#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p77 s ASP 2 N 0.00 6.67 -0.11 6.12 -0.00 -1.26 -4.86 116.67 123.22 1p77 s ASP 2 Ca 0.00 2.77 0.02 0.00 -0.00 0.00 0.00 52.55 55.34 1p77 s ASP 2 Cb 0.00 -2.65 -0.01 0.00 -0.00 0.00 0.00 42.92 40.26 1p77 s ASP 2 CO 0.00 -0.62 -0.17 -0.22 -0.00 0.00 0.00 175.17 174.16 1p77 s LEU 3 N -1.81 2.49 0.25 1.23 2.96 -1.26 -1.00 118.68 121.55 1p77 s LEU 3 Ca 0.50 -0.40 0.05 0.00 -0.22 0.00 0.00 54.13 54.06 1p77 s LEU 3 Cb -0.41 -1.54 -0.05 0.00 0.50 0.00 0.00 46.19 44.69 1p77 s LEU 3 CO 0.55 0.17 -0.03 -0.31 -1.32 0.00 0.00 176.35 175.41 1p77 s TYR 4 N 0.28 1.73 0.23 5.38 1.51 0.22 -0.92 117.35 125.78 1p77 s TYR 4 Ca -0.12 -0.82 -0.17 0.00 -1.01 0.00 0.00 57.07 54.94 1p77 s TYR 4 Cb -0.16 -1.00 0.02 0.00 -0.11 0.00 0.00 41.96 40.71 1p77 s TYR 4 CO 0.06 0.10 0.56 0.00 -1.11 0.00 0.00 175.55 175.17 1p77 s ALA 5 N -3.24 -0.80 -0.14 3.71 0.00 -1.15 -1.48 121.76 118.66 1p77 s ALA 5 Ca 0.29 -0.44 -0.02 0.00 0.00 0.00 0.00 51.96 51.79 1p77 s ALA 5 Cb 0.05 0.92 -0.02 0.00 0.00 0.00 0.00 23.12 24.07 1p77 s ALA 5 CO 0.10 -0.88 -0.09 0.54 0.00 0.00 0.00 175.76 175.43 1p77 s VAL 6 N -3.93 3.43 -0.14 0.00 0.11 -0.44 -0.01 120.40 119.42 1p77 s VAL 6 Ca 0.14 -0.52 -0.04 0.00 -2.93 0.00 0.00 61.98 58.62 1p77 s VAL 6 Cb -0.02 -2.48 -0.03 0.00 -1.53 0.00 0.00 36.38 32.32 1p77 s VAL 6 CO 0.03 0.51 -0.01 0.26 -3.33 0.00 0.00 175.10 172.56 1p77 s TRP 7 N 0.39 3.10 0.06 1.54 0.52 -0.04 -0.81 118.94 123.69 1p77 s TRP 7 Ca -0.07 -0.10 -0.27 0.00 0.02 0.00 0.00 56.10 55.67 1p77 s TRP 7 Cb -0.15 -1.94 0.09 0.00 -1.15 0.00 0.00 33.47 30.33 1p77 s TRP 7 CO 0.04 0.13 1.18 0.20 0.02 0.00 0.00 176.95 178.52 1p77 s GLY 8 N 0.05 -0.13 -0.29 0.98 0.00 -1.10 -0.37 107.32 106.46 1p77 s GLY 8 Ca 0.02 0.08 0.01 0.00 0.00 0.00 0.00 44.72 44.83 1p77 s GLY 8 CO 0.02 2.92 0.56 0.21 0.00 0.00 0.00 173.10 176.81 1p77 s ASN 9 N -3.42 -1.16 0.96 1.64 3.84 -0.37 -0.82 114.94 115.60 1p77 s ASN 9 Ca 0.22 0.54 -0.15 0.00 0.21 0.00 0.00 52.86 53.68 1p77 s ASN 9 Cb 0.00 1.95 0.18 0.00 -0.55 0.00 0.00 41.25 42.82 1p77 s ASN 9 CO 0.01 -0.28 1.23 -2.16 -2.79 0.00 0.00 177.10 173.10 1p77 s PRO 10 N 2.80 0.74 0.00 0.43 0.04 -1.26 -4.00 135.00 133.74 1p77 s PRO 10 Ca 0.16 -0.12 0.00 0.00 0.04 0.00 0.00 61.00 61.08 1p77 s PRO 10 Cb -0.14 -1.83 0.00 0.00 0.04 0.00 0.00 34.50 32.58 1p77 s PRO 10 CO -0.22 -2.40 0.00 1.51 0.04 0.00 0.00 177.00 175.93 1p77 n ILE 11 N -3.82 0.00 -0.26 0.56 0.13 -1.26 -4.87 119.36 109.84 1p77 n ILE 11 Ca 0.12 -0.03 0.28 0.00 -1.10 0.00 0.00 62.75 62.02 1p77 n ILE 11 Cb 0.60 0.41 0.65 0.00 -0.84 0.00 0.00 39.64 40.45 1p77 n ILE 11 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 1p77 h ALA 12 N 0.00 2.69 -0.00 1.51 0.00 -1.96 0.11 119.26 121.61 1p77 h ALA 12 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1p77 h ALA 12 Cb 0.00 0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1p77 h ALA 12 CO 0.00 -1.01 -0.00 0.00 0.00 0.00 0.00 179.25 178.24 1p77 n GLN 13 N -4.36 0.19 -1.96 0.00 0.00 -1.26 -4.95 117.38 105.04 1p77 n GLN 13 Ca 0.22 -0.00 -0.41 0.00 0.00 0.00 0.00 57.00 56.81 1p77 n GLN 13 Cb 0.99 -1.50 -0.02 0.00 0.00 0.00 0.00 30.24 29.70 1p77 n GLN 13 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 1p77 s SER 14 N -2.81 6.59 0.00 2.61 0.15 0.38 -4.88 113.70 115.73 1p77 s SER 14 Ca 0.20 2.71 0.25 0.00 0.70 0.00 0.00 55.95 59.82 1p77 s SER 14 Cb 0.20 -2.62 0.50 0.00 -1.71 0.00 0.00 66.02 62.38 1p77 s SER 14 CO 0.50 -0.76 1.40 0.29 1.20 0.00 0.00 173.24 175.87 1p77 n LYS 15 N 2.55 0.42 -0.16 5.44 4.76 -1.26 -4.52 118.16 125.39 1p77 n LYS 15 Ca 0.08 -0.27 -0.03 0.00 -2.87 0.00 0.00 58.31 55.22 1p77 n LYS 15 Cb 0.39 -1.49 0.05 0.00 -1.84 0.00 0.00 35.03 32.14 1p77 n LYS 15 CO 0.00 0.00 0.00 0.77 -1.37 0.00 0.00 177.40 176.80 1p77 h SER 16 N 0.66 -0.34 -0.53 4.39 0.02 -1.97 -0.25 113.55 115.52 1p77 h SER 16 Ca 0.00 0.13 0.06 0.00 -0.84 0.00 0.00 61.79 61.15 1p77 h SER 16 Cb 0.52 0.26 -0.05 0.00 0.14 0.00 0.00 62.40 63.27 1p77 h SER 16 CO 0.00 -0.12 0.23 -0.65 -1.14 0.00 0.00 176.83 175.15 1p77 h PRO 17 N 0.05 0.43 -0.56 3.45 0.11 -1.85 0.20 132.00 133.83 1p77 h PRO 17 Ca 0.24 -0.03 0.02 0.00 0.11 0.00 0.00 66.00 66.35 1p77 h PRO 17 Cb 0.37 -0.10 -0.03 0.00 0.11 0.00 0.00 31.00 31.36 1p77 h PRO 17 CO -0.46 0.28 0.35 1.25 -0.21 0.00 0.00 178.00 179.21 1p77 h LEU 18 N 0.44 0.59 0.01 2.35 5.85 -1.74 -0.56 115.31 122.25 1p77 h LEU 18 Ca 0.25 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.96 1p77 h LEU 18 Cb 0.22 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.12 1p77 h LEU 18 CO -0.22 0.42 -0.01 0.40 -0.34 0.00 0.00 178.44 178.70 1p77 h ILE 19 N 0.71 1.25 -0.43 4.05 2.04 -0.50 -2.65 117.51 121.98 1p77 h ILE 19 Ca 0.22 -0.81 -0.05 0.00 1.00 0.00 0.00 64.86 65.22 1p77 h ILE 19 Cb -0.03 1.80 -0.02 0.00 -0.74 0.00 0.00 36.82 37.83 1p77 h ILE 19 CO -0.07 0.21 0.06 1.56 0.00 0.00 0.00 178.15 179.91 1p77 h GLN 20 N -0.36 0.66 -0.37 2.37 1.08 -0.47 0.16 115.11 118.18 1p77 h GLN 20 Ca -0.00 -0.14 0.01 0.00 -1.45 0.00 0.00 58.65 57.08 1p77 h GLN 20 Cb 0.35 -0.10 -0.02 0.00 -0.05 0.00 0.00 27.48 27.66 1p77 h GLN 20 CO 0.00 0.64 0.22 -0.97 -0.95 0.00 0.00 178.83 177.77 1p77 h ASN 21 N 0.64 0.36 -0.26 1.46 -0.73 -1.09 0.16 115.58 116.11 1p77 h ASN 21 Ca 0.14 0.00 -0.10 0.00 1.87 0.00 0.00 56.30 58.21 1p77 h ASN 21 Cb 0.31 -0.08 -0.02 0.00 0.27 0.00 0.00 38.32 38.81 1p77 h ASN 21 CO 0.00 0.26 -0.18 0.11 -0.37 0.00 0.00 177.43 177.25 1p77 h LYS 22 N 0.44 0.71 -0.61 6.67 1.57 -0.97 -0.53 116.57 123.84 1p77 h LYS 22 Ca 0.14 -0.26 -0.06 0.00 -1.87 0.00 0.00 60.65 58.60 1p77 h LYS 22 Cb -0.01 -0.05 -0.03 0.00 0.08 0.00 0.00 32.23 32.23 1p77 h LYS 22 CO -0.06 0.84 0.13 -0.07 -0.57 0.00 0.00 179.45 179.72 1p77 h LEU 23 N 0.63 0.92 -0.30 2.94 3.38 -0.49 -2.26 115.31 120.14 1p77 h LEU 23 Ca 0.10 -0.19 -0.08 0.00 0.09 0.00 0.00 57.88 57.79 1p77 h LEU 23 Cb 0.66 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 1p77 h LEU 23 CO 0.05 0.91 -0.14 0.00 0.09 0.00 0.00 178.44 179.35 1p77 h ALA 24 N 1.20 0.42 -0.07 1.53 0.00 -0.18 -2.86 119.26 119.30 1p77 h ALA 24 Ca 0.19 -0.33 0.03 0.00 0.00 0.00 0.00 54.91 54.81 1p77 h ALA 24 Cb 0.36 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 1p77 h ALA 24 CO 0.00 0.30 -0.14 0.00 0.00 0.00 0.00 179.25 179.42 1p77 h ALA 25 N 0.76 -0.11 -0.89 0.00 0.00 -0.95 0.57 119.26 118.64 1p77 h ALA 25 Ca 0.07 0.03 0.12 0.00 0.00 0.00 0.00 54.91 55.13 1p77 h ALA 25 Cb 0.66 0.27 -0.07 0.00 0.00 0.00 0.00 17.79 18.65 1p77 h ALA 25 CO 0.04 -0.61 0.57 0.37 0.00 0.00 0.00 179.25 179.62 1p77 h GLN 26 N -0.20 0.75 -0.31 0.00 4.15 -1.44 -1.25 115.11 116.80 1p77 h GLN 26 Ca 0.07 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.45 1p77 h GLN 26 Cb 0.30 -0.17 0.00 0.00 0.21 0.00 0.00 27.48 27.82 1p77 h GLN 26 CO -0.19 0.50 0.00 0.25 -1.93 0.00 0.00 178.83 177.46 1p77 n THR 27 N -4.55 0.39 -3.95 2.39 -2.24 -1.08 -4.97 114.28 100.26 1p77 n THR 27 Ca 0.16 -0.70 -0.26 0.00 -2.27 0.00 0.00 64.05 60.99 1p77 n THR 27 Cb 0.39 1.11 -0.02 0.00 -2.10 0.00 0.00 70.33 69.71 1p77 n THR 27 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1p77 n HIS 28 N 1.48 -1.66 -3.85 4.78 8.25 -0.00 -4.96 115.22 119.26 1p77 n HIS 28 Ca 0.18 0.75 -0.36 0.00 -0.26 0.00 0.00 57.72 58.04 1p77 n HIS 28 Cb 0.61 -3.74 -0.07 0.00 1.12 0.00 0.00 29.99 27.91 1p77 n HIS 28 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 1p77 s GLN 29 N -6.55 3.77 -0.46 -0.41 -1.52 -0.09 -5.03 119.66 109.37 1p77 s GLN 29 Ca 0.03 -0.19 -0.19 0.00 -1.95 0.00 0.00 55.36 53.06 1p77 s GLN 29 Cb -0.02 -3.27 0.04 0.00 -0.22 0.00 0.00 33.01 29.54 1p77 s GLN 29 CO 0.89 0.54 0.59 0.99 -0.25 0.00 0.00 175.29 178.05 1p77 s THR 30 N -0.36 4.90 0.12 -0.19 2.01 -1.26 -4.58 115.64 116.29 1p77 s THR 30 Ca 0.11 -0.22 -0.26 0.00 0.31 0.00 0.00 61.69 61.63 1p77 s THR 30 Cb -0.12 -4.21 0.07 0.00 0.01 0.00 0.00 72.50 68.26 1p77 s THR 30 CO 0.01 -0.64 0.98 0.00 -0.69 0.00 0.00 174.62 174.28 1p77 s MET 31 N 2.60 1.09 0.02 4.92 0.23 -1.26 -4.32 119.30 122.58 1p77 s MET 31 Ca 0.17 -0.59 0.01 0.00 -1.03 0.00 0.00 55.69 54.26 1p77 s MET 31 Cb -0.17 0.38 -0.02 0.00 -1.53 0.00 0.00 34.83 33.50 1p77 s MET 31 CO 0.15 -0.50 -0.05 -1.83 -2.03 0.00 0.00 175.02 170.77 1p77 s GLU 32 N -3.19 0.36 -0.08 3.16 -1.05 -0.17 -4.93 118.70 112.81 1p77 s GLU 32 Ca 0.12 -0.55 -0.01 0.00 -0.15 0.00 0.00 54.97 54.37 1p77 s GLU 32 Cb -0.01 -0.10 0.03 0.00 -0.44 0.00 0.00 34.13 33.61 1p77 s GLU 32 CO 0.01 0.01 -0.02 -0.47 0.95 0.00 0.00 175.26 175.73 1p77 s TYR 33 N -1.14 0.84 0.41 4.83 5.04 -1.26 -0.61 117.35 125.46 1p77 s TYR 33 Ca -0.10 -0.28 0.06 0.00 -2.44 0.00 0.00 57.07 54.31 1p77 s TYR 33 Cb -0.08 -0.87 -0.07 0.00 0.35 0.00 0.00 41.96 41.29 1p77 s TYR 33 CO -0.00 -0.34 0.01 0.96 -1.34 0.00 0.00 175.55 174.84 1p77 s ILE 34 N 1.77 1.87 -0.16 3.14 -4.36 -0.55 -4.74 121.20 118.16 1p77 s ILE 34 Ca 0.03 -2.00 -0.08 0.00 -0.26 0.00 0.00 60.65 58.34 1p77 s ILE 34 Cb -0.13 -2.92 -0.04 0.00 1.25 0.00 0.00 42.46 40.63 1p77 s ILE 34 CO -0.05 0.00 0.10 0.00 0.24 0.00 0.00 174.94 175.23 1p77 s ALA 35 N -2.77 3.61 -0.10 2.27 0.00 -1.26 -1.33 121.76 122.18 1p77 s ALA 35 Ca 0.33 -0.70 0.03 0.00 0.00 0.00 0.00 51.96 51.61 1p77 s ALA 35 Cb 0.09 -1.98 0.01 0.00 0.00 0.00 0.00 23.12 21.23 1p77 s ALA 35 CO 0.17 0.32 -0.20 0.15 0.00 0.00 0.00 175.76 176.19 1p77 s LYS 36 N -0.09 2.64 -0.40 0.00 -0.14 0.01 -4.92 119.74 116.84 1p77 s LYS 36 Ca 0.09 -0.73 -0.25 0.00 -1.36 0.00 0.00 55.97 53.71 1p77 s LYS 36 Cb -0.12 -2.07 0.02 0.00 -1.68 0.00 0.00 37.83 33.98 1p77 s LYS 36 CO 0.00 0.09 0.90 -1.17 -0.76 0.00 0.00 175.35 174.41 1p77 s LEU 37 N 0.57 4.02 -0.04 3.17 2.96 -1.26 -2.71 118.68 125.39 1p77 s LEU 37 Ca -0.15 0.36 -0.29 0.00 -0.22 0.00 0.00 54.13 53.83 1p77 s LEU 37 Cb -0.17 -3.20 -0.02 0.00 0.50 0.00 0.00 46.19 43.30 1p77 s LEU 37 CO 0.05 -0.91 0.97 -0.83 -1.32 0.00 0.00 176.35 174.30 1p77 s GLY 38 N 2.02 2.71 0.30 7.98 0.00 -0.00 -4.91 107.32 115.43 1p77 s GLY 38 Ca 0.37 0.46 -0.29 0.00 0.00 0.00 0.00 44.72 45.25 1p77 s GLY 38 CO 0.21 1.73 1.25 -0.35 0.00 0.00 0.00 173.10 175.94 1p77 s ASP 39 N 1.03 6.93 0.51 1.64 2.15 -1.26 -4.55 116.67 123.11 1p77 s ASP 39 Ca 0.50 2.54 0.21 0.00 0.43 0.00 0.00 52.55 56.22 1p77 s ASP 39 Cb -0.20 -2.64 1.32 0.00 -0.30 0.00 0.00 42.92 41.11 1p77 s ASP 39 CO 0.24 -0.42 2.10 -0.07 -0.17 0.00 0.00 175.17 176.85 1p77 h LEU 40 N 3.75 0.00 0.00 -1.34 3.38 -1.98 -0.75 115.31 118.38 1p77 h LEU 40 Ca -0.48 0.00 -0.42 0.00 0.09 0.00 0.00 57.88 57.07 1p77 h LEU 40 Cb 1.22 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.90 1p77 h LEU 40 CO 0.67 0.09 -2.48 0.47 0.09 0.00 0.00 178.44 177.28 1p77 n ASP 41 N -4.13 1.97 -0.37 -0.43 8.00 -1.26 -4.63 116.55 115.70 1p77 n ASP 41 Ca -0.03 0.08 0.14 0.00 0.71 0.00 0.00 54.79 55.69 1p77 n ASP 41 Cb 0.18 -0.60 0.61 0.00 -0.02 0.00 0.00 41.12 41.29 1p77 n ASP 41 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1p77 n ALA 42 N -3.67 2.60 -0.33 2.24 0.00 -1.18 -4.45 120.51 115.71 1p77 n ALA 42 Ca -0.49 -0.39 -0.01 0.00 0.00 0.00 0.00 53.44 52.55 1p77 n ALA 42 Cb 0.94 -1.24 0.05 0.00 0.00 0.00 0.00 19.45 19.21 1p77 n ALA 42 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1p77 h PHE 43 N 1.81 -0.93 -0.61 0.00 3.04 -1.39 0.23 116.94 119.09 1p77 h PHE 43 Ca 0.00 0.09 0.11 0.00 3.98 0.00 0.00 57.97 62.16 1p77 h PHE 43 Cb 0.39 0.54 -0.08 0.00 2.56 0.00 0.00 35.95 39.35 1p77 h PHE 43 CO 0.00 -0.40 0.15 0.93 -2.02 0.00 0.00 178.31 176.97 1p77 h GLU 44 N -0.03 0.27 -0.27 1.11 3.07 -1.87 0.23 114.58 117.09 1p77 h GLU 44 Ca 0.34 -0.02 -0.07 0.00 -0.50 0.00 0.00 59.36 59.12 1p77 h GLU 44 Cb 0.60 -0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 28.44 1p77 h GLU 44 CO -0.92 0.18 -0.09 1.96 -1.40 0.00 0.00 179.01 178.74 1p77 h GLN 45 N 0.28 0.53 -0.71 2.33 7.50 -1.35 -1.85 115.11 121.84 1p77 h GLN 45 Ca 0.32 -0.22 0.00 0.00 0.50 0.00 0.00 58.65 59.25 1p77 h GLN 45 Cb 0.46 -0.02 -0.03 0.00 0.05 0.00 0.00 27.48 27.94 1p77 h GLN 45 CO -0.39 0.76 0.45 1.96 -1.50 0.00 0.00 178.83 180.11 1p77 h GLN 46 N 0.27 0.95 0.37 1.46 4.20 -0.67 -0.87 115.11 120.83 1p77 h GLN 46 Ca 0.06 -0.07 -0.02 0.00 0.06 0.00 0.00 58.65 58.68 1p77 h GLN 46 Cb 0.59 -0.21 0.00 0.00 0.30 0.00 0.00 27.48 28.16 1p77 h GLN 46 CO 0.03 0.66 -0.18 1.25 -0.67 0.00 0.00 178.83 179.92 1p77 h LEU 47 N 0.97 -0.42 -0.90 1.46 5.85 -0.39 -0.53 115.31 121.35 1p77 h LEU 47 Ca 0.26 -0.05 0.09 0.00 0.84 0.00 0.00 57.88 59.02 1p77 h LEU 47 Cb -0.07 0.11 -0.07 0.00 0.37 0.00 0.00 40.66 41.00 1p77 h LEU 47 CO -0.05 -0.22 0.55 -0.07 -0.34 0.00 0.00 178.44 178.30 1p77 h LEU 48 N -0.60 0.82 -1.04 2.25 3.38 -1.22 0.10 115.31 119.00 1p77 h LEU 48 Ca -0.05 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 1p77 h LEU 48 Cb 0.44 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.03 1p77 h LEU 48 CO 0.08 0.48 0.39 0.00 0.09 0.00 0.00 178.44 179.48 1p77 h ALA 49 N 1.47 1.26 -0.62 1.53 0.00 -0.95 0.30 119.26 122.25 1p77 h ALA 49 Ca 0.42 -0.13 0.01 0.00 0.00 0.00 0.00 54.91 55.21 1p77 h ALA 49 Cb 0.33 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 1p77 h ALA 49 CO -0.23 0.58 0.41 0.35 0.00 0.00 0.00 179.25 180.36 1p77 h PHE 50 N 1.06 0.78 -0.01 0.00 3.04 0.66 0.65 116.94 123.12 1p77 h PHE 50 Ca 0.26 0.02 -0.22 0.00 3.98 0.00 0.00 57.97 62.01 1p77 h PHE 50 Cb 0.07 -0.26 0.00 0.00 2.56 0.00 0.00 35.95 38.32 1p77 h PHE 50 CO 0.01 0.49 -0.91 0.74 -2.02 0.00 0.00 178.31 176.62 1p77 h PHE 51 N 0.84 0.62 -0.21 0.41 -1.00 -0.70 -2.77 116.94 114.13 1p77 h PHE 51 Ca 0.23 -0.33 -0.03 0.00 2.81 0.00 0.00 57.97 60.65 1p77 h PHE 51 Cb -0.09 -0.07 -0.01 0.00 3.61 0.00 0.00 35.95 39.38 1p77 h PHE 51 CO -0.03 1.14 -0.01 0.93 -1.61 0.00 0.00 178.31 178.73 1p77 h GLU 52 N 0.25 0.30 -0.02 1.51 4.39 0.06 -0.03 114.58 121.04 1p77 h GLU 52 Ca -0.07 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.58 1p77 h GLU 52 Cb 1.54 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 30.14 1p77 h GLU 52 CO 0.16 0.34 0.00 0.39 -1.16 0.00 0.00 179.01 178.74 1p77 n GLU 53 N -4.36 1.08 0.00 2.33 1.02 0.18 -4.90 120.64 115.99 1p77 n GLU 53 Ca 0.00 -0.12 0.00 0.00 -0.02 0.00 0.00 57.16 57.02 1p77 n GLU 53 Cb 0.19 -1.21 0.00 0.00 -0.02 0.00 0.00 31.44 30.40 1p77 n GLU 53 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1p77 n GLY 54 N 0.74 0.87 3.75 0.62 0.00 -0.02 -5.06 105.19 106.09 1p77 n GLY 54 Ca 0.10 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.74 1p77 n GLY 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p77 s ALA 55 N -2.00 2.81 -0.02 4.61 0.00 -1.05 -4.75 121.76 121.35 1p77 s ALA 55 Ca 0.00 1.20 0.12 0.00 0.00 0.00 0.00 51.96 53.28 1p77 s ALA 55 Cb 0.00 -3.51 -0.17 0.00 0.00 0.00 0.00 23.12 19.44 1p77 s ALA 55 CO 0.00 -1.19 0.97 0.87 0.00 0.00 0.00 175.76 176.41 1p77 h LYS 56 N 1.50 0.00 0.00 0.00 1.57 -1.39 -3.44 116.57 114.81 1p77 h LYS 56 Ca -0.50 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.28 1p77 h LYS 56 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.60 1p77 h LYS 56 CO 0.57 0.61 0.00 0.41 -0.57 0.00 0.00 179.45 180.47 1p77 n GLY 57 N 1.42 -0.86 3.45 3.86 0.00 -1.24 -0.88 105.19 110.95 1p77 n GLY 57 Ca -0.08 -0.99 -0.11 0.00 0.00 0.00 0.00 46.02 44.85 1p77 n GLY 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p77 s ASN 59 N -2.64 6.32 -0.06 0.00 0.02 0.99 -0.61 114.94 118.96 1p77 s ASN 59 Ca 0.02 0.34 0.02 0.00 -1.02 0.00 0.00 52.86 52.22 1p77 s ASN 59 Cb -0.01 -1.98 0.01 0.00 0.02 0.00 0.00 41.25 39.29 1p77 s ASN 59 CO -0.11 -0.18 -0.11 -0.63 0.02 0.00 0.00 177.10 176.08 1p77 s ILE 60 N -2.14 1.04 0.00 0.60 -1.09 -0.18 -0.86 121.20 118.57 1p77 s ILE 60 Ca 0.38 -0.43 0.00 0.00 -2.23 0.00 0.00 60.65 58.37 1p77 s ILE 60 Cb -0.10 -0.95 0.00 0.00 -1.58 0.00 0.00 42.46 39.83 1p77 s ILE 60 CO 0.33 0.33 0.00 1.07 -1.23 0.00 0.00 174.94 175.44 1p77 n THR 61 N 3.76 0.00 -1.85 2.92 5.66 0.50 -4.49 114.28 120.78 1p77 n THR 61 Ca -0.23 0.00 -0.37 0.00 -3.05 0.00 0.00 64.05 60.41 1p77 n THR 61 Cb 0.52 0.00 0.05 0.00 -1.55 0.00 0.00 70.33 69.35 1p77 n THR 61 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 175.07 171.58 1p77 s SER 62 N -0.62 4.89 -0.60 1.09 0.01 -1.26 -1.47 113.70 115.74 1p77 s SER 62 Ca 0.00 2.55 0.00 0.00 1.31 0.00 0.00 55.95 59.82 1p77 s SER 62 Cb 0.00 -2.61 0.44 0.00 0.21 0.00 0.00 66.02 64.05 1p77 s SER 62 CO 0.00 -1.81 1.79 -0.81 0.41 0.00 0.00 173.24 172.82 1p77 n PRO 63 N -1.69 2.96 -0.14 12.44 -0.04 -1.26 -1.24 135.00 146.04 1p77 n PRO 63 Ca 0.14 -3.60 0.05 0.00 -0.04 0.00 0.00 63.50 60.05 1p77 n PRO 63 Cb 0.48 -2.28 0.12 0.00 -0.04 0.00 0.00 33.50 31.78 1p77 n PRO 63 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1p77 n PHE 64 N -0.79 0.36 0.02 0.54 0.99 -0.54 -4.78 117.46 113.26 1p77 n PHE 64 Ca 0.56 -0.44 -0.10 0.00 -0.00 0.00 0.00 57.45 57.46 1p77 n PHE 64 Cb 0.67 -0.03 -0.04 0.00 -1.00 0.00 0.00 39.48 39.08 1p77 n PHE 64 CO 0.00 0.00 0.00 0.87 -0.00 0.00 0.00 176.76 177.63 1p77 h LYS 65 N 1.79 -0.21 -0.05 -1.08 1.57 -1.77 0.24 116.57 117.05 1p77 h LYS 65 Ca 0.00 0.01 0.03 0.00 -1.87 0.00 0.00 60.65 58.82 1p77 h LYS 65 Cb 0.67 0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.99 1p77 h LYS 65 CO 0.00 -0.14 -0.15 0.93 -0.57 0.00 0.00 179.45 179.52 1p77 h GLU 66 N -0.22 -0.21 -0.64 3.15 5.08 -1.82 -0.79 114.58 119.12 1p77 h GLU 66 Ca 0.08 0.01 -0.05 0.00 -1.00 0.00 0.00 59.36 58.40 1p77 h GLU 66 Cb 0.33 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.59 1p77 h GLU 66 CO -0.20 -0.14 0.19 0.00 -1.00 0.00 0.00 179.01 177.85 1p77 h ARG 67 N -0.22 0.99 -0.38 2.33 3.08 -1.78 -1.96 114.38 116.44 1p77 h ARG 67 Ca 0.07 -0.20 -0.14 0.00 0.07 0.00 0.00 59.98 59.77 1p77 h ARG 67 Cb 0.31 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 1p77 h ARG 67 CO -0.18 0.86 -0.32 0.00 -1.07 0.00 0.00 179.97 179.26 1p77 h ALA 68 N 1.25 0.56 -0.73 0.04 0.00 -0.38 -2.90 119.26 117.09 1p77 h ALA 68 Ca 0.21 -0.42 0.07 0.00 0.00 0.00 0.00 54.91 54.76 1p77 h ALA 68 Cb 0.29 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 17.90 1p77 h ALA 68 CO -0.01 0.61 0.42 -0.92 0.00 0.00 0.00 179.25 179.35 1p77 h TYR 69 N 0.70 0.76 0.00 0.00 3.20 -0.92 -1.51 116.97 119.20 1p77 h TYR 69 Ca 0.07 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.95 1p77 h TYR 69 Cb 0.90 -0.23 -0.00 0.00 1.54 0.00 0.00 36.73 38.93 1p77 h TYR 69 CO 0.06 0.36 -0.08 1.96 -1.64 0.00 0.00 178.16 178.82 1p77 h GLN 70 N 0.75 0.00 0.00 1.82 1.08 -1.17 -2.29 115.11 115.30 1p77 h GLN 70 Ca 0.33 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.51 1p77 h GLN 70 Cb 0.22 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.65 1p77 h GLN 70 CO -0.19 0.08 -0.11 -0.07 -0.95 0.00 0.00 178.83 177.58 1p77 h LEU 71 N 0.00 0.00-10.11 1.46 3.38 -1.18 -3.47 115.31 105.39 1p77 h LEU 71 Ca -0.00 0.00 -0.50 0.00 0.09 0.00 0.00 57.88 57.47 1p77 h LEU 71 Cb 0.36 0.00 0.07 0.00 0.09 0.00 0.00 40.66 41.17 1p77 h LEU 71 CO 0.01 0.09 0.41 0.00 0.09 0.00 0.00 178.44 179.04 1p77 s ALA 72 N -3.17 2.69 -0.04 1.53 0.00 -0.87 -4.95 121.76 116.96 1p77 s ALA 72 Ca 0.06 0.70 -0.08 0.00 0.00 0.00 0.00 51.96 52.65 1p77 s ALA 72 Cb 0.06 -3.32 -0.29 0.00 0.00 0.00 0.00 23.12 19.56 1p77 s ALA 72 CO 0.69 -0.77 0.68 -0.44 0.00 0.00 0.00 175.76 175.91 1p77 h ASP 73 N 1.01 0.52 -4.71 0.00 3.32 -0.51 -3.48 116.42 112.57 1p77 h ASP 73 Ca -0.49 -0.81 -0.22 0.00 0.02 0.00 0.00 57.03 55.53 1p77 h ASP 73 Cb 1.25 -0.17 -0.16 0.00 0.22 0.00 0.00 39.33 40.47 1p77 h ASP 73 CO 0.57 1.69 -0.70 -1.61 -1.72 0.00 0.00 179.24 177.46 1p77 s GLU 74 N -2.59 0.74 0.11 3.56 0.41 -0.83 -4.99 118.70 115.11 1p77 s GLU 74 Ca -0.15 -1.20 -0.18 0.00 -0.41 0.00 0.00 54.97 53.03 1p77 s GLU 74 Cb 0.06 -0.18 0.04 0.00 -1.78 0.00 0.00 34.13 32.28 1p77 s GLU 74 CO 0.84 -0.01 0.45 1.52 -0.49 0.00 0.00 175.26 177.57 1p77 s TYR 75 N -3.17 -0.30 0.65 1.61 -0.85 -1.26 -0.67 117.35 113.37 1p77 s TYR 75 Ca 0.07 0.09 -0.08 0.00 -0.52 0.00 0.00 57.07 56.62 1p77 s TYR 75 Cb 0.02 0.31 0.02 0.00 0.38 0.00 0.00 41.96 42.69 1p77 s TYR 75 CO -0.04 -0.70 1.00 -1.54 -1.52 0.00 0.00 175.55 172.75 1p77 s SER 76 N -2.57 5.43 0.28 -0.18 1.04 -0.43 -4.89 113.70 112.39 1p77 s SER 76 Ca 0.00 0.87 -0.01 0.00 0.48 0.00 0.00 55.95 57.29 1p77 s SER 76 Cb 0.01 -1.74 0.47 0.00 0.10 0.00 0.00 66.02 64.86 1p77 s SER 76 CO -0.09 -1.25 1.89 -0.61 0.98 0.00 0.00 173.24 174.15 1p77 h GLN 77 N -0.44 1.08 -0.68 4.02 4.15 -1.99 0.12 115.11 121.37 1p77 h GLN 77 Ca -0.45 -0.06 0.02 0.00 0.77 0.00 0.00 58.65 58.93 1p77 h GLN 77 Cb 1.26 -0.24 -0.04 0.00 0.21 0.00 0.00 27.48 28.67 1p77 h GLN 77 CO 0.62 0.71 0.43 0.00 -1.93 0.00 0.00 178.83 178.67 1p77 h ARG 78 N 1.11 0.83 -0.29 1.69 3.08 -1.93 0.17 114.38 119.04 1p77 h ARG 78 Ca 0.43 -0.05 -0.15 0.00 0.07 0.00 0.00 59.98 60.28 1p77 h ARG 78 Cb 0.22 -0.19 -0.00 0.00 0.08 0.00 0.00 29.97 30.08 1p77 h ARG 78 CO -0.17 0.55 -0.38 0.00 -1.07 0.00 0.00 179.97 178.89 1p77 h ALA 79 N 1.28 0.44 -0.03 0.04 0.00 -1.66 -2.20 119.26 117.14 1p77 h ALA 79 Ca 0.27 -0.45 0.02 0.00 0.00 0.00 0.00 54.91 54.75 1p77 h ALA 79 Cb -0.02 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1p77 h ALA 79 CO -0.09 0.54 -0.08 -0.22 0.00 0.00 0.00 179.25 179.40 1p77 h LYS 80 N 0.54 -0.11 -0.29 0.00 3.64 -0.44 0.26 116.57 120.16 1p77 h LYS 80 Ca 0.04 0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.42 1p77 h LYS 80 Cb 0.98 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.81 1p77 h LYS 80 CO 0.09 -0.08 0.17 -0.07 -2.27 0.00 0.00 179.45 177.30 1p77 h LEU 81 N -0.12 0.34 -1.93 5.20 -0.00 -1.00 -1.96 115.31 115.84 1p77 h LEU 81 Ca 0.04 -0.05 -0.02 0.00 -0.00 0.00 0.00 57.88 57.85 1p77 h LEU 81 Cb 0.17 -0.09 -0.00 0.00 -0.00 0.00 0.00 40.66 40.74 1p77 h LEU 81 CO -0.10 0.29 -0.10 0.00 -0.00 0.00 0.00 178.44 178.53 1p77 h ALA 82 N 1.07 1.20 -6.31 1.53 0.00 -1.14 -3.46 119.26 112.14 1p77 h ALA 82 Ca 0.10 -0.09 -0.49 0.00 0.00 0.00 0.00 54.91 54.44 1p77 h ALA 82 Cb 0.01 -0.02 -0.10 0.00 0.00 0.00 0.00 17.79 17.68 1p77 h ALA 82 CO -0.02 0.12 -0.75 0.39 0.00 0.00 0.00 179.25 178.99 1p77 n GLU 83 N -3.49 -4.37 -3.48 0.00 1.02 0.88 -4.75 120.64 106.45 1p77 n GLU 83 Ca -0.01 0.50 -0.10 0.00 -0.02 0.00 0.00 57.16 57.53 1p77 n GLU 83 Cb 0.24 -5.32 -0.02 0.00 -0.02 0.00 0.00 31.44 26.32 1p77 n GLU 83 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1p77 s ALA 84 N -3.23 -1.75 -0.05 0.62 0.00 -1.13 -4.46 121.76 111.75 1p77 s ALA 84 Ca 0.66 0.89 -0.04 0.00 0.00 0.00 0.00 51.96 53.47 1p77 s ALA 84 Cb -0.34 0.48 0.02 0.00 0.00 0.00 0.00 23.12 23.28 1p77 s ALA 84 CO 0.81 -0.67 0.12 0.00 0.00 0.00 0.00 175.76 176.02 1p77 n ASN 86 N 3.24 1.59 -3.75 0.00 6.94 -0.99 -4.42 115.26 117.86 1p77 n ASN 86 Ca -0.15 -1.30 -0.14 0.00 -0.02 0.00 0.00 54.58 52.97 1p77 n ASN 86 Cb 0.58 0.05 -0.15 0.00 -2.36 0.00 0.00 39.78 37.90 1p77 n ASN 86 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 1p77 s THR 87 N -0.72 -0.06 0.02 5.53 2.01 -0.95 -1.01 115.64 120.46 1p77 s THR 87 Ca 0.09 0.20 0.08 0.00 0.31 0.00 0.00 61.69 62.37 1p77 s THR 87 Cb 0.07 -0.18 -0.02 0.00 0.01 0.00 0.00 72.50 72.37 1p77 s THR 87 CO 0.11 0.08 -0.23 -0.76 -0.69 0.00 0.00 174.62 173.13 1p77 s LEU 88 N 1.17 2.12 -0.08 4.42 1.43 0.22 -0.91 118.68 127.05 1p77 s LEU 88 Ca -0.09 -0.50 0.02 0.00 -1.03 0.00 0.00 54.13 52.54 1p77 s LEU 88 Cb -0.12 -1.14 0.01 0.00 0.03 0.00 0.00 46.19 44.97 1p77 s LEU 88 CO -0.05 0.24 -0.14 -0.75 0.23 0.00 0.00 176.35 175.88 1p77 s LYS 89 N -0.93 1.96 -0.37 1.70 2.20 -0.10 -1.13 119.74 123.07 1p77 s LYS 89 Ca 0.09 -0.49 -0.26 0.00 -0.36 0.00 0.00 55.97 54.95 1p77 s LYS 89 Cb -0.09 -1.64 0.02 0.00 -1.51 0.00 0.00 37.83 34.60 1p77 s LYS 89 CO 0.01 -0.00 0.93 0.21 -0.36 0.00 0.00 175.35 176.13 1p77 s LYS 90 N 0.80 3.85 0.79 4.03 2.20 -0.05 -1.23 119.74 130.12 1p77 s LYS 90 Ca -0.11 0.59 -0.11 0.00 -0.36 0.00 0.00 55.97 55.98 1p77 s LYS 90 Cb -0.16 -3.80 0.06 0.00 -1.51 0.00 0.00 37.83 32.43 1p77 s LYS 90 CO 0.02 -0.95 1.09 -0.51 -0.36 0.00 0.00 175.35 174.64 1p77 s LEU 91 N 3.48 2.75 0.54 5.43 1.43 0.11 -4.89 118.68 127.53 1p77 s LEU 91 Ca 0.38 1.54 0.23 0.00 -1.03 0.00 0.00 54.13 55.25 1p77 s LEU 91 Cb -0.12 -4.19 1.48 0.00 0.03 0.00 0.00 46.19 43.39 1p77 s LEU 91 CO 0.19 -2.01 2.16 0.44 0.23 0.00 0.00 176.35 177.36 1p77 h ASP 92 N -1.11 0.00 -0.08 2.29 3.32 -1.95 0.99 116.42 119.88 1p77 h ASP 92 Ca -0.46 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.59 1p77 h ASP 92 Cb 1.25 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.80 1p77 h ASP 92 CO 0.56 0.04 0.00 -0.90 -1.72 0.00 0.00 179.24 177.22 1p77 n ASP 93 N -4.12 0.89 0.00 6.45 3.85 -1.26 -4.89 116.55 117.47 1p77 n ASP 93 Ca -0.03 -1.53 0.00 0.00 -0.71 0.00 0.00 54.79 52.52 1p77 n ASP 93 Cb 0.13 -0.05 0.00 0.00 -1.35 0.00 0.00 41.12 39.85 1p77 n ASP 93 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1p77 n GLY 94 N 0.99 2.08 3.77 6.12 0.00 0.34 -5.06 105.19 113.43 1p77 n GLY 94 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 1p77 n GLY 94 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1p77 s LYS 95 N -0.92 4.39 -0.40 1.61 1.02 -1.26 -4.73 119.74 119.46 1p77 s LYS 95 Ca 0.00 2.17 -0.21 0.00 0.02 0.00 0.00 55.97 57.94 1p77 s LYS 95 Cb 0.00 -3.08 0.01 0.00 -0.52 0.00 0.00 37.83 34.24 1p77 s LYS 95 CO 0.00 -0.14 0.69 -0.51 -0.92 0.00 0.00 175.35 174.47 1p77 s LEU 96 N -1.76 4.30 -0.24 3.17 1.43 -1.26 0.05 118.68 124.37 1p77 s LEU 96 Ca 0.48 -0.01 -0.09 0.00 -1.03 0.00 0.00 54.13 53.49 1p77 s LEU 96 Cb -0.39 -2.84 -0.04 0.00 0.03 0.00 0.00 46.19 42.95 1p77 s LEU 96 CO 0.52 -0.73 0.11 -0.47 0.23 0.00 0.00 176.35 176.01 1p77 s TYR 97 N 2.92 3.18 -0.13 0.29 6.14 -0.37 0.28 117.35 129.67 1p77 s TYR 97 Ca 0.26 -0.09 -0.09 0.00 0.64 0.00 0.00 57.07 57.80 1p77 s TYR 97 Cb -0.14 -2.25 -0.04 0.00 0.42 0.00 0.00 41.96 39.95 1p77 s TYR 97 CO 0.18 -0.14 0.17 0.00 0.64 0.00 0.00 175.55 176.40 1p77 s ALA 98 N 1.31 3.81 0.26 3.97 0.00 0.15 -0.93 121.76 130.34 1p77 s ALA 98 Ca 0.06 -0.61 0.01 0.00 0.00 0.00 0.00 51.96 51.42 1p77 s ALA 98 Cb -0.15 -2.07 -0.05 0.00 0.00 0.00 0.00 23.12 20.86 1p77 s ALA 98 CO 0.05 0.49 0.09 0.34 0.00 0.00 0.00 175.76 176.73 1p77 s ASP 99 N -0.67 1.27 -0.21 0.00 3.68 -0.08 -1.32 116.67 119.34 1p77 s ASP 99 Ca 0.14 -1.38 -0.02 0.00 2.13 0.00 0.00 52.55 53.42 1p77 s ASP 99 Cb -0.12 0.15 0.06 0.00 -1.45 0.00 0.00 42.92 41.56 1p77 s ASP 99 CO 0.03 -0.72 0.03 0.21 0.13 0.00 0.00 175.17 174.85 1p77 s ASN 100 N -3.32 3.13 0.00 -0.34 3.84 -1.26 -2.24 114.94 114.75 1p77 s ASN 100 Ca 0.38 -0.94 0.22 0.00 0.21 0.00 0.00 52.86 52.73 1p77 s ASN 100 Cb 0.08 -0.70 0.52 0.00 -0.55 0.00 0.00 41.25 40.61 1p77 s ASN 100 CO 0.14 -0.30 1.44 0.35 -2.79 0.00 0.00 177.10 175.94 1p77 n THR 101 N 4.98 0.49 -0.17 -5.21 -2.24 -1.26 -4.35 114.28 106.53 1p77 n THR 101 Ca -0.09 -0.66 -0.08 0.00 -2.27 0.00 0.00 64.05 60.96 1p77 n THR 101 Cb 0.46 0.70 0.01 0.00 -2.10 0.00 0.00 70.33 69.41 1p77 n THR 101 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1p77 h ASP 102 N 3.70 0.61 -0.25 3.42 3.32 -1.89 0.43 116.42 125.76 1p77 h ASP 102 Ca 0.00 -0.10 -0.05 0.00 0.02 0.00 0.00 57.03 56.90 1p77 h ASP 102 Cb 0.82 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 40.21 1p77 h ASP 102 CO 0.00 0.54 -0.04 1.23 -1.72 0.00 0.00 179.24 179.24 1p77 h GLY 103 N 0.64 0.51 2.00 2.75 0.00 -1.70 -0.65 103.07 106.61 1p77 h GLY 103 Ca 0.17 -0.40 -0.09 0.00 0.00 0.00 0.00 47.33 47.00 1p77 h GLY 103 CO -0.03 0.37 -0.44 0.16 0.00 0.00 0.00 176.54 176.60 1p77 h ILE 104 N 0.22 1.07 -0.35 2.60 3.07 -1.80 -0.76 117.51 121.56 1p77 h ILE 104 Ca 0.07 -1.66 -0.03 0.00 1.55 0.00 0.00 64.86 64.78 1p77 h ILE 104 Cb 0.49 1.96 -0.01 0.00 -0.27 0.00 0.00 36.82 38.99 1p77 h ILE 104 CO 0.02 0.43 0.08 1.23 -1.05 0.00 0.00 178.15 178.87 1p77 h GLY 105 N 1.91 0.60 0.98 0.16 0.00 -0.60 0.37 103.07 106.49 1p77 h GLY 105 Ca -0.00 -0.38 0.00 0.00 0.00 0.00 0.00 47.33 46.95 1p77 h GLY 105 CO 0.06 0.35 0.01 -2.00 0.00 0.00 0.00 176.54 174.96 1p77 h LEU 106 N 0.41 0.02 -0.66 3.11 5.85 -0.75 -0.39 115.31 122.89 1p77 h LEU 106 Ca 0.11 -0.02 0.08 0.00 0.84 0.00 0.00 57.88 58.88 1p77 h LEU 106 Cb 0.30 -0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.26 1p77 h LEU 106 CO 0.00 0.03 0.34 0.58 -0.34 0.00 0.00 178.44 179.05 1p77 h VAL 107 N -0.00 0.89 -0.54 1.05 2.07 -1.02 -0.62 116.25 118.09 1p77 h VAL 107 Ca 0.00 -0.21 -0.04 0.00 0.82 0.00 0.00 66.70 67.28 1p77 h VAL 107 Cb 0.02 0.24 -0.02 0.00 -1.52 0.00 0.00 31.29 30.01 1p77 h VAL 107 CO -0.00 0.11 0.19 0.74 0.02 0.00 0.00 177.57 178.63 1p77 h THR 108 N 0.60 1.23 -0.41 2.57 2.02 -0.47 -1.02 112.91 117.42 1p77 h THR 108 Ca 0.31 -0.74 -0.07 0.00 0.77 0.00 0.00 66.41 66.69 1p77 h THR 108 Cb 0.28 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 67.38 1p77 h THR 108 CO -0.23 0.28 -0.01 -0.78 0.37 0.00 0.00 175.52 175.15 1p77 h ASP 109 N 0.73 0.72 -0.61 4.18 -0.00 -0.60 -1.36 116.42 119.48 1p77 h ASP 109 Ca 0.18 -0.31 0.02 0.00 -0.00 0.00 0.00 57.03 56.91 1p77 h ASP 109 Cb 0.24 -0.19 -0.03 0.00 -0.00 0.00 0.00 39.33 39.35 1p77 h ASP 109 CO -0.01 0.86 0.41 -0.07 -0.00 0.00 0.00 179.24 180.42 1p77 h LEU 110 N 0.56 0.67 -0.57 2.28 3.38 -0.95 -1.39 115.31 119.29 1p77 h LEU 110 Ca 0.12 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 58.00 1p77 h LEU 110 Cb 0.49 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 1p77 h LEU 110 CO 0.02 0.48 0.06 1.56 0.09 0.00 0.00 178.44 180.65 1p77 h GLN 111 N 0.79 0.96 -0.65 1.13 4.20 -0.79 0.29 115.11 121.04 1p77 h GLN 111 Ca 0.23 -0.28 0.09 0.00 0.06 0.00 0.00 58.65 58.75 1p77 h GLN 111 Cb -0.03 -0.10 -0.07 0.00 0.30 0.00 0.00 27.48 27.58 1p77 h GLN 111 CO -0.06 0.94 0.30 -0.09 -0.67 0.00 0.00 178.83 179.25 1p77 h ARG 112 N 0.85 0.51 0.00 1.46 2.43 -0.42 -0.94 114.38 118.27 1p77 h ARG 112 Ca 0.17 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.31 1p77 h ARG 112 Cb 0.46 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.90 1p77 h ARG 112 CO 0.02 0.34 0.00 1.28 -1.51 0.00 0.00 179.97 180.09 1p77 n LEU 113 N -4.91 0.00 -3.14 3.80 4.77 -0.60 -4.88 117.00 112.03 1p77 n LEU 113 Ca 0.09 0.32 -0.22 0.00 -0.03 0.00 0.00 56.01 56.17 1p77 n LEU 113 Cb 0.25 -0.32 0.06 0.00 -2.33 0.00 0.00 43.42 41.09 1p77 n LEU 113 CO 0.24 -0.05 0.12 0.59 -1.33 0.00 0.00 177.39 176.97 1p77 n ASN 114 N -1.32 -6.02 -1.93 -1.43 5.03 -0.32 -4.90 115.26 104.36 1p77 n ASN 114 Ca 0.11 -0.39 -0.23 0.00 0.87 0.00 0.00 54.58 54.94 1p77 n ASN 114 Cb 0.22 -4.74 0.05 0.00 -1.02 0.00 0.00 39.78 34.28 1p77 n ASN 114 CO 0.00 0.00 0.00 0.79 -1.83 0.00 0.00 177.26 176.22 1p77 n TRP 115 N -4.67 2.57 -2.67 3.10 7.02 0.88 -4.72 117.44 118.95 1p77 n TRP 115 Ca -0.05 -2.25 -0.09 0.00 -1.02 0.00 0.00 57.50 54.10 1p77 n TRP 115 Cb 0.58 -0.48 0.05 0.00 -2.42 0.00 0.00 31.31 29.05 1p77 n TRP 115 CO 0.00 0.00 0.00 -0.11 -2.02 0.00 0.00 177.69 175.56 1p77 n LEU 116 N -0.78 0.71 -4.77 -0.99 7.94 -1.25 -4.81 117.00 113.06 1p77 n LEU 116 Ca 0.44 -3.65 -0.39 0.00 -1.11 0.00 0.00 56.01 51.30 1p77 n LEU 116 Cb 0.92 0.34 -0.02 0.00 0.53 0.00 0.00 43.42 45.18 1p77 n LEU 116 CO 0.41 1.63 0.84 -0.13 -1.11 0.00 0.00 177.39 179.04 1p77 s ARG 117 N -2.40 4.16 0.36 1.96 3.00 -1.26 -4.94 118.95 119.83 1p77 s ARG 117 Ca 0.26 1.86 -0.27 0.00 0.00 0.00 0.00 55.73 57.57 1p77 s ARG 117 Cb 0.45 -2.77 -0.12 0.00 0.00 0.00 0.00 34.95 32.51 1p77 s ARG 117 CO 0.01 -0.24 1.23 -2.30 0.00 0.00 0.00 175.30 174.01 1p77 n PRO 118 N 0.27 1.94 -1.28 3.54 -0.02 -1.26 -2.41 135.00 135.78 1p77 n PRO 118 Ca 0.03 0.68 -0.10 0.00 -2.02 0.00 0.00 63.50 62.10 1p77 n PRO 118 Cb 0.46 -2.26 -0.04 0.00 -0.02 0.00 0.00 33.50 31.64 1p77 n PRO 118 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1p77 n ASN 119 N 0.68 -4.62 -4.71 2.55 3.02 0.18 -4.99 115.26 107.37 1p77 n ASN 119 Ca 0.06 0.24 -0.35 0.00 -0.03 0.00 0.00 54.58 54.50 1p77 n ASN 119 Cb 0.37 -2.96 0.10 0.00 -0.61 0.00 0.00 39.78 36.67 1p77 n ASN 119 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1p77 s GLN 120 N -2.62 2.01 -0.39 3.52 -0.21 -1.01 -4.74 119.66 116.22 1p77 s GLN 120 Ca 0.00 1.85 -0.10 0.00 0.02 0.00 0.00 55.36 57.12 1p77 s GLN 120 Cb 0.00 -1.81 0.04 0.00 1.00 0.00 0.00 33.01 32.24 1p77 s GLN 120 CO 0.00 -1.96 0.22 -1.01 -2.12 0.00 0.00 175.29 170.42 1p77 s HIS 121 N -1.89 3.27 -0.12 0.91 3.76 -1.26 -1.18 115.29 118.77 1p77 s HIS 121 Ca 0.76 -1.13 0.02 0.00 -0.15 0.00 0.00 55.06 54.56 1p77 s HIS 121 Cb -0.31 -2.57 -0.01 0.00 1.11 0.00 0.00 32.58 30.80 1p77 s HIS 121 CO 0.46 -0.71 -0.19 0.08 -0.85 0.00 0.00 174.74 173.54 1p77 s VAL 122 N 1.52 2.52 -0.21 -0.90 1.01 -0.60 0.11 120.40 123.85 1p77 s VAL 122 Ca 0.02 -0.85 -0.08 0.00 0.00 0.00 0.00 61.98 61.07 1p77 s VAL 122 Cb -0.20 -2.02 -0.04 0.00 0.00 0.00 0.00 36.38 34.12 1p77 s VAL 122 CO 0.05 0.54 0.08 -0.22 0.00 0.00 0.00 175.10 175.55 1p77 s LEU 123 N 0.43 3.76 -0.19 3.92 2.96 0.17 -1.00 118.68 128.74 1p77 s LEU 123 Ca -0.14 0.01 -0.01 0.00 -0.22 0.00 0.00 54.13 53.77 1p77 s LEU 123 Cb -0.17 -1.98 -0.00 0.00 0.50 0.00 0.00 46.19 44.55 1p77 s LEU 123 CO 0.06 0.10 -0.11 -0.63 -1.32 0.00 0.00 176.35 174.44 1p77 s ILE 124 N 0.83 2.87 -0.26 6.68 1.01 0.22 -0.46 121.20 132.09 1p77 s ILE 124 Ca 0.04 -0.68 -0.13 0.00 0.00 0.00 0.00 60.65 59.88 1p77 s ILE 124 Cb -0.13 -2.26 -0.04 0.00 0.01 0.00 0.00 42.46 40.04 1p77 s ILE 124 CO 0.02 0.48 0.30 -0.76 0.00 0.00 0.00 174.94 174.98 1p77 s LEU 125 N 1.16 4.05 0.00 2.97 1.43 -0.02 -1.67 118.68 126.61 1p77 s LEU 125 Ca 0.01 0.20 0.00 0.00 -1.03 0.00 0.00 54.13 53.32 1p77 s LEU 125 Cb -0.14 -2.31 0.00 0.00 0.03 0.00 0.00 46.19 43.77 1p77 s LEU 125 CO -0.04 -0.10 0.00 0.61 0.23 0.00 0.00 176.35 177.05 1p77 n GLY 126 N 4.67 2.78 2.78 -3.19 0.00 0.51 -0.44 105.19 112.30 1p77 n GLY 126 Ca -0.11 -1.61 -0.03 0.00 0.00 0.00 0.00 46.02 44.27 1p77 n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p77 n ALA 127 N 0.92 2.86 -1.71 4.61 0.00 -1.26 -4.72 120.51 121.21 1p77 n ALA 127 Ca 0.00 -2.85 0.00 0.00 0.00 0.00 0.00 53.44 50.59 1p77 n ALA 127 Cb 0.00 -0.90 0.00 0.00 0.00 0.00 0.00 19.45 18.55 1p77 n ALA 127 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1p77 n GLY 128 N -0.43 0.98 0.27 0.00 0.00 -1.26 -4.77 105.19 99.98 1p77 n GLY 128 Ca 0.07 -1.90 -0.01 0.00 0.00 0.00 0.00 46.02 44.18 1p77 n GLY 128 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1p77 h GLY 129 N 0.00 0.59 0.65 -0.02 0.00 -1.97 -1.91 103.07 100.40 1p77 h GLY 129 Ca 0.00 -0.38 0.03 0.00 0.00 0.00 0.00 47.33 46.99 1p77 h GLY 129 CO 0.00 0.35 -0.04 0.00 0.00 0.00 0.00 176.54 176.85 1p77 h ALA 130 N 1.43 0.12 -0.56 3.60 0.00 -1.94 0.19 119.26 122.10 1p77 h ALA 130 Ca 0.10 0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.99 1p77 h ALA 130 Cb 0.42 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 1p77 h ALA 130 CO 0.02 -0.48 0.01 1.15 0.00 0.00 0.00 179.25 179.95 1p77 h THR 131 N 0.00 1.26 -0.35 0.00 2.02 -1.76 -2.47 112.91 111.61 1p77 h THR 131 Ca 0.08 -1.11 0.01 0.00 0.77 0.00 0.00 66.41 66.17 1p77 h THR 131 Cb 0.13 0.86 -0.02 0.00 -1.74 0.00 0.00 68.15 67.38 1p77 h THR 131 CO -0.18 0.40 0.23 0.50 0.37 0.00 0.00 175.52 176.84 1p77 h LYS 132 N 0.87 0.43 0.00 6.66 3.64 -0.73 -1.29 116.57 126.16 1p77 h LYS 132 Ca 0.16 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 1p77 h LYS 132 Cb 0.53 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.25 1p77 h LYS 132 CO 0.03 0.28 0.00 0.41 -2.27 0.00 0.00 179.45 177.90 1p77 n GLY 133 N -1.49 -1.34 0.00 5.01 0.00 0.62 -4.04 105.19 103.96 1p77 n GLY 133 Ca 0.03 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.94 1p77 n GLY 133 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1p77 n VAL 134 N -1.42 0.00 -0.18 1.61 0.24 -0.55 -2.64 118.33 115.38 1p77 n VAL 134 Ca 0.09 -0.26 -0.02 0.00 -2.04 0.00 0.00 64.34 62.11 1p77 n VAL 134 Cb 0.28 0.75 0.08 0.00 -1.47 0.00 0.00 33.84 33.48 1p77 n VAL 134 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 1p77 h LEU 135 N 0.00 0.29 0.30 1.34 3.38 -1.51 -2.31 115.31 116.79 1p77 h LEU 135 Ca 0.00 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 1p77 h LEU 135 Cb 0.03 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1p77 h LEU 135 CO 0.00 0.19 -0.21 0.25 0.09 0.00 0.00 178.44 178.76 1p77 h LEU 136 N 0.45 -0.54 -1.38 1.67 5.85 -1.86 0.17 115.31 119.66 1p77 h LEU 136 Ca 0.26 0.04 -0.06 0.00 0.84 0.00 0.00 57.88 58.96 1p77 h LEU 136 Cb 0.26 0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.45 1p77 h LEU 136 CO -0.23 -0.33 -0.29 -0.65 -0.34 0.00 0.00 178.44 176.60 1p77 h PRO 137 N -0.50 0.03 -0.22 5.25 0.11 -1.87 0.11 132.00 134.91 1p77 h PRO 137 Ca -0.02 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 66.02 1p77 h PRO 137 Cb 0.43 -0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.53 1p77 h PRO 137 CO 0.01 0.32 -0.07 -0.07 -0.21 0.00 0.00 178.00 177.98 1p77 h LEU 138 N 0.03 0.44 -0.94 2.35 3.38 -1.08 -1.12 115.31 118.37 1p77 h LEU 138 Ca 0.00 -0.38 -0.01 0.00 0.09 0.00 0.00 57.88 57.58 1p77 h LEU 138 Cb 0.53 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.11 1p77 h LEU 138 CO 0.04 0.72 0.51 -0.07 0.09 0.00 0.00 178.44 179.72 1p77 h LEU 139 N 0.16 1.12 -1.85 1.67 3.38 -0.34 -1.27 115.31 118.17 1p77 h LEU 139 Ca 0.05 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 1p77 h LEU 139 Cb 0.53 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 1p77 h LEU 139 CO 0.02 0.89 -0.11 1.56 0.09 0.00 0.00 178.44 180.89 1p77 h GLN 140 N 1.26 0.00 -0.64 1.13 4.20 -0.62 -0.52 115.11 119.93 1p77 h GLN 140 Ca 0.32 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.03 1p77 h GLN 140 Cb 0.01 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.79 1p77 h GLN 140 CO -0.05 0.11 0.00 0.00 -0.67 0.00 0.00 178.83 178.21 1p77 n ALA 141 N -2.23 2.85 -3.32 3.87 0.00 -0.44 -4.89 120.51 116.35 1p77 n ALA 141 Ca -0.01 -0.71 -0.22 0.00 0.00 0.00 0.00 53.44 52.49 1p77 n ALA 141 Cb 0.26 -1.03 0.06 0.00 0.00 0.00 0.00 19.45 18.74 1p77 n ALA 141 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1p77 n GLN 142 N 0.32 -6.46 -3.18 0.00 6.02 -0.20 -4.51 117.38 109.37 1p77 n GLN 142 Ca 0.11 0.82 -0.39 0.00 -0.01 0.00 0.00 57.00 57.54 1p77 n GLN 142 Cb 0.51 -5.69 -0.05 0.00 1.02 0.00 0.00 30.24 26.02 1p77 n GLN 142 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1p77 s GLN 143 N -6.01 4.38 -0.36 -1.09 -1.52 -0.99 0.50 119.66 114.58 1p77 s GLN 143 Ca 0.45 0.68 -0.19 0.00 -1.95 0.00 0.00 55.36 54.36 1p77 s GLN 143 Cb -0.20 -3.43 0.00 0.00 -0.22 0.00 0.00 33.01 29.16 1p77 s GLN 143 CO 0.56 0.14 0.58 -0.80 -0.25 0.00 0.00 175.29 175.52 1p77 s ASN 144 N 0.61 6.37 -0.14 5.90 0.01 -0.33 -4.49 114.94 122.87 1p77 s ASN 144 Ca 0.32 0.05 -0.03 0.00 -0.71 0.00 0.00 52.86 52.49 1p77 s ASN 144 Cb -0.17 -2.30 -0.03 0.00 0.41 0.00 0.00 41.25 39.17 1p77 s ASN 144 CO 0.15 -0.54 -0.05 -0.63 -1.51 0.00 0.00 177.10 174.51 1p77 s ILE 145 N 2.56 3.76 -0.27 0.60 1.01 0.88 -1.55 121.20 128.18 1p77 s ILE 145 Ca 0.22 -0.41 -0.10 0.00 0.00 0.00 0.00 60.65 60.36 1p77 s ILE 145 Cb -0.15 -2.63 -0.04 0.00 0.01 0.00 0.00 42.46 39.65 1p77 s ILE 145 CO 0.14 0.51 0.15 -0.69 0.00 0.00 0.00 174.94 175.05 1p77 s VAL 146 N 0.26 4.97 -0.15 2.92 1.01 -0.17 0.27 120.40 129.51 1p77 s VAL 146 Ca -0.04 0.05 -0.04 0.00 0.00 0.00 0.00 61.98 61.96 1p77 s VAL 146 Cb -0.14 -3.35 -0.03 0.00 0.00 0.00 0.00 36.38 32.86 1p77 s VAL 146 CO 0.03 0.28 -0.03 -0.22 0.00 0.00 0.00 175.10 175.16 1p77 s LEU 147 N 1.70 3.29 0.00 3.92 2.96 0.12 -0.61 118.68 130.07 1p77 s LEU 147 Ca 0.07 -0.10 0.02 0.00 -0.22 0.00 0.00 54.13 53.89 1p77 s LEU 147 Cb -0.16 -1.79 -0.01 0.00 0.50 0.00 0.00 46.19 44.74 1p77 s LEU 147 CO 0.08 0.19 -0.05 0.00 -1.32 0.00 0.00 176.35 175.25 1p77 s ALA 148 N 0.24 0.42 0.02 5.97 0.00 -0.67 -0.54 121.76 127.20 1p77 s ALA 148 Ca -0.02 -0.30 -0.07 0.00 0.00 0.00 0.00 51.96 51.57 1p77 s ALA 148 Cb -0.14 -0.08 -0.00 0.00 0.00 0.00 0.00 23.12 22.90 1p77 s ALA 148 CO 0.03 0.08 0.14 1.21 0.00 0.00 0.00 175.76 177.21 1p77 s ASN 149 N -0.35 0.08 0.27 0.00 2.47 -1.26 -0.36 114.94 115.79 1p77 s ASN 149 Ca -0.00 -0.35 0.00 0.00 0.42 0.00 0.00 52.86 52.93 1p77 s ASN 149 Cb -0.03 0.23 0.57 0.00 -1.45 0.00 0.00 41.25 40.57 1p77 s ASN 149 CO -0.00 -0.45 1.76 -0.09 -3.72 0.00 0.00 177.10 174.60 1p77 h ARG 150 N 3.90 0.63 -4.55 0.43 2.43 -1.98 -3.36 114.38 111.89 1p77 h ARG 150 Ca -0.32 -0.04 -0.71 0.00 -0.81 0.00 0.00 59.98 58.10 1p77 h ARG 150 Cb 1.19 -0.14 -0.23 0.00 -0.42 0.00 0.00 29.97 30.37 1p77 h ARG 150 CO 0.45 0.42 -0.48 0.99 -1.51 0.00 0.00 179.97 179.84 1p77 s THR 151 N -5.95 4.85 0.31 0.20 2.01 -1.26 -4.88 115.64 110.92 1p77 s THR 151 Ca -0.12 -0.79 -0.01 0.00 0.31 0.00 0.00 61.69 61.08 1p77 s THR 151 Cb 0.22 -3.71 0.22 0.00 0.01 0.00 0.00 72.50 69.24 1p77 s THR 151 CO 0.78 -0.27 1.93 0.15 -0.69 0.00 0.00 174.62 176.52 1p77 h PHE 152 N 8.52 0.90 -0.86 4.92 3.04 -1.95 -3.05 116.94 128.47 1p77 h PHE 152 Ca -0.26 -0.02 0.07 0.00 3.98 0.00 0.00 57.97 61.75 1p77 h PHE 152 Cb 1.11 -0.29 -0.06 0.00 2.56 0.00 0.00 35.95 39.27 1p77 h PHE 152 CO 0.56 0.63 0.56 0.66 -2.02 0.00 0.00 178.31 178.70 1p77 h SER 153 N 0.93 0.81 0.07 0.41 4.64 -1.94 -0.61 113.55 117.85 1p77 h SER 153 Ca 0.24 0.01 -0.13 0.00 -0.47 0.00 0.00 61.79 61.44 1p77 h SER 153 Cb 0.03 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 61.95 1p77 h SER 153 CO -0.04 0.51 -0.43 0.11 -0.87 0.00 0.00 176.83 176.11 1p77 h LYS 154 N 0.92 0.45 -0.18 4.77 1.57 -1.89 -1.41 116.57 120.79 1p77 h LYS 154 Ca 0.38 -0.24 -0.00 0.00 -1.87 0.00 0.00 60.65 58.92 1p77 h LYS 154 Cb 0.28 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.59 1p77 h LYS 154 CO -0.14 0.80 0.11 1.15 -0.57 0.00 0.00 179.45 180.80 1p77 h THR 155 N 0.37 1.07 -0.60 -0.16 2.02 -1.16 -2.21 112.91 112.25 1p77 h THR 155 Ca 0.03 -0.17 -0.07 0.00 0.77 0.00 0.00 66.41 66.96 1p77 h THR 155 Cb 0.91 0.86 -0.02 0.00 -1.74 0.00 0.00 68.15 68.16 1p77 h THR 155 CO 0.08 0.07 0.08 0.50 0.37 0.00 0.00 175.52 176.62 1p77 h LYS 156 N 0.22 0.98 -0.54 6.66 1.63 -1.14 -0.66 116.57 123.71 1p77 h LYS 156 Ca 0.07 -0.25 -0.02 0.00 -0.85 0.00 0.00 60.65 59.60 1p77 h LYS 156 Cb 0.02 -0.12 -0.03 0.00 -0.60 0.00 0.00 32.23 31.50 1p77 h LYS 156 CO -0.01 0.91 0.28 0.93 -3.45 0.00 0.00 179.45 178.11 1p77 h GLU 157 N 0.92 0.77 -0.36 1.90 5.08 -1.11 0.25 114.58 122.03 1p77 h GLU 157 Ca 0.18 -0.10 -0.09 0.00 -1.00 0.00 0.00 59.36 58.35 1p77 h GLU 157 Cb 0.42 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 1p77 h GLU 157 CO 0.01 0.61 -0.12 -0.07 -1.00 0.00 0.00 179.01 178.45 1p77 h LEU 158 N 0.73 0.73 -0.78 1.33 3.38 -1.04 0.19 115.31 119.85 1p77 h LEU 158 Ca 0.19 -0.38 0.01 0.00 0.09 0.00 0.00 57.88 57.79 1p77 h LEU 158 Cb 0.08 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.59 1p77 h LEU 158 CO -0.03 0.95 0.52 0.00 0.09 0.00 0.00 178.44 179.96 1p77 h ALA 159 N 0.81 0.99 -0.56 1.53 0.00 -0.94 0.09 119.26 121.18 1p77 h ALA 159 Ca 0.09 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1p77 h ALA 159 Cb 0.64 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1p77 h ALA 159 CO 0.04 0.41 0.24 1.49 0.00 0.00 0.00 179.25 181.43 1p77 h GLU 160 N 1.06 0.82 -0.69 0.00 4.81 -0.63 -0.21 114.58 119.75 1p77 h GLU 160 Ca 0.29 -0.14 -0.05 0.00 -0.13 0.00 0.00 59.36 59.32 1p77 h GLU 160 Cb -0.12 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.09 1p77 h GLU 160 CO -0.06 0.70 0.21 -0.09 -0.73 0.00 0.00 179.01 179.04 1p77 h ARG 161 N 0.76 1.06 -0.02 1.92 2.43 0.21 -3.17 114.38 117.57 1p77 h ARG 161 Ca 0.19 -0.22 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1p77 h ARG 161 Cb 0.18 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.57 1p77 h ARG 161 CO -0.02 0.91 -0.32 1.19 -1.51 0.00 0.00 179.97 180.21 1p77 n PHE 162 N -4.26 0.00 -0.33 2.20 3.72 -0.06 -4.46 117.46 114.26 1p77 n PHE 162 Ca 0.06 0.00 0.25 0.00 -0.05 0.00 0.00 57.45 57.70 1p77 n PHE 162 Cb 0.22 -0.01 0.53 0.00 -0.94 0.00 0.00 39.48 39.28 1p77 n PHE 162 CO 0.00 0.00 0.00 0.37 -0.05 0.00 0.00 176.76 177.08 1p77 h GLN 163 N 2.80 0.33 0.00 -1.08 5.75 -1.00 0.27 115.11 122.18 1p77 h GLN 163 Ca 0.00 -0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.48 1p77 h GLN 163 Cb 0.77 -0.08 0.00 0.00 1.07 0.00 0.00 27.48 29.25 1p77 h GLN 163 CO 0.00 0.22 0.00 -2.30 -2.65 0.00 0.00 178.83 174.10 1p77 n PRO 164 N -4.62 0.14 0.00 -2.39 -0.02 -1.26 -3.28 135.00 123.56 1p77 n PRO 164 Ca 0.27 0.43 0.09 0.00 -2.02 0.00 0.00 63.50 62.26 1p77 n PRO 164 Cb 0.95 -1.79 -0.08 0.00 -0.02 0.00 0.00 33.50 32.56 1p77 n PRO 164 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1p77 n TYR 165 N -2.05 0.00 -2.10 6.00 4.02 0.93 -5.06 117.16 118.89 1p77 n TYR 165 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.91 1p77 n TYR 165 Cb 0.17 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.49 1p77 n TYR 165 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1p77 n GLY 166 N 1.39 -0.57 3.49 2.72 0.00 -1.21 -4.44 105.19 106.59 1p77 n GLY 166 Ca 0.04 -0.75 -0.42 0.00 0.00 0.00 0.00 46.02 44.89 1p77 n GLY 166 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1p77 s ASN 167 N -4.00 6.17 -0.03 1.61 0.01 -1.26 -4.68 114.94 112.76 1p77 s ASN 167 Ca 0.00 -0.62 -0.00 0.00 -0.71 0.00 0.00 52.86 51.53 1p77 s ASN 167 Cb 0.00 -2.20 0.03 0.00 0.41 0.00 0.00 41.25 39.48 1p77 s ASN 167 CO 0.00 -0.50 0.02 -0.51 -1.51 0.00 0.00 177.10 174.60 1p77 s ILE 168 N 2.02 0.08 -0.14 0.60 2.07 -1.26 -0.08 121.20 124.48 1p77 s ILE 168 Ca 0.11 0.19 -0.02 0.00 -1.41 0.00 0.00 60.65 59.52 1p77 s ILE 168 Cb -0.17 -0.22 -0.02 0.00 0.13 0.00 0.00 42.46 42.17 1p77 s ILE 168 CO 0.12 0.15 -0.09 -1.58 -1.91 0.00 0.00 174.94 171.63 1p77 s GLN 169 N 1.35 3.51 -0.06 3.50 0.74 0.14 -4.93 119.66 123.91 1p77 s GLN 169 Ca -0.05 -0.61 -0.22 0.00 0.05 0.00 0.00 55.36 54.53 1p77 s GLN 169 Cb -0.13 -2.76 -0.04 0.00 1.10 0.00 0.00 33.01 31.18 1p77 s GLN 169 CO -0.03 0.22 0.63 0.00 -0.55 0.00 0.00 175.29 175.56 1p77 s ALA 170 N 0.37 3.40 0.08 1.58 0.00 -1.26 0.13 121.76 126.07 1p77 s ALA 170 Ca -0.08 0.05 0.02 0.00 0.00 0.00 0.00 51.96 51.96 1p77 s ALA 170 Cb -0.15 -2.84 -0.03 0.00 0.00 0.00 0.00 23.12 20.09 1p77 s ALA 170 CO 0.04 -0.01 -0.08 0.14 0.00 0.00 0.00 175.76 175.85 1p77 s VAL 171 N 0.49 0.71 0.60 0.00 -7.23 0.29 -4.93 120.40 110.34 1p77 s VAL 171 Ca 0.34 -1.58 -0.18 0.00 -1.81 0.00 0.00 61.98 58.75 1p77 s VAL 171 Cb -0.17 -1.25 -0.03 0.00 0.56 0.00 0.00 36.38 35.49 1p77 s VAL 171 CO 0.16 -0.63 1.20 -0.55 -0.31 0.00 0.00 175.10 174.98 1p77 s SER 172 N -2.40 5.15 0.48 4.85 0.15 -1.26 -4.25 113.70 116.41 1p77 s SER 172 Ca 0.03 2.36 0.22 0.00 0.70 0.00 0.00 55.95 59.26 1p77 s SER 172 Cb -0.02 -2.60 1.22 0.00 -1.71 0.00 0.00 66.02 62.92 1p77 s SER 172 CO -0.02 -1.62 2.02 -0.03 1.20 0.00 0.00 173.24 174.79 1p77 h MET 173 N 0.79 0.00 -0.14 5.44 4.05 -1.90 -2.20 114.93 120.97 1p77 h MET 173 Ca -0.50 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 58.92 1p77 h MET 173 Cb 1.29 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.09 1p77 h MET 173 CO 0.55 0.17 0.00 -0.25 0.23 0.00 0.00 176.91 177.61 1p77 n ASP 174 N -3.90 1.86 -2.61 1.39 9.92 -1.26 -4.01 116.55 117.93 1p77 n ASP 174 Ca -0.02 -1.70 -0.14 0.00 -0.53 0.00 0.00 54.79 52.40 1p77 n ASP 174 Cb 0.26 -0.09 0.02 0.00 -0.64 0.00 0.00 41.12 40.67 1p77 n ASP 174 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 1p77 n SER 175 N 0.45 2.33 -4.70 -2.24 7.64 -0.83 -5.06 113.62 111.20 1p77 n SER 175 Ca 0.17 -2.96 -0.42 0.00 1.01 0.00 0.00 58.87 56.67 1p77 n SER 175 Cb 0.37 -0.51 -0.03 0.00 -1.01 0.00 0.00 64.21 63.04 1p77 n SER 175 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1p77 s ILE 176 N -3.78 4.13 0.16 0.44 1.01 -1.19 -4.54 121.20 117.42 1p77 s ILE 176 Ca 0.33 1.50 -0.33 0.00 0.00 0.00 0.00 60.65 62.14 1p77 s ILE 176 Cb 0.44 -3.96 -0.13 0.00 0.01 0.00 0.00 42.46 38.82 1p77 s ILE 176 CO -0.02 0.05 1.63 -2.65 0.00 0.00 0.00 174.94 173.94 1p77 n PRO 177 N 4.66 2.30 -2.45 2.79 -0.02 -1.26 -4.86 135.00 136.16 1p77 n PRO 177 Ca 0.10 0.83 -0.43 0.00 -2.02 0.00 0.00 63.50 61.98 1p77 n PRO 177 Cb 0.46 -2.62 -0.02 0.00 -0.02 0.00 0.00 33.50 31.30 1p77 n PRO 177 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1p77 s LEU 178 N 1.12 3.58 0.26 2.45 2.96 -1.26 -4.93 118.68 122.87 1p77 s LEU 178 Ca 0.79 0.63 -0.21 0.00 -0.22 0.00 0.00 54.13 55.11 1p77 s LEU 178 Cb -0.64 -3.50 0.03 0.00 0.50 0.00 0.00 46.19 42.58 1p77 s LEU 178 CO 0.37 -1.39 0.70 -1.10 -1.32 0.00 0.00 176.35 173.61 1p77 s GLN 179 N 4.80 1.70 -0.06 1.98 -1.52 -1.26 -5.12 119.66 120.18 1p77 s GLN 179 Ca 0.55 -0.89 -0.28 0.00 -1.95 0.00 0.00 55.36 52.79 1p77 s GLN 179 Cb -0.11 0.61 -0.02 0.00 -0.22 0.00 0.00 33.01 33.27 1p77 s GLN 179 CO 0.32 -0.77 0.92 0.99 -0.25 0.00 0.00 175.29 176.50 1p77 s THR 180 N -3.89 4.88 -0.19 -0.19 2.01 -1.26 -4.76 115.64 112.24 1p77 s THR 180 Ca 0.09 1.90 -0.08 0.00 0.31 0.00 0.00 61.69 63.90 1p77 s THR 180 Cb -0.05 -4.25 -0.04 0.00 0.01 0.00 0.00 72.50 68.17 1p77 s THR 180 CO 0.03 0.12 0.08 -0.31 -0.69 0.00 0.00 174.62 173.86 1p77 s TYR 181 N 1.37 3.31 0.43 4.92 1.51 -1.26 -4.95 117.35 122.68 1p77 s TYR 181 Ca 0.47 0.16 0.20 0.00 -1.01 0.00 0.00 57.07 56.89 1p77 s TYR 181 Cb -0.19 -2.10 1.19 0.00 -0.11 0.00 0.00 41.96 40.75 1p77 s TYR 181 CO 0.22 0.21 2.02 -0.44 -1.11 0.00 0.00 175.55 176.44 1p77 h ASP 182 N 6.66 0.00 -3.64 2.29 3.32 -0.70 -0.69 116.42 123.66 1p77 h ASP 182 Ca -0.38 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.57 1p77 h ASP 182 Cb 1.16 0.00 -0.24 0.00 0.22 0.00 0.00 39.33 40.47 1p77 h ASP 182 CO 0.72 0.17 -0.16 -0.22 -1.72 0.00 0.00 179.24 178.03 1p77 s LEU 183 N -8.01 -0.06 -0.11 1.55 2.96 -1.16 -2.87 118.68 110.98 1p77 s LEU 183 Ca -0.03 1.02 0.03 0.00 -0.22 0.00 0.00 54.13 54.93 1p77 s LEU 183 Cb 0.15 1.68 0.00 0.00 0.50 0.00 0.00 46.19 48.52 1p77 s LEU 183 CO 0.65 -0.19 -0.22 -0.69 -1.32 0.00 0.00 176.35 174.58 1p77 s VAL 184 N 0.71 1.95 -0.16 1.68 1.01 -0.34 -0.65 120.40 124.60 1p77 s VAL 184 Ca -0.04 -0.94 -0.00 0.00 0.00 0.00 0.00 61.98 61.00 1p77 s VAL 184 Cb -0.05 -1.71 -0.00 0.00 0.00 0.00 0.00 36.38 34.62 1p77 s VAL 184 CO -0.05 0.53 -0.14 -0.63 0.00 0.00 0.00 175.10 174.81 1p77 s ILE 185 N 0.55 2.77 -0.21 2.22 1.01 0.40 -0.48 121.20 127.46 1p77 s ILE 185 Ca -0.14 -0.73 -0.20 0.00 0.00 0.00 0.00 60.65 59.58 1p77 s ILE 185 Cb -0.17 -2.18 -0.03 0.00 0.01 0.00 0.00 42.46 40.10 1p77 s ILE 185 CO 0.05 0.51 0.58 0.21 0.00 0.00 0.00 174.94 176.29 1p77 s ASN 186 N 0.81 6.62 -0.11 3.58 2.47 0.03 -0.84 114.94 127.50 1p77 s ASN 186 Ca -0.05 0.75 0.15 0.00 0.42 0.00 0.00 52.86 54.14 1p77 s ASN 186 Cb -0.15 -2.32 0.34 0.00 -1.45 0.00 0.00 41.25 37.66 1p77 s ASN 186 CO 0.00 -0.25 1.16 0.00 -3.72 0.00 0.00 177.10 174.30 1p77 n ALA 187 N 5.03 2.80 -2.74 1.71 0.00 0.42 -1.28 120.51 126.45 1p77 n ALA 187 Ca -0.03 -2.59 -0.25 0.00 0.00 0.00 0.00 53.44 50.57 1p77 n ALA 187 Cb 0.50 -0.49 -0.02 0.00 0.00 0.00 0.00 19.45 19.44 1p77 n ALA 187 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1p77 s THR 188 N -1.79 5.16 -0.14 0.00 -4.23 -1.16 -4.62 115.64 108.86 1p77 s THR 188 Ca 0.31 -0.46 -0.27 0.00 -1.18 0.00 0.00 61.69 60.08 1p77 s THR 188 Cb 0.31 -3.80 -0.25 0.00 1.34 0.00 0.00 72.50 70.09 1p77 s THR 188 CO -0.07 -0.36 0.69 0.77 -0.54 0.00 0.00 174.62 175.11 1p77 h SER 189 N 1.37 0.05 0.00 3.99 4.64 -1.96 -3.46 113.55 118.18 1p77 h SER 189 Ca -0.49 -0.92 0.00 0.00 -0.47 0.00 0.00 61.79 59.91 1p77 h SER 189 Cb 1.21 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1p77 h SER 189 CO 0.64 1.13 0.00 0.00 -0.87 0.00 0.00 176.83 177.73 1p77 n ALA 190 N -2.75 0.00 -3.24 5.18 0.00 -1.26 -5.11 120.51 113.33 1p77 n ALA 190 Ca -0.14 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.12 1p77 n ALA 190 Cb 0.55 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.94 1p77 n ALA 190 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1p77 s SER 198 N 0.00 0.69 0.16 0.00 1.04 -1.26 -4.98 113.70 109.35 1p77 s SER 198 Ca 0.00 -2.18 -0.34 0.00 0.48 0.00 0.00 55.95 53.91 1p77 s SER 198 Cb 0.00 0.48 -0.15 0.00 0.10 0.00 0.00 66.02 66.45 1p77 s SER 198 CO 0.00 -0.18 1.33 0.55 0.98 0.00 0.00 173.24 175.92 1p77 n VAL 199 N 3.42 0.53 -1.67 5.02 3.14 -1.26 -4.86 118.33 122.65 1p77 n VAL 199 Ca 0.20 -0.13 -0.51 0.00 -2.96 0.00 0.00 64.34 60.94 1p77 n VAL 199 Cb 0.48 -1.08 -0.05 0.00 -1.06 0.00 0.00 33.84 32.13 1p77 n VAL 199 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 1p77 n ASP 200 N 2.40 3.08 0.12 6.55 2.03 -1.26 -4.85 116.55 124.62 1p77 n ASP 200 Ca 0.15 0.93 0.16 0.00 0.52 0.00 0.00 54.79 56.56 1p77 n ASP 200 Cb 0.25 -1.31 0.72 0.00 -0.72 0.00 0.00 41.12 40.06 1p77 n ASP 200 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1p77 h ALA 201 N 9.20 2.19 -0.25 -1.67 0.00 -2.00 0.53 119.26 127.26 1p77 h ALA 201 Ca -0.46 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.44 1p77 h ALA 201 Cb 1.29 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 1p77 h ALA 201 CO 0.96 -0.41 0.14 0.93 0.00 0.00 0.00 179.25 180.87 1p77 h GLU 202 N 0.00 0.33 0.07 0.00 4.39 -2.00 -1.29 114.58 116.07 1p77 h GLU 202 Ca 0.15 -0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.82 1p77 h GLU 202 Cb 0.64 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.22 1p77 h GLU 202 CO -0.00 0.24 -0.03 0.82 -1.16 0.00 0.00 179.01 178.88 1p77 h ILE 203 N 0.34 1.20 -0.62 3.13 1.08 -1.26 -3.27 117.51 118.11 1p77 h ILE 203 Ca 0.09 -0.98 0.11 0.00 -0.39 0.00 0.00 64.86 63.69 1p77 h ILE 203 Cb 0.00 1.83 -0.08 0.00 -3.07 0.00 0.00 36.82 35.50 1p77 h ILE 203 CO -0.02 0.24 0.18 -0.07 -0.69 0.00 0.00 178.15 177.79 1p77 h LEU 204 N -0.54 0.10 -2.13 1.44 3.38 -1.35 -1.70 115.31 114.50 1p77 h LEU 204 Ca -0.01 0.10 0.08 0.00 0.09 0.00 0.00 57.88 58.14 1p77 h LEU 204 Cb 0.47 0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 1p77 h LEU 204 CO 0.02 0.05 0.29 0.11 0.09 0.00 0.00 178.44 179.00 1p77 h LYS 205 N 0.32 0.00 0.00 1.13 1.57 -1.30 -1.41 116.57 116.88 1p77 h LYS 205 Ca 0.32 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.10 1p77 h LYS 205 Cb 0.46 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.77 1p77 h LYS 205 CO -0.38 0.00 -0.86 -0.07 -0.57 0.00 0.00 179.45 177.58 1p77 h LEU 206 N 0.00 0.00-10.06 2.94 3.38 -1.38 -3.48 115.31 106.71 1p77 h LEU 206 Ca 0.13 -0.11 -0.55 0.00 0.09 0.00 0.00 57.88 57.43 1p77 h LEU 206 Cb 0.71 0.00 0.14 0.00 0.09 0.00 0.00 40.66 41.60 1p77 h LEU 206 CO -0.00 0.06 0.60 -0.83 0.09 0.00 0.00 178.44 178.35 1p77 s GLY 207 N -4.05 2.89 0.01 0.83 0.00 -0.53 -4.39 107.32 102.08 1p77 s GLY 207 Ca 0.02 1.33 0.20 0.00 0.00 0.00 0.00 44.72 46.28 1p77 s GLY 207 CO 0.76 1.84 0.61 1.44 0.00 0.00 0.00 173.10 177.75 1p77 n SER 208 N -1.23 0.37 -3.65 1.64 7.64 -0.27 -4.95 113.62 113.17 1p77 n SER 208 Ca 0.12 0.15 -0.15 0.00 1.01 0.00 0.00 58.87 60.00 1p77 n SER 208 Cb 0.45 1.09 -0.08 0.00 -1.01 0.00 0.00 64.21 64.67 1p77 n SER 208 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1p77 s ALA 209 N -3.18 -1.37 -0.07 -0.43 0.00 -1.14 -4.74 121.76 110.83 1p77 s ALA 209 Ca -0.06 1.25 0.01 0.00 0.00 0.00 0.00 51.96 53.16 1p77 s ALA 209 Cb 0.11 -0.46 0.02 0.00 0.00 0.00 0.00 23.12 22.79 1p77 s ALA 209 CO 0.85 -0.29 -0.07 -0.06 0.00 0.00 0.00 175.76 176.19 1p77 s PHE 210 N -0.45 1.16 -0.11 0.00 0.08 0.46 -1.20 117.98 117.92 1p77 s PHE 210 Ca -0.06 -0.45 0.02 0.00 0.12 0.00 0.00 56.93 56.56 1p77 s PHE 210 Cb -0.03 -0.97 0.01 0.00 -0.57 0.00 0.00 43.02 41.47 1p77 s PHE 210 CO 0.04 -0.33 -0.16 -0.47 -0.10 0.00 0.00 175.22 174.21 1p77 s TYR 211 N 1.20 2.05 -0.22 0.36 6.14 0.37 -0.68 117.35 126.57 1p77 s TYR 211 Ca -0.06 -0.98 -0.09 0.00 0.64 0.00 0.00 57.07 56.59 1p77 s TYR 211 Cb -0.14 -1.47 -0.04 0.00 0.42 0.00 0.00 41.96 40.73 1p77 s TYR 211 CO -0.02 -0.49 0.11 0.34 0.64 0.00 0.00 175.55 176.12 1p77 s ASP 212 N 0.98 5.79 0.54 4.32 3.68 0.38 -0.79 116.67 131.57 1p77 s ASP 212 Ca -0.06 0.06 0.35 0.00 2.13 0.00 0.00 52.55 55.02 1p77 s ASP 212 Cb -0.15 -2.02 1.54 0.00 -1.45 0.00 0.00 42.92 40.84 1p77 s ASP 212 CO -0.02 0.10 2.03 0.24 0.13 0.00 0.00 175.17 177.65 1p77 h MET 213 N 7.26 0.00 -7.05 4.34 2.86 -1.51 0.57 114.93 121.40 1p77 h MET 213 Ca -0.38 0.00 -0.46 0.00 -2.06 0.00 0.00 59.70 56.81 1p77 h MET 213 Cb 1.17 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.83 1p77 h MET 213 CO 0.67 0.00 0.36 -0.65 1.06 0.00 0.00 176.91 178.35 1p77 s GLN 214 N -3.73 4.07 -0.17 1.72 -1.52 -1.26 -4.25 119.66 114.53 1p77 s GLN 214 Ca 0.00 1.26 -0.02 0.00 -1.95 0.00 0.00 55.36 54.65 1p77 s GLN 214 Cb 0.10 -2.21 0.05 0.00 -0.22 0.00 0.00 33.01 30.73 1p77 s GLN 214 CO 0.49 -0.18 0.01 -0.47 -0.25 0.00 0.00 175.29 174.89 1p77 s TYR 215 N -2.03 1.10 -0.52 0.91 5.04 -1.26 -1.52 117.35 119.07 1p77 s TYR 215 Ca 0.63 -0.78 -0.17 0.00 -2.44 0.00 0.00 57.07 54.31 1p77 s TYR 215 Cb -0.14 -1.04 0.09 0.00 0.35 0.00 0.00 41.96 41.22 1p77 s TYR 215 CO 0.17 -0.56 0.55 0.00 -1.34 0.00 0.00 175.55 174.38 1p77 s ALA 216 N 1.83 3.50 -0.26 3.97 0.00 -1.26 -5.01 121.76 124.53 1p77 s ALA 216 Ca 0.00 -2.14 -0.37 0.00 0.00 0.00 0.00 51.96 49.46 1p77 s ALA 216 Cb -0.16 -3.30 -0.13 0.00 0.00 0.00 0.00 23.12 19.54 1p77 s ALA 216 CO -0.07 -2.01 1.96 1.17 0.00 0.00 0.00 175.76 176.81 1p77 n LYS 217 N 5.73 1.38 -2.14 0.00 0.00 -1.26 -0.98 118.16 120.90 1p77 n LYS 217 Ca -0.11 0.46 -0.15 0.00 0.00 0.00 0.00 58.31 58.52 1p77 n LYS 217 Cb 0.43 -2.38 -0.02 0.00 0.00 0.00 0.00 35.03 33.06 1p77 n LYS 217 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1p77 n GLY 218 N 5.21 0.07 3.88 3.14 0.00 -1.26 -5.01 105.19 111.22 1p77 n GLY 218 Ca 0.32 -0.26 -0.03 0.00 0.00 0.00 0.00 46.02 46.05 1p77 n GLY 218 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1p77 s THR 219 N -2.72 0.00 0.06 2.61 -1.32 -0.15 -5.14 115.64 108.98 1p77 s THR 219 Ca 0.00 -0.59 -0.29 0.00 -1.21 0.00 0.00 61.69 59.60 1p77 s THR 219 Cb 0.00 -2.89 -0.05 0.00 -1.51 0.00 0.00 72.50 68.06 1p77 s THR 219 CO 0.00 0.00 0.94 -1.81 -2.21 0.00 0.00 174.62 171.54 1p77 s ASP 220 N -3.40 7.41 0.89 8.08 1.01 -1.26 -4.37 116.67 125.03 1p77 s ASP 220 Ca 0.22 1.70 -0.11 0.00 0.71 0.00 0.00 52.55 55.06 1p77 s ASP 220 Cb -0.03 -2.57 0.13 0.00 1.01 0.00 0.00 42.92 41.47 1p77 s ASP 220 CO 0.05 -0.12 1.09 0.42 0.21 0.00 0.00 175.17 176.82 1p77 s THR 221 N 0.35 2.68 0.22 -1.27 -4.23 -1.26 -4.73 115.64 107.40 1p77 s THR 221 Ca 0.47 0.22 -0.07 0.00 -1.18 0.00 0.00 61.69 61.13 1p77 s THR 221 Cb -0.22 -2.66 0.17 0.00 1.34 0.00 0.00 72.50 71.13 1p77 s THR 221 CO 0.28 -0.29 1.76 -0.65 -0.54 0.00 0.00 174.62 175.19 1p77 h PRO 222 N -1.56 0.52 -0.22 3.99 0.11 -1.96 -0.53 132.00 132.35 1p77 h PRO 222 Ca -0.49 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.59 1p77 h PRO 222 Cb 1.28 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 1p77 h PRO 222 CO 0.53 0.34 0.14 0.35 -0.21 0.00 0.00 178.00 179.16 1p77 h PHE 223 N 0.53 0.28 -0.58 0.65 3.04 -1.93 -0.32 116.94 118.61 1p77 h PHE 223 Ca 0.35 0.00 -0.07 0.00 3.98 0.00 0.00 57.97 62.23 1p77 h PHE 223 Cb 0.40 -0.10 -0.02 0.00 2.56 0.00 0.00 35.95 38.79 1p77 h PHE 223 CO -0.13 0.19 0.08 0.82 -2.02 0.00 0.00 178.31 177.25 1p77 h ILE 224 N 0.29 1.26 -0.47 1.41 1.08 -1.82 -0.99 117.51 118.27 1p77 h ILE 224 Ca 0.08 -1.01 0.07 0.00 -0.39 0.00 0.00 64.86 63.61 1p77 h ILE 224 Cb -0.02 0.79 -0.06 0.00 -3.07 0.00 0.00 36.82 34.46 1p77 h ILE 224 CO -0.02 0.37 0.15 0.00 -0.69 0.00 0.00 178.15 177.96 1p77 h ALA 225 N 1.00 0.56 -0.04 1.87 0.00 -0.83 0.19 119.26 122.01 1p77 h ALA 225 Ca 0.17 0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.18 1p77 h ALA 225 Cb 0.44 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.25 1p77 h ALA 225 CO 0.01 -0.25 -0.19 1.25 0.00 0.00 0.00 179.25 180.08 1p77 h LEU 226 N 0.31 -0.56 -0.72 0.00 6.46 -0.68 0.24 115.31 120.36 1p77 h LEU 226 Ca 0.23 0.09 0.05 0.00 -0.12 0.00 0.00 57.88 58.12 1p77 h LEU 226 Cb 0.25 0.24 -0.05 0.00 -0.73 0.00 0.00 40.66 40.37 1p77 h LEU 226 CO -0.25 -0.25 0.44 0.00 -0.62 0.00 0.00 178.44 177.76 1p77 h LYS 228 N 0.83 0.10 0.00 0.00 1.57 -0.04 0.25 116.57 119.28 1p77 h LYS 228 Ca 0.31 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.06 1p77 h LYS 228 Cb 0.10 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.40 1p77 h LYS 228 CO -0.15 0.35 0.00 -1.13 -0.57 0.00 0.00 179.45 177.95 1p77 n SER 229 N -4.21 0.55 -1.25 0.86 3.41 0.02 -1.77 113.62 111.24 1p77 n SER 229 Ca -0.02 0.61 0.11 0.00 -0.26 0.00 0.00 58.87 59.32 1p77 n SER 229 Cb 0.33 -0.74 0.28 0.00 -0.26 0.00 0.00 64.21 63.82 1p77 n SER 229 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1p77 n LEU 230 N -2.08 3.73 0.00 1.04 4.77 -0.77 -4.92 117.00 118.77 1p77 n LEU 230 Ca 0.03 -1.82 0.00 0.00 -0.03 0.00 0.00 56.01 54.19 1p77 n LEU 230 Cb 0.27 -0.39 0.00 0.00 -2.33 0.00 0.00 43.42 40.97 1p77 n LEU 230 CO 0.21 0.89 0.00 0.61 -1.33 0.00 0.00 177.39 177.77 1p77 n GLY 231 N 1.54 0.39 3.82 -0.72 0.00 -0.73 -4.99 105.19 104.50 1p77 n GLY 231 Ca 0.22 -1.02 -0.38 0.00 0.00 0.00 0.00 46.02 44.84 1p77 n GLY 231 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1p77 s LEU 232 N 0.00 4.49 0.00 0.99 1.43 0.01 -4.96 118.68 120.64 1p77 s LEU 232 Ca 0.00 1.06 0.00 0.00 -1.03 0.00 0.00 54.13 54.16 1p77 s LEU 232 Cb 0.00 -2.69 0.00 0.00 0.03 0.00 0.00 46.19 43.53 1p77 s LEU 232 CO 0.00 0.30 0.00 0.41 0.23 0.00 0.00 176.35 177.29 1p77 n THR 233 N 1.84 0.00 -2.59 5.49 -1.04 -1.26 -3.86 114.28 112.86 1p77 n THR 233 Ca -0.13 0.00 -0.43 0.00 -2.04 0.00 0.00 64.05 61.45 1p77 n THR 233 Cb 0.52 -0.54 0.00 0.00 -1.82 0.00 0.00 70.33 68.49 1p77 n THR 233 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 1p77 n ASN 234 N -1.56 4.94 -4.22 8.00 5.15 -1.26 -4.93 115.26 121.38 1p77 n ASN 234 Ca 0.00 -2.96 -0.17 0.00 -0.60 0.00 0.00 54.58 50.86 1p77 n ASN 234 Cb 0.31 -1.64 -0.11 0.00 -0.53 0.00 0.00 39.78 37.81 1p77 n ASN 234 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 1p77 s VAL 235 N 2.60 1.19 -0.10 3.44 -7.23 -1.26 -0.40 120.40 118.64 1p77 s VAL 235 Ca 0.47 -1.70 -0.15 0.00 -1.81 0.00 0.00 61.98 58.79 1p77 s VAL 235 Cb 0.03 -1.48 0.04 0.00 0.56 0.00 0.00 36.38 35.53 1p77 s VAL 235 CO 0.02 -0.48 0.38 -0.55 -0.31 0.00 0.00 175.10 174.17 1p77 s SER 236 N -2.47 -0.35 0.71 4.85 0.15 0.15 -4.95 113.70 111.78 1p77 s SER 236 Ca 0.08 0.55 -0.03 0.00 0.70 0.00 0.00 55.95 57.26 1p77 s SER 236 Cb -0.04 0.63 0.08 0.00 -1.71 0.00 0.00 66.02 64.97 1p77 s SER 236 CO 0.02 -0.27 0.48 -0.90 1.20 0.00 0.00 173.24 173.77 1p77 n ASP 237 N 2.22 0.39 -2.11 5.45 3.85 -1.26 -0.47 116.55 124.61 1p77 n ASP 237 Ca -0.16 -1.39 -0.13 0.00 -0.71 0.00 0.00 54.79 52.40 1p77 n ASP 237 Cb 0.57 -0.34 0.27 0.00 -1.35 0.00 0.00 41.12 40.26 1p77 n ASP 237 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1p77 n GLY 238 N 1.52 3.95 0.28 6.12 0.00 0.20 -4.52 105.19 112.74 1p77 n GLY 238 Ca 0.07 -1.03 -0.03 0.00 0.00 0.00 0.00 46.02 45.03 1p77 n GLY 238 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1p77 h PHE 239 N 2.12 0.76 -0.23 1.61 3.57 -1.85 -2.15 116.94 120.78 1p77 h PHE 239 Ca 0.40 -0.10 -0.07 0.00 3.53 0.00 0.00 57.97 61.74 1p77 h PHE 239 Cb 2.55 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 41.07 1p77 h PHE 239 CO 1.42 0.71 -0.16 0.78 -2.23 0.00 0.00 178.31 178.83 1p77 h GLY 240 N 0.95 0.41 1.20 2.40 0.00 -1.98 -1.49 103.07 104.55 1p77 h GLY 240 Ca 0.14 -0.29 -0.11 0.00 0.00 0.00 0.00 47.33 47.07 1p77 h GLY 240 CO 0.02 0.27 -0.10 1.98 0.00 0.00 0.00 176.54 178.70 1p77 h MET 241 N 0.35 0.95 -0.50 4.80 1.85 -1.67 0.22 114.93 120.94 1p77 h MET 241 Ca 0.06 -0.33 -0.05 0.00 -0.61 0.00 0.00 59.70 58.77 1p77 h MET 241 Cb 0.50 -0.07 -0.02 0.00 0.43 0.00 0.00 31.60 32.44 1p77 h MET 241 CO 0.03 0.99 0.12 1.25 -0.40 0.00 0.00 176.91 178.90 1p77 h LEU 242 N 0.85 0.77 -0.31 3.39 5.85 -0.80 -0.99 115.31 124.06 1p77 h LEU 242 Ca 0.14 -0.24 -0.16 0.00 0.84 0.00 0.00 57.88 58.46 1p77 h LEU 242 Cb 0.64 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 41.46 1p77 h LEU 242 CO 0.04 0.80 -0.45 0.58 -0.34 0.00 0.00 178.44 179.08 1p77 h VAL 243 N 0.69 1.28 -0.47 1.05 2.07 -1.03 -2.94 116.25 116.90 1p77 h VAL 243 Ca 0.16 -1.63 -0.11 0.00 0.82 0.00 0.00 66.70 65.94 1p77 h VAL 243 Cb 0.34 1.56 -0.01 0.00 -1.52 0.00 0.00 31.29 31.65 1p77 h VAL 243 CO 0.00 0.53 -0.14 0.00 0.02 0.00 0.00 177.57 177.99 1p77 h ALA 244 N 0.71 0.65 -0.51 1.67 0.00 -0.45 -1.31 119.26 120.01 1p77 h ALA 244 Ca 0.03 -0.35 -0.04 0.00 0.00 0.00 0.00 54.91 54.55 1p77 h ALA 244 Cb 1.05 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 1p77 h ALA 244 CO 0.10 0.58 0.15 -0.56 0.00 0.00 0.00 179.25 179.52 1p77 h GLN 245 N 0.77 0.77 -0.59 0.00 -0.00 -1.23 -1.04 115.11 113.79 1p77 h GLN 245 Ca 0.12 -0.14 -0.03 0.00 -0.00 0.00 0.00 58.65 58.60 1p77 h GLN 245 Cb 0.70 -0.13 -0.03 0.00 -0.00 0.00 0.00 27.48 28.02 1p77 h GLN 245 CO 0.05 0.68 0.25 0.00 -0.00 0.00 0.00 178.83 179.80 1p77 h ALA 246 N 1.42 0.77 -0.79 0.06 0.00 -1.31 0.27 119.26 119.67 1p77 h ALA 246 Ca 0.17 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 1p77 h ALA 246 Cb 0.24 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1p77 h ALA 246 CO -0.01 0.37 0.31 0.00 0.00 0.00 0.00 179.25 179.92 1p77 h ALA 247 N 1.09 1.05 -0.47 0.00 0.00 -0.54 0.12 119.26 120.51 1p77 h ALA 247 Ca 0.20 -0.20 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 1p77 h ALA 247 Cb 0.18 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1p77 h ALA 247 CO -0.02 0.67 -0.24 0.45 0.00 0.00 0.00 179.25 180.11 1p77 h HIS 248 N 1.16 1.16 -0.88 0.00 3.86 -0.92 -0.37 115.15 119.15 1p77 h HIS 248 Ca 0.26 -0.29 -0.02 0.00 -1.16 0.00 0.00 60.37 59.16 1p77 h HIS 248 Cb 0.22 -0.27 -0.04 0.00 1.06 0.00 0.00 27.41 28.39 1p77 h HIS 248 CO 0.02 1.12 0.46 0.77 0.86 0.00 0.00 177.93 181.17 1p77 h SER 249 N 0.85 1.13 -0.43 2.45 0.02 -0.57 -1.52 113.55 115.48 1p77 h SER 249 Ca 0.10 -0.12 -0.01 0.00 -0.84 0.00 0.00 61.79 60.93 1p77 h SER 249 Cb 0.83 -0.29 -0.02 0.00 0.14 0.00 0.00 62.40 63.06 1p77 h SER 249 CO 0.07 0.92 0.23 0.15 -1.14 0.00 0.00 176.83 177.07 1p77 h PHE 250 N 1.25 0.59 -0.84 3.45 3.04 -0.40 -1.56 116.94 122.46 1p77 h PHE 250 Ca 0.31 -0.02 0.04 0.00 3.98 0.00 0.00 57.97 62.28 1p77 h PHE 250 Cb 0.06 -0.19 -0.05 0.00 2.56 0.00 0.00 35.95 38.33 1p77 h PHE 250 CO 0.01 0.45 0.53 1.25 -2.02 0.00 0.00 178.31 178.54 1p77 h HIS 251 N 0.56 1.00 -0.62 0.41 2.76 -0.76 -1.13 115.15 117.36 1p77 h HIS 251 Ca 0.15 0.03 -0.02 0.00 -2.20 0.00 0.00 60.37 58.32 1p77 h HIS 251 Cb 0.06 -0.33 -0.03 0.00 1.55 0.00 0.00 27.41 28.66 1p77 h HIS 251 CO -0.02 0.55 0.29 1.25 -1.30 0.00 0.00 177.93 178.71 1p77 h LEU 252 N 1.02 0.81 -0.26 0.26 5.85 -0.68 -1.32 115.31 120.99 1p77 h LEU 252 Ca 0.35 -0.13 -0.12 0.00 0.84 0.00 0.00 57.88 58.81 1p77 h LEU 252 Cb 0.06 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 40.88 1p77 h LEU 252 CO -0.13 0.72 -0.30 -0.50 -0.34 0.00 0.00 178.44 177.89 1p77 h TRP 253 N 0.85 0.80 0.00 1.25 6.55 -0.81 -3.38 115.95 121.21 1p77 h TRP 253 Ca 0.21 -0.25 -0.07 0.00 0.95 0.00 0.00 58.89 59.73 1p77 h TRP 253 Cb 0.13 -0.17 -0.01 0.00 -0.86 0.00 0.00 29.16 28.25 1p77 h TRP 253 CO 0.00 0.99 -1.88 0.54 -1.05 0.00 0.00 178.44 177.04 1p77 n ARG 254 N -4.28 0.71 -1.33 0.49 5.12 -0.47 -5.00 116.66 111.89 1p77 n ARG 254 Ca -0.04 -0.13 -0.11 0.00 -1.93 0.00 0.00 57.85 55.63 1p77 n ARG 254 Cb 0.48 -1.42 -0.05 0.00 -1.16 0.00 0.00 32.46 30.31 1p77 n ARG 254 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1p77 n GLY 255 N 1.61 1.26 2.97 -0.13 0.00 -0.50 -4.99 105.19 105.40 1p77 n GLY 255 Ca -0.09 -0.45 -0.23 0.00 0.00 0.00 0.00 46.02 45.26 1p77 n GLY 255 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1p77 s VAL 256 N -2.40 0.90 -0.37 1.61 0.11 -1.26 -5.06 120.40 113.93 1p77 s VAL 256 Ca 0.00 -0.34 -0.25 0.00 -2.93 0.00 0.00 61.98 58.47 1p77 s VAL 256 Cb 0.00 -0.85 0.01 0.00 -1.53 0.00 0.00 36.38 34.01 1p77 s VAL 256 CO 0.00 0.30 0.86 -0.32 -3.33 0.00 0.00 175.10 172.61 1p77 s MET 257 N 0.77 3.79 0.74 1.54 1.75 -1.26 -3.86 119.30 122.78 1p77 s MET 257 Ca -0.13 0.44 -0.14 0.00 -1.25 0.00 0.00 55.69 54.62 1p77 s MET 257 Cb -0.15 -3.81 0.05 0.00 2.84 0.00 0.00 34.83 33.75 1p77 s MET 257 CO 0.02 -0.91 1.15 -2.14 -0.65 0.00 0.00 175.02 172.49 1p77 s PRO 258 N 3.31 2.18 -0.79 4.11 0.02 -1.26 -4.89 135.00 137.68 1p77 s PRO 258 Ca 0.35 1.54 -0.26 0.00 0.02 0.00 0.00 61.00 62.65 1p77 s PRO 258 Cb -0.12 -1.86 0.02 0.00 0.02 0.00 0.00 34.50 32.55 1p77 s PRO 258 CO 0.18 -1.75 1.47 0.34 -0.33 0.00 0.00 177.00 176.91 1p77 s ASP 259 N -2.47 6.00 0.15 2.53 3.68 -1.26 -4.88 116.67 120.41 1p77 s ASP 259 Ca 0.69 -0.55 -0.28 0.00 2.13 0.00 0.00 52.55 54.54 1p77 s ASP 259 Cb -0.24 -2.56 -0.02 0.00 -1.45 0.00 0.00 42.92 38.65 1p77 s ASP 259 CO 0.47 -1.93 1.58 0.15 0.13 0.00 0.00 175.17 175.57 1p77 h PHE 260 N 10.97 -1.24 -0.26 -5.34 3.57 -1.97 -2.37 116.94 120.29 1p77 h PHE 260 Ca -0.14 0.06 0.05 0.00 3.53 0.00 0.00 57.97 61.47 1p77 h PHE 260 Cb 1.06 0.59 -0.05 0.00 2.79 0.00 0.00 35.95 40.34 1p77 h PHE 260 CO 1.15 -0.45 -0.06 0.28 -2.23 0.00 0.00 178.31 177.00 1p77 h VAL 261 N -0.38 0.75 0.00 1.41 2.07 -1.99 -0.38 116.25 117.74 1p77 h VAL 261 Ca 0.12 -0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.67 1p77 h VAL 261 Cb 0.60 0.74 -0.04 0.00 -1.52 0.00 0.00 31.29 31.07 1p77 h VAL 261 CO -0.52 0.00 -0.22 0.28 0.02 0.00 0.00 177.57 177.13 1p77 h SER 262 N 0.00 -0.65 -0.72 0.57 0.02 -1.91 0.39 113.55 111.25 1p77 h SER 262 Ca 0.12 0.09 -0.06 0.00 -0.84 0.00 0.00 61.79 61.10 1p77 h SER 262 Cb 0.19 0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.97 1p77 h SER 262 CO -0.26 -0.29 0.20 0.58 -1.14 0.00 0.00 176.83 175.92 1p77 h VAL 263 N -0.35 1.26 -0.30 2.27 2.07 -1.23 0.22 116.25 120.20 1p77 h VAL 263 Ca 0.06 -0.94 0.05 0.00 0.82 0.00 0.00 66.70 66.69 1p77 h VAL 263 Cb 0.43 0.49 -0.04 0.00 -1.52 0.00 0.00 31.29 30.65 1p77 h VAL 263 CO -0.20 0.36 0.03 0.22 0.02 0.00 0.00 177.57 178.00 1p77 h TYR 264 N 1.08 0.03 -0.57 1.57 5.03 -0.62 0.75 116.97 124.24 1p77 h TYR 264 Ca 0.23 0.02 0.02 0.00 2.58 0.00 0.00 58.73 61.58 1p77 h TYR 264 Cb 0.34 0.03 -0.03 0.00 1.55 0.00 0.00 36.73 38.61 1p77 h TYR 264 CO 0.03 -0.02 0.36 0.93 -1.32 0.00 0.00 178.16 178.14 1p77 h GLU 265 N 0.12 0.71 -0.50 1.82 5.08 0.70 0.71 114.58 123.22 1p77 h GLU 265 Ca 0.14 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.42 1p77 h GLU 265 Cb 0.17 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 1p77 h GLU 265 CO -0.21 0.47 0.16 1.96 -1.00 0.00 0.00 179.01 180.38 1p77 h GLN 266 N 0.73 0.78 -0.50 2.33 4.20 -0.60 0.31 115.11 122.36 1p77 h GLN 266 Ca 0.22 -0.17 -0.03 0.00 0.06 0.00 0.00 58.65 58.74 1p77 h GLN 266 Cb -0.03 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 27.62 1p77 h GLN 266 CO -0.08 0.72 0.21 -0.07 -0.67 0.00 0.00 178.83 178.94 1p77 h LEU 267 N 0.68 0.68 -1.17 1.46 3.38 -0.62 1.16 115.31 120.88 1p77 h LEU 267 Ca 0.16 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1p77 h LEU 267 Cb 0.27 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.81 1p77 h LEU 267 CO -0.01 0.65 0.29 0.11 0.09 0.00 0.00 178.44 179.58 1p77 h LYS 268 N 0.66 0.87 -0.02 1.13 1.79 -0.46 0.42 116.57 120.96 1p77 h LYS 268 Ca 0.17 -0.11 -0.01 0.00 -2.18 0.00 0.00 60.65 58.52 1p77 h LYS 268 Cb 0.18 -0.17 -0.00 0.00 -1.58 0.00 0.00 32.23 30.66 1p77 h LYS 268 CO -0.02 0.68 -0.01 -0.22 -1.08 0.00 0.00 179.45 178.80 1p77 h LYS 269 N 0.87 0.05 -0.59 3.15 3.11 0.75 -1.36 116.57 122.55 1p77 h LYS 269 Ca 0.22 -0.02 0.06 0.00 -2.81 0.00 0.00 60.65 58.09 1p77 h LYS 269 Cb 0.10 -0.00 -0.09 0.00 -1.00 0.00 0.00 32.23 31.24 1p77 h LYS 269 CO -0.03 0.49 -0.54 0.00 -2.81 0.00 0.00 179.45 176.56 1p77 h ALA 270 N 0.56 -0.67 -0.20 5.00 0.00 0.20 -1.15 119.26 123.00 1p77 h ALA 270 Ca 0.00 0.04 0.04 0.00 0.00 0.00 0.00 54.91 54.99 1p77 h ALA 270 Cb 0.47 1.20 -0.04 0.00 0.00 0.00 0.00 17.79 19.42 1p77 h ALA 270 CO 0.00 -0.97 -0.05 -1.33 0.00 0.00 0.00 179.25 176.90 1p77 n MET 271 N -5.17 -0.02 0.00 0.00 2.81 0.14 -5.06 117.12 109.82 1p77 n MET 271 Ca -0.01 0.31 0.08 0.00 -1.81 0.00 0.00 57.70 56.26 1p77 n MET 271 Cb 0.29 -0.46 0.07 0.00 -0.71 0.00 0.00 33.22 32.41 1p77 n MET 271 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76