33 Cb 1.24 0.09 -0.02 0.00 0.21 0.00 0.00 27.48 29.00 1n65 h GLN 33 CO -0.00 -0.09 -0.90 1.15 -1.93 0.00 0.00 178.83 177.05 1n65 h THR 34 N -0.97 0.95 -0.10 2.39 2.02 0.13 -3.22 112.91 114.11 1n65 h THR 34 Ca -0.04 -2.05 0.02 0.00 0.77 0.00 0.00 66.41 65.11 1n65 h THR 34 Cb 0.50 2.13 -0.03 0.00 -1.74 0.00 0.00 68.15 69.01 1n65 h THR 34 CO 0.07 0.32 -0.26 -0.08 0.37 0.00 0.00 175.52 175.95 1n65 h GLU 35 N -1.00 -0.24 -1.89 6.66 4.81 0.42 -3.40 114.58 119.94 1n65 h GLU 35 Ca -0.24 0.02 -0.32 0.00 -0.13 0.00 0.00 59.36 58.69 1n65 h GLU 35 Cb 1.12 0.05 -0.30 0.00 0.63 0.00 0.00 28.75 30.25 1n65 h GLU 35 CO -0.14 -0.16 -0.65 -0.06 -0.73 0.00 0.00 179.01 177.27 1n65 s PHE 36 N -4.25 -0.49 0.12 0.92 0.08 -1.13 -4.99 117.98 108.24 1n65 s PHE 36 Ca -0.07 -0.52 0.14 0.00 0.12 0.00 0.00 56.93 56.60 1n65 s PHE 36 Cb 0.04 -0.34 0.34 0.00 -0.57 0.00 0.00 43.02 42.48 1n65 s PHE 36 CO 0.28 -0.98 1.57 -1.00 -0.10 0.00 0.00 175.22 175.00 1n65 h PRO 37 N 7.37 0.00 -0.11 0.24 0.13 -0.67 -3.03 132.00 135.92 1n65 h PRO 37 Ca 0.01 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.10 1n65 h PRO 37 Cb 1.07 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.20 1n65 h PRO 37 CO 0.22 0.56 -0.07 0.77 -0.23 0.00 0.00 178.00 179.25 1n65 h SER 38 N 0.00 0.15 0.57 1.44 0.02 -1.90 0.22 113.55 114.06 1n65 h SER 38 Ca -0.01 -0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 60.90 1n65 h SER 38 Cb 1.18 -0.04 -0.00 0.00 0.14 0.00 0.00 62.40 63.68 1n65 h SER 38 CO 0.07 0.25 -0.12 -0.07 -1.14 0.00 0.00 176.83 175.83 1n65 h LEU 39 N 0.17 0.00 -0.03 5.07 -0.00 -1.84 -1.76 115.31 116.92 1n65 h LEU 39 Ca 0.04 0.00 -0.11 0.00 -0.00 0.00 0.00 57.88 57.81 1n65 h LEU 39 Cb 0.24 0.00 0.01 0.00 -0.00 0.00 0.00 40.66 40.90 1n65 h LEU 39 CO 0.01 0.12 -0.42 -0.07 -0.00 0.00 0.00 178.44 178.08 1n65 h LEU 40 N 0.00 0.42 -1.90 1.67 3.38 -1.06 -3.10 115.31 114.71 1n65 h LEU 40 Ca -0.00 -0.72 -0.03 0.00 0.09 0.00 0.00 57.88 57.22 1n65 h LEU 40 Cb 0.43 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 1n65 h LEU 40 CO 0.02 1.08 -0.12 0.07 0.09 0.00 0.00 178.44 179.57 1n65 h LYS 41 N -0.21 0.00 -6.48 1.13 5.09 -1.19 -3.37 116.57 111.54 1n65 h LYS 41 Ca -0.04 0.00 -0.37 0.00 0.09 0.00 0.00 60.65 60.33 1n65 h LYS 41 Cb 1.11 0.00 0.20 0.00 0.10 0.00 0.00 32.23 33.64 1n65 h LYS 41 CO 0.08 0.12 -0.72 0.41 -2.09 0.00 0.00 179.45 177.25 1n65 n GLY 42 N -0.96 -2.63 0.33 0.07 0.00 -0.70 -4.79 105.19 96.50 1n65 n GLY 42 Ca -0.02 -0.89 0.21 0.00 0.00 0.00 0.00 46.02 45.31 1n65 n GLY 42 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1n65 h MET 43 N -2.45 0.00 -4.06 1.61 2.86 -1.85 -3.34 114.93 107.70 1n65 h MET 43 Ca -0.43 0.00 -0.76 0.00 -2.06 0.00 0.00 59.70 56.45 1n65 h MET 43 Cb 1.15 0.00 -0.25 0.00 0.06 0.00 0.00 31.60 32.56 1n65 h MET 43 CO 0.29 0.00 -0.19 -1.12 1.06 0.00 0.00 176.91 176.96 1n65 s SER 44 N -5.45 6.23 0.84 1.22 0.01 -1.26 -5.03 113.70 110.25 1n65 s SER 44 Ca -0.05 -1.94 -0.12 0.00 1.31 0.00 0.00 55.95 55.15 1n65 s SER 44 Cb 0.13 -2.19 0.09 0.00 0.21 0.00 0.00 66.02 64.27 1n65 s SER 44 CO 0.45 -0.80 1.16 0.42 0.41 0.00 0.00 173.24 174.88 1n65 s THR 45 N 1.35 2.16 0.06 1.44 -4.23 -1.26 -4.47 115.64 110.70 1n65 s THR 45 Ca 0.06 0.05 -0.16 0.00 -1.18 0.00 0.00 61.69 60.46 1n65 s THR 45 Cb -0.27 -2.95 -0.06 0.00 1.34 0.00 0.00 72.50 70.57 1n65 s THR 45 CO 0.01 -0.07 1.27 0.25 -0.54 0.00 0.00 174.62 175.54 1n65 h LEU 46 N -1.18 -0.89 -0.81 4.79 7.12 -1.90 0.62 115.31 123.06 1n65 h LEU 46 Ca -0.48 0.11 0.19 0.00 0.13 0.00 0.00 57.88 57.84 1n65 h LEU 46 Cb 1.32 0.36 -0.12 0.00 -0.53 0.00 0.00 40.66 41.69 1n65 h LEU 46 CO 0.64 -0.20 0.21 0.44 -0.13 0.00 0.00 178.44 179.40 1n65 h ASP 47 N -0.21 0.01 -0.73 1.25 3.32 -1.98 0.58 116.42 118.66 1n65 h ASP 47 Ca 0.03 0.17 0.07 0.00 0.02 0.00 0.00 57.03 57.32 1n65 h ASP 47 Cb 0.30 0.23 -0.06 0.00 0.22 0.00 0.00 39.33 40.01 1n65 h ASP 47 CO -0.27 -0.08 0.41 -0.33 -1.72 0.00 0.00 179.24 177.24 1n65 h GLU 48 N 0.25 0.71 0.69 3.56 5.08 -1.17 -1.46 114.58 122.24 1n65 h GLU 48 Ca 0.48 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.76 1n65 h GLU 48 Cb 0.88 -0.16 0.01 0.00 0.50 0.00 0.00 28.75 29.98 1n65 h GLU 48 CO -0.58 0.47 -0.33 1.25 -1.00 0.00 0.00 179.01 178.82 1n65 h LEU 49 N 0.73 -0.79 -1.25 1.33 5.85 0.52 0.19 115.31 121.90 1n65 h LEU 49 Ca 0.34 0.03 0.46 0.00 0.84 0.00 0.00 57.88 59.54 1n65 h LEU 49 Cb 0.26 0.20 -0.15 0.00 0.37 0.00 0.00 40.66 41.34 1n65 h LEU 49 CO -0.21 -0.45 0.76 0.33 -0.34 0.00 0.00 178.44 178.53 1n65 n PHE 50 N -5.11 0.86 0.08 1.25 7.35 0.50 0.19 117.46 122.59 1n65 n PHE 50 Ca -0.12 0.87 -0.06 0.00 -0.76 0.00 0.00 57.45 57.38 1n65 n PHE 50 Cb 0.37 -1.30 -0.04 0.00 0.35 0.00 0.00 39.48 38.86 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 -0.28 -0.41 -4.13 4.57 -1.07 -2.65 114.58 110.61 1n65 h GLU 51 Ca 0.87 0.02 0.07 0.00 -1.18 0.00 0.00 59.36 59.13 1n65 h GLU 51 Cb 2.63 0.06 -0.06 0.00 -0.16 0.00 0.00 28.75 31.23 1n65 h GLU 51 CO -0.57 -0.08 0.07 1.49 -1.18 0.00 0.00 179.01 178.74 1n65 h GLU 52 N -1.04 0.19 0.11 1.92 4.81 0.15 -2.54 114.58 118.18 1n65 h GLU 52 Ca -0.03 -0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.20 1n65 h GLU 52 Cb 0.33 -0.04 -0.05 0.00 0.63 0.00 0.00 28.75 29.62 1n65 h GLU 52 CO 0.05 0.12 -0.53 -0.07 -0.73 0.00 0.00 179.01 177.85 1n65 h LEU 53 N 0.19 -1.60 -8.36 1.64 3.38 0.19 -3.31 115.31 107.44 1n65 h LEU 53 Ca 0.20 0.17 -0.29 0.00 0.09 0.00 0.00 57.88 58.05 1n65 h LEU 53 Cb 0.25 0.59 -0.03 0.00 0.09 0.00 0.00 40.66 41.57 1n65 h LEU 53 CO -0.28 -0.56 0.82 -0.62 0.09 0.00 0.00 178.44 177.89 1n65 s ASP 54 N -4.65 4.79 -0.18 -0.43 2.15 -0.96 -4.70 116.67 112.69 1n65 s ASP 54 Ca -0.16 -0.07 -0.14 0.00 0.43 0.00 0.00 52.55 52.60 1n65 s ASP 54 Cb 0.06 -2.54 -0.09 0.00 -0.30 0.00 0.00 42.92 40.05 1n65 s ASP 54 CO 0.61 -2.94 -0.13 1.17 -0.17 0.00 0.00 175.17 173.70 1n65 n LYS 55 N 8.94 0.51 -0.37 4.34 3.00 -1.25 -4.41 118.16 128.92 1n65 n LYS 55 Ca 0.37 0.45 -0.03 0.00 -0.00 0.00 0.00 58.31 59.10 1n65 n LYS 55 Cb 0.48 -1.64 0.02 0.00 0.00 0.00 0.00 35.03 33.89 1n65 n LYS 55 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.40 176.49 1n65 h ASN 56 N -1.00 -1.52 0.00 3.14 4.21 -1.94 -3.46 115.58 115.02 1n65 h ASN 56 Ca -0.16 0.31 0.00 0.00 1.21 0.00 0.00 56.30 57.65 1n65 h ASN 56 Cb 0.92 0.77 0.00 0.00 -1.12 0.00 0.00 38.32 38.89 1n65 h ASN 56 CO -0.10 -0.28 0.00 0.61 -1.29 0.00 0.00 177.43 176.37 1n65 n GLY 57 N -1.44 2.30 0.00 2.83 0.00 -1.26 -5.09 105.19 102.53 1n65 n GLY 57 Ca 0.08 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.57 1n65 n GLY 57 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1n65 n ASP 58 N 0.00 0.00 0.00 1.61 5.75 -1.26 -5.03 116.55 117.62 1n65 n ASP 58 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.78 1n65 n ASP 58 Cb 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.09 1n65 n ASP 58 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1n65 n GLY 59 N 0.00 3.68 3.67 6.12 0.00 -1.26 -5.10 105.19 112.30 1n65 n GLY 59 Ca 0.00 -0.61 -0.65 0.00 0.00 0.00 0.00 46.02 44.75 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 0.00 -3.26 1.61 4.71 -1.26 -4.35 120.64 118.09 1n65 n GLU 60 Ca 0.00 0.00 -0.45 0.00 -0.01 0.00 0.00 57.16 56.70 1n65 n GLU 60 Cb 0.00 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 28.94 1n65 n GLU 60 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 1n65 n VAL 61 N 3.28 4.63 -1.24 2.62 0.31 -1.17 -4.65 118.33 122.11 1n65 n VAL 61 Ca 0.28 -5.38 -0.37 0.00 -0.01 0.00 0.00 64.34 58.86 1n65 n VAL 61 Cb -0.02 -2.52 0.06 0.00 -0.91 0.00 0.00 33.84 30.45 1n65 n VAL 61 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1n65 n SER 62 N 2.80 -1.84 -0.32 4.52 3.41 -1.26 -2.30 113.62 118.64 1n65 n SER 62 Ca 0.26 0.57 0.20 0.00 -0.26 0.00 0.00 58.87 59.64 1n65 n SER 62 Cb 0.39 -1.14 0.46 0.00 -0.26 0.00 0.00 64.21 63.66 1n65 n SER 62 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 1n65 h PHE 63 N -0.36 0.75 0.39 7.33 3.57 -0.03 0.14 116.94 128.74 1n65 h PHE 63 Ca -0.45 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.06 1n65 h PHE 63 Cb 1.36 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 39.88 1n65 h PHE 63 CO 0.32 0.10 -0.19 0.93 -2.23 0.00 0.00 178.31 177.24 1n65 h GLU 64 N 0.48 -0.51 -1.02 1.11 5.08 -1.87 0.22 114.58 118.06 1n65 h GLU 64 Ca 0.58 0.03 0.30 0.00 -1.00 0.00 0.00 59.36 59.27 1n65 h GLU 64 Cb 1.34 0.12 -0.04 0.00 0.50 0.00 0.00 28.75 30.66 1n65 h GLU 64 CO -0.32 -0.34 0.82 0.93 -1.00 0.00 0.00 179.01 179.11 1n65 h GLU 65 N -0.62 0.00 0.05 2.33 5.08 -1.72 0.48 114.58 120.17 1n65 h GLU 65 Ca -0.05 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.12 1n65 h GLU 65 Cb 0.41 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.67 1n65 h GLU 65 CO 0.09 0.00 -0.77 0.35 -1.00 0.00 0.00 179.01 177.68 1n65 h PHE 66 N 0.00 0.68 -0.94 4.33 3.57 -0.73 -3.20 116.94 120.66 1n65 h PHE 66 Ca 0.49 -0.40 0.27 0.00 3.53 0.00 0.00 57.97 61.85 1n65 h PHE 66 Cb 2.12 -0.06 -0.04 0.00 2.79 0.00 0.00 35.95 40.76 1n65 h PHE 66 CO 0.00 1.25 0.87 1.96 -2.23 0.00 0.00 178.31 180.16 1n65 h GLN 67 N -0.08 0.00 -0.66 1.11 4.20 0.33 1.47 115.11 121.48 1n65 h GLN 67 Ca -0.11 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.59 1n65 h GLN 67 Cb 1.50 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 29.24 1n65 h GLN 67 CO 0.15 0.00 0.38 0.28 -0.67 0.00 0.00 178.83 178.97 1n65 h VAL 68 N 0.00 1.19 0.11 -0.54 2.07 -1.51 0.80 116.25 118.37 1n65 h VAL 68 Ca 0.45 -0.45 -0.23 0.00 0.82 0.00 0.00 66.70 67.29 1n65 h VAL 68 Cb 2.18 0.28 0.02 0.00 -1.52 0.00 0.00 31.29 32.26 1n65 h VAL 68 CO -0.00 0.21 -0.96 0.25 0.02 0.00 0.00 177.57 177.08 1n65 h LEU 69 N 0.91 0.65 -0.58 2.57 5.85 0.18 -3.16 115.31 121.74 1n65 h LEU 69 Ca 0.24 -0.86 0.09 0.00 0.84 0.00 0.00 57.88 58.19 1n65 h LEU 69 Cb -0.01 -0.21 -0.07 0.00 0.37 0.00 0.00 40.66 40.74 1n65 h LEU 69 CO -0.04 1.45 0.18 0.58 -0.34 0.00 0.00 178.44 180.27 1n65 h VAL 70 N -0.05 0.74 -0.67 1.05 2.07 -0.89 0.39 116.25 118.90 1n65 h VAL 70 Ca -0.15 -0.12 0.10 0.00 0.82 0.00 0.00 66.70 67.35 1n65 h VAL 70 Cb 1.69 0.37 -0.07 0.00 -1.52 0.00 0.00 31.29 31.76 1n65 h VAL 70 CO 0.18 0.06 0.30 0.50 0.02 0.00 0.00 177.57 178.64 1n65 h LYS 71 N 0.35 0.50 0.00 1.57 3.11 -0.91 1.12 116.57 122.30 1n65 h LYS 71 Ca 0.29 -0.03 -0.04 0.00 -2.81 0.00 0.00 60.65 58.06 1n65 h LYS 71 Cb 0.38 -0.11 -0.01 0.00 -1.00 0.00 0.00 32.23 31.49 1n65 h LYS 71 CO -0.32 0.33 -0.19 0.87 -2.81 0.00 0.00 179.45 177.33 1n65 h LYS 72 N 0.52 0.00 0.02 1.90 1.79 -0.92 1.18 116.57 121.06 1n65 h LYS 72 Ca 0.34 0.00 -0.06 0.00 -2.18 0.00 0.00 60.65 58.75 1n65 h LYS 72 Cb 0.39 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.05 1n65 h LYS 72 CO -0.29 0.19 -0.25 0.82 -1.08 0.00 0.00 179.45 178.84 1n65 h ILE 73 N 0.00 1.62 0.12 1.86 2.04 0.40 -3.37 117.51 120.18 1n65 h ILE 73 Ca -0.00 -2.15 -0.01 0.00 1.00 0.00 0.00 64.86 63.70 1n65 h ILE 73 Cb 0.65 3.03 0.00 0.00 -0.74 0.00 0.00 36.82 39.76 1n65 h ILE 73 CO 0.03 0.58 -0.06 0.28 0.00 0.00 0.00 178.15 178.98 1n65 h SER 74 N -0.64 -0.13 0.00 1.72 0.02 0.12 -3.51 113.55 111.13 1n65 h SER 74 Ca -0.04 -0.38 0.00 0.00 -0.84 0.00 0.00 61.79 60.54 1n65 h SER 74 Cb 1.09 0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.67 1n65 h SER 74 CO 0.05 0.49 0.00 1.67 -1.14 0.00 0.00 176.83 177.89