#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rjv n SER 2 N 0.00 0.00 -3.47 3.17 7.64 -1.26 -4.87 113.62 114.83 1rjv n SER 2 Ca 0.00 0.00 -0.37 0.00 1.01 0.00 0.00 58.87 59.51 1rjv n SER 2 Cb 0.00 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.18 1rjv n SER 2 CO 0.00 0.00 0.00 0.80 -3.01 0.00 0.00 175.04 172.83 1rjv n MET 3 N 0.00 2.55 0.00 1.43 0.00 -1.26 -2.34 117.12 117.50 1rjv n MET 3 Ca 0.00 -2.04 0.00 0.00 0.00 0.00 0.00 57.70 55.66 1rjv n MET 3 Cb 0.00 -2.88 0.00 0.00 0.00 0.00 0.00 33.22 30.34 1rjv n MET 3 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 175.97 178.38 1rjv n THR 4 N 4.73 0.00 0.00 1.12 -1.04 -1.26 -4.71 114.28 113.12 1rjv n THR 4 Ca 0.56 0.00 -0.06 0.00 -2.04 0.00 0.00 64.05 62.51 1rjv n THR 4 Cb 0.29 0.00 -0.05 0.00 -1.82 0.00 0.00 70.33 68.75 1rjv n THR 4 CO 0.00 0.00 0.00 -0.78 -0.64 0.00 0.00 175.07 173.65 1rjv h ASP 5 N 0.00 -0.11 -0.11 8.00 3.58 -1.86 -3.12 116.42 122.80 1rjv h ASP 5 Ca 0.00 -0.28 -0.00 0.00 0.42 0.00 0.00 57.03 57.17 1rjv h ASP 5 Cb 0.00 0.03 -0.01 0.00 1.72 0.00 0.00 39.33 41.07 1rjv h ASP 5 CO 0.00 0.50 0.06 -0.07 -2.88 0.00 0.00 179.24 176.85 1rjv h LEU 6 N -0.99 0.14 0.00 2.28 -0.00 -1.86 -3.43 115.31 111.46 1rjv h LEU 6 Ca -0.01 -0.08 0.00 0.00 -0.00 0.00 0.00 57.88 57.79 1rjv h LEU 6 Cb 0.38 -0.04 0.00 0.00 -0.00 0.00 0.00 40.66 41.00 1rjv h LEU 6 CO 0.02 0.18 0.00 0.18 -0.00 0.00 0.00 178.44 178.82 1rjv n LEU 7 N -4.96 0.00 -3.21 1.67 7.99 -1.26 -5.00 117.00 112.22 1rjv n LEU 7 Ca -0.05 0.00 0.04 0.00 -0.01 0.00 0.00 56.01 55.99 1rjv n LEU 7 Cb 0.07 0.00 -0.03 0.00 -0.11 0.00 0.00 43.42 43.34 1rjv n LEU 7 CO 0.34 0.00 0.80 0.20 -1.51 0.00 0.00 177.39 177.22 1rjv s ASN 8 N -1.00 -0.21 0.26 -1.43 0.01 -1.18 -4.93 114.94 106.47 1rjv s ASN 8 Ca 0.00 0.24 -0.02 0.00 -0.71 0.00 0.00 52.86 52.37 1rjv s ASN 8 Cb 0.00 1.22 0.43 0.00 0.41 0.00 0.00 41.25 43.31 1rjv s ASN 8 CO 0.00 -0.04 1.86 0.00 -1.51 0.00 0.00 177.10 177.41 1rjv h ALA 9 N 7.39 1.37 -0.42 0.60 0.00 -1.84 -0.66 119.26 125.70 1rjv h ALA 9 Ca -0.13 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1rjv h ALA 9 Cb 1.14 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 1rjv h ALA 9 CO 0.00 0.34 0.23 0.93 0.00 0.00 0.00 179.25 180.75 1rjv h GLU 10 N 1.07 0.58 -0.23 0.00 5.08 -1.97 0.12 114.58 119.22 1rjv h GLU 10 Ca 0.44 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.70 1rjv h GLU 10 Cb 0.26 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 1rjv h GLU 10 CO -0.20 0.46 0.03 -0.44 -1.00 0.00 0.00 179.01 177.86 1rjv h ASP 11 N 0.55 0.38 -0.72 1.42 5.19 -1.76 -2.40 116.42 119.08 1rjv h ASP 11 Ca 0.15 -0.28 0.08 0.00 -0.62 0.00 0.00 57.03 56.36 1rjv h ASP 11 Cb 0.05 -0.10 -0.06 0.00 0.18 0.00 0.00 39.33 39.39 1rjv h ASP 11 CO -0.02 0.56 0.40 0.40 -3.12 0.00 0.00 179.24 177.46 1rjv h ILE 12 N 0.19 0.92 -0.72 0.35 5.03 -0.98 0.77 117.51 123.07 1rjv h ILE 12 Ca 0.07 -0.24 0.08 0.00 -0.12 0.00 0.00 64.86 64.65 1rjv h ILE 12 Cb 0.35 0.16 -0.07 0.00 -3.03 0.00 0.00 36.82 34.24 1rjv h ILE 12 CO 0.01 0.13 0.39 0.50 -0.68 0.00 0.00 178.15 178.49 1rjv h LYS 13 N 0.70 0.66 -0.40 2.37 1.63 -0.51 0.70 116.57 121.72 1rjv h LYS 13 Ca 0.34 -0.04 -0.12 0.00 -0.85 0.00 0.00 60.65 59.98 1rjv h LYS 13 Cb 0.28 -0.15 -0.01 0.00 -0.60 0.00 0.00 32.23 31.75 1rjv h LYS 13 CO -0.22 0.44 -0.24 0.87 -3.45 0.00 0.00 179.45 176.85 1rjv h LYS 14 N 0.68 0.87 0.07 1.90 1.57 -0.91 -3.18 116.57 117.58 1rjv h LYS 14 Ca 0.34 -0.40 -0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1rjv h LYS 14 Cb 0.29 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.59 1rjv h LYS 14 CO -0.23 1.04 -0.04 0.00 -0.57 0.00 0.00 179.45 179.66 1rjv h ALA 15 N 0.81 -0.10 -0.25 3.86 0.00 -0.10 -0.05 119.26 123.43 1rjv h ALA 15 Ca 0.08 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.98 1rjv h ALA 15 Cb 0.80 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 1rjv h ALA 15 CO 0.07 -0.56 0.17 0.28 0.00 0.00 0.00 179.25 179.21 1rjv h VAL 16 N -0.10 1.05 -0.17 0.00 2.07 -1.00 0.00 116.25 118.10 1rjv h VAL 16 Ca -0.01 -0.11 -0.00 0.00 0.82 0.00 0.00 66.70 67.40 1rjv h VAL 16 Cb 0.08 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 30.55 1rjv h VAL 16 CO 0.01 0.06 0.09 1.23 0.02 0.00 0.00 177.57 178.98 1rjv h GLY 17 N 0.32 0.25 2.00 2.17 0.00 -1.40 -2.34 103.07 104.06 1rjv h GLY 17 Ca 0.10 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.32 1rjv h GLY 17 CO -0.02 0.11 0.00 0.00 0.00 0.00 0.00 176.54 176.63 1rjv h ALA 18 N 0.99 1.00 -0.28 3.60 0.00 0.92 -0.24 119.26 125.25 1rjv h ALA 18 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1rjv h ALA 18 Cb 0.06 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1rjv h ALA 18 CO -0.01 0.00 0.00 1.19 0.00 0.00 0.00 179.25 180.43 1rjv n PHE 19 N -2.49 0.37 -0.87 0.00 3.72 -0.92 -4.44 117.46 112.82 1rjv n PHE 19 Ca -0.02 -0.40 -0.25 0.00 -0.05 0.00 0.00 57.45 56.73 1rjv n PHE 19 Cb 0.04 -0.02 -0.03 0.00 -0.94 0.00 0.00 39.48 38.54 1rjv n PHE 19 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1rjv n SER 20 N 0.54 5.81 -3.65 4.37 2.88 -0.10 -4.79 113.62 118.68 1rjv n SER 20 Ca 0.11 -2.37 -0.13 0.00 -1.33 0.00 0.00 58.87 55.14 1rjv n SER 20 Cb 0.40 -1.20 -0.06 0.00 -0.75 0.00 0.00 64.21 62.59 1rjv n SER 20 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1rjv s ALA 21 N 3.00 0.68 -0.01 -1.46 0.00 -1.26 -5.06 121.76 117.65 1rjv s ALA 21 Ca 0.47 -1.43 -0.06 0.00 0.00 0.00 0.00 51.96 50.94 1rjv s ALA 21 Cb 0.13 1.21 -0.03 0.00 0.00 0.00 0.00 23.12 24.42 1rjv s ALA 21 CO -0.04 -0.76 0.52 1.79 0.00 0.00 0.00 175.76 177.27 1rjv h THR 22 N 2.25 0.00 -0.00 0.00 1.35 -1.93 -3.43 112.91 111.14 1rjv h THR 22 Ca -0.29 -0.20 0.00 0.00 -0.55 0.00 0.00 66.41 65.37 1rjv h THR 22 Cb 1.24 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 67.66 1rjv h THR 22 CO 0.41 0.00 -0.05 0.47 -0.25 0.00 0.00 175.52 176.09 1rjv n ASP 23 N -3.10 0.45 -2.20 5.36 9.92 -1.26 -1.20 116.55 124.53 1rjv n ASP 23 Ca -0.03 -0.73 -0.19 0.00 -0.53 0.00 0.00 54.79 53.32 1rjv n ASP 23 Cb 0.08 0.66 -0.09 0.00 -0.64 0.00 0.00 41.12 41.13 1rjv n ASP 23 CO 0.00 0.00 0.00 -0.24 0.13 0.00 0.00 177.20 177.09 1rjv n SER 24 N -0.65 5.96 -4.04 -2.24 2.88 -1.26 -4.70 113.62 109.57 1rjv n SER 24 Ca 0.01 -2.88 -0.42 0.00 -1.33 0.00 0.00 58.87 54.25 1rjv n SER 24 Cb 0.03 -1.28 -0.01 0.00 -0.75 0.00 0.00 64.21 62.21 1rjv n SER 24 CO 0.00 0.00 0.00 0.33 -1.23 0.00 0.00 175.04 174.14 1rjv n PHE 25 N 1.45 3.72 -1.88 0.66 7.35 -1.26 -4.84 117.46 122.65 1rjv n PHE 25 Ca 0.42 -2.75 -0.32 0.00 -0.76 0.00 0.00 57.45 54.04 1rjv n PHE 25 Cb 0.69 -2.51 -0.06 0.00 0.35 0.00 0.00 39.48 37.95 1rjv n PHE 25 CO 0.00 0.00 0.00 -3.47 -0.76 0.00 0.00 176.76 172.53 1rjv n ASP 26 N 7.40 3.02 -0.29 -2.13 -0.08 -1.26 -4.77 116.55 118.43 1rjv n ASP 26 Ca 0.50 -2.70 0.02 0.00 -1.51 0.00 0.00 54.79 51.10 1rjv n ASP 26 Cb 0.42 -1.60 0.22 0.00 2.34 0.00 0.00 41.12 42.49 1rjv n ASP 26 CO 0.00 0.00 0.00 1.12 0.12 0.00 0.00 177.20 178.44 1rjv h HIS 27 N 9.24 1.06 -0.07 -0.67 -0.00 -1.92 0.83 115.15 123.62 1rjv h HIS 27 Ca 0.27 0.03 0.03 0.00 -0.00 0.00 0.00 60.37 60.70 1rjv h HIS 27 Cb 0.88 -0.35 -0.03 0.00 -0.00 0.00 0.00 27.41 27.90 1rjv h HIS 27 CO 1.22 0.60 -0.12 0.87 -0.00 0.00 0.00 177.93 180.51 1rjv h LYS 28 N 1.08 -0.16 -0.06 5.12 1.57 -1.86 -0.71 116.57 121.55 1rjv h LYS 28 Ca 0.36 0.01 -0.22 0.00 -1.87 0.00 0.00 60.65 58.93 1rjv h LYS 28 Cb 0.06 0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.41 1rjv h LYS 28 CO -0.11 -0.10 -0.85 -0.22 -0.57 0.00 0.00 179.45 177.59 1rjv h LYS 29 N -0.16 0.53 0.05 3.15 3.64 -1.75 -2.89 116.57 119.13 1rjv h LYS 29 Ca 0.07 -0.49 0.03 0.00 -1.27 0.00 0.00 60.65 58.98 1rjv h LYS 29 Cb 0.26 0.12 -0.05 0.00 -0.41 0.00 0.00 32.23 32.14 1rjv h LYS 29 CO -0.17 1.12 -0.42 0.35 -2.27 0.00 0.00 179.45 178.06 1rjv h PHE 30 N 0.33 -1.18 0.00 1.91 3.04 -0.79 0.16 116.94 120.41 1rjv h PHE 30 Ca -0.06 0.03 0.00 0.00 3.98 0.00 0.00 57.97 61.92 1rjv h PHE 30 Cb 1.46 0.51 0.00 0.00 2.56 0.00 0.00 35.95 40.49 1rjv h PHE 30 CO 0.07 -0.50 0.00 0.74 -2.02 0.00 0.00 178.31 176.59 1rjv h PHE 31 N -0.61 0.00 0.00 0.41 -1.00 -1.14 0.12 116.94 114.72 1rjv h PHE 31 Ca 0.04 0.00 -0.06 0.00 2.81 0.00 0.00 57.97 60.76 1rjv h PHE 31 Cb 0.66 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.21 1rjv h PHE 31 CO -0.40 0.00 -0.41 1.96 -1.61 0.00 0.00 178.31 177.85 1rjv h GLN 32 N 0.00 0.00 -0.57 1.51 4.20 -1.23 -1.97 115.11 117.05 1rjv h GLN 32 Ca 0.00 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.71 1rjv h GLN 32 Cb 0.05 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.80 1rjv h GLN 32 CO 0.00 0.55 0.35 0.52 -0.67 0.00 0.00 178.83 179.58 1rjv h MET 33 N -1.00 0.77 0.00 1.46 2.86 -0.09 -0.82 114.93 118.10 1rjv h MET 33 Ca -0.09 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.50 1rjv h MET 33 Cb 0.72 -0.17 0.00 0.00 0.06 0.00 0.00 31.60 32.22 1rjv h MET 33 CO -0.05 0.53 0.00 1.55 1.06 0.00 0.00 176.91 180.00 1rjv n VAL 34 N -4.43 0.09 -0.97 -2.22 3.14 0.35 -4.59 118.33 109.71 1rjv n VAL 34 Ca 0.05 0.02 0.00 0.00 -2.96 0.00 0.00 64.34 61.46 1rjv n VAL 34 Cb 0.07 -0.55 0.00 0.00 -1.06 0.00 0.00 33.84 32.29 1rjv n VAL 34 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1rjv n GLY 35 N 1.25 0.29 0.40 7.55 0.00 -0.31 -4.59 105.19 109.77 1rjv n GLY 35 Ca 0.09 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.99 1rjv n GLY 35 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1rjv h LEU 36 N 0.00 -1.53 -0.86 0.99 3.38 -1.60 0.19 115.31 115.88 1rjv h LEU 36 Ca 0.00 0.19 0.00 0.00 0.09 0.00 0.00 57.88 58.16 1rjv h LEU 36 Cb 0.42 0.61 0.00 0.00 0.09 0.00 0.00 40.66 41.78 1rjv h LEU 36 CO 0.00 -0.39 0.20 0.29 0.09 0.00 0.00 178.44 178.63 1rjv n LYS 37 N -5.00 0.09 0.04 1.13 5.02 -1.19 -0.66 118.16 117.58 1rjv n LYS 37 Ca -0.04 0.55 0.11 0.00 -2.02 0.00 0.00 58.31 56.91 1rjv n LYS 37 Cb 0.31 -1.99 0.07 0.00 -0.02 0.00 0.00 35.03 33.40 1rjv n LYS 37 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 1rjv n LYS 38 N -1.98 0.32 -2.39 1.97 2.85 0.64 -4.94 118.16 114.63 1rjv n LYS 38 Ca -0.01 0.03 -0.24 0.00 -1.05 0.00 0.00 58.31 57.04 1rjv n LYS 38 Cb 0.22 -1.64 0.09 0.00 -0.65 0.00 0.00 35.03 33.05 1rjv n LYS 38 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 1rjv s LYS 39 N -3.21 1.92 0.65 -1.58 -0.14 0.17 -5.08 119.74 112.47 1rjv s LYS 39 Ca 0.04 -0.67 -0.14 0.00 -1.36 0.00 0.00 55.97 53.85 1rjv s LYS 39 Cb 0.14 -2.25 -0.01 0.00 -1.68 0.00 0.00 37.83 34.03 1rjv s LYS 39 CO 0.78 -1.33 1.07 0.45 -0.76 0.00 0.00 175.35 175.56 1rjv s SER 40 N -4.61 5.38 0.25 2.83 0.15 -1.26 -4.90 113.70 111.54 1rjv s SER 40 Ca 0.63 1.81 -0.05 0.00 0.70 0.00 0.00 55.95 59.04 1rjv s SER 40 Cb -0.08 -2.53 0.32 0.00 -1.71 0.00 0.00 66.02 62.02 1rjv s SER 40 CO 0.44 -1.44 1.90 0.00 1.20 0.00 0.00 173.24 175.34 1rjv h ALA 41 N -0.12 1.29 0.00 5.45 0.00 -1.97 -0.53 119.26 123.38 1rjv h ALA 41 Ca -0.46 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.37 1rjv h ALA 41 Cb 1.22 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 1rjv h ALA 41 CO 0.56 0.50 -0.21 0.22 0.00 0.00 0.00 179.25 180.32 1rjv h ASP 42 N 1.21 0.00 -0.24 0.00 3.58 -2.01 -2.60 116.42 116.37 1rjv h ASP 42 Ca 0.39 0.00 -0.05 0.00 0.42 0.00 0.00 57.03 57.79 1rjv h ASP 42 Cb 0.02 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.06 1rjv h ASP 42 CO -0.13 0.21 -0.04 -0.78 -2.88 0.00 0.00 179.24 175.62 1rjv h ASP 43 N 0.00 0.44 -0.60 2.28 3.58 -1.62 -3.13 116.42 117.37 1rjv h ASP 43 Ca -0.00 -0.35 0.17 0.00 0.42 0.00 0.00 57.03 57.28 1rjv h ASP 43 Cb 0.75 -0.12 -0.02 0.00 1.72 0.00 0.00 39.33 41.66 1rjv h ASP 43 CO 0.03 0.68 0.51 0.58 -2.88 0.00 0.00 179.24 178.16 1rjv h VAL 44 N 0.19 0.50 -0.06 2.25 2.07 -0.76 0.28 116.25 120.72 1rjv h VAL 44 Ca 0.06 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.58 1rjv h VAL 44 Cb 0.48 0.62 -0.00 0.00 -1.52 0.00 0.00 31.29 30.87 1rjv h VAL 44 CO 0.02 0.00 0.03 0.11 0.02 0.00 0.00 177.57 177.75 1rjv h LYS 45 N 0.00 0.09 0.00 1.57 1.57 -1.45 -2.40 116.57 115.95 1rjv h LYS 45 Ca 0.29 -0.01 -0.07 0.00 -1.87 0.00 0.00 60.65 58.98 1rjv h LYS 45 Cb 1.30 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.58 1rjv h LYS 45 CO -0.00 0.20 -0.33 0.87 -0.57 0.00 0.00 179.45 179.62 1rjv h LYS 46 N -0.04 0.00 0.00 3.15 6.56 -0.60 -2.83 116.57 122.81 1rjv h LYS 46 Ca 0.02 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.61 1rjv h LYS 46 Cb 0.14 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.80 1rjv h LYS 46 CO -0.00 0.33 0.00 0.28 -2.06 0.00 0.00 179.45 177.99 1rjv n VAL 47 N -3.88 0.00 -0.32 0.50 0.31 -0.09 -3.31 118.33 111.54 1rjv n VAL 47 Ca -0.01 1.36 0.11 0.00 -0.01 0.00 0.00 64.34 65.78 1rjv n VAL 47 Cb 0.40 -2.34 0.24 0.00 -0.91 0.00 0.00 33.84 31.23 1rjv n VAL 47 CO 0.00 0.00 0.00 0.15 -1.32 0.00 0.00 176.83 175.66 1rjv h PHE 48 N 0.00 -0.10 -0.16 3.52 3.57 -1.46 0.54 116.94 122.85 1rjv h PHE 48 Ca 0.00 0.07 0.05 0.00 3.53 0.00 0.00 57.97 61.61 1rjv h PHE 48 Cb 0.00 0.19 -0.01 0.00 2.79 0.00 0.00 35.95 38.93 1rjv h PHE 48 CO 0.13 -0.37 0.20 1.25 -2.23 0.00 0.00 178.31 177.28 1rjv h HIS 49 N 0.04 0.00 0.00 0.41 2.76 -1.58 -1.02 115.15 115.76 1rjv h HIS 49 Ca 0.53 0.00 -0.14 0.00 -2.20 0.00 0.00 60.37 58.56 1rjv h HIS 49 Cb 1.03 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.97 1rjv h HIS 49 CO -0.51 0.00 -0.67 1.98 -1.30 0.00 0.00 177.93 177.43 1rjv h MET 50 N 0.00 0.00 0.13 5.26 1.85 -0.87 -3.33 114.93 117.97 1rjv h MET 50 Ca 0.07 0.00 -0.27 0.00 -0.61 0.00 0.00 59.70 58.89 1rjv h MET 50 Cb 0.47 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.50 1rjv h MET 50 CO -0.00 0.67 -1.37 -0.07 -0.40 0.00 0.00 176.91 175.74 1rjv h LEU 51 N 0.00 0.42 -7.21 3.39 -0.00 -1.31 -3.39 115.31 107.22 1rjv h LEU 51 Ca -0.01 -0.87 -0.50 0.00 -0.00 0.00 0.00 57.88 56.50 1rjv h LEU 51 Cb 1.24 -0.14 0.01 0.00 -0.00 0.00 0.00 40.66 41.77 1rjv h LEU 51 CO 0.09 1.61 1.71 -0.67 -0.00 0.00 0.00 178.44 181.18 1rjv n ASP 52 N -3.92 2.80 -0.28 -0.43 2.03 -0.68 -4.79 116.55 111.29 1rjv n ASP 52 Ca -0.23 -2.69 0.06 0.00 0.52 0.00 0.00 54.79 52.45 1rjv n ASP 52 Cb 0.91 -1.41 0.21 0.00 -0.72 0.00 0.00 41.12 40.11 1rjv n ASP 52 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 1rjv h LYS 53 N 8.76 0.54 -0.48 -0.67 1.57 -1.79 -1.73 116.57 122.77 1rjv h LYS 53 Ca 0.33 -0.03 0.14 0.00 -1.87 0.00 0.00 60.65 59.21 1rjv h LYS 53 Cb 0.80 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.97 1rjv h LYS 53 CO 1.61 0.36 0.41 -0.44 -0.57 0.00 0.00 179.45 180.82 1rjv h ASP 54 N 0.55 0.00 -3.82 0.86 3.32 -1.94 -3.46 116.42 111.94 1rjv h ASP 54 Ca 0.44 0.00 -0.26 0.00 0.02 0.00 0.00 57.03 57.23 1rjv h ASP 54 Cb 0.63 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.17 1rjv h ASP 54 CO -0.37 0.00 -0.34 0.29 -1.72 0.00 0.00 179.24 177.10 1rjv n LYS 55 N -4.05 -2.25 0.02 3.56 4.76 -0.65 -4.90 118.16 114.66 1rjv n LYS 55 Ca 0.09 0.63 0.14 0.00 -2.87 0.00 0.00 58.31 56.29 1rjv n LYS 55 Cb 0.62 -5.24 0.53 0.00 -1.84 0.00 0.00 35.03 29.10 1rjv n LYS 55 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 1rjv n SER 56 N -1.84 0.23 0.00 4.39 3.41 -1.26 -4.95 113.62 113.60 1rjv n SER 56 Ca -0.15 0.45 0.00 0.00 -0.26 0.00 0.00 58.87 58.91 1rjv n SER 56 Cb 0.62 -0.48 0.00 0.00 -0.26 0.00 0.00 64.21 64.08 1rjv n SER 56 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1rjv n GLY 57 N 1.45 0.75 3.07 5.00 0.00 -1.26 -5.04 105.19 109.16 1rjv n GLY 57 Ca 0.06 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.96 1rjv n GLY 57 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1rjv s PHE 58 N -2.46 -0.36 -0.16 1.61 0.08 -1.26 -4.80 117.98 110.63 1rjv s PHE 58 Ca 0.00 0.84 -0.11 0.00 0.12 0.00 0.00 56.93 57.78 1rjv s PHE 58 Cb 0.00 0.07 -0.05 0.00 -0.57 0.00 0.00 43.02 42.47 1rjv s PHE 58 CO 0.00 -0.25 0.20 0.42 -0.10 0.00 0.00 175.22 175.49 1rjv s ILE 59 N 1.29 5.38 0.27 0.64 1.01 -0.80 -4.94 121.20 124.05 1rjv s ILE 59 Ca -0.09 0.34 0.02 0.00 0.00 0.00 0.00 60.65 60.91 1rjv s ILE 59 Cb -0.10 -3.52 -0.04 0.00 0.01 0.00 0.00 42.46 38.81 1rjv s ILE 59 CO -0.09 0.47 0.14 -1.83 0.00 0.00 0.00 174.94 173.63 1rjv s GLU 60 N 0.03 1.47 0.45 2.79 1.03 -1.26 -1.17 118.70 122.04 1rjv s GLU 60 Ca 0.13 -1.82 0.23 0.00 0.03 0.00 0.00 54.97 53.55 1rjv s GLU 60 Cb -0.12 -0.05 1.24 0.00 -0.80 0.00 0.00 34.13 34.40 1rjv s GLU 60 CO 0.02 -0.40 1.83 0.93 -1.33 0.00 0.00 175.26 176.31 1rjv h GLU 61 N 2.34 0.25 -0.04 -4.83 5.08 -1.94 -0.45 114.58 115.00 1rjv h GLU 61 Ca -0.35 -0.02 0.02 0.00 -1.00 0.00 0.00 59.36 58.01 1rjv h GLU 61 Cb 1.25 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.42 1rjv h GLU 61 CO 0.54 0.17 -0.07 0.22 -1.00 0.00 0.00 179.01 178.87 1rjv h ASP 62 N 0.26 -0.20 -0.05 1.42 1.82 -2.01 -1.28 116.42 116.39 1rjv h ASP 62 Ca 0.51 0.04 -0.16 0.00 -0.39 0.00 0.00 57.03 57.03 1rjv h ASP 62 Cb 1.54 0.09 0.01 0.00 0.68 0.00 0.00 39.33 41.65 1rjv h ASP 62 CO -0.15 -0.10 -0.58 -0.33 -1.61 0.00 0.00 179.24 176.47 1rjv h GLU 63 N -0.10 0.48 0.00 0.28 5.08 -1.68 -3.35 114.58 115.29 1rjv h GLU 63 Ca 0.04 -0.45 0.00 0.00 -1.00 0.00 0.00 59.36 57.95 1rjv h GLU 63 Cb 0.15 0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.52 1rjv h GLU 63 CO -0.10 1.09 0.00 -0.11 -1.00 0.00 0.00 179.01 178.90 1rjv n LEU 64 N -4.20 0.39 0.22 1.33 7.94 -0.27 -0.94 117.00 121.46 1rjv n LEU 64 Ca -0.09 0.63 0.15 0.00 -1.11 0.00 0.00 56.01 55.59 1rjv n LEU 64 Cb 0.65 -0.61 0.61 0.00 0.53 0.00 0.00 43.42 44.61 1rjv n LEU 64 CO 0.47 -0.58 0.94 1.23 -1.11 0.00 0.00 177.39 178.35 1rjv h GLY 65 N 1.43 0.00 -1.90 -3.96 0.00 -1.37 -3.37 103.07 93.90 1rjv h GLY 65 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.24 1rjv h GLY 65 CO 0.00 0.00 -0.53 1.97 0.00 0.00 0.00 176.54 177.98 1rjv n PHE 66 N -2.76 0.00 -0.38 5.60 -1.74 -0.12 -0.65 117.46 117.41 1rjv n PHE 66 Ca 0.01 -0.29 0.30 0.00 -0.56 0.00 0.00 57.45 56.91 1rjv n PHE 66 Cb 0.28 0.11 0.57 0.00 1.52 0.00 0.00 39.48 41.96 1rjv n PHE 66 CO 0.00 0.00 0.00 0.97 -0.56 0.00 0.00 176.76 177.17 1rjv h ILE 67 N 6.13 0.25 -0.81 1.97 -0.00 -1.42 -0.05 117.51 123.59 1rjv h ILE 67 Ca -0.22 -0.07 0.23 0.00 -0.00 0.00 0.00 64.86 64.80 1rjv h ILE 67 Cb 1.49 0.02 -0.03 0.00 -0.00 0.00 0.00 36.82 38.30 1rjv h ILE 67 CO -0.04 0.04 0.66 -0.07 -0.00 0.00 0.00 178.15 178.74 1rjv h LEU 68 N 0.21 0.00 -2.81 2.19 3.38 -1.88 -0.90 115.31 115.50 1rjv h LEU 68 Ca 0.75 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.72 1rjv h LEU 68 Cb 2.08 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.83 1rjv h LEU 68 CO -0.46 0.00 -0.00 0.11 0.09 0.00 0.00 178.44 178.18 1rjv h LYS 69 N 0.00 0.00 0.14 1.13 1.57 -1.12 0.57 116.57 118.86 1rjv h LYS 69 Ca 0.38 0.00 -0.28 0.00 -1.87 0.00 0.00 60.65 58.88 1rjv h LYS 69 Cb 1.69 0.00 0.01 0.00 0.08 0.00 0.00 32.23 34.01 1rjv h LYS 69 CO -0.00 0.00 -1.29 0.78 -0.57 0.00 0.00 179.45 178.37 1rjv h GLY 70 N 0.24 0.33 1.06 3.86 0.00 -1.35 -3.33 103.07 103.88 1rjv h GLY 70 Ca -0.00 -0.84 -0.08 0.00 0.00 0.00 0.00 47.33 46.41 1rjv h GLY 70 CO 0.00 0.73 0.07 0.74 0.00 0.00 0.00 176.54 178.09 1rjv h PHE 71 N 0.08 1.14 0.00 5.60 0.04 -1.05 -3.44 116.94 119.31 1rjv h PHE 71 Ca -0.15 -0.17 0.00 0.00 2.80 0.00 0.00 57.97 60.44 1rjv h PHE 71 Cb 1.99 -0.31 0.00 0.00 2.20 0.00 0.00 35.95 39.83 1rjv h PHE 71 CO 0.07 0.98 0.00 0.43 -0.60 0.00 0.00 178.31 179.19 1rjv n SER 72 N -4.23 0.00 -4.58 2.17 7.64 -0.17 -4.85 113.62 109.60 1rjv n SER 72 Ca 0.03 0.00 -0.29 0.00 1.01 0.00 0.00 58.87 59.63 1rjv n SER 72 Cb 0.31 0.00 0.21 0.00 -1.01 0.00 0.00 64.21 63.72 1rjv n SER 72 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1rjv s PRO 73 N -2.00 -0.08 0.00 1.43 0.04 -1.26 -3.84 135.00 129.28 1rjv s PRO 73 Ca 0.00 0.88 0.00 0.00 0.04 0.00 0.00 61.00 61.92 1rjv s PRO 73 Cb 0.00 -1.65 0.00 0.00 0.04 0.00 0.00 34.50 32.89 1rjv s PRO 73 CO 0.00 -3.17 0.00 -3.47 0.04 0.00 0.00 177.00 170.40 1rjv n ASP 74 N -4.54 -2.51 -0.34 6.66 2.03 -1.26 -4.96 116.55 111.63 1rjv n ASP 74 Ca 0.05 0.00 -0.11 0.00 0.52 0.00 0.00 54.79 55.25 1rjv n ASP 74 Cb 0.55 -1.44 -0.09 0.00 -0.72 0.00 0.00 41.12 39.41 1rjv n ASP 74 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1rjv h ALA 75 N 0.00 -0.56 -1.14 -1.67 0.00 -1.85 -3.50 119.26 110.55 1rjv h ALA 75 Ca 0.00 0.09 0.13 0.00 0.00 0.00 0.00 54.91 55.13 1rjv h ALA 75 Cb 0.24 1.31 -0.05 0.00 0.00 0.00 0.00 17.79 19.29 1rjv h ALA 75 CO 0.00 -0.93 -0.30 0.54 0.00 0.00 0.00 179.25 178.56 1rjv n ARG 76 N -5.12 -1.06 -2.48 0.00 1.74 -1.26 -4.88 116.66 103.59 1rjv n ARG 76 Ca 0.01 0.79 -0.43 0.00 -0.77 0.00 0.00 57.85 57.45 1rjv n ARG 76 Cb 0.26 -1.27 -0.02 0.00 -1.02 0.00 0.00 32.46 30.41 1rjv n ARG 76 CO 0.00 0.00 0.00 0.16 -1.52 0.00 0.00 177.63 176.27 1rjv s ASP 77 N -5.66 6.49 0.70 0.55 -4.77 -1.26 -4.56 116.67 108.15 1rjv s ASP 77 Ca 0.00 0.63 -0.15 0.00 -3.30 0.00 0.00 52.55 49.72 1rjv s ASP 77 Cb 0.00 -2.55 0.02 0.00 -1.09 0.00 0.00 42.92 39.31 1rjv s ASP 77 CO 0.00 -1.34 1.19 -0.76 0.70 0.00 0.00 175.17 174.95 1rjv s LEU 78 N 4.92 3.38 0.60 2.11 1.43 0.17 -4.97 118.68 126.32 1rjv s LEU 78 Ca 0.54 2.28 -0.18 0.00 -1.03 0.00 0.00 54.13 55.74 1rjv s LEU 78 Cb -0.10 -4.58 -0.03 0.00 0.03 0.00 0.00 46.19 41.51 1rjv s LEU 78 CO 0.32 -2.04 1.19 -0.55 0.23 0.00 0.00 176.35 175.50 1rjv s SER 79 N -2.09 5.17 0.38 2.29 0.15 -0.34 -4.89 113.70 114.37 1rjv s SER 79 Ca 0.73 2.32 0.11 0.00 0.70 0.00 0.00 55.95 59.81 1rjv s SER 79 Cb -0.27 -2.59 0.89 0.00 -1.71 0.00 0.00 66.02 62.34 1rjv s SER 79 CO 0.43 -1.60 1.91 0.00 1.20 0.00 0.00 173.24 175.18 1rjv h ALA 80 N 0.76 1.91 -0.00 5.45 0.00 -1.95 -0.91 119.26 124.51 1rjv h ALA 80 Ca -0.50 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.29 1rjv h ALA 80 Cb 1.29 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 1rjv h ALA 80 CO 0.55 -0.11 -0.57 0.87 0.00 0.00 0.00 179.25 179.98 1rjv h LYS 81 N 0.60 0.01 0.58 0.00 1.57 -1.93 -3.19 116.57 114.20 1rjv h LYS 81 Ca 0.39 -0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 59.14 1rjv h LYS 81 Cb 0.67 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.99 1rjv h LYS 81 CO -0.15 0.58 -0.28 1.49 -0.57 0.00 0.00 179.45 180.52 1rjv h GLU 82 N 0.00 -0.75 -0.80 3.15 4.22 -1.46 -2.83 114.58 116.12 1rjv h GLU 82 Ca -0.01 0.05 0.15 0.00 0.08 0.00 0.00 59.36 59.64 1rjv h GLU 82 Cb 1.01 0.17 -0.10 0.00 0.50 0.00 0.00 28.75 30.34 1rjv h GLU 82 CO 0.07 -0.50 0.35 0.00 -2.18 0.00 0.00 179.01 176.75 1rjv h THR 83 N -1.03 0.65 0.22 0.32 1.03 -1.51 0.28 112.91 112.87 1rjv h THR 83 Ca -0.08 -0.17 0.01 0.00 -0.01 0.00 0.00 66.41 66.16 1rjv h THR 83 Cb 0.59 0.13 -0.04 0.00 -1.07 0.00 0.00 68.15 67.76 1rjv h THR 83 CO 0.13 0.09 -0.45 0.11 -0.01 0.00 0.00 175.52 175.39 1rjv h LYS 84 N 0.48 -0.73 -0.40 0.00 1.57 -1.63 0.30 116.57 116.16 1rjv h LYS 84 Ca 0.44 0.05 -0.05 0.00 -1.87 0.00 0.00 60.65 59.22 1rjv h LYS 84 Cb 0.69 0.16 -0.02 0.00 0.08 0.00 0.00 32.23 33.15 1rjv h LYS 84 CO -0.41 -0.48 0.04 0.52 -0.57 0.00 0.00 179.45 178.55 1rjv h MET 85 N -0.75 0.67 -0.27 3.15 2.86 -0.93 -2.64 114.93 117.02 1rjv h MET 85 Ca -0.00 -0.19 -0.01 0.00 -2.06 0.00 0.00 59.70 57.44 1rjv h MET 85 Cb 0.73 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 32.31 1rjv h MET 85 CO -0.20 0.73 0.13 1.25 1.06 0.00 0.00 176.91 179.89 1rjv h LEU 86 N 0.51 0.34 -0.61 1.22 5.85 -0.42 0.63 115.31 122.82 1rjv h LEU 86 Ca 0.12 -0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 1rjv h LEU 86 Cb 0.40 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.31 1rjv h LEU 86 CO 0.01 0.36 0.34 0.00 -0.34 0.00 0.00 178.44 178.81 1rjv h MET 87 N 0.30 0.86 -0.09 1.25 -0.00 -0.98 0.25 114.93 116.52 1rjv h MET 87 Ca 0.09 -0.10 -0.06 0.00 -0.00 0.00 0.00 59.70 59.63 1rjv h MET 87 Cb 0.10 -0.17 -0.01 0.00 -0.00 0.00 0.00 31.60 31.52 1rjv h MET 87 CO -0.01 0.65 -0.24 0.00 -0.00 0.00 0.00 176.91 177.31 1rjv h ALA 88 N 1.16 1.44 0.19 -3.00 0.00 -1.16 0.27 119.26 118.15 1rjv h ALA 88 Ca 0.22 -0.26 -0.27 0.00 0.00 0.00 0.00 54.91 54.59 1rjv h ALA 88 Cb 0.04 -0.07 0.02 0.00 0.00 0.00 0.00 17.79 17.78 1rjv h ALA 88 CO -0.03 0.40 -1.24 0.00 0.00 0.00 0.00 179.25 178.37 1rjv h ALA 89 N 1.62 -0.06 -0.00 0.00 0.00 -0.73 -3.40 119.26 116.69 1rjv h ALA 89 Ca 0.02 -0.86 -0.17 0.00 0.00 0.00 0.00 54.91 53.91 1rjv h ALA 89 Cb 0.50 0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 1rjv h ALA 89 CO 0.04 0.62 -0.80 0.78 0.00 0.00 0.00 179.25 179.89 1rjv h GLY 90 N -0.02 0.05 -7.17 0.00 0.00 -0.30 -3.34 103.07 92.29 1rjv h GLY 90 Ca -0.23 -0.08 -0.49 0.00 0.00 0.00 0.00 47.33 46.54 1rjv h GLY 90 CO 0.19 0.07 1.23 -0.35 0.00 0.00 0.00 176.54 177.67 1rjv s ASP 91 N -6.82 5.99 0.29 0.19 2.15 0.06 -4.48 116.67 114.06 1rjv s ASP 91 Ca -0.01 -1.19 0.14 0.00 0.43 0.00 0.00 52.55 51.92 1rjv s ASP 91 Cb 0.11 -2.57 0.38 0.00 -0.30 0.00 0.00 42.92 40.54 1rjv s ASP 91 CO 0.79 -1.98 1.60 0.11 -0.17 0.00 0.00 175.17 175.53 1rjv h LYS 92 N 10.30 0.00 -0.08 4.34 1.79 -1.85 -3.36 116.57 127.70 1rjv h LYS 92 Ca 0.17 0.00 -0.19 0.00 -2.18 0.00 0.00 60.65 58.44 1rjv h LYS 92 Cb 1.00 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.67 1rjv h LYS 92 CO 1.35 0.56 -0.71 -0.44 -1.08 0.00 0.00 179.45 179.13 1rjv h ASP 93 N 0.00 0.76 0.00 0.86 3.32 -1.91 -3.48 116.42 115.97 1rjv h ASP 93 Ca -0.01 -0.68 0.00 0.00 0.02 0.00 0.00 57.03 56.37 1rjv h ASP 93 Cb 1.14 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 40.46 1rjv h ASP 93 CO 0.07 1.32 0.00 0.61 -1.72 0.00 0.00 179.24 179.53 1rjv n GLY 94 N 0.84 1.42 0.93 2.75 0.00 -1.26 -5.03 105.19 104.83 1rjv n GLY 94 Ca -0.09 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.03 1rjv n GLY 94 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1rjv n ASP 95 N 0.00 3.07 -0.04 1.61 5.68 -1.26 -5.00 116.55 120.61 1rjv n ASP 95 Ca 0.00 -1.90 -0.00 0.00 -0.50 0.00 0.00 54.79 52.39 1rjv n ASP 95 Cb 0.00 -0.18 -0.00 0.00 -1.14 0.00 0.00 41.12 39.80 1rjv n ASP 95 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1rjv n GLY 96 N 1.18 0.36 3.30 6.12 0.00 -1.26 -5.02 105.19 109.87 1rjv n GLY 96 Ca 0.15 -0.04 -0.20 0.00 0.00 0.00 0.00 46.02 45.93 1rjv n GLY 96 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rjv s LYS 97 N -0.85 1.18 -0.21 1.61 1.02 -1.26 -4.83 119.74 116.40 1rjv s LYS 97 Ca 0.00 -1.36 -0.29 0.00 0.02 0.00 0.00 55.97 54.34 1rjv s LYS 97 Cb 0.00 -1.15 0.00 0.00 -0.52 0.00 0.00 37.83 36.16 1rjv s LYS 97 CO 0.00 0.23 1.12 0.42 -0.92 0.00 0.00 175.35 176.20 1rjv s ILE 98 N -2.16 4.53 0.06 2.17 1.01 -0.32 -3.77 121.20 122.73 1rjv s ILE 98 Ca 0.14 1.84 0.03 0.00 0.00 0.00 0.00 60.65 62.66 1rjv s ILE 98 Cb -0.05 -4.21 -0.04 0.00 0.01 0.00 0.00 42.46 38.17 1rjv s ILE 98 CO 0.05 -0.19 0.07 -0.83 0.00 0.00 0.00 174.94 174.05 1rjv s GLY 99 N 1.51 2.01 0.16 6.18 0.00 -1.26 -1.91 107.32 114.01 1rjv s GLY 99 Ca 0.48 -0.99 -0.23 0.00 0.00 0.00 0.00 44.72 43.98 1rjv s GLY 99 CO 0.10 -0.95 1.61 -0.24 0.00 0.00 0.00 173.10 173.61 1rjv h VAL 100 N 2.71 0.29 -0.29 1.40 3.04 -1.94 0.35 116.25 121.81 1rjv h VAL 100 Ca -0.47 0.00 -0.10 0.00 -1.01 0.00 0.00 66.70 65.12 1rjv h VAL 100 Cb 1.17 0.29 -0.01 0.00 -2.01 0.00 0.00 31.29 30.73 1rjv h VAL 100 CO 0.65 0.00 -0.24 -0.78 -1.01 0.00 0.00 177.57 176.19 1rjv h ASP 101 N -0.26 0.57 0.88 3.17 3.58 -1.98 -0.18 116.42 122.20 1rjv h ASP 101 Ca 0.16 -0.19 -0.04 0.00 0.42 0.00 0.00 57.03 57.37 1rjv h ASP 101 Cb 0.51 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 41.41 1rjv h ASP 101 CO -0.47 0.80 -0.48 -0.33 -2.88 0.00 0.00 179.24 175.88 1rjv h GLU 102 N 0.50 -1.20 -0.90 0.28 5.08 -1.84 -3.20 114.58 113.28 1rjv h GLU 102 Ca 0.07 0.08 0.09 0.00 -1.00 0.00 0.00 59.36 58.61 1rjv h GLU 102 Cb 0.68 0.27 -0.06 0.00 0.50 0.00 0.00 28.75 30.14 1rjv h GLU 102 CO 0.05 -0.80 0.58 0.35 -1.00 0.00 0.00 179.01 178.19 1rjv h PHE 103 N -1.25 0.99 -0.47 4.33 3.57 -0.30 0.32 116.94 124.13 1rjv h PHE 103 Ca -0.12 0.03 0.08 0.00 3.53 0.00 0.00 57.97 61.49 1rjv h PHE 103 Cb 0.98 -0.32 -0.03 0.00 2.79 0.00 0.00 35.95 39.37 1rjv h PHE 103 CO -0.05 0.46 0.32 1.03 -2.23 0.00 0.00 178.31 177.85 1rjv h SER 104 N 0.93 0.26 0.00 0.41 0.87 -1.12 -3.33 113.55 111.57 1rjv h SER 104 Ca 0.42 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.96 1rjv h SER 104 Cb 0.37 -0.05 -0.00 0.00 -0.44 0.00 0.00 62.40 62.27 1rjv h SER 104 CO -0.18 0.17 -1.07 0.35 -0.53 0.00 0.00 176.83 175.57 1rjv n THR 105 N -4.47 0.06 -0.40 2.23 -2.24 0.05 -4.21 114.28 105.30 1rjv n THR 105 Ca 0.07 -0.04 0.33 0.00 -2.27 0.00 0.00 64.05 62.13 1rjv n THR 105 Cb 0.33 -0.61 0.60 0.00 -2.10 0.00 0.00 70.33 68.56 1rjv n THR 105 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1rjv h LEU 106 N 0.00 0.31 0.00 3.22 7.12 -0.60 0.13 115.31 125.48 1rjv h LEU 106 Ca -0.02 0.14 0.00 0.00 0.13 0.00 0.00 57.88 58.12 1rjv h LEU 106 Cb 0.82 0.11 0.00 0.00 -0.53 0.00 0.00 40.66 41.06 1rjv h LEU 106 CO 0.00 -0.14 -0.90 1.33 -0.13 0.00 0.00 178.44 178.60 1rjv n VAL 107 N -4.74 0.23 0.13 1.05 0.24 -1.25 -3.86 118.33 110.13 1rjv n VAL 107 Ca 0.34 -0.26 0.00 0.00 -2.04 0.00 0.00 64.34 62.39 1rjv n VAL 107 Cb 1.28 0.09 0.11 0.00 -1.47 0.00 0.00 33.84 33.84 1rjv n VAL 107 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1rjv h ALA 108 N 2.52 0.75 0.00 2.33 0.00 -1.16 -2.16 119.26 121.54 1rjv h ALA 108 Ca 0.00 -0.56 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1rjv h ALA 108 Cb 0.74 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1rjv h ALA 108 CO 0.00 0.77 0.13 0.93 0.00 0.00 0.00 179.25 181.09 1rjv h GLU 109 N 0.00 0.00 0.00 0.00 5.08 -1.52 -3.52 114.58 114.62 1rjv h GLU 109 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1rjv h GLU 109 Cb 1.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.53 1rjv h GLU 109 CO 0.08 0.00 0.00 0.45 -1.00 0.00 0.00 179.01 178.54