#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 -2.93 6.12 7.64 -1.26 -4.86 113.62 118.33 1rjv n SER 2 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1rjv n SER 2 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1rjv n SER 2 CO 0.00 0.00 0.00 1.15 -3.01 0.00 0.00 175.04 173.18 1rjv n MET 3 N -1.24 0.00 0.05 1.43 3.85 -1.26 -1.46 117.12 118.49 1rjv n MET 3 Ca 0.00 -0.24 0.00 0.00 -1.00 0.00 0.00 57.70 56.46 1rjv n MET 3 Cb 0.00 -1.57 0.00 0.00 -1.05 0.00 0.00 33.22 30.60 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 3.74 0.00 -0.07 3.17 -1.04 -1.26 -4.73 114.28 114.10 1rjv n THR 4 Ca 0.00 0.00 -0.11 0.00 -2.04 0.00 0.00 64.05 61.90 1rjv n THR 4 Cb 0.00 0.00 -0.06 0.00 -1.82 0.00 0.00 70.33 68.45 1rjv n THR 4 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 1rjv n ASP 5 N -2.78 2.28 0.14 8.00 -0.08 -0.64 -1.16 116.55 122.31 1rjv n ASP 5 Ca 0.00 0.01 -0.13 0.00 -1.51 0.00 0.00 54.79 53.16 1rjv n ASP 5 Cb 0.00 -0.28 -0.08 0.00 2.34 0.00 0.00 41.12 43.10 1rjv n ASP 5 CO 0.00 0.00 0.00 -0.07 0.12 0.00 0.00 177.20 177.25 1rjv h LEU 6 N -0.18 -0.32 0.00 -2.67 -0.00 -1.58 -3.40 115.31 107.16 1rjv h LEU 6 Ca -0.32 -0.20 0.00 0.00 -0.00 0.00 0.00 57.88 57.36 1rjv h LEU 6 Cb 1.41 0.08 0.00 0.00 -0.00 0.00 0.00 40.66 42.15 1rjv h LEU 6 CO -0.11 0.06 0.00 0.18 -0.00 0.00 0.00 178.44 178.58 1rjv n LEU 7 N -5.10 0.28 0.00 1.67 7.99 -1.25 -5.06 117.00 115.54 1rjv n LEU 7 Ca -0.09 0.02 0.00 0.00 -0.01 0.00 0.00 56.01 55.93 1rjv n LEU 7 Cb 0.26 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.57 1rjv n LEU 7 CO 0.30 0.00 0.00 0.59 -1.51 0.00 0.00 177.39 176.77 1rjv n ASN 8 N -0.07 0.00 -0.32 -1.43 3.02 -1.22 -4.95 115.26 110.29 1rjv n ASN 8 Ca 0.00 0.00 0.11 0.00 -0.03 0.00 0.00 54.58 54.66 1rjv n ASN 8 Cb 0.00 0.00 0.33 0.00 -0.61 0.00 0.00 39.78 39.50 1rjv n ASN 8 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1rjv h ALA 9 N 0.00 1.71 0.06 5.41 0.00 -1.43 -0.77 119.26 124.24 1rjv h ALA 9 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1rjv h ALA 9 Cb 0.00 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1rjv h ALA 9 CO 0.00 0.01 -0.07 0.93 0.00 0.00 0.00 179.25 180.11 1rjv h GLU 10 N 0.80 -0.15 -0.21 0.00 5.08 -1.98 0.78 114.58 118.90 1rjv h GLU 10 Ca 0.50 0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.86 1rjv h GLU 10 Cb 0.71 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.99 1rjv h GLU 10 CO -0.26 -0.10 0.11 -0.44 -1.00 0.00 0.00 179.01 177.32 1rjv h ASP 11 N -0.16 0.26 -0.71 1.42 5.19 -1.73 -1.87 116.42 118.83 1rjv h ASP 11 Ca 0.01 -0.09 0.11 0.00 -0.62 0.00 0.00 57.03 56.44 1rjv h ASP 11 Cb 0.16 -0.07 -0.08 0.00 0.18 0.00 0.00 39.33 39.52 1rjv h ASP 11 CO -0.03 0.28 0.31 0.40 -3.12 0.00 0.00 179.24 177.08 1rjv h ILE 12 N 0.23 0.76 -0.18 0.35 5.03 -1.05 0.59 117.51 123.24 1rjv h ILE 12 Ca 0.07 -0.18 0.02 0.00 -0.12 0.00 0.00 64.86 64.66 1rjv h ILE 12 Cb 0.07 0.21 -0.02 0.00 -3.03 0.00 0.00 36.82 34.05 1rjv h ILE 12 CO -0.01 0.09 0.04 0.50 -0.68 0.00 0.00 178.15 178.10 1rjv h LYS 13 N 0.51 0.12 -0.50 2.37 1.63 -0.37 -0.10 116.57 120.22 1rjv h LYS 13 Ca 0.37 -0.01 -0.05 0.00 -0.85 0.00 0.00 60.65 60.11 1rjv h LYS 13 Cb 0.46 -0.03 -0.02 0.00 -0.60 0.00 0.00 32.23 32.04 1rjv h LYS 13 CO -0.32 0.08 0.13 0.87 -3.45 0.00 0.00 179.45 176.75 1rjv h LYS 14 N 0.12 0.76 0.76 1.90 1.79 -0.95 -2.68 116.57 118.27 1rjv h LYS 14 Ca 0.08 -0.15 -0.04 0.00 -2.18 0.00 0.00 60.65 58.37 1rjv h LYS 14 Cb 0.07 -0.12 0.00 0.00 -1.58 0.00 0.00 32.23 30.60 1rjv h LYS 14 CO -0.10 0.69 -0.41 0.00 -1.08 0.00 0.00 179.45 178.55 1rjv h ALA 15 N 1.40 -1.26 -0.59 3.86 0.00 -0.24 -2.57 119.26 119.86 1rjv h ALA 15 Ca 0.17 -0.23 0.05 0.00 0.00 0.00 0.00 54.91 54.90 1rjv h ALA 15 Cb 0.27 0.48 -0.03 0.00 0.00 0.00 0.00 17.79 18.51 1rjv h ALA 15 CO -0.00 -1.20 0.39 0.28 0.00 0.00 0.00 179.25 178.71 1rjv h VAL 16 N -1.08 1.02 -0.08 0.00 2.07 -1.08 0.11 116.25 117.22 1rjv h VAL 16 Ca -0.10 -0.21 0.02 0.00 0.82 0.00 0.00 66.70 67.23 1rjv h VAL 16 Cb 0.84 0.37 -0.00 0.00 -1.52 0.00 0.00 31.29 30.98 1rjv h VAL 16 CO 0.14 0.11 0.06 1.23 0.02 0.00 0.00 177.57 179.13 1rjv h GLY 17 N 0.60 0.00 2.00 2.17 0.00 -1.36 -0.62 103.07 105.87 1rjv h GLY 17 Ca 0.25 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 47.43 1rjv h GLY 17 CO -0.07 0.00 -0.71 0.00 0.00 0.00 0.00 176.54 175.76 1rjv h ALA 18 N 1.95 0.55 -0.01 3.60 0.00 -0.35 -3.22 119.26 121.77 1rjv h ALA 18 Ca 0.04 -0.64 0.00 0.00 0.00 0.00 0.00 54.91 54.31 1rjv h ALA 18 Cb 0.16 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1rjv h ALA 18 CO -0.00 0.88 -0.48 1.19 0.00 0.00 0.00 179.25 180.84 1rjv n PHE 19 N -3.29 0.00 -0.41 0.00 3.01 -1.08 -4.51 117.46 111.18 1rjv n PHE 19 Ca 0.01 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.34 1rjv n PHE 19 Cb 0.81 -0.01 -0.01 0.00 -0.01 0.00 0.00 39.48 40.26 1rjv n PHE 19 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1rjv n SER 20 N -0.14 2.71 -1.18 4.37 2.88 -0.26 -4.68 113.62 117.31 1rjv n SER 20 Ca 0.09 -2.18 -0.01 0.00 -1.33 0.00 0.00 58.87 55.44 1rjv n SER 20 Cb 0.45 -0.83 -0.00 0.00 -0.75 0.00 0.00 64.21 63.08 1rjv n SER 20 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1rjv n ALA 21 N 4.63 -0.06 -0.49 -1.46 0.00 -1.26 -5.03 120.51 116.84 1rjv n ALA 21 Ca 0.25 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.55 1rjv n ALA 21 Cb 0.08 0.12 0.00 0.00 0.00 0.00 0.00 19.45 19.64 1rjv n ALA 21 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1rjv n THR 22 N -0.05 0.00 -1.78 0.00 -2.24 -1.26 -4.71 114.28 104.23 1rjv n THR 22 Ca -0.00 0.31 0.03 0.00 -2.27 0.00 0.00 64.05 62.12 1rjv n THR 22 Cb 0.05 -0.85 0.05 0.00 -2.10 0.00 0.00 70.33 67.49 1rjv n THR 22 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1rjv n ASP 23 N -1.27 0.82 0.27 3.42 5.68 -1.26 -0.91 116.55 123.31 1rjv n ASP 23 Ca 0.00 -2.39 -0.17 0.00 -0.50 0.00 0.00 54.79 51.73 1rjv n ASP 23 Cb 0.00 -0.29 -0.09 0.00 -1.14 0.00 0.00 41.12 39.61 1rjv n ASP 23 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 1rjv h SER 24 N 0.15 -1.14 -2.29 -1.12 0.02 -1.92 -3.42 113.55 103.84 1rjv h SER 24 Ca -0.02 0.09 0.00 0.00 -0.84 0.00 0.00 61.79 61.02 1rjv h SER 24 Cb 1.33 0.37 0.00 0.00 0.14 0.00 0.00 62.40 64.24 1rjv h SER 24 CO 0.01 -0.59 -0.15 0.33 -1.14 0.00 0.00 176.83 175.30 1rjv n PHE 25 N -5.52 -0.69 -2.72 3.45 7.35 -1.26 -5.05 117.46 113.02 1rjv n PHE 25 Ca -0.11 0.37 -0.08 0.00 -0.76 0.00 0.00 57.45 56.87 1rjv n PHE 25 Cb 0.41 -0.76 0.09 0.00 0.35 0.00 0.00 39.48 39.58 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 -1.56 -1.31 -0.32 -2.13 -0.08 -1.26 -5.01 116.55 104.88 1rjv n ASP 26 Ca 0.00 -2.73 0.17 0.00 -1.51 0.00 0.00 54.79 50.73 1rjv n ASP 26 Cb 0.04 0.84 0.36 0.00 2.34 0.00 0.00 41.12 44.70 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 2.37 0.38 -0.03 -0.67 2.07 -1.96 0.28 115.15 117.59 1rjv h HIS 27 Ca -0.20 0.05 0.01 0.00 -2.85 0.00 0.00 60.37 57.37 1rjv h HIS 27 Cb 1.23 -0.01 -0.01 0.00 2.57 0.00 0.00 27.41 31.19 1rjv h HIS 27 CO 0.24 -0.31 -0.11 0.87 -3.07 0.00 0.00 177.93 175.55 1rjv h LYS 28 N 0.13 -0.11 -0.14 5.12 6.56 -1.88 -1.58 116.57 124.68 1rjv h LYS 28 Ca 0.63 0.01 -0.12 0.00 -1.06 0.00 0.00 60.65 60.10 1rjv h LYS 28 Cb 1.38 0.03 -0.01 0.00 -0.57 0.00 0.00 32.23 33.05 1rjv h LYS 28 CO -0.74 -0.07 -0.46 0.87 -2.06 0.00 0.00 179.45 176.99 1rjv h LYS 29 N -0.12 0.33 0.30 3.15 1.57 -1.53 -2.99 116.57 117.30 1rjv h LYS 29 Ca 0.01 -0.18 0.00 0.00 -1.87 0.00 0.00 60.65 58.61 1rjv h LYS 29 Cb 0.14 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.42 1rjv h LYS 29 CO -0.09 0.73 -0.41 0.35 -0.57 0.00 0.00 179.45 179.46 1rjv h PHE 30 N 0.27 -1.14 -0.22 -1.35 3.04 -0.50 0.27 116.94 117.31 1rjv h PHE 30 Ca 0.02 0.02 0.06 0.00 3.98 0.00 0.00 57.97 62.05 1rjv h PHE 30 Cb 0.91 0.46 -0.01 0.00 2.56 0.00 0.00 35.95 39.87 1rjv h PHE 30 CO 0.02 -0.55 0.17 0.74 -2.02 0.00 0.00 178.31 176.67 1rjv h PHE 31 N -0.77 0.00 0.06 0.41 -1.00 -1.26 0.88 116.94 115.25 1rjv h PHE 31 Ca -0.02 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.76 1rjv h PHE 31 Cb 0.72 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.28 1rjv h PHE 31 CO -0.27 0.00 -0.03 1.96 -1.61 0.00 0.00 178.31 178.36 1rjv h GLN 32 N 0.00 -0.08 -0.56 1.51 4.20 -1.27 -0.89 115.11 118.02 1rjv h GLN 32 Ca 0.10 0.01 0.02 0.00 0.06 0.00 0.00 58.65 58.84 1rjv h GLN 32 Cb 0.44 0.02 -0.04 0.00 0.30 0.00 0.00 27.48 28.20 1rjv h GLN 32 CO -0.00 0.50 0.34 0.52 -0.67 0.00 0.00 178.83 179.53 1rjv h MET 33 N -0.90 0.66 0.00 1.46 2.86 -0.08 -1.25 114.93 117.69 1rjv h MET 33 Ca -0.01 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.59 1rjv h MET 33 Cb 0.62 -0.15 0.00 0.00 0.06 0.00 0.00 31.60 32.13 1rjv h MET 33 CO 0.01 0.44 0.00 1.55 1.06 0.00 0.00 176.91 179.97 1rjv n VAL 34 N -4.76 0.86 -1.21 -2.22 3.14 0.27 -4.59 118.33 109.81 1rjv n VAL 34 Ca 0.05 0.21 -0.07 0.00 -2.96 0.00 0.00 64.34 61.56 1rjv n VAL 34 Cb 0.08 -1.06 -0.03 0.00 -1.06 0.00 0.00 33.84 31.77 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 0.10 0.90 0.45 7.55 0.00 -0.47 -4.55 105.19 109.17 1rjv n GLY 35 Ca 0.03 -0.34 -0.18 0.00 0.00 0.00 0.00 46.02 45.53 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 -1.14 -1.69 0.99 3.38 -1.42 0.10 115.31 115.53 1rjv h LEU 36 Ca -0.15 0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1rjv h LEU 36 Cb 0.66 0.36 0.00 0.00 0.09 0.00 0.00 40.66 41.78 1rjv h LEU 36 CO 0.22 -0.62 0.43 0.11 0.09 0.00 0.00 178.44 178.67 1rjv h LYS 37 N -0.95 0.00 0.00 1.13 1.57 -1.89 -0.55 116.57 115.88 1rjv h LYS 37 Ca -0.06 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.65 1rjv h LYS 37 Cb 0.81 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.10 1rjv h LYS 37 CO -0.01 0.00 -1.01 -0.22 -0.57 0.00 0.00 179.45 177.64 1rjv h LYS 38 N 0.00 0.00 -7.50 3.15 3.64 -1.11 -3.47 116.57 111.28 1rjv h LYS 38 Ca 0.00 0.00 -0.46 0.00 -1.27 0.00 0.00 60.65 58.92 1rjv h LYS 38 Cb 0.85 0.00 0.09 0.00 -0.41 0.00 0.00 32.23 32.77 1rjv h LYS 38 CO 0.00 0.15 0.34 0.15 -2.27 0.00 0.00 179.45 177.82 1rjv s LYS 39 N -3.15 2.00 0.76 1.90 -0.14 -0.21 -5.09 119.74 115.81 1rjv s LYS 39 Ca -0.00 -0.07 -0.11 0.00 -1.36 0.00 0.00 55.97 54.44 1rjv s LYS 39 Cb 0.09 -2.04 0.05 0.00 -1.68 0.00 0.00 37.83 34.25 1rjv s LYS 39 CO 0.78 -1.49 1.09 -1.12 -0.76 0.00 0.00 175.35 173.85 1rjv s SER 40 N -4.57 4.61 0.30 2.83 0.01 -1.26 -4.88 113.70 110.74 1rjv s SER 40 Ca 0.62 1.79 0.04 0.00 1.31 0.00 0.00 55.95 59.71 1rjv s SER 40 Cb -0.11 -2.51 0.67 0.00 0.21 0.00 0.00 66.02 64.28 1rjv s SER 40 CO 0.47 -1.96 1.80 0.00 0.41 0.00 0.00 173.24 173.96 1rjv h ALA 41 N -1.08 1.61 -0.06 1.44 0.00 -1.97 -0.52 119.26 118.69 1rjv h ALA 41 Ca -0.44 0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.55 1rjv h ALA 41 Cb 1.23 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 1rjv h ALA 41 CO 0.52 0.06 0.06 -0.44 0.00 0.00 0.00 179.25 179.45 1rjv h ASP 42 N 0.86 0.00 0.07 0.00 5.19 -1.99 0.13 116.42 120.67 1rjv h ASP 42 Ca 0.55 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.95 1rjv h ASP 42 Cb 0.74 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.25 1rjv h ASP 42 CO -0.34 0.00 -0.03 -0.78 -3.12 0.00 0.00 179.24 174.97 1rjv h ASP 43 N 0.00 -0.08 -1.00 6.45 1.82 -1.47 -3.28 116.42 118.85 1rjv h ASP 43 Ca 0.03 -0.27 0.21 0.00 -0.39 0.00 0.00 57.03 56.61 1rjv h ASP 43 Cb 0.14 0.02 -0.11 0.00 0.68 0.00 0.00 39.33 40.05 1rjv h ASP 43 CO -0.00 0.53 0.61 0.58 -1.61 0.00 0.00 179.24 179.35 1rjv h VAL 44 N -1.00 0.65 -0.67 2.25 2.07 -0.99 0.25 116.25 118.81 1rjv h VAL 44 Ca -0.01 -0.24 0.11 0.00 0.82 0.00 0.00 66.70 67.38 1rjv h VAL 44 Cb 0.34 -0.12 -0.12 0.00 -1.52 0.00 0.00 31.29 29.87 1rjv h VAL 44 CO 0.02 0.13 -0.38 0.50 0.02 0.00 0.00 177.57 177.85 1rjv h LYS 45 N 0.70 -0.15 -0.03 1.57 3.64 -0.90 -2.30 116.57 119.11 1rjv h LYS 45 Ca 0.60 0.01 -0.15 0.00 -1.27 0.00 0.00 60.65 59.84 1rjv h LYS 45 Cb 1.01 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.85 1rjv h LYS 45 CO -0.41 -0.10 -0.67 1.57 -2.27 0.00 0.00 179.45 177.57 1rjv h LYS 46 N -0.15 0.15 0.45 1.90 2.10 -0.66 -3.02 116.57 117.34 1rjv h LYS 46 Ca 0.23 -0.12 -0.02 0.00 -2.00 0.00 0.00 60.65 58.74 1rjv h LYS 46 Cb 0.56 0.02 0.00 0.00 -0.90 0.00 0.00 32.23 31.92 1rjv h LYS 46 CO -0.74 0.76 -0.22 0.28 -2.00 0.00 0.00 179.45 177.54 1rjv h VAL 47 N 0.11 0.53 -0.81 0.07 2.07 -0.51 -1.79 116.25 115.91 1rjv h VAL 47 Ca -0.01 -0.31 0.16 0.00 0.82 0.00 0.00 66.70 67.36 1rjv h VAL 47 Cb 1.19 0.67 -0.10 0.00 -1.52 0.00 0.00 31.29 31.53 1rjv h VAL 47 CO 0.10 0.05 0.36 0.15 0.02 0.00 0.00 177.57 178.25 1rjv h PHE 48 N -0.79 0.62 -0.09 1.57 3.57 -1.56 -0.50 116.94 119.75 1rjv h PHE 48 Ca -0.06 0.04 0.03 0.00 3.53 0.00 0.00 57.97 61.50 1rjv h PHE 48 Cb 0.55 -0.15 -0.00 0.00 2.79 0.00 0.00 35.95 39.13 1rjv h PHE 48 CO -0.01 0.08 0.17 1.25 -2.23 0.00 0.00 178.31 177.57 1rjv h HIS 49 N 0.49 0.00 0.00 0.41 2.76 -1.29 -0.92 115.15 116.61 1rjv h HIS 49 Ca 0.46 0.00 -0.13 0.00 -2.20 0.00 0.00 60.37 58.49 1rjv h HIS 49 Cb 0.72 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.66 1rjv h HIS 49 CO -0.14 0.00 -0.93 1.98 -1.30 0.00 0.00 177.93 177.54 1rjv h MET 50 N 0.00 0.00 -0.14 5.26 1.85 -0.24 -3.34 114.93 118.31 1rjv h MET 50 Ca 0.04 0.00 -0.15 0.00 -0.61 0.00 0.00 59.70 58.98 1rjv h MET 50 Cb 0.38 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.41 1rjv h MET 50 CO -0.00 0.42 -0.49 -0.07 -0.40 0.00 0.00 176.91 176.36 1rjv h LEU 51 N 0.00 0.69 -7.09 3.39 3.38 -1.08 -3.37 115.31 111.23 1rjv h LEU 51 Ca -0.07 -0.61 -0.50 0.00 0.09 0.00 0.00 57.88 56.79 1rjv h LEU 51 Cb 1.48 -0.20 0.06 0.00 0.09 0.00 0.00 40.66 42.09 1rjv h LEU 51 CO 0.06 1.17 1.52 0.47 0.09 0.00 0.00 178.44 181.75 1rjv n ASP 52 N -4.20 1.97 0.11 -0.43 9.92 -0.84 -4.77 116.55 118.31 1rjv n ASP 52 Ca -0.07 -2.60 0.19 0.00 -0.53 0.00 0.00 54.79 51.78 1rjv n ASP 52 Cb 0.59 -1.09 0.76 0.00 -0.64 0.00 0.00 41.12 40.74 1rjv n ASP 52 CO 0.00 0.00 0.00 0.07 0.13 0.00 0.00 177.20 177.40 1rjv h LYS 53 N 9.34 0.00 -0.01 -1.24 2.10 -1.83 0.51 116.57 125.44 1rjv h LYS 53 Ca 0.29 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.94 1rjv h LYS 53 Cb 0.76 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.09 1rjv h LYS 53 CO 1.75 0.00 -0.34 -0.40 -2.00 0.00 0.00 179.45 178.46 1rjv n ASP 54 N -3.83 1.11 -3.49 7.07 5.75 -1.26 -4.99 116.55 116.90 1rjv n ASP 54 Ca 0.06 -0.91 -0.25 0.00 -0.01 0.00 0.00 54.79 53.68 1rjv n ASP 54 Cb 0.53 0.23 0.00 0.00 -1.03 0.00 0.00 41.12 40.85 1rjv n ASP 54 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1rjv n LYS 55 N -0.69 -3.95 0.08 0.11 4.76 0.17 -4.90 118.16 113.73 1rjv n LYS 55 Ca 0.11 0.54 -0.02 0.00 -2.87 0.00 0.00 58.31 56.07 1rjv n LYS 55 Cb 0.36 -5.31 0.25 0.00 -1.84 0.00 0.00 35.03 28.50 1rjv n LYS 55 CO 0.00 0.00 0.00 0.77 -1.37 0.00 0.00 177.40 176.80 1rjv h SER 56 N -1.27 0.31 0.00 4.39 0.02 -1.95 -3.47 113.55 111.58 1rjv h SER 56 Ca -0.48 -0.11 0.00 0.00 -0.84 0.00 0.00 61.79 60.36 1rjv h SER 56 Cb 1.32 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.78 1rjv h SER 56 CO 0.58 0.61 0.00 0.61 -1.14 0.00 0.00 176.83 177.50 1rjv n GLY 57 N -0.38 0.62 3.31 -3.77 0.00 -1.26 -5.07 105.19 98.64 1rjv n GLY 57 Ca -0.01 -0.72 -0.07 0.00 0.00 0.00 0.00 46.02 45.22 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 -2.00 -0.92 -0.16 1.61 0.08 -1.26 -4.84 117.98 110.48 1rjv s PHE 58 Ca 0.00 1.64 -0.22 0.00 0.12 0.00 0.00 56.93 58.47 1rjv s PHE 58 Cb 0.00 0.39 -0.02 0.00 -0.57 0.00 0.00 43.02 42.81 1rjv s PHE 58 CO 0.00 -0.54 0.69 0.42 -0.10 0.00 0.00 175.22 175.69 1rjv s ILE 59 N 2.67 5.00 0.35 0.64 1.01 -1.00 -4.93 121.20 124.93 1rjv s ILE 59 Ca -0.01 1.34 0.03 0.00 0.00 0.00 0.00 60.65 62.01 1rjv s ILE 59 Cb -0.12 -4.01 -0.04 0.00 0.01 0.00 0.00 42.46 38.30 1rjv s ILE 59 CO -0.14 0.12 0.10 -1.83 0.00 0.00 0.00 174.94 173.18 1rjv s GLU 60 N 1.73 1.74 0.39 2.79 -1.05 -1.26 -2.14 118.70 120.90 1rjv s GLU 60 Ca 0.33 -2.01 0.20 0.00 -0.15 0.00 0.00 54.97 53.33 1rjv s GLU 60 Cb -0.16 -0.66 1.16 0.00 -0.44 0.00 0.00 34.13 34.03 1rjv s GLU 60 CO 0.12 -0.33 1.71 1.05 0.95 0.00 0.00 175.26 178.76 1rjv h GLU 61 N 2.01 0.31 0.01 -4.83 -0.00 -1.97 -0.02 114.58 110.09 1rjv h GLU 61 Ca -0.38 -0.02 0.03 0.00 -0.00 0.00 0.00 59.36 58.99 1rjv h GLU 61 Cb 1.26 -0.07 -0.05 0.00 -0.00 0.00 0.00 28.75 29.88 1rjv h GLU 61 CO 0.63 0.20 -0.44 0.22 -0.00 0.00 0.00 179.01 179.62 1rjv h ASP 62 N 0.32 -1.33 0.35 3.06 1.82 -2.01 -2.35 116.42 116.29 1rjv h ASP 62 Ca 0.69 0.16 -0.22 0.00 -0.39 0.00 0.00 57.03 57.26 1rjv h ASP 62 Cb 1.79 0.51 0.00 0.00 0.68 0.00 0.00 39.33 42.31 1rjv h ASP 62 CO -0.41 -0.47 -0.91 -0.33 -1.61 0.00 0.00 179.24 175.50 1rjv h GLU 63 N -0.60 0.39 -1.03 0.28 3.07 -1.50 -3.31 114.58 111.88 1rjv h GLU 63 Ca 0.04 -0.41 0.26 0.00 -0.50 0.00 0.00 59.36 58.75 1rjv h GLU 63 Cb 0.67 0.11 -0.09 0.00 -0.84 0.00 0.00 28.75 28.60 1rjv h GLU 63 CO -0.32 1.08 0.66 1.25 -1.40 0.00 0.00 179.01 180.28 1rjv h LEU 64 N 0.22 0.46 -2.10 1.33 5.85 -0.82 0.12 115.31 120.37 1rjv h LEU 64 Ca -0.07 0.08 0.08 0.00 0.84 0.00 0.00 57.88 58.82 1rjv h LEU 64 Cb 1.54 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 42.57 1rjv h LEU 64 CO 0.16 0.10 0.26 1.23 -0.34 0.00 0.00 178.44 179.85 1rjv h GLY 65 N 0.42 0.00 -2.67 3.75 0.00 -1.51 -3.34 103.07 99.71 1rjv h GLY 65 Ca 0.58 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 47.76 1rjv h GLY 65 CO -0.29 0.00 -0.49 1.97 0.00 0.00 0.00 176.54 177.72 1rjv n PHE 66 N -4.06 -0.17 -0.48 5.60 -1.74 -0.08 -0.54 117.46 116.00 1rjv n PHE 66 Ca 0.04 -0.69 0.39 0.00 -0.56 0.00 0.00 57.45 56.64 1rjv n PHE 66 Cb 0.42 0.43 0.71 0.00 1.52 0.00 0.00 39.48 42.55 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 5.39 0.20 -0.60 1.97 -0.00 -0.99 0.41 117.51 123.88 1rjv h ILE 67 Ca -0.46 -0.03 0.18 0.00 -0.00 0.00 0.00 64.86 64.55 1rjv h ILE 67 Cb 1.51 0.11 -0.02 0.00 -0.00 0.00 0.00 36.82 38.42 1rjv h ILE 67 CO -0.17 0.01 0.56 -0.07 -0.00 0.00 0.00 178.15 178.48 1rjv h LEU 68 N 0.08 0.00 -2.35 2.19 3.38 -1.87 -0.81 115.31 115.93 1rjv h LEU 68 Ca 0.77 0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.77 1rjv h LEU 68 Cb 2.72 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 43.46 1rjv h LEU 68 CO -0.20 0.00 0.09 0.11 0.09 0.00 0.00 178.44 178.53 1rjv h LYS 69 N 0.00 0.00 -0.01 1.13 1.57 -1.05 0.18 116.57 118.39 1rjv h LYS 69 Ca 0.29 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.07 1rjv h LYS 69 Cb 1.40 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.71 1rjv h LYS 69 CO -0.00 0.00 -0.28 0.41 -0.57 0.00 0.00 179.45 179.01 1rjv n GLY 70 N -1.36 -0.84 0.11 3.86 0.00 -0.31 -3.93 105.19 102.72 1rjv n GLY 70 Ca -0.01 -0.36 -0.13 0.00 0.00 0.00 0.00 46.02 45.53 1rjv n GLY 70 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1rjv n PHE 71 N -0.92 0.27 0.00 1.61 3.72 0.43 -4.42 117.46 118.16 1rjv n PHE 71 Ca 0.11 0.08 0.00 0.00 -0.05 0.00 0.00 57.45 57.59 1rjv n PHE 71 Cb 0.33 -1.04 0.00 0.00 -0.94 0.00 0.00 39.48 37.83 1rjv n PHE 71 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1rjv n SER 72 N -2.99 0.00 -4.51 4.37 2.88 -0.08 -4.85 113.62 108.44 1rjv n SER 72 Ca -0.34 0.00 -0.28 0.00 -1.33 0.00 0.00 58.87 56.92 1rjv n SER 72 Cb 1.09 0.00 0.24 0.00 -0.75 0.00 0.00 64.21 64.79 1rjv n SER 72 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 1rjv s PRO 73 N -2.00 -0.76 -1.88 -1.46 0.04 -1.26 -3.70 135.00 123.97 1rjv s PRO 73 Ca 0.00 0.70 0.00 0.00 0.04 0.00 0.00 61.00 61.74 1rjv s PRO 73 Cb 0.00 -1.58 0.00 0.00 0.04 0.00 0.00 34.50 32.96 1rjv s PRO 73 CO 0.00 -3.58 0.00 -3.47 0.04 0.00 0.00 177.00 169.99 1rjv n ASP 74 N -4.80 -5.37 -0.00 6.66 -0.08 -1.26 -4.96 116.55 106.75 1rjv n ASP 74 Ca 0.03 0.30 -0.09 0.00 -1.51 0.00 0.00 54.79 53.52 1rjv n ASP 74 Cb 0.55 -4.50 -0.03 0.00 2.34 0.00 0.00 41.12 39.49 1rjv n ASP 74 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1rjv h ALA 75 N 0.32 -0.13 -1.91 -1.67 0.00 -1.85 -3.50 119.26 110.52 1rjv h ALA 75 Ca -0.41 0.05 0.21 0.00 0.00 0.00 0.00 54.91 54.76 1rjv h ALA 75 Cb 1.28 0.38 -0.08 0.00 0.00 0.00 0.00 17.79 19.37 1rjv h ALA 75 CO 0.56 -0.65 -0.48 0.54 0.00 0.00 0.00 179.25 179.22 1rjv n ARG 76 N -5.33 -1.77 -2.51 0.00 1.74 -1.26 -4.81 116.66 102.72 1rjv n ARG 76 Ca -0.03 1.30 -0.43 0.00 -0.77 0.00 0.00 57.85 57.92 1rjv n ARG 76 Cb 0.25 -2.12 -0.02 0.00 -1.02 0.00 0.00 32.46 29.55 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 -6.05 6.77 0.60 0.55 -4.77 -1.26 -4.48 116.67 108.02 1rjv s ASP 77 Ca 0.00 1.12 -0.19 0.00 -3.30 0.00 0.00 52.55 50.19 1rjv s ASP 77 Cb 0.00 -2.54 -0.03 0.00 -1.09 0.00 0.00 42.92 39.25 1rjv s ASP 77 CO 0.00 -1.01 1.21 -0.76 0.70 0.00 0.00 175.17 175.31 1rjv s LEU 78 N 4.11 3.66 0.68 2.11 1.43 0.29 -4.94 118.68 126.02 1rjv s LEU 78 Ca 0.52 2.41 -0.16 0.00 -1.03 0.00 0.00 54.13 55.87 1rjv s LEU 78 Cb -0.15 -4.60 0.01 0.00 0.03 0.00 0.00 46.19 41.49 1rjv s LEU 78 CO 0.21 -1.62 1.17 -0.55 0.23 0.00 0.00 176.35 175.79 1rjv s SER 79 N -1.58 4.70 0.50 2.29 0.15 -0.09 -4.82 113.70 114.86 1rjv s SER 79 Ca 0.78 2.23 0.17 0.00 0.70 0.00 0.00 55.95 59.82 1rjv s SER 79 Cb -0.31 -2.58 1.22 0.00 -1.71 0.00 0.00 66.02 62.65 1rjv s SER 79 CO 0.33 -1.92 2.09 0.00 1.20 0.00 0.00 173.24 174.95 1rjv h ALA 80 N 0.03 2.07 -0.14 5.45 0.00 -1.96 0.25 119.26 124.97 1rjv h ALA 80 Ca -0.48 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.27 1rjv h ALA 80 Cb 1.28 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.04 1rjv h ALA 80 CO 0.52 -0.11 -0.59 0.87 0.00 0.00 0.00 179.25 179.94 1rjv h LYS 81 N 0.11 0.44 0.57 0.00 1.57 -1.92 -1.99 116.57 115.35 1rjv h LYS 81 Ca 0.10 -0.29 -0.03 0.00 -1.87 0.00 0.00 60.65 58.55 1rjv h LYS 81 Cb 0.25 0.04 0.01 0.00 0.08 0.00 0.00 32.23 32.60 1rjv h LYS 81 CO -0.01 0.90 -0.27 1.49 -0.57 0.00 0.00 179.45 180.99 1rjv h GLU 82 N 0.33 -0.74 -0.77 3.15 4.81 -1.41 -2.64 114.58 117.31 1rjv h GLU 82 Ca -0.00 0.05 0.11 0.00 -0.13 0.00 0.00 59.36 59.39 1rjv h GLU 82 Cb 1.12 0.17 -0.08 0.00 0.63 0.00 0.00 28.75 30.59 1rjv h GLU 82 CO 0.10 -0.43 0.38 1.79 -0.73 0.00 0.00 179.01 180.13 1rjv h THR 83 N -1.01 0.79 -0.02 0.32 1.35 -1.05 0.37 112.91 113.67 1rjv h THR 83 Ca -0.08 -0.21 0.03 0.00 -0.55 0.00 0.00 66.41 65.60 1rjv h THR 83 Cb 0.65 0.13 -0.06 0.00 -1.73 0.00 0.00 68.15 67.15 1rjv h THR 83 CO 0.13 0.11 -0.40 0.50 -0.25 0.00 0.00 175.52 175.61 1rjv h LYS 84 N 0.61 -0.52 -0.26 4.72 3.64 -1.39 0.23 116.57 123.60 1rjv h LYS 84 Ca 0.40 0.04 -0.13 0.00 -1.27 0.00 0.00 60.65 59.68 1rjv h LYS 84 Cb 0.48 0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 32.42 1rjv h LYS 84 CO -0.31 -0.35 -0.35 0.52 -2.27 0.00 0.00 179.45 176.69 1rjv h MET 85 N -0.54 0.70 -0.79 1.90 2.86 -0.98 -3.15 114.93 114.92 1rjv h MET 85 Ca 0.05 -0.40 0.07 0.00 -2.06 0.00 0.00 59.70 57.37 1rjv h MET 85 Cb 0.63 0.03 -0.06 0.00 0.06 0.00 0.00 31.60 32.26 1rjv h MET 85 CO -0.32 1.02 0.46 1.25 1.06 0.00 0.00 176.91 180.38 1rjv h LEU 86 N 0.43 0.70 0.50 1.22 6.46 -0.21 0.28 115.31 124.68 1rjv h LEU 86 Ca 0.03 0.03 -0.02 0.00 -0.12 0.00 0.00 57.88 57.80 1rjv h LEU 86 Cb 0.93 -0.11 -0.01 0.00 -0.73 0.00 0.00 40.66 40.74 1rjv h LEU 86 CO 0.08 0.43 -0.41 -0.03 -0.62 0.00 0.00 178.44 177.89 1rjv h MET 87 N 0.82 -0.85 -0.38 1.25 4.05 -0.98 0.21 114.93 119.05 1rjv h MET 87 Ca 0.36 0.06 -0.03 0.00 -0.28 0.00 0.00 59.70 59.81 1rjv h MET 87 Cb 0.25 0.19 -0.02 0.00 -0.80 0.00 0.00 31.60 31.22 1rjv h MET 87 CO -0.20 -0.57 0.13 0.00 0.23 0.00 0.00 176.91 176.49 1rjv h ALA 88 N -1.16 0.50 -0.10 0.39 0.00 -1.44 -0.91 119.26 116.54 1rjv h ALA 88 Ca -0.07 -0.16 -0.18 0.00 0.00 0.00 0.00 54.91 54.50 1rjv h ALA 88 Cb 0.74 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 1rjv h ALA 88 CO 0.00 0.13 -0.70 0.00 0.00 0.00 0.00 179.25 178.68 1rjv h ALA 89 N 0.97 0.60 0.34 0.00 0.00 -0.52 -3.35 119.26 117.31 1rjv h ALA 89 Ca 0.12 -0.59 -0.02 0.00 0.00 0.00 0.00 54.91 54.43 1rjv h ALA 89 Cb 0.24 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1rjv h ALA 89 CO -0.01 0.75 -0.17 0.78 0.00 0.00 0.00 179.25 180.60 1rjv h GLY 90 N 1.21 -0.48 -5.80 0.00 0.00 -0.46 -3.29 103.07 94.24 1rjv h GLY 90 Ca -0.03 0.18 -0.64 0.00 0.00 0.00 0.00 47.33 46.84 1rjv h GLY 90 CO 0.12 -0.18 3.05 1.34 0.00 0.00 0.00 176.54 180.88 1rjv n ASP 91 N -5.13 4.84 0.24 0.19 2.03 -0.36 -4.69 116.55 113.68 1rjv n ASP 91 Ca -0.09 -2.67 0.17 0.00 0.52 0.00 0.00 54.79 52.71 1rjv n ASP 91 Cb 0.27 -1.44 0.80 0.00 -0.72 0.00 0.00 41.12 40.04 1rjv n ASP 91 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 1rjv h LYS 92 N 6.23 0.00 0.03 -0.67 1.57 -1.70 -3.08 116.57 118.96 1rjv h LYS 92 Ca 0.60 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 59.14 1rjv h LYS 92 Cb 0.50 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.79 1rjv h LYS 92 CO 1.82 0.00 -1.12 0.22 -0.57 0.00 0.00 179.45 179.80 1rjv h ASP 93 N 0.00 0.11 0.00 0.86 1.82 -1.92 -3.49 116.42 113.80 1rjv h ASP 93 Ca 0.00 -0.12 0.00 0.00 -0.39 0.00 0.00 57.03 56.52 1rjv h ASP 93 Cb 0.18 -0.04 0.00 0.00 0.68 0.00 0.00 39.33 40.16 1rjv h ASP 93 CO 0.00 1.10 0.00 0.61 -1.61 0.00 0.00 179.24 179.34 1rjv n GLY 94 N 1.42 0.94 0.27 -0.78 0.00 -1.17 -4.99 105.19 100.88 1rjv n GLY 94 Ca -0.04 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.09 1rjv n GLY 94 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1rjv h ASP 95 N 0.00 0.00 -0.02 1.61 3.32 -1.95 -3.47 116.42 115.92 1rjv h ASP 95 Ca 0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 1rjv h ASP 95 Cb 0.00 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.55 1rjv h ASP 95 CO 0.00 0.06 -0.01 0.61 -1.72 0.00 0.00 179.24 178.18 1rjv n GLY 96 N -1.22 0.47 3.03 2.75 0.00 -1.26 -5.06 105.19 103.89 1rjv n GLY 96 Ca -0.03 -0.20 -0.13 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.57 0.46 0.12 1.61 3.01 -1.26 -4.84 119.74 118.27 1rjv s LYS 97 Ca 0.00 -0.63 -0.31 0.00 -1.01 0.00 0.00 55.97 54.02 1rjv s LYS 97 Cb 0.00 -0.23 -0.09 0.00 -1.01 0.00 0.00 37.83 36.50 1rjv s LYS 97 CO 0.00 0.04 1.66 0.42 0.51 0.00 0.00 175.35 177.98 1rjv s ILE 98 N -1.17 2.75 0.08 2.17 1.01 -0.91 -4.54 121.20 120.59 1rjv s ILE 98 Ca -0.09 0.37 0.04 0.00 0.00 0.00 0.00 60.65 60.97 1rjv s ILE 98 Cb -0.09 -3.24 -0.04 0.00 0.01 0.00 0.00 42.46 39.11 1rjv s ILE 98 CO 0.00 0.01 0.01 -0.83 0.00 0.00 0.00 174.94 174.14 1rjv s GLY 99 N 1.97 1.94 0.24 6.18 0.00 -1.26 -2.38 107.32 114.01 1rjv s GLY 99 Ca 0.74 -1.08 -0.05 0.00 0.00 0.00 0.00 44.72 44.33 1rjv s GLY 99 CO 0.33 -1.06 1.78 -0.24 0.00 0.00 0.00 173.10 173.91 1rjv h VAL 100 N 2.86 0.82 -0.63 1.40 3.04 -1.94 0.35 116.25 122.14 1rjv h VAL 100 Ca -0.48 -0.22 -0.05 0.00 -1.01 0.00 0.00 66.70 64.94 1rjv h VAL 100 Cb 1.16 0.12 -0.03 0.00 -2.01 0.00 0.00 31.29 30.54 1rjv h VAL 100 CO 0.61 0.12 0.19 -0.78 -1.01 0.00 0.00 177.57 176.70 1rjv h ASP 101 N 0.64 0.93 0.81 3.17 3.58 -1.97 0.12 116.42 123.69 1rjv h ASP 101 Ca 0.40 -0.21 -0.04 0.00 0.42 0.00 0.00 57.03 57.59 1rjv h ASP 101 Cb 0.46 -0.24 0.01 0.00 1.72 0.00 0.00 39.33 41.27 1rjv h ASP 101 CO -0.30 0.89 -0.39 -0.33 -2.88 0.00 0.00 179.24 176.23 1rjv h GLU 102 N 0.91 -1.05 -0.95 0.28 3.07 -1.90 -3.28 114.58 111.66 1rjv h GLU 102 Ca 0.20 0.07 0.20 0.00 -0.50 0.00 0.00 59.36 59.34 1rjv h GLU 102 Cb 0.30 0.24 -0.08 0.00 -0.84 0.00 0.00 28.75 28.37 1rjv h GLU 102 CO -0.01 -0.70 0.61 0.35 -1.40 0.00 0.00 179.01 177.86 1rjv h PHE 103 N -1.09 0.74 -0.80 4.33 3.57 -0.24 0.39 116.94 123.84 1rjv h PHE 103 Ca -0.11 0.02 0.10 0.00 3.53 0.00 0.00 57.97 61.52 1rjv h PHE 103 Cb 0.84 -0.22 -0.08 0.00 2.79 0.00 0.00 35.95 39.28 1rjv h PHE 103 CO 0.04 0.18 0.44 1.03 -2.23 0.00 0.00 178.31 177.76 1rjv h SER 104 N 0.54 0.60 0.00 0.41 0.87 -0.90 -3.29 113.55 111.77 1rjv h SER 104 Ca 0.51 0.06 -0.03 0.00 -1.23 0.00 0.00 61.79 61.10 1rjv h SER 104 Cb 1.08 -0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 62.99 1rjv h SER 104 CO -0.25 0.33 -1.71 0.35 -0.53 0.00 0.00 176.83 175.02 1rjv n THR 105 N -4.80 0.12 -0.39 2.23 -2.24 0.46 -4.30 114.28 105.37 1rjv n THR 105 Ca 0.14 -0.37 0.36 0.00 -2.27 0.00 0.00 64.05 61.91 1rjv n THR 105 Cb 0.31 0.06 0.72 0.00 -2.10 0.00 0.00 70.33 69.31 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 0.09 0.00 3.22 7.12 -0.44 -0.85 115.31 124.45 1rjv h LEU 106 Ca -0.05 0.02 0.00 0.00 0.13 0.00 0.00 57.88 57.99 1rjv h LEU 106 Cb 0.83 0.01 0.00 0.00 -0.53 0.00 0.00 40.66 40.97 1rjv h LEU 106 CO 0.00 -0.00 -0.86 1.33 -0.13 0.00 0.00 178.44 178.78 1rjv n VAL 107 N -4.25 0.00 0.19 1.05 0.24 -1.26 -3.98 118.33 110.32 1rjv n VAL 107 Ca 0.29 -0.16 0.06 0.00 -2.04 0.00 0.00 64.34 62.50 1rjv n VAL 107 Cb 1.33 0.90 0.34 0.00 -1.47 0.00 0.00 33.84 34.93 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 2.13 0.97 0.00 2.33 0.00 -1.34 -1.88 119.26 121.48 1rjv h ALA 108 Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1rjv h ALA 108 Cb 0.41 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1rjv h ALA 108 CO 0.00 0.44 0.11 0.39 0.00 0.00 0.00 179.25 180.19 1rjv n GLU 109 N -3.48 0.07 0.00 0.00 -0.58 -1.11 -5.13 120.64 110.41 1rjv n GLU 109 Ca 0.00 0.53 0.00 0.00 -0.42 0.00 0.00 57.16 57.28 1rjv n GLU 109 Cb 0.51 -1.85 0.00 0.00 -0.57 0.00 0.00 31.44 29.53 1rjv n GLU 109 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52