#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 6.23 0.31 7.83 0.15 -1.26 -5.03 113.70 121.93 2yz0 s SER 2 Ca 0.00 -3.07 0.00 0.00 0.70 0.00 0.00 55.95 53.58 2yz0 s SER 2 Cb 0.00 -2.05 -0.00 0.00 -1.71 0.00 0.00 66.02 62.26 2yz0 s SER 2 CO 0.00 -0.40 0.00 0.18 1.20 0.00 0.00 173.24 174.23 2yz0 n LEU 3 N 3.33 0.00 -4.33 3.45 4.32 -1.26 -5.13 117.00 117.38 2yz0 n LEU 3 Ca 0.15 -1.97 -0.35 0.00 -0.02 0.00 0.00 56.01 53.81 2yz0 n LEU 3 Cb 0.41 0.23 -0.14 0.00 -1.62 0.00 0.00 43.42 42.30 2yz0 n LEU 3 CO 0.36 -0.28 -0.38 -0.44 -1.22 0.00 0.00 177.39 175.43 2yz0 s SER 4 N -2.73 4.37 -0.50 -1.43 0.01 -1.26 -5.07 113.70 107.09 2yz0 s SER 4 Ca 0.00 -0.36 -0.29 0.00 1.31 0.00 0.00 55.95 56.61 2yz0 s SER 4 Cb 0.00 -1.75 0.03 0.00 0.21 0.00 0.00 66.02 64.51 2yz0 s SER 4 CO 0.00 -0.00 1.14 -2.28 0.41 0.00 0.00 173.24 172.51 2yz0 s HIS 5 N 1.39 2.77 0.00 2.43 2.46 -1.26 -4.56 115.29 118.52 2yz0 s HIS 5 Ca 0.05 0.62 0.00 0.00 0.47 0.00 0.00 55.06 56.20 2yz0 s HIS 5 Cb -0.14 -4.44 0.00 0.00 -0.13 0.00 0.00 32.58 27.87 2yz0 s HIS 5 CO -0.02 -1.34 0.00 1.28 -2.47 0.00 0.00 174.74 172.19 2yz0 n LEU 6 N 7.96 0.00 -4.91 8.88 4.77 -1.26 -5.14 117.00 127.30 2yz0 n LEU 6 Ca 0.11 0.00 -0.27 0.00 -0.03 0.00 0.00 56.01 55.82 2yz0 n LEU 6 Cb 0.49 0.35 0.02 0.00 -2.33 0.00 0.00 43.42 41.95 2yz0 n LEU 6 CO 0.71 -0.45 0.50 0.28 -1.33 0.00 0.00 177.39 177.11 2yz0 s THR 7 N -1.90 4.21 0.28 -5.08 -1.32 -1.26 -4.98 115.64 105.60 2yz0 s THR 7 Ca 0.00 0.11 0.21 0.00 -1.21 0.00 0.00 61.69 60.80 2yz0 s THR 7 Cb 0.00 -3.64 0.19 0.00 -1.51 0.00 0.00 72.50 67.54 2yz0 s THR 7 CO 0.00 -0.65 1.87 -0.07 -2.21 0.00 0.00 174.62 173.57 2yz0 h LEU 8 N -0.01 0.00 -1.59 9.08 3.38 -2.00 -2.94 115.31 121.24 2yz0 h LEU 8 Ca -0.46 0.00 0.26 0.00 0.09 0.00 0.00 57.88 57.77 2yz0 h LEU 8 Cb 1.23 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.91 2yz0 h LEU 8 CO 0.61 0.27 0.68 -0.78 0.09 0.00 0.00 178.44 179.31 2yz0 h ASP 9 N 0.00 0.30 -0.43 -0.43 3.58 -1.93 0.25 116.42 117.76 2yz0 h ASP 9 Ca -0.00 0.05 -0.13 0.00 0.42 0.00 0.00 57.03 57.37 2yz0 h ASP 9 Cb 0.64 -0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.68 2yz0 h ASP 9 CO 0.04 0.08 -0.22 1.56 -2.88 0.00 0.00 179.24 177.81 2yz0 h GLN 10 N 0.28 0.94 -0.08 0.28 1.08 -1.89 -2.76 115.11 112.96 2yz0 h GLN 10 Ca 0.53 -0.40 0.02 0.00 -1.45 0.00 0.00 58.65 57.36 2yz0 h GLN 10 Cb 1.57 -0.03 -0.00 0.00 -0.05 0.00 0.00 27.48 28.96 2yz0 h GLN 10 CO -0.18 1.06 0.07 1.88 -0.95 0.00 0.00 178.83 180.71 2yz0 h TYR 11 N 0.81 0.00 -0.69 2.96 0.05 -0.65 -1.32 116.97 118.13 2yz0 h TYR 11 Ca 0.11 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.88 2yz0 h TYR 11 Cb 0.78 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 38.49 2yz0 h TYR 11 CO 0.05 0.00 0.41 1.88 -1.05 0.00 0.00 178.16 179.45 2yz0 h TYR 12 N 0.00 0.90 -0.69 4.88 0.05 -1.30 -2.28 116.97 118.51 2yz0 h TYR 12 Ca 0.04 0.00 0.03 0.00 0.05 0.00 0.00 58.73 58.85 2yz0 h TYR 12 Cb 0.18 -0.30 -0.04 0.00 1.01 0.00 0.00 36.73 37.58 2yz0 h TYR 12 CO 0.00 0.60 0.43 0.93 -1.05 0.00 0.00 178.16 179.07 2yz0 h GLU 13 N 0.94 0.82 -0.44 4.88 4.39 -1.35 -0.04 114.58 123.79 2yz0 h GLU 13 Ca 0.25 -0.05 -0.07 0.00 0.34 0.00 0.00 59.36 59.83 2yz0 h GLU 13 Cb -0.04 -0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 28.41 2yz0 h GLU 13 CO -0.05 0.54 0.01 0.82 -1.16 0.00 0.00 179.01 179.18 2yz0 h ILE 14 N 0.85 1.26 -0.66 3.13 5.03 -1.51 -2.39 117.51 123.21 2yz0 h ILE 14 Ca 0.28 -1.01 -0.03 0.00 -0.12 0.00 0.00 64.86 63.98 2yz0 h ILE 14 Cb 0.02 1.06 -0.03 0.00 -3.03 0.00 0.00 36.82 34.84 2yz0 h ILE 14 CO -0.11 0.35 0.30 1.56 -0.68 0.00 0.00 178.15 179.57 2yz0 h GLN 15 N 0.61 0.96 -0.75 2.37 4.20 -1.00 -2.72 115.11 118.77 2yz0 h GLN 15 Ca 0.12 -0.15 -0.01 0.00 0.06 0.00 0.00 58.65 58.68 2yz0 h GLN 15 Cb 0.47 -0.17 -0.04 0.00 0.30 0.00 0.00 27.48 28.05 2yz0 h GLN 15 CO 0.02 0.77 0.44 0.00 -0.67 0.00 0.00 178.83 179.39 2yz0 h ASN 17 N 1.03 0.42 -0.51 0.00 2.35 -1.13 -1.50 115.58 116.24 2yz0 h ASN 17 Ca 0.27 -0.01 -0.07 0.00 -0.55 0.00 0.00 56.30 55.94 2yz0 h ASN 17 Cb -0.01 -0.10 -0.02 0.00 0.05 0.00 0.00 38.32 38.23 2yz0 h ASN 17 CO -0.05 0.29 0.08 -0.33 -1.65 0.00 0.00 177.43 175.77 2yz0 h GLU 18 N 0.49 0.90 0.11 0.81 5.08 -1.14 0.35 114.58 121.19 2yz0 h GLU 18 Ca 0.17 -0.22 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 2yz0 h GLU 18 Cb 0.10 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.23 2yz0 h GLU 18 CO -0.04 0.85 -0.05 -0.07 -1.00 0.00 0.00 179.01 178.69 2yz0 h LEU 19 N 0.85 -0.13 -0.90 1.33 4.07 -1.16 -0.43 115.31 118.95 2yz0 h LEU 19 Ca 0.17 -0.25 -0.11 0.00 0.08 0.00 0.00 57.88 57.77 2yz0 h LEU 19 Cb 0.40 0.03 -0.01 0.00 1.08 0.00 0.00 40.66 42.16 2yz0 h LEU 19 CO 0.01 0.19 -0.38 1.05 -1.08 0.00 0.00 178.44 178.23 2yz0 h GLU 20 N -0.46 0.33 0.04 1.13 4.11 -1.39 0.21 114.58 118.55 2yz0 h GLU 20 Ca -0.02 -0.15 -0.00 0.00 0.07 0.00 0.00 59.36 59.26 2yz0 h GLU 20 Cb 0.37 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.62 2yz0 h GLU 20 CO 0.03 0.67 -0.02 0.00 0.07 0.00 0.00 179.01 179.76 2yz0 h ALA 21 N 1.32 -0.05 -0.12 1.06 0.00 -0.24 -2.93 119.26 118.31 2yz0 h ALA 21 Ca 0.03 -0.16 -0.20 0.00 0.00 0.00 0.00 54.91 54.58 2yz0 h ALA 21 Cb 0.80 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.62 2yz0 h ALA 21 CO 0.06 -0.37 -0.74 0.82 0.00 0.00 0.00 179.25 179.02 2yz0 h ILE 22 N -0.38 1.33 -0.85 0.00 5.03 -1.05 -3.15 117.51 118.45 2yz0 h ILE 22 Ca -0.01 -2.06 0.19 0.00 -0.12 0.00 0.00 64.86 62.87 2yz0 h ILE 22 Cb 0.34 2.04 -0.06 0.00 -3.03 0.00 0.00 36.82 36.12 2yz0 h ILE 22 CO 0.01 0.63 0.57 0.03 -0.68 0.00 0.00 178.15 178.71 2yz0 h ARG 23 N 0.40 0.38 -0.07 2.37 3.08 -0.59 0.34 114.38 120.29 2yz0 h ARG 23 Ca -0.04 -0.02 -0.08 0.00 0.07 0.00 0.00 59.98 59.91 2yz0 h ARG 23 Cb 1.34 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 31.29 2yz0 h ARG 23 CO 0.14 0.25 -0.30 0.77 -1.07 0.00 0.00 179.97 179.76 2yz0 h SER 24 N 0.39 0.13 0.11 7.04 0.02 -1.47 0.27 113.55 120.05 2yz0 h SER 24 Ca 0.43 -0.04 -0.25 0.00 -0.84 0.00 0.00 61.79 61.10 2yz0 h SER 24 Cb 1.08 -0.03 -0.00 0.00 0.14 0.00 0.00 62.40 63.58 2yz0 h SER 24 CO -0.15 0.43 -1.25 0.40 -1.14 0.00 0.00 176.83 175.12 2yz0 h ILE 25 N 0.11 1.13 -1.17 3.27 2.04 -0.59 -3.37 117.51 118.94 2yz0 h ILE 25 Ca 0.02 -2.40 -0.65 0.00 1.00 0.00 0.00 64.86 62.82 2yz0 h ILE 25 Cb 0.60 2.79 -0.33 0.00 -0.74 0.00 0.00 36.82 39.13 2yz0 h ILE 25 CO 0.04 0.68 0.32 -1.22 0.00 0.00 0.00 178.15 177.97 2yz0 n TYR 26 N -4.02 3.09 -0.33 1.37 4.01 0.54 -4.79 117.16 117.03 2yz0 n TYR 26 Ca -0.23 -2.71 0.15 0.00 -0.16 0.00 0.00 57.90 54.95 2yz0 n TYR 26 Cb 0.86 -0.99 0.31 0.00 -0.31 0.00 0.00 39.34 39.20 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 2.28 0.04 0.00 -0.72 2.86 -0.62 0.51 114.93 119.28 2yz0 h MET 27 Ca 0.51 -0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.15 2yz0 h MET 27 Cb 0.87 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.52 2yz0 h MET 27 CO 1.28 0.02 -1.34 -0.25 1.06 0.00 0.00 176.91 177.69 2yz0 n ASP 28 N -5.43 0.71 -1.78 1.22 9.92 -1.26 -4.24 116.55 115.68 2yz0 n ASP 28 Ca 0.24 -0.55 0.03 0.00 -0.53 0.00 0.00 54.79 53.98 2yz0 n ASP 28 Cb 0.78 1.39 0.34 0.00 -0.64 0.00 0.00 41.12 42.99 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 -1.77 5.07 -4.57 -2.24 9.92 0.92 -4.91 116.55 118.97 2yz0 n ASP 29 Ca 0.01 -2.89 -0.34 0.00 -0.53 0.00 0.00 54.79 51.04 2yz0 n ASP 29 Cb 0.40 -0.68 -0.11 0.00 -0.64 0.00 0.00 41.12 40.08 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 -2.61 2.98 -0.08 1.24 2.19 0.14 -2.74 117.98 119.10 2yz0 s PHE 30 Ca 0.49 -0.06 0.03 0.00 0.33 0.00 0.00 56.93 57.72 2yz0 s PHE 30 Cb 0.38 -1.78 -0.02 0.00 -1.31 0.00 0.00 43.02 40.29 2yz0 s PHE 30 CO 0.14 0.24 -0.18 0.99 1.83 0.00 0.00 175.22 178.23 2yz0 s THR 31 N -0.50 2.65 -0.31 0.12 2.01 0.23 -4.94 115.64 114.90 2yz0 s THR 31 Ca 0.08 -0.84 -0.13 0.00 0.31 0.00 0.00 61.69 61.11 2yz0 s THR 31 Cb -0.12 -2.04 -0.03 0.00 0.01 0.00 0.00 72.50 70.32 2yz0 s THR 31 CO 0.02 0.56 0.25 1.51 -0.69 0.00 0.00 174.62 176.27 2yz0 s ASP 32 N -0.15 6.08 0.00 3.53 -4.77 -1.26 -2.52 116.67 117.58 2yz0 s ASP 32 Ca -0.02 -0.19 0.00 0.00 -3.30 0.00 0.00 52.55 49.04 2yz0 s ASP 32 Cb -0.14 -2.15 0.00 0.00 -1.09 0.00 0.00 42.92 39.55 2yz0 s ASP 32 CO 0.04 -0.18 0.00 0.00 0.70 0.00 0.00 175.17 175.72 2yz0 n LEU 33 N 5.15 0.00 -4.33 2.11 -0.00 -1.26 -4.96 117.00 113.71 2yz0 n LEU 33 Ca -0.12 0.00 -0.37 0.00 -0.00 0.00 0.00 56.01 55.52 2yz0 n LEU 33 Cb 0.51 0.00 0.04 0.00 -0.00 0.00 0.00 43.42 43.97 2yz0 n LEU 33 CO 0.36 0.00 -0.36 0.41 -0.00 0.00 0.00 177.39 177.80 2yz0 n THR 34 N -1.48 1.00 -2.36 1.47 -1.04 -1.25 -4.83 114.28 105.79 2yz0 n THR 34 Ca 0.00 -0.46 -0.42 0.00 -2.04 0.00 0.00 64.05 61.13 2yz0 n THR 34 Cb 0.07 -0.39 0.00 0.00 -1.82 0.00 0.00 70.33 68.19 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 0.53 4.03 -4.33 -2.82 4.01 -1.26 -4.96 118.16 113.36 2yz0 n LYS 35 Ca 0.08 -3.70 -0.28 0.00 -0.51 0.00 0.00 58.31 53.90 2yz0 n LYS 35 Cb 0.50 -2.78 -0.11 0.00 -0.51 0.00 0.00 35.03 32.13 2yz0 n LYS 35 CO 0.00 0.00 0.00 -0.98 -1.11 0.00 0.00 177.40 175.31 2yz0 s ARG 36 N -0.59 1.79 1.87 1.97 1.04 -1.26 -3.62 118.95 120.14 2yz0 s ARG 36 Ca 0.42 -1.30 0.00 0.00 -1.04 0.00 0.00 55.73 53.80 2yz0 s ARG 36 Cb 0.11 -2.05 0.00 0.00 -2.04 0.00 0.00 34.95 30.97 2yz0 s ARG 36 CO -0.01 0.44 0.00 1.63 -0.04 0.00 0.00 175.30 177.33 2yz0 n LYS 37 N 0.42 0.00 -0.12 3.89 4.76 -1.26 -4.64 118.16 121.20 2yz0 n LYS 37 Ca -0.13 0.00 -0.05 0.00 -2.87 0.00 0.00 58.31 55.25 2yz0 n LYS 37 Cb 0.54 0.00 0.05 0.00 -1.84 0.00 0.00 35.03 33.79 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 3.57 -1.84 -0.26 4.39 2.88 -1.26 -4.84 113.62 116.26 2yz0 n SER 38 Ca 0.00 -0.16 0.02 0.00 -1.33 0.00 0.00 58.87 57.40 2yz0 n SER 38 Cb 0.00 -0.23 -0.00 0.00 -0.75 0.00 0.00 64.21 63.22 2yz0 n SER 38 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2yz0 n SER 39 N -2.02 -1.53 -0.15 -3.46 7.64 -1.26 -4.62 113.62 108.21 2yz0 n SER 39 Ca 0.02 0.13 0.03 0.00 1.01 0.00 0.00 58.87 60.06 2yz0 n SER 39 Cb 0.11 -0.36 0.00 0.00 -1.01 0.00 0.00 64.21 62.95 2yz0 n SER 39 CO 0.00 0.00 0.00 -2.67 -3.01 0.00 0.00 175.04 169.36 2yz0 n TRP 40 N -0.92 0.00 -4.20 1.43 2.14 -1.26 -5.02 117.44 109.61 2yz0 n TRP 40 Ca 0.00 0.00 -0.14 0.00 2.07 0.00 0.00 57.50 59.43 2yz0 n TRP 40 Cb 0.05 0.00 -0.10 0.00 -0.81 0.00 0.00 31.31 30.45 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 -0.93 1.54 -0.64 -0.67 -1.08 -1.26 -5.10 116.67 108.52 2yz0 s ASP 41 Ca 0.05 -0.90 0.06 0.00 -0.52 0.00 0.00 52.55 51.24 2yz0 s ASP 41 Cb 0.05 0.01 0.23 0.00 -1.46 0.00 0.00 42.92 41.75 2yz0 s ASP 41 CO 0.14 -0.31 0.66 0.29 0.52 0.00 0.00 175.17 176.48 2yz0 n LYS 42 N 0.24 2.23 -2.39 4.34 5.02 -1.26 -4.67 118.16 121.66 2yz0 n LYS 42 Ca -0.14 -4.54 -0.26 0.00 -2.02 0.00 0.00 58.31 51.36 2yz0 n LYS 42 Cb 0.59 -2.21 0.00 0.00 -0.02 0.00 0.00 35.03 33.40 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 1.20 3.41 -2.19 1.97 6.02 -1.24 -5.06 117.38 121.49 2yz0 n GLN 43 Ca 0.27 -4.41 -0.42 0.00 -0.01 0.00 0.00 57.00 52.43 2yz0 n GLN 43 Cb 0.40 -2.23 -0.03 0.00 1.02 0.00 0.00 30.24 29.40 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 -3.54 4.31 -0.03 -1.09 0.04 -1.24 -4.69 135.00 128.75 2yz0 s PRO 44 Ca 0.48 2.03 0.14 0.00 0.04 0.00 0.00 61.00 63.70 2yz0 s PRO 44 Cb 0.40 -3.37 0.43 0.00 0.04 0.00 0.00 34.50 32.01 2yz0 s PRO 44 CO -0.14 -0.48 1.36 0.94 0.04 0.00 0.00 177.00 178.73 2yz0 n GLN 45 N 4.45 2.94 0.00 4.56 7.27 -1.26 -4.95 117.38 130.39 2yz0 n GLN 45 Ca 0.12 -2.33 0.00 0.00 0.07 0.00 0.00 57.00 54.86 2yz0 n GLN 45 Cb 0.43 -1.44 0.00 0.00 2.41 0.00 0.00 30.24 31.63 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 0.69 0.00 -1.42 1.69 0.13 -1.26 -4.62 119.36 114.57 2yz0 n ILE 46 Ca 0.16 0.00 -0.41 0.00 -1.10 0.00 0.00 62.75 61.40 2yz0 n ILE 46 Cb 0.56 0.00 0.01 0.00 -0.84 0.00 0.00 39.64 39.36 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 -0.09 1.55 -3.82 9.51 -0.00 -1.26 -4.92 119.36 120.33 2yz0 n ILE 47 Ca 0.00 -0.50 -0.10 0.00 -0.00 0.00 0.00 62.75 62.15 2yz0 n ILE 47 Cb 0.00 -0.43 -0.06 0.00 -0.00 0.00 0.00 39.64 39.15 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 -1.53 0.10 0.08 4.28 -0.71 -1.21 -3.84 117.98 115.16 2yz0 s PHE 48 Ca 0.63 -0.46 0.05 0.00 -1.04 0.00 0.00 56.93 56.11 2yz0 s PHE 48 Cb -0.60 0.12 -0.04 0.00 -1.21 0.00 0.00 43.02 41.29 2yz0 s PHE 48 CO 0.59 -0.74 -0.00 -1.21 -1.34 0.00 0.00 175.22 172.52 2yz0 s GLU 49 N -3.89 2.55 -0.02 1.99 2.02 -1.05 -3.27 118.70 117.03 2yz0 s GLU 49 Ca 0.10 -0.83 0.03 0.00 0.02 0.00 0.00 54.97 54.29 2yz0 s GLU 49 Cb 0.02 -2.54 0.00 0.00 0.10 0.00 0.00 34.13 31.71 2yz0 s GLU 49 CO -0.05 0.55 -0.10 0.42 0.02 0.00 0.00 175.26 176.10 2yz0 s ILE 50 N -1.29 0.83 -0.02 -1.63 -1.09 -1.16 -0.60 121.20 116.25 2yz0 s ILE 50 Ca 0.25 -0.40 -0.26 0.00 -2.23 0.00 0.00 60.65 58.01 2yz0 s ILE 50 Cb -0.12 -0.74 -0.04 0.00 -1.58 0.00 0.00 42.46 39.99 2yz0 s ILE 50 CO 0.18 0.26 0.82 -0.89 -1.23 0.00 0.00 174.94 174.07 2yz0 s THR 51 N 0.13 4.91 0.10 2.92 2.01 -1.11 -2.19 115.64 122.41 2yz0 s THR 51 Ca -0.02 1.71 0.03 0.00 0.31 0.00 0.00 61.69 63.72 2yz0 s THR 51 Cb -0.08 -4.16 -0.04 0.00 0.01 0.00 0.00 72.50 68.23 2yz0 s THR 51 CO 0.00 0.24 -0.09 -0.76 -0.69 0.00 0.00 174.62 173.32 2yz0 s LEU 52 N 0.69 2.43 -0.04 4.42 1.43 0.20 -4.92 118.68 122.88 2yz0 s LEU 52 Ca 0.43 -0.86 -0.31 0.00 -1.03 0.00 0.00 54.13 52.36 2yz0 s LEU 52 Cb -0.20 -0.26 0.12 0.00 0.03 0.00 0.00 46.19 45.88 2yz0 s LEU 52 CO 0.23 -0.30 1.26 0.00 0.23 0.00 0.00 176.35 177.76 2yz0 s ARG 53 N -3.03 0.42 1.14 1.70 3.03 -1.26 0.05 118.95 121.00 2yz0 s ARG 53 Ca 0.07 -0.22 -0.12 0.00 2.03 0.00 0.00 55.73 57.49 2yz0 s ARG 53 Cb -0.01 0.15 0.27 0.00 -1.03 0.00 0.00 34.95 34.33 2yz0 s ARG 53 CO -0.01 -0.19 1.04 -1.12 -1.13 0.00 0.00 175.30 173.89 2yz0 s SER 54 N -2.83 1.14 0.12 -2.89 0.01 -0.20 -4.94 113.70 104.11 2yz0 s SER 54 Ca 0.13 1.60 0.08 0.00 1.31 0.00 0.00 55.95 59.07 2yz0 s SER 54 Cb 0.03 -2.34 -0.19 0.00 0.21 0.00 0.00 66.02 63.73 2yz0 s SER 54 CO -0.04 -4.12 1.26 -0.37 0.41 0.00 0.00 173.24 170.39 2yz0 h VAL 55 N -2.56 1.60 -3.97 3.43 -1.51 -1.89 -3.47 116.25 107.88 2yz0 h VAL 55 Ca -0.60 -3.29 0.00 0.00 -1.23 0.00 0.00 66.70 61.58 2yz0 h VAL 55 Cb 1.33 2.79 0.00 0.00 -2.13 0.00 0.00 31.29 33.28 2yz0 h VAL 55 CO 0.49 0.91 0.00 -0.67 -1.23 0.00 0.00 177.57 177.08 2yz0 n ASP 56 N -3.32 1.46 -0.01 4.19 2.03 -1.26 -5.07 116.55 114.56 2yz0 n ASP 56 Ca -0.01 -0.97 0.02 0.00 0.52 0.00 0.00 54.79 54.35 2yz0 n ASP 56 Cb 0.93 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 41.29 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 -0.26 0.75 -4.58 -0.67 4.76 -1.23 -4.34 118.16 112.59 2yz0 n LYS 57 Ca 0.00 -0.04 -0.31 0.00 -2.87 0.00 0.00 58.31 55.09 2yz0 n LYS 57 Cb 0.00 -1.11 -0.12 0.00 -1.84 0.00 0.00 35.03 31.96 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 -2.29 2.32 0.00 1.97 -1.05 -1.26 -0.76 118.70 117.63 2yz0 s GLU 58 Ca -0.02 -0.85 0.15 0.00 -0.15 0.00 0.00 54.97 54.10 2yz0 s GLU 58 Cb 0.03 -2.34 0.69 0.00 -0.44 0.00 0.00 34.13 32.07 2yz0 s GLU 58 CO 0.20 0.57 1.43 -0.35 0.95 0.00 0.00 175.26 178.05 2yz0 n PRO 59 N 1.58 0.13 -3.92 -4.83 -0.04 -1.26 -4.92 135.00 121.74 2yz0 n PRO 59 Ca -0.16 0.19 -0.12 0.00 -0.04 0.00 0.00 63.50 63.37 2yz0 n PRO 59 Cb 0.52 -1.50 -0.00 0.00 -0.04 0.00 0.00 33.50 32.48 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 -1.37 0.00 0.13 0.52 0.24 0.06 -5.06 118.33 112.85 2yz0 n VAL 60 Ca 0.06 -1.41 0.04 0.00 -2.04 0.00 0.00 64.34 60.98 2yz0 n VAL 60 Cb 0.14 1.06 -0.05 0.00 -1.47 0.00 0.00 33.84 33.51 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 -0.57 1.83 -2.23 7.34 0.28 -1.14 -3.48 120.64 122.68 2yz0 n GLU 61 Ca -0.04 -0.04 0.00 0.00 -0.16 0.00 0.00 57.16 56.91 2yz0 n GLU 61 Cb 0.60 -1.06 0.00 0.00 1.43 0.00 0.00 31.44 32.41 2yz0 n GLU 61 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 2yz0 n SER 62 N -1.55 -4.42 -4.56 -1.84 2.88 -1.26 -1.04 113.62 101.83 2yz0 n SER 62 Ca -0.00 0.32 -0.36 0.00 -1.33 0.00 0.00 58.87 57.49 2yz0 n SER 62 Cb 0.17 -1.03 -0.11 0.00 -0.75 0.00 0.00 64.21 62.49 2yz0 n SER 62 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2yz0 s SER 63 N -0.56 5.64 0.03 -3.46 0.01 -1.26 -1.88 113.70 112.23 2yz0 s SER 63 Ca 0.00 -0.04 0.01 0.00 1.31 0.00 0.00 55.95 57.23 2yz0 s SER 63 Cb 0.00 -2.01 -0.02 0.00 0.21 0.00 0.00 66.02 64.19 2yz0 s SER 63 CO 0.00 0.03 -0.05 -0.63 0.41 0.00 0.00 173.24 172.99 2yz0 s ILE 64 N 1.27 0.32 -0.21 1.44 1.01 0.11 -2.54 121.20 122.60 2yz0 s ILE 64 Ca 0.06 -1.07 0.02 0.00 0.00 0.00 0.00 60.65 59.66 2yz0 s ILE 64 Cb -0.14 -0.53 0.04 0.00 0.01 0.00 0.00 42.46 41.83 2yz0 s ILE 64 CO 0.05 -0.49 -0.15 -0.89 0.00 0.00 0.00 174.94 173.46 2yz0 s THR 65 N -1.64 2.01 -0.43 2.92 2.01 -1.16 0.59 115.64 119.93 2yz0 s THR 65 Ca -0.11 -1.21 -0.21 0.00 0.31 0.00 0.00 61.69 60.46 2yz0 s THR 65 Cb -0.08 -1.99 0.02 0.00 0.01 0.00 0.00 72.50 70.46 2yz0 s THR 65 CO -0.01 0.25 0.67 -0.76 -0.69 0.00 0.00 174.62 174.08 2yz0 s LEU 66 N 1.24 4.41 -0.35 4.42 1.43 -0.93 -2.03 118.68 126.87 2yz0 s LEU 66 Ca -0.02 -0.22 -0.12 0.00 -1.03 0.00 0.00 54.13 52.74 2yz0 s LEU 66 Cb -0.16 -2.79 -0.01 0.00 0.03 0.00 0.00 46.19 43.26 2yz0 s LEU 66 CO -0.09 -0.78 0.23 -2.28 0.23 0.00 0.00 176.35 173.66 2yz0 s HIS 67 N 2.90 3.22 -0.07 0.29 5.65 -0.93 -2.96 115.29 123.39 2yz0 s HIS 67 Ca 0.24 -0.35 -0.02 0.00 0.25 0.00 0.00 55.06 55.18 2yz0 s HIS 67 Cb -0.14 -2.47 -0.04 0.00 -1.18 0.00 0.00 32.58 28.76 2yz0 s HIS 67 CO 0.19 -0.42 0.04 -0.06 -0.65 0.00 0.00 174.74 173.85 2yz0 s PHE 68 N 1.69 3.26 -0.20 3.88 0.40 -1.20 -2.67 117.98 123.14 2yz0 s PHE 68 Ca 0.06 0.26 0.01 0.00 -0.60 0.00 0.00 56.93 56.66 2yz0 s PHE 68 Cb -0.18 -1.80 0.03 0.00 0.51 0.00 0.00 43.02 41.58 2yz0 s PHE 68 CO 0.10 0.54 -0.17 0.00 0.70 0.00 0.00 175.22 176.38 2yz0 s ALA 69 N -0.97 2.35 -0.88 5.36 0.00 -0.75 -3.32 121.76 123.55 2yz0 s ALA 69 Ca 0.15 -1.34 -0.22 0.00 0.00 0.00 0.00 51.96 50.55 2yz0 s ALA 69 Cb -0.12 -1.28 0.07 0.00 0.00 0.00 0.00 23.12 21.79 2yz0 s ALA 69 CO 0.05 -0.60 1.24 -1.64 0.00 0.00 0.00 175.76 174.81 2yz0 s MET 70 N 1.26 3.43 0.93 0.00 -1.94 -1.26 -3.07 119.30 118.65 2yz0 s MET 70 Ca 0.01 -1.08 -0.13 0.00 -1.71 0.00 0.00 55.69 52.78 2yz0 s MET 70 Cb -0.15 -4.81 0.01 0.00 2.01 0.00 0.00 34.83 31.89 2yz0 s MET 70 CO -0.11 -2.01 0.31 0.25 -0.01 0.00 0.00 175.02 173.46 2yz0 n THR 71 N 6.24 0.22 0.75 2.05 -2.24 -1.26 -4.82 114.28 115.22 2yz0 n THR 71 Ca 0.18 -0.24 0.07 0.00 -2.27 0.00 0.00 64.05 61.79 2yz0 n THR 71 Cb 0.49 -0.58 0.39 0.00 -2.10 0.00 0.00 70.33 68.53 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 -1.20 0.27 -0.03 -0.78 -0.04 -1.26 -2.35 135.00 129.61 2yz0 n PRO 72 Ca 0.06 0.12 0.01 0.00 -0.04 0.00 0.00 63.50 63.65 2yz0 n PRO 72 Cb 0.53 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.40 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 -1.22 1.14 -1.40 0.54 2.81 -1.26 -4.79 117.12 112.93 2yz0 n MET 73 Ca 0.08 -0.06 -0.38 0.00 -1.81 0.00 0.00 57.70 55.53 2yz0 n MET 73 Cb 0.10 -1.28 0.04 0.00 -0.71 0.00 0.00 33.22 31.37 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 -2.12 -1.02 0.45 2.03 4.19 -0.99 -0.93 117.16 118.78 2yz0 n TYR 74 Ca -0.09 0.42 0.09 0.00 3.31 0.00 0.00 57.90 61.63 2yz0 n TYR 74 Cb 0.54 -1.91 0.37 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 0.05 0.07 -0.29 2.98 -0.04 -1.26 -4.75 135.00 131.76 2yz0 n PRO 75 Ca 0.11 0.32 0.01 0.00 -0.04 0.00 0.00 63.50 63.89 2yz0 n PRO 75 Cb 0.48 -1.64 0.05 0.00 -0.04 0.00 0.00 33.50 32.36 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 -1.77 0.10 -3.14 0.54 9.36 -0.11 -4.45 117.16 117.69 2yz0 n TYR 76 Ca 0.03 0.94 -0.19 0.00 3.32 0.00 0.00 57.90 61.99 2yz0 n TYR 76 Cb 0.19 -0.83 0.03 0.00 -0.63 0.00 0.00 39.34 38.10 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 -5.80 2.40 -0.18 2.97 -4.23 -1.24 -5.10 115.64 104.47 2yz0 s THR 77 Ca -0.11 -1.07 -0.11 0.00 -1.18 0.00 0.00 61.69 59.22 2yz0 s THR 77 Cb 0.17 -2.47 -0.05 0.00 1.34 0.00 0.00 72.50 71.49 2yz0 s THR 77 CO 0.56 0.00 0.18 0.00 -0.54 0.00 0.00 174.62 174.82 2yz0 s ALA 78 N -2.56 3.69 1.18 3.99 0.00 -1.26 -4.39 121.76 122.40 2yz0 s ALA 78 Ca 0.56 -0.61 -0.18 0.00 0.00 0.00 0.00 51.96 51.73 2yz0 s ALA 78 Cb -0.07 -2.21 0.28 0.00 0.00 0.00 0.00 23.12 21.12 2yz0 s ALA 78 CO 0.35 0.20 1.11 -1.25 0.00 0.00 0.00 175.76 176.16 2yz0 s PRO 79 N 0.20 -1.04 -0.11 0.00 0.04 -1.26 -4.86 135.00 127.97 2yz0 s PRO 79 Ca 0.11 -0.00 -0.01 0.00 0.04 0.00 0.00 61.00 61.15 2yz0 s PRO 79 Cb -0.12 -1.61 -0.02 0.00 0.04 0.00 0.00 34.50 32.79 2yz0 s PRO 79 CO 0.01 -3.61 -0.09 -2.00 0.04 0.00 0.00 177.00 171.35 2yz0 s GLU 80 N -5.35 3.23 -0.10 4.56 2.12 -1.17 -4.90 118.70 117.08 2yz0 s GLU 80 Ca 0.70 -0.60 0.02 0.00 0.36 0.00 0.00 54.97 55.45 2yz0 s GLU 80 Cb -0.11 -2.68 0.01 0.00 0.26 0.00 0.00 34.13 31.61 2yz0 s GLU 80 CO 0.56 0.38 -0.17 0.42 -0.54 0.00 0.00 175.26 175.90 2yz0 s ILE 81 N -0.04 1.62 0.01 -3.70 -1.09 -1.25 -1.80 121.20 114.94 2yz0 s ILE 81 Ca -0.01 -0.74 0.02 0.00 -2.23 0.00 0.00 60.65 57.69 2yz0 s ILE 81 Cb -0.14 -1.45 -0.01 0.00 -1.58 0.00 0.00 42.46 39.28 2yz0 s ILE 81 CO 0.03 0.46 -0.07 -1.83 -1.23 0.00 0.00 174.94 172.31 2yz0 s GLU 82 N 0.76 0.53 0.02 2.79 -1.05 -1.09 -4.97 118.70 115.69 2yz0 s GLU 82 Ca -0.11 -0.35 -0.14 0.00 -0.15 0.00 0.00 54.97 54.22 2yz0 s GLU 82 Cb -0.16 -0.48 -0.06 0.00 -0.44 0.00 0.00 34.13 33.00 2yz0 s GLU 82 CO 0.02 0.12 0.42 -0.06 0.95 0.00 0.00 175.26 176.71 2yz0 s PHE 83 N -0.41 3.71 0.38 4.83 0.08 -1.26 -2.20 117.98 123.11 2yz0 s PHE 83 Ca 0.00 0.97 0.05 0.00 0.12 0.00 0.00 56.93 58.08 2yz0 s PHE 83 Cb -0.04 -2.28 -0.07 0.00 -0.57 0.00 0.00 43.02 40.06 2yz0 s PHE 83 CO -0.00 0.62 0.03 0.15 -0.10 0.00 0.00 175.22 175.92 2yz0 s LYS 84 N -1.23 1.83 0.00 0.44 -0.14 -0.86 -4.89 119.74 114.89 2yz0 s LYS 84 Ca 0.26 -2.04 0.00 0.00 -1.36 0.00 0.00 55.97 52.83 2yz0 s LYS 84 Cb -0.16 -1.29 0.00 0.00 -1.68 0.00 0.00 37.83 34.70 2yz0 s LYS 84 CO 0.14 -0.12 0.00 0.09 -0.76 0.00 0.00 175.35 174.70 2yz0 n ASN 85 N -0.86 0.00 -2.50 2.83 3.02 -1.26 -3.01 115.26 113.48 2yz0 n ASN 85 Ca -0.04 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.51 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 -1.44 0.00 2.41 0.24 -1.05 -4.97 118.33 113.51 2yz0 n VAL 86 Ca 0.00 0.35 0.00 0.00 -2.04 0.00 0.00 64.34 62.65 2yz0 n VAL 86 Cb 0.00 -2.22 0.00 0.00 -1.47 0.00 0.00 33.84 30.15 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 1.16 0.00 -0.34 7.34 10.64 -1.24 -4.71 117.38 130.22 2yz0 n GLN 87 Ca 0.00 0.00 0.15 0.00 -1.83 0.00 0.00 57.00 55.32 2yz0 n GLN 87 Cb 0.35 0.00 0.36 0.00 -0.86 0.00 0.00 30.24 30.08 2yz0 n GLN 87 CO 0.00 0.00 0.00 -0.91 -1.83 0.00 0.00 177.06 174.32 2yz0 h ASN 88 N 0.00 0.69 -3.79 2.61 4.21 -1.93 -3.40 115.58 113.97 2yz0 h ASN 88 Ca 0.00 0.12 -0.52 0.00 1.21 0.00 0.00 56.30 57.11 2yz0 h ASN 88 Cb 0.00 0.01 0.05 0.00 -1.12 0.00 0.00 38.32 37.26 2yz0 h ASN 88 CO 0.00 0.16 0.62 0.54 -1.29 0.00 0.00 177.43 177.46 2yz0 s VAL 89 N -5.81 2.88 -0.03 2.81 0.11 -1.26 -4.98 120.40 114.10 2yz0 s VAL 89 Ca -0.11 0.85 -0.02 0.00 -2.93 0.00 0.00 61.98 59.78 2yz0 s VAL 89 Cb 0.26 -3.54 -0.01 0.00 -1.53 0.00 0.00 36.38 31.56 2yz0 s VAL 89 CO 0.80 0.19 -0.03 0.24 -3.33 0.00 0.00 175.10 172.97 2yz0 h MET 90 N 3.76 0.00 0.00 1.54 2.86 -1.93 -3.48 114.93 117.69 2yz0 h MET 90 Ca -0.48 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.16 2yz0 h MET 90 Cb 1.22 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.88 2yz0 h MET 90 CO 0.68 0.00 0.00 -0.40 1.06 0.00 0.00 176.91 178.25 2yz0 n ASP 91 N -2.82 0.00 -0.29 1.22 5.75 -1.26 -4.97 116.55 114.19 2yz0 n ASP 91 Ca -0.01 0.00 0.04 0.00 -0.01 0.00 0.00 54.79 54.81 2yz0 n ASP 91 Cb 0.05 0.00 0.19 0.00 -1.03 0.00 0.00 41.12 40.33 2yz0 n ASP 91 CO 0.00 0.00 0.00 0.28 -0.11 0.00 0.00 177.20 177.37 2yz0 h SER 92 N 0.00 0.58 -0.38 -1.12 0.02 -2.00 -0.29 113.55 110.36 2yz0 h SER 92 Ca 0.00 0.07 -0.16 0.00 -0.84 0.00 0.00 61.79 60.86 2yz0 h SER 92 Cb 0.00 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.50 2yz0 h SER 92 CO 0.00 0.29 -0.40 1.56 -1.14 0.00 0.00 176.83 177.15 2yz0 h GLN 93 N 0.69 0.93 -0.39 3.45 7.50 -1.98 -2.34 115.11 122.97 2yz0 h GLN 93 Ca 0.42 -0.50 0.01 0.00 0.50 0.00 0.00 58.65 59.08 2yz0 h GLN 93 Cb 0.49 0.02 -0.02 0.00 0.05 0.00 0.00 27.48 28.02 2yz0 h GLN 93 CO -0.30 1.16 0.24 -0.07 -1.50 0.00 0.00 178.83 178.36 2yz0 h LEU 94 N 0.75 0.41 -0.79 1.46 4.07 -1.64 -1.74 115.31 117.83 2yz0 h LEU 94 Ca 0.06 -0.00 -0.07 0.00 0.08 0.00 0.00 57.88 57.94 2yz0 h LEU 94 Cb 1.00 -0.09 -0.03 0.00 1.08 0.00 0.00 40.66 42.62 2yz0 h LEU 94 CO 0.10 0.29 0.10 1.56 -1.08 0.00 0.00 178.44 179.41 2yz0 h GLN 95 N 0.50 1.01 -0.66 1.13 1.08 -1.09 -2.68 115.11 114.40 2yz0 h GLN 95 Ca 0.15 -0.26 -0.01 0.00 -1.45 0.00 0.00 58.65 57.08 2yz0 h GLN 95 Cb -0.03 -0.13 -0.03 0.00 -0.05 0.00 0.00 27.48 27.25 2yz0 h GLN 95 CO -0.05 0.93 0.37 1.98 -0.95 0.00 0.00 178.83 181.11 2yz0 h MET 96 N 0.95 0.90 -0.66 1.46 1.85 -0.98 -2.44 114.93 116.01 2yz0 h MET 96 Ca 0.19 -0.09 -0.02 0.00 -0.61 0.00 0.00 59.70 59.17 2yz0 h MET 96 Cb 0.41 -0.18 -0.03 0.00 0.43 0.00 0.00 31.60 32.23 2yz0 h MET 96 CO 0.01 0.65 0.33 -0.07 -0.40 0.00 0.00 176.91 177.43 2yz0 h LEU 97 N 0.91 0.85 -0.67 3.39 3.38 -0.99 -2.72 115.31 119.47 2yz0 h LEU 97 Ca 0.23 -0.12 0.09 0.00 0.09 0.00 0.00 57.88 58.17 2yz0 h LEU 97 Cb 0.00 -0.22 -0.07 0.00 0.09 0.00 0.00 40.66 40.47 2yz0 h LEU 97 CO -0.04 0.73 0.32 0.11 0.09 0.00 0.00 178.44 179.65 2yz0 h LYS 98 N 0.91 0.54 -0.95 1.13 1.79 -1.32 -0.90 116.57 117.77 2yz0 h LYS 98 Ca 0.23 -0.03 0.06 0.00 -2.18 0.00 0.00 60.65 58.72 2yz0 h LYS 98 Cb 0.10 -0.12 -0.06 0.00 -1.58 0.00 0.00 32.23 30.57 2yz0 h LYS 98 CO -0.03 0.36 0.62 0.77 -1.08 0.00 0.00 179.45 180.08 2yz0 h SER 99 N 0.55 0.98 0.76 0.86 0.02 -1.38 -0.59 113.55 114.75 2yz0 h SER 99 Ca 0.32 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 61.20 2yz0 h SER 99 Cb 0.34 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.66 2yz0 h SER 99 CO -0.26 0.64 -0.38 -0.33 -1.14 0.00 0.00 176.83 175.36 2yz0 h GLU 100 N 1.12 0.00 -0.10 3.45 4.39 -1.07 -2.93 114.58 119.44 2yz0 h GLU 100 Ca 0.40 0.00 0.02 0.00 0.34 0.00 0.00 59.36 60.12 2yz0 h GLU 100 Cb 0.15 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.80 2yz0 h GLU 100 CO -0.15 0.38 0.07 0.74 -1.16 0.00 0.00 179.01 178.89 2yz0 h PHE 101 N 0.00 0.05 -0.26 4.33 0.04 0.01 -0.36 116.94 120.75 2yz0 h PHE 101 Ca -0.00 0.00 -0.18 0.00 2.80 0.00 0.00 57.97 60.59 2yz0 h PHE 101 Cb 0.86 -0.02 0.00 0.00 2.20 0.00 0.00 35.95 39.00 2yz0 h PHE 101 CO 0.00 0.03 -0.53 -0.22 -0.60 0.00 0.00 178.31 176.98 2yz0 h LYS 102 N 0.05 0.81 -0.24 1.51 3.11 -1.49 -1.87 116.57 118.46 2yz0 h LYS 102 Ca 0.04 -0.53 -0.12 0.00 -2.81 0.00 0.00 60.65 57.23 2yz0 h LYS 102 Cb 0.11 0.07 -0.00 0.00 -1.00 0.00 0.00 32.23 31.41 2yz0 h LYS 102 CO -0.00 1.16 -0.30 -0.22 -2.81 0.00 0.00 179.45 177.28 2yz0 h LYS 103 N 0.57 0.62 -0.21 1.90 3.11 -1.43 -1.79 116.57 119.33 2yz0 h LYS 103 Ca 0.01 -0.35 -0.01 0.00 -2.81 0.00 0.00 60.65 57.48 2yz0 h LYS 103 Cb 1.15 0.02 -0.01 0.00 -1.00 0.00 0.00 32.23 32.39 2yz0 h LYS 103 CO 0.12 0.96 0.10 0.82 -2.81 0.00 0.00 179.45 178.64 2yz0 h ILE 104 N 0.33 1.14 -0.70 2.00 2.04 -1.13 -2.12 117.51 119.06 2yz0 h ILE 104 Ca 0.03 -0.39 -0.03 0.00 1.00 0.00 0.00 64.86 65.47 2yz0 h ILE 104 Cb 0.88 1.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.93 2yz0 h ILE 104 CO 0.07 0.13 0.33 -0.74 0.00 0.00 0.00 178.15 177.94 2yz0 h HIS 105 N 0.22 1.02 -0.80 1.37 2.76 -1.37 0.27 115.15 118.62 2yz0 h HIS 105 Ca 0.07 -0.05 0.04 0.00 -2.20 0.00 0.00 60.37 58.23 2yz0 h HIS 105 Cb 0.12 -0.31 -0.05 0.00 1.55 0.00 0.00 27.41 28.71 2yz0 h HIS 105 CO -0.02 0.76 0.50 -0.97 -1.30 0.00 0.00 177.93 176.89 2yz0 h ASN 106 N 0.98 0.80 0.47 3.26 -0.73 -1.13 1.17 115.58 120.40 2yz0 h ASN 106 Ca 0.24 0.01 -0.25 0.00 1.87 0.00 0.00 56.30 58.16 2yz0 h ASN 106 Cb 0.13 -0.17 0.01 0.00 0.27 0.00 0.00 38.32 38.56 2yz0 h ASN 106 CO -0.03 0.54 -1.10 0.00 -0.37 0.00 0.00 177.43 176.47 2yz0 h THR 107 N 0.94 1.44 -0.80 -3.57 1.03 -1.05 -3.26 112.91 107.64 2yz0 h THR 107 Ca 0.33 -2.74 -0.42 0.00 -0.01 0.00 0.00 66.41 63.57 2yz0 h THR 107 Cb 0.08 2.69 -0.25 0.00 -1.07 0.00 0.00 68.15 69.60 2yz0 h THR 107 CO -0.14 0.81 0.43 -1.20 -0.01 0.00 0.00 175.52 175.41 2yz0 n SER 108 N -3.65 3.35 -4.58 0.00 7.64 0.91 -4.89 113.62 112.40 2yz0 n SER 108 Ca -0.08 -3.67 -0.31 0.00 1.01 0.00 0.00 58.87 55.82 2yz0 n SER 108 Cb 0.93 -0.78 -0.05 0.00 -1.01 0.00 0.00 64.21 63.31 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 -3.29 2.83 0.00 1.43 3.52 0.40 -2.10 118.95 121.75 2yz0 s ARG 109 Ca 0.53 -1.32 0.00 0.00 -0.13 0.00 0.00 55.73 54.81 2yz0 s ARG 109 Cb 0.46 -5.30 0.00 0.00 -1.56 0.00 0.00 34.95 28.54 2yz0 s ARG 109 CO 0.07 -3.57 0.00 0.41 -0.81 0.00 0.00 175.30 171.40 2yz0 n GLY 110 N 5.77 0.36 0.00 8.12 0.00 -1.26 -5.06 105.19 113.12 2yz0 n GLY 110 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.47 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 2.48 -2.28 1.61 10.64 -0.89 -4.93 117.38 124.02 2yz0 n GLN 111 Ca 0.00 0.00 -0.41 0.00 -1.83 0.00 0.00 57.00 54.76 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 0.50 4.42 0.00 2.61 2.02 -1.26 -4.90 118.70 122.09 2yz0 s GLU 112 Ca 0.00 1.98 0.00 0.00 0.02 0.00 0.00 54.97 56.97 2yz0 s GLU 112 Cb 0.00 -3.22 0.00 0.00 0.10 0.00 0.00 34.13 31.01 2yz0 s GLU 112 CO 0.00 -0.21 0.00 0.44 0.02 0.00 0.00 175.26 175.51 2yz0 n ILE 113 N 2.70 0.00 -0.12 -1.63 -5.35 -1.26 -4.65 119.36 109.04 2yz0 n ILE 113 Ca 0.06 -0.29 -0.09 0.00 -0.27 0.00 0.00 62.75 62.16 2yz0 n ILE 113 Cb 0.44 0.91 -0.01 0.00 -1.74 0.00 0.00 39.64 39.24 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 1.16 -0.06 7.28 1.08 -1.97 0.25 117.51 125.25 2yz0 h ILE 114 Ca 0.00 -0.42 -0.15 0.00 -0.39 0.00 0.00 64.86 63.90 2yz0 h ILE 114 Cb 0.00 0.73 -0.01 0.00 -3.07 0.00 0.00 36.82 34.47 2yz0 h ILE 114 CO 0.00 0.16 -0.64 0.15 -0.69 0.00 0.00 178.15 177.13 2yz0 h PHE 115 N 0.48 0.29 -0.13 1.37 3.57 -1.96 -2.39 116.94 118.18 2yz0 h PHE 115 Ca 0.13 -0.12 -0.03 0.00 3.53 0.00 0.00 57.97 61.49 2yz0 h PHE 115 Cb 0.08 -0.05 -0.00 0.00 2.79 0.00 0.00 35.95 38.77 2yz0 h PHE 115 CO -0.02 0.80 -0.03 0.93 -2.23 0.00 0.00 178.31 177.76 2yz0 h GLU 116 N 0.16 0.24 -0.60 1.11 4.39 -1.76 0.47 114.58 118.59 2yz0 h GLU 116 Ca -0.01 -0.09 -0.05 0.00 0.34 0.00 0.00 59.36 59.54 2yz0 h GLU 116 Cb 1.16 -0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 29.77 2yz0 h GLU 116 CO 0.10 0.54 0.18 0.97 -1.16 0.00 0.00 179.01 179.64 2yz0 h ILE 117 N -0.07 1.25 -0.39 3.13 2.10 -0.98 0.11 117.51 122.66 2yz0 h ILE 117 Ca 0.03 -0.85 -0.10 0.00 1.08 0.00 0.00 64.86 65.03 2yz0 h ILE 117 Cb 0.45 0.65 -0.01 0.00 -1.09 0.00 0.00 36.82 36.82 2yz0 h ILE 117 CO 0.01 0.32 -0.13 0.71 -1.08 0.00 0.00 178.15 177.98 2yz0 h THR 118 N 0.86 1.28 -0.37 2.19 1.35 -1.41 -1.56 112.91 115.25 2yz0 h THR 118 Ca 0.19 -1.24 -0.06 0.00 -0.55 0.00 0.00 66.41 64.75 2yz0 h THR 118 Cb 0.30 1.27 -0.01 0.00 -1.73 0.00 0.00 68.15 67.98 2yz0 h THR 118 CO -0.00 0.41 0.00 0.28 -0.25 0.00 0.00 175.52 175.96 2yz0 h SER 119 N 0.58 0.64 -0.00 5.36 0.02 -0.76 -0.08 113.55 119.31 2yz0 h SER 119 Ca 0.09 -0.30 -0.00 0.00 -0.84 0.00 0.00 61.79 60.74 2yz0 h SER 119 Cb 0.67 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 63.04 2yz0 h SER 119 CO 0.05 0.79 0.00 0.15 -1.14 0.00 0.00 176.83 176.68 2yz0 h PHE 120 N 0.48 0.00 -0.75 3.45 3.04 -0.95 -0.16 116.94 122.06 2yz0 h PHE 120 Ca 0.11 -0.00 -0.05 0.00 3.98 0.00 0.00 57.97 62.01 2yz0 h PHE 120 Cb 0.46 -0.00 -0.03 0.00 2.56 0.00 0.00 35.95 38.93 2yz0 h PHE 120 CO 0.04 0.11 0.28 1.79 -2.02 0.00 0.00 178.31 178.51 2yz0 h THR 121 N -0.10 1.25 -0.27 4.41 1.35 -1.26 0.27 112.91 118.57 2yz0 h THR 121 Ca 0.00 -0.82 -0.03 0.00 -0.55 0.00 0.00 66.41 65.02 2yz0 h THR 121 Cb 0.11 0.38 -0.01 0.00 -1.73 0.00 0.00 68.15 66.89 2yz0 h THR 121 CO -0.00 0.33 0.07 -0.61 -0.25 0.00 0.00 175.52 175.06 2yz0 h GLN 122 N 1.09 0.42 -0.26 4.72 4.15 -0.82 0.66 115.11 125.08 2yz0 h GLN 122 Ca 0.25 -0.10 -0.17 0.00 0.77 0.00 0.00 58.65 59.40 2yz0 h GLN 122 Cb 0.23 -0.06 -0.00 0.00 0.21 0.00 0.00 27.48 27.86 2yz0 h GLN 122 CO -0.02 0.51 -0.52 1.05 -1.93 0.00 0.00 178.83 177.92 2yz0 h GLU 123 N 0.26 0.74 0.00 1.69 4.11 -0.84 -2.57 114.58 117.96 2yz0 h GLU 123 Ca 0.08 -0.45 -0.15 0.00 0.07 0.00 0.00 59.36 58.91 2yz0 h GLU 123 Cb 0.28 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.55 2yz0 h GLU 123 CO 0.00 1.08 -0.72 -0.22 0.07 0.00 0.00 179.01 179.22 2yz0 h LYS 124 N 0.57 0.00 -0.17 1.06 1.63 -0.36 -3.06 116.57 116.24 2yz0 h LYS 124 Ca 0.02 0.00 -0.05 0.00 -0.85 0.00 0.00 60.65 59.77 2yz0 h LYS 124 Cb 1.10 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 32.72 2yz0 h LYS 124 CO 0.11 0.72 -0.08 1.25 -3.45 0.00 0.00 179.45 178.00 2yz0 h LEU 125 N 0.00 0.38 -1.26 5.20 5.85 0.43 -2.85 115.31 123.05 2yz0 h LEU 125 Ca -0.01 -0.41 0.01 0.00 0.84 0.00 0.00 57.88 58.31 2yz0 h LEU 125 Cb 1.28 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 42.17 2yz0 h LEU 125 CO 0.09 0.70 0.50 0.44 -0.34 0.00 0.00 178.44 179.84 2yz0 h ASP 126 N 0.05 0.86 -0.03 1.25 3.32 -1.50 -0.48 116.42 119.90 2yz0 h ASP 126 Ca 0.04 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.07 2yz0 h ASP 126 Cb 0.56 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 39.90 2yz0 h ASP 126 CO 0.03 0.62 0.02 -0.33 -1.72 0.00 0.00 179.24 177.85 2yz0 h GLU 127 N 1.01 0.03 0.61 3.56 4.39 -1.44 -1.90 114.58 120.84 2yz0 h GLU 127 Ca 0.28 -0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.95 2yz0 h GLU 127 Cb -0.10 -0.01 0.01 0.00 -0.10 0.00 0.00 28.75 28.55 2yz0 h GLU 127 CO -0.06 0.04 -0.29 0.74 -1.16 0.00 0.00 179.01 178.28 2yz0 h PHE 128 N 0.01 -0.75 -1.42 4.33 -1.00 -1.24 -2.92 116.94 113.95 2yz0 h PHE 128 Ca 0.01 -0.02 0.41 0.00 2.81 0.00 0.00 57.97 61.18 2yz0 h PHE 128 Cb 0.02 0.25 -0.07 0.00 3.61 0.00 0.00 35.95 39.76 2yz0 h PHE 128 CO -0.07 -0.42 1.01 0.37 -1.61 0.00 0.00 178.31 177.58 2yz0 h GLN 129 N -1.11 0.03 0.00 1.51 -0.00 -1.12 -2.10 115.11 112.32 2yz0 h GLN 129 Ca -0.08 -0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.56 2yz0 h GLN 129 Cb 0.67 -0.01 0.00 0.00 0.00 0.00 0.00 27.48 28.14 2yz0 h GLN 129 CO 0.14 0.02 0.00 -1.71 0.00 0.00 0.00 178.83 177.28 2yz0 n ASN 130 N -4.18 0.00 0.00 -0.69 2.85 -0.71 -4.40 115.26 108.12 2yz0 n ASN 130 Ca 0.32 0.80 0.00 0.00 -0.11 0.00 0.00 54.58 55.59 2yz0 n ASN 130 Cb 1.46 -0.47 0.00 0.00 1.24 0.00 0.00 39.78 42.01 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 -1.90 0.00 -2.48 3.44 3.14 -0.79 -4.87 118.33 114.87 2yz0 n VAL 131 Ca 0.00 0.00 -0.02 0.00 -2.96 0.00 0.00 64.34 61.36 2yz0 n VAL 131 Cb 0.00 0.00 -0.02 0.00 -1.06 0.00 0.00 33.84 32.76 2yz0 n VAL 131 CO 0.00 0.00 0.00 0.52 -6.46 0.00 0.00 176.83 170.89 2yz0 n VAL 132 N 0.00-10.82 -3.51 1.55 0.31 -1.22 -4.97 118.33 99.67 2yz0 n VAL 132 Ca 0.00 1.87 -0.12 0.00 -0.01 0.00 0.00 64.34 66.08 2yz0 n VAL 132 Cb 0.00 -6.33 -0.03 0.00 -0.91 0.00 0.00 33.84 26.56 2yz0 n VAL 132 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 2yz0 s ASN 133 N -1.07 -0.45 -1.06 4.52 3.84 -1.26 -5.09 114.94 114.38 2yz0 s ASN 133 Ca -0.09 -0.05 -0.22 0.00 0.21 0.00 0.00 52.86 52.70 2yz0 s ASN 133 Cb 0.01 0.54 0.01 0.00 -0.55 0.00 0.00 41.25 41.26 2yz0 s ASN 133 CO 0.67 -0.88 1.68 0.42 -2.79 0.00 0.00 177.10 176.19 2yz0 s THR 134 N -3.49 3.80 0.36 -5.21 -4.23 -1.26 -4.12 115.64 101.48 2yz0 s THR 134 Ca 0.00 -0.88 0.00 0.00 -1.18 0.00 0.00 61.69 59.63 2yz0 s THR 134 Cb -0.00 -4.77 0.00 0.00 1.34 0.00 0.00 72.50 69.07 2yz0 s THR 134 CO -0.10 -1.61 0.00 1.67 -0.54 0.00 0.00 174.62 174.04 2yz0 n GLN 135 N 8.73 0.00 -4.55 3.99 7.27 -1.26 -5.13 117.38 126.44 2yz0 n GLN 135 Ca 0.39 0.00 -0.24 0.00 0.07 0.00 0.00 57.00 57.22 2yz0 n GLN 135 Cb 0.49 0.00 -0.16 0.00 2.41 0.00 0.00 30.24 32.97 2yz0 n GLN 135 CO 0.00 0.00 0.00 0.45 0.07 0.00 0.00 177.06 177.58 2yz0 s SER 136 N -2.48 1.64 0.05 1.69 0.15 -1.26 -5.13 113.70 108.36 2yz0 s SER 136 Ca 0.00 -0.27 -0.27 0.00 0.70 0.00 0.00 55.95 56.11 2yz0 s SER 136 Cb 0.00 -0.67 0.09 0.00 -1.71 0.00 0.00 66.02 63.74 2yz0 s SER 136 CO 0.00 0.05 0.81 -0.22 1.20 0.00 0.00 173.24 175.08 2yz0 s LEU 137 N 0.51 -0.42 0.00 3.45 0.20 -1.26 -4.89 118.68 116.27 2yz0 s LEU 137 Ca -0.11 -0.01 0.02 0.00 0.69 0.00 0.00 54.13 54.72 2yz0 s LEU 137 Cb -0.14 2.19 0.14 0.00 -0.43 0.00 0.00 46.19 47.96 2yz0 s LEU 137 CO 0.03 -0.73 0.63 1.21 -0.29 0.00 0.00 176.35 177.20