#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yz0 n SER 2 N 0.00 0.00 -4.60 3.17 7.64 -1.26 -5.13 113.62 113.44 2yz0 n SER 2 Ca 0.00 0.00 -0.24 0.00 1.01 0.00 0.00 58.87 59.64 2yz0 n SER 2 Cb 0.00 0.00 0.12 0.00 -1.01 0.00 0.00 64.21 63.32 2yz0 n SER 2 CO 0.00 0.00 0.00 -1.48 -3.01 0.00 0.00 175.04 170.55 2yz0 s LEU 3 N 0.00 2.93 -0.72 -3.43 2.34 -1.26 -5.04 118.68 113.50 2yz0 s LEU 3 Ca 0.00 -0.27 -0.13 0.00 0.06 0.00 0.00 54.13 53.79 2yz0 s LEU 3 Cb 0.00 -2.02 0.19 0.00 -0.56 0.00 0.00 46.19 43.80 2yz0 s LEU 3 CO 0.00 -1.99 0.65 -0.94 -1.06 0.00 0.00 176.35 173.00 2yz0 s SER 4 N -4.76 6.38 0.29 1.48 1.04 -1.26 -4.95 113.70 111.92 2yz0 s SER 4 Ca 0.67 -2.50 -0.20 0.00 0.48 0.00 0.00 55.95 54.41 2yz0 s SER 4 Cb -0.05 -2.15 0.04 0.00 0.10 0.00 0.00 66.02 63.96 2yz0 s SER 4 CO 0.46 -0.61 0.78 -2.28 0.98 0.00 0.00 173.24 172.58 2yz0 s HIS 5 N 0.47 -0.08 -0.73 5.02 5.04 -1.26 -5.05 115.29 118.71 2yz0 s HIS 5 Ca 0.14 -0.42 -0.02 0.00 -1.54 0.00 0.00 55.06 53.22 2yz0 s HIS 5 Cb -0.16 0.74 0.39 0.00 0.04 0.00 0.00 32.58 33.59 2yz0 s HIS 5 CO -0.05 -1.27 2.06 -0.11 -2.34 0.00 0.00 174.74 173.02 2yz0 n LEU 6 N -0.49 7.57 0.00 8.88 0.00 -1.26 -4.68 117.00 127.01 2yz0 n LEU 6 Ca -0.05 -4.47 0.00 0.00 0.00 0.00 0.00 56.01 51.48 2yz0 n LEU 6 Cb 0.59 -1.03 0.00 0.00 0.00 0.00 0.00 43.42 42.99 2yz0 n LEU 6 CO 0.18 1.59 0.00 1.07 0.00 0.00 0.00 177.39 180.23 2yz0 n THR 7 N -0.67 0.00 0.23 1.96 5.66 -1.26 -4.98 114.28 115.22 2yz0 n THR 7 Ca 0.58 0.00 0.10 0.00 -3.05 0.00 0.00 64.05 61.68 2yz0 n THR 7 Cb 0.48 -1.25 0.54 0.00 -1.55 0.00 0.00 70.33 68.55 2yz0 n THR 7 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 175.07 171.95 2yz0 h LEU 8 N 0.00 0.00 -1.98 1.09 3.38 -1.93 -2.83 115.31 113.05 2yz0 h LEU 8 Ca 0.00 0.00 0.14 0.00 0.09 0.00 0.00 57.88 58.11 2yz0 h LEU 8 Cb 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 2yz0 h LEU 8 CO 0.00 0.21 0.35 0.44 0.09 0.00 0.00 178.44 179.53 2yz0 h ASP 9 N 0.00 0.02 -0.16 -0.43 3.32 -1.93 0.40 116.42 117.63 2yz0 h ASP 9 Ca -0.00 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.95 2yz0 h ASP 9 Cb 0.62 -0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.15 2yz0 h ASP 9 CO 0.03 0.01 -0.21 1.56 -1.72 0.00 0.00 179.24 178.90 2yz0 h GLN 10 N 0.02 0.60 0.00 3.56 1.08 -1.77 -2.64 115.11 115.96 2yz0 h GLN 10 Ca 0.23 -0.22 -0.06 0.00 -1.45 0.00 0.00 58.65 57.15 2yz0 h GLN 10 Cb 0.91 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 28.29 2yz0 h GLN 10 CO -0.01 0.78 -0.27 1.88 -0.95 0.00 0.00 178.83 180.26 2yz0 h TYR 11 N 0.54 0.00 -0.94 2.96 0.05 -1.08 -2.76 116.97 115.73 2yz0 h TYR 11 Ca 0.08 0.00 0.02 0.00 0.05 0.00 0.00 58.73 58.88 2yz0 h TYR 11 Cb 0.66 0.00 -0.05 0.00 1.01 0.00 0.00 36.73 38.35 2yz0 h TYR 11 CO 0.03 0.27 0.62 1.88 -1.05 0.00 0.00 178.16 179.90 2yz0 h TYR 12 N 0.00 1.16 -0.60 4.88 0.05 -1.34 -1.33 116.97 119.79 2yz0 h TYR 12 Ca -0.00 0.03 0.02 0.00 0.05 0.00 0.00 58.73 58.83 2yz0 h TYR 12 Cb 0.54 -0.39 -0.04 0.00 1.01 0.00 0.00 36.73 37.85 2yz0 h TYR 12 CO 0.00 0.70 0.38 0.93 -1.05 0.00 0.00 178.16 179.11 2yz0 h GLU 13 N 1.22 0.73 -0.11 4.88 4.39 -1.57 0.42 114.58 124.54 2yz0 h GLU 13 Ca 0.36 -0.04 -0.02 0.00 0.34 0.00 0.00 59.36 59.99 2yz0 h GLU 13 Cb -0.06 -0.16 -0.00 0.00 -0.10 0.00 0.00 28.75 28.42 2yz0 h GLU 13 CO -0.10 0.48 -0.02 0.82 -1.16 0.00 0.00 179.01 179.04 2yz0 h ILE 14 N 0.75 1.28 -0.42 3.13 5.03 -1.51 -2.23 117.51 123.54 2yz0 h ILE 14 Ca 0.24 -0.90 0.03 0.00 -0.12 0.00 0.00 64.86 64.11 2yz0 h ILE 14 Cb -0.01 1.65 -0.04 0.00 -3.03 0.00 0.00 36.82 35.39 2yz0 h ILE 14 CO -0.09 0.26 0.21 1.56 -0.68 0.00 0.00 178.15 179.41 2yz0 h GLN 15 N -0.09 0.41 -0.55 2.37 4.20 -1.04 -2.06 115.11 118.35 2yz0 h GLN 15 Ca 0.03 -0.02 0.03 0.00 0.06 0.00 0.00 58.65 58.74 2yz0 h GLN 15 Cb 0.41 -0.09 -0.04 0.00 0.30 0.00 0.00 27.48 28.06 2yz0 h GLN 15 CO 0.01 0.27 0.33 0.00 -0.67 0.00 0.00 178.83 178.77 2yz0 h ASN 17 N 0.65 0.43 -0.65 0.00 -1.24 -0.93 -1.64 115.58 112.20 2yz0 h ASN 17 Ca 0.22 -0.01 -0.06 0.00 0.71 0.00 0.00 56.30 57.16 2yz0 h ASN 17 Cb 0.03 -0.10 -0.03 0.00 0.73 0.00 0.00 38.32 38.95 2yz0 h ASN 17 CO -0.10 0.30 0.16 -0.33 -1.29 0.00 0.00 177.43 176.17 2yz0 h GLU 18 N 0.51 1.05 0.11 6.67 3.07 -0.63 0.27 114.58 125.62 2yz0 h GLU 18 Ca 0.18 -0.24 -0.01 0.00 -0.50 0.00 0.00 59.36 58.79 2yz0 h GLU 18 Cb 0.10 -0.14 0.00 0.00 -0.84 0.00 0.00 28.75 27.86 2yz0 h GLU 18 CO -0.04 0.93 -0.05 -0.07 -1.40 0.00 0.00 179.01 178.38 2yz0 h LEU 19 N 1.00 -0.12 -0.80 1.33 3.38 -1.04 -0.76 115.31 118.30 2yz0 h LEU 19 Ca 0.21 -0.15 -0.12 0.00 0.09 0.00 0.00 57.88 57.91 2yz0 h LEU 19 Cb 0.35 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 2yz0 h LEU 19 CO 0.00 0.08 -0.34 1.05 0.09 0.00 0.00 178.44 179.32 2yz0 h GLU 20 N -0.32 0.50 0.06 1.13 4.11 -1.40 0.18 114.58 118.84 2yz0 h GLU 20 Ca -0.01 -0.23 -0.00 0.00 0.07 0.00 0.00 59.36 59.19 2yz0 h GLU 20 Cb 0.26 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.51 2yz0 h GLU 20 CO 0.02 0.78 -0.03 0.00 0.07 0.00 0.00 179.01 179.85 2yz0 h ALA 21 N 1.21 -0.08 -0.04 1.06 0.00 -0.34 -2.80 119.26 118.27 2yz0 h ALA 21 Ca 0.05 -0.08 -0.20 0.00 0.00 0.00 0.00 54.91 54.68 2yz0 h ALA 21 Cb 0.80 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 2yz0 h ALA 21 CO 0.07 -0.48 -0.83 0.82 0.00 0.00 0.00 179.25 178.83 2yz0 h ILE 22 N -0.21 1.40 -0.89 0.00 5.03 -1.11 -3.19 117.51 118.53 2yz0 h ILE 22 Ca -0.01 -2.32 0.18 0.00 -0.12 0.00 0.00 64.86 62.60 2yz0 h ILE 22 Cb 0.19 2.27 -0.07 0.00 -3.03 0.00 0.00 36.82 36.18 2yz0 h ILE 22 CO 0.01 0.69 0.58 0.03 -0.68 0.00 0.00 178.15 178.79 2yz0 h ARG 23 N 0.24 0.48 -0.06 2.37 3.08 -0.56 0.31 114.38 120.23 2yz0 h ARG 23 Ca -0.05 -0.03 -0.08 0.00 0.07 0.00 0.00 59.98 59.89 2yz0 h ARG 23 Cb 1.43 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 31.36 2yz0 h ARG 23 CO 0.14 0.32 -0.35 1.03 -1.07 0.00 0.00 179.97 180.04 2yz0 h SER 24 N 0.50 0.13 0.12 7.04 0.87 -1.48 0.27 113.55 121.00 2yz0 h SER 24 Ca 0.46 -0.04 -0.17 0.00 -1.23 0.00 0.00 61.79 60.81 2yz0 h SER 24 Cb 1.02 -0.03 0.02 0.00 -0.44 0.00 0.00 62.40 62.96 2yz0 h SER 24 CO -0.20 0.47 -0.74 0.40 -0.53 0.00 0.00 176.83 176.23 2yz0 h ILE 25 N 0.11 1.53 -1.23 2.23 2.04 -0.61 -3.35 117.51 118.22 2yz0 h ILE 25 Ca 0.01 -2.51 -0.64 0.00 1.00 0.00 0.00 64.86 62.72 2yz0 h ILE 25 Cb 0.67 3.20 -0.35 0.00 -0.74 0.00 0.00 36.82 39.60 2yz0 h ILE 25 CO 0.05 0.70 0.10 -1.22 0.00 0.00 0.00 178.15 177.78 2yz0 n TYR 26 N -4.18 3.08 -0.33 1.37 4.01 0.07 -4.80 117.16 116.39 2yz0 n TYR 26 Ca -0.14 -2.67 0.24 0.00 -0.16 0.00 0.00 57.90 55.18 2yz0 n TYR 26 Cb 0.78 -0.80 0.47 0.00 -0.31 0.00 0.00 39.34 39.48 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 2.37 0.21 0.00 -0.72 2.86 -0.60 0.47 114.93 119.52 2yz0 h MET 27 Ca 0.47 -0.01 -0.00 0.00 -2.06 0.00 0.00 59.70 58.09 2yz0 h MET 27 Cb 0.89 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 32.50 2yz0 h MET 27 CO 1.17 0.14 -1.77 -0.25 1.06 0.00 0.00 176.91 177.27 2yz0 n ASP 28 N -5.14 1.18 -1.67 1.22 9.92 -1.26 -4.35 116.55 116.44 2yz0 n ASP 28 Ca 0.32 0.00 -0.02 0.00 -0.53 0.00 0.00 54.79 54.56 2yz0 n ASP 28 Cb 1.01 1.75 0.26 0.00 -0.64 0.00 0.00 41.12 43.51 2yz0 n ASP 28 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 2yz0 n ASP 29 N -2.09 4.33 -4.49 -2.24 9.92 0.16 -4.90 116.55 117.24 2yz0 n ASP 29 Ca -0.03 -2.86 -0.31 0.00 -0.53 0.00 0.00 54.79 51.05 2yz0 n ASP 29 Cb 0.44 -0.68 -0.12 0.00 -0.64 0.00 0.00 41.12 40.12 2yz0 n ASP 29 CO 0.00 0.00 0.00 0.12 0.13 0.00 0.00 177.20 177.45 2yz0 s PHE 30 N -2.39 2.66 -0.08 1.24 2.19 0.14 -1.50 117.98 120.25 2yz0 s PHE 30 Ca 0.42 -0.19 0.04 0.00 0.33 0.00 0.00 56.93 57.53 2yz0 s PHE 30 Cb 0.33 -1.53 0.00 0.00 -1.31 0.00 0.00 43.02 40.51 2yz0 s PHE 30 CO 0.11 0.26 -0.19 0.99 1.83 0.00 0.00 175.22 178.22 2yz0 s THR 31 N -0.90 1.64 -0.36 0.12 2.01 0.06 -4.91 115.64 113.30 2yz0 s THR 31 Ca 0.15 -0.78 -0.18 0.00 0.31 0.00 0.00 61.69 61.18 2yz0 s THR 31 Cb -0.11 -1.43 -0.00 0.00 0.01 0.00 0.00 72.50 70.97 2yz0 s THR 31 CO 0.05 0.47 0.50 -0.62 -0.69 0.00 0.00 174.62 174.33 2yz0 s ASP 32 N 0.40 6.30 -0.00 3.53 -1.08 -1.26 -2.27 116.67 122.28 2yz0 s ASP 32 Ca -0.15 -0.11 0.02 0.00 -0.52 0.00 0.00 52.55 51.80 2yz0 s ASP 32 Cb -0.16 -2.26 -0.03 0.00 -1.46 0.00 0.00 42.92 39.00 2yz0 s ASP 32 CO 0.06 -0.49 0.06 0.00 0.52 0.00 0.00 175.17 175.32 2yz0 n LEU 33 N 5.74 0.03 -4.60 -1.34 -0.00 -1.26 -4.98 117.00 110.59 2yz0 n LEU 33 Ca -0.05 -0.13 -0.46 0.00 -0.00 0.00 0.00 56.01 55.37 2yz0 n LEU 33 Cb 0.49 0.00 -0.03 0.00 -0.00 0.00 0.00 43.42 43.88 2yz0 n LEU 33 CO 0.45 0.01 0.69 0.41 -0.00 0.00 0.00 177.39 178.95 2yz0 n THR 34 N -1.44 1.45 -1.55 1.47 -1.04 -1.24 -4.71 114.28 107.22 2yz0 n THR 34 Ca -0.00 -0.36 -0.15 0.00 -2.04 0.00 0.00 64.05 61.50 2yz0 n THR 34 Cb 0.05 -1.02 -0.10 0.00 -1.82 0.00 0.00 70.33 67.44 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 1.27 0.46 -2.75 -2.82 5.02 -1.26 -4.73 118.16 113.35 2yz0 n LYS 35 Ca 0.12 -0.72 -0.23 0.00 -2.02 0.00 0.00 58.31 55.46 2yz0 n LYS 35 Cb 0.29 -3.24 -0.01 0.00 -0.02 0.00 0.00 35.03 32.05 2yz0 n LYS 35 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2yz0 n ARG 36 N 8.23 2.66 -1.81 1.97 5.12 -1.26 -3.97 116.66 127.60 2yz0 n ARG 36 Ca 0.51 -4.26 -0.29 0.00 -1.93 0.00 0.00 57.85 51.87 2yz0 n ARG 36 Cb 0.38 -2.01 0.10 0.00 -1.16 0.00 0.00 32.46 29.78 2yz0 n ARG 36 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 2yz0 s LYS 37 N -3.30 1.71 -0.09 5.56 -0.14 -1.26 -5.04 119.74 117.17 2yz0 s LYS 37 Ca 0.44 0.14 -0.04 0.00 -1.36 0.00 0.00 55.97 55.15 2yz0 s LYS 37 Cb 0.37 -1.92 -0.01 0.00 -1.68 0.00 0.00 37.83 34.59 2yz0 s LYS 37 CO -0.12 -1.78 -0.07 1.03 -0.76 0.00 0.00 175.35 173.65 2yz0 h SER 38 N -1.19 0.00 -2.53 2.83 0.87 -1.99 -3.46 113.55 108.08 2yz0 h SER 38 Ca -0.47 0.00 -0.50 0.00 -1.23 0.00 0.00 61.79 59.59 2yz0 h SER 38 Cb 1.33 0.00 -0.38 0.00 -0.44 0.00 0.00 62.40 62.91 2yz0 h SER 38 CO 0.64 0.49 -0.77 -0.44 -0.53 0.00 0.00 176.83 176.22 2yz0 s SER 39 N -5.13 2.80 0.00 6.23 0.01 -1.26 -4.90 113.70 111.45 2yz0 s SER 39 Ca -0.06 -1.55 0.00 0.00 1.31 0.00 0.00 55.95 55.65 2yz0 s SER 39 Cb 0.01 -0.14 0.00 0.00 0.21 0.00 0.00 66.02 66.10 2yz0 s SER 39 CO 0.08 -0.37 0.00 1.87 0.41 0.00 0.00 173.24 175.24 2yz0 n TRP 40 N 4.73 -0.17 -3.61 2.43 -0.00 -1.26 -5.16 117.44 114.41 2yz0 n TRP 40 Ca 0.03 0.00 -0.10 0.00 -0.00 0.00 0.00 57.50 57.43 2yz0 n TRP 40 Cb 0.41 0.03 -0.02 0.00 -0.00 0.00 0.00 31.31 31.73 2yz0 n TRP 40 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 177.69 178.03 2yz0 s ASP 41 N -1.81 -0.43 -0.46 5.87 2.15 -1.26 -5.11 116.67 115.63 2yz0 s ASP 41 Ca 0.00 -0.27 0.07 0.00 0.43 0.00 0.00 52.55 52.78 2yz0 s ASP 41 Cb 0.00 0.65 0.26 0.00 -0.30 0.00 0.00 42.92 43.53 2yz0 s ASP 41 CO 0.00 -1.12 0.82 2.29 -0.17 0.00 0.00 175.17 176.99 2yz0 n LYS 42 N -0.41 0.80 -2.61 4.34 2.85 -1.26 -4.32 118.16 117.56 2yz0 n LYS 42 Ca -0.12 -2.19 -0.28 0.00 -1.05 0.00 0.00 58.31 54.67 2yz0 n LYS 42 Cb 0.63 -1.37 -0.01 0.00 -0.65 0.00 0.00 35.03 33.63 2yz0 n LYS 42 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 177.40 178.39 2yz0 n GLN 43 N 1.37 3.39 -1.56 -1.58 6.02 -1.26 -5.08 117.38 118.68 2yz0 n GLN 43 Ca 0.12 -4.59 -0.32 0.00 -0.01 0.00 0.00 57.00 52.20 2yz0 n GLN 43 Cb 0.62 -2.25 0.06 0.00 1.02 0.00 0.00 30.24 29.69 2yz0 n GLN 43 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 2yz0 s PRO 44 N -3.56 2.58 -0.00 -1.09 0.04 -1.26 -4.66 135.00 127.05 2yz0 s PRO 44 Ca 0.48 1.30 0.00 0.00 0.04 0.00 0.00 61.00 62.83 2yz0 s PRO 44 Cb 0.36 -1.93 0.00 0.00 0.04 0.00 0.00 34.50 32.97 2yz0 s PRO 44 CO -0.18 -1.41 0.65 0.94 0.04 0.00 0.00 177.00 177.03 2yz0 n GLN 45 N -2.86 0.04 0.00 4.56 7.27 -1.26 -4.96 117.38 120.16 2yz0 n GLN 45 Ca 0.10 -0.66 0.00 0.00 0.07 0.00 0.00 57.00 56.51 2yz0 n GLN 45 Cb 0.52 -0.51 0.00 0.00 2.41 0.00 0.00 30.24 32.66 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 -0.01 0.00 -0.95 1.69 0.13 -1.26 -4.60 119.36 114.36 2yz0 n ILE 46 Ca 0.00 0.00 -0.32 0.00 -1.10 0.00 0.00 62.75 61.33 2yz0 n ILE 46 Cb 0.55 0.00 -0.01 0.00 -0.84 0.00 0.00 39.64 39.34 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 0.94 -3.88 9.51 -0.00 -1.26 -4.82 119.36 119.85 2yz0 n ILE 47 Ca 0.00 -0.35 -0.10 0.00 -0.00 0.00 0.00 62.75 62.30 2yz0 n ILE 47 Cb 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 39.64 39.58 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 -0.93 0.22 0.05 4.28 -0.71 -1.21 -3.67 117.98 116.02 2yz0 s PHE 48 Ca 0.43 -0.58 0.04 0.00 -1.04 0.00 0.00 56.93 55.78 2yz0 s PHE 48 Cb -0.55 0.08 -0.04 0.00 -1.21 0.00 0.00 43.02 41.30 2yz0 s PHE 48 CO 0.42 -0.77 -0.01 -1.21 -1.34 0.00 0.00 175.22 172.31 2yz0 s GLU 49 N -3.93 2.61 -0.03 1.99 2.02 -0.96 -3.24 118.70 117.15 2yz0 s GLU 49 Ca 0.14 -0.75 0.04 0.00 0.02 0.00 0.00 54.97 54.41 2yz0 s GLU 49 Cb 0.02 -2.57 -0.00 0.00 0.10 0.00 0.00 34.13 31.68 2yz0 s GLU 49 CO -0.02 0.57 -0.14 0.42 0.02 0.00 0.00 175.26 176.12 2yz0 s ILE 50 N -1.20 1.19 -0.20 -1.63 -1.09 -1.06 -0.76 121.20 116.46 2yz0 s ILE 50 Ca 0.23 -0.59 -0.16 0.00 -2.23 0.00 0.00 60.65 57.89 2yz0 s ILE 50 Cb -0.12 -1.03 -0.04 0.00 -1.58 0.00 0.00 42.46 39.70 2yz0 s ILE 50 CO 0.14 0.35 0.43 -0.89 -1.23 0.00 0.00 174.94 173.74 2yz0 s THR 51 N 0.06 5.18 0.35 2.92 2.01 -0.56 -2.15 115.64 123.44 2yz0 s THR 51 Ca -0.03 0.76 0.09 0.00 0.31 0.00 0.00 61.69 62.83 2yz0 s THR 51 Cb -0.10 -3.75 -0.06 0.00 0.01 0.00 0.00 72.50 68.59 2yz0 s THR 51 CO 0.01 0.24 -0.09 -0.76 -0.69 0.00 0.00 174.62 173.33 2yz0 s LEU 52 N 1.36 2.75 -0.07 4.42 1.43 -0.54 -4.81 118.68 123.23 2yz0 s LEU 52 Ca 0.20 -1.19 -0.29 0.00 -1.03 0.00 0.00 54.13 51.82 2yz0 s LEU 52 Cb -0.15 -1.02 0.11 0.00 0.03 0.00 0.00 46.19 45.15 2yz0 s LEU 52 CO 0.08 -0.21 0.89 -0.13 0.23 0.00 0.00 176.35 177.21 2yz0 s ARG 53 N -3.62 0.79 0.40 1.70 3.00 -1.26 -2.68 118.95 117.27 2yz0 s ARG 53 Ca 0.33 -0.04 -0.06 0.00 0.00 0.00 0.00 55.73 55.96 2yz0 s ARG 53 Cb 0.02 0.37 0.10 0.00 0.00 0.00 0.00 34.95 35.44 2yz0 s ARG 53 CO 0.17 -0.29 0.22 0.43 0.00 0.00 0.00 175.30 175.82 2yz0 n SER 54 N 0.33 -2.33 0.01 0.23 7.64 -0.40 -4.95 113.62 114.15 2yz0 n SER 54 Ca -0.11 -0.22 -0.12 0.00 1.01 0.00 0.00 58.87 59.42 2yz0 n SER 54 Cb 0.60 -0.27 -0.14 0.00 -1.01 0.00 0.00 64.21 63.38 2yz0 n SER 54 CO 0.00 0.00 0.00 -0.37 -3.01 0.00 0.00 175.04 171.66 2yz0 h VAL 55 N -2.31 0.97 -3.66 0.44 -1.51 -1.90 -3.48 116.25 104.80 2yz0 h VAL 55 Ca -0.10 -2.74 0.00 0.00 -1.23 0.00 0.00 66.70 62.63 2yz0 h VAL 55 Cb 0.33 2.56 0.00 0.00 -2.13 0.00 0.00 31.29 32.05 2yz0 h VAL 55 CO 0.06 0.69 0.00 -0.67 -1.23 0.00 0.00 177.57 176.42 2yz0 n ASP 56 N -3.25 1.94 -0.00 4.19 2.03 -1.26 -5.08 116.55 115.12 2yz0 n ASP 56 Ca -0.17 -0.66 -0.00 0.00 0.52 0.00 0.00 54.79 54.48 2yz0 n ASP 56 Cb 1.04 0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 41.43 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 2.30 -4.51 -0.67 4.76 -1.21 -4.40 118.16 114.42 2yz0 n LYS 57 Ca 0.00 -0.00 -0.32 0.00 -2.87 0.00 0.00 58.31 55.12 2yz0 n LYS 57 Cb 0.00 -1.02 -0.11 0.00 -1.84 0.00 0.00 35.03 32.06 2yz0 n LYS 57 CO 0.00 0.00 0.00 -1.83 -1.37 0.00 0.00 177.40 174.20 2yz0 s GLU 58 N -2.03 2.44 0.25 1.97 -1.05 -1.26 -1.27 118.70 117.74 2yz0 s GLU 58 Ca -0.00 -0.78 0.23 0.00 -0.15 0.00 0.00 54.97 54.26 2yz0 s GLU 58 Cb 0.00 -2.43 0.97 0.00 -0.44 0.00 0.00 34.13 32.23 2yz0 s GLU 58 CO 0.03 0.59 1.70 -0.35 0.95 0.00 0.00 175.26 178.18 2yz0 n PRO 59 N 1.55 0.19 -3.78 -4.83 -0.04 -1.26 -4.95 135.00 121.88 2yz0 n PRO 59 Ca -0.15 0.42 -0.15 0.00 -0.04 0.00 0.00 63.50 63.57 2yz0 n PRO 59 Cb 0.52 -1.86 -0.06 0.00 -0.04 0.00 0.00 33.50 32.07 2yz0 n PRO 59 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 2yz0 n VAL 60 N -2.21 0.00 0.01 0.52 0.24 -0.40 -5.07 118.33 111.43 2yz0 n VAL 60 Ca 0.02 -1.91 0.00 0.00 -2.04 0.00 0.00 64.34 60.41 2yz0 n VAL 60 Cb 0.22 0.98 -0.00 0.00 -1.47 0.00 0.00 33.84 33.57 2yz0 n VAL 60 CO 0.00 0.00 0.00 -1.84 -2.14 0.00 0.00 176.83 172.85 2yz0 n GLU 61 N -0.51 4.87 -2.42 7.34 0.28 -1.12 -3.30 120.64 125.77 2yz0 n GLU 61 Ca 0.06 -0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.06 2yz0 n GLU 61 Cb 0.49 -0.66 0.00 0.00 1.43 0.00 0.00 31.44 32.70 2yz0 n GLU 61 CO 0.00 0.00 0.00 0.43 -0.16 0.00 0.00 177.13 177.40 2yz0 n SER 62 N -1.16 -4.68 -4.39 -1.84 7.64 -1.26 -1.28 113.62 106.66 2yz0 n SER 62 Ca 0.00 0.29 -0.35 0.00 1.01 0.00 0.00 58.87 59.82 2yz0 n SER 62 Cb 0.01 -1.12 -0.13 0.00 -1.01 0.00 0.00 64.21 61.96 2yz0 n SER 62 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2yz0 s SER 63 N -0.71 4.57 0.01 6.43 1.04 -1.26 -1.88 113.70 121.89 2yz0 s SER 63 Ca 0.00 -0.29 0.02 0.00 0.48 0.00 0.00 55.95 56.16 2yz0 s SER 63 Cb 0.00 -1.78 -0.01 0.00 0.10 0.00 0.00 66.02 64.33 2yz0 s SER 63 CO 0.00 0.03 -0.06 -0.63 0.98 0.00 0.00 173.24 173.56 2yz0 s ILE 64 N 1.17 0.47 -0.27 -1.02 1.01 -1.09 -2.18 121.20 119.28 2yz0 s ILE 64 Ca 0.02 -0.41 -0.06 0.00 0.00 0.00 0.00 60.65 60.21 2yz0 s ILE 64 Cb -0.14 -0.43 0.01 0.00 0.01 0.00 0.00 42.46 41.90 2yz0 s ILE 64 CO 0.00 0.03 0.04 -0.89 0.00 0.00 0.00 174.94 174.12 2yz0 s THR 65 N -0.38 3.74 -0.32 2.92 2.01 -1.13 -1.46 115.64 121.02 2yz0 s THR 65 Ca -0.00 -0.66 -0.16 0.00 0.31 0.00 0.00 61.69 61.17 2yz0 s THR 65 Cb -0.04 -2.88 -0.02 0.00 0.01 0.00 0.00 72.50 69.58 2yz0 s THR 65 CO -0.00 0.18 0.43 -0.76 -0.69 0.00 0.00 174.62 173.78 2yz0 s LEU 66 N 1.48 4.29 -0.32 4.42 1.43 -0.92 -2.14 118.68 126.92 2yz0 s LEU 66 Ca 0.03 0.01 -0.09 0.00 -1.03 0.00 0.00 54.13 53.05 2yz0 s LEU 66 Cb -0.16 -2.47 0.01 0.00 0.03 0.00 0.00 46.19 43.59 2yz0 s LEU 66 CO 0.01 -0.36 0.14 -2.28 0.23 0.00 0.00 176.35 174.10 2yz0 s HIS 67 N 2.19 3.19 -0.10 0.29 5.65 -1.03 -2.55 115.29 122.93 2yz0 s HIS 67 Ca 0.16 -0.81 -0.04 0.00 0.25 0.00 0.00 55.06 54.61 2yz0 s HIS 67 Cb -0.16 -2.35 -0.04 0.00 -1.18 0.00 0.00 32.58 28.86 2yz0 s HIS 67 CO 0.12 -0.55 0.06 -0.06 -0.65 0.00 0.00 174.74 173.66 2yz0 s PHE 68 N 1.56 3.36 -0.32 3.88 0.40 -1.20 -2.83 117.98 122.83 2yz0 s PHE 68 Ca 0.03 0.34 -0.01 0.00 -0.60 0.00 0.00 56.93 56.69 2yz0 s PHE 68 Cb -0.18 -1.86 0.07 0.00 0.51 0.00 0.00 43.02 41.56 2yz0 s PHE 68 CO 0.05 0.59 0.03 0.00 0.70 0.00 0.00 175.22 176.59 2yz0 s ALA 69 N -0.94 2.86 -1.19 5.36 0.00 -0.48 -3.30 121.76 124.07 2yz0 s ALA 69 Ca 0.14 -1.97 -0.21 0.00 0.00 0.00 0.00 51.96 49.92 2yz0 s ALA 69 Cb -0.12 -1.99 -0.01 0.00 0.00 0.00 0.00 23.12 21.01 2yz0 s ALA 69 CO 0.03 -1.40 1.81 -1.64 0.00 0.00 0.00 175.76 174.57 2yz0 s MET 70 N 1.18 3.18 0.94 0.00 -1.94 -1.26 -3.10 119.30 118.30 2yz0 s MET 70 Ca -0.02 -1.41 -0.17 0.00 -1.71 0.00 0.00 55.69 52.39 2yz0 s MET 70 Cb -0.20 -5.35 -0.14 0.00 2.01 0.00 0.00 34.83 31.14 2yz0 s MET 70 CO -0.03 -3.09 -0.67 0.25 -0.01 0.00 0.00 175.02 171.47 2yz0 n THR 71 N 7.18 0.02 0.92 2.05 -2.24 -1.26 -4.75 114.28 116.19 2yz0 n THR 71 Ca 0.45 -0.49 0.08 0.00 -2.27 0.00 0.00 64.05 61.82 2yz0 n THR 71 Cb 0.47 -0.03 0.44 0.00 -2.10 0.00 0.00 70.33 69.11 2yz0 n THR 71 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 2yz0 n PRO 72 N 2.18 0.43 -0.02 -0.78 -0.04 -1.26 -2.38 135.00 133.13 2yz0 n PRO 72 Ca -0.00 0.03 -0.01 0.00 -0.04 0.00 0.00 63.50 63.48 2yz0 n PRO 72 Cb 0.55 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.45 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 -1.06 1.78 -1.46 0.54 2.81 -1.26 -4.88 117.12 113.59 2yz0 n MET 73 Ca 0.11 -0.03 -0.38 0.00 -1.81 0.00 0.00 57.70 55.58 2yz0 n MET 73 Cb 0.07 -1.19 0.04 0.00 -0.71 0.00 0.00 33.22 31.42 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 -2.07 -0.73 0.43 2.03 4.19 -1.00 -0.78 117.16 119.23 2yz0 n TYR 74 Ca -0.08 0.44 0.10 0.00 3.31 0.00 0.00 57.90 61.68 2yz0 n TYR 74 Cb 0.53 -1.95 0.42 0.00 0.49 0.00 0.00 39.34 38.83 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 -0.01 0.12 -0.29 2.98 -0.04 -1.26 -4.77 135.00 131.73 2yz0 n PRO 75 Ca 0.12 0.36 0.03 0.00 -0.04 0.00 0.00 63.50 63.97 2yz0 n PRO 75 Cb 0.47 -1.73 0.09 0.00 -0.04 0.00 0.00 33.50 32.29 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 -1.96 0.20 -3.72 0.54 9.36 0.04 -4.43 117.16 117.20 2yz0 n TYR 76 Ca 0.03 0.96 -0.21 0.00 3.32 0.00 0.00 57.90 62.00 2yz0 n TYR 76 Cb 0.20 -0.91 -0.04 0.00 -0.63 0.00 0.00 39.34 37.97 2yz0 n TYR 76 CO 0.00 0.00 0.00 0.95 0.22 0.00 0.00 176.86 178.03 2yz0 s THR 77 N -5.91 3.05 -0.10 2.97 -4.23 -1.22 -5.10 115.64 105.10 2yz0 s THR 77 Ca -0.11 -1.39 -0.21 0.00 -1.18 0.00 0.00 61.69 58.79 2yz0 s THR 77 Cb 0.20 -3.08 -0.04 0.00 1.34 0.00 0.00 72.50 70.92 2yz0 s THR 77 CO 0.60 -0.09 0.60 0.00 -0.54 0.00 0.00 174.62 175.19 2yz0 s ALA 78 N -2.40 3.41 1.06 3.99 0.00 -1.26 -4.16 121.76 122.40 2yz0 s ALA 78 Ca 0.44 -0.03 -0.05 0.00 0.00 0.00 0.00 51.96 52.32 2yz0 s ALA 78 Cb -0.04 -2.83 0.08 0.00 0.00 0.00 0.00 23.12 20.32 2yz0 s ALA 78 CO 0.27 -0.10 0.28 -0.35 0.00 0.00 0.00 175.76 175.85 2yz0 n PRO 79 N 3.85 -1.56 -5.21 0.00 -0.04 -1.26 -4.87 135.00 125.92 2yz0 n PRO 79 Ca -0.04 -0.44 -0.31 0.00 -0.04 0.00 0.00 63.50 62.67 2yz0 n PRO 79 Cb 0.51 -0.41 -0.17 0.00 -0.04 0.00 0.00 33.50 33.39 2yz0 n PRO 79 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 2yz0 s GLU 80 N -3.62 2.69 0.01 0.54 2.12 -1.18 -4.90 118.70 114.36 2yz0 s GLU 80 Ca 0.18 -0.87 0.07 0.00 0.36 0.00 0.00 54.97 54.72 2yz0 s GLU 80 Cb -0.02 -2.16 -0.02 0.00 0.26 0.00 0.00 34.13 32.19 2yz0 s GLU 80 CO 0.14 0.28 -0.22 0.42 -0.54 0.00 0.00 175.26 175.33 2yz0 s ILE 81 N 0.08 1.79 -0.03 -3.70 -1.09 -1.25 -1.38 121.20 115.61 2yz0 s ILE 81 Ca -0.10 -1.10 -0.07 0.00 -2.23 0.00 0.00 60.65 57.14 2yz0 s ILE 81 Cb -0.15 -1.52 0.01 0.00 -1.58 0.00 0.00 42.46 39.22 2yz0 s ILE 81 CO 0.06 0.38 0.17 -1.83 -1.23 0.00 0.00 174.94 172.49 2yz0 s GLU 82 N -0.85 0.36 -0.14 2.79 -1.05 -1.13 -4.97 118.70 113.69 2yz0 s GLU 82 Ca 0.09 -0.06 -0.09 0.00 -0.15 0.00 0.00 54.97 54.75 2yz0 s GLU 82 Cb -0.09 0.16 -0.05 0.00 -0.44 0.00 0.00 34.13 33.71 2yz0 s GLU 82 CO 0.00 -0.07 0.17 -0.06 0.95 0.00 0.00 175.26 176.26 2yz0 s PHE 83 N -0.64 3.53 0.38 4.83 0.08 -1.26 -2.48 117.98 122.42 2yz0 s PHE 83 Ca -0.07 0.50 0.04 0.00 0.12 0.00 0.00 56.93 57.52 2yz0 s PHE 83 Cb -0.04 -2.09 -0.06 0.00 -0.57 0.00 0.00 43.02 40.26 2yz0 s PHE 83 CO 0.01 0.51 0.05 0.15 -0.10 0.00 0.00 175.22 175.84 2yz0 s LYS 84 N -0.36 1.82 0.00 0.44 -0.14 -0.91 -4.90 119.74 115.69 2yz0 s LYS 84 Ca 0.13 -2.05 0.00 0.00 -1.36 0.00 0.00 55.97 52.70 2yz0 s LYS 84 Cb -0.12 -1.10 0.00 0.00 -1.68 0.00 0.00 37.83 34.93 2yz0 s LYS 84 CO 0.03 -0.21 0.00 0.09 -0.76 0.00 0.00 175.35 174.50 2yz0 n ASN 85 N -0.90 0.00 -1.76 2.83 3.02 -1.26 -2.82 115.26 114.37 2yz0 n ASN 85 Ca -0.05 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.50 2yz0 n ASN 85 Cb 0.67 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.84 2yz0 n ASN 85 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 2yz0 n VAL 86 N 0.00 -0.90 -0.05 2.41 0.24 -0.93 -4.93 118.33 114.17 2yz0 n VAL 86 Ca 0.00 0.21 -0.04 0.00 -2.04 0.00 0.00 64.34 62.47 2yz0 n VAL 86 Cb 0.00 -1.42 -0.01 0.00 -1.47 0.00 0.00 33.84 30.93 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 1.01 0.31 -0.54 7.34 10.64 -1.24 -4.42 117.38 130.48 2yz0 n GLN 87 Ca 0.00 0.32 -0.03 0.00 -1.83 0.00 0.00 57.00 55.46 2yz0 n GLN 87 Cb 0.21 -1.26 0.01 0.00 -0.86 0.00 0.00 30.24 28.33 2yz0 n GLN 87 CO 0.00 0.00 0.00 -1.71 -1.83 0.00 0.00 177.06 173.52 2yz0 n ASN 88 N -3.77 5.37 -3.95 2.61 5.15 -1.26 -4.80 115.26 114.61 2yz0 n ASN 88 Ca -0.06 -2.50 -0.10 0.00 -0.60 0.00 0.00 54.58 51.32 2yz0 n ASN 88 Cb 0.23 -1.07 -0.11 0.00 -0.53 0.00 0.00 39.78 38.30 2yz0 n ASN 88 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2yz0 s VAL 89 N -0.43 0.10 -0.06 3.44 1.01 -1.26 -4.92 120.40 118.28 2yz0 s VAL 89 Ca 0.06 -0.81 -0.09 0.00 0.00 0.00 0.00 61.98 61.13 2yz0 s VAL 89 Cb 0.05 -0.29 -0.03 0.00 0.00 0.00 0.00 36.38 36.10 2yz0 s VAL 89 CO -0.00 -0.45 -0.18 0.23 0.00 0.00 0.00 175.10 174.70 2yz0 n MET 90 N 1.63 0.28 0.00 2.72 2.81 -1.26 -5.00 117.12 118.30 2yz0 n MET 90 Ca -0.23 0.11 0.00 0.00 -1.81 0.00 0.00 57.70 55.77 2yz0 n MET 90 Cb 0.55 -0.96 0.00 0.00 -0.71 0.00 0.00 33.22 32.11 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 -3.85 0.00 -0.19 7.83 5.75 -1.26 -4.96 116.55 119.87 2yz0 n ASP 91 Ca -0.07 0.00 -0.02 0.00 -0.01 0.00 0.00 54.79 54.69 2yz0 n ASP 91 Cb 0.27 0.00 0.08 0.00 -1.03 0.00 0.00 41.12 40.44 2yz0 n ASP 91 CO 0.00 0.00 0.00 -1.28 -0.11 0.00 0.00 177.20 175.81 2yz0 h SER 92 N 0.00 0.30 -0.39 -1.12 0.87 -1.99 0.22 113.55 111.45 2yz0 h SER 92 Ca 0.00 0.05 -0.12 0.00 -1.23 0.00 0.00 61.79 60.50 2yz0 h SER 92 Cb 0.00 0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 61.96 2yz0 h SER 92 CO 0.00 0.19 -0.21 1.56 -0.53 0.00 0.00 176.83 177.84 2yz0 h GLN 93 N 0.46 0.83 -0.17 2.24 7.50 -1.99 -1.61 115.11 122.37 2yz0 h GLN 93 Ca 0.27 -0.37 0.02 0.00 0.50 0.00 0.00 58.65 59.06 2yz0 h GLN 93 Cb 0.26 -0.02 -0.02 0.00 0.05 0.00 0.00 27.48 27.76 2yz0 h GLN 93 CO -0.23 1.01 0.05 -0.07 -1.50 0.00 0.00 178.83 178.08 2yz0 h LEU 94 N 0.63 0.05 -1.04 1.46 4.07 -1.77 -2.08 115.31 116.63 2yz0 h LEU 94 Ca 0.08 0.02 -0.08 0.00 0.08 0.00 0.00 57.88 57.98 2yz0 h LEU 94 Cb 0.77 0.01 -0.02 0.00 1.08 0.00 0.00 40.66 42.51 2yz0 h LEU 94 CO 0.06 0.06 -0.17 1.56 -1.08 0.00 0.00 178.44 178.87 2yz0 h GLN 95 N 0.13 0.48 -0.98 1.13 4.20 -0.96 -2.77 115.11 116.34 2yz0 h GLN 95 Ca 0.07 -0.15 0.02 0.00 0.06 0.00 0.00 58.65 58.64 2yz0 h GLN 95 Cb 0.05 -0.04 -0.05 0.00 0.30 0.00 0.00 27.48 27.73 2yz0 h GLN 95 CO -0.08 0.64 0.65 1.98 -0.67 0.00 0.00 178.83 181.35 2yz0 h MET 96 N 0.44 1.27 -0.43 1.46 4.05 -0.75 -2.41 114.93 118.57 2yz0 h MET 96 Ca 0.08 -0.08 -0.09 0.00 -0.28 0.00 0.00 59.70 59.33 2yz0 h MET 96 Cb 0.55 -0.29 -0.01 0.00 -0.80 0.00 0.00 31.60 31.05 2yz0 h MET 96 CO 0.04 0.84 -0.09 -0.07 0.23 0.00 0.00 176.91 177.86 2yz0 h LEU 97 N 1.31 0.82 -0.83 3.39 3.38 -1.12 -3.01 115.31 119.26 2yz0 h LEU 97 Ca 0.37 -0.35 0.09 0.00 0.09 0.00 0.00 57.88 58.07 2yz0 h LEU 97 Cb -0.12 -0.22 -0.07 0.00 0.09 0.00 0.00 40.66 40.33 2yz0 h LEU 97 CO -0.09 0.98 0.47 0.11 0.09 0.00 0.00 178.44 180.01 2yz0 h LYS 98 N 0.65 0.77 -0.55 1.13 1.79 -1.25 0.32 116.57 119.43 2yz0 h LYS 98 Ca 0.11 -0.05 0.01 0.00 -2.18 0.00 0.00 60.65 58.54 2yz0 h LYS 98 Cb 0.62 -0.17 -0.03 0.00 -1.58 0.00 0.00 32.23 31.06 2yz0 h LYS 98 CO 0.04 0.51 0.36 0.77 -1.08 0.00 0.00 179.45 180.05 2yz0 h SER 99 N 0.80 0.62 0.62 0.86 0.02 -1.34 -1.93 113.55 113.21 2yz0 h SER 99 Ca 0.40 -0.01 -0.08 0.00 -0.84 0.00 0.00 61.79 61.26 2yz0 h SER 99 Cb 0.36 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.74 2yz0 h SER 99 CO -0.24 0.45 -0.37 -0.33 -1.14 0.00 0.00 176.83 175.20 2yz0 h GLU 100 N 0.74 0.00 -0.06 3.45 5.08 -1.21 -2.81 114.58 119.78 2yz0 h GLU 100 Ca 0.21 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.58 2yz0 h GLU 100 Cb -0.07 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.18 2yz0 h GLU 100 CO -0.05 0.37 0.04 0.74 -1.00 0.00 0.00 179.01 179.11 2yz0 h PHE 101 N 0.00 0.00 -0.17 4.33 0.04 -0.14 -0.41 116.94 120.58 2yz0 h PHE 101 Ca -0.00 0.00 -0.13 0.00 2.80 0.00 0.00 57.97 60.64 2yz0 h PHE 101 Cb 0.78 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.93 2yz0 h PHE 101 CO 0.00 0.00 -0.40 -0.22 -0.60 0.00 0.00 178.31 177.09 2yz0 h LYS 102 N 0.00 0.58 -0.30 1.51 3.64 -1.43 -1.73 116.57 118.83 2yz0 h LYS 102 Ca 0.03 -0.39 -0.10 0.00 -1.27 0.00 0.00 60.65 58.91 2yz0 h LYS 102 Cb 0.11 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.98 2yz0 h LYS 102 CO -0.00 1.00 -0.22 -0.22 -2.27 0.00 0.00 179.45 177.75 2yz0 h LYS 103 N 0.23 0.69 -0.21 1.90 3.64 -1.46 -1.53 116.57 119.82 2yz0 h LYS 103 Ca -0.00 -0.33 -0.01 0.00 -1.27 0.00 0.00 60.65 59.04 2yz0 h LYS 103 Cb 1.01 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.81 2yz0 h LYS 103 CO 0.09 0.94 0.10 0.82 -2.27 0.00 0.00 179.45 179.12 2yz0 h ILE 104 N 0.44 1.14 -0.67 2.00 2.04 -1.15 -2.25 117.51 119.06 2yz0 h ILE 104 Ca 0.06 -0.42 -0.03 0.00 1.00 0.00 0.00 64.86 65.47 2yz0 h ILE 104 Cb 0.77 1.03 -0.03 0.00 -0.74 0.00 0.00 36.82 37.85 2yz0 h ILE 104 CO 0.06 0.14 0.29 -0.74 0.00 0.00 0.00 178.15 177.90 2yz0 h HIS 105 N 0.21 0.99 -0.90 1.37 2.76 -1.32 0.10 115.15 118.36 2yz0 h HIS 105 Ca 0.07 -0.06 0.06 0.00 -2.20 0.00 0.00 60.37 58.24 2yz0 h HIS 105 Cb 0.13 -0.30 -0.06 0.00 1.55 0.00 0.00 27.41 28.73 2yz0 h HIS 105 CO -0.02 0.76 0.57 -0.91 -1.30 0.00 0.00 177.93 177.03 2yz0 h ASN 106 N 0.94 0.90 1.28 3.26 2.35 -1.10 0.36 115.58 123.57 2yz0 h ASN 106 Ca 0.23 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.99 2yz0 h ASN 106 Cb 0.17 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 38.36 2yz0 h ASN 106 CO -0.02 0.58 -0.28 0.00 -1.65 0.00 0.00 177.43 176.06 2yz0 h THR 107 N 1.04 0.00 -0.93 2.81 1.03 -1.07 -3.32 112.91 112.46 2yz0 h THR 107 Ca 0.39 -0.56 -0.50 0.00 -0.01 0.00 0.00 66.41 65.73 2yz0 h THR 107 Cb 0.15 1.38 -0.42 0.00 -1.07 0.00 0.00 68.15 68.20 2yz0 h THR 107 CO -0.17 0.00 -0.87 -1.20 -0.01 0.00 0.00 175.52 173.27 2yz0 n SER 108 N -2.31 4.10 -4.45 0.00 7.64 0.32 -4.97 113.62 113.94 2yz0 n SER 108 Ca 0.04 -3.40 -0.44 0.00 1.01 0.00 0.00 58.87 56.08 2yz0 n SER 108 Cb 0.45 -0.41 -0.01 0.00 -1.01 0.00 0.00 64.21 63.23 2yz0 n SER 108 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 2yz0 s ARG 109 N -3.58 3.94 0.00 1.43 3.52 0.11 -3.66 118.95 120.72 2yz0 s ARG 109 Ca 0.45 -2.38 0.00 0.00 -0.13 0.00 0.00 55.73 53.67 2yz0 s ARG 109 Cb 0.40 -4.98 0.00 0.00 -1.56 0.00 0.00 34.95 28.81 2yz0 s ARG 109 CO -0.03 -1.73 0.00 0.41 -0.81 0.00 0.00 175.30 173.13 2yz0 n GLY 110 N 4.43 -0.07 0.00 8.12 0.00 -1.26 -4.99 105.19 111.42 2yz0 n GLY 110 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.34 2yz0 n GLY 110 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2yz0 n GLN 111 N 0.00 0.00 -3.72 1.61 1.13 -1.24 -4.93 117.38 110.23 2yz0 n GLN 111 Ca 0.00 0.00 -0.12 0.00 -1.94 0.00 0.00 57.00 54.94 2yz0 n GLN 111 Cb 0.00 0.00 -0.12 0.00 0.11 0.00 0.00 30.24 30.23 2yz0 n GLN 111 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 2yz0 s GLU 112 N 0.48 0.31 0.00 -1.09 2.02 -1.26 -5.01 118.70 114.15 2yz0 s GLU 112 Ca 0.00 0.63 0.00 0.00 0.02 0.00 0.00 54.97 55.62 2yz0 s GLU 112 Cb 0.00 -0.04 0.00 0.00 0.10 0.00 0.00 34.13 34.19 2yz0 s GLU 112 CO 0.00 -0.14 0.02 0.44 0.02 0.00 0.00 175.26 175.60 2yz0 n ILE 113 N 4.06 0.00 -0.09 -1.63 -5.35 -1.26 -4.57 119.36 110.52 2yz0 n ILE 113 Ca -0.23 -0.47 -0.11 0.00 -0.27 0.00 0.00 62.75 61.68 2yz0 n ILE 113 Cb 0.55 1.00 -0.04 0.00 -1.74 0.00 0.00 39.64 39.41 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 1.24 -0.08 7.28 1.08 -1.97 0.39 117.51 125.45 2yz0 h ILE 114 Ca 0.00 -0.83 -0.17 0.00 -0.39 0.00 0.00 64.86 63.47 2yz0 h ILE 114 Cb 0.00 1.25 -0.01 0.00 -3.07 0.00 0.00 36.82 35.00 2yz0 h ILE 114 CO 0.00 0.27 -0.69 0.15 -0.69 0.00 0.00 178.15 177.19 2yz0 h PHE 115 N 0.27 0.49 -0.11 1.37 3.57 -1.96 -2.30 116.94 118.27 2yz0 h PHE 115 Ca 0.08 -0.21 -0.03 0.00 3.53 0.00 0.00 57.97 61.34 2yz0 h PHE 115 Cb 0.36 -0.08 -0.00 0.00 2.79 0.00 0.00 35.95 39.02 2yz0 h PHE 115 CO 0.03 0.94 -0.04 0.93 -2.23 0.00 0.00 178.31 177.94 2yz0 h GLU 116 N 0.26 0.21 -0.78 1.11 4.39 -1.78 -0.42 114.58 117.57 2yz0 h GLU 116 Ca -0.02 -0.09 -0.05 0.00 0.34 0.00 0.00 59.36 59.54 2yz0 h GLU 116 Cb 1.25 -0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 29.86 2yz0 h GLU 116 CO 0.12 0.55 0.29 0.97 -1.16 0.00 0.00 179.01 179.78 2yz0 h ILE 117 N -0.13 1.26 -0.32 3.13 2.10 -0.96 0.12 117.51 122.71 2yz0 h ILE 117 Ca 0.02 -0.86 -0.08 0.00 1.08 0.00 0.00 64.86 65.02 2yz0 h ILE 117 Cb 0.48 0.35 -0.01 0.00 -1.09 0.00 0.00 36.82 36.55 2yz0 h ILE 117 CO 0.01 0.35 -0.13 0.71 -1.08 0.00 0.00 178.15 178.02 2yz0 h THR 118 N 1.15 1.29 -0.29 2.19 1.35 -1.39 -1.43 112.91 115.77 2yz0 h THR 118 Ca 0.26 -1.21 -0.08 0.00 -0.55 0.00 0.00 66.41 64.83 2yz0 h THR 118 Cb 0.25 1.39 -0.01 0.00 -1.73 0.00 0.00 68.15 68.06 2yz0 h THR 118 CO -0.02 0.39 -0.11 -1.28 -0.25 0.00 0.00 175.52 174.25 2yz0 h SER 119 N 0.43 0.61 -0.05 5.36 0.87 -0.90 -1.90 113.55 117.97 2yz0 h SER 119 Ca 0.08 -0.39 -0.00 0.00 -1.23 0.00 0.00 61.79 60.24 2yz0 h SER 119 Cb 0.64 -0.17 -0.00 0.00 -0.44 0.00 0.00 62.40 62.43 2yz0 h SER 119 CO 0.04 0.86 0.03 0.15 -0.53 0.00 0.00 176.83 177.39 2yz0 h PHE 120 N 0.35 0.07 -0.97 2.24 3.04 -0.75 0.15 116.94 121.06 2yz0 h PHE 120 Ca 0.07 0.00 0.01 0.00 3.98 0.00 0.00 57.97 62.03 2yz0 h PHE 120 Cb 0.62 -0.02 -0.05 0.00 2.56 0.00 0.00 35.95 39.06 2yz0 h PHE 120 CO 0.06 0.08 0.64 1.79 -2.02 0.00 0.00 178.31 178.86 2yz0 h THR 121 N 0.04 1.25 0.08 4.41 1.35 -1.26 0.11 112.91 118.88 2yz0 h THR 121 Ca 0.02 -0.46 -0.00 0.00 -0.55 0.00 0.00 66.41 65.42 2yz0 h THR 121 Cb 0.03 -0.18 0.00 0.00 -1.73 0.00 0.00 68.15 66.28 2yz0 h THR 121 CO -0.00 0.24 -0.04 -0.61 -0.25 0.00 0.00 175.52 174.86 2yz0 h GLN 122 N 1.32 -0.11 -0.42 4.72 -0.00 -1.06 0.47 115.11 120.03 2yz0 h GLN 122 Ca 0.36 0.01 0.02 0.00 -0.00 0.00 0.00 58.65 59.03 2yz0 h GLN 122 Cb -0.15 0.02 -0.03 0.00 0.00 0.00 0.00 27.48 27.33 2yz0 h GLN 122 CO -0.08 0.28 0.24 1.05 0.00 0.00 0.00 178.83 180.33 2yz0 h GLU 123 N -0.51 0.48 0.00 1.69 4.11 -0.54 -0.65 114.58 119.15 2yz0 h GLU 123 Ca -0.01 -0.03 -0.10 0.00 0.07 0.00 0.00 59.36 59.29 2yz0 h GLU 123 Cb 0.43 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 2yz0 h GLU 123 CO 0.02 0.31 -0.48 -0.22 0.07 0.00 0.00 179.01 178.72 2yz0 h LYS 124 N 0.49 0.00 0.01 1.06 1.63 -0.80 -2.91 116.57 116.04 2yz0 h LYS 124 Ca 0.17 0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 59.97 2yz0 h LYS 124 Cb 0.01 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.64 2yz0 h LYS 124 CO -0.08 0.48 -0.01 1.25 -3.45 0.00 0.00 179.45 177.64 2yz0 h LEU 125 N 0.00 -0.01 -1.07 5.20 5.85 0.65 -2.72 115.31 123.21 2yz0 h LEU 125 Ca -0.00 -0.39 -0.01 0.00 0.84 0.00 0.00 57.88 58.31 2yz0 h LEU 125 Cb 1.05 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 42.05 2yz0 h LEU 125 CO 0.06 0.38 0.43 -2.24 -0.34 0.00 0.00 178.44 176.73 2yz0 h ASP 126 N -0.41 0.96 0.13 1.25 3.04 -1.18 -1.60 116.42 118.61 2yz0 h ASP 126 Ca -0.00 -0.08 -0.02 0.00 -3.24 0.00 0.00 57.03 53.69 2yz0 h ASP 126 Cb 0.40 -0.24 -0.00 0.00 -1.04 0.00 0.00 39.33 38.44 2yz0 h ASP 126 CO 0.00 0.77 -0.10 1.05 -2.04 0.00 0.00 179.24 178.92 2yz0 h GLU 127 N 1.08 0.00 0.02 4.15 -0.00 -1.47 0.23 114.58 118.60 2yz0 h GLU 127 Ca 0.27 0.00 -0.08 0.00 -0.00 0.00 0.00 59.36 59.56 2yz0 h GLU 127 Cb 0.02 0.00 0.01 0.00 -0.00 0.00 0.00 28.75 28.78 2yz0 h GLU 127 CO -0.04 0.10 -0.32 0.74 -0.00 0.00 0.00 179.01 179.49 2yz0 h PHE 128 N 0.00 0.28 -0.29 2.06 -1.00 -0.98 -2.90 116.94 114.10 2yz0 h PHE 128 Ca -0.00 -0.17 -0.07 0.00 2.81 0.00 0.00 57.97 60.54 2yz0 h PHE 128 Cb 0.19 -0.03 -0.01 0.00 3.61 0.00 0.00 35.95 39.72 2yz0 h PHE 128 CO 0.00 1.02 -0.11 0.37 -1.61 0.00 0.00 178.31 177.98 2yz0 h GLN 129 N -0.53 0.59 0.00 1.51 -0.00 -1.14 -3.37 115.11 112.16 2yz0 h GLN 129 Ca -0.05 -0.24 0.00 0.00 -0.00 0.00 0.00 58.65 58.36 2yz0 h GLN 129 Cb 1.12 -0.02 0.00 0.00 0.00 0.00 0.00 27.48 28.58 2yz0 h GLN 129 CO 0.06 0.80 0.00 -1.71 0.00 0.00 0.00 178.83 177.99 2yz0 n ASN 130 N -4.45 0.00 0.00 -0.69 5.15 0.80 -4.85 115.26 111.21 2yz0 n ASN 130 Ca -0.03 0.25 0.00 0.00 -0.60 0.00 0.00 54.58 54.20 2yz0 n ASN 130 Cb 0.34 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.59 2yz0 n ASN 130 CO 0.00 0.00 0.00 0.52 1.40 0.00 0.00 177.26 179.18 2yz0 n VAL 131 N -0.29 0.00 -3.28 3.44 0.31 -1.10 -4.86 118.33 112.55 2yz0 n VAL 131 Ca 0.00 0.00 0.03 0.00 -0.01 0.00 0.00 64.34 64.36 2yz0 n VAL 131 Cb 0.00 0.00 -0.02 0.00 -0.91 0.00 0.00 33.84 32.91 2yz0 n VAL 131 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 2yz0 s VAL 132 N -1.09 -0.95 0.34 2.52 1.01 -1.26 -5.13 120.40 115.84 2yz0 s VAL 132 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 61.98 61.79 2yz0 s VAL 132 Cb 0.00 -1.00 -0.14 0.00 0.00 0.00 0.00 36.38 35.24 2yz0 s VAL 132 CO 0.00 0.00 0.09 -0.46 0.00 0.00 0.00 175.10 174.73 2yz0 n ASN 133 N 5.43 -2.45 0.00 3.32 6.94 -1.26 -2.01 115.26 125.22 2yz0 n ASN 133 Ca -0.04 0.72 0.00 0.00 -0.02 0.00 0.00 54.58 55.23 2yz0 n ASN 133 Cb 0.51 -0.77 0.00 0.00 -2.36 0.00 0.00 39.78 37.16 2yz0 n ASN 133 CO 0.00 0.00 0.00 0.41 -1.03 0.00 0.00 177.26 176.64 2yz0 n THR 134 N -0.85 0.00 -0.78 5.53 -1.04 -1.26 -4.93 114.28 110.95 2yz0 n THR 134 Ca 0.10 0.00 0.09 0.00 -2.04 0.00 0.00 64.05 62.20 2yz0 n THR 134 Cb 0.34 0.00 -0.05 0.00 -1.82 0.00 0.00 70.33 68.80 2yz0 n THR 134 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2yz0 n GLN 135 N 0.00 -1.83 -2.92 -2.82 1.13 -0.85 -4.82 117.38 105.26 2yz0 n GLN 135 Ca 0.00 1.49 -0.41 0.00 -1.94 0.00 0.00 57.00 56.14 2yz0 n GLN 135 Cb 0.00 -2.11 -0.04 0.00 0.11 0.00 0.00 30.24 28.20 2yz0 n GLN 135 CO 0.00 0.00 0.00 -1.12 -1.44 0.00 0.00 177.06 174.50 2yz0 s SER 136 N -5.65 6.97 0.23 1.08 0.01 -1.26 -4.95 113.70 110.12 2yz0 s SER 136 Ca 0.00 1.18 -0.07 0.00 1.31 0.00 0.00 55.95 58.37 2yz0 s SER 136 Cb 0.00 -2.45 0.37 0.00 0.21 0.00 0.00 66.02 64.15 2yz0 s SER 136 CO 0.00 -0.33 1.71 0.25 0.41 0.00 0.00 173.24 175.28 2yz0 h LEU 137 N 7.94 0.10 0.00 2.44 5.85 -2.00 -3.46 115.31 126.17 2yz0 h LEU 137 Ca -0.32 0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.51 2yz0 h LEU 137 Cb 1.15 0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.31 2yz0 h LEU 137 CO 0.81 0.04 0.00 -0.62 -0.34 0.00 0.00 178.44 178.33