#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1m12 s ASP 2 N 0.00 5.84 0.24 4.04 2.15 -1.26 -4.84 116.67 122.84 1m12 s ASP 2 Ca 0.00 1.23 0.23 0.00 0.43 0.00 0.00 52.55 54.44 1m12 s ASP 2 Cb 0.00 -2.53 0.96 0.00 -0.30 0.00 0.00 42.92 41.06 1m12 s ASP 2 CO 0.00 -1.76 1.69 1.33 -0.17 0.00 0.00 175.17 176.25 1m12 n VAL 3 N 7.40 0.86 -0.04 1.11 0.24 -1.26 -3.50 118.33 123.15 1m12 n VAL 3 Ca 0.23 0.27 -0.13 0.00 -2.04 0.00 0.00 64.34 62.66 1m12 n VAL 3 Cb 0.47 -1.20 -0.11 0.00 -1.47 0.00 0.00 33.84 31.53 1m12 n VAL 3 CO 0.00 0.00 0.00 1.88 -2.14 0.00 0.00 176.83 176.57 1m12 h TYR 4 N 0.00 -0.00 -0.75 6.34 0.05 -1.94 -3.06 116.97 117.61 1m12 h TYR 4 Ca 0.00 -0.00 0.10 0.00 0.05 0.00 0.00 58.73 58.88 1m12 h TYR 4 Cb 0.33 0.00 -0.07 0.00 1.01 0.00 0.00 36.73 37.99 1m12 h TYR 4 CO 0.00 0.73 0.40 0.00 -1.05 0.00 0.00 178.16 178.23 1m12 h GLU 6 N 0.67 0.84 -0.22 0.00 4.57 -1.64 -2.04 114.58 116.76 1m12 h GLU 6 Ca 0.37 -0.05 -0.16 0.00 -1.18 0.00 0.00 59.36 58.34 1m12 h GLU 6 Cb 0.38 -0.19 0.00 0.00 -0.16 0.00 0.00 28.75 28.78 1m12 h GLU 6 CO -0.26 0.56 -0.49 0.28 -1.18 0.00 0.00 179.01 177.91 1m12 h VAL 7 N 0.87 1.31 -0.16 0.32 2.07 -1.06 -2.30 116.25 117.29 1m12 h VAL 7 Ca 0.43 -1.71 0.02 0.00 0.82 0.00 0.00 66.70 66.27 1m12 h VAL 7 Cb 0.41 1.82 -0.02 0.00 -1.52 0.00 0.00 31.29 31.97 1m12 h VAL 7 CO -0.25 0.54 0.04 0.00 0.02 0.00 0.00 177.57 177.91 1m12 h GLU 9 N 0.11 0.00 -0.05 0.00 4.39 -1.43 -1.73 114.58 115.87 1m12 h GLU 9 Ca 0.07 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.74 1m12 h GLU 9 Cb 0.06 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.71 1m12 h GLU 9 CO -0.09 0.17 -0.09 0.35 -1.16 0.00 0.00 179.01 178.19 1m12 h PHE 10 N 0.00 0.18 -0.72 4.33 3.04 -0.51 -1.97 116.94 121.28 1m12 h PHE 10 Ca -0.00 -0.06 -0.01 0.00 3.98 0.00 0.00 57.97 61.87 1m12 h PHE 10 Cb 0.34 -0.03 -0.03 0.00 2.56 0.00 0.00 35.95 38.78 1m12 h PHE 10 CO 0.00 0.68 0.41 -0.07 -2.02 0.00 0.00 178.31 177.31 1m12 h LEU 11 N -0.37 0.89 -0.17 0.59 3.38 -0.86 -1.48 115.31 117.30 1m12 h LEU 11 Ca 0.00 -0.08 0.01 0.00 0.09 0.00 0.00 57.88 57.89 1m12 h LEU 11 Cb 0.66 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 1m12 h LEU 11 CO 0.02 0.71 0.10 0.58 0.09 0.00 0.00 178.44 179.94 1m12 h VAL 12 N 0.99 1.02 -0.65 1.22 2.07 -1.32 0.35 116.25 119.93 1m12 h VAL 12 Ca 0.26 -0.07 0.02 0.00 0.82 0.00 0.00 66.70 67.72 1m12 h VAL 12 Cb 0.01 0.80 -0.04 0.00 -1.52 0.00 0.00 31.29 30.54 1m12 h VAL 12 CO -0.04 0.04 0.42 0.50 0.02 0.00 0.00 177.57 178.51 1m12 h LYS 13 N 0.21 0.83 -0.31 1.57 3.64 -1.03 -0.98 116.57 120.50 1m12 h LYS 13 Ca 0.06 -0.05 -0.15 0.00 -1.27 0.00 0.00 60.65 59.25 1m12 h LYS 13 Cb -0.01 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.62 1m12 h LYS 13 CO -0.03 0.55 -0.40 1.49 -2.27 0.00 0.00 179.45 178.79 1m12 h GLU 14 N 0.85 0.74 -0.39 1.90 4.22 -0.90 -3.00 114.58 118.00 1m12 h GLU 14 Ca 0.25 -0.39 -0.09 0.00 0.08 0.00 0.00 59.36 59.21 1m12 h GLU 14 Cb -0.06 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 1m12 h GLU 14 CO -0.07 1.01 -0.12 0.28 -2.18 0.00 0.00 179.01 177.93 1m12 h VAL 15 N 0.61 1.28 -0.65 0.32 2.07 0.17 -2.68 116.25 117.36 1m12 h VAL 15 Ca 0.05 -1.21 -0.05 0.00 0.82 0.00 0.00 66.70 66.31 1m12 h VAL 15 Cb 0.95 1.25 -0.03 0.00 -1.52 0.00 0.00 31.29 31.94 1m12 h VAL 15 CO 0.09 0.41 0.22 0.71 0.02 0.00 0.00 177.57 179.01 1m12 h THR 16 N 0.58 1.24 -0.26 2.57 1.35 -1.16 0.38 112.91 117.60 1m12 h THR 16 Ca 0.10 -0.80 -0.03 0.00 -0.55 0.00 0.00 66.41 65.13 1m12 h THR 16 Cb 0.64 0.51 -0.01 0.00 -1.73 0.00 0.00 68.15 67.56 1m12 h THR 16 CO 0.04 0.31 0.05 0.50 -0.25 0.00 0.00 175.52 176.17 1m12 h LYS 17 N 0.95 0.38 -0.17 4.72 3.64 -1.45 1.06 116.57 125.71 1m12 h LYS 17 Ca 0.22 -0.06 -0.17 0.00 -1.27 0.00 0.00 60.65 59.37 1m12 h LYS 17 Cb 0.25 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 32.00 1m12 h LYS 17 CO -0.01 0.37 -0.60 -0.07 -2.27 0.00 0.00 179.45 176.87 1m12 h LEU 18 N 0.38 0.66 -0.68 5.20 3.38 -0.75 0.18 115.31 123.68 1m12 h LEU 18 Ca 0.09 -0.37 -0.14 0.00 0.09 0.00 0.00 57.88 57.55 1m12 h LEU 18 Cb 0.18 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 1m12 h LEU 18 CO -0.00 1.10 -0.59 0.40 0.09 0.00 0.00 178.44 179.44 1m12 h ILE 19 N 0.43 1.38 0.00 1.22 2.04 0.14 -2.74 117.51 119.98 1m12 h ILE 19 Ca -0.00 -1.94 -0.07 0.00 1.00 0.00 0.00 64.86 63.84 1m12 h ILE 19 Cb 1.16 1.98 -0.01 0.00 -0.74 0.00 0.00 36.82 39.21 1m12 h ILE 19 CO 0.11 0.57 -0.33 -0.78 0.00 0.00 0.00 178.15 177.73 1m12 h ASP 20 N 0.18 0.00 -0.09 1.72 3.58 0.15 -3.02 116.42 118.93 1m12 h ASP 20 Ca -0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1m12 h ASP 20 Cb 1.08 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.13 1m12 h ASP 20 CO 0.09 0.33 0.00 -3.20 -2.88 0.00 0.00 179.24 173.58 1m12 n ASN 21 N -3.27 1.29 -0.85 2.28 4.05 0.59 -4.93 115.26 114.41 1m12 n ASN 21 Ca 0.02 -1.56 -0.02 0.00 0.45 0.00 0.00 54.58 53.46 1m12 n ASN 21 Cb 0.59 -0.06 0.01 0.00 1.23 0.00 0.00 39.78 41.55 1m12 n ASN 21 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 177.26 174.80 1m12 n ASN 22 N 0.05 -2.33 -4.91 1.20 3.02 -1.14 -5.06 115.26 106.08 1m12 n ASN 22 Ca 0.17 -0.05 -0.30 0.00 -0.03 0.00 0.00 54.58 54.37 1m12 n ASN 22 Cb 0.29 -0.91 -0.04 0.00 -0.61 0.00 0.00 39.78 38.51 1m12 n ASN 22 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1m12 s LYS 23 N -4.96 3.57 0.68 3.52 1.02 -1.08 -5.07 119.74 117.42 1m12 s LYS 23 Ca 0.04 -0.19 -0.11 0.00 0.02 0.00 0.00 55.97 55.73 1m12 s LYS 23 Cb -0.02 -2.87 -0.00 0.00 -0.52 0.00 0.00 37.83 34.42 1m12 s LYS 23 CO 0.07 0.47 1.07 0.95 -0.92 0.00 0.00 175.35 176.98 1m12 s THR 24 N -1.69 3.94 0.21 2.17 -4.23 -1.26 -4.84 115.64 109.93 1m12 s THR 24 Ca 0.40 0.63 -0.09 0.00 -1.18 0.00 0.00 61.69 61.45 1m12 s THR 24 Cb -0.12 -3.57 0.15 0.00 1.34 0.00 0.00 72.50 70.30 1m12 s THR 24 CO 0.26 -0.82 1.76 -0.08 -0.54 0.00 0.00 174.62 175.20 1m12 h GLU 25 N -0.58 0.49 -0.61 3.99 4.22 -2.00 0.01 114.58 120.09 1m12 h GLU 25 Ca -0.45 -0.03 0.13 0.00 0.08 0.00 0.00 59.36 59.10 1m12 h GLU 25 Cb 1.23 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 30.33 1m12 h GLU 25 CO 0.62 0.32 0.42 -0.22 -2.18 0.00 0.00 179.01 177.97 1m12 h LYS 26 N 0.50 0.24 0.02 1.92 3.64 -2.00 -1.38 116.57 119.51 1m12 h LYS 26 Ca 0.31 -0.01 -0.23 0.00 -1.27 0.00 0.00 60.65 59.45 1m12 h LYS 26 Cb 0.34 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.11 1m12 h LYS 26 CO -0.27 0.16 -0.98 0.93 -2.27 0.00 0.00 179.45 177.02 1m12 h GLU 27 N 0.25 0.38 -0.56 1.90 5.08 -1.36 -2.39 114.58 117.88 1m12 h GLU 27 Ca 0.29 -0.44 -0.08 0.00 -1.00 0.00 0.00 59.36 58.13 1m12 h GLU 27 Cb 0.81 0.13 -0.02 0.00 0.50 0.00 0.00 28.75 30.17 1m12 h GLU 27 CO -0.06 1.12 0.02 0.82 -1.00 0.00 0.00 179.01 179.91 1m12 h ILE 28 N 0.20 1.26 -0.05 3.13 2.04 -0.90 -0.94 117.51 122.25 1m12 h ILE 28 Ca -0.09 -1.09 -0.12 0.00 1.00 0.00 0.00 64.86 64.56 1m12 h ILE 28 Cb 1.63 0.85 -0.01 0.00 -0.74 0.00 0.00 36.82 38.55 1m12 h ILE 28 CO 0.17 0.39 -0.54 -0.07 0.00 0.00 0.00 178.15 178.10 1m12 h LEU 29 N 0.86 0.15 -0.33 1.44 3.38 -1.49 -2.60 115.31 116.73 1m12 h LEU 29 Ca 0.16 -0.08 -0.07 0.00 0.09 0.00 0.00 57.88 57.98 1m12 h LEU 29 Cb 0.51 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 1m12 h LEU 29 CO 0.02 0.66 -0.08 -0.78 0.09 0.00 0.00 178.44 178.35 1m12 h ASP 30 N 0.11 0.64 0.60 -0.43 3.58 -1.01 -2.91 116.42 117.00 1m12 h ASP 30 Ca -0.00 -0.37 -0.04 0.00 0.42 0.00 0.00 57.03 57.05 1m12 h ASP 30 Cb 0.99 -0.17 -0.01 0.00 1.72 0.00 0.00 39.33 41.86 1m12 h ASP 30 CO 0.08 0.86 -0.18 0.00 -2.88 0.00 0.00 179.24 177.12 1m12 h ALA 31 N 0.80 1.16 0.00 -0.78 0.00 -1.05 -2.61 119.26 116.78 1m12 h ALA 31 Ca 0.08 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1m12 h ALA 31 Cb 0.58 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1m12 h ALA 31 CO 0.03 0.22 0.19 1.19 0.00 0.00 0.00 179.25 180.88 1m12 n PHE 32 N -3.53 0.08 0.16 0.00 3.01 -0.99 0.18 117.46 116.36 1m12 n PHE 32 Ca -0.01 0.04 0.10 0.00 1.01 0.00 0.00 57.45 58.59 1m12 n PHE 32 Cb 0.33 -0.39 0.08 0.00 -0.01 0.00 0.00 39.48 39.48 1m12 n PHE 32 CO 0.00 0.00 0.00 -0.44 1.01 0.00 0.00 176.76 177.33 1m12 h ASP 33 N 0.00 0.00 0.00 4.37 5.19 -1.64 -3.36 116.42 120.99 1m12 h ASP 33 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1m12 h ASP 33 Cb 0.38 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.89 1m12 h ASP 33 CO 0.00 0.09 -0.02 2.29 -3.12 0.00 0.00 179.24 178.48 1m12 n LYS 34 N -2.95 1.49 0.10 3.56 2.85 0.13 -4.77 118.16 118.57 1m12 n LYS 34 Ca 0.01 -1.09 -0.23 0.00 -1.05 0.00 0.00 58.31 55.96 1m12 n LYS 34 Cb 0.58 -0.78 -0.15 0.00 -0.65 0.00 0.00 35.03 34.02 1m12 n LYS 34 CO 0.00 0.00 0.00 1.98 -0.05 0.00 0.00 177.40 179.33 1m12 h MET 35 N 0.00 0.43 0.00 -1.58 4.05 -1.25 -2.87 114.93 113.71 1m12 h MET 35 Ca 0.00 -0.73 0.00 0.00 -0.28 0.00 0.00 59.70 58.69 1m12 h MET 35 Cb 0.78 0.27 0.00 0.00 -0.80 0.00 0.00 31.60 31.85 1m12 h MET 35 CO 0.00 1.35 0.00 0.00 0.23 0.00 0.00 176.91 178.49 1m12 h SER 37 N 0.00 0.00 -0.42 0.00 0.87 -1.83 -3.21 113.55 108.96 1m12 h SER 37 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1m12 h SER 37 Cb 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 1m12 h SER 37 CO 0.00 0.00 0.00 2.29 -0.53 0.00 0.00 176.83 178.59 1m12 n LYS 38 N -2.87 2.07 -4.45 2.24 2.85 -0.87 -4.87 118.16 112.26 1m12 n LYS 38 Ca 0.03 -1.65 -0.34 0.00 -1.05 0.00 0.00 58.31 55.30 1m12 n LYS 38 Cb 0.42 -1.38 -0.10 0.00 -0.65 0.00 0.00 35.03 33.32 1m12 n LYS 38 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 1m12 s LEU 39 N -1.12 3.43 0.89 -5.58 1.43 -1.21 -5.08 118.68 111.43 1m12 s LEU 39 Ca 0.32 0.07 -0.16 0.00 -1.03 0.00 0.00 54.13 53.33 1m12 s LEU 39 Cb 0.17 -1.78 -0.10 0.00 0.03 0.00 0.00 46.19 44.51 1m12 s LEU 39 CO 0.23 0.35 -0.33 -2.65 0.23 0.00 0.00 176.35 174.18 1m12 n PRO 40 N 2.29 -0.03 0.28 1.29 -0.02 -1.26 -4.71 135.00 132.85 1m12 n PRO 40 Ca -0.18 0.01 0.15 0.00 -2.02 0.00 0.00 63.50 61.46 1m12 n PRO 40 Cb 0.53 -1.26 0.84 0.00 -0.02 0.00 0.00 33.50 33.59 1m12 n PRO 40 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1m12 h LYS 41 N -0.91 0.00 0.00 -0.52 3.64 -1.96 -2.72 116.57 114.10 1m12 h LYS 41 Ca -0.44 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.94 1m12 h LYS 41 Cb 1.32 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.14 1m12 h LYS 41 CO 0.30 0.07 0.00 0.45 -2.27 0.00 0.00 179.45 178.00 1m12 n SER 42 N -3.53 0.00 -0.11 4.20 2.88 -1.26 -2.54 113.62 113.26 1m12 n SER 42 Ca -0.02 0.19 0.03 0.00 -1.33 0.00 0.00 58.87 57.74 1m12 n SER 42 Cb 0.19 -0.38 -0.01 0.00 -0.75 0.00 0.00 64.21 63.27 1m12 n SER 42 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 1m12 n LEU 43 N -1.38 0.78 -0.15 2.46 7.94 -1.03 -4.76 117.00 120.86 1m12 n LEU 43 Ca 0.08 -0.70 -0.04 0.00 -1.11 0.00 0.00 56.01 54.25 1m12 n LEU 43 Cb 0.21 0.00 -0.04 0.00 0.53 0.00 0.00 43.42 44.13 1m12 n LEU 43 CO 0.19 0.17 0.45 -0.24 -1.11 0.00 0.00 177.39 176.85 1m12 n SER 44 N -0.54 -0.37 0.14 1.96 2.88 -1.05 -3.23 113.62 113.40 1m12 n SER 44 Ca 0.02 1.20 -0.13 0.00 -1.33 0.00 0.00 58.87 58.63 1m12 n SER 44 Cb 0.12 -0.37 -0.06 0.00 -0.75 0.00 0.00 64.21 63.15 1m12 n SER 44 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 1m12 h GLU 45 N 0.00 -0.51 -0.09 -1.46 4.39 -1.86 -2.41 114.58 112.64 1m12 h GLU 45 Ca 0.06 0.03 0.03 0.00 0.34 0.00 0.00 59.36 59.82 1m12 h GLU 45 Cb 0.14 0.12 -0.00 0.00 -0.10 0.00 0.00 28.75 28.91 1m12 h GLU 45 CO -0.33 -0.34 0.24 0.93 -1.16 0.00 0.00 179.01 178.35 1m12 h GLU 46 N -0.53 0.00 0.12 2.33 3.07 -1.90 0.47 114.58 118.13 1m12 h GLU 46 Ca 0.02 0.00 -0.19 0.00 -0.50 0.00 0.00 59.36 58.68 1m12 h GLU 46 Cb 0.53 0.00 0.02 0.00 -0.84 0.00 0.00 28.75 28.46 1m12 h GLU 46 CO -0.13 0.00 -0.83 0.00 -1.40 0.00 0.00 179.01 176.65 1m12 h GLN 48 N -0.25 0.78 -0.42 0.00 4.20 -0.63 0.20 115.11 118.99 1m12 h GLN 48 Ca -0.14 -0.05 -0.13 0.00 0.06 0.00 0.00 58.65 58.40 1m12 h GLN 48 Cb 1.62 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 29.21 1m12 h GLN 48 CO 0.16 0.51 -0.25 0.93 -0.67 0.00 0.00 178.83 179.51 1m12 h GLU 49 N 0.80 0.91 0.06 1.46 4.39 -1.51 -1.00 114.58 119.69 1m12 h GLU 49 Ca 0.48 -0.42 -0.00 0.00 0.34 0.00 0.00 59.36 59.76 1m12 h GLU 49 Cb 0.59 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.23 1m12 h GLU 49 CO -0.31 1.07 -0.03 0.28 -1.16 0.00 0.00 179.01 178.86 1m12 h VAL 50 N 0.74 1.22 0.43 3.13 2.07 -1.02 -1.96 116.25 120.87 1m12 h VAL 50 Ca 0.09 -1.06 -0.02 0.00 0.82 0.00 0.00 66.70 66.53 1m12 h VAL 50 Cb 0.82 1.90 0.00 0.00 -1.52 0.00 0.00 31.29 32.50 1m12 h VAL 50 CO 0.07 0.26 -0.21 0.58 0.02 0.00 0.00 177.57 178.29 1m12 h VAL 51 N -0.57 0.58 -0.61 2.57 2.07 -0.69 0.74 116.25 120.33 1m12 h VAL 51 Ca -0.01 -0.03 -0.01 0.00 0.82 0.00 0.00 66.70 67.47 1m12 h VAL 51 Cb 0.49 0.59 -0.03 0.00 -1.52 0.00 0.00 31.29 30.83 1m12 h VAL 51 CO 0.01 0.01 0.33 -2.24 0.02 0.00 0.00 177.57 175.70 1m12 h ASP 52 N -0.60 0.78 0.21 0.57 2.03 -1.27 0.22 116.42 118.35 1m12 h ASP 52 Ca -0.06 -0.10 -0.35 0.00 -0.73 0.00 0.00 57.03 55.79 1m12 h ASP 52 Cb 0.45 -0.20 -0.00 0.00 -0.83 0.00 0.00 39.33 38.76 1m12 h ASP 52 CO 0.10 0.66 -1.79 0.74 -1.03 0.00 0.00 179.24 177.91 1m12 h THR 53 N 0.83 0.87 -0.47 1.15 2.02 -1.34 -3.38 112.91 112.60 1m12 h THR 53 Ca 0.21 -2.50 -0.24 0.00 0.77 0.00 0.00 66.41 64.65 1m12 h THR 53 Cb 0.06 2.69 -0.14 0.00 -1.74 0.00 0.00 68.15 69.02 1m12 h THR 53 CO -0.03 0.86 0.05 -1.22 0.37 0.00 0.00 175.52 175.54 1m12 n TYR 54 N -3.54 1.45 -0.07 3.16 4.02 0.26 -4.72 117.16 117.73 1m12 n TYR 54 Ca -0.26 -1.65 -0.11 0.00 -0.01 0.00 0.00 57.90 55.88 1m12 n TYR 54 Cb 1.07 -0.58 -0.09 0.00 -0.02 0.00 0.00 39.34 39.72 1m12 n TYR 54 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 1m12 h GLY 55 N 1.02 0.00 2.00 2.72 0.00 -0.54 -2.89 103.07 105.38 1m12 h GLY 55 Ca 0.30 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.53 1m12 h GLY 55 CO 0.52 0.00 -0.45 1.76 0.00 0.00 0.00 176.54 178.37 1m12 h SER 56 N -1.00 0.00 -0.00 0.19 0.02 -1.84 -2.83 113.55 108.08 1m12 h SER 56 Ca -0.02 -0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.87 1m12 h SER 56 Cb 0.74 -0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.29 1m12 h SER 56 CO -0.01 0.45 -0.25 0.77 -1.14 0.00 0.00 176.83 176.65 1m12 h SER 57 N 0.00 0.23 0.11 3.07 4.64 -1.87 -0.68 113.55 119.05 1m12 h SER 57 Ca -0.00 -0.77 0.02 0.00 -0.47 0.00 0.00 61.79 60.57 1m12 h SER 57 Cb 0.80 -0.07 -0.03 0.00 -0.31 0.00 0.00 62.40 62.78 1m12 h SER 57 CO 0.06 0.97 -0.23 0.40 -0.87 0.00 0.00 176.83 177.15 1m12 h ILE 58 N -0.48 0.48 0.00 0.95 2.04 -1.55 0.35 117.51 119.30 1m12 h ILE 58 Ca -0.03 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.83 1m12 h ILE 58 Cb 1.00 0.48 -0.00 0.00 -0.74 0.00 0.00 36.82 37.56 1m12 h ILE 58 CO 0.05 0.00 -0.01 0.25 0.00 0.00 0.00 178.15 178.44 1m12 h LEU 59 N -0.43 0.00 0.14 1.44 5.85 -1.57 -1.82 115.31 118.92 1m12 h LEU 59 Ca 0.03 0.00 -0.29 0.00 0.84 0.00 0.00 57.88 58.46 1m12 h LEU 59 Cb 0.45 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.49 1m12 h LEU 59 CO -0.14 0.01 -1.34 -1.28 -0.34 0.00 0.00 178.44 175.36 1m12 h SER 60 N 0.00 0.47 -0.09 1.25 0.87 0.61 -3.27 113.55 113.39 1m12 h SER 60 Ca -0.00 -0.53 -0.03 0.00 -1.23 0.00 0.00 61.79 60.00 1m12 h SER 60 Cb 0.04 -0.15 -0.00 0.00 -0.44 0.00 0.00 62.40 61.84 1m12 h SER 60 CO 0.00 1.42 -0.07 0.40 -0.53 0.00 0.00 176.83 178.05 1m12 h ILE 61 N 0.08 1.35 -0.81 2.23 2.04 -0.44 -3.08 117.51 118.88 1m12 h ILE 61 Ca -0.17 -1.18 0.16 0.00 1.00 0.00 0.00 64.86 64.67 1m12 h ILE 61 Cb 2.01 1.93 -0.06 0.00 -0.74 0.00 0.00 36.82 39.96 1m12 h ILE 61 CO 0.20 0.33 0.54 -0.07 0.00 0.00 0.00 178.15 179.15 1m12 h LEU 62 N -0.18 0.45 -0.50 1.44 3.38 -1.48 0.59 115.31 119.00 1m12 h LEU 62 Ca 0.02 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1m12 h LEU 62 Cb 0.56 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.26 1m12 h LEU 62 CO 0.02 0.22 0.00 0.18 0.09 0.00 0.00 178.44 178.95 1m12 n LEU 63 N -4.50 0.73 -1.45 1.67 4.77 -1.17 -2.68 117.00 114.36 1m12 n LEU 63 Ca 0.16 0.64 -0.08 0.00 -0.03 0.00 0.00 56.01 56.70 1m12 n LEU 63 Cb 0.55 -0.50 0.06 0.00 -2.33 0.00 0.00 43.42 41.20 1m12 n LEU 63 CO 0.32 -0.45 0.81 -0.62 -1.33 0.00 0.00 177.39 176.11 1m12 n GLU 64 N -2.26 1.44 -2.75 3.23 1.02 0.21 -4.81 120.64 116.71 1m12 n GLU 64 Ca 0.03 -1.03 -0.14 0.00 -0.02 0.00 0.00 57.16 56.01 1m12 n GLU 64 Cb 0.29 -1.40 -0.01 0.00 -0.02 0.00 0.00 31.44 30.30 1m12 n GLU 64 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1m12 n GLU 65 N 0.02 -2.69 -3.46 3.49 -0.58 -1.09 -4.93 120.64 111.39 1m12 n GLU 65 Ca 0.20 0.46 -0.35 0.00 -0.42 0.00 0.00 57.16 57.05 1m12 n GLU 65 Cb 0.86 -5.07 -0.06 0.00 -0.57 0.00 0.00 31.44 26.61 1m12 n GLU 65 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 1m12 s VAL 66 N -2.62 4.97 0.62 2.62 1.01 -1.25 -5.04 120.40 120.71 1m12 s VAL 66 Ca 0.13 0.64 -0.18 0.00 0.00 0.00 0.00 61.98 62.57 1m12 s VAL 66 Cb -0.07 -3.69 -0.05 0.00 0.00 0.00 0.00 36.38 32.57 1m12 s VAL 66 CO 0.16 0.26 0.85 -1.20 0.00 0.00 0.00 175.10 175.16 1m12 n SER 67 N 0.82 0.23 -0.21 3.32 7.64 -1.26 -4.78 113.62 119.38 1m12 n SER 67 Ca -0.06 0.76 -0.09 0.00 1.01 0.00 0.00 58.87 60.49 1m12 n SER 67 Cb 0.52 -1.34 0.03 0.00 -1.01 0.00 0.00 64.21 62.41 1m12 n SER 67 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1m12 h PRO 68 N 0.29 1.08 0.00 1.43 0.13 -1.97 -3.01 132.00 129.94 1m12 h PRO 68 Ca -0.48 -0.35 -0.01 0.00 -0.87 0.00 0.00 66.00 64.29 1m12 h PRO 68 Cb 1.37 -0.10 -0.00 0.00 0.13 0.00 0.00 31.00 32.40 1m12 h PRO 68 CO 0.49 1.05 -0.06 1.49 -0.23 0.00 0.00 178.00 180.74 1m12 h GLU 69 N 0.98 0.00 0.00 0.86 4.57 -2.00 -2.63 114.58 116.36 1m12 h GLU 69 Ca 0.17 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.35 1m12 h GLU 69 Cb 0.57 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.16 1m12 h GLU 69 CO 0.03 0.06 0.00 -0.07 -1.18 0.00 0.00 179.01 177.86 1m12 h LEU 70 N 0.00 0.00 0.35 1.64 3.38 -1.89 -3.18 115.31 115.61 1m12 h LEU 70 Ca -0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1m12 h LEU 70 Cb 0.78 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.53 1m12 h LEU 70 CO 0.01 0.00 -0.17 0.58 0.09 0.00 0.00 178.44 178.95 1m12 h VAL 71 N 0.00 0.64 0.00 1.22 2.07 -1.55 -0.00 116.25 118.63 1m12 h VAL 71 Ca 0.00 -0.45 -0.05 0.00 0.82 0.00 0.00 66.70 67.02 1m12 h VAL 71 Cb 0.42 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 1m12 h VAL 71 CO 0.00 0.08 -0.24 0.00 0.02 0.00 0.00 177.57 177.44 1m12 h SER 73 N 0.00 0.81 -0.17 0.00 0.87 -1.57 -2.72 113.55 110.77 1m12 h SER 73 Ca -0.00 -0.69 -0.20 0.00 -1.23 0.00 0.00 61.79 59.67 1m12 h SER 73 Cb 0.50 -0.25 0.01 0.00 -0.44 0.00 0.00 62.40 62.21 1m12 h SER 73 CO 0.03 1.49 -0.69 0.24 -0.53 0.00 0.00 176.83 177.38 1m12 h MET 74 N 0.31 0.77 -0.36 2.24 2.86 -0.80 -2.99 114.93 116.96 1m12 h MET 74 Ca -0.14 -0.60 0.00 0.00 -2.06 0.00 0.00 59.70 56.90 1m12 h MET 74 Cb 1.76 0.11 0.00 0.00 0.06 0.00 0.00 31.60 33.53 1m12 h MET 74 CO 0.21 1.21 0.00 1.28 1.06 0.00 0.00 176.91 180.67 1m12 n LEU 75 N -4.00 0.36 -1.85 1.22 4.77 -0.86 -4.77 117.00 111.86 1m12 n LEU 75 Ca -0.07 -0.18 -0.11 0.00 -0.03 0.00 0.00 56.01 55.63 1m12 n LEU 75 Cb 0.70 -0.18 -0.03 0.00 -2.33 0.00 0.00 43.42 41.58 1m12 n LEU 75 CO 0.51 0.09 -0.12 1.41 -1.33 0.00 0.00 177.39 177.96 1m12 n HIS 76 N -0.12 -0.97 0.87 -1.77 8.25 -1.13 -4.77 115.22 115.58 1m12 n HIS 76 Ca 0.00 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.59 1m12 n HIS 76 Cb 0.09 -2.37 0.34 0.00 1.12 0.00 0.00 29.99 29.17 1m12 n HIS 76 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1m12 n LEU 77 N -2.20 0.44 -4.33 2.41 4.77 -1.04 -4.87 117.00 112.18 1m12 n LEU 77 Ca -0.11 0.23 -0.18 0.00 -0.03 0.00 0.00 56.01 55.92 1m12 n LEU 77 Cb 0.46 -0.31 -0.10 0.00 -2.33 0.00 0.00 43.42 41.15 1m12 n LEU 77 CO 0.15 0.02 -0.44 0.00 -1.33 0.00 0.00 177.39 175.79 1m12 n SER 79 N -0.26 -1.53 -2.77 0.00 7.64 -1.26 -4.89 113.62 110.54 1m12 n SER 79 Ca -0.09 0.00 -0.11 0.00 1.01 0.00 0.00 58.87 59.68 1m12 n SER 79 Cb 0.60 -0.38 -0.04 0.00 -1.01 0.00 0.00 64.21 63.38 1m12 n SER 79 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1m12 n GLY 80 N -0.71 2.35 0.05 0.23 0.00 -1.26 -4.30 105.19 101.55 1m12 n GLY 80 Ca 0.00 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.45 1m12 n GLY 80 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1m12 n LEU 81 N 3.72 0.10 -4.85 0.99 7.99 -1.26 -4.77 117.00 118.92 1m12 n LEU 81 Ca 0.26 -0.05 -0.33 0.00 -0.01 0.00 0.00 56.01 55.88 1m12 n LEU 81 Cb 0.22 -0.05 -0.06 0.00 -0.11 0.00 0.00 43.42 43.42 1m12 n LEU 81 CO 0.46 0.03 0.32 0.68 -1.51 0.00 0.00 177.39 177.36 1m12 s VAL 82 N -1.89 4.78 0.25 4.08 -7.23 -1.26 -5.01 120.40 114.13 1m12 s VAL 82 Ca 0.00 0.80 -0.30 0.00 -1.81 0.00 0.00 61.98 60.67 1m12 s VAL 82 Cb 0.00 -3.66 -0.14 0.00 0.56 0.00 0.00 36.38 33.14 1m12 s VAL 82 CO 0.00 -0.02 1.26 -2.65 -0.31 0.00 0.00 175.10 173.38 1m12 n PRO 83 N 0.05 1.75 0.00 4.82 -0.01 -1.26 -5.22 135.00 135.13 1m12 n PRO 83 Ca 0.00 0.62 0.08 0.00 -0.01 0.00 0.00 63.50 64.19 1m12 n PRO 83 Cb 0.52 -2.18 0.48 0.00 -0.01 0.00 0.00 33.50 32.31 1m12 n PRO 83 CO 0.00 0.00 0.00 2.89 -0.01 0.00 0.00 175.50 178.38