#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rc3 s LYS 24 N 0.00 0.97 0.51 2.12 1.02 -1.26 -5.02 119.74 118.07 2rc3 s LYS 24 Ca 0.00 -1.06 -0.17 0.00 0.02 0.00 0.00 55.97 54.75 2rc3 s LYS 24 Cb 0.00 -1.08 -0.08 0.00 -0.52 0.00 0.00 37.83 36.15 2rc3 s LYS 24 CO 0.00 0.24 0.98 0.95 -0.92 0.00 0.00 175.35 176.61 2rc3 s THR 25 N -1.28 4.49 0.36 2.17 -4.23 -1.26 -0.52 115.64 115.37 2rc3 s THR 25 Ca 0.02 1.24 0.06 0.00 -1.18 0.00 0.00 61.69 61.83 2rc3 s THR 25 Cb -0.10 -3.69 0.29 0.00 1.34 0.00 0.00 72.50 70.34 2rc3 s THR 25 CO 0.03 -0.64 1.96 0.58 -0.54 0.00 0.00 174.62 176.02 2rc3 h VAL 26 N 1.02 1.02 -0.54 2.29 2.07 -1.45 -1.79 116.25 118.86 2rc3 h VAL 26 Ca -0.47 -0.25 0.01 0.00 0.82 0.00 0.00 66.70 66.80 2rc3 h VAL 26 Cb 1.19 0.21 -0.03 0.00 -1.52 0.00 0.00 31.29 31.14 2rc3 h VAL 26 CO 0.61 0.14 0.36 0.50 0.02 0.00 0.00 177.57 179.20 2rc3 h LYS 27 N 0.74 0.72 -0.21 1.57 3.64 -1.86 0.10 116.57 121.28 2rc3 h LYS 27 Ca 0.31 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.64 2rc3 h LYS 27 Cb 0.26 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.91 2rc3 h LYS 27 CO -0.10 0.48 0.13 1.25 -2.27 0.00 0.00 179.45 178.94 2rc3 h HIS 28 N 0.74 0.27 -0.91 1.91 2.76 -1.81 -1.10 115.15 117.02 2rc3 h HIS 28 Ca 0.20 0.00 0.05 0.00 -2.20 0.00 0.00 60.37 58.42 2rc3 h HIS 28 Cb -0.08 -0.09 -0.06 0.00 1.55 0.00 0.00 27.41 28.73 2rc3 h HIS 28 CO -0.04 0.20 0.58 -0.07 -1.30 0.00 0.00 177.93 177.30 2rc3 h LEU 29 N 0.27 0.93 -0.65 0.26 3.38 -0.94 -2.24 115.31 116.31 2rc3 h LEU 29 Ca 0.08 0.01 -0.14 0.00 0.09 0.00 0.00 57.88 57.91 2rc3 h LEU 29 Cb 0.00 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 2rc3 h LEU 29 CO -0.02 0.61 -0.58 0.25 0.09 0.00 0.00 178.44 178.79 2rc3 h LEU 30 N 1.07 0.33 -0.83 1.67 5.85 -0.67 -1.15 115.31 121.58 2rc3 h LEU 30 Ca 0.38 -0.18 0.04 0.00 0.84 0.00 0.00 57.88 58.96 2rc3 h LEU 30 Cb 0.12 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 41.00 2rc3 h LEU 30 CO -0.16 0.84 0.52 1.56 -0.34 0.00 0.00 178.44 180.86 2rc3 h GLN 31 N 0.22 0.98 -0.25 1.25 1.08 -0.65 0.93 115.11 118.68 2rc3 h GLN 31 Ca -0.00 -0.06 -0.03 0.00 -1.45 0.00 0.00 58.65 57.11 2rc3 h GLN 31 Cb 1.08 -0.22 -0.01 0.00 -0.05 0.00 0.00 27.48 28.28 2rc3 h GLN 31 CO 0.09 0.65 0.04 0.93 -0.95 0.00 0.00 178.83 179.59 2rc3 h GLU 32 N 1.01 0.41 -0.16 1.46 5.08 -1.08 -3.30 114.58 117.99 2rc3 h GLU 32 Ca 0.34 -0.11 -0.19 0.00 -1.00 0.00 0.00 59.36 58.39 2rc3 h GLU 32 Cb 0.05 -0.05 0.01 0.00 0.50 0.00 0.00 28.75 29.26 2rc3 h GLU 32 CO -0.13 0.54 -0.66 -0.22 -1.00 0.00 0.00 179.01 177.54 2rc3 h LYS 33 N 0.21 0.73 0.00 2.33 1.63 -0.92 -3.51 116.57 117.05 2rc3 h LYS 33 Ca 0.07 -0.57 0.00 0.00 -0.85 0.00 0.00 60.65 59.30 2rc3 h LYS 33 Cb 0.33 0.11 0.00 0.00 -0.60 0.00 0.00 32.23 32.07 2rc3 h LYS 33 CO 0.00 1.19 0.00 0.41 -3.45 0.00 0.00 179.45 177.60 2rc3 n GLY 34 N 0.65 1.62 1.93 5.01 0.00 0.32 -4.85 105.19 109.87 2rc3 n GLY 34 Ca -0.07 -1.86 0.02 0.00 0.00 0.00 0.00 46.02 44.12 2rc3 n GLY 34 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2rc3 n HIS 35 N 1.54 2.21 -1.84 1.61 8.25 -1.26 -4.77 115.22 120.96 2rc3 n HIS 35 Ca 0.00 -0.88 -0.41 0.00 -0.26 0.00 0.00 57.72 56.17 2rc3 n HIS 35 Cb 0.00 -0.57 -0.01 0.00 1.12 0.00 0.00 29.99 30.52 2rc3 n HIS 35 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2rc3 s THR 36 N -2.82 2.21 -0.11 1.59 2.01 -1.26 -4.57 115.64 112.69 2rc3 s THR 36 Ca 0.54 0.18 -0.00 0.00 0.31 0.00 0.00 61.69 62.72 2rc3 s THR 36 Cb 0.42 -3.12 0.02 0.00 0.01 0.00 0.00 72.50 69.84 2rc3 s THR 36 CO 0.15 0.03 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.34 2rc3 s VAL 37 N -0.23 1.06 -0.26 3.82 1.01 -1.26 -4.31 120.40 120.23 2rc3 s VAL 37 Ca 0.60 -0.32 -0.08 0.00 0.00 0.00 0.00 61.98 62.19 2rc3 s VAL 37 Cb -0.46 -1.06 -0.02 0.00 0.00 0.00 0.00 36.38 34.83 2rc3 s VAL 37 CO 0.50 0.37 0.08 -0.69 0.00 0.00 0.00 175.10 175.36 2rc3 s VAL 38 N 1.61 4.34 0.38 2.92 1.01 -1.26 -5.08 120.40 124.32 2rc3 s VAL 38 Ca 0.03 -0.24 0.07 0.00 0.00 0.00 0.00 61.98 61.85 2rc3 s VAL 38 Cb -0.13 -3.07 -0.07 0.00 0.00 0.00 0.00 36.38 33.11 2rc3 s VAL 38 CO -0.07 0.28 -0.01 0.00 0.00 0.00 0.00 175.10 175.30 2rc3 s ALA 39 N 1.61 2.97 0.04 5.51 0.00 -1.26 -1.90 121.76 128.72 2rc3 s ALA 39 Ca 0.06 -2.21 -0.14 0.00 0.00 0.00 0.00 51.96 49.67 2rc3 s ALA 39 Cb -0.15 0.19 0.02 0.00 0.00 0.00 0.00 23.12 23.18 2rc3 s ALA 39 CO 0.04 -0.10 0.30 -1.50 0.00 0.00 0.00 175.76 174.50 2rc3 s ILE 40 N -2.79 0.08 0.40 0.00 2.07 0.21 -4.83 121.20 116.35 2rc3 s ILE 40 Ca 0.34 -0.68 -0.12 0.00 -1.41 0.00 0.00 60.65 58.78 2rc3 s ILE 40 Cb 0.08 -0.93 -0.07 0.00 0.13 0.00 0.00 42.46 41.67 2rc3 s ILE 40 CO 0.17 -0.38 0.79 -0.83 -1.91 0.00 0.00 174.94 172.79 2rc3 s GLY 41 N -2.05 2.04 0.51 1.50 0.00 -1.26 -2.59 107.32 105.46 2rc3 s GLY 41 Ca -0.05 -0.10 0.25 0.00 0.00 0.00 0.00 44.72 44.82 2rc3 s GLY 41 CO -0.03 0.10 2.06 -0.56 0.00 0.00 0.00 173.10 174.67 2rc3 h PRO 42 N 1.41 0.00 -0.01 2.90 0.13 -1.93 -2.67 132.00 131.83 2rc3 h PRO 42 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2rc3 h PRO 42 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2rc3 h PRO 42 CO 0.64 0.13 -0.29 -0.25 -0.23 0.00 0.00 178.00 177.99 2rc3 n ASP 43 N -3.75 1.10 -4.75 1.44 8.00 -1.26 -0.70 116.55 116.63 2rc3 n ASP 43 Ca -0.02 -0.93 -0.30 0.00 0.71 0.00 0.00 54.79 54.25 2rc3 n ASP 43 Cb 0.24 0.18 0.11 0.00 -0.02 0.00 0.00 41.12 41.63 2rc3 n ASP 43 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2rc3 s ASP 44 N -2.52 4.03 0.36 -2.24 -1.08 -1.01 -4.72 116.67 109.49 2rc3 s ASP 44 Ca 0.23 1.60 -0.23 0.00 -0.52 0.00 0.00 52.55 53.63 2rc3 s ASP 44 Cb 0.19 -2.30 -0.10 0.00 -1.46 0.00 0.00 42.92 39.24 2rc3 s ASP 44 CO 0.53 -2.30 0.93 -0.94 0.52 0.00 0.00 175.17 173.91 2rc3 s SER 45 N -3.47 7.14 0.29 -0.34 1.04 -1.26 -0.49 113.70 116.60 2rc3 s SER 45 Ca 0.62 1.74 0.00 0.00 0.48 0.00 0.00 55.95 58.79 2rc3 s SER 45 Cb -0.17 -2.55 0.51 0.00 0.10 0.00 0.00 66.02 63.91 2rc3 s SER 45 CO 0.56 -0.19 1.89 0.58 0.98 0.00 0.00 173.24 177.06 2rc3 h VAL 46 N 2.29 1.04 -0.14 5.02 2.07 -1.00 -1.27 116.25 124.26 2rc3 h VAL 46 Ca -0.48 -0.36 0.04 0.00 0.82 0.00 0.00 66.70 66.72 2rc3 h VAL 46 Cb 1.19 -0.11 -0.05 0.00 -1.52 0.00 0.00 31.29 30.80 2rc3 h VAL 46 CO 0.63 0.19 -0.14 0.15 0.02 0.00 0.00 177.57 178.43 2rc3 h PHE 47 N 1.06 -0.35 -0.99 1.57 3.57 -1.80 -0.47 116.94 119.52 2rc3 h PHE 47 Ca 0.42 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.97 2rc3 h PHE 47 Cb 0.25 0.18 -0.05 0.00 2.79 0.00 0.00 35.95 39.12 2rc3 h PHE 47 CO -0.00 -0.21 0.65 -0.91 -2.23 0.00 0.00 178.31 175.61 2rc3 h ASN 48 N -0.16 1.10 -0.10 0.41 2.35 -1.77 -1.66 115.58 115.75 2rc3 h ASN 48 Ca 0.10 -0.02 -0.00 0.00 -0.55 0.00 0.00 56.30 55.83 2rc3 h ASN 48 Cb 0.31 -0.26 -0.00 0.00 0.05 0.00 0.00 38.32 38.41 2rc3 h ASN 48 CO -0.24 0.77 0.06 0.00 -1.65 0.00 0.00 177.43 176.37 2rc3 h ALA 49 N 1.41 0.13 -0.24 -0.83 0.00 -0.68 -1.25 119.26 117.79 2rc3 h ALA 49 Ca 0.38 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 55.16 2rc3 h ALA 49 Cb -0.06 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 2rc3 h ALA 49 CO -0.10 -0.36 -0.31 0.52 0.00 0.00 0.00 179.25 179.00 2rc3 h MET 50 N 0.10 0.48 -0.87 0.00 2.86 -0.90 -0.60 114.93 116.01 2rc3 h MET 50 Ca 0.04 -0.20 0.00 0.00 -2.06 0.00 0.00 59.70 57.47 2rc3 h MET 50 Cb 0.03 -0.02 -0.04 0.00 0.06 0.00 0.00 31.60 31.63 2rc3 h MET 50 CO -0.01 0.74 0.55 1.96 1.06 0.00 0.00 176.91 181.21 2rc3 h GLN 51 N 0.42 1.17 -0.42 1.72 1.08 -1.18 -1.07 115.11 116.83 2rc3 h GLN 51 Ca 0.05 -0.09 -0.08 0.00 -1.45 0.00 0.00 58.65 57.08 2rc3 h GLN 51 Cb 0.75 -0.25 -0.01 0.00 -0.05 0.00 0.00 27.48 27.91 2rc3 h GLN 51 CO 0.06 0.80 -0.04 -0.22 -0.95 0.00 0.00 178.83 178.48 2rc3 h LYS 52 N 1.19 0.77 -0.93 1.46 3.64 -0.61 -0.72 116.57 121.37 2rc3 h LYS 52 Ca 0.32 -0.27 0.01 0.00 -1.27 0.00 0.00 60.65 59.44 2rc3 h LYS 52 Cb -0.08 -0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 31.63 2rc3 h LYS 52 CO -0.06 0.86 0.60 0.52 -2.27 0.00 0.00 179.45 179.10 2rc3 h MET 53 N 0.60 1.23 -0.37 1.90 2.86 -0.92 -2.09 114.93 118.14 2rc3 h MET 53 Ca 0.11 -0.08 -0.02 0.00 -2.06 0.00 0.00 59.70 57.65 2rc3 h MET 53 Cb 0.54 -0.27 -0.02 0.00 0.06 0.00 0.00 31.60 31.92 2rc3 h MET 53 CO 0.03 0.82 0.16 0.00 1.06 0.00 0.00 176.91 178.98 2rc3 h ALA 54 N 1.33 0.47 -0.36 6.32 0.00 -0.98 -0.34 119.26 125.70 2rc3 h ALA 54 Ca 0.34 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 55.06 2rc3 h ALA 54 Cb -0.13 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 2rc3 h ALA 54 CO -0.07 0.06 -0.05 0.00 0.00 0.00 0.00 179.25 179.19 2rc3 h ALA 55 N 1.00 1.24 -0.01 0.00 0.00 -0.89 -2.87 119.26 117.74 2rc3 h ALA 55 Ca 0.12 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2rc3 h ALA 55 Cb 0.16 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2rc3 h ALA 55 CO -0.01 0.50 -0.39 -0.25 0.00 0.00 0.00 179.25 179.10 2rc3 n ASP 56 N -4.23 1.53 -3.50 0.00 8.00 -0.81 -4.98 116.55 112.56 2rc3 n ASP 56 Ca 0.01 -1.21 -0.19 0.00 0.71 0.00 0.00 54.79 54.12 2rc3 n ASP 56 Cb 0.29 0.33 0.07 0.00 -0.02 0.00 0.00 41.12 41.79 2rc3 n ASP 56 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2rc3 n ASN 57 N -0.35 -2.33 -4.36 -2.24 4.13 -0.23 -5.02 115.26 104.86 2rc3 n ASN 57 Ca 0.10 -0.70 -0.18 0.00 1.68 0.00 0.00 54.58 55.48 2rc3 n ASN 57 Cb 0.41 -4.75 -0.10 0.00 -1.54 0.00 0.00 39.78 33.79 2rc3 n ASN 57 CO 0.00 0.00 0.00 0.27 0.28 0.00 0.00 177.26 177.81 2rc3 s ILE 58 N -3.46 0.77 -0.09 2.41 -4.36 -0.68 -5.06 121.20 110.72 2rc3 s ILE 58 Ca 0.06 -2.00 0.01 0.00 -0.26 0.00 0.00 60.65 58.46 2rc3 s ILE 58 Cb -0.01 -2.67 0.01 0.00 1.25 0.00 0.00 42.46 41.04 2rc3 s ILE 58 CO 0.76 -0.01 0.72 0.61 0.24 0.00 0.00 174.94 177.25 2rc3 n GLY 59 N -0.53 0.27 3.20 6.27 0.00 -1.26 -4.59 105.19 108.56 2rc3 n GLY 59 Ca -0.01 -0.03 -0.11 0.00 0.00 0.00 0.00 46.02 45.88 2rc3 n GLY 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rc3 s ALA 60 N -0.43 -0.48 -0.03 4.61 0.00 -1.26 -1.21 121.76 122.97 2rc3 s ALA 60 Ca 0.01 -0.15 0.04 0.00 0.00 0.00 0.00 51.96 51.86 2rc3 s ALA 60 Cb 0.01 0.27 -0.00 0.00 0.00 0.00 0.00 23.12 23.40 2rc3 s ALA 60 CO 0.01 -0.36 -0.13 -0.51 0.00 0.00 0.00 175.76 174.77 2rc3 s LEU 61 N -2.00 1.90 0.13 0.00 1.43 0.65 -4.95 118.68 115.84 2rc3 s LEU 61 Ca -0.06 -0.26 -0.30 0.00 -1.03 0.00 0.00 54.13 52.48 2rc3 s LEU 61 Cb -0.02 -0.74 -0.06 0.00 0.03 0.00 0.00 46.19 45.40 2rc3 s LEU 61 CO -0.03 0.13 1.06 -0.76 0.23 0.00 0.00 176.35 176.98 2rc3 s LEU 62 N -0.01 4.47 -0.34 1.79 2.01 -0.80 -1.07 118.68 124.72 2rc3 s LEU 62 Ca -0.01 1.95 -0.09 0.00 0.01 0.00 0.00 54.13 56.00 2rc3 s LEU 62 Cb -0.09 -3.59 0.02 0.00 0.01 0.00 0.00 46.19 42.54 2rc3 s LEU 62 CO 0.01 -0.21 0.15 -0.69 1.01 0.00 0.00 176.35 176.62 2rc3 s VAL 63 N 0.10 4.25 0.05 -1.59 1.01 0.16 -0.62 120.40 123.75 2rc3 s VAL 63 Ca 0.50 -0.85 0.07 0.00 0.00 0.00 0.00 61.98 61.70 2rc3 s VAL 63 Cb -0.27 -3.32 -0.03 0.00 0.00 0.00 0.00 36.38 32.76 2rc3 s VAL 63 CO 0.32 -0.12 -0.16 -0.04 0.00 0.00 0.00 175.10 175.09 2rc3 s MET 64 N 1.51 2.11 -0.33 2.72 1.00 -1.07 -0.99 119.30 124.25 2rc3 s MET 64 Ca 0.01 -0.97 0.03 0.00 0.00 0.00 0.00 55.69 54.76 2rc3 s MET 64 Cb -0.19 -2.22 0.10 0.00 0.00 0.00 0.00 34.83 32.52 2rc3 s MET 64 CO 0.05 0.54 0.05 -1.59 0.00 0.00 0.00 175.02 174.07 2rc3 s LYS 65 N -1.54 1.34 5.71 2.03 -2.85 -0.55 -4.37 119.74 119.50 2rc3 s LYS 65 Ca 0.16 -1.65 0.00 0.00 -1.00 0.00 0.00 55.97 53.48 2rc3 s LYS 65 Cb -0.11 -2.90 0.00 0.00 -2.06 0.00 0.00 37.83 32.76 2rc3 s LYS 65 CO 0.06 -0.92 0.00 -0.25 0.10 0.00 0.00 175.35 174.34 2rc3 n ASP 66 N 4.41 0.00 0.02 0.03 8.00 -1.26 -1.46 116.55 126.29 2rc3 n ASP 66 Ca 0.01 0.00 0.13 0.00 0.71 0.00 0.00 54.79 55.64 2rc3 n ASP 66 Cb 0.42 0.00 0.43 0.00 -0.02 0.00 0.00 41.12 41.95 2rc3 n ASP 66 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2rc3 n GLU 67 N 14.00 0.07 -2.65 -1.24 1.02 -1.26 -4.87 120.64 125.71 2rc3 n GLU 67 Ca 0.00 0.04 -0.42 0.00 -0.02 0.00 0.00 57.16 56.76 2rc3 n GLU 67 Cb 0.00 -1.57 -0.03 0.00 -0.02 0.00 0.00 31.44 29.82 2rc3 n GLU 67 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 2rc3 s LYS 68 N -3.04 4.47 -0.67 3.49 2.47 -0.53 -4.71 119.74 121.22 2rc3 s LYS 68 Ca 0.12 1.46 -0.25 0.00 -1.56 0.00 0.00 55.97 55.73 2rc3 s LYS 68 Cb 0.17 -3.50 0.05 0.00 -1.46 0.00 0.00 37.83 33.08 2rc3 s LYS 68 CO 0.61 -0.23 1.12 -1.17 0.16 0.00 0.00 175.35 175.84 2rc3 s LEU 69 N 1.60 3.74 0.15 5.43 2.96 -1.26 -1.48 118.68 129.81 2rc3 s LEU 69 Ca 0.51 -0.56 0.23 0.00 -0.22 0.00 0.00 54.13 54.08 2rc3 s LEU 69 Cb -0.21 -2.61 0.01 0.00 0.50 0.00 0.00 46.19 43.88 2rc3 s LEU 69 CO 0.23 -1.58 1.01 1.33 -1.32 0.00 0.00 176.35 176.02 2rc3 n VAL 70 N 6.23 0.47 -3.98 1.68 0.24 -0.16 -5.01 118.33 117.81 2rc3 n VAL 70 Ca 0.01 -0.48 0.01 0.00 -2.04 0.00 0.00 64.34 61.85 2rc3 n VAL 70 Cb 0.48 -0.21 0.01 0.00 -1.47 0.00 0.00 33.84 32.65 2rc3 n VAL 70 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2rc3 s GLY 71 N -4.21 -0.05 -0.04 7.63 0.00 -0.95 -4.54 107.32 105.15 2rc3 s GLY 71 Ca -0.00 -0.09 0.01 0.00 0.00 0.00 0.00 44.72 44.65 2rc3 s GLY 71 CO 0.80 5.05 -0.05 -1.50 0.00 0.00 0.00 173.10 177.40 2rc3 s ILE 72 N -2.03 0.52 -0.23 0.90 2.07 0.01 -0.67 121.20 121.77 2rc3 s ILE 72 Ca 0.28 -0.14 -0.09 0.00 -1.41 0.00 0.00 60.65 59.28 2rc3 s ILE 72 Cb -0.01 -0.53 -0.04 0.00 0.13 0.00 0.00 42.46 42.00 2rc3 s ILE 72 CO 0.01 0.21 0.13 -0.22 -1.91 0.00 0.00 174.94 173.15 2rc3 s LEU 73 N 0.73 3.93 0.25 8.50 2.96 -0.23 -0.38 118.68 134.43 2rc3 s LEU 73 Ca -0.10 0.04 0.08 0.00 -0.22 0.00 0.00 54.13 53.94 2rc3 s LEU 73 Cb -0.13 -2.04 -0.05 0.00 0.50 0.00 0.00 46.19 44.47 2rc3 s LEU 73 CO 0.00 0.06 -0.13 0.42 -1.32 0.00 0.00 176.35 175.39 2rc3 s THR 74 N 1.06 1.90 0.38 3.68 -4.23 -1.26 -0.25 115.64 116.92 2rc3 s THR 74 Ca 0.06 -2.23 0.13 0.00 -1.18 0.00 0.00 61.69 58.48 2rc3 s THR 74 Cb -0.14 -2.25 0.35 0.00 1.34 0.00 0.00 72.50 71.80 2rc3 s THR 74 CO 0.04 -0.44 1.85 -0.33 -0.54 0.00 0.00 174.62 175.19 2rc3 h GLU 75 N 2.38 0.53 -0.43 3.99 5.08 -1.55 -1.50 114.58 123.08 2rc3 h GLU 75 Ca -0.39 -0.03 -0.13 0.00 -1.00 0.00 0.00 59.36 57.81 2rc3 h GLU 75 Cb 1.23 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.36 2rc3 h GLU 75 CO 0.64 0.35 -0.22 -0.09 -1.00 0.00 0.00 179.01 178.68 2rc3 h ARG 76 N 0.54 0.90 -0.45 2.33 2.43 -1.96 0.29 114.38 118.47 2rc3 h ARG 76 Ca 0.48 -0.40 0.08 0.00 -0.81 0.00 0.00 59.98 59.33 2rc3 h ARG 76 Cb 1.01 -0.02 -0.07 0.00 -0.42 0.00 0.00 29.97 30.47 2rc3 h ARG 76 CO -0.22 1.06 0.04 -0.44 -1.51 0.00 0.00 179.97 178.89 2rc3 h ASP 77 N 0.73 -0.11 -0.38 -3.80 3.32 -1.69 -0.10 116.42 114.38 2rc3 h ASP 77 Ca 0.09 0.09 -0.03 0.00 0.02 0.00 0.00 57.03 57.21 2rc3 h ASP 77 Cb 0.80 0.15 -0.02 0.00 0.22 0.00 0.00 39.33 40.48 2rc3 h ASP 77 CO 0.07 -0.02 0.12 0.15 -1.72 0.00 0.00 179.24 177.84 2rc3 h PHE 78 N 0.15 0.61 0.00 4.55 3.57 -1.04 -1.40 116.94 123.38 2rc3 h PHE 78 Ca 0.22 -0.06 -0.05 0.00 3.53 0.00 0.00 57.97 61.62 2rc3 h PHE 78 Cb 0.31 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 38.87 2rc3 h PHE 78 CO -0.26 0.58 -0.21 0.77 -2.23 0.00 0.00 178.31 176.95 2rc3 h SER 79 N 0.47 0.00 0.22 0.41 0.02 -0.58 -2.38 113.55 111.70 2rc3 h SER 79 Ca 0.12 0.00 -0.32 0.00 -0.84 0.00 0.00 61.79 60.76 2rc3 h SER 79 Cb 0.25 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 62.73 2rc3 h SER 79 CO -0.00 0.21 -2.07 0.54 -1.14 0.00 0.00 176.83 174.37 2rc3 n ARG 80 N -3.34 0.66 -0.03 3.45 5.12 -0.08 -4.78 116.66 117.67 2rc3 n ARG 80 Ca 0.00 0.11 -0.03 0.00 -1.93 0.00 0.00 57.85 56.00 2rc3 n ARG 80 Cb 0.45 -1.64 -0.04 0.00 -1.16 0.00 0.00 32.46 30.07 2rc3 n ARG 80 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 2rc3 n LYS 81 N -2.84 2.32 -0.13 5.56 5.02 -0.54 -4.79 118.16 122.76 2rc3 n LYS 81 Ca -0.25 0.01 -0.10 0.00 -2.02 0.00 0.00 58.31 55.95 2rc3 n LYS 81 Cb 1.08 -1.15 -0.02 0.00 -0.02 0.00 0.00 35.03 34.92 2rc3 n LYS 81 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2rc3 h SER 82 N 0.00 0.64 1.57 4.39 4.64 -1.54 -2.75 113.55 120.49 2rc3 h SER 82 Ca -0.16 -0.30 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 2rc3 h SER 82 Cb 1.33 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 2rc3 h SER 82 CO -0.00 0.78 0.00 0.10 -0.87 0.00 0.00 176.83 176.84 2rc3 h TYR 83 N 0.47 0.00 0.00 4.77 -0.00 -1.89 -3.06 116.97 117.26 2rc3 h TYR 83 Ca 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.84 2rc3 h TYR 83 Cb 0.45 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.18 2rc3 h TYR 83 CO 0.04 0.00 0.00 -0.07 -0.00 0.00 0.00 178.16 178.13 2rc3 h LEU 84 N 0.00 0.00-10.18 0.10 3.38 -1.80 -3.46 115.31 103.36 2rc3 h LEU 84 Ca 0.00 0.00 -0.50 0.00 0.09 0.00 0.00 57.88 57.47 2rc3 h LEU 84 Cb 0.78 0.00 0.08 0.00 0.09 0.00 0.00 40.66 41.61 2rc3 h LEU 84 CO 0.00 0.00 0.38 -0.76 0.09 0.00 0.00 178.44 178.15 2rc3 s LEU 85 N -4.77 3.51 -0.81 1.67 1.43 -1.16 -4.94 118.68 113.61 2rc3 s LEU 85 Ca 0.09 1.94 -0.04 0.00 -1.03 0.00 0.00 54.13 55.09 2rc3 s LEU 85 Cb 0.11 -4.55 0.10 0.00 0.03 0.00 0.00 46.19 41.89 2rc3 s LEU 85 CO 0.59 -1.33 2.57 -0.67 0.23 0.00 0.00 176.35 177.74 2rc3 n ASP 86 N -2.02 7.13 -3.58 2.29 2.03 -1.26 -4.85 116.55 116.29 2rc3 n ASP 86 Ca 0.10 -3.22 -0.08 0.00 0.52 0.00 0.00 54.79 52.10 2rc3 n ASP 86 Cb 0.52 -1.27 -0.04 0.00 -0.72 0.00 0.00 41.12 39.61 2rc3 n ASP 86 CO 0.00 0.00 0.00 -1.59 -1.92 0.00 0.00 177.20 173.69 2rc3 s LYS 87 N -1.69 0.50 0.77 -0.67 -2.85 -1.26 -5.18 119.74 109.37 2rc3 s LYS 87 Ca 0.56 0.04 -0.11 0.00 -1.00 0.00 0.00 55.97 55.46 2rc3 s LYS 87 Cb 0.30 0.24 0.06 0.00 -2.06 0.00 0.00 37.83 36.37 2rc3 s LYS 87 CO -0.18 -0.17 1.08 -1.25 0.10 0.00 0.00 175.35 174.93 2rc3 s PRO 88 N -1.50 2.26 0.32 1.78 0.04 -1.26 -4.91 135.00 131.74 2rc3 s PRO 88 Ca 0.02 0.89 0.00 0.00 0.04 0.00 0.00 61.00 61.96 2rc3 s PRO 88 Cb -0.01 -1.92 0.53 0.00 0.04 0.00 0.00 34.50 33.15 2rc3 s PRO 88 CO -0.02 -1.56 1.97 -0.39 0.04 0.00 0.00 177.00 177.04 2rc3 h VAL 89 N -1.05 1.19 0.00 -0.36 -1.51 -1.93 -1.13 116.25 111.45 2rc3 h VAL 89 Ca -0.46 -0.40 0.00 0.00 -1.23 0.00 0.00 66.70 64.61 2rc3 h VAL 89 Cb 1.24 0.21 0.00 0.00 -2.13 0.00 0.00 31.29 30.62 2rc3 h VAL 89 CO 0.56 0.20 0.00 0.11 -1.23 0.00 0.00 177.57 177.20 2rc3 h LYS 90 N 0.94 0.00 -0.19 5.19 1.57 -1.95 -2.25 116.57 119.88 2rc3 h LYS 90 Ca 0.25 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.03 2rc3 h LYS 90 Cb -0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.26 2rc3 h LYS 90 CO -0.05 0.00 0.00 -0.25 -0.57 0.00 0.00 179.45 178.58 2rc3 n ASP 91 N -2.49 3.03 -4.72 0.86 8.00 -0.45 -4.86 116.55 115.91 2rc3 n ASP 91 Ca 0.01 -1.95 -0.35 0.00 0.71 0.00 0.00 54.79 53.21 2rc3 n ASP 91 Cb 0.24 -0.11 -0.08 0.00 -0.02 0.00 0.00 41.12 41.15 2rc3 n ASP 91 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2rc3 s THR 92 N -1.78 5.02 0.19 -3.53 2.01 -0.85 -4.92 115.64 111.78 2rc3 s THR 92 Ca 0.33 0.04 -0.11 0.00 0.31 0.00 0.00 61.69 62.26 2rc3 s THR 92 Cb 0.21 -3.23 -0.07 0.00 0.01 0.00 0.00 72.50 69.42 2rc3 s THR 92 CO 0.31 0.52 0.53 -1.10 -0.69 0.00 0.00 174.62 174.19 2rc3 s GLN 93 N -0.16 3.86 0.27 4.92 -0.21 -1.26 -0.67 119.66 126.41 2rc3 s GLN 93 Ca 0.08 0.33 -0.01 0.00 0.02 0.00 0.00 55.36 55.78 2rc3 s GLN 93 Cb -0.12 -2.78 0.59 0.00 1.00 0.00 0.00 33.01 31.70 2rc3 s GLN 93 CO 0.01 0.40 1.67 0.28 -2.12 0.00 0.00 175.29 175.52 2rc3 h VAL 94 N 2.36 0.42 -0.07 1.09 2.07 -0.69 0.07 116.25 121.49 2rc3 h VAL 94 Ca -0.48 -0.09 0.02 0.00 0.82 0.00 0.00 66.70 66.98 2rc3 h VAL 94 Cb 1.18 0.15 -0.00 0.00 -1.52 0.00 0.00 31.29 31.09 2rc3 h VAL 94 CO 0.68 0.05 0.10 0.07 0.02 0.00 0.00 177.57 178.48 2rc3 h LYS 95 N 0.25 0.00 -0.09 1.57 2.10 -1.19 -1.15 116.57 118.06 2rc3 h LYS 95 Ca 0.49 0.00 -0.09 0.00 -2.00 0.00 0.00 60.65 59.04 2rc3 h LYS 95 Cb 0.90 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.22 2rc3 h LYS 95 CO -0.58 0.00 -0.38 0.93 -2.00 0.00 0.00 179.45 177.42 2rc3 h GLU 96 N 0.00 0.18 0.00 0.07 5.08 -1.25 -3.34 114.58 115.32 2rc3 h GLU 96 Ca 0.03 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 2rc3 h GLU 96 Cb 0.23 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.47 2rc3 h GLU 96 CO -0.00 0.54 0.00 0.44 -1.00 0.00 0.00 179.01 178.99 2rc3 n ILE 97 N -4.06 0.00 -1.32 3.13 -5.35 -0.86 -5.06 119.36 105.83 2rc3 n ILE 97 Ca -0.01 -0.44 -0.33 0.00 -0.27 0.00 0.00 62.75 61.70 2rc3 n ILE 97 Cb 0.44 1.06 0.10 0.00 -1.74 0.00 0.00 39.64 39.50 2rc3 n ILE 97 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2rc3 s MET 98 N -0.47 2.06 -0.31 6.28 0.23 -0.49 -4.79 119.30 121.82 2rc3 s MET 98 Ca 0.00 1.55 -0.27 0.00 -1.03 0.00 0.00 55.69 55.94 2rc3 s MET 98 Cb 0.00 -1.85 0.01 0.00 -1.53 0.00 0.00 34.83 31.47 2rc3 s MET 98 CO 0.00 -1.85 0.99 0.99 -2.03 0.00 0.00 175.02 173.12 2rc3 s THR 99 N -2.33 4.60 0.03 3.16 2.01 0.49 -4.90 115.64 118.69 2rc3 s THR 99 Ca 0.69 1.59 0.10 0.00 0.31 0.00 0.00 61.69 64.39 2rc3 s THR 99 Cb -0.24 -4.34 -0.15 0.00 0.01 0.00 0.00 72.50 67.78 2rc3 s THR 99 CO 0.49 -0.40 1.22 0.03 -0.69 0.00 0.00 174.62 175.26 2rc3 h ARG 100 N 8.07 0.00 -4.81 4.92 3.08 -1.84 0.06 114.38 123.86 2rc3 h ARG 100 Ca -0.21 0.00 -0.70 0.00 0.07 0.00 0.00 59.98 59.14 2rc3 h ARG 100 Cb 1.07 0.00 -0.19 0.00 0.08 0.00 0.00 29.97 30.93 2rc3 h ARG 100 CO 0.99 0.79 0.40 -1.14 -1.07 0.00 0.00 179.97 179.95 2rc3 s GLN 101 N -2.76 3.29 -0.36 0.04 0.74 -1.26 -4.59 119.66 114.76 2rc3 s GLN 101 Ca 0.01 -1.52 -0.07 0.00 0.05 0.00 0.00 55.36 53.83 2rc3 s GLN 101 Cb 0.09 -4.48 0.05 0.00 1.10 0.00 0.00 33.01 29.78 2rc3 s GLN 101 CO 0.80 -1.63 0.15 0.08 -0.55 0.00 0.00 175.29 174.15 2rc3 s VAL 102 N 2.59 3.89 0.32 1.34 1.01 -1.26 -5.02 120.40 123.27 2rc3 s VAL 102 Ca 0.20 -1.24 -0.29 0.00 0.00 0.00 0.00 61.98 60.66 2rc3 s VAL 102 Cb -0.15 -3.27 -0.10 0.00 0.00 0.00 0.00 36.38 32.86 2rc3 s VAL 102 CO 0.00 -0.29 1.33 0.00 0.00 0.00 0.00 175.10 176.15 2rc3 s ALA 103 N 1.40 3.52 0.12 5.51 0.00 -1.26 -5.02 121.76 126.03 2rc3 s ALA 103 Ca 0.00 1.28 -0.06 0.00 0.00 0.00 0.00 51.96 53.18 2rc3 s ALA 103 Cb -0.20 -3.50 -0.02 0.00 0.00 0.00 0.00 23.12 19.40 2rc3 s ALA 103 CO 0.02 -0.68 0.17 1.52 0.00 0.00 0.00 175.76 176.80 2rc3 s TYR 104 N -0.96 0.46 0.34 0.00 -0.85 -1.26 -4.26 117.35 110.82 2rc3 s TYR 104 Ca 0.51 -0.86 0.09 0.00 -0.52 0.00 0.00 57.07 56.28 2rc3 s TYR 104 Cb -0.40 -0.20 -0.06 0.00 0.38 0.00 0.00 41.96 41.68 2rc3 s TYR 104 CO 0.52 -0.59 -0.06 0.14 -1.52 0.00 0.00 175.55 174.04 2rc3 s VAL 105 N -3.95 2.39 0.02 -3.49 -7.23 -0.52 -5.00 120.40 102.61 2rc3 s VAL 105 Ca 0.15 -2.12 0.00 0.00 -1.81 0.00 0.00 61.98 58.20 2rc3 s VAL 105 Cb 0.05 -2.70 -0.00 0.00 0.56 0.00 0.00 36.38 34.29 2rc3 s VAL 105 CO -0.03 -0.20 0.01 -0.90 -0.31 0.00 0.00 175.10 173.66 2rc3 n ASP 106 N -0.85 0.30 0.00 4.85 5.68 -1.26 -1.00 116.55 124.26 2rc3 n ASP 106 Ca -0.05 -1.09 0.13 0.00 -0.50 0.00 0.00 54.79 53.28 2rc3 n ASP 106 Cb 0.63 0.06 0.79 0.00 -1.14 0.00 0.00 41.12 41.46 2rc3 n ASP 106 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 2rc3 n LEU 107 N 0.00 0.00 -0.39 -2.12 4.77 -1.22 -1.46 117.00 116.58 2rc3 n LEU 107 Ca 0.00 0.02 0.14 0.00 -0.03 0.00 0.00 56.01 56.14 2rc3 n LEU 107 Cb 0.03 -0.02 0.52 0.00 -2.33 0.00 0.00 43.42 41.62 2rc3 n LEU 107 CO 0.01 -0.00 0.84 0.59 -1.33 0.00 0.00 177.39 177.50 2rc3 n ASN 108 N -1.02 1.26 -4.97 -1.43 5.03 -1.26 -4.76 115.26 108.12 2rc3 n ASN 108 Ca 0.20 -1.30 -0.21 0.00 0.87 0.00 0.00 54.58 54.14 2rc3 n ASN 108 Cb 0.10 0.02 0.01 0.00 -1.02 0.00 0.00 39.78 38.89 2rc3 n ASN 108 CO 0.00 0.00 0.00 0.20 -1.83 0.00 0.00 177.26 175.63 2rc3 s ASN 109 N -2.13 5.84 0.36 6.41 -0.87 -0.54 -5.02 114.94 119.00 2rc3 s ASN 109 Ca 0.35 0.11 0.07 0.00 -1.57 0.00 0.00 52.86 51.82 2rc3 s ASN 109 Cb 0.21 -1.39 -0.07 0.00 -0.02 0.00 0.00 41.25 39.98 2rc3 s ASN 109 CO 0.38 -0.64 -0.01 0.42 -2.57 0.00 0.00 177.10 174.68 2rc3 s THR 110 N -2.44 1.84 0.40 1.60 -4.23 -1.26 -1.23 115.64 110.32 2rc3 s THR 110 Ca 0.48 -2.06 0.10 0.00 -1.18 0.00 0.00 61.69 59.03 2rc3 s THR 110 Cb -0.10 -2.81 0.31 0.00 1.34 0.00 0.00 72.50 71.25 2rc3 s THR 110 CO 0.36 -0.09 1.97 -0.55 -0.54 0.00 0.00 174.62 175.77 2rc3 h ASN 111 N 1.96 0.51 -0.25 3.99 -1.07 -1.07 -1.79 115.58 117.86 2rc3 h ASN 111 Ca -0.42 0.01 -0.00 0.00 0.07 0.00 0.00 56.30 55.95 2rc3 h ASN 111 Cb 1.24 -0.10 -0.01 0.00 -2.07 0.00 0.00 38.32 37.38 2rc3 h ASN 111 CO 0.75 0.32 0.14 -0.08 0.07 0.00 0.00 177.43 178.62 2rc3 h GLU 112 N 0.57 0.35 -0.57 4.14 4.81 -1.97 -0.52 114.58 121.40 2rc3 h GLU 112 Ca 0.30 -0.04 0.03 0.00 -0.13 0.00 0.00 59.36 59.52 2rc3 h GLU 112 Cb 0.42 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.69 2rc3 h GLU 112 CO -0.09 0.30 0.34 -0.44 -0.73 0.00 0.00 179.01 178.39 2rc3 h ASP 113 N 0.30 0.53 -0.07 1.04 3.32 -1.82 -0.96 116.42 118.77 2rc3 h ASP 113 Ca 0.09 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.15 2rc3 h ASP 113 Cb 0.05 -0.10 -0.00 0.00 0.22 0.00 0.00 39.33 39.50 2rc3 h ASP 113 CO -0.02 0.37 0.04 0.00 -1.72 0.00 0.00 179.24 177.91 2rc3 n MET 115 N -5.00 0.00 0.00 0.00 2.81 -0.24 -1.00 117.12 113.69 2rc3 n MET 115 Ca -0.06 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.83 2rc3 n MET 115 Cb 0.07 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.58 2rc3 n MET 115 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2rc3 n ALA 116 N 0.00 0.00 -0.10 3.04 0.00 -0.38 -1.80 120.51 121.27 2rc3 n ALA 116 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 2rc3 n ALA 116 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 2rc3 n ALA 116 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2rc3 h LEU 117 N 0.00 0.66 -0.50 0.00 5.85 -0.76 0.16 115.31 120.71 2rc3 h LEU 117 Ca 0.00 -0.43 0.06 0.00 0.84 0.00 0.00 57.88 58.35 2rc3 h LEU 117 Cb 0.00 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 40.80 2rc3 h LEU 117 CO 0.00 0.95 0.22 0.40 -0.34 0.00 0.00 178.44 179.67 2rc3 h ILE 118 N 0.37 0.90 -0.04 4.05 2.04 -1.08 -0.03 117.51 123.72 2rc3 h ILE 118 Ca 0.06 -0.15 -0.02 0.00 1.00 0.00 0.00 64.86 65.75 2rc3 h ILE 118 Cb 0.72 0.43 -0.00 0.00 -0.74 0.00 0.00 36.82 37.23 2rc3 h ILE 118 CO 0.05 0.08 -0.04 0.74 0.00 0.00 0.00 178.15 178.98 2rc3 h THR 119 N 0.43 1.38 -0.22 -0.27 2.02 -1.17 -1.31 112.91 113.78 2rc3 h THR 119 Ca 0.23 -1.21 -0.13 0.00 0.77 0.00 0.00 66.41 66.08 2rc3 h THR 119 Cb 0.19 2.10 -0.00 0.00 -1.74 0.00 0.00 68.15 68.70 2rc3 h THR 119 CO -0.20 0.33 -0.37 -0.33 0.37 0.00 0.00 175.52 175.32 2rc3 h GLU 120 N -0.36 0.63 -0.01 6.66 5.08 -0.59 -3.19 114.58 122.80 2rc3 h GLU 120 Ca 0.01 -0.39 0.00 0.00 -1.00 0.00 0.00 59.36 57.98 2rc3 h GLU 120 Cb 0.55 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.84 2rc3 h GLU 120 CO 0.01 1.00 -0.30 -1.33 -1.00 0.00 0.00 179.01 177.39 2rc3 n MET 121 N -4.26 0.79 -3.70 2.33 2.81 -0.04 -4.96 117.12 110.10 2rc3 n MET 121 Ca -0.05 -0.49 -0.24 0.00 -1.81 0.00 0.00 57.70 55.11 2rc3 n MET 121 Cb 0.52 -1.49 0.05 0.00 -0.71 0.00 0.00 33.22 31.59 2rc3 n MET 121 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 2rc3 n ARG 122 N -0.68 -6.02 -5.03 0.03 1.74 -0.52 -5.01 116.66 101.18 2rc3 n ARG 122 Ca 0.11 0.70 -0.32 0.00 -0.77 0.00 0.00 57.85 57.57 2rc3 n ARG 122 Cb 0.36 -5.53 -0.15 0.00 -1.02 0.00 0.00 32.46 26.12 2rc3 n ARG 122 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 2rc3 s VAL 123 N -3.44 2.65 -0.99 1.55 -7.23 -1.05 -5.03 120.40 106.86 2rc3 s VAL 123 Ca 0.32 -0.85 0.24 0.00 -1.81 0.00 0.00 61.98 59.87 2rc3 s VAL 123 Cb -0.15 -2.02 -0.06 0.00 0.56 0.00 0.00 36.38 34.71 2rc3 s VAL 123 CO 0.79 0.57 1.28 0.54 -0.31 0.00 0.00 175.10 177.96 2rc3 n ARG 124 N 2.75 0.01 -4.80 4.82 1.74 -1.26 -4.43 116.66 115.49 2rc3 n ARG 124 Ca -0.17 0.00 -0.24 0.00 -0.77 0.00 0.00 57.85 56.66 2rc3 n ARG 124 Cb 0.52 -1.50 -0.15 0.00 -1.02 0.00 0.00 32.46 30.30 2rc3 n ARG 124 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 2rc3 s HIS 125 N -3.00 1.51 -0.24 -1.55 3.76 -1.26 -0.52 115.29 113.98 2rc3 s HIS 125 Ca 0.10 -0.29 -0.01 0.00 -0.15 0.00 0.00 55.06 54.72 2rc3 s HIS 125 Cb 0.17 -0.97 0.07 0.00 1.11 0.00 0.00 32.58 32.96 2rc3 s HIS 125 CO 0.75 -0.03 0.02 -0.51 -0.85 0.00 0.00 174.74 174.11 2rc3 s LEU 126 N -0.39 2.11 0.48 0.89 1.43 0.13 -4.93 118.68 118.41 2rc3 s LEU 126 Ca 0.06 -1.20 -0.24 0.00 -1.03 0.00 0.00 54.13 51.73 2rc3 s LEU 126 Cb -0.07 -0.93 -0.08 0.00 0.03 0.00 0.00 46.19 45.15 2rc3 s LEU 126 CO -0.01 -0.31 1.26 -2.65 0.23 0.00 0.00 176.35 174.88 2rc3 n PRO 127 N 4.82 1.75 -4.05 1.29 -0.02 -1.26 -0.87 135.00 136.66 2rc3 n PRO 127 Ca -0.08 0.63 -0.35 0.00 -2.02 0.00 0.00 63.50 61.68 2rc3 n PRO 127 Cb 0.45 -2.42 -0.12 0.00 -0.02 0.00 0.00 33.50 31.38 2rc3 n PRO 127 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2rc3 s VAL 128 N -1.26 4.01 0.10 -1.45 1.01 -0.34 -1.45 120.40 121.03 2rc3 s VAL 128 Ca 0.66 -0.29 0.06 0.00 0.00 0.00 0.00 61.98 62.41 2rc3 s VAL 128 Cb -0.47 -2.82 -0.04 0.00 0.00 0.00 0.00 36.38 33.05 2rc3 s VAL 128 CO 0.54 0.42 -0.05 -0.76 0.00 0.00 0.00 175.10 175.26 2rc3 s LEU 129 N 1.01 3.25 -0.04 3.92 1.02 -0.17 -0.51 118.68 127.16 2rc3 s LEU 129 Ca 0.02 -0.29 -0.01 0.00 0.02 0.00 0.00 54.13 53.86 2rc3 s LEU 129 Cb -0.14 -2.01 0.03 0.00 0.02 0.00 0.00 46.19 44.09 2rc3 s LEU 129 CO 0.02 0.17 0.04 -0.62 0.02 0.00 0.00 176.35 175.98 2rc3 s ASP 130 N -2.29 0.87 -1.61 2.29 2.15 -0.06 -3.43 116.67 114.59 2rc3 s ASP 130 Ca 0.24 0.05 -0.13 0.00 0.43 0.00 0.00 52.55 53.13 2rc3 s ASP 130 Cb -0.11 -0.16 0.11 0.00 -0.30 0.00 0.00 42.92 42.46 2rc3 s ASP 130 CO 0.16 -0.21 0.71 0.47 -0.17 0.00 0.00 175.17 176.13 2rc3 n ASP 131 N 4.94 -2.67 0.00 -0.34 10.43 -1.26 -1.76 116.55 125.89 2rc3 n ASP 131 Ca -0.11 -0.99 0.00 0.00 2.57 0.00 0.00 54.79 56.26 2rc3 n ASP 131 Cb 0.50 -2.92 0.00 0.00 1.84 0.00 0.00 41.12 40.54 2rc3 n ASP 131 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2rc3 n GLY 132 N -1.59 0.74 3.35 0.44 0.00 -1.26 -5.04 105.19 101.83 2rc3 n GLY 132 Ca -0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.67 2rc3 n GLY 132 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2rc3 s LYS 133 N -0.19 2.59 -0.10 1.61 1.02 -0.72 -4.95 119.74 118.99 2rc3 s LYS 133 Ca 0.00 -0.81 -0.30 0.00 0.02 0.00 0.00 55.97 54.88 2rc3 s LYS 133 Cb 0.00 -2.28 -0.04 0.00 -0.52 0.00 0.00 37.83 35.00 2rc3 s LYS 133 CO 0.00 0.46 1.47 0.08 -0.92 0.00 0.00 175.35 176.44 2rc3 s VAL 134 N -0.33 3.89 -0.29 3.17 1.01 -1.26 -0.88 120.40 125.71 2rc3 s VAL 134 Ca 0.02 1.09 0.04 0.00 0.00 0.00 0.00 61.98 63.13 2rc3 s VAL 134 Cb -0.13 -3.70 -0.02 0.00 0.00 0.00 0.00 36.38 32.53 2rc3 s VAL 134 CO 0.02 -0.09 0.29 2.30 0.00 0.00 0.00 175.10 177.62 2rc3 n ILE 135 N 5.39 0.00 -3.09 2.22 -5.35 0.34 -4.95 119.36 113.91 2rc3 n ILE 135 Ca 0.16 -0.43 0.00 0.00 -0.27 0.00 0.00 62.75 62.20 2rc3 n ILE 135 Cb 0.44 1.02 0.00 0.00 -1.74 0.00 0.00 39.64 39.36 2rc3 n ILE 135 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2rc3 n GLY 136 N 0.87 -1.12 3.28 3.28 0.00 -1.14 -4.66 105.19 105.71 2rc3 n GLY 136 Ca 0.01 -0.80 -0.12 0.00 0.00 0.00 0.00 46.02 45.11 2rc3 n GLY 136 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2rc3 s LEU 137 N 0.00 0.23 -0.08 0.99 0.20 -1.26 -1.20 118.68 117.57 2rc3 s LEU 137 Ca 0.00 0.84 0.03 0.00 0.69 0.00 0.00 54.13 55.69 2rc3 s LEU 137 Cb 0.00 1.37 -0.02 0.00 -0.43 0.00 0.00 46.19 47.11 2rc3 s LEU 137 CO 0.00 -0.16 -0.15 -0.76 -0.29 0.00 0.00 176.35 174.98 2rc3 s LEU 138 N 0.70 2.63 0.39 -0.68 1.43 -0.05 -4.93 118.68 118.17 2rc3 s LEU 138 Ca -0.04 -0.28 0.08 0.00 -1.03 0.00 0.00 54.13 52.85 2rc3 s LEU 138 Cb -0.05 -1.55 -0.07 0.00 0.03 0.00 0.00 46.19 44.56 2rc3 s LEU 138 CO -0.05 0.27 0.05 -0.94 0.23 0.00 0.00 176.35 175.91 2rc3 s SER 139 N -0.29 4.08 0.26 2.29 1.04 -1.26 0.22 113.70 120.03 2rc3 s SER 139 Ca 0.02 -1.20 -0.01 0.00 0.48 0.00 0.00 55.95 55.24 2rc3 s SER 139 Cb -0.13 -0.44 0.52 0.00 0.10 0.00 0.00 66.02 66.07 2rc3 s SER 139 CO 0.03 -0.41 1.77 -0.29 0.98 0.00 0.00 173.24 175.31 2rc3 h ILE 140 N 1.71 0.75 -0.85 -1.02 2.10 -1.14 -0.38 117.51 118.67 2rc3 h ILE 140 Ca -0.43 -0.22 0.07 0.00 1.08 0.00 0.00 64.86 65.35 2rc3 h ILE 140 Cb 1.25 0.05 -0.05 0.00 -1.09 0.00 0.00 36.82 36.97 2rc3 h ILE 140 CO 0.74 0.12 0.55 1.23 -1.08 0.00 0.00 178.15 179.71 2rc3 h GLY 141 N 0.65 1.20 1.05 8.18 0.00 -1.96 -1.33 103.07 110.86 2rc3 h GLY 141 Ca 0.46 -0.38 -0.07 0.00 0.00 0.00 0.00 47.33 47.35 2rc3 h GLY 141 CO -0.35 0.27 0.17 -0.55 0.00 0.00 0.00 176.54 176.08 2rc3 h ASP 142 N 0.93 1.03 -0.41 0.19 3.32 -1.47 -0.46 116.42 119.54 2rc3 h ASP 142 Ca 0.37 -0.23 -0.15 0.00 0.02 0.00 0.00 57.03 57.03 2rc3 h ASP 142 Cb 0.24 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 2rc3 h ASP 142 CO -0.13 0.99 -0.33 -0.07 -1.72 0.00 0.00 179.24 177.98 2rc3 h LEU 143 N 1.01 1.01 -0.40 1.55 -0.00 -0.92 -1.30 115.31 116.26 2rc3 h LEU 143 Ca 0.21 -0.44 -0.09 0.00 -0.00 0.00 0.00 57.88 57.56 2rc3 h LEU 143 Cb 0.37 -0.28 -0.01 0.00 -0.00 0.00 0.00 40.66 40.73 2rc3 h LEU 143 CO 0.00 1.24 -0.10 0.58 -0.00 0.00 0.00 178.44 180.16 2rc3 h VAL 144 N 0.80 1.28 -0.57 1.22 2.07 -1.19 -1.72 116.25 118.12 2rc3 h VAL 144 Ca 0.08 -1.20 -0.00 0.00 0.82 0.00 0.00 66.70 66.40 2rc3 h VAL 144 Cb 0.92 1.22 -0.03 0.00 -1.52 0.00 0.00 31.29 31.88 2rc3 h VAL 144 CO 0.09 0.40 0.36 0.50 0.02 0.00 0.00 177.57 178.94 2rc3 h LYS 145 N 0.60 0.77 -0.91 1.57 3.64 -0.95 -2.13 116.57 119.15 2rc3 h LYS 145 Ca 0.10 -0.06 0.02 0.00 -1.27 0.00 0.00 60.65 59.44 2rc3 h LYS 145 Cb 0.63 -0.17 -0.05 0.00 -0.41 0.00 0.00 32.23 32.24 2rc3 h LYS 145 CO 0.04 0.54 0.60 0.22 -2.27 0.00 0.00 179.45 178.59 2rc3 h ASP 146 N 0.78 1.03 0.26 4.20 3.58 -1.11 -2.67 116.42 122.49 2rc3 h ASP 146 Ca 0.21 -0.02 -0.04 0.00 0.42 0.00 0.00 57.03 57.59 2rc3 h ASP 146 Cb -0.04 -0.25 -0.01 0.00 1.72 0.00 0.00 39.33 40.75 2rc3 h ASP 146 CO -0.04 0.74 -0.20 0.00 -2.88 0.00 0.00 179.24 176.85 2rc3 h ALA 147 N 1.44 1.54 -0.71 -0.78 0.00 -0.67 -2.53 119.26 117.56 2rc3 h ALA 147 Ca 0.34 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2rc3 h ALA 147 Cb -0.10 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.66 2rc3 h ALA 147 CO -0.08 0.25 0.00 0.44 0.00 0.00 0.00 179.25 179.86 2rc3 n ILE 148 N -4.11 1.00 1.96 0.00 -5.35 -0.98 -5.10 119.36 106.77 2rc3 n ILE 148 Ca -0.02 -1.00 0.16 0.00 -0.27 0.00 0.00 62.75 61.62 2rc3 n ILE 148 Cb 0.27 0.50 0.91 0.00 -1.74 0.00 0.00 39.64 39.59 2rc3 n ILE 148 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25