#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 -0.50 0.00 3.17 0.15 -1.26 -5.16 113.70 110.09 2yz0 s SER 2 Ca 0.00 0.82 0.00 0.00 0.70 0.00 0.00 55.95 57.47 2yz0 s SER 2 Cb 0.00 1.17 0.00 0.00 -1.71 0.00 0.00 66.02 65.48 2yz0 s SER 2 CO 0.00 -0.13 0.00 0.18 1.20 0.00 0.00 173.24 174.49 2yz0 n LEU 3 N 3.57 0.00 -1.45 3.45 4.77 -1.26 -5.16 117.00 120.91 2yz0 n LEU 3 Ca -0.18 0.00 0.18 0.00 -0.03 0.00 0.00 56.01 55.98 2yz0 n LEU 3 Cb 0.57 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.59 2yz0 n LEU 3 CO 0.02 0.00 -0.53 -1.20 -1.33 0.00 0.00 177.39 174.36 2yz0 n SER 4 N 0.00 -8.32 -0.03 -1.43 7.64 -1.26 -4.93 113.62 105.29 2yz0 n SER 4 Ca 0.00 1.19 -0.05 0.00 1.01 0.00 0.00 58.87 61.02 2yz0 n SER 4 Cb 0.00 -4.81 -0.02 0.00 -1.01 0.00 0.00 64.21 58.38 2yz0 n SER 4 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 2yz0 n HIS 5 N -4.32 0.00 -2.71 1.43 8.25 -1.26 -4.88 115.22 111.74 2yz0 n HIS 5 Ca -0.06 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 56.98 2yz0 n HIS 5 Cb 0.68 -0.27 -0.03 0.00 1.12 0.00 0.00 29.99 31.49 2yz0 n HIS 5 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 2yz0 s LEU 6 N -7.40 4.01 0.22 2.41 0.20 -1.26 -4.66 118.68 112.20 2yz0 s LEU 6 Ca -0.16 -1.34 -0.23 0.00 0.69 0.00 0.00 54.13 53.10 2yz0 s LEU 6 Cb 0.02 -2.50 0.04 0.00 -0.43 0.00 0.00 46.19 43.33 2yz0 s LEU 6 CO 0.23 -1.44 0.80 0.28 -0.29 0.00 0.00 176.35 175.94 2yz0 s THR 7 N 4.35 0.00 0.61 3.68 -1.32 -1.26 -5.01 115.64 116.68 2yz0 s THR 7 Ca 0.36 -0.80 0.30 0.00 -1.21 0.00 0.00 61.69 60.34 2yz0 s THR 7 Cb -0.06 -1.92 0.36 0.00 -1.51 0.00 0.00 72.50 69.38 2yz0 s THR 7 CO -0.02 0.00 2.01 -0.07 -2.21 0.00 0.00 174.62 174.34 2yz0 h LEU 8 N 2.00 0.00 -1.83 9.08 3.38 -1.91 -0.21 115.31 125.81 2yz0 h LEU 8 Ca -0.22 0.00 0.16 0.00 0.09 0.00 0.00 57.88 57.92 2yz0 h LEU 8 Cb 1.25 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.96 2yz0 h LEU 8 CO 0.25 0.00 0.45 -0.78 0.09 0.00 0.00 178.44 178.45 2yz0 h ASP 9 N 0.00 0.15 -0.55 -0.43 3.58 -1.91 -0.14 116.42 117.11 2yz0 h ASP 9 Ca 0.11 0.01 -0.10 0.00 0.42 0.00 0.00 57.03 57.47 2yz0 h ASP 9 Cb 0.73 -0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.74 2yz0 h ASP 9 CO -0.00 0.08 -0.05 1.56 -2.88 0.00 0.00 179.24 177.94 2yz0 h GLN 10 N 0.16 1.01 -0.11 0.28 1.08 -1.29 -2.55 115.11 113.68 2yz0 h GLN 10 Ca 0.32 -0.35 0.03 0.00 -1.45 0.00 0.00 58.65 57.20 2yz0 h GLN 10 Cb 1.01 -0.08 -0.00 0.00 -0.05 0.00 0.00 27.48 28.36 2yz0 h GLN 10 CO -0.05 1.03 0.22 1.88 -0.95 0.00 0.00 178.83 180.96 2yz0 h TYR 11 N 0.89 0.00 -0.72 2.96 0.05 -1.16 -0.71 116.97 118.28 2yz0 h TYR 11 Ca 0.15 0.00 0.06 0.00 0.05 0.00 0.00 58.73 58.99 2yz0 h TYR 11 Cb 0.61 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 38.31 2yz0 h TYR 11 CO 0.04 0.00 0.48 -0.92 -1.05 0.00 0.00 178.16 176.71 2yz0 h TYR 12 N 0.00 0.77 -0.81 4.88 3.20 -1.45 -1.44 116.97 122.13 2yz0 h TYR 12 Ca 0.05 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.93 2yz0 h TYR 12 Cb 0.50 -0.26 -0.04 0.00 1.54 0.00 0.00 36.73 38.47 2yz0 h TYR 12 CO 0.00 0.41 0.44 1.05 -1.64 0.00 0.00 178.16 178.42 2yz0 h GLU 13 N 0.77 1.13 -0.27 1.82 4.11 -1.29 0.21 114.58 121.04 2yz0 h GLU 13 Ca 0.31 -0.13 -0.08 0.00 0.07 0.00 0.00 59.36 59.53 2yz0 h GLU 13 Cb 0.24 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 2yz0 h GLU 13 CO -0.10 0.83 -0.13 0.82 0.07 0.00 0.00 179.01 180.50 2yz0 h ILE 14 N 1.12 1.30 -0.18 -1.06 5.03 -1.42 -1.11 117.51 121.18 2yz0 h ILE 14 Ca 0.28 -1.21 -0.03 0.00 -0.12 0.00 0.00 64.86 63.79 2yz0 h ILE 14 Cb 0.04 1.50 -0.01 0.00 -3.03 0.00 0.00 36.82 35.32 2yz0 h ILE 14 CO -0.04 0.38 0.01 1.56 -0.68 0.00 0.00 178.15 179.37 2yz0 h GLN 15 N 0.31 0.31 -0.86 2.37 4.20 -1.12 -2.84 115.11 117.48 2yz0 h GLN 15 Ca 0.06 -0.09 -0.01 0.00 0.06 0.00 0.00 58.65 58.66 2yz0 h GLN 15 Cb 0.64 -0.03 -0.04 0.00 0.30 0.00 0.00 27.48 28.35 2yz0 h GLN 15 CO 0.04 0.51 0.48 0.00 -0.67 0.00 0.00 178.83 179.19 2yz0 h ASN 17 N 1.19 0.40 -0.56 0.00 -1.24 -1.10 -1.41 115.58 112.87 2yz0 h ASN 17 Ca 0.30 -0.00 -0.09 0.00 0.71 0.00 0.00 56.30 57.22 2yz0 h ASN 17 Cb 0.01 -0.09 -0.02 0.00 0.73 0.00 0.00 38.32 38.95 2yz0 h ASN 17 CO -0.05 0.27 0.01 -0.33 -1.29 0.00 0.00 177.43 176.04 2yz0 h GLU 18 N 0.46 1.00 0.15 6.67 5.08 -1.14 0.26 114.58 127.07 2yz0 h GLU 18 Ca 0.21 -0.30 -0.01 0.00 -1.00 0.00 0.00 59.36 58.26 2yz0 h GLU 18 Cb 0.24 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.39 2yz0 h GLU 18 CO -0.05 0.98 -0.07 -0.07 -1.00 0.00 0.00 179.01 178.79 2yz0 h LEU 19 N 0.92 -0.18 -0.64 1.33 4.07 -1.16 0.12 115.31 119.78 2yz0 h LEU 19 Ca 0.17 -0.12 -0.13 0.00 0.08 0.00 0.00 57.88 57.88 2yz0 h LEU 19 Cb 0.52 0.05 -0.01 0.00 1.08 0.00 0.00 40.66 42.29 2yz0 h LEU 19 CO 0.03 0.02 -0.32 1.05 -1.08 0.00 0.00 178.44 178.13 2yz0 h GLU 20 N -0.37 0.71 0.04 1.13 4.11 -1.43 0.18 114.58 118.95 2yz0 h GLU 20 Ca -0.02 -0.33 -0.00 0.00 0.07 0.00 0.00 59.36 59.08 2yz0 h GLU 20 Cb 0.29 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.53 2yz0 h GLU 20 CO 0.03 0.94 -0.02 0.00 0.07 0.00 0.00 179.01 180.03 2yz0 h ALA 21 N 1.04 -0.06 -0.14 1.06 0.00 -0.40 -2.76 119.26 118.01 2yz0 h ALA 21 Ca 0.07 -0.11 -0.16 0.00 0.00 0.00 0.00 54.91 54.70 2yz0 h ALA 21 Cb 0.84 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 2yz0 h ALA 21 CO 0.07 -0.42 -0.60 0.82 0.00 0.00 0.00 179.25 179.12 2yz0 h ILE 22 N -0.27 1.34 -0.92 0.00 5.03 -0.75 -3.11 117.51 118.84 2yz0 h ILE 22 Ca -0.01 -1.90 0.13 0.00 -0.12 0.00 0.00 64.86 62.96 2yz0 h ILE 22 Cb 0.24 1.89 -0.07 0.00 -3.03 0.00 0.00 36.82 35.85 2yz0 h ILE 22 CO 0.01 0.58 0.59 0.03 -0.68 0.00 0.00 178.15 178.68 2yz0 h ARG 23 N 0.34 0.76 -0.09 2.37 3.08 -0.59 0.15 114.38 120.40 2yz0 h ARG 23 Ca -0.00 -0.05 -0.06 0.00 0.07 0.00 0.00 59.98 59.94 2yz0 h ARG 23 Cb 1.14 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 31.01 2yz0 h ARG 23 CO 0.11 0.51 -0.22 1.03 -1.07 0.00 0.00 179.97 180.32 2yz0 h SER 24 N 0.79 0.15 0.12 7.04 0.87 -1.42 0.44 113.55 121.54 2yz0 h SER 24 Ca 0.46 -0.04 -0.16 0.00 -1.23 0.00 0.00 61.79 60.82 2yz0 h SER 24 Cb 0.63 -0.04 0.02 0.00 -0.44 0.00 0.00 62.40 62.57 2yz0 h SER 24 CO -0.22 0.38 -0.71 0.40 -0.53 0.00 0.00 176.83 176.15 2yz0 h ILE 25 N 0.15 1.53 -1.02 2.23 2.04 -0.90 -3.35 117.51 118.19 2yz0 h ILE 25 Ca 0.03 -2.50 -0.64 0.00 1.00 0.00 0.00 64.86 62.75 2yz0 h ILE 25 Cb 0.48 3.21 -0.34 0.00 -0.74 0.00 0.00 36.82 39.42 2yz0 h ILE 25 CO 0.03 0.70 0.22 -1.22 0.00 0.00 0.00 178.15 177.88 2yz0 n TYR 26 N -4.20 3.06 -0.34 1.37 4.01 0.18 -4.81 117.16 116.42 2yz0 n TYR 26 Ca -0.14 -2.70 0.01 0.00 -0.16 0.00 0.00 57.90 54.91 2yz0 n TYR 26 Cb 0.77 -0.98 0.06 0.00 -0.31 0.00 0.00 39.34 38.88 2yz0 n TYR 26 CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 2yz0 n MET 27 N -0.80 -0.17 0.00 -0.72 2.81 0.15 0.16 117.12 118.56 2yz0 n MET 27 Ca 0.54 1.40 -0.13 0.00 -1.81 0.00 0.00 57.70 57.70 2yz0 n MET 27 Cb 0.73 -2.08 -0.14 0.00 -0.71 0.00 0.00 33.22 31.03 2yz0 n MET 27 CO 0.00 0.00 0.00 -0.44 1.51 0.00 0.00 175.97 177.04 2yz0 h ASP 28 N 0.00 0.15 -0.15 7.83 3.32 -1.87 -3.32 116.42 122.38 2yz0 h ASP 28 Ca 0.35 -0.31 -0.02 0.00 0.02 0.00 0.00 57.03 57.07 2yz0 h ASP 28 Cb 0.57 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 40.06 2yz0 h ASP 28 CO -0.91 1.27 0.02 0.47 -1.72 0.00 0.00 179.24 178.38 2yz0 n ASP 29 N -3.22 2.26 -4.43 6.45 9.92 0.10 -4.80 116.55 122.83 2yz0 n ASP 29 Ca -0.19 -2.24 -0.34 0.00 -0.53 0.00 0.00 54.79 51.49 2yz0 n ASP 29 Cb 1.04 -0.55 -0.13 0.00 -0.64 0.00 0.00 41.12 40.84 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 -1.29 2.95 -0.10 1.24 2.19 0.42 -2.75 117.98 120.64 2yz0 s PHE 30 Ca 0.12 -0.49 0.01 0.00 0.33 0.00 0.00 56.93 56.91 2yz0 s PHE 30 Cb 0.10 -1.94 -0.02 0.00 -1.31 0.00 0.00 43.02 39.85 2yz0 s PHE 30 CO 0.03 -0.16 -0.14 0.99 1.83 0.00 0.00 175.22 177.78 2yz0 s THR 31 N 0.50 3.04 -0.27 0.12 2.01 -0.60 -4.99 115.64 115.45 2yz0 s THR 31 Ca -0.05 -0.69 -0.13 0.00 0.31 0.00 0.00 61.69 61.13 2yz0 s THR 31 Cb -0.15 -2.24 -0.04 0.00 0.01 0.00 0.00 72.50 70.08 2yz0 s THR 31 CO 0.03 0.55 0.27 -0.62 -0.69 0.00 0.00 174.62 174.16 2yz0 s ASP 32 N -0.07 6.13 0.00 3.53 -1.08 -1.26 -2.86 116.67 121.06 2yz0 s ASP 32 Ca -0.02 0.13 0.00 0.00 -0.52 0.00 0.00 52.55 52.14 2yz0 s ASP 32 Cb -0.14 -2.16 0.00 0.00 -1.46 0.00 0.00 42.92 39.16 2yz0 s ASP 32 CO 0.04 -0.10 0.50 0.00 0.52 0.00 0.00 175.17 176.13 2yz0 n LEU 33 N 5.10 0.99 0.00 -1.34 -0.00 -1.26 -4.98 117.00 115.51 2yz0 n LEU 33 Ca -0.12 -0.99 0.00 0.00 -0.00 0.00 0.00 56.01 54.90 2yz0 n LEU 33 Cb 0.51 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.93 2yz0 n LEU 33 CO 0.35 0.25 0.00 0.41 -0.00 0.00 0.00 177.39 178.40 2yz0 n THR 34 N -0.03 0.00 0.39 1.47 -1.04 -1.25 -4.79 114.28 109.02 2yz0 n THR 34 Ca 0.00 0.00 0.03 0.00 -2.04 0.00 0.00 64.05 62.04 2yz0 n THR 34 Cb 0.04 0.00 0.15 0.00 -1.82 0.00 0.00 70.33 68.70 2yz0 n THR 34 CO 0.00 0.00 0.00 2.29 -0.64 0.00 0.00 175.07 176.72 2yz0 n LYS 35 N -1.01 2.36 0.00 -2.82 2.85 -1.26 -4.61 118.16 113.68 2yz0 n LYS 35 Ca 0.00 -1.15 0.00 0.00 -1.05 0.00 0.00 58.31 56.11 2yz0 n LYS 35 Cb 0.00 -1.72 0.00 0.00 -0.65 0.00 0.00 35.03 32.66 2yz0 n LYS 35 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 2yz0 n ARG 36 N 0.24 0.00 -1.68 -1.58 5.12 -1.26 -4.19 116.66 113.31 2yz0 n ARG 36 Ca 0.10 0.00 -0.35 0.00 -1.93 0.00 0.00 57.85 55.67 2yz0 n ARG 36 Cb 0.56 -0.22 -0.03 0.00 -1.16 0.00 0.00 32.46 31.61 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 0.00 3.83 -3.29 5.56 4.76 -1.26 -4.66 118.16 123.10 2yz0 n LYS 37 Ca 0.00 -2.81 -0.24 0.00 -2.87 0.00 0.00 58.31 52.39 2yz0 n LYS 37 Cb 0.00 -2.54 -0.08 0.00 -1.84 0.00 0.00 35.03 30.57 2yz0 n LYS 37 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 2yz0 n SER 38 N 2.04 -0.78 -4.55 4.39 3.41 -1.26 -5.08 113.62 111.79 2yz0 n SER 38 Ca 0.62 -2.47 -0.36 0.00 -0.26 0.00 0.00 58.87 56.40 2yz0 n SER 38 Cb 0.35 -0.28 -0.03 0.00 -0.26 0.00 0.00 64.21 63.98 2yz0 n SER 38 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2yz0 s SER 39 N -0.01 4.71 0.00 4.04 0.01 -1.26 -3.87 113.70 117.31 2yz0 s SER 39 Ca 0.33 0.73 0.00 0.00 1.31 0.00 0.00 55.95 58.32 2yz0 s SER 39 Cb 0.05 -2.51 0.00 0.00 0.21 0.00 0.00 66.02 63.77 2yz0 s SER 39 CO -0.18 -2.76 0.00 1.87 0.41 0.00 0.00 173.24 172.59 2yz0 n TRP 40 N 14.94 -0.75 -3.91 2.43 -0.00 -1.26 -5.15 117.44 123.73 2yz0 n TRP 40 Ca 0.32 0.00 -0.10 0.00 -0.00 0.00 0.00 57.50 57.72 2yz0 n TRP 40 Cb 0.53 0.15 -0.10 0.00 -0.00 0.00 0.00 31.31 31.90 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 -1.72 0.12 -0.57 5.87 2.15 -1.25 -5.09 116.67 116.18 2yz0 s ASP 41 Ca 0.00 -0.39 0.06 0.00 0.43 0.00 0.00 52.55 52.65 2yz0 s ASP 41 Cb 0.00 0.20 0.29 0.00 -0.30 0.00 0.00 42.92 43.12 2yz0 s ASP 41 CO 0.00 -0.43 0.80 0.29 -0.17 0.00 0.00 175.17 175.67 2yz0 n LYS 42 N 1.15 2.51 -2.78 4.34 5.02 -1.26 -4.88 118.16 122.26 2yz0 n LYS 42 Ca -0.21 -4.50 -0.07 0.00 -2.02 0.00 0.00 58.31 51.51 2yz0 n LYS 42 Cb 0.57 -2.10 0.02 0.00 -0.02 0.00 0.00 35.03 33.50 2yz0 n LYS 42 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 2yz0 n GLN 43 N 0.42 0.65 -0.83 1.97 6.02 -1.26 -5.16 117.38 119.19 2yz0 n GLN 43 Ca 0.29 -1.94 -0.24 0.00 -0.01 0.00 0.00 57.00 55.10 2yz0 n GLN 43 Cb 0.44 -1.47 0.20 0.00 1.02 0.00 0.00 30.24 30.43 2yz0 n GLN 43 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 2yz0 n PRO 44 N 2.29 -2.74 -0.41 -1.09 -0.04 -1.26 -5.03 135.00 126.73 2yz0 n PRO 44 Ca 0.14 -1.40 0.00 0.00 -0.04 0.00 0.00 63.50 62.20 2yz0 n PRO 44 Cb 0.59 -1.31 0.00 0.00 -0.04 0.00 0.00 33.50 32.74 2yz0 n PRO 44 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2yz0 n GLN 45 N -4.18 0.00 -2.23 0.54 10.64 -1.26 -5.06 117.38 115.83 2yz0 n GLN 45 Ca 0.12 -0.13 -0.02 0.00 -1.83 0.00 0.00 57.00 55.14 2yz0 n GLN 45 Cb 0.47 -0.07 0.00 0.00 -0.86 0.00 0.00 30.24 29.78 2yz0 n GLN 45 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.06 174.34 2yz0 n ILE 46 N 0.00 -6.17 -3.91 -0.39 2.08 -1.26 -4.55 119.36 105.15 2yz0 n ILE 46 Ca 0.00 0.19 -0.10 0.00 0.56 0.00 0.00 62.75 63.40 2yz0 n ILE 46 Cb 0.52 -5.48 -0.11 0.00 -0.75 0.00 0.00 39.64 33.83 2yz0 n ILE 46 CO 0.00 0.00 0.00 0.27 0.56 0.00 0.00 176.55 177.38 2yz0 s ILE 47 N -2.35 0.08 0.02 1.39 -0.00 -1.26 -3.02 121.20 116.07 2yz0 s ILE 47 Ca 0.07 -0.66 -0.28 0.00 -0.00 0.00 0.00 60.65 59.78 2yz0 s ILE 47 Cb -0.02 -0.32 0.08 0.00 -0.00 0.00 0.00 42.46 42.21 2yz0 s ILE 47 CO 0.38 -0.36 0.72 0.72 -0.00 0.00 0.00 174.94 176.40 2yz0 s PHE 48 N -1.18 -0.53 0.12 1.37 -0.71 -1.20 -3.88 117.98 111.98 2yz0 s PHE 48 Ca -0.13 0.62 0.05 0.00 -1.04 0.00 0.00 56.93 56.44 2yz0 s PHE 48 Cb -0.07 0.49 -0.04 0.00 -1.21 0.00 0.00 43.02 42.19 2yz0 s PHE 48 CO 0.00 -0.66 0.03 -1.21 -1.34 0.00 0.00 175.22 172.04 2yz0 s GLU 49 N -2.46 2.60 -0.03 1.99 2.02 -1.13 -3.02 118.70 118.66 2yz0 s GLU 49 Ca -0.03 -0.89 0.03 0.00 0.02 0.00 0.00 54.97 54.10 2yz0 s GLU 49 Cb -0.01 -2.53 0.00 0.00 0.10 0.00 0.00 34.13 31.69 2yz0 s GLU 49 CO -0.03 0.51 -0.11 0.42 0.02 0.00 0.00 175.26 176.07 2yz0 s ILE 50 N -1.49 0.97 -0.31 -1.63 -1.09 -0.72 -1.56 121.20 115.38 2yz0 s ILE 50 Ca 0.27 -0.47 -0.23 0.00 -2.23 0.00 0.00 60.65 58.00 2yz0 s ILE 50 Cb -0.11 -0.85 -0.00 0.00 -1.58 0.00 0.00 42.46 39.92 2yz0 s ILE 50 CO 0.20 0.29 0.77 -0.89 -1.23 0.00 0.00 174.94 174.08 2yz0 s THR 51 N 0.14 4.81 0.34 2.92 2.01 -1.11 -0.96 115.64 123.80 2yz0 s THR 51 Ca -0.03 1.11 0.09 0.00 0.31 0.00 0.00 61.69 63.17 2yz0 s THR 51 Cb -0.09 -4.13 -0.06 0.00 0.01 0.00 0.00 72.50 68.23 2yz0 s THR 51 CO 0.01 -0.25 -0.01 -0.76 -0.69 0.00 0.00 174.62 172.92 2yz0 s LEU 52 N 2.92 2.92 -0.00 4.42 1.43 0.75 -4.91 118.68 126.21 2yz0 s LEU 52 Ca 0.31 -1.04 -0.29 0.00 -1.03 0.00 0.00 54.13 52.08 2yz0 s LEU 52 Cb -0.14 -1.27 0.10 0.00 0.03 0.00 0.00 46.19 44.92 2yz0 s LEU 52 CO 0.13 -0.23 1.27 0.00 0.23 0.00 0.00 176.35 177.75 2yz0 s ARG 53 N -3.69 0.44 0.00 1.70 3.03 -1.26 0.20 118.95 119.37 2yz0 s ARG 53 Ca 0.34 -0.27 0.00 0.00 2.03 0.00 0.00 55.73 57.83 2yz0 s ARG 53 Cb 0.01 0.13 0.00 0.00 -1.03 0.00 0.00 34.95 34.06 2yz0 s ARG 53 CO 0.19 -0.21 0.00 -1.13 -1.13 0.00 0.00 175.30 173.02 2yz0 n SER 54 N -0.86 0.00 -0.00 -2.89 3.41 0.20 -4.84 113.62 108.65 2yz0 n SER 54 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.60 2yz0 n SER 54 Cb 0.60 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.55 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 -0.29 0.00 -4.27 -3.33 0.24 -1.26 -4.97 118.33 104.45 2yz0 n VAL 55 Ca 0.00 -0.04 -0.29 0.00 -2.04 0.00 0.00 64.34 61.97 2yz0 n VAL 55 Cb 0.00 0.50 -0.04 0.00 -1.47 0.00 0.00 33.84 32.83 2yz0 n VAL 55 CO 0.00 0.00 0.00 1.51 -2.14 0.00 0.00 176.83 176.20 2yz0 s ASP 56 N -2.06 4.42 0.00 -1.34 1.47 -1.26 -5.06 116.67 112.84 2yz0 s ASP 56 Ca -0.00 -1.43 0.02 0.00 1.18 0.00 0.00 52.55 52.32 2yz0 s ASP 56 Cb 0.01 0.48 -0.00 0.00 -0.34 0.00 0.00 42.92 43.06 2yz0 s ASP 56 CO 0.04 -1.00 0.29 0.29 0.68 0.00 0.00 175.17 175.46 2yz0 n LYS 57 N -1.55 3.28 -4.12 2.11 4.01 -1.17 -4.30 118.16 116.42 2yz0 n LYS 57 Ca -0.09 -0.27 -0.15 0.00 -0.51 0.00 0.00 58.31 57.29 2yz0 n LYS 57 Cb 0.65 -0.79 -0.13 0.00 -0.51 0.00 0.00 35.03 34.26 2yz0 n LYS 57 CO 0.00 0.00 0.00 -1.83 -1.11 0.00 0.00 177.40 174.46 2yz0 s GLU 58 N -0.74 0.51 0.00 1.97 -1.05 -1.26 -3.10 118.70 115.04 2yz0 s GLU 58 Ca 0.01 -0.53 0.15 0.00 -0.15 0.00 0.00 54.97 54.45 2yz0 s GLU 58 Cb 0.02 -0.39 0.71 0.00 -0.44 0.00 0.00 34.13 34.03 2yz0 s GLU 58 CO 0.05 0.09 1.42 -0.35 0.95 0.00 0.00 175.26 177.42 2yz0 n PRO 59 N 2.10 0.15 -2.94 -4.83 -0.04 -1.26 -4.94 135.00 123.23 2yz0 n PRO 59 Ca -0.18 0.18 -0.08 0.00 -0.04 0.00 0.00 63.50 63.37 2yz0 n PRO 59 Cb 0.56 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.49 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 -1.35 0.00 0.03 0.52 0.24 -1.18 -5.07 118.33 111.53 2yz0 n VAL 60 Ca 0.06 -1.03 0.00 0.00 -2.04 0.00 0.00 64.34 61.33 2yz0 n VAL 60 Cb 0.13 0.53 -0.00 0.00 -1.47 0.00 0.00 33.84 33.02 2yz0 n VAL 60 CO 0.00 0.00 0.00 1.21 -2.14 0.00 0.00 176.83 175.90 2yz0 n GLU 61 N -0.27 5.27 -2.39 7.34 2.13 -1.25 -3.06 120.64 128.41 2yz0 n GLU 61 Ca 0.03 -0.00 -0.02 0.00 0.66 0.00 0.00 57.16 57.83 2yz0 n GLU 61 Cb 0.26 -0.64 0.00 0.00 0.27 0.00 0.00 31.44 31.33 2yz0 n GLU 61 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 2yz0 n SER 62 N -1.13 -4.47 -4.18 4.31 2.88 -1.26 -2.65 113.62 107.12 2yz0 n SER 62 Ca 0.00 0.25 -0.33 0.00 -1.33 0.00 0.00 58.87 57.46 2yz0 n SER 62 Cb 0.01 -1.08 -0.16 0.00 -0.75 0.00 0.00 64.21 62.23 2yz0 n SER 62 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2yz0 s SER 63 N -0.71 3.26 -0.02 -3.46 1.04 -1.26 0.61 113.70 113.15 2yz0 s SER 63 Ca 0.02 -0.58 0.01 0.00 0.48 0.00 0.00 55.95 55.88 2yz0 s SER 63 Cb -0.00 -1.49 0.01 0.00 0.10 0.00 0.00 66.02 64.64 2yz0 s SER 63 CO 0.05 0.06 -0.04 -0.63 0.98 0.00 0.00 173.24 173.65 2yz0 s ILE 64 N 0.96 0.42 -0.36 -1.02 1.01 0.13 -3.05 121.20 119.29 2yz0 s ILE 64 Ca -0.03 -0.14 -0.14 0.00 0.00 0.00 0.00 60.65 60.33 2yz0 s ILE 64 Cb -0.15 -0.41 -0.01 0.00 0.01 0.00 0.00 42.46 41.91 2yz0 s ILE 64 CO -0.04 0.16 0.31 -0.89 0.00 0.00 0.00 174.94 174.47 2yz0 s THR 65 N 0.40 5.23 -0.41 2.92 2.01 -1.15 -0.17 115.64 124.46 2yz0 s THR 65 Ca -0.05 -0.22 -0.18 0.00 0.31 0.00 0.00 61.69 61.55 2yz0 s THR 65 Cb -0.08 -3.81 0.01 0.00 0.01 0.00 0.00 72.50 68.63 2yz0 s THR 65 CO -0.00 -0.12 0.51 -0.76 -0.69 0.00 0.00 174.62 173.55 2yz0 s LEU 66 N 1.85 4.63 -0.36 4.42 1.02 -0.13 -2.10 118.68 128.00 2yz0 s LEU 66 Ca 0.08 -0.42 -0.11 0.00 0.02 0.00 0.00 54.13 53.70 2yz0 s LEU 66 Cb -0.17 -2.52 0.01 0.00 0.02 0.00 0.00 46.19 43.53 2yz0 s LEU 66 CO 0.11 -0.60 0.21 -2.28 0.02 0.00 0.00 176.35 173.81 2yz0 s HIS 67 N 2.38 3.22 -0.10 0.29 5.65 -0.95 -1.75 115.29 124.03 2yz0 s HIS 67 Ca 0.16 -0.74 -0.04 0.00 0.25 0.00 0.00 55.06 54.69 2yz0 s HIS 67 Cb -0.16 -2.44 -0.04 0.00 -1.18 0.00 0.00 32.58 28.76 2yz0 s HIS 67 CO 0.15 -0.56 0.06 -0.06 -0.65 0.00 0.00 174.74 173.68 2yz0 s PHE 68 N 1.60 3.36 -0.19 3.88 0.40 -1.17 -2.63 117.98 123.24 2yz0 s PHE 68 Ca 0.03 0.35 0.01 0.00 -0.60 0.00 0.00 56.93 56.72 2yz0 s PHE 68 Cb -0.18 -1.86 0.04 0.00 0.51 0.00 0.00 43.02 41.52 2yz0 s PHE 68 CO 0.07 0.59 -0.12 0.00 0.70 0.00 0.00 175.22 176.46 2yz0 s ALA 69 N -0.94 2.03 0.64 5.36 0.00 -0.40 -3.23 121.76 125.23 2yz0 s ALA 69 Ca 0.14 -1.17 -0.11 0.00 0.00 0.00 0.00 51.96 50.82 2yz0 s ALA 69 Cb -0.12 -1.23 -0.03 0.00 0.00 0.00 0.00 23.12 21.74 2yz0 s ALA 69 CO 0.03 -0.68 1.04 -1.64 0.00 0.00 0.00 175.76 174.51 2yz0 s MET 70 N 1.39 3.42 0.29 0.00 -1.94 -1.17 -2.58 119.30 118.72 2yz0 s MET 70 Ca 0.00 0.74 0.10 0.00 -1.71 0.00 0.00 55.69 54.83 2yz0 s MET 70 Cb -0.15 -2.06 -0.05 0.00 2.01 0.00 0.00 34.83 34.58 2yz0 s MET 70 CO -0.09 -0.69 -0.09 0.95 -0.01 0.00 0.00 175.02 175.09 2yz0 s THR 71 N -3.19 2.82 -2.00 2.05 -4.23 -1.26 -4.82 115.64 105.02 2yz0 s THR 71 Ca 0.56 -2.15 0.11 0.00 -1.18 0.00 0.00 61.69 59.02 2yz0 s THR 71 Cb -0.11 -2.59 0.31 0.00 1.34 0.00 0.00 72.50 71.44 2yz0 s THR 71 CO 0.54 -0.35 1.08 -0.81 -0.54 0.00 0.00 174.62 174.55 2yz0 n PRO 72 N -0.78 0.49 0.00 3.99 -0.04 -1.26 -2.42 135.00 134.97 2yz0 n PRO 72 Ca -0.05 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.41 2yz0 n PRO 72 Cb 0.60 -1.35 0.00 0.00 -0.04 0.00 0.00 33.50 32.72 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 -0.85 2.10 -1.41 0.54 2.81 -1.26 -4.81 117.12 114.24 2yz0 n MET 73 Ca 0.08 0.00 -0.38 0.00 -1.81 0.00 0.00 57.70 55.59 2yz0 n MET 73 Cb 0.04 -0.95 0.03 0.00 -0.71 0.00 0.00 33.22 31.63 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 -1.59 -1.24 0.48 2.03 4.19 -1.02 -0.82 117.16 119.21 2yz0 n TYR 74 Ca 0.00 0.45 0.07 0.00 3.31 0.00 0.00 57.90 61.73 2yz0 n TYR 74 Cb 0.22 -1.89 0.32 0.00 0.49 0.00 0.00 39.34 38.48 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 0.35 0.01 -0.24 2.98 -0.04 -1.26 -4.81 135.00 131.99 2yz0 n PRO 75 Ca 0.11 0.27 0.12 0.00 -0.04 0.00 0.00 63.50 63.95 2yz0 n PRO 75 Cb 0.47 -1.52 0.23 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 -1.55 0.49 -3.76 0.54 9.36 -0.00 -4.39 117.16 117.86 2yz0 n TYR 76 Ca 0.03 0.85 -0.24 0.00 3.32 0.00 0.00 57.90 61.86 2yz0 n TYR 76 Cb 0.17 -1.05 -0.01 0.00 -0.63 0.00 0.00 39.34 37.81 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 -5.55 2.03 -0.22 2.97 -4.23 -1.25 -5.10 115.64 104.30 2yz0 s THR 77 Ca -0.09 -1.43 -0.10 0.00 -1.18 0.00 0.00 61.69 58.89 2yz0 s THR 77 Cb 0.21 -2.46 -0.05 0.00 1.34 0.00 0.00 72.50 71.54 2yz0 s THR 77 CO 0.55 0.00 0.13 0.00 -0.54 0.00 0.00 174.62 174.76 2yz0 s ALA 78 N -2.67 3.61 1.00 3.99 0.00 -1.26 -4.49 121.76 121.94 2yz0 s ALA 78 Ca 0.41 -0.79 0.00 0.00 0.00 0.00 0.00 51.96 51.58 2yz0 s ALA 78 Cb -0.02 -2.20 0.00 0.00 0.00 0.00 0.00 23.12 20.89 2yz0 s ALA 78 CO 0.24 0.00 0.00 -0.35 0.00 0.00 0.00 175.76 175.65 2yz0 n PRO 79 N 3.87 -0.78 -4.60 0.00 -0.04 -1.26 -4.95 135.00 127.24 2yz0 n PRO 79 Ca -0.16 0.00 -0.22 0.00 -0.04 0.00 0.00 63.50 63.08 2yz0 n PRO 79 Cb 0.52 0.00 -0.15 0.00 -0.04 0.00 0.00 33.50 33.83 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 -2.65 1.11 0.07 0.54 2.12 -1.07 -4.96 118.70 113.86 2yz0 s GLU 80 Ca 0.00 -0.55 0.06 0.00 0.36 0.00 0.00 54.97 54.84 2yz0 s GLU 80 Cb 0.00 -1.09 -0.03 0.00 0.26 0.00 0.00 34.13 33.28 2yz0 s GLU 80 CO 0.00 0.29 -0.16 0.42 -0.54 0.00 0.00 175.26 175.28 2yz0 s ILE 81 N -0.41 1.26 -0.08 -3.70 -1.09 -1.26 -1.27 121.20 114.65 2yz0 s ILE 81 Ca 0.05 -1.25 -0.10 0.00 -2.23 0.00 0.00 60.65 57.12 2yz0 s ILE 81 Cb -0.06 -1.17 0.02 0.00 -1.58 0.00 0.00 42.46 39.68 2yz0 s ILE 81 CO -0.00 -0.09 0.27 -1.83 -1.23 0.00 0.00 174.94 172.06 2yz0 s GLU 82 N -1.55 0.41 -0.12 2.79 -1.05 -1.08 -4.98 118.70 113.12 2yz0 s GLU 82 Ca 0.01 0.20 -0.08 0.00 -0.15 0.00 0.00 54.97 54.95 2yz0 s GLU 82 Cb -0.09 0.19 -0.04 0.00 -0.44 0.00 0.00 34.13 33.74 2yz0 s GLU 82 CO 0.02 -0.07 0.16 -0.06 0.95 0.00 0.00 175.26 176.26 2yz0 s PHE 83 N -0.28 3.59 0.35 4.83 0.08 -1.26 -2.23 117.98 123.06 2yz0 s PHE 83 Ca -0.04 0.55 0.05 0.00 0.12 0.00 0.00 56.93 57.60 2yz0 s PHE 83 Cb -0.03 -2.00 -0.07 0.00 -0.57 0.00 0.00 43.02 40.35 2yz0 s PHE 83 CO 0.01 0.67 0.05 0.15 -0.10 0.00 0.00 175.22 176.00 2yz0 s LYS 84 N -0.84 1.75 0.00 0.44 -0.14 -0.89 -4.90 119.74 115.16 2yz0 s LYS 84 Ca 0.15 -1.99 0.00 0.00 -1.36 0.00 0.00 55.97 52.77 2yz0 s LYS 84 Cb -0.12 -1.07 0.00 0.00 -1.68 0.00 0.00 37.83 34.96 2yz0 s LYS 84 CO 0.04 -0.17 0.00 0.09 -0.76 0.00 0.00 175.35 174.55 2yz0 n ASN 85 N -0.79 0.00 -2.60 2.83 5.03 -1.26 -2.95 115.26 115.52 2yz0 n ASN 85 Ca -0.03 0.00 -0.00 0.00 0.87 0.00 0.00 54.58 55.41 2yz0 n ASN 85 Cb 0.67 0.00 0.00 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 -1.57 -0.01 2.41 0.24 -1.17 -4.95 118.33 113.27 2yz0 n VAL 86 Ca 0.00 0.39 -0.01 0.00 -2.04 0.00 0.00 64.34 62.68 2yz0 n VAL 86 Cb 0.00 -2.34 -0.00 0.00 -1.47 0.00 0.00 33.84 30.02 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 1.11 0.09 -0.64 7.34 10.64 -1.25 -4.49 117.38 130.19 2yz0 n GLN 87 Ca -0.00 0.17 -0.05 0.00 -1.83 0.00 0.00 57.00 55.29 2yz0 n GLN 87 Cb 0.39 -0.80 -0.01 0.00 -0.86 0.00 0.00 30.24 28.97 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 -2.78 5.59 -4.12 2.61 2.85 -1.26 -4.56 115.26 113.60 2yz0 n ASN 88 Ca -0.02 -2.56 -0.16 0.00 -0.11 0.00 0.00 54.58 51.72 2yz0 n ASN 88 Cb 0.07 -1.14 -0.12 0.00 1.24 0.00 0.00 39.78 39.84 2yz0 n ASN 88 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 2yz0 s VAL 89 N -0.44 0.86 -0.01 3.44 1.01 -1.26 -4.93 120.40 119.07 2yz0 s VAL 89 Ca 0.12 -1.14 -0.01 0.00 0.00 0.00 0.00 61.98 60.95 2yz0 s VAL 89 Cb 0.08 -0.85 -0.00 0.00 0.00 0.00 0.00 36.38 35.61 2yz0 s VAL 89 CO -0.01 -0.25 -0.02 0.23 0.00 0.00 0.00 175.10 175.06 2yz0 n MET 90 N 1.48 0.02 0.00 2.72 2.81 -1.26 -4.98 117.12 117.91 2yz0 n MET 90 Ca -0.21 0.01 0.00 0.00 -1.81 0.00 0.00 57.70 55.69 2yz0 n MET 90 Cb 0.55 -0.50 0.00 0.00 -0.71 0.00 0.00 33.22 32.56 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 -2.59 0.00 -0.33 7.83 5.68 -1.26 -4.97 116.55 120.92 2yz0 n ASP 91 Ca -0.01 0.00 0.09 0.00 -0.50 0.00 0.00 54.79 54.38 2yz0 n ASP 91 Cb 0.02 0.02 0.30 0.00 -1.14 0.00 0.00 41.12 40.32 2yz0 n ASP 91 CO 0.00 0.00 0.00 -1.28 -1.33 0.00 0.00 177.20 174.59 2yz0 h SER 92 N 0.00 0.82 -0.30 -1.12 0.87 -1.99 -0.66 113.55 111.17 2yz0 h SER 92 Ca 0.00 0.05 -0.05 0.00 -1.23 0.00 0.00 61.79 60.56 2yz0 h SER 92 Cb 0.00 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 61.83 2yz0 h SER 92 CO 0.00 0.42 0.01 -0.61 -0.53 0.00 0.00 176.83 176.12 2yz0 h GLN 93 N 0.87 0.53 -0.14 2.24 4.15 -1.99 -0.88 115.11 119.90 2yz0 h GLN 93 Ca 0.48 -0.16 0.00 0.00 0.77 0.00 0.00 58.65 59.74 2yz0 h GLN 93 Cb 0.60 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 28.23 2yz0 h GLN 93 CO -0.25 0.66 0.09 -0.07 -1.93 0.00 0.00 178.83 177.33 2yz0 h LEU 94 N 0.33 0.16 -1.31 -2.39 3.38 -1.65 -2.43 115.31 111.41 2yz0 h LEU 94 Ca 0.09 -0.03 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 2yz0 h LEU 94 Cb 0.41 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 2yz0 h LEU 94 CO 0.01 0.14 -0.01 1.56 0.09 0.00 0.00 178.44 180.24 2yz0 h GLN 95 N 0.17 0.45 -0.96 1.13 1.08 -1.13 -2.50 115.11 113.35 2yz0 h GLN 95 Ca 0.05 -0.09 0.02 0.00 -1.45 0.00 0.00 58.65 57.17 2yz0 h GLN 95 Cb 0.01 -0.07 -0.05 0.00 -0.05 0.00 0.00 27.48 27.32 2yz0 h GLN 95 CO -0.01 0.49 0.64 1.98 -0.95 0.00 0.00 178.83 180.98 2yz0 h MET 96 N 0.44 1.24 -0.55 1.46 1.85 -0.68 -2.16 114.93 116.53 2yz0 h MET 96 Ca 0.10 -0.07 -0.10 0.00 -0.61 0.00 0.00 59.70 59.01 2yz0 h MET 96 Cb 0.30 -0.28 -0.02 0.00 0.43 0.00 0.00 31.60 32.03 2yz0 h MET 96 CO 0.01 0.82 -0.04 -0.07 -0.40 0.00 0.00 176.91 177.23 2yz0 h LEU 97 N 1.28 0.97 -1.43 3.39 3.38 -1.09 -2.53 115.31 119.29 2yz0 h LEU 97 Ca 0.36 -0.29 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 2yz0 h LEU 97 Cb -0.12 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.35 2yz0 h LEU 97 CO -0.09 1.05 0.17 0.11 0.09 0.00 0.00 178.44 179.78 2yz0 h LYS 98 N 0.90 0.56 -0.15 1.13 1.79 -1.26 0.21 116.57 119.75 2yz0 h LYS 98 Ca 0.15 -0.07 -0.07 0.00 -2.18 0.00 0.00 60.65 58.49 2yz0 h LYS 98 Cb 0.58 -0.11 -0.00 0.00 -1.58 0.00 0.00 32.23 31.12 2yz0 h LYS 98 CO 0.03 0.45 -0.18 0.77 -1.08 0.00 0.00 179.45 179.44 2yz0 h SER 99 N 0.56 0.41 1.02 0.86 0.02 -1.14 -3.10 113.55 112.18 2yz0 h SER 99 Ca 0.14 -0.51 -0.05 0.00 -0.84 0.00 0.00 61.79 60.53 2yz0 h SER 99 Cb 0.09 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.51 2yz0 h SER 99 CO -0.02 0.84 -0.24 1.05 -1.14 0.00 0.00 176.83 177.32 2yz0 h GLU 100 N 0.00 0.00 -0.81 3.45 4.11 -1.15 -3.08 114.58 117.10 2yz0 h GLU 100 Ca 0.02 0.00 0.01 0.00 0.07 0.00 0.00 59.36 59.46 2yz0 h GLU 100 Cb 0.74 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.95 2yz0 h GLU 100 CO 0.04 0.24 0.54 0.74 0.07 0.00 0.00 179.01 180.64 2yz0 h PHE 101 N 0.00 1.02 -0.85 2.06 -1.00 -0.51 -1.83 116.94 115.82 2yz0 h PHE 101 Ca -0.00 0.02 -0.03 0.00 2.81 0.00 0.00 57.97 60.77 2yz0 h PHE 101 Cb 0.81 -0.34 -0.04 0.00 3.61 0.00 0.00 35.95 39.99 2yz0 h PHE 101 CO 0.00 0.63 0.41 -0.22 -1.61 0.00 0.00 178.31 177.53 2yz0 h LYS 102 N 1.09 1.23 -0.52 1.51 1.63 -1.55 -1.59 116.57 118.36 2yz0 h LYS 102 Ca 0.30 -0.18 -0.12 0.00 -0.85 0.00 0.00 60.65 59.80 2yz0 h LYS 102 Cb -0.11 -0.22 -0.02 0.00 -0.60 0.00 0.00 32.23 31.28 2yz0 h LYS 102 CO -0.07 0.94 -0.15 -0.22 -3.45 0.00 0.00 179.45 176.50 2yz0 h LYS 103 N 1.21 1.02 -0.24 1.90 3.11 -1.51 -1.79 116.57 120.28 2yz0 h LYS 103 Ca 0.29 -0.40 -0.01 0.00 -2.81 0.00 0.00 60.65 57.72 2yz0 h LYS 103 Cb 0.11 -0.05 -0.01 0.00 -1.00 0.00 0.00 32.23 31.28 2yz0 h LYS 103 CO -0.04 1.08 0.10 0.82 -2.81 0.00 0.00 179.45 178.61 2yz0 h ILE 104 N 0.89 1.16 -0.57 2.00 2.04 -1.01 -2.11 117.51 119.90 2yz0 h ILE 104 Ca 0.13 -0.47 -0.03 0.00 1.00 0.00 0.00 64.86 65.49 2yz0 h ILE 104 Cb 0.72 1.03 -0.03 0.00 -0.74 0.00 0.00 36.82 37.81 2yz0 h ILE 104 CO 0.06 0.16 0.25 -0.74 0.00 0.00 0.00 178.15 177.88 2yz0 h HIS 105 N 0.24 0.85 -0.11 1.37 2.76 -1.26 0.56 115.15 119.57 2yz0 h HIS 105 Ca 0.08 -0.05 0.00 0.00 -2.20 0.00 0.00 60.37 58.20 2yz0 h HIS 105 Cb 0.15 -0.26 -0.01 0.00 1.55 0.00 0.00 27.41 28.85 2yz0 h HIS 105 CO -0.01 0.67 0.07 -0.91 -1.30 0.00 0.00 177.93 176.45 2yz0 h ASN 106 N 0.79 0.12 0.11 3.26 2.35 -1.17 0.11 115.58 121.14 2yz0 h ASN 106 Ca 0.19 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.94 2yz0 h ASN 106 Cb 0.16 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.50 2yz0 h ASN 106 CO -0.02 0.09 -0.86 1.07 -1.65 0.00 0.00 177.43 176.06 2yz0 n THR 107 N -4.52 0.00 -2.09 2.81 5.66 -0.81 -4.27 114.28 111.06 2yz0 n THR 107 Ca -0.01 -0.02 -0.11 0.00 -3.05 0.00 0.00 64.05 60.86 2yz0 n THR 107 Cb 0.08 0.85 0.07 0.00 -1.55 0.00 0.00 70.33 69.78 2yz0 n THR 107 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 2yz0 n SER 108 N -1.41 3.36 -4.36 1.09 7.64 0.19 -4.98 113.62 115.16 2yz0 n SER 108 Ca 0.05 -3.39 -0.46 0.00 1.01 0.00 0.00 58.87 56.08 2yz0 n SER 108 Cb 0.34 -0.40 -0.03 0.00 -1.01 0.00 0.00 64.21 63.10 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 -3.30 3.38 0.00 1.43 3.52 0.25 -4.09 118.95 120.14 2yz0 s ARG 109 Ca 0.43 -1.98 0.00 0.00 -0.13 0.00 0.00 55.73 54.05 2yz0 s ARG 109 Cb 0.38 -4.45 0.00 0.00 -1.56 0.00 0.00 34.95 29.32 2yz0 s ARG 109 CO -0.01 -1.43 0.00 0.41 -0.81 0.00 0.00 175.30 173.46 2yz0 n GLY 110 N 4.72 0.29 0.00 8.12 0.00 -1.26 -5.04 105.19 112.02 2yz0 n GLY 110 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 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 -4.05 1.61 10.64 -1.26 -4.99 117.38 119.33 2yz0 n GLN 111 Ca 0.00 0.00 -0.14 0.00 -1.83 0.00 0.00 57.00 55.03 2yz0 n GLN 111 Cb 0.00 0.00 -0.14 0.00 -0.86 0.00 0.00 30.24 29.24 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 0.55 0.30 0.00 2.61 2.02 -1.26 -4.91 118.70 118.01 2yz0 s GLU 112 Ca 0.00 -0.21 0.00 0.00 0.02 0.00 0.00 54.97 54.78 2yz0 s GLU 112 Cb 0.00 -0.24 0.00 0.00 0.10 0.00 0.00 34.13 33.99 2yz0 s GLU 112 CO 0.00 0.06 0.09 0.44 0.02 0.00 0.00 175.26 175.87 2yz0 n ILE 113 N 2.76 0.00 -0.15 -1.63 -5.35 -1.26 -4.63 119.36 109.10 2yz0 n ILE 113 Ca -0.14 -0.40 -0.11 0.00 -0.27 0.00 0.00 62.75 61.84 2yz0 n ILE 113 Cb 0.58 1.05 -0.01 0.00 -1.74 0.00 0.00 39.64 39.52 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 0.05 1.27 -0.19 7.28 1.08 -1.96 -0.71 117.51 124.33 2yz0 h ILE 114 Ca 0.00 -1.17 -0.19 0.00 -0.39 0.00 0.00 64.86 63.11 2yz0 h ILE 114 Cb 0.02 1.13 0.01 0.00 -3.07 0.00 0.00 36.82 34.91 2yz0 h ILE 114 CO 0.00 0.40 -0.62 0.15 -0.69 0.00 0.00 178.15 177.39 2yz0 h PHE 115 N 0.66 0.99 -0.57 1.37 3.57 -1.96 -2.05 116.94 118.96 2yz0 h PHE 115 Ca 0.12 -0.40 -0.04 0.00 3.53 0.00 0.00 57.97 61.17 2yz0 h PHE 115 Cb 0.60 -0.17 -0.02 0.00 2.79 0.00 0.00 35.95 39.15 2yz0 h PHE 115 CO 0.05 1.22 0.18 0.93 -2.23 0.00 0.00 178.31 178.46 2yz0 h GLU 116 N 0.49 0.87 -0.44 1.11 4.39 -1.81 0.14 114.58 119.33 2yz0 h GLU 116 Ca -0.02 -0.18 -0.09 0.00 0.34 0.00 0.00 59.36 59.40 2yz0 h GLU 116 Cb 1.24 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 29.75 2yz0 h GLU 116 CO 0.13 0.79 -0.09 0.97 -1.16 0.00 0.00 179.01 179.65 2yz0 h ILE 117 N 0.79 1.27 -0.33 3.13 2.10 -1.15 -0.93 117.51 122.40 2yz0 h ILE 117 Ca 0.18 -1.19 -0.09 0.00 1.08 0.00 0.00 64.86 64.84 2yz0 h ILE 117 Cb 0.27 1.13 -0.01 0.00 -1.09 0.00 0.00 36.82 37.13 2yz0 h ILE 117 CO -0.01 0.41 -0.16 0.71 -1.08 0.00 0.00 178.15 178.02 2yz0 h THR 118 N 0.67 1.29 -0.44 2.19 1.35 -1.21 -1.65 112.91 115.11 2yz0 h THR 118 Ca 0.11 -1.27 -0.04 0.00 -0.55 0.00 0.00 66.41 64.67 2yz0 h THR 118 Cb 0.62 1.40 -0.02 0.00 -1.73 0.00 0.00 68.15 68.43 2yz0 h THR 118 CO 0.04 0.41 0.11 0.28 -0.25 0.00 0.00 175.52 176.11 2yz0 h SER 119 N 0.46 0.66 -0.37 5.36 0.02 -0.68 0.24 113.55 119.24 2yz0 h SER 119 Ca 0.07 -0.23 -0.02 0.00 -0.84 0.00 0.00 61.79 60.78 2yz0 h SER 119 Cb 0.69 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 63.04 2yz0 h SER 119 CO 0.05 0.72 0.15 -0.26 -1.14 0.00 0.00 176.83 176.35 2yz0 h PHE 120 N 0.57 0.56 -0.38 3.45 -1.00 -1.15 -0.78 116.94 118.22 2yz0 h PHE 120 Ca 0.14 -0.04 -0.14 0.00 2.81 0.00 0.00 57.97 60.73 2yz0 h PHE 120 Cb 0.31 -0.17 -0.01 0.00 3.61 0.00 0.00 35.95 39.69 2yz0 h PHE 120 CO 0.02 0.50 -0.34 1.79 -1.61 0.00 0.00 178.31 178.68 2yz0 h THR 121 N 0.45 1.28 -0.65 -1.55 1.35 -1.19 0.41 112.91 113.00 2yz0 h THR 121 Ca 0.12 -1.50 -0.06 0.00 -0.55 0.00 0.00 66.41 64.42 2yz0 h THR 121 Cb 0.18 1.34 -0.03 0.00 -1.73 0.00 0.00 68.15 67.91 2yz0 h THR 121 CO -0.01 0.50 0.16 -0.61 -0.25 0.00 0.00 175.52 175.31 2yz0 h GLN 122 N 0.72 1.03 0.10 4.72 -0.00 -0.36 0.38 115.11 121.69 2yz0 h GLN 122 Ca 0.07 -0.23 -0.29 0.00 -0.00 0.00 0.00 58.65 58.20 2yz0 h GLN 122 Cb 0.90 -0.14 0.02 0.00 0.00 0.00 0.00 27.48 28.26 2yz0 h GLN 122 CO 0.08 0.91 -1.20 1.05 0.00 0.00 0.00 178.83 179.67 2yz0 h GLU 123 N 0.98 0.58 -0.34 1.69 4.11 -1.05 -2.93 114.58 117.61 2yz0 h GLU 123 Ca 0.21 -0.76 -0.17 0.00 0.07 0.00 0.00 59.36 58.72 2yz0 h GLU 123 Cb 0.34 0.25 -0.00 0.00 0.50 0.00 0.00 28.75 29.83 2yz0 h GLU 123 CO -0.00 1.33 -0.45 -0.22 0.07 0.00 0.00 179.01 179.74 2yz0 h LYS 124 N 0.26 0.89 0.04 1.06 1.63 -0.77 -2.63 116.57 117.06 2yz0 h LYS 124 Ca -0.17 -0.51 -0.00 0.00 -0.85 0.00 0.00 60.65 59.12 2yz0 h LYS 124 Cb 1.87 0.03 0.00 0.00 -0.60 0.00 0.00 32.23 33.54 2yz0 h LYS 124 CO 0.23 1.15 -0.02 1.25 -3.45 0.00 0.00 179.45 178.61 2yz0 h LEU 125 N 0.71 -0.05 -1.09 5.20 5.85 -0.31 -2.27 115.31 123.35 2yz0 h LEU 125 Ca 0.04 -0.08 0.05 0.00 0.84 0.00 0.00 57.88 58.74 2yz0 h LEU 125 Cb 1.04 0.01 -0.06 0.00 0.37 0.00 0.00 40.66 42.03 2yz0 h LEU 125 CO 0.10 0.05 0.62 -0.78 -0.34 0.00 0.00 178.44 178.09 2yz0 h ASP 126 N -0.14 0.98 0.22 1.25 3.58 -1.54 -0.59 116.42 120.18 2yz0 h ASP 126 Ca -0.01 0.00 -0.04 0.00 0.42 0.00 0.00 57.03 57.41 2yz0 h ASP 126 Cb 0.12 -0.21 -0.01 0.00 1.72 0.00 0.00 39.33 40.96 2yz0 h ASP 126 CO 0.01 0.65 -0.17 1.05 -2.88 0.00 0.00 179.24 177.89 2yz0 h GLU 127 N 1.12 0.00 0.05 0.28 -0.00 -1.18 -3.07 114.58 111.78 2yz0 h GLU 127 Ca 0.40 0.00 -0.00 0.00 -0.00 0.00 0.00 59.36 59.75 2yz0 h GLU 127 Cb 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 28.88 2yz0 h GLU 127 CO -0.14 0.17 -0.02 0.74 -0.00 0.00 0.00 179.01 179.76 2yz0 h PHE 128 N 0.00 -0.06 -0.88 2.06 -1.00 -0.53 -3.01 116.94 113.52 2yz0 h PHE 128 Ca -0.00 -0.00 0.34 0.00 2.81 0.00 0.00 57.97 61.12 2yz0 h PHE 128 Cb 0.33 0.02 -0.13 0.00 3.61 0.00 0.00 35.95 39.78 2yz0 h PHE 128 CO 0.00 -0.04 0.51 0.94 -1.61 0.00 0.00 178.31 178.12 2yz0 n GLN 129 N -2.33 -0.04 -0.11 1.51 0.00 -1.01 0.24 117.38 115.64 2yz0 n GLN 129 Ca -0.01 1.05 -0.10 0.00 -0.00 0.00 0.00 57.00 57.94 2yz0 n GLN 129 Cb 0.02 -1.94 -0.02 0.00 0.00 0.00 0.00 30.24 28.30 2yz0 n GLN 129 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.06 176.15 2yz0 h ASN 130 N 0.00 0.47 -0.47 1.69 4.21 -1.59 -3.09 115.58 116.81 2yz0 h ASN 130 Ca 0.67 -0.22 -0.22 0.00 1.21 0.00 0.00 56.30 57.74 2yz0 h ASN 130 Cb 1.91 -0.12 -0.13 0.00 -1.12 0.00 0.00 38.32 38.86 2yz0 h ASN 130 CO -0.52 0.57 0.07 1.33 -1.29 0.00 0.00 177.43 177.58 2yz0 n VAL 131 N -4.66 2.65 -2.42 2.81 0.24 0.65 -5.01 118.33 112.59 2yz0 n VAL 131 Ca -0.02 -2.47 -0.42 0.00 -2.04 0.00 0.00 64.34 59.39 2yz0 n VAL 131 Cb 0.18 -0.34 -0.03 0.00 -1.47 0.00 0.00 33.84 32.18 2yz0 n VAL 131 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2yz0 s VAL 132 N -3.20 3.85 -0.32 3.34 0.11 0.40 -4.95 120.40 119.62 2yz0 s VAL 132 Ca 0.47 1.43 0.11 0.00 -2.93 0.00 0.00 61.98 61.06 2yz0 s VAL 132 Cb 0.41 -3.92 0.46 0.00 -1.53 0.00 0.00 36.38 31.81 2yz0 s VAL 132 CO 0.03 0.17 1.13 -0.46 -3.33 0.00 0.00 175.10 172.65 2yz0 n ASN 133 N 3.21 3.91 -3.89 3.54 0.23 -1.26 -5.00 115.26 116.00 2yz0 n ASN 133 Ca 0.06 -3.31 -0.09 0.00 -0.53 0.00 0.00 54.58 50.71 2yz0 n ASN 133 Cb 0.46 -0.41 -0.08 0.00 -2.08 0.00 0.00 39.78 37.66 2yz0 n ASN 133 CO 0.00 0.00 0.00 0.42 -0.93 0.00 0.00 177.26 176.75 2yz0 s THR 134 N -4.53 0.14 -0.06 5.53 -4.23 -1.26 -5.17 115.64 106.07 2yz0 s THR 134 Ca 0.43 -1.19 -0.04 0.00 -1.18 0.00 0.00 61.69 59.72 2yz0 s THR 134 Cb 0.39 -1.23 0.03 0.00 1.34 0.00 0.00 72.50 73.04 2yz0 s THR 134 CO -0.03 -0.66 0.14 -1.58 -0.54 0.00 0.00 174.62 171.96 2yz0 s GLN 135 N -3.48 0.12 0.00 3.99 0.74 -1.26 -5.04 119.66 114.73 2yz0 s GLN 135 Ca 0.02 0.30 0.00 0.00 0.05 0.00 0.00 55.36 55.73 2yz0 s GLN 135 Cb 0.03 -0.08 0.00 0.00 1.10 0.00 0.00 33.01 34.06 2yz0 s GLN 135 CO -0.09 -0.11 0.00 0.43 -0.55 0.00 0.00 175.29 174.97 2yz0 n SER 136 N 3.75 0.02 -4.49 6.67 7.64 -1.26 -5.04 113.62 120.91 2yz0 n SER 136 Ca -0.21 0.00 -0.51 0.00 1.01 0.00 0.00 58.87 59.16 2yz0 n SER 136 Cb 0.55 0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.68 2yz0 n SER 136 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 2yz0 n LEU 137 N -2.67 2.30 0.00 -3.43 0.00 -1.26 -5.15 117.00 106.79 2yz0 n LEU 137 Ca 0.00 0.49 0.07 0.00 0.00 0.00 0.00 56.01 56.57 2yz0 n LEU 137 Cb 0.18 -1.28 0.41 0.00 0.00 0.00 0.00 43.42 42.74 2yz0 n LEU 137 CO 0.00 -0.65 0.62 1.21 0.00 0.00 0.00 177.39 178.57