#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 5.06 0.12 4.39 0.01 -1.26 -4.97 113.70 117.05 1n65 s SER 2 Ca 0.00 1.37 -0.08 0.00 1.31 0.00 0.00 55.95 58.55 1n65 s SER 2 Cb 0.00 -2.18 -0.11 0.00 0.21 0.00 0.00 66.02 63.94 1n65 s SER 2 CO 0.00 -1.61 1.30 1.55 0.41 0.00 0.00 173.24 174.88 1n65 h PRO 3 N -0.84 0.56 -0.28 12.44 0.13 -2.05 -2.82 132.00 139.14 1n65 h PRO 3 Ca -0.45 -0.54 0.03 0.00 -0.87 0.00 0.00 66.00 64.16 1n65 h PRO 3 Cb 1.24 0.14 -0.03 0.00 0.13 0.00 0.00 31.00 32.48 1n65 h PRO 3 CO 0.60 1.17 0.08 1.49 -0.23 0.00 0.00 178.00 181.10 1n65 h GLU 4 N 0.34 0.19 0.26 0.86 4.22 -1.99 0.64 114.58 119.11 1n65 h GLU 4 Ca -0.08 -0.01 -0.01 0.00 0.08 0.00 0.00 59.36 59.34 1n65 h GLU 4 Cb 1.53 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.74 1n65 h GLU 4 CO 0.17 0.13 -0.13 0.93 -2.18 0.00 0.00 179.01 177.93 1n65 h GLU 5 N 0.19 -0.34 -0.59 1.92 4.39 -1.96 -1.16 114.58 117.03 1n65 h GLU 5 Ca 0.13 0.02 0.12 0.00 0.34 0.00 0.00 59.36 59.97 1n65 h GLU 5 Cb 0.11 0.08 -0.10 0.00 -0.10 0.00 0.00 28.75 28.74 1n65 h GLU 5 CO -0.14 -0.22 0.04 -0.07 -1.16 0.00 0.00 179.01 177.45 1n65 h LEU 6 N -0.36 -0.18 0.31 1.33 3.38 -1.22 1.40 115.31 119.96 1n65 h LEU 6 Ca -0.04 0.14 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 1n65 h LEU 6 Cb 0.28 0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.23 1n65 h LEU 6 CO 0.06 -0.07 -0.39 0.50 0.09 0.00 0.00 178.44 178.62 1n65 h LYS 7 N 0.16 -0.69 -0.76 1.13 1.63 -0.52 -0.08 116.57 117.44 1n65 h LYS 7 Ca 0.31 0.05 0.09 0.00 -0.85 0.00 0.00 60.65 60.25 1n65 h LYS 7 Cb 0.49 0.16 -0.05 0.00 -0.60 0.00 0.00 32.23 32.23 1n65 h LYS 7 CO -0.48 -0.46 0.50 0.78 -3.45 0.00 0.00 179.45 176.34 1n65 h GLY 8 N -0.72 0.98 0.48 5.01 0.00 -0.41 -1.92 103.07 106.49 1n65 h GLY 8 Ca -0.04 -0.29 0.03 0.00 0.00 0.00 0.00 47.33 47.03 1n65 h GLY 8 CO -0.10 0.18 -0.24 -2.22 0.00 0.00 0.00 176.54 174.17 1n65 h ILE 9 N 0.71 0.46 -0.37 2.60 2.04 0.27 0.63 117.51 123.84 1n65 h ILE 9 Ca 0.34 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.28 1n65 h ILE 9 Cb 0.41 0.46 -0.08 0.00 -0.74 0.00 0.00 36.82 36.86 1n65 h ILE 9 CO -0.12 0.00 -0.22 0.15 0.00 0.00 0.00 178.15 177.95 1n65 h PHE 10 N -0.38 -0.57 -0.24 1.37 3.04 -0.23 -1.43 116.94 118.50 1n65 h PHE 10 Ca 0.06 0.05 -0.00 0.00 3.98 0.00 0.00 57.97 62.05 1n65 h PHE 10 Cb 0.45 0.31 -0.01 0.00 2.56 0.00 0.00 35.95 39.26 1n65 h PHE 10 CO -0.26 -0.30 0.14 0.93 -2.02 0.00 0.00 178.31 176.80 1n65 h GLU 11 N -0.16 0.32 -1.13 1.11 5.08 -1.18 0.38 114.58 118.99 1n65 h GLU 11 Ca 0.18 -0.03 0.33 0.00 -1.00 0.00 0.00 59.36 58.84 1n65 h GLU 11 Cb 0.45 -0.07 -0.05 0.00 0.50 0.00 0.00 28.75 29.58 1n65 h GLU 11 CO -0.47 0.26 0.98 -0.22 -1.00 0.00 0.00 179.01 178.56 1n65 h LYS 12 N 0.29 0.00 0.01 2.33 3.64 0.13 0.79 116.57 123.76 1n65 h LYS 12 Ca 0.08 0.00 -0.37 0.00 -1.27 0.00 0.00 60.65 59.09 1n65 h LYS 12 Cb 0.02 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 31.79 1n65 h LYS 12 CO -0.02 0.00 -2.06 0.66 -2.27 0.00 0.00 179.45 175.76 1n65 n TYR 13 N -3.77 0.45 -0.13 1.91 4.02 -0.49 -3.96 117.16 115.19 1n65 n TYR 13 Ca 0.25 0.17 0.21 0.00 -0.01 0.00 0.00 57.90 58.52 1n65 n TYR 13 Cb 1.34 -1.05 0.61 0.00 -0.02 0.00 0.00 39.34 40.23 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 -0.63 2.42 -0.30 -0.72 0.00 0.21 0.66 119.26 120.90 1n65 h ALA 14 Ca -0.55 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.25 1n65 h ALA 14 Cb 1.58 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.36 1n65 h ALA 14 CO -0.27 -0.64 -0.25 0.00 0.00 0.00 0.00 179.25 178.09 1n65 h ALA 15 N 1.65 1.01 0.45 0.00 0.00 0.31 -3.14 119.26 119.53 1n65 h ALA 15 Ca 0.37 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1n65 h ALA 15 Cb 1.16 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.79 1n65 h ALA 15 CO -0.07 0.59 -0.50 0.87 0.00 0.00 0.00 179.25 180.14 1n65 h LYS 16 N 0.52 -0.93 -5.28 0.00 1.57 0.20 -3.41 116.57 109.24 1n65 h LYS 16 Ca 0.07 0.06 -0.65 0.00 -1.87 0.00 0.00 60.65 58.27 1n65 h LYS 16 Cb 0.70 0.21 -0.25 0.00 0.08 0.00 0.00 32.23 32.98 1n65 h LYS 16 CO 0.05 -0.62 -0.72 -1.21 -0.57 0.00 0.00 179.45 176.38 1n65 s GLU 17 N -5.87 3.51 0.28 3.15 2.02 -1.10 -5.03 118.70 115.66 1n65 s GLU 17 Ca -0.18 -0.61 0.00 0.00 0.02 0.00 0.00 54.97 54.20 1n65 s GLU 17 Cb 0.05 -2.79 0.00 0.00 0.10 0.00 0.00 34.13 31.49 1n65 s GLU 17 CO 0.61 0.19 0.00 0.41 0.02 0.00 0.00 175.26 176.49 1n65 n GLY 18 N 3.64 -1.49 3.18 -1.39 0.00 -1.26 -4.65 105.19 103.23 1n65 n GLY 18 Ca -0.18 -0.91 -0.35 0.00 0.00 0.00 0.00 46.02 44.59 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 -4.33 -3.53 0.00 1.61 2.03 -1.26 -4.21 116.55 106.86 1n65 n ASP 19 Ca 0.01 0.13 0.12 0.00 0.52 0.00 0.00 54.79 55.56 1n65 n ASP 19 Cb 0.52 -0.89 0.65 0.00 -0.72 0.00 0.00 41.12 40.68 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 0.28 0.55 -0.00 -0.67 -0.04 -1.25 -1.99 135.00 131.88 1n65 n PRO 20 Ca 0.01 0.03 0.07 0.00 -0.04 0.00 0.00 63.50 63.58 1n65 n PRO 20 Cb 0.60 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.46 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 -1.13 0.99 -4.74 3.54 3.02 -1.26 -4.57 115.26 111.11 1n65 n ASN 21 Ca 0.15 -0.53 -0.36 0.00 -0.03 0.00 0.00 54.58 53.81 1n65 n ASN 21 Cb 0.13 1.27 -0.08 0.00 -0.61 0.00 0.00 39.78 40.48 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 -2.67 3.20 0.45 3.52 -0.21 -0.84 0.15 119.66 123.25 1n65 s GLN 22 Ca 0.01 -0.32 0.06 0.00 0.02 0.00 0.00 55.36 55.14 1n65 s GLN 22 Cb 0.11 -2.94 -0.03 0.00 1.00 0.00 0.00 33.01 31.15 1n65 s GLN 22 CO 0.63 0.70 0.22 -0.51 -2.12 0.00 0.00 175.29 174.20 1n65 s LEU 23 N -0.84 2.95 0.03 2.90 2.01 0.51 -4.50 118.68 121.74 1n65 s LEU 23 Ca 0.13 -1.16 0.00 0.00 0.01 0.00 0.00 54.13 53.11 1n65 s LEU 23 Cb -0.12 -1.34 -0.03 0.00 0.01 0.00 0.00 46.19 44.72 1n65 s LEU 23 CO 0.03 -0.71 -0.04 -0.44 1.01 0.00 0.00 176.35 176.20 1n65 s SER 24 N -4.00 0.43 0.12 2.29 0.01 -1.26 -2.81 113.70 108.48 1n65 s SER 24 Ca 0.36 -0.63 -0.31 0.00 1.31 0.00 0.00 55.95 56.68 1n65 s SER 24 Cb 0.02 0.11 -0.09 0.00 0.21 0.00 0.00 66.02 66.27 1n65 s SER 24 CO 0.20 -0.35 1.57 0.50 0.41 0.00 0.00 173.24 175.58 1n65 h LYS 25 N 4.27 -0.54 -0.63 12.44 3.64 -1.98 1.07 116.57 134.83 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 0.12 -0.07 0.00 -0.41 0.00 0.00 32.23 33.07 1n65 h LYS 25 CO 0.47 -0.36 0.28 1.49 -2.27 0.00 0.00 179.45 179.06 1n65 h GLU 26 N -0.56 0.49 0.49 1.90 4.22 -1.99 0.28 114.58 119.41 1n65 h GLU 26 Ca 0.05 -0.03 -0.02 0.00 0.08 0.00 0.00 59.36 59.44 1n65 h GLU 26 Cb 0.66 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.81 1n65 h GLU 26 CO -0.39 0.32 -0.24 0.93 -2.18 0.00 0.00 179.01 177.45 1n65 h GLU 27 N 0.50 -0.63 -0.72 1.92 5.08 -1.56 -2.63 114.58 116.54 1n65 h GLU 27 Ca 0.31 0.04 0.15 0.00 -1.00 0.00 0.00 59.36 58.87 1n65 h GLU 27 Cb 0.33 0.14 -0.13 0.00 0.50 0.00 0.00 28.75 29.59 1n65 h GLU 27 CO -0.26 -0.42 -0.11 1.25 -1.00 0.00 0.00 179.01 178.46 1n65 h LEU 28 N -0.66 -0.55 -0.96 1.33 5.85 0.13 0.11 115.31 120.56 1n65 h LEU 28 Ca -0.07 0.21 0.12 0.00 0.84 0.00 0.00 57.88 58.98 1n65 h LEU 28 Cb 0.51 0.40 -0.14 0.00 0.37 0.00 0.00 40.66 41.80 1n65 h LEU 28 CO 0.11 -0.22 -0.49 0.50 -0.34 0.00 0.00 178.44 178.01 1n65 h LYS 29 N 0.03 -0.02 0.21 1.25 3.64 -0.30 0.94 116.57 122.32 1n65 h LYS 29 Ca 0.37 0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.76 1n65 h LYS 29 Cb 0.59 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.38 1n65 h LYS 29 CO -0.71 -0.01 -0.38 -0.07 -2.27 0.00 0.00 179.45 176.01 1n65 h LEU 30 N -0.02 -1.10 -0.09 5.20 3.38 -0.43 0.27 115.31 122.52 1n65 h LEU 30 Ca 0.25 0.11 0.02 0.00 0.09 0.00 0.00 57.88 58.35 1n65 h LEU 30 Cb 0.51 0.40 -0.03 0.00 0.09 0.00 0.00 40.66 41.63 1n65 h LEU 30 CO -0.94 -0.48 -0.23 0.25 0.09 0.00 0.00 178.44 177.12 1n65 h LEU 31 N -0.67 -0.75 -1.61 1.67 5.85 0.19 0.90 115.31 120.88 1n65 h LEU 31 Ca 0.01 0.09 0.06 0.00 0.84 0.00 0.00 57.88 58.88 1n65 h LEU 31 Cb 0.67 0.30 -0.01 0.00 0.37 0.00 0.00 40.66 41.98 1n65 h LEU 31 CO -0.17 -0.19 0.54 -0.07 -0.34 0.00 0.00 178.44 178.21 1n65 h LEU 32 N -0.22 0.00 0.38 2.25 3.38 0.91 2.60 115.31 124.60 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 0.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.03 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 -0.49 0.00 1.13 4.15 0.44 0.19 115.11 120.54 1n65 h GLN 33 Ca 0.10 0.03 -0.14 0.00 0.77 0.00 0.00 58.65 59.41 1n65 h GLN 33 Cb 1.19 0.11 -0.02 0.00 0.21 0.00 0.00 27.48 28.97 1n65 h GLN 33 CO -0.00 -0.22 -0.81 1.15 -1.93 0.00 0.00 178.83 177.02 1n65 h THR 34 N -1.04 1.09 -0.10 2.39 2.02 0.14 -3.19 112.91 114.22 1n65 h THR 34 Ca -0.05 -2.12 0.02 0.00 0.77 0.00 0.00 66.41 65.02 1n65 h THR 34 Cb 0.49 2.37 -0.03 0.00 -1.74 0.00 0.00 68.15 69.24 1n65 h THR 34 CO 0.08 0.37 -0.26 -0.08 0.37 0.00 0.00 175.52 176.01 1n65 h GLU 35 N -1.00 -0.24 -1.86 6.66 4.81 0.42 -3.40 114.58 119.97 1n65 h GLU 35 Ca -0.22 0.02 -0.32 0.00 -0.13 0.00 0.00 59.36 58.71 1n65 h GLU 35 Cb 1.13 0.05 -0.30 0.00 0.63 0.00 0.00 28.75 30.27 1n65 h GLU 35 CO -0.13 -0.16 -0.65 -0.06 -0.73 0.00 0.00 179.01 177.28 1n65 s PHE 36 N -4.25 -0.49 -0.11 0.92 0.08 -1.13 -4.98 117.98 108.02 1n65 s PHE 36 Ca -0.07 -0.59 0.26 0.00 0.12 0.00 0.00 56.93 56.64 1n65 s PHE 36 Cb 0.03 -0.33 0.78 0.00 -0.57 0.00 0.00 43.02 42.93 1n65 s PHE 36 CO 0.29 -0.99 1.76 -1.00 -0.10 0.00 0.00 175.22 175.18 1n65 h PRO 37 N 7.23 0.00 -0.09 0.24 0.13 -0.60 -2.98 132.00 135.93 1n65 h PRO 37 Ca 0.02 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 65.05 1n65 h PRO 37 Cb 1.07 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.19 1n65 h PRO 37 CO 0.21 0.10 -0.41 0.66 -0.23 0.00 0.00 178.00 178.33 1n65 h SER 38 N 0.00 0.20 0.45 1.44 4.64 -1.89 -1.98 113.55 116.40 1n65 h SER 38 Ca -0.00 -0.08 -0.02 0.00 -0.47 0.00 0.00 61.79 61.22 1n65 h SER 38 Cb 0.83 -0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 62.86 1n65 h SER 38 CO 0.01 0.59 -0.09 -0.07 -0.87 0.00 0.00 176.83 176.41 1n65 h LEU 39 N 0.16 0.00 -0.03 5.97 -0.00 -1.83 -2.14 115.31 117.44 1n65 h LEU 39 Ca 0.01 0.00 -0.13 0.00 -0.00 0.00 0.00 57.88 57.76 1n65 h LEU 39 Cb 0.80 0.00 0.01 0.00 -0.00 0.00 0.00 40.66 41.47 1n65 h LEU 39 CO 0.06 0.09 -0.49 -0.07 -0.00 0.00 0.00 178.44 178.03 1n65 h LEU 40 N 0.00 0.48 -2.22 1.67 3.38 -1.47 -3.06 115.31 114.09 1n65 h LEU 40 Ca -0.00 -0.72 -0.01 0.00 0.09 0.00 0.00 57.88 57.24 1n65 h LEU 40 Cb 0.33 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 1n65 h LEU 40 CO 0.01 1.14 -0.03 0.07 0.09 0.00 0.00 178.44 179.72 1n65 h LYS 41 N -0.12 0.00 -6.50 1.13 2.10 -1.26 -3.38 116.57 108.53 1n65 h LYS 41 Ca -0.05 0.00 -0.40 0.00 -2.00 0.00 0.00 60.65 58.19 1n65 h LYS 41 Cb 1.18 0.00 0.21 0.00 -0.90 0.00 0.00 32.23 32.73 1n65 h LYS 41 CO 0.10 0.03 -1.00 0.41 -2.00 0.00 0.00 179.45 176.99 1n65 n GLY 42 N -1.28 -2.57 0.33 0.07 0.00 -0.88 -4.78 105.19 96.07 1n65 n GLY 42 Ca -0.03 -0.78 0.22 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.20 0.00 -4.07 1.61 2.86 -1.85 -3.35 114.93 107.94 1n65 h MET 43 Ca -0.46 0.00 -0.76 0.00 -2.06 0.00 0.00 59.70 56.42 1n65 h MET 43 Cb 1.24 0.00 -0.25 0.00 0.06 0.00 0.00 31.60 32.65 1n65 h MET 43 CO 0.32 0.00 -0.19 -1.12 1.06 0.00 0.00 176.91 176.98 1n65 s SER 44 N -5.11 6.22 0.89 1.22 0.01 -1.26 -5.03 113.70 110.64 1n65 s SER 44 Ca -0.04 -1.94 -0.12 0.00 1.31 0.00 0.00 55.95 55.15 1n65 s SER 44 Cb 0.12 -2.19 0.12 0.00 0.21 0.00 0.00 66.02 64.29 1n65 s SER 44 CO 0.41 -0.80 1.14 0.42 0.41 0.00 0.00 173.24 174.82 1n65 s THR 45 N 1.35 2.06 0.07 1.44 -4.23 -1.26 -4.55 115.64 110.52 1n65 s THR 45 Ca 0.06 0.02 -0.16 0.00 -1.18 0.00 0.00 61.69 60.43 1n65 s THR 45 Cb -0.27 -2.81 -0.05 0.00 1.34 0.00 0.00 72.50 70.71 1n65 s THR 45 CO 0.01 -0.02 1.27 0.25 -0.54 0.00 0.00 174.62 175.58 1n65 h LEU 46 N -1.40 -0.98 -0.83 4.79 7.12 -1.92 0.47 115.31 122.56 1n65 h LEU 46 Ca -0.50 0.14 0.21 0.00 0.13 0.00 0.00 57.88 57.86 1n65 h LEU 46 Cb 1.33 0.41 -0.13 0.00 -0.53 0.00 0.00 40.66 41.74 1n65 h LEU 46 CO 0.63 -0.17 0.20 0.44 -0.13 0.00 0.00 178.44 179.40 1n65 h ASP 47 N -0.12 -0.04 -0.69 1.25 5.19 -1.99 0.67 116.42 120.70 1n65 h ASP 47 Ca 0.05 0.18 0.09 0.00 -0.62 0.00 0.00 57.03 56.73 1n65 h ASP 47 Cb 0.26 0.26 -0.07 0.00 0.18 0.00 0.00 39.33 39.96 1n65 h ASP 47 CO -0.36 -0.13 0.35 -0.33 -3.12 0.00 0.00 179.24 175.65 1n65 h GLU 48 N 0.22 0.58 0.74 3.56 5.08 -0.64 0.62 114.58 124.74 1n65 h GLU 48 Ca 0.50 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.79 1n65 h GLU 48 Cb 0.96 -0.13 0.01 0.00 0.50 0.00 0.00 28.75 30.09 1n65 h GLU 48 CO -0.62 0.39 -0.36 1.25 -1.00 0.00 0.00 179.01 178.67 1n65 h LEU 49 N 0.60 -0.84 -0.94 1.33 5.85 0.43 0.98 115.31 122.73 1n65 h LEU 49 Ca 0.33 0.03 0.28 0.00 0.84 0.00 0.00 57.88 59.36 1n65 h LEU 49 Cb 0.33 0.22 -0.16 0.00 0.37 0.00 0.00 40.66 41.42 1n65 h LEU 49 CO -0.25 -0.48 0.24 0.15 -0.34 0.00 0.00 178.44 177.76 1n65 h PHE 50 N -1.24 0.34 0.01 1.25 3.57 -0.45 1.58 116.94 121.99 1n65 h PHE 50 Ca -0.10 0.05 -0.00 0.00 3.53 0.00 0.00 57.97 61.45 1n65 h PHE 50 Cb 0.76 0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.51 1n65 h PHE 50 CO 0.00 -0.31 -0.00 1.49 -2.23 0.00 0.00 178.31 177.26 1n65 h GLU 51 N 0.12 -0.01 0.07 1.11 4.81 -0.78 -2.43 114.58 117.47 1n65 h GLU 51 Ca 0.62 0.00 0.02 0.00 -0.13 0.00 0.00 59.36 59.87 1n65 h GLU 51 Cb 1.35 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.69 1n65 h GLU 51 CO -0.75 0.74 -0.27 1.49 -0.73 0.00 0.00 179.01 179.49 1n65 h GLU 52 N -0.77 -0.44 0.19 1.92 4.81 0.33 -2.94 114.58 117.69 1n65 h GLU 52 Ca -0.00 0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 1n65 h GLU 52 Cb 0.75 0.10 -0.03 0.00 0.63 0.00 0.00 28.75 30.20 1n65 h GLU 52 CO 0.00 -0.29 -0.38 -0.07 -0.73 0.00 0.00 179.01 177.54 1n65 h LEU 53 N -0.45 -1.11 -8.48 1.64 3.38 0.20 -3.34 115.31 107.14 1n65 h LEU 53 Ca 0.04 0.11 -0.48 0.00 0.09 0.00 0.00 57.88 57.64 1n65 h LEU 53 Cb 0.51 0.40 -0.03 0.00 0.09 0.00 0.00 40.66 41.62 1n65 h LEU 53 CO -0.19 -0.44 1.34 -0.62 0.09 0.00 0.00 178.44 178.62 1n65 s ASP 54 N -3.95 5.17 -0.14 -0.43 2.15 -0.91 -4.79 116.67 113.77 1n65 s ASP 54 Ca -0.12 0.35 -0.11 0.00 0.43 0.00 0.00 52.55 53.10 1n65 s ASP 54 Cb 0.04 -2.53 -0.08 0.00 -0.30 0.00 0.00 42.92 40.05 1n65 s ASP 54 CO 0.44 -2.46 0.09 0.50 -0.17 0.00 0.00 175.17 173.57 1n65 h LYS 55 N 15.22 0.00 -0.93 4.34 3.11 -1.72 -3.37 116.57 133.21 1n65 h LYS 55 Ca -0.24 0.00 0.12 0.00 -2.81 0.00 0.00 60.65 57.73 1n65 h LYS 55 Cb 1.16 0.00 -0.14 0.00 -1.00 0.00 0.00 32.23 32.25 1n65 h LYS 55 CO 1.21 0.31 -0.46 -0.91 -2.81 0.00 0.00 179.45 176.78 1n65 h ASN 56 N -1.00 -1.70 0.00 4.20 4.21 -1.94 -3.46 115.58 115.90 1n65 h ASN 56 Ca -0.05 0.31 0.00 0.00 1.21 0.00 0.00 56.30 57.76 1n65 h ASN 56 Cb 0.52 0.81 0.00 0.00 -1.12 0.00 0.00 38.32 38.54 1n65 h ASN 56 CO -0.03 -0.28 0.00 0.61 -1.29 0.00 0.00 177.43 176.44 1n65 n GLY 57 N -1.39 0.70 1.00 2.83 0.00 -1.26 -5.08 105.19 101.99 1n65 n GLY 57 Ca 0.06 -0.81 -0.01 0.00 0.00 0.00 0.00 46.02 45.26 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 0.95 0.00 1.61 8.00 -1.26 -5.09 116.55 120.77 1n65 n ASP 58 Ca 0.00 0.12 0.00 0.00 0.71 0.00 0.00 54.79 55.62 1n65 n ASP 58 Cb 0.00 -0.30 0.00 0.00 -0.02 0.00 0.00 41.12 40.80 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 3.33 0.33 3.58 0.44 0.00 -1.26 -5.16 105.19 106.44 1n65 n GLY 59 Ca -0.01 -0.23 -0.02 0.00 0.00 0.00 0.00 46.02 45.76 1n65 n GLY 59 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1n65 s GLU 60 N 0.00 0.42 -0.40 1.61 -1.05 -1.26 -4.95 118.70 113.07 1n65 s GLU 60 Ca 0.00 0.83 -0.15 0.00 -0.15 0.00 0.00 54.97 55.50 1n65 s GLU 60 Cb 0.00 0.26 0.01 0.00 -0.44 0.00 0.00 34.13 33.96 1n65 s GLU 60 CO 0.00 -0.11 0.29 0.08 0.95 0.00 0.00 175.26 176.48 1n65 s VAL 61 N 1.82 5.26 0.51 1.83 1.01 -1.12 -4.72 120.40 124.99 1n65 s VAL 61 Ca -0.07 -0.58 -0.17 0.00 0.00 0.00 0.00 61.98 61.16 1n65 s VAL 61 Cb -0.05 -3.90 -0.08 0.00 0.00 0.00 0.00 36.38 32.35 1n65 s VAL 61 CO -0.17 -0.26 0.99 -0.94 0.00 0.00 0.00 175.10 174.72 1n65 s SER 62 N 1.69 6.60 0.36 3.32 1.04 -1.26 0.19 113.70 125.64 1n65 s SER 62 Ca 0.05 1.60 0.13 0.00 0.48 0.00 0.00 55.95 58.22 1n65 s SER 62 Cb -0.19 -2.51 0.97 0.00 0.10 0.00 0.00 66.02 64.39 1n65 s SER 62 CO 0.10 -0.60 1.77 0.15 0.98 0.00 0.00 173.24 175.64 1n65 h PHE 63 N 0.99 0.83 0.42 5.02 3.57 0.10 0.47 116.94 128.33 1n65 h PHE 63 Ca -0.47 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.04 1n65 h PHE 63 Cb 1.19 -0.24 0.00 0.00 2.79 0.00 0.00 35.95 39.69 1n65 h PHE 63 CO 0.63 0.11 -0.20 0.93 -2.23 0.00 0.00 178.31 177.55 1n65 h GLU 64 N 0.52 -0.54 -1.08 1.11 5.08 -1.92 -0.53 114.58 117.23 1n65 h GLU 64 Ca 0.59 0.04 0.30 0.00 -1.00 0.00 0.00 59.36 59.29 1n65 h GLU 64 Cb 1.27 0.12 -0.11 0.00 0.50 0.00 0.00 28.75 30.54 1n65 h GLU 64 CO -0.35 -0.36 0.68 0.93 -1.00 0.00 0.00 179.01 178.91 1n65 h GLU 65 N -0.62 0.35 -0.50 2.33 5.08 -1.78 0.49 114.58 119.92 1n65 h GLU 65 Ca -0.06 -0.02 -0.05 0.00 -1.00 0.00 0.00 59.36 58.23 1n65 h GLU 65 Cb 0.43 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 1n65 h GLU 65 CO 0.09 0.23 0.12 0.35 -1.00 0.00 0.00 179.01 178.80 1n65 h PHE 66 N 0.36 0.84 -0.99 4.33 3.57 -0.75 -2.40 116.94 121.90 1n65 h PHE 66 Ca 0.65 -0.10 0.29 0.00 3.53 0.00 0.00 57.97 62.34 1n65 h PHE 66 Cb 1.67 -0.24 -0.04 0.00 2.79 0.00 0.00 35.95 40.13 1n65 h PHE 66 CO -0.00 0.75 1.00 1.96 -2.23 0.00 0.00 178.31 179.79 1n65 h GLN 67 N 0.69 0.00 -0.65 1.11 4.20 0.17 1.45 115.11 122.08 1n65 h GLN 67 Ca 0.16 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.86 1n65 h GLN 67 Cb 0.33 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.08 1n65 h GLN 67 CO 0.00 0.00 0.38 0.28 -0.67 0.00 0.00 178.83 178.83 1n65 h VAL 68 N 0.00 1.19 -0.20 -0.54 2.07 -1.42 0.05 116.25 117.40 1n65 h VAL 68 Ca 0.47 -0.43 -0.17 0.00 0.82 0.00 0.00 66.70 67.39 1n65 h VAL 68 Cb 2.47 0.31 0.00 0.00 -1.52 0.00 0.00 31.29 32.55 1n65 h VAL 68 CO -0.00 0.20 -0.53 0.25 0.02 0.00 0.00 177.57 177.51 1n65 h LEU 69 N 0.88 0.81 -0.51 2.57 5.85 0.18 -2.88 115.31 122.22 1n65 h LEU 69 Ca 0.23 -0.57 0.09 0.00 0.84 0.00 0.00 57.88 58.47 1n65 h LEU 69 Cb -0.01 -0.23 -0.08 0.00 0.37 0.00 0.00 40.66 40.70 1n65 h LEU 69 CO -0.04 1.24 0.06 0.58 -0.34 0.00 0.00 178.44 179.93 1n65 h VAL 70 N 0.42 0.66 -0.58 1.05 2.07 -0.96 1.04 116.25 119.95 1n65 h VAL 70 Ca -0.01 -0.06 0.06 0.00 0.82 0.00 0.00 66.70 67.51 1n65 h VAL 70 Cb 1.14 0.47 -0.05 0.00 -1.52 0.00 0.00 31.29 31.32 1n65 h VAL 70 CO 0.11 0.03 0.28 0.50 0.02 0.00 0.00 177.57 178.51 1n65 h LYS 71 N 0.18 0.50 0.00 1.57 3.64 -0.96 1.06 116.57 122.56 1n65 h LYS 71 Ca 0.26 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.57 1n65 h LYS 71 Cb 0.37 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.07 1n65 h LYS 71 CO -0.38 0.33 -0.19 0.87 -2.27 0.00 0.00 179.45 177.82 1n65 h LYS 72 N 0.52 0.00 0.02 1.90 1.79 -0.74 1.14 116.57 121.21 1n65 h LYS 72 Ca 0.27 0.00 -0.07 0.00 -2.18 0.00 0.00 60.65 58.67 1n65 h LYS 72 Cb 0.22 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 30.87 1n65 h LYS 72 CO -0.21 0.19 -0.28 0.82 -1.08 0.00 0.00 179.45 178.89 1n65 h ILE 73 N 0.00 1.60 0.11 1.86 2.04 0.43 -3.37 117.51 120.18 1n65 h ILE 73 Ca -0.00 -2.14 -0.01 0.00 1.00 0.00 0.00 64.86 63.71 1n65 h ILE 73 Cb 0.64 2.99 0.00 0.00 -0.74 0.00 0.00 36.82 39.72 1n65 h ILE 73 CO 0.02 0.58 -0.05 -1.28 0.00 0.00 0.00 178.15 177.42 1n65 h SER 74 N -0.60 -0.12 0.00 1.72 0.87 0.11 -3.50 113.55 112.03 1n65 h SER 74 Ca -0.04 -0.39 0.00 0.00 -1.23 0.00 0.00 61.79 60.12 1n65 h SER 74 Cb 1.11 0.03 0.00 0.00 -0.44 0.00 0.00 62.40 63.10 1n65 h SER 74 CO 0.05 0.51 0.00 1.67 -0.53 0.00 0.00 176.83 178.53