#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yz0 s SER 2 N 0.00 0.79 0.35 7.83 0.01 -1.26 -4.71 113.70 116.71 2yz0 s SER 2 Ca 0.00 -0.17 0.03 0.00 1.31 0.00 0.00 55.95 57.12 2yz0 s SER 2 Cb 0.00 -0.07 0.03 0.00 0.21 0.00 0.00 66.02 66.19 2yz0 s SER 2 CO 0.00 0.05 0.23 0.18 0.41 0.00 0.00 173.24 174.11 2yz0 n LEU 3 N 2.74 0.00 -0.05 2.44 7.99 -1.26 -5.05 117.00 123.80 2yz0 n LEU 3 Ca -0.14 -1.87 -0.07 0.00 -0.01 0.00 0.00 56.01 53.91 2yz0 n LEU 3 Cb 0.57 0.00 -0.05 0.00 -0.11 0.00 0.00 43.42 43.83 2yz0 n LEU 3 CO 0.25 -0.45 0.50 0.28 -1.51 0.00 0.00 177.39 176.46 2yz0 h SER 4 N 0.46 -0.95 0.00 -1.43 0.02 -2.04 -3.44 113.55 106.18 2yz0 h SER 4 Ca -0.23 0.12 0.00 0.00 -0.84 0.00 0.00 61.79 60.84 2yz0 h SER 4 Cb 0.82 0.38 0.00 0.00 0.14 0.00 0.00 62.40 63.75 2yz0 h SER 4 CO 0.36 -0.22 0.00 1.41 -1.14 0.00 0.00 176.83 177.24 2yz0 n HIS 5 N -4.08 -1.34 -2.54 3.45 8.25 -1.26 -5.06 115.22 112.65 2yz0 n HIS 5 Ca -0.02 0.24 -0.43 0.00 -0.26 0.00 0.00 57.72 57.25 2yz0 n HIS 5 Cb 0.18 0.42 -0.02 0.00 1.12 0.00 0.00 29.99 31.69 2yz0 n HIS 5 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2yz0 s LEU 6 N -6.36 4.17 0.08 2.41 1.02 -1.26 -5.01 118.68 113.73 2yz0 s LEU 6 Ca 0.00 1.59 -0.08 0.00 0.02 0.00 0.00 54.13 55.65 2yz0 s LEU 6 Cb 0.00 -3.54 -0.00 0.00 0.02 0.00 0.00 46.19 42.66 2yz0 s LEU 6 CO 0.00 -0.68 0.17 0.28 0.02 0.00 0.00 176.35 176.15 2yz0 s THR 7 N 3.08 0.14 0.50 5.49 -1.32 -1.26 -4.65 115.64 117.62 2yz0 s THR 7 Ca 0.51 -1.17 0.15 0.00 -1.21 0.00 0.00 61.69 59.96 2yz0 s THR 7 Cb -0.19 -1.26 0.26 0.00 -1.51 0.00 0.00 72.50 69.80 2yz0 s THR 7 CO 0.13 -0.65 2.13 -0.07 -2.21 0.00 0.00 174.62 173.95 2yz0 h LEU 8 N 2.93 0.06 -1.86 9.08 3.38 -1.89 -1.61 115.31 125.39 2yz0 h LEU 8 Ca -0.34 -0.00 0.14 0.00 0.09 0.00 0.00 57.88 57.77 2yz0 h LEU 8 Cb 1.19 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.91 2yz0 h LEU 8 CO 0.55 0.05 0.54 -0.78 0.09 0.00 0.00 178.44 178.90 2yz0 h ASP 9 N 0.07 0.00 -0.43 -0.43 1.82 -1.90 0.26 116.42 115.81 2yz0 h ASP 9 Ca 0.02 0.00 -0.12 0.00 -0.39 0.00 0.00 57.03 56.54 2yz0 h ASP 9 Cb 0.01 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.01 2yz0 h ASP 9 CO -0.00 0.00 -0.19 1.56 -1.61 0.00 0.00 179.24 179.00 2yz0 h GLN 10 N 0.00 0.92 0.00 0.28 1.08 -1.69 -2.62 115.11 113.08 2yz0 h GLN 10 Ca 0.23 -0.37 -0.01 0.00 -1.45 0.00 0.00 58.65 57.05 2yz0 h GLN 10 Cb 1.32 -0.04 -0.00 0.00 -0.05 0.00 0.00 27.48 28.70 2yz0 h GLN 10 CO -0.00 1.03 -0.05 1.88 -0.95 0.00 0.00 178.83 180.74 2yz0 h TYR 11 N 0.81 0.00 -0.73 2.96 0.05 -0.64 -2.50 116.97 116.92 2yz0 h TYR 11 Ca 0.11 0.00 0.07 0.00 0.05 0.00 0.00 58.73 58.96 2yz0 h TYR 11 Cb 0.74 0.00 -0.05 0.00 1.01 0.00 0.00 36.73 38.44 2yz0 h TYR 11 CO 0.05 0.05 0.48 -0.92 -1.05 0.00 0.00 178.16 176.76 2yz0 h TYR 12 N 0.00 0.76 -1.00 4.88 3.20 -1.43 -1.33 116.97 122.05 2yz0 h TYR 12 Ca -0.00 0.02 0.01 0.00 3.14 0.00 0.00 58.73 61.90 2yz0 h TYR 12 Cb 0.26 -0.25 -0.05 0.00 1.54 0.00 0.00 36.73 38.23 2yz0 h TYR 12 CO 0.00 0.40 0.66 1.05 -1.64 0.00 0.00 178.16 178.63 2yz0 h GLU 13 N 0.75 1.31 -0.13 1.82 4.11 -1.59 0.24 114.58 121.08 2yz0 h GLU 13 Ca 0.32 -0.08 -0.03 0.00 0.07 0.00 0.00 59.36 59.64 2yz0 h GLU 13 Cb 0.28 -0.29 -0.00 0.00 0.50 0.00 0.00 28.75 29.23 2yz0 h GLU 13 CO -0.11 0.86 -0.04 0.82 0.07 0.00 0.00 179.01 180.62 2yz0 h ILE 14 N 1.35 1.30 -0.39 -1.06 5.03 -1.41 -0.51 117.51 121.80 2yz0 h ILE 14 Ca 0.37 -1.00 -0.04 0.00 -0.12 0.00 0.00 64.86 64.07 2yz0 h ILE 14 Cb -0.14 1.69 -0.02 0.00 -3.03 0.00 0.00 36.82 35.32 2yz0 h ILE 14 CO -0.09 0.29 0.10 1.56 -0.68 0.00 0.00 178.15 179.33 2yz0 h GLN 15 N -0.05 0.63 -0.67 2.37 4.20 -1.16 -2.71 115.11 117.72 2yz0 h GLN 15 Ca 0.03 -0.15 -0.05 0.00 0.06 0.00 0.00 58.65 58.55 2yz0 h GLN 15 Cb 0.47 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 28.14 2yz0 h GLN 15 CO 0.01 0.66 0.24 0.00 -0.67 0.00 0.00 178.83 179.07 2yz0 h ASN 17 N 0.95 0.50 -0.42 0.00 2.35 -0.93 -1.42 115.58 116.62 2yz0 h ASN 17 Ca 0.22 -0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 55.86 2yz0 h ASN 17 Cb 0.25 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 38.49 2yz0 h ASN 17 CO -0.01 0.33 -0.15 -0.33 -1.65 0.00 0.00 177.43 175.63 2yz0 h GLU 18 N 0.58 0.90 0.15 0.81 5.08 -1.13 0.48 114.58 121.45 2yz0 h GLU 18 Ca 0.25 -0.34 -0.01 0.00 -1.00 0.00 0.00 59.36 58.26 2yz0 h GLU 18 Cb 0.24 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.44 2yz0 h GLU 18 CO -0.07 0.98 -0.07 -0.07 -1.00 0.00 0.00 179.01 178.78 2yz0 h LEU 19 N 0.80 -0.17 -0.60 1.33 3.38 -1.09 0.22 115.31 119.18 2yz0 h LEU 19 Ca 0.12 -0.03 -0.13 0.00 0.09 0.00 0.00 57.88 57.93 2yz0 h LEU 19 Cb 0.68 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.46 2yz0 h LEU 19 CO 0.05 -0.08 -0.30 1.05 0.09 0.00 0.00 178.44 179.25 2yz0 h GLU 20 N -0.24 0.78 0.05 1.13 4.11 -1.45 0.19 114.58 119.15 2yz0 h GLU 20 Ca -0.02 -0.36 -0.00 0.00 0.07 0.00 0.00 59.36 59.05 2yz0 h GLU 20 Cb 0.19 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.43 2yz0 h GLU 20 CO 0.03 0.98 -0.03 0.00 0.07 0.00 0.00 179.01 180.07 2yz0 h ALA 21 N 1.00 -0.07 -0.19 1.06 0.00 -0.73 -2.90 119.26 117.43 2yz0 h ALA 21 Ca 0.08 -0.11 -0.17 0.00 0.00 0.00 0.00 54.91 54.72 2yz0 h ALA 21 Cb 0.83 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 2yz0 h ALA 21 CO 0.07 -0.44 -0.56 0.82 0.00 0.00 0.00 179.25 179.13 2yz0 h ILE 22 N -0.26 1.32 -0.87 0.00 5.03 -0.56 -3.07 117.51 119.10 2yz0 h ILE 22 Ca -0.01 -1.81 0.19 0.00 -0.12 0.00 0.00 64.86 63.11 2yz0 h ILE 22 Cb 0.23 1.78 -0.06 0.00 -3.03 0.00 0.00 36.82 35.74 2yz0 h ILE 22 CO 0.01 0.57 0.58 0.03 -0.68 0.00 0.00 178.15 178.65 2yz0 h ARG 23 N 0.44 0.37 -0.34 2.37 3.08 -0.57 0.27 114.38 120.00 2yz0 h ARG 23 Ca 0.01 -0.02 -0.10 0.00 0.07 0.00 0.00 59.98 59.93 2yz0 h ARG 23 Cb 1.12 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 31.07 2yz0 h ARG 23 CO 0.11 0.24 -0.20 0.77 -1.07 0.00 0.00 179.97 179.82 2yz0 h SER 24 N 0.38 0.66 0.10 7.04 0.02 -1.41 0.29 113.55 120.63 2yz0 h SER 24 Ca 0.44 -0.22 -0.16 0.00 -0.84 0.00 0.00 61.79 61.02 2yz0 h SER 24 Cb 1.13 -0.18 0.02 0.00 0.14 0.00 0.00 62.40 63.51 2yz0 h SER 24 CO -0.15 0.86 -0.68 0.40 -1.14 0.00 0.00 176.83 176.12 2yz0 h ILE 25 N 0.58 1.54 -1.46 3.27 2.04 -0.80 -3.35 117.51 119.34 2yz0 h ILE 25 Ca 0.09 -2.44 -0.66 0.00 1.00 0.00 0.00 64.86 62.84 2yz0 h ILE 25 Cb 0.67 3.14 -0.34 0.00 -0.74 0.00 0.00 36.82 39.54 2yz0 h ILE 25 CO 0.05 0.69 0.20 -1.22 0.00 0.00 0.00 178.15 177.87 2yz0 n TYR 26 N -4.20 3.12 -0.30 1.37 4.01 0.64 -4.83 117.16 116.97 2yz0 n TYR 26 Ca -0.13 -2.68 -0.08 0.00 -0.16 0.00 0.00 57.90 54.85 2yz0 n TYR 26 Cb 0.76 -0.79 -0.04 0.00 -0.31 0.00 0.00 39.34 38.96 2yz0 n TYR 26 CO 0.00 0.00 0.00 0.52 -0.46 0.00 0.00 176.86 176.92 2yz0 h MET 27 N 2.54 -0.13 -0.76 -0.72 2.86 -0.56 0.65 114.93 118.80 2yz0 h MET 27 Ca 0.47 0.01 -0.44 0.00 -2.06 0.00 0.00 59.70 57.67 2yz0 h MET 27 Cb 0.69 0.03 -0.25 0.00 0.06 0.00 0.00 31.60 32.13 2yz0 h MET 27 CO 1.19 -0.09 0.32 -0.40 1.06 0.00 0.00 176.91 179.00 2yz0 n ASP 28 N -5.37 4.24 -0.12 1.22 5.75 -1.26 -4.27 116.55 116.73 2yz0 n ASP 28 Ca 0.03 -3.72 0.01 0.00 -0.01 0.00 0.00 54.79 51.09 2yz0 n ASP 28 Cb 0.33 -0.76 0.01 0.00 -1.03 0.00 0.00 41.12 39.68 2yz0 n ASP 28 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 2yz0 n ASP 29 N -1.06 0.53 -4.54 -1.12 9.92 0.15 -5.07 116.55 115.37 2yz0 n ASP 29 Ca 0.50 -1.57 -0.33 0.00 -0.53 0.00 0.00 54.79 52.86 2yz0 n ASP 29 Cb 1.19 -0.08 -0.12 0.00 -0.64 0.00 0.00 41.12 41.47 2yz0 n ASP 29 CO 0.00 0.00 0.00 0.72 0.13 0.00 0.00 177.20 178.05 2yz0 s PHE 30 N -0.40 2.85 -0.16 1.24 -0.12 -0.81 -1.32 117.98 119.26 2yz0 s PHE 30 Ca 0.03 -0.05 -0.03 0.00 -0.05 0.00 0.00 56.93 56.83 2yz0 s PHE 30 Cb 0.02 -1.68 -0.02 0.00 -0.63 0.00 0.00 43.02 40.71 2yz0 s PHE 30 CO 0.00 0.27 -0.06 0.99 -0.05 0.00 0.00 175.22 176.37 2yz0 s THR 31 N -0.77 3.58 -0.38 -4.49 2.01 0.91 -4.95 115.64 111.56 2yz0 s THR 31 Ca 0.12 -0.46 -0.23 0.00 0.31 0.00 0.00 61.69 61.43 2yz0 s THR 31 Cb -0.11 -2.57 0.01 0.00 0.01 0.00 0.00 72.50 69.85 2yz0 s THR 31 CO 0.01 0.49 0.78 -0.62 -0.69 0.00 0.00 174.62 174.59 2yz0 s ASP 32 N 0.57 6.53 0.00 3.53 2.15 -1.26 -1.89 116.67 126.30 2yz0 s ASP 32 Ca -0.04 0.28 0.00 0.00 0.43 0.00 0.00 52.55 53.22 2yz0 s ASP 32 Cb -0.15 -2.39 0.00 0.00 -0.30 0.00 0.00 42.92 40.08 2yz0 s ASP 32 CO 0.03 -0.76 0.00 0.00 -0.17 0.00 0.00 175.17 174.27 2yz0 n LEU 33 N 6.46 0.00 -4.39 -1.34 -0.00 -1.26 -4.98 117.00 111.50 2yz0 n LEU 33 Ca 0.03 -0.15 -0.42 0.00 -0.00 0.00 0.00 56.01 55.47 2yz0 n LEU 33 Cb 0.48 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.91 2yz0 n LEU 33 CO 0.54 0.00 -0.15 0.41 -0.00 0.00 0.00 177.39 178.19 2yz0 n THR 34 N -1.22 1.31 -1.51 1.47 -1.04 -1.23 -4.47 114.28 107.59 2yz0 n THR 34 Ca 0.00 -0.50 -0.22 0.00 -2.04 0.00 0.00 64.05 61.29 2yz0 n THR 34 Cb 0.00 -0.30 -0.20 0.00 -1.82 0.00 0.00 70.33 68.01 2yz0 n THR 34 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 2yz0 n LYS 35 N 0.89 0.11 -1.04 -2.82 4.01 -1.26 -4.71 118.16 113.33 2yz0 n LYS 35 Ca 0.11 -0.14 -0.23 0.00 -0.51 0.00 0.00 58.31 57.55 2yz0 n LYS 35 Cb 0.40 -1.51 0.05 0.00 -0.51 0.00 0.00 35.03 33.46 2yz0 n LYS 35 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 2yz0 n ARG 36 N 6.32 2.10 -1.23 1.97 5.12 -1.26 -4.69 116.66 124.98 2yz0 n ARG 36 Ca 0.64 -2.13 -0.38 0.00 -1.93 0.00 0.00 57.85 54.05 2yz0 n ARG 36 Cb 0.18 -1.84 0.02 0.00 -1.16 0.00 0.00 32.46 29.67 2yz0 n ARG 36 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 2yz0 n LYS 37 N -0.06 0.07 0.00 5.56 4.76 -1.26 -4.94 118.16 122.29 2yz0 n LYS 37 Ca 0.41 0.03 0.00 0.00 -2.87 0.00 0.00 58.31 55.88 2yz0 n LYS 37 Cb 0.60 -1.14 0.00 0.00 -1.84 0.00 0.00 35.03 32.66 2yz0 n LYS 37 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2yz0 n SER 38 N 2.24 0.00 -3.17 4.39 2.88 -1.26 -4.88 113.62 113.82 2yz0 n SER 38 Ca 0.07 0.00 -0.08 0.00 -1.33 0.00 0.00 58.87 57.53 2yz0 n SER 38 Cb 0.49 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.91 2yz0 n SER 38 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2yz0 s SER 39 N -2.10 -0.46 0.00 -3.46 0.01 -1.26 -4.93 113.70 101.50 2yz0 s SER 39 Ca 0.00 -1.42 0.00 0.00 1.31 0.00 0.00 55.95 55.84 2yz0 s SER 39 Cb 0.00 1.33 0.00 0.00 0.21 0.00 0.00 66.02 67.56 2yz0 s SER 39 CO 0.00 -0.17 0.00 -2.67 0.41 0.00 0.00 173.24 170.81 2yz0 n TRP 40 N 3.92 0.00 -3.90 2.43 2.14 -1.26 -5.13 117.44 115.63 2yz0 n TRP 40 Ca 0.14 0.00 -0.14 0.00 2.07 0.00 0.00 57.50 59.57 2yz0 n TRP 40 Cb 0.52 0.00 -0.15 0.00 -0.81 0.00 0.00 31.31 30.87 2yz0 n TRP 40 CO 0.00 0.00 0.00 0.34 2.07 0.00 0.00 177.69 180.10 2yz0 s ASP 41 N 0.00 0.20 -0.40 -0.67 -1.08 -1.26 -5.10 116.67 108.36 2yz0 s ASP 41 Ca 0.00 -0.01 0.04 0.00 -0.52 0.00 0.00 52.55 52.06 2yz0 s ASP 41 Cb 0.00 -0.08 0.17 0.00 -1.46 0.00 0.00 42.92 41.55 2yz0 s ASP 41 CO 0.00 -0.05 0.33 -0.54 0.52 0.00 0.00 175.17 175.44 2yz0 s LYS 42 N 0.49 0.85 -0.44 4.34 1.02 -1.26 -4.54 119.74 120.20 2yz0 s LYS 42 Ca -0.04 -1.95 0.06 0.00 0.02 0.00 0.00 55.97 54.05 2yz0 s LYS 42 Cb -0.07 -1.35 0.42 0.00 -0.52 0.00 0.00 37.83 36.31 2yz0 s LYS 42 CO -0.01 -1.36 1.08 0.94 -0.92 0.00 0.00 175.35 175.08 2yz0 n GLN 43 N 3.03 3.25 -1.01 1.68 7.27 -1.26 -5.08 117.38 125.26 2yz0 n GLN 43 Ca 0.27 -4.45 -0.29 0.00 0.07 0.00 0.00 57.00 52.59 2yz0 n GLN 43 Cb 0.47 -2.18 0.25 0.00 2.41 0.00 0.00 30.24 31.18 2yz0 n GLN 43 CO 0.00 0.00 0.00 -0.35 0.07 0.00 0.00 177.06 176.78 2yz0 n PRO 44 N -0.43 -3.13 0.00 3.69 -0.04 -1.26 -4.93 135.00 128.90 2yz0 n PRO 44 Ca 0.36 -1.71 0.00 0.00 -0.04 0.00 0.00 63.50 62.11 2yz0 n PRO 44 Cb 0.65 -1.61 0.00 0.00 -0.04 0.00 0.00 33.50 32.50 2yz0 n PRO 44 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 2yz0 n GLN 45 N -4.79 0.02 0.00 0.54 7.27 -1.26 -5.01 117.38 114.15 2yz0 n GLN 45 Ca 0.15 -0.43 0.00 0.00 0.07 0.00 0.00 57.00 56.79 2yz0 n GLN 45 Cb 0.58 -0.50 0.00 0.00 2.41 0.00 0.00 30.24 32.72 2yz0 n GLN 45 CO 0.00 0.00 0.00 1.51 0.07 0.00 0.00 177.06 178.64 2yz0 n ILE 46 N -0.00 0.00 -0.90 1.69 0.13 -1.26 -4.46 119.36 114.56 2yz0 n ILE 46 Ca 0.00 0.00 -0.31 0.00 -1.10 0.00 0.00 62.75 61.34 2yz0 n ILE 46 Cb 0.46 0.00 -0.02 0.00 -0.84 0.00 0.00 39.64 39.24 2yz0 n ILE 46 CO 0.00 0.00 0.00 2.30 2.80 0.00 0.00 176.55 181.65 2yz0 n ILE 47 N 0.00 1.16 -3.80 9.51 -0.00 -1.26 -4.83 119.36 120.14 2yz0 n ILE 47 Ca 0.00 -0.32 -0.10 0.00 -0.00 0.00 0.00 62.75 62.33 2yz0 n ILE 47 Cb 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 39.64 39.59 2yz0 n ILE 47 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.55 177.27 2yz0 s PHE 48 N -0.71 0.03 0.13 4.28 -0.71 -1.13 -3.49 117.98 116.38 2yz0 s PHE 48 Ca 0.41 -0.38 0.06 0.00 -1.04 0.00 0.00 56.93 55.97 2yz0 s PHE 48 Cb -0.57 0.25 -0.04 0.00 -1.21 0.00 0.00 43.02 41.44 2yz0 s PHE 48 CO 0.37 -0.85 0.02 -1.21 -1.34 0.00 0.00 175.22 172.22 2yz0 s GLU 49 N -3.90 2.56 0.00 1.99 2.02 -0.79 -2.80 118.70 117.79 2yz0 s GLU 49 Ca 0.11 -0.93 0.03 0.00 0.02 0.00 0.00 54.97 54.20 2yz0 s GLU 49 Cb 0.00 -2.50 -0.01 0.00 0.10 0.00 0.00 34.13 31.72 2yz0 s GLU 49 CO -0.02 0.50 -0.08 0.42 0.02 0.00 0.00 175.26 176.10 2yz0 s ILE 50 N -1.52 0.65 -0.12 -1.63 -1.09 -0.61 -0.06 121.20 116.81 2yz0 s ILE 50 Ca 0.27 -0.47 -0.24 0.00 -2.23 0.00 0.00 60.65 57.99 2yz0 s ILE 50 Cb -0.11 -0.57 -0.03 0.00 -1.58 0.00 0.00 42.46 40.18 2yz0 s ILE 50 CO 0.19 0.10 0.73 -0.89 -1.23 0.00 0.00 174.94 173.85 2yz0 s THR 51 N -0.36 4.99 0.13 2.92 2.01 -0.44 -1.89 115.64 123.00 2yz0 s THR 51 Ca 0.02 1.46 0.04 0.00 0.31 0.00 0.00 61.69 63.52 2yz0 s THR 51 Cb -0.04 -4.06 -0.04 0.00 0.01 0.00 0.00 72.50 68.37 2yz0 s THR 51 CO -0.00 0.15 -0.09 -0.76 -0.69 0.00 0.00 174.62 173.23 2yz0 s LEU 52 N 1.45 2.52 -0.06 4.42 1.43 -0.48 -4.93 118.68 123.02 2yz0 s LEU 52 Ca 0.36 -0.99 -0.31 0.00 -1.03 0.00 0.00 54.13 52.16 2yz0 s LEU 52 Cb -0.17 -0.29 0.12 0.00 0.03 0.00 0.00 46.19 45.88 2yz0 s LEU 52 CO 0.15 -0.35 1.36 0.00 0.23 0.00 0.00 176.35 177.74 2yz0 s ARG 53 N -3.67 0.17 1.08 1.70 3.03 -1.26 -0.93 118.95 119.07 2yz0 s ARG 53 Ca 0.15 -0.10 -0.18 0.00 2.03 0.00 0.00 55.73 57.62 2yz0 s ARG 53 Cb 0.03 0.05 0.28 0.00 -1.03 0.00 0.00 34.95 34.28 2yz0 s ARG 53 CO -0.01 -0.08 0.73 -1.13 -1.13 0.00 0.00 175.30 173.68 2yz0 n SER 54 N -0.75 -3.11 0.06 -2.89 3.41 -0.07 -4.85 113.62 105.42 2yz0 n SER 54 Ca -0.03 -0.79 0.07 0.00 -0.26 0.00 0.00 58.87 57.86 2yz0 n SER 54 Cb 0.61 -0.77 -0.05 0.00 -0.26 0.00 0.00 64.21 63.74 2yz0 n SER 54 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 2yz0 n VAL 55 N -4.93 0.80 -4.01 -3.33 0.24 -1.26 -4.96 118.33 100.87 2yz0 n VAL 55 Ca 0.11 -0.61 -0.00 0.00 -2.04 0.00 0.00 64.34 61.80 2yz0 n VAL 55 Cb 0.46 -0.46 -0.00 0.00 -1.47 0.00 0.00 33.84 32.37 2yz0 n VAL 55 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 2yz0 n ASP 56 N -2.72 1.74 -0.00 -1.34 2.03 -1.26 -5.07 116.55 109.93 2yz0 n ASP 56 Ca -0.05 -1.03 0.01 0.00 0.52 0.00 0.00 54.79 54.24 2yz0 n ASP 56 Cb 0.67 0.01 -0.01 0.00 -0.72 0.00 0.00 41.12 41.07 2yz0 n ASP 56 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2yz0 n LYS 57 N -0.02 2.22 -4.69 -0.67 4.76 -1.22 -4.46 118.16 114.09 2yz0 n LYS 57 Ca -0.00 -0.01 -0.29 0.00 -2.87 0.00 0.00 58.31 55.13 2yz0 n LYS 57 Cb 0.01 -0.89 -0.14 0.00 -1.84 0.00 0.00 35.03 32.17 2yz0 n LYS 57 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 2yz0 s GLU 58 N -1.82 1.62 0.00 1.97 2.02 -1.26 -2.00 118.70 119.23 2yz0 s GLU 58 Ca -0.00 -1.20 0.14 0.00 0.02 0.00 0.00 54.97 53.93 2yz0 s GLU 58 Cb 0.01 -1.92 0.62 0.00 0.10 0.00 0.00 34.13 32.94 2yz0 s GLU 58 CO 0.08 0.48 1.45 -0.35 0.02 0.00 0.00 175.26 176.94 2yz0 n PRO 59 N 1.42 0.02 -4.21 0.39 -0.04 -1.26 -4.95 135.00 126.38 2yz0 n PRO 59 Ca -0.17 0.25 -0.16 0.00 -0.04 0.00 0.00 63.50 63.37 2yz0 n PRO 59 Cb 0.52 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.41 2yz0 n PRO 59 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2yz0 s VAL 60 N -2.96 0.00 -0.23 0.52 -7.23 -0.85 -5.06 120.40 104.60 2yz0 s VAL 60 Ca 0.08 -1.90 0.14 0.00 -1.81 0.00 0.00 61.98 58.49 2yz0 s VAL 60 Cb 0.09 -2.51 -0.20 0.00 0.56 0.00 0.00 36.38 34.32 2yz0 s VAL 60 CO 0.25 0.00 0.40 1.21 -0.31 0.00 0.00 175.10 176.66 2yz0 n GLU 61 N -0.50 1.09 -2.51 4.82 2.13 -1.13 -3.45 120.64 121.08 2yz0 n GLU 61 Ca 0.04 -0.09 -0.08 0.00 0.66 0.00 0.00 57.16 57.70 2yz0 n GLU 61 Cb 0.63 -1.28 0.01 0.00 0.27 0.00 0.00 31.44 31.07 2yz0 n GLU 61 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 2yz0 n SER 62 N -1.78 -4.41 -4.39 4.31 7.64 -1.26 -2.54 113.62 111.19 2yz0 n SER 62 Ca -0.01 0.17 -0.34 0.00 1.01 0.00 0.00 58.87 59.70 2yz0 n SER 62 Cb 0.32 -1.11 -0.14 0.00 -1.01 0.00 0.00 64.21 62.27 2yz0 n SER 62 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2yz0 s SER 63 N -0.80 4.28 -0.01 6.43 0.15 -1.26 -0.89 113.70 121.60 2yz0 s SER 63 Ca 0.08 -0.29 -0.01 0.00 0.70 0.00 0.00 55.95 56.43 2yz0 s SER 63 Cb -0.01 -1.69 0.00 0.00 -1.71 0.00 0.00 66.02 62.62 2yz0 s SER 63 CO 0.17 0.12 0.02 -0.63 1.20 0.00 0.00 173.24 174.13 2yz0 s ILE 64 N 0.62 0.00 -0.30 6.45 1.01 -0.10 -3.04 121.20 125.84 2yz0 s ILE 64 Ca -0.05 -0.03 -0.10 0.00 0.00 0.00 0.00 60.65 60.47 2yz0 s ILE 64 Cb -0.15 -0.05 -0.02 0.00 0.01 0.00 0.00 42.46 42.25 2yz0 s ILE 64 CO 0.03 -0.02 0.15 -0.89 0.00 0.00 0.00 174.94 174.22 2yz0 s THR 65 N -0.04 4.77 -0.34 2.92 2.01 -1.22 -1.38 115.64 122.36 2yz0 s THR 65 Ca -0.01 -0.23 -0.14 0.00 0.31 0.00 0.00 61.69 61.62 2yz0 s THR 65 Cb -0.00 -3.37 -0.01 0.00 0.01 0.00 0.00 72.50 69.13 2yz0 s THR 65 CO 0.00 0.15 0.33 -0.76 -0.69 0.00 0.00 174.62 173.64 2yz0 s LEU 66 N 1.66 4.48 -0.32 4.42 1.43 -0.79 -2.60 118.68 126.96 2yz0 s LEU 66 Ca 0.06 -0.31 -0.04 0.00 -1.03 0.00 0.00 54.13 52.81 2yz0 s LEU 66 Cb -0.16 -2.28 0.04 0.00 0.03 0.00 0.00 46.19 43.82 2yz0 s LEU 66 CO 0.07 -0.31 0.06 -2.28 0.23 0.00 0.00 176.35 174.12 2yz0 s HIS 67 N 1.92 3.26 -0.10 0.29 5.65 -1.23 -1.58 115.29 123.50 2yz0 s HIS 67 Ca 0.10 -1.60 -0.05 0.00 0.25 0.00 0.00 55.06 53.76 2yz0 s HIS 67 Cb -0.17 -2.20 -0.04 0.00 -1.18 0.00 0.00 32.58 28.99 2yz0 s HIS 67 CO 0.11 -0.76 0.09 -0.59 -0.65 0.00 0.00 174.74 172.94 2yz0 s PHE 68 N 1.34 3.42 -0.20 3.88 -0.12 -1.12 -3.45 117.98 121.73 2yz0 s PHE 68 Ca -0.03 0.39 0.02 0.00 -0.05 0.00 0.00 56.93 57.25 2yz0 s PHE 68 Cb -0.20 -1.87 0.03 0.00 -0.63 0.00 0.00 43.02 40.36 2yz0 s PHE 68 CO 0.01 0.63 -0.16 0.00 -0.05 0.00 0.00 175.22 175.65 2yz0 s ALA 69 N -0.98 2.34 -0.48 1.99 0.00 -0.42 -2.82 121.76 121.38 2yz0 s ALA 69 Ca 0.15 -1.37 -0.24 0.00 0.00 0.00 0.00 51.96 50.50 2yz0 s ALA 69 Cb -0.12 -1.31 0.03 0.00 0.00 0.00 0.00 23.12 21.73 2yz0 s ALA 69 CO 0.04 -0.66 0.86 -1.64 0.00 0.00 0.00 175.76 174.36 2yz0 s MET 70 N 1.26 3.42 0.91 0.00 -1.94 -1.26 -3.06 119.30 118.62 2yz0 s MET 70 Ca 0.00 -0.08 -0.10 0.00 -1.71 0.00 0.00 55.69 53.80 2yz0 s MET 70 Cb -0.15 -3.96 0.14 0.00 2.01 0.00 0.00 34.83 32.86 2yz0 s MET 70 CO -0.10 -1.24 1.14 0.95 -0.01 0.00 0.00 175.02 175.76 2yz0 s THR 71 N 3.57 2.22 -1.58 2.05 -4.23 -1.26 -4.75 115.64 111.65 2yz0 s THR 71 Ca 0.32 0.07 0.15 0.00 -1.18 0.00 0.00 61.69 61.05 2yz0 s THR 71 Cb -0.12 -2.15 0.31 0.00 1.34 0.00 0.00 72.50 71.88 2yz0 s THR 71 CO 0.23 -0.09 1.39 -0.81 -0.54 0.00 0.00 174.62 174.80 2yz0 n PRO 72 N -4.17 0.29 -0.02 3.99 -0.04 -1.26 -2.43 135.00 131.35 2yz0 n PRO 72 Ca 0.11 0.11 0.01 0.00 -0.04 0.00 0.00 63.50 63.68 2yz0 n PRO 72 Cb 0.52 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.42 2yz0 n PRO 72 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 2yz0 n MET 73 N -1.21 1.37 -1.30 0.54 2.81 -1.26 -4.83 117.12 113.24 2yz0 n MET 73 Ca 0.08 -0.05 -0.37 0.00 -1.81 0.00 0.00 57.70 55.56 2yz0 n MET 73 Cb 0.10 -1.21 0.05 0.00 -0.71 0.00 0.00 33.22 31.45 2yz0 n MET 73 CO 0.00 0.00 0.00 0.98 1.51 0.00 0.00 175.97 178.46 2yz0 n TYR 74 N -2.03 -1.21 0.56 2.03 4.19 -1.02 -1.07 117.16 118.60 2yz0 n TYR 74 Ca -0.07 0.37 0.07 0.00 3.31 0.00 0.00 57.90 61.57 2yz0 n TYR 74 Cb 0.48 -1.88 0.33 0.00 0.49 0.00 0.00 39.34 38.75 2yz0 n TYR 74 CO 0.00 0.00 0.00 -0.35 0.91 0.00 0.00 176.86 177.42 2yz0 n PRO 75 N -0.16 0.07 -0.23 2.98 -0.04 -1.26 -4.82 135.00 131.54 2yz0 n PRO 75 Ca 0.10 0.22 0.09 0.00 -0.04 0.00 0.00 63.50 63.87 2yz0 n PRO 75 Cb 0.49 -1.50 0.18 0.00 -0.04 0.00 0.00 33.50 32.64 2yz0 n PRO 75 CO 0.00 0.00 0.00 0.98 -0.04 0.00 0.00 175.50 176.44 2yz0 n TYR 76 N -1.43 0.40 -3.38 0.54 9.36 -0.24 -4.41 117.16 118.00 2yz0 n TYR 76 Ca 0.05 0.78 -0.04 0.00 3.32 0.00 0.00 57.90 62.02 2yz0 n TYR 76 Cb 0.15 -0.98 0.00 0.00 -0.63 0.00 0.00 39.34 37.88 2yz0 n TYR 76 CO 0.00 0.00 0.00 0.25 0.22 0.00 0.00 176.86 177.33 2yz0 n THR 77 N -4.87 0.00 -4.09 2.97 -2.24 -1.25 -5.11 114.28 99.68 2yz0 n THR 77 Ca 0.15 -0.31 -0.34 0.00 -2.27 0.00 0.00 64.05 61.27 2yz0 n THR 77 Cb 0.49 -0.59 -0.10 0.00 -2.10 0.00 0.00 70.33 68.03 2yz0 n THR 77 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2yz0 s ALA 78 N -2.11 3.33 0.95 6.98 0.00 -1.26 -4.65 121.76 125.00 2yz0 s ALA 78 Ca 0.06 -0.76 -0.12 0.00 0.00 0.00 0.00 51.96 51.14 2yz0 s ALA 78 Cb -0.00 -1.83 0.16 0.00 0.00 0.00 0.00 23.12 21.44 2yz0 s ALA 78 CO 0.04 0.21 1.09 -1.25 0.00 0.00 0.00 175.76 175.85 2yz0 s PRO 79 N 0.30 0.78 -0.07 0.00 0.04 -1.26 -4.88 135.00 129.91 2yz0 s PRO 79 Ca 0.02 0.65 0.05 0.00 0.04 0.00 0.00 61.00 61.76 2yz0 s PRO 79 Cb -0.13 -1.77 -0.01 0.00 0.04 0.00 0.00 34.50 32.63 2yz0 s PRO 79 CO 0.01 -2.52 -0.23 -2.00 0.04 0.00 0.00 177.00 172.30 2yz0 s GLU 80 N -4.95 2.67 0.01 4.56 2.12 -1.17 -4.96 118.70 116.98 2yz0 s GLU 80 Ca 0.64 -0.86 -0.04 0.00 0.36 0.00 0.00 54.97 55.07 2yz0 s GLU 80 Cb -0.18 -2.24 -0.01 0.00 0.26 0.00 0.00 34.13 31.96 2yz0 s GLU 80 CO 0.57 0.37 0.07 0.42 -0.54 0.00 0.00 175.26 176.15 2yz0 s ILE 81 N -0.13 0.10 -0.04 -3.70 1.01 -1.26 -1.31 121.20 115.88 2yz0 s ILE 81 Ca -0.04 -0.85 -0.14 0.00 0.00 0.00 0.00 60.65 59.62 2yz0 s ILE 81 Cb -0.14 -0.45 0.02 0.00 0.01 0.00 0.00 42.46 41.90 2yz0 s ILE 81 CO 0.04 -0.47 0.31 -1.83 0.00 0.00 0.00 174.94 173.00 2yz0 s GLU 82 N -1.63 0.60 0.09 2.79 -1.05 -1.22 -5.01 118.70 113.27 2yz0 s GLU 82 Ca -0.14 -0.04 -0.19 0.00 -0.15 0.00 0.00 54.97 54.45 2yz0 s GLU 82 Cb -0.07 0.27 -0.07 0.00 -0.44 0.00 0.00 34.13 33.82 2yz0 s GLU 82 CO -0.00 -0.15 0.58 -0.06 0.95 0.00 0.00 175.26 176.58 2yz0 s PHE 83 N -0.98 3.79 0.42 4.83 0.08 -1.26 -3.52 117.98 121.34 2yz0 s PHE 83 Ca -0.10 1.28 0.04 0.00 0.12 0.00 0.00 56.93 58.26 2yz0 s PHE 83 Cb -0.05 -2.50 -0.04 0.00 -0.57 0.00 0.00 43.02 39.86 2yz0 s PHE 83 CO 0.03 0.56 0.05 0.15 -0.10 0.00 0.00 175.22 175.92 2yz0 s LYS 84 N -1.22 1.96 0.00 0.44 -0.14 -1.07 -4.90 119.74 114.81 2yz0 s LYS 84 Ca 0.30 -2.18 0.00 0.00 -1.36 0.00 0.00 55.97 52.74 2yz0 s LYS 84 Cb -0.19 -1.18 0.00 0.00 -1.68 0.00 0.00 37.83 34.78 2yz0 s LYS 84 CO 0.19 -0.29 0.00 0.09 -0.76 0.00 0.00 175.35 174.59 2yz0 n ASN 85 N -1.09 0.00 -3.24 2.83 5.03 -1.26 -3.41 115.26 114.12 2yz0 n ASN 85 Ca -0.09 0.00 -0.09 0.00 0.87 0.00 0.00 54.58 55.26 2yz0 n ASN 85 Cb 0.66 0.00 0.01 0.00 -1.02 0.00 0.00 39.78 39.43 2yz0 n ASN 85 CO 0.00 0.00 0.00 1.33 -1.83 0.00 0.00 177.26 176.76 2yz0 n VAL 86 N 0.00 -3.06 0.00 2.41 0.24 -1.17 -4.98 118.33 111.77 2yz0 n VAL 86 Ca 0.00 0.47 0.00 0.00 -2.04 0.00 0.00 64.34 62.77 2yz0 n VAL 86 Cb 0.00 -3.38 0.00 0.00 -1.47 0.00 0.00 33.84 28.99 2yz0 n VAL 86 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2yz0 n GLN 87 N 0.90 0.00 -1.38 7.34 10.64 -1.25 -4.62 117.38 129.01 2yz0 n GLN 87 Ca -0.02 0.02 -0.29 0.00 -1.83 0.00 0.00 57.00 54.89 2yz0 n GLN 87 Cb 0.52 -0.22 -0.07 0.00 -0.86 0.00 0.00 30.24 29.61 2yz0 n GLN 87 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 2yz0 n ASN 88 N -1.41 7.11 -3.70 2.61 4.13 -1.26 -4.83 115.26 117.91 2yz0 n ASN 88 Ca 0.00 -2.77 -0.14 0.00 1.68 0.00 0.00 54.58 53.35 2yz0 n ASN 88 Cb 0.00 -1.42 -0.09 0.00 -1.54 0.00 0.00 39.78 36.74 2yz0 n ASN 88 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 2yz0 s VAL 89 N 0.34 0.02 0.00 2.41 0.11 -1.26 -4.64 120.40 117.38 2yz0 s VAL 89 Ca 0.64 -0.19 0.00 0.00 -2.93 0.00 0.00 61.98 59.50 2yz0 s VAL 89 Cb 0.26 -0.69 0.00 0.00 -1.53 0.00 0.00 36.38 34.42 2yz0 s VAL 89 CO -0.08 -0.10 0.00 0.23 -3.33 0.00 0.00 175.10 171.82 2yz0 n MET 90 N 1.86 3.06 0.00 1.54 2.81 -1.26 -5.01 117.12 120.12 2yz0 n MET 90 Ca -0.18 0.00 0.11 0.00 -1.81 0.00 0.00 57.70 55.82 2yz0 n MET 90 Cb 0.57 0.00 -0.13 0.00 -0.71 0.00 0.00 33.22 32.95 2yz0 n MET 90 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 2yz0 n ASP 91 N 0.00 0.30 -0.06 7.83 5.75 -1.26 -4.00 116.55 125.12 2yz0 n ASP 91 Ca 0.00 -0.17 -0.12 0.00 -0.01 0.00 0.00 54.79 54.50 2yz0 n ASP 91 Cb 0.00 1.58 -0.06 0.00 -1.03 0.00 0.00 41.12 41.62 2yz0 n ASP 91 CO 0.00 0.00 0.00 0.77 -0.11 0.00 0.00 177.20 177.86 2yz0 h SER 92 N 0.00 0.31 -0.32 -1.12 4.64 -1.99 -1.27 113.55 113.80 2yz0 h SER 92 Ca 0.00 -0.33 -0.10 0.00 -0.47 0.00 0.00 61.79 60.89 2yz0 h SER 92 Cb 0.89 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 62.89 2yz0 h SER 92 CO 0.00 0.56 -0.19 1.56 -0.87 0.00 0.00 176.83 177.89 2yz0 h GLN 93 N 0.04 0.70 -0.13 4.77 4.20 -1.98 -1.21 115.11 121.49 2yz0 h GLN 93 Ca 0.05 -0.32 0.01 0.00 0.06 0.00 0.00 58.65 58.45 2yz0 h GLN 93 Cb 0.41 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.17 2yz0 h GLN 93 CO 0.01 0.92 0.05 -0.07 -0.67 0.00 0.00 178.83 179.07 2yz0 h LEU 94 N 0.46 0.06 -0.99 1.46 4.07 -1.68 -1.67 115.31 117.02 2yz0 h LEU 94 Ca 0.07 0.01 -0.08 0.00 0.08 0.00 0.00 57.88 57.96 2yz0 h LEU 94 Cb 0.73 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.46 2yz0 h LEU 94 CO 0.05 0.05 -0.14 1.56 -1.08 0.00 0.00 178.44 178.89 2yz0 h GLN 95 N 0.12 0.57 -0.51 1.13 1.08 -1.23 -2.93 115.11 113.34 2yz0 h GLN 95 Ca 0.06 -0.18 0.00 0.00 -1.45 0.00 0.00 58.65 57.08 2yz0 h GLN 95 Cb 0.03 -0.05 -0.03 0.00 -0.05 0.00 0.00 27.48 27.38 2yz0 h GLN 95 CO -0.06 0.70 0.33 1.98 -0.95 0.00 0.00 178.83 180.83 2yz0 h MET 96 N 0.53 0.68 -0.99 1.46 4.05 -0.74 -2.43 114.93 117.48 2yz0 h MET 96 Ca 0.09 -0.05 0.05 0.00 -0.28 0.00 0.00 59.70 59.51 2yz0 h MET 96 Cb 0.54 -0.15 -0.06 0.00 -0.80 0.00 0.00 31.60 31.13 2yz0 h MET 96 CO 0.03 0.46 0.65 -0.07 0.23 0.00 0.00 176.91 178.22 2yz0 h LEU 97 N 0.69 1.06 -0.68 3.39 3.38 -1.14 -2.03 115.31 119.99 2yz0 h LEU 97 Ca 0.19 -0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.20 2yz0 h LEU 97 Cb -0.06 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.41 2yz0 h LEU 97 CO -0.04 0.71 0.39 0.11 0.09 0.00 0.00 178.44 179.70 2yz0 h LYS 98 N 1.22 0.72 -0.83 1.13 1.79 -1.35 -0.97 116.57 118.27 2yz0 h LYS 98 Ca 0.41 -0.04 -0.01 0.00 -2.18 0.00 0.00 60.65 58.82 2yz0 h LYS 98 Cb 0.07 -0.16 -0.04 0.00 -1.58 0.00 0.00 32.23 30.52 2yz0 h LYS 98 CO -0.14 0.48 0.47 1.03 -1.08 0.00 0.00 179.45 180.20 2yz0 h SER 99 N 0.74 1.03 0.56 0.86 0.87 -1.17 -1.87 113.55 114.57 2yz0 h SER 99 Ca 0.29 -0.08 -0.09 0.00 -1.23 0.00 0.00 61.79 60.68 2yz0 h SER 99 Cb 0.13 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 61.82 2yz0 h SER 99 CO -0.16 0.81 -0.42 -0.33 -0.53 0.00 0.00 176.83 176.20 2yz0 h GLU 100 N 1.16 0.00 -0.93 2.24 3.07 -1.02 -2.99 114.58 116.11 2yz0 h GLU 100 Ca 0.30 0.00 0.02 0.00 -0.50 0.00 0.00 59.36 59.18 2yz0 h GLU 100 Cb 0.00 0.00 -0.05 0.00 -0.84 0.00 0.00 28.75 27.86 2yz0 h GLU 100 CO -0.05 0.42 0.61 0.74 -1.40 0.00 0.00 179.01 179.34 2yz0 h PHE 101 N 0.00 1.15 -0.73 4.33 -1.00 -0.35 -1.00 116.94 119.34 2yz0 h PHE 101 Ca -0.00 0.03 -0.06 0.00 2.81 0.00 0.00 57.97 60.75 2yz0 h PHE 101 Cb 0.82 -0.39 -0.03 0.00 3.61 0.00 0.00 35.95 39.96 2yz0 h PHE 101 CO 0.00 0.70 0.24 -0.22 -1.61 0.00 0.00 178.31 177.42 2yz0 h LYS 102 N 1.22 1.12 -0.41 1.51 1.63 -1.47 -0.72 116.57 119.45 2yz0 h LYS 102 Ca 0.35 -0.23 -0.13 0.00 -0.85 0.00 0.00 60.65 59.79 2yz0 h LYS 102 Cb -0.07 -0.17 -0.01 0.00 -0.60 0.00 0.00 32.23 31.38 2yz0 h LYS 102 CO -0.09 0.95 -0.25 0.87 -3.45 0.00 0.00 179.45 177.48 2yz0 h LYS 103 N 1.08 0.89 -0.17 1.90 1.57 -1.44 -1.38 116.57 119.03 2yz0 h LYS 103 Ca 0.24 -0.41 -0.02 0.00 -1.87 0.00 0.00 60.65 58.59 2yz0 h LYS 103 Cb 0.29 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.58 2yz0 h LYS 103 CO -0.01 1.06 0.03 0.82 -0.57 0.00 0.00 179.45 180.78 2yz0 h ILE 104 N 0.71 1.22 -0.72 1.86 2.04 -0.98 -2.23 117.51 119.40 2yz0 h ILE 104 Ca 0.08 -0.71 -0.03 0.00 1.00 0.00 0.00 64.86 65.21 2yz0 h ILE 104 Cb 0.82 1.37 -0.03 0.00 -0.74 0.00 0.00 36.82 38.24 2yz0 h ILE 104 CO 0.07 0.21 0.32 -0.74 0.00 0.00 0.00 178.15 178.01 2yz0 h HIS 105 N 0.06 1.07 -0.78 1.37 2.76 -1.14 0.67 115.15 119.16 2yz0 h HIS 105 Ca 0.05 -0.06 0.02 0.00 -2.20 0.00 0.00 60.37 58.18 2yz0 h HIS 105 Cb 0.30 -0.33 -0.04 0.00 1.55 0.00 0.00 27.41 28.89 2yz0 h HIS 105 CO 0.02 0.80 0.51 -0.91 -1.30 0.00 0.00 177.93 177.05 2yz0 h ASN 106 N 1.02 0.85 1.03 3.26 2.35 -1.15 1.85 115.58 124.79 2yz0 h ASN 106 Ca 0.24 -0.01 -0.19 0.00 -0.55 0.00 0.00 56.30 55.80 2yz0 h ASN 106 Cb 0.16 -0.20 -0.03 0.00 0.05 0.00 0.00 38.32 38.30 2yz0 h ASN 106 CO -0.03 0.60 -1.01 0.00 -1.65 0.00 0.00 177.43 175.34 2yz0 h THR 107 N 1.00 1.21 -0.63 2.81 1.03 -1.09 -3.26 112.91 113.99 2yz0 h THR 107 Ca 0.30 -2.82 0.00 0.00 -0.01 0.00 0.00 66.41 63.89 2yz0 h THR 107 Cb -0.04 2.57 0.00 0.00 -1.07 0.00 0.00 68.15 69.61 2yz0 h THR 107 CO -0.09 0.69 0.00 -1.20 -0.01 0.00 0.00 175.52 174.91 2yz0 n SER 108 N -3.22 4.39 -4.35 0.00 7.64 0.23 -4.87 113.62 113.44 2yz0 n SER 108 Ca -0.03 -2.32 -0.22 0.00 1.01 0.00 0.00 58.87 57.30 2yz0 n SER 108 Cb 0.89 -0.53 -0.11 0.00 -1.01 0.00 0.00 64.21 63.45 2yz0 n SER 108 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 2yz0 n ARG 109 N 1.15 0.31 0.00 1.43 0.63 0.63 -1.76 116.66 119.05 2yz0 n ARG 109 Ca 0.24 -1.68 0.00 0.00 -0.92 0.00 0.00 57.85 55.49 2yz0 n ARG 109 Cb 0.79 -3.63 0.00 0.00 0.45 0.00 0.00 32.46 30.06 2yz0 n ARG 109 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2yz0 n GLY 110 N 5.84 0.26 0.00 5.14 0.00 -1.26 -5.06 105.19 110.11 2yz0 n GLY 110 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.45 2yz0 n GLY 110 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2yz0 n GLN 111 N 0.00 0.00 -1.99 1.61 10.64 -0.72 -5.09 117.38 121.83 2yz0 n GLN 111 Ca 0.00 0.00 -0.42 0.00 -1.83 0.00 0.00 57.00 54.75 2yz0 n GLN 111 Cb 0.00 0.00 -0.03 0.00 -0.86 0.00 0.00 30.24 29.35 2yz0 n GLN 111 CO 0.00 0.00 0.00 -1.21 -1.83 0.00 0.00 177.06 174.02 2yz0 s GLU 112 N -0.71 4.23 0.00 2.61 2.02 -1.26 -4.86 118.70 120.73 2yz0 s GLU 112 Ca 0.00 2.27 0.00 0.00 0.02 0.00 0.00 54.97 57.26 2yz0 s GLU 112 Cb 0.00 -3.38 0.00 0.00 0.10 0.00 0.00 34.13 30.85 2yz0 s GLU 112 CO 0.00 -0.63 0.00 0.44 0.02 0.00 0.00 175.26 175.09 2yz0 n ILE 113 N 4.32 0.00 -0.10 -1.63 -5.35 -1.26 -4.67 119.36 110.68 2yz0 n ILE 113 Ca 0.14 -0.31 -0.11 0.00 -0.27 0.00 0.00 62.75 62.20 2yz0 n ILE 113 Cb 0.40 0.94 -0.04 0.00 -1.74 0.00 0.00 39.64 39.21 2yz0 n ILE 113 CO 0.00 0.00 0.00 0.40 -1.76 0.00 0.00 176.55 175.19 2yz0 h ILE 114 N 0.00 1.27 -0.20 7.28 1.08 -1.97 -1.30 117.51 123.68 2yz0 h ILE 114 Ca 0.00 -1.05 -0.12 0.00 -0.39 0.00 0.00 64.86 63.30 2yz0 h ILE 114 Cb 0.00 1.38 -0.01 0.00 -3.07 0.00 0.00 36.82 35.12 2yz0 h ILE 114 CO 0.00 0.33 -0.38 0.15 -0.69 0.00 0.00 178.15 177.56 2yz0 h PHE 115 N 0.31 0.52 -0.13 1.37 3.57 -1.96 -1.80 116.94 118.81 2yz0 h PHE 115 Ca 0.08 -0.14 -0.03 0.00 3.53 0.00 0.00 57.97 61.41 2yz0 h PHE 115 Cb 0.51 -0.11 -0.00 0.00 2.79 0.00 0.00 35.95 39.13 2yz0 h PHE 115 CO 0.05 0.76 -0.03 0.93 -2.23 0.00 0.00 178.31 177.78 2yz0 h GLU 116 N 0.37 0.26 -0.70 1.11 4.39 -1.80 -0.37 114.58 117.84 2yz0 h GLU 116 Ca 0.04 -0.10 -0.06 0.00 0.34 0.00 0.00 59.36 59.58 2yz0 h GLU 116 Cb 0.84 -0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 29.44 2yz0 h GLU 116 CO 0.07 0.55 0.19 0.97 -1.16 0.00 0.00 179.01 179.63 2yz0 h ILE 117 N -0.06 1.26 -0.37 3.13 2.10 -1.20 0.42 117.51 122.78 2yz0 h ILE 117 Ca 0.03 -0.93 -0.07 0.00 1.08 0.00 0.00 64.86 64.97 2yz0 h ILE 117 Cb 0.46 0.53 -0.01 0.00 -1.09 0.00 0.00 36.82 36.71 2yz0 h ILE 117 CO 0.01 0.36 -0.06 0.71 -1.08 0.00 0.00 178.15 178.09 2yz0 h THR 118 N 1.04 1.27 -0.46 2.19 1.35 -1.29 0.64 112.91 117.65 2yz0 h THR 118 Ca 0.22 -1.11 -0.13 0.00 -0.55 0.00 0.00 66.41 64.84 2yz0 h THR 118 Cb 0.34 1.23 -0.01 0.00 -1.73 0.00 0.00 68.15 67.98 2yz0 h THR 118 CO -0.00 0.37 -0.22 -1.28 -0.25 0.00 0.00 175.52 174.14 2yz0 h SER 119 N 0.50 0.96 -0.19 5.36 0.87 -0.91 0.22 113.55 120.36 2yz0 h SER 119 Ca 0.10 -0.36 -0.08 0.00 -1.23 0.00 0.00 61.79 60.22 2yz0 h SER 119 Cb 0.56 -0.26 -0.00 0.00 -0.44 0.00 0.00 62.40 62.25 2yz0 h SER 119 CO 0.03 1.13 -0.18 0.15 -0.53 0.00 0.00 176.83 177.44 2yz0 h PHE 120 N 0.81 0.55 -0.46 2.24 3.04 -0.84 -1.02 116.94 121.25 2yz0 h PHE 120 Ca 0.11 -0.16 -0.08 0.00 3.98 0.00 0.00 57.97 61.81 2yz0 h PHE 120 Cb 0.78 -0.12 -0.02 0.00 2.56 0.00 0.00 35.95 39.16 2yz0 h PHE 120 CO 0.05 0.81 -0.04 1.79 -2.02 0.00 0.00 178.31 178.91 2yz0 h THR 121 N 0.12 1.27 0.10 4.41 1.35 -0.84 0.41 112.91 119.73 2yz0 h THR 121 Ca 0.03 -1.12 -0.00 0.00 -0.55 0.00 0.00 66.41 64.77 2yz0 h THR 121 Cb 0.72 1.06 0.00 0.00 -1.73 0.00 0.00 68.15 68.20 2yz0 h THR 121 CO 0.05 0.39 -0.05 -0.61 -0.25 0.00 0.00 175.52 175.04 2yz0 h GLN 122 N 0.68 -0.13 -0.33 4.72 -0.00 -0.97 0.18 115.11 119.27 2yz0 h GLN 122 Ca 0.13 0.01 -0.01 0.00 -0.00 0.00 0.00 58.65 58.77 2yz0 h GLN 122 Cb 0.55 0.03 -0.02 0.00 0.00 0.00 0.00 27.48 28.05 2yz0 h GLN 122 CO 0.03 0.14 0.17 1.05 0.00 0.00 0.00 178.83 180.21 2yz0 h GLU 123 N -0.38 0.47 -0.76 1.69 4.11 -1.19 0.23 114.58 118.76 2yz0 h GLU 123 Ca -0.01 -0.07 -0.06 0.00 0.07 0.00 0.00 59.36 59.29 2yz0 h GLU 123 Cb 0.32 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.45 2yz0 h GLU 123 CO 0.02 0.42 0.25 0.87 0.07 0.00 0.00 179.01 180.64 2yz0 h LYS 124 N 0.41 1.17 -0.33 1.06 1.79 -0.90 -0.23 116.57 119.53 2yz0 h LYS 124 Ca 0.12 -0.25 -0.16 0.00 -2.18 0.00 0.00 60.65 58.18 2yz0 h LYS 124 Cb 0.10 -0.17 -0.01 0.00 -1.58 0.00 0.00 32.23 30.57 2yz0 h LYS 124 CO -0.02 0.99 -0.43 1.25 -1.08 0.00 0.00 179.45 180.16 2yz0 h LEU 125 N 1.12 0.91 -0.20 2.94 7.12 -0.38 -1.24 115.31 125.57 2yz0 h LEU 125 Ca 0.25 -0.43 -0.04 0.00 0.13 0.00 0.00 57.88 57.79 2yz0 h LEU 125 Cb 0.30 -0.26 -0.01 0.00 -0.53 0.00 0.00 40.66 40.16 2yz0 h LEU 125 CO -0.01 1.20 -0.02 -0.78 -0.13 0.00 0.00 178.44 178.70 2yz0 h ASP 126 N 0.68 0.37 0.45 1.25 3.58 -0.30 -1.24 116.42 121.21 2yz0 h ASP 126 Ca 0.05 -0.33 -0.07 0.00 0.42 0.00 0.00 57.03 57.09 2yz0 h ASP 126 Cb 1.01 -0.10 -0.01 0.00 1.72 0.00 0.00 39.33 41.95 2yz0 h ASP 126 CO 0.10 0.62 -0.34 1.05 -2.88 0.00 0.00 179.24 177.78 2yz0 h GLU 127 N 0.12 0.00 0.23 0.28 -0.00 -1.05 -3.15 114.58 111.01 2yz0 h GLU 127 Ca 0.06 0.00 -0.01 0.00 -0.00 0.00 0.00 59.36 59.40 2yz0 h GLU 127 Cb 0.44 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.19 2yz0 h GLU 127 CO 0.01 0.34 -0.11 0.74 -0.00 0.00 0.00 179.01 180.00 2yz0 h PHE 128 N 0.00 -0.28 -0.87 2.06 -1.00 -1.04 -2.94 116.94 112.88 2yz0 h PHE 128 Ca -0.00 -0.01 0.17 0.00 2.81 0.00 0.00 57.97 60.94 2yz0 h PHE 128 Cb 0.66 0.09 -0.16 0.00 3.61 0.00 0.00 35.95 40.14 2yz0 h PHE 128 CO 0.00 0.09 -0.22 0.37 -1.61 0.00 0.00 178.31 176.94 2yz0 h GLN 129 N -0.91 -0.00 0.00 1.51 -0.00 -1.23 -2.74 115.11 111.74 2yz0 h GLN 129 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.62 2yz0 h GLN 129 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 27.48 27.98 2yz0 h GLN 129 CO 0.05 -0.00 0.00 -1.71 0.00 0.00 0.00 178.83 177.17 2yz0 n ASN 130 N -5.56 0.00 0.00 -0.69 2.85 -1.19 -4.93 115.26 105.74 2yz0 n ASN 130 Ca 0.13 0.77 0.00 0.00 -0.11 0.00 0.00 54.58 55.37 2yz0 n ASN 130 Cb 0.44 -0.27 0.00 0.00 1.24 0.00 0.00 39.78 41.19 2yz0 n ASN 130 CO 0.00 0.00 0.00 0.55 -2.11 0.00 0.00 177.26 175.70 2yz0 n VAL 131 N -1.34 0.00 -3.80 3.44 3.14 -1.04 -5.08 118.33 113.66 2yz0 n VAL 131 Ca 0.00 0.00 -0.13 0.00 -2.96 0.00 0.00 64.34 61.25 2yz0 n VAL 131 Cb 0.00 0.00 -0.13 0.00 -1.06 0.00 0.00 33.84 32.65 2yz0 n VAL 131 CO 0.00 0.00 0.00 -0.69 -6.46 0.00 0.00 176.83 169.68 2yz0 s VAL 132 N 0.00 -0.02 0.05 1.55 1.01 -1.24 -4.86 120.40 116.90 2yz0 s VAL 132 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 61.98 62.04 2yz0 s VAL 132 Cb 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 36.38 36.18 2yz0 s VAL 132 CO 0.00 0.03 0.00 0.59 0.00 0.00 0.00 175.10 175.72 2yz0 n ASN 133 N 3.42 -2.76 -4.44 3.32 3.02 -1.26 -4.85 115.26 111.71 2yz0 n ASN 133 Ca -0.17 0.25 -0.27 0.00 -0.03 0.00 0.00 54.58 54.36 2yz0 n ASN 133 Cb 0.57 -0.82 -0.12 0.00 -0.61 0.00 0.00 39.78 38.80 2yz0 n ASN 133 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 2yz0 s THR 134 N -0.60 2.45 -0.08 3.41 -1.32 -1.26 -4.37 115.64 113.86 2yz0 s THR 134 Ca 0.00 -1.97 0.05 0.00 -1.21 0.00 0.00 61.69 58.56 2yz0 s THR 134 Cb 0.00 -2.18 -0.00 0.00 -1.51 0.00 0.00 72.50 68.81 2yz0 s THR 134 CO 0.00 -0.10 -0.24 -1.58 -2.21 0.00 0.00 174.62 170.49 2yz0 s GLN 135 N -2.65 2.82 -0.58 7.08 0.74 -1.26 -4.84 119.66 120.97 2yz0 s GLN 135 Ca 0.21 -0.87 -0.13 0.00 0.05 0.00 0.00 55.36 54.61 2yz0 s GLN 135 Cb -0.08 -2.22 0.02 0.00 1.10 0.00 0.00 33.01 31.83 2yz0 s GLN 135 CO 0.10 0.25 0.64 0.45 -0.55 0.00 0.00 175.29 176.18 2yz0 n SER 136 N 3.31 -7.02 -0.30 6.67 2.88 -1.26 -4.83 113.62 113.07 2yz0 n SER 136 Ca -0.18 0.02 0.06 0.00 -1.33 0.00 0.00 58.87 57.43 2yz0 n SER 136 Cb 0.53 -4.15 0.15 0.00 -0.75 0.00 0.00 64.21 59.99 2yz0 n SER 136 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 2yz0 h LEU 137 N 1.24 -0.66 -0.63 2.46 5.85 -2.05 -3.52 115.31 118.01 2yz0 h LEU 137 Ca -0.20 0.25 0.00 0.00 0.84 0.00 0.00 57.88 58.77 2yz0 h LEU 137 Cb 1.13 0.49 0.00 0.00 0.37 0.00 0.00 40.66 42.66 2yz0 h LEU 137 CO 0.26 -0.28 0.00 -0.62 -0.34 0.00 0.00 178.44 177.46