#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 1.22 0.27 7.83 7.64 -1.26 -4.71 113.62 124.62 2yz0 n SER 2 Ca 0.00 1.17 0.10 0.00 1.01 0.00 0.00 58.87 61.15 2yz0 n SER 2 Cb 0.00 -0.92 0.52 0.00 -1.01 0.00 0.00 64.21 62.80 2yz0 n SER 2 CO 0.00 0.00 0.00 0.17 -3.01 0.00 0.00 175.04 172.20 2yz0 h LEU 3 N 5.04 0.00-10.14 -3.43 8.10 -2.07 -3.41 115.31 109.40 2yz0 h LEU 3 Ca -0.45 0.00 -0.49 0.00 0.11 0.00 0.00 57.88 57.05 2yz0 h LEU 3 Cb 1.37 0.00 0.06 0.00 -0.44 0.00 0.00 40.66 41.65 2yz0 h LEU 3 CO 0.94 0.00 0.39 -0.94 -4.11 0.00 0.00 178.44 174.72 2yz0 s SER 4 N -3.80 5.87 0.43 0.17 1.04 -1.26 -4.83 113.70 111.32 2yz0 s SER 4 Ca -0.02 1.93 0.00 0.00 0.48 0.00 0.00 55.95 58.34 2yz0 s SER 4 Cb 0.05 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.62 2yz0 s SER 4 CO 0.17 -1.11 0.00 1.41 0.98 0.00 0.00 173.24 174.70 2yz0 n HIS 5 N -1.63 -3.12 -2.88 5.02 8.25 -1.26 -4.87 115.22 114.73 2yz0 n HIS 5 Ca 0.10 1.66 -0.17 0.00 -0.26 0.00 0.00 57.72 59.04 2yz0 n HIS 5 Cb 0.52 -2.84 0.02 0.00 1.12 0.00 0.00 29.99 28.81 2yz0 n HIS 5 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 2yz0 n LEU 6 N -3.95 -2.43 -4.90 2.41 -0.00 -1.26 -4.92 117.00 101.95 2yz0 n LEU 6 Ca -0.04 0.08 -0.28 0.00 -0.00 0.00 0.00 56.01 55.77 2yz0 n LEU 6 Cb 0.63 -1.29 -0.01 0.00 -0.00 0.00 0.00 43.42 42.76 2yz0 n LEU 6 CO 0.03 -0.54 0.43 0.28 -0.00 0.00 0.00 177.39 177.59 2yz0 s THR 7 N -1.01 4.90 0.56 1.96 -1.32 -1.26 -4.96 115.64 114.51 2yz0 s THR 7 Ca 0.17 0.25 0.36 0.00 -1.21 0.00 0.00 61.69 61.26 2yz0 s THR 7 Cb -0.02 -3.84 0.39 0.00 -1.51 0.00 0.00 72.50 67.52 2yz0 s THR 7 CO 0.38 -0.76 2.26 -0.07 -2.21 0.00 0.00 174.62 174.21 2yz0 h LEU 8 N 0.48 0.00 -2.07 9.08 3.38 -1.91 -1.87 115.31 122.40 2yz0 h LEU 8 Ca -0.47 0.00 0.10 0.00 0.09 0.00 0.00 57.88 57.60 2yz0 h LEU 8 Cb 1.20 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 2yz0 h LEU 8 CO 0.62 0.02 0.30 0.44 0.09 0.00 0.00 178.44 179.91 2yz0 h ASP 9 N 0.00 0.00 -0.21 -0.43 5.19 -1.93 0.16 116.42 119.21 2yz0 h ASP 9 Ca -0.00 0.00 -0.12 0.00 -0.62 0.00 0.00 57.03 56.29 2yz0 h ASP 9 Cb 0.09 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.59 2yz0 h ASP 9 CO 0.00 0.00 -0.27 1.56 -3.12 0.00 0.00 179.24 177.42 2yz0 h GLN 10 N 0.00 0.69 0.00 3.56 1.08 -1.73 -2.68 115.11 116.03 2yz0 h GLN 10 Ca 0.17 -0.29 -0.02 0.00 -1.45 0.00 0.00 58.65 57.05 2yz0 h GLN 10 Cb 0.76 -0.03 -0.00 0.00 -0.05 0.00 0.00 27.48 28.16 2yz0 h GLN 10 CO -0.00 0.88 -0.11 1.88 -0.95 0.00 0.00 178.83 180.53 2yz0 h TYR 11 N 0.60 0.00 -0.78 2.96 0.05 -1.13 -2.41 116.97 116.27 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 0.76 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 38.46 2yz0 h TYR 11 CO 0.04 0.11 0.51 1.88 -1.05 0.00 0.00 178.16 179.65 2yz0 h TYR 12 N 0.00 0.95 -0.46 4.88 0.05 -1.43 -1.04 116.97 119.93 2yz0 h TYR 12 Ca -0.00 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.80 2yz0 h TYR 12 Cb 0.28 -0.32 -0.02 0.00 1.01 0.00 0.00 36.73 37.68 2yz0 h TYR 12 CO 0.00 0.57 0.30 0.93 -1.05 0.00 0.00 178.16 178.91 2yz0 h GLU 13 N 1.00 0.60 -0.45 4.88 4.39 -1.55 0.77 114.58 124.24 2yz0 h GLU 13 Ca 0.30 -0.04 -0.12 0.00 0.34 0.00 0.00 59.36 59.84 2yz0 h GLU 13 Cb -0.04 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.47 2yz0 h GLU 13 CO -0.08 0.41 -0.18 0.82 -1.16 0.00 0.00 179.01 178.83 2yz0 h ILE 14 N 0.61 1.27 -0.17 3.13 5.03 -1.53 -2.30 117.51 123.56 2yz0 h ILE 14 Ca 0.17 -1.32 -0.01 0.00 -0.12 0.00 0.00 64.86 63.58 2yz0 h ILE 14 Cb -0.05 1.18 -0.01 0.00 -3.03 0.00 0.00 36.82 34.91 2yz0 h ILE 14 CO -0.03 0.45 0.07 1.56 -0.68 0.00 0.00 178.15 179.52 2yz0 h GLN 15 N 0.74 0.26 -0.71 2.37 7.50 -0.93 -2.67 115.11 121.67 2yz0 h GLN 15 Ca 0.10 -0.05 0.03 0.00 0.50 0.00 0.00 58.65 59.24 2yz0 h GLN 15 Cb 0.74 -0.04 -0.04 0.00 0.05 0.00 0.00 27.48 28.19 2yz0 h GLN 15 CO 0.06 0.33 0.45 0.00 -1.50 0.00 0.00 178.83 178.17 2yz0 h ASN 17 N 0.88 0.39 -0.41 0.00 -1.24 -1.24 -1.13 115.58 112.83 2yz0 h ASN 17 Ca 0.28 0.00 -0.09 0.00 0.71 0.00 0.00 56.30 57.20 2yz0 h ASN 17 Cb 0.00 -0.08 -0.02 0.00 0.73 0.00 0.00 38.32 38.95 2yz0 h ASN 17 CO -0.10 0.25 -0.06 -0.33 -1.29 0.00 0.00 177.43 175.90 2yz0 h GLU 18 N 0.44 0.84 0.12 6.67 5.08 -0.95 0.18 114.58 126.96 2yz0 h GLU 18 Ca 0.22 -0.26 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 2yz0 h GLU 18 Cb 0.31 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.48 2yz0 h GLU 18 CO -0.06 0.88 -0.06 -0.07 -1.00 0.00 0.00 179.01 178.71 2yz0 h LEU 19 N 0.77 -0.13 -0.91 1.33 4.07 -1.02 -0.36 115.31 119.06 2yz0 h LEU 19 Ca 0.14 -0.21 -0.11 0.00 0.08 0.00 0.00 57.88 57.78 2yz0 h LEU 19 Cb 0.55 0.03 -0.01 0.00 1.08 0.00 0.00 40.66 42.31 2yz0 h LEU 19 CO 0.03 0.13 -0.37 1.05 -1.08 0.00 0.00 178.44 178.21 2yz0 h GLU 20 N -0.41 0.35 -0.02 1.13 4.11 -1.42 0.22 114.58 118.54 2yz0 h GLU 20 Ca -0.02 -0.16 -0.00 0.00 0.07 0.00 0.00 59.36 59.25 2yz0 h GLU 20 Cb 0.33 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.57 2yz0 h GLU 20 CO 0.03 0.67 0.00 0.00 0.07 0.00 0.00 179.01 179.78 2yz0 h ALA 21 N 1.32 0.03 -0.03 1.06 0.00 -0.54 -3.01 119.26 118.09 2yz0 h ALA 21 Ca 0.03 -0.15 -0.20 0.00 0.00 0.00 0.00 54.91 54.59 2yz0 h ALA 21 Cb 0.79 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 2yz0 h ALA 21 CO 0.06 -0.31 -0.83 0.82 0.00 0.00 0.00 179.25 178.99 2yz0 h ILE 22 N -0.25 1.42 -0.93 0.00 5.03 -1.03 -3.20 117.51 118.57 2yz0 h ILE 22 Ca 0.01 -2.37 0.19 0.00 -0.12 0.00 0.00 64.86 62.56 2yz0 h ILE 22 Cb 0.30 2.31 -0.08 0.00 -3.03 0.00 0.00 36.82 36.32 2yz0 h ILE 22 CO 0.00 0.70 0.60 0.03 -0.68 0.00 0.00 178.15 178.80 2yz0 h ARG 23 N 0.20 0.54 -0.33 2.37 3.08 -0.54 0.27 114.38 119.98 2yz0 h ARG 23 Ca -0.05 -0.03 -0.04 0.00 0.07 0.00 0.00 59.98 59.93 2yz0 h ARG 23 Cb 1.44 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 31.35 2yz0 h ARG 23 CO 0.14 0.36 0.02 0.77 -1.07 0.00 0.00 179.97 180.18 2yz0 h SER 24 N 0.56 0.46 0.15 7.04 0.02 -1.51 0.39 113.55 120.65 2yz0 h SER 24 Ca 0.49 -0.08 -0.25 0.00 -0.84 0.00 0.00 61.79 61.12 2yz0 h SER 24 Cb 1.00 -0.12 0.01 0.00 0.14 0.00 0.00 62.40 63.44 2yz0 h SER 24 CO -0.23 0.51 -1.18 0.40 -1.14 0.00 0.00 176.83 175.20 2yz0 h ILE 25 N 0.48 1.26 -1.48 3.27 2.04 -0.75 -3.36 117.51 118.97 2yz0 h ILE 25 Ca 0.11 -2.50 -0.67 0.00 1.00 0.00 0.00 64.86 62.80 2yz0 h ILE 25 Cb 0.28 2.96 -0.34 0.00 -0.74 0.00 0.00 36.82 38.99 2yz0 h ILE 25 CO 0.01 0.73 0.23 -1.22 0.00 0.00 0.00 178.15 177.89 2yz0 n TYR 26 N -3.97 3.12 -0.15 1.37 4.01 0.50 -4.83 117.16 117.21 2yz0 n TYR 26 Ca -0.19 -2.67 -0.12 0.00 -0.16 0.00 0.00 57.90 54.76 2yz0 n TYR 26 Cb 0.90 -0.79 -0.07 0.00 -0.31 0.00 0.00 39.34 39.07 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 2.57 -0.33 -0.01 -0.72 2.86 -0.38 -0.44 114.93 118.48 2yz0 h MET 27 Ca 0.47 0.02 0.00 0.00 -2.06 0.00 0.00 59.70 58.13 2yz0 h MET 27 Cb 0.66 0.08 0.00 0.00 0.06 0.00 0.00 31.60 32.39 2yz0 h MET 27 CO 1.20 -0.22 -0.34 -0.25 1.06 0.00 0.00 176.91 178.35 2yz0 n ASP 28 N -5.39 1.13 -2.00 1.22 8.00 -1.26 -3.95 116.55 114.29 2yz0 n ASP 28 Ca -0.02 -0.93 -0.20 0.00 0.71 0.00 0.00 54.79 54.36 2yz0 n ASP 28 Cb 0.35 0.23 0.18 0.00 -0.02 0.00 0.00 41.12 41.86 2yz0 n ASP 28 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2yz0 n ASP 29 N -0.67 3.56 -4.41 -2.24 9.92 -0.30 -4.95 116.55 117.47 2yz0 n ASP 29 Ca 0.11 -3.66 -0.31 0.00 -0.53 0.00 0.00 54.79 50.40 2yz0 n ASP 29 Cb 0.37 -0.80 -0.14 0.00 -0.64 0.00 0.00 41.12 39.91 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 -3.31 2.46 -0.06 1.24 2.19 -0.48 -2.69 117.98 117.33 2yz0 s PHE 30 Ca 0.54 -0.32 0.04 0.00 0.33 0.00 0.00 56.93 57.53 2yz0 s PHE 30 Cb 0.46 -1.45 -0.00 0.00 -1.31 0.00 0.00 43.02 40.72 2yz0 s PHE 30 CO 0.08 0.18 -0.20 0.99 1.83 0.00 0.00 175.22 178.10 2yz0 s THR 31 N -0.84 1.69 -0.36 0.12 2.01 -0.12 -4.95 115.64 113.19 2yz0 s THR 31 Ca 0.13 -0.84 -0.18 0.00 0.31 0.00 0.00 61.69 61.12 2yz0 s THR 31 Cb -0.10 -1.46 -0.00 0.00 0.01 0.00 0.00 72.50 70.95 2yz0 s THR 31 CO 0.03 0.48 0.49 -0.62 -0.69 0.00 0.00 174.62 174.31 2yz0 s ASP 32 N 0.17 6.29 -0.00 3.53 -1.08 -1.26 -2.58 116.67 121.73 2yz0 s ASP 32 Ca -0.09 -0.14 0.07 0.00 -0.52 0.00 0.00 52.55 51.87 2yz0 s ASP 32 Cb -0.14 -2.26 -0.09 0.00 -1.46 0.00 0.00 42.92 38.97 2yz0 s ASP 32 CO 0.05 -0.49 0.23 0.00 0.52 0.00 0.00 175.17 175.48 2yz0 n LEU 33 N 5.71 0.18 0.00 -1.34 -0.00 -1.26 -4.99 117.00 115.30 2yz0 n LEU 33 Ca -0.05 -0.28 -0.13 0.00 -0.00 0.00 0.00 56.01 55.55 2yz0 n LEU 33 Cb 0.49 0.00 0.13 0.00 -0.00 0.00 0.00 43.42 44.03 2yz0 n LEU 33 CO 0.45 0.04 0.15 0.41 -0.00 0.00 0.00 177.39 178.44 2yz0 n THR 34 N -1.42 0.00 1.76 1.47 -1.04 -1.26 -4.76 114.28 109.02 2yz0 n THR 34 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2yz0 n THR 34 Cb 0.14 -0.43 0.00 0.00 -1.82 0.00 0.00 70.33 68.23 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 -1.04 0.90 -0.13 -2.82 0.00 -1.26 -4.19 118.16 109.62 2yz0 n LYS 35 Ca 0.06 0.00 -0.13 0.00 -0.00 0.00 0.00 58.31 58.24 2yz0 n LYS 35 Cb 0.26 -1.03 -0.08 0.00 -0.00 0.00 0.00 35.03 34.18 2yz0 n LYS 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2yz0 h ARG 36 N 0.01 -0.37 -7.13 -1.58 3.08 -1.95 -3.41 114.38 103.02 2yz0 h ARG 36 Ca 0.00 0.03 -0.48 0.00 0.07 0.00 0.00 59.98 59.60 2yz0 h ARG 36 Cb 0.03 0.08 0.04 0.00 0.08 0.00 0.00 29.97 30.20 2yz0 h ARG 36 CO 0.00 -0.25 0.38 0.15 -1.07 0.00 0.00 179.97 179.18 2yz0 s LYS 37 N -5.72 3.65 0.40 0.04 1.02 -1.26 -4.87 119.74 113.01 2yz0 s LYS 37 Ca -0.15 1.25 0.00 0.00 0.02 0.00 0.00 55.97 57.10 2yz0 s LYS 37 Cb 0.09 -2.08 0.00 0.00 -0.52 0.00 0.00 37.83 35.33 2yz0 s LYS 37 CO 0.63 -0.54 0.00 0.45 -0.92 0.00 0.00 175.35 174.97 2yz0 n SER 38 N -1.41 -8.33 -3.93 2.83 2.88 -1.26 -4.96 113.62 99.44 2yz0 n SER 38 Ca 0.09 0.79 -0.12 0.00 -1.33 0.00 0.00 58.87 58.30 2yz0 n SER 38 Cb 0.53 -4.43 -0.13 0.00 -0.75 0.00 0.00 64.21 59.43 2yz0 n SER 38 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2yz0 s SER 39 N -6.98 0.25 0.00 -3.46 0.01 -1.26 -4.97 113.70 97.29 2yz0 s SER 39 Ca 0.00 -0.21 0.00 0.00 1.31 0.00 0.00 55.95 57.05 2yz0 s SER 39 Cb 0.00 0.02 0.00 0.00 0.21 0.00 0.00 66.02 66.25 2yz0 s SER 39 CO 0.00 -0.09 0.00 1.87 0.41 0.00 0.00 173.24 175.43 2yz0 n TRP 40 N 2.49 0.00 -3.96 2.43 -0.00 -1.26 -5.14 117.44 112.00 2yz0 n TRP 40 Ca -0.17 0.00 -0.12 0.00 -0.00 0.00 0.00 57.50 57.21 2yz0 n TRP 40 Cb 0.58 0.00 -0.13 0.00 -0.00 0.00 0.00 31.31 31.76 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 0.00 0.23 -0.64 5.87 2.15 -1.26 -5.09 116.67 117.93 2yz0 s ASP 41 Ca 0.00 -0.18 0.06 0.00 0.43 0.00 0.00 52.55 52.86 2yz0 s ASP 41 Cb 0.00 0.01 0.23 0.00 -0.30 0.00 0.00 42.92 42.87 2yz0 s ASP 41 CO 0.00 -0.07 0.68 0.29 -0.17 0.00 0.00 175.17 175.90 2yz0 n LYS 42 N 2.59 2.29 -2.91 4.34 5.02 -1.26 -4.89 118.16 123.33 2yz0 n LYS 42 Ca -0.16 -4.56 -0.13 0.00 -2.02 0.00 0.00 58.31 51.44 2yz0 n LYS 42 Cb 0.58 -2.21 0.02 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 1.12 0.84 -2.11 1.97 6.02 -1.26 -5.14 117.38 118.82 2yz0 n GLN 43 Ca 0.28 -2.36 -0.34 0.00 -0.01 0.00 0.00 57.00 54.56 2yz0 n GLN 43 Cb 0.40 -1.34 0.02 0.00 1.02 0.00 0.00 30.24 30.34 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 -0.28 3.19 0.00 -1.09 0.04 -1.26 -4.97 135.00 130.64 2yz0 s PRO 44 Ca 0.32 1.54 0.09 0.00 0.04 0.00 0.00 61.00 62.99 2yz0 s PRO 44 Cb 0.25 -1.99 0.01 0.00 0.04 0.00 0.00 34.50 32.81 2yz0 s PRO 44 CO -0.15 -0.97 0.63 0.94 0.04 0.00 0.00 177.00 177.50 2yz0 n GLN 45 N -1.63 1.75 -0.77 4.56 7.27 -1.26 -4.97 117.38 122.33 2yz0 n GLN 45 Ca 0.11 -0.67 0.00 0.00 0.07 0.00 0.00 57.00 56.51 2yz0 n GLN 45 Cb 0.51 -1.07 0.00 0.00 2.41 0.00 0.00 30.24 32.09 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 -0.10 0.00 -1.95 1.69 0.13 -1.26 -4.61 119.36 113.26 2yz0 n ILE 46 Ca 0.04 0.00 -0.40 0.00 -1.10 0.00 0.00 62.75 61.29 2yz0 n ILE 46 Cb 0.19 0.00 -0.00 0.00 -0.84 0.00 0.00 39.64 38.99 2yz0 n ILE 46 CO 0.00 0.00 0.00 0.27 2.80 0.00 0.00 176.55 179.62 2yz0 s ILE 47 N -2.67 2.38 -0.00 9.51 -0.00 -1.26 -4.82 121.20 124.34 2yz0 s ILE 47 Ca 0.00 0.35 -0.11 0.00 -0.00 0.00 0.00 60.65 60.89 2yz0 s ILE 47 Cb 0.00 -3.22 0.01 0.00 -0.00 0.00 0.00 42.46 39.26 2yz0 s ILE 47 CO 0.00 0.07 0.23 0.72 -0.00 0.00 0.00 174.94 175.96 2yz0 s PHE 48 N -1.19 -0.07 0.21 1.37 -0.71 -1.15 -4.26 117.98 112.18 2yz0 s PHE 48 Ca 0.55 0.05 0.07 0.00 -1.04 0.00 0.00 56.93 56.57 2yz0 s PHE 48 Cb -0.42 0.03 -0.04 0.00 -1.21 0.00 0.00 43.02 41.38 2yz0 s PHE 48 CO 0.55 -0.36 0.09 -1.21 -1.34 0.00 0.00 175.22 172.95 2yz0 s GLU 49 N -1.49 2.66 0.00 1.99 2.02 -1.06 -2.71 118.70 120.11 2yz0 s GLU 49 Ca -0.13 -1.08 0.02 0.00 0.02 0.00 0.00 54.97 53.79 2yz0 s GLU 49 Cb -0.06 -2.46 -0.01 0.00 0.10 0.00 0.00 34.13 31.71 2yz0 s GLU 49 CO 0.02 0.43 -0.05 0.42 0.02 0.00 0.00 175.26 176.10 2yz0 s ILE 50 N -1.95 0.42 -0.15 -1.63 -1.09 -0.03 -0.94 121.20 115.83 2yz0 s ILE 50 Ca 0.31 -0.37 -0.21 0.00 -2.23 0.00 0.00 60.65 58.15 2yz0 s ILE 50 Cb -0.09 -0.38 -0.03 0.00 -1.58 0.00 0.00 42.46 40.38 2yz0 s ILE 50 CO 0.22 0.02 0.60 -0.89 -1.23 0.00 0.00 174.94 173.66 2yz0 s THR 51 N -0.35 5.07 0.19 2.92 2.01 -1.10 -0.97 115.64 123.41 2yz0 s THR 51 Ca -0.00 1.17 0.05 0.00 0.31 0.00 0.00 61.69 63.22 2yz0 s THR 51 Cb -0.03 -3.93 -0.05 0.00 0.01 0.00 0.00 72.50 68.50 2yz0 s THR 51 CO -0.00 0.19 -0.07 -0.76 -0.69 0.00 0.00 174.62 173.29 2yz0 s LEU 52 N 1.37 2.43 -0.08 4.42 1.43 -0.68 -4.96 118.68 122.61 2yz0 s LEU 52 Ca 0.30 -1.09 -0.32 0.00 -1.03 0.00 0.00 54.13 51.99 2yz0 s LEU 52 Cb -0.16 -0.39 0.13 0.00 0.03 0.00 0.00 46.19 45.80 2yz0 s LEU 52 CO 0.12 -0.36 1.40 0.00 0.23 0.00 0.00 176.35 177.73 2yz0 s ARG 53 N -3.77 0.07 1.03 1.70 3.03 -1.26 -1.53 118.95 118.22 2yz0 s ARG 53 Ca 0.22 -0.04 -0.12 0.00 2.03 0.00 0.00 55.73 57.82 2yz0 s ARG 53 Cb 0.03 0.02 0.21 0.00 -1.03 0.00 0.00 34.95 34.18 2yz0 s ARG 53 CO 0.05 -0.03 1.07 -1.12 -1.13 0.00 0.00 175.30 174.14 2yz0 s SER 54 N -3.37 2.20 0.21 -2.89 0.01 -0.19 -4.89 113.70 104.77 2yz0 s SER 54 Ca 0.22 1.57 0.11 0.00 1.31 0.00 0.00 55.95 59.15 2yz0 s SER 54 Cb 0.05 -2.24 0.05 0.00 0.21 0.00 0.00 66.02 64.08 2yz0 s SER 54 CO -0.05 -3.45 1.42 -0.37 0.41 0.00 0.00 173.24 171.21 2yz0 h VAL 55 N -2.11 1.40 -3.82 3.43 -1.51 -1.90 -3.47 116.25 108.28 2yz0 h VAL 55 Ca -0.54 -2.73 0.00 0.00 -1.23 0.00 0.00 66.70 62.20 2yz0 h VAL 55 Cb 1.31 2.53 0.00 0.00 -2.13 0.00 0.00 31.29 33.00 2yz0 h VAL 55 CO 0.51 0.74 0.00 -0.67 -1.23 0.00 0.00 177.57 176.92 2yz0 n ASP 56 N -3.43 1.88 -0.00 4.19 2.03 -1.26 -5.07 116.55 114.89 2yz0 n ASP 56 Ca 0.00 -0.82 0.01 0.00 0.52 0.00 0.00 54.79 54.51 2yz0 n ASP 56 Cb 0.79 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 41.18 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 -0.05 2.06 -4.93 -0.67 4.76 -1.24 -4.30 118.16 113.79 2yz0 n LYS 57 Ca 0.00 -0.01 -0.31 0.00 -2.87 0.00 0.00 58.31 55.12 2yz0 n LYS 57 Cb 0.00 -0.91 -0.14 0.00 -1.84 0.00 0.00 35.03 32.14 2yz0 n LYS 57 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 2yz0 s GLU 58 N -1.84 2.03 0.05 1.97 2.02 -1.26 -1.58 118.70 120.09 2yz0 s GLU 58 Ca -0.00 -0.99 0.16 0.00 0.02 0.00 0.00 54.97 54.16 2yz0 s GLU 58 Cb 0.01 -2.10 0.68 0.00 0.10 0.00 0.00 34.13 32.83 2yz0 s GLU 58 CO 0.09 0.54 1.51 -0.35 0.02 0.00 0.00 175.26 177.07 2yz0 n PRO 59 N 1.93 0.04 -4.04 0.39 -0.04 -1.26 -4.95 135.00 127.07 2yz0 n PRO 59 Ca -0.17 0.29 -0.11 0.00 -0.04 0.00 0.00 63.50 63.47 2yz0 n PRO 59 Cb 0.52 -1.57 -0.06 0.00 -0.04 0.00 0.00 33.50 32.35 2yz0 n PRO 59 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2yz0 s VAL 60 N -3.06 0.00 -0.19 0.52 -7.23 -0.61 -5.06 120.40 104.77 2yz0 s VAL 60 Ca 0.06 -1.53 0.12 0.00 -1.81 0.00 0.00 61.98 58.82 2yz0 s VAL 60 Cb 0.09 -2.36 -0.16 0.00 0.56 0.00 0.00 36.38 34.51 2yz0 s VAL 60 CO 0.29 0.00 0.33 -1.84 -0.31 0.00 0.00 175.10 173.57 2yz0 n GLU 61 N -0.41 1.32 -2.47 4.82 0.28 -1.16 -3.67 120.64 119.35 2yz0 n GLU 61 Ca -0.01 -0.07 -0.04 0.00 -0.16 0.00 0.00 57.16 56.88 2yz0 n GLU 61 Cb 0.62 -1.20 0.00 0.00 1.43 0.00 0.00 31.44 32.30 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 -1.69 -4.54 -4.49 -1.84 2.88 -1.26 -1.03 113.62 101.64 2yz0 n SER 62 Ca -0.01 0.22 -0.36 0.00 -1.33 0.00 0.00 58.87 57.40 2yz0 n SER 62 Cb 0.26 -1.12 -0.12 0.00 -0.75 0.00 0.00 64.21 62.49 2yz0 n SER 62 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2yz0 s SER 63 N -0.76 5.21 -0.02 -3.46 0.15 -1.26 -2.11 113.70 111.45 2yz0 s SER 63 Ca 0.04 -0.13 -0.01 0.00 0.70 0.00 0.00 55.95 56.55 2yz0 s SER 63 Cb -0.00 -1.92 0.01 0.00 -1.71 0.00 0.00 66.02 62.40 2yz0 s SER 63 CO 0.09 0.04 0.04 -0.63 1.20 0.00 0.00 173.24 173.98 2yz0 s ILE 64 N 1.18 -0.01 -0.35 6.45 1.01 -0.59 -2.82 121.20 126.08 2yz0 s ILE 64 Ca 0.04 0.04 -0.15 0.00 0.00 0.00 0.00 60.65 60.59 2yz0 s ILE 64 Cb -0.14 -0.07 -0.01 0.00 0.01 0.00 0.00 42.46 42.24 2yz0 s ILE 64 CO 0.03 0.02 0.35 -0.89 0.00 0.00 0.00 174.94 174.44 2yz0 s THR 65 N 0.25 5.18 -0.41 2.92 2.01 -1.20 -1.68 115.64 122.72 2yz0 s THR 65 Ca -0.02 -0.05 -0.21 0.00 0.31 0.00 0.00 61.69 61.73 2yz0 s THR 65 Cb -0.03 -3.82 0.02 0.00 0.01 0.00 0.00 72.50 68.67 2yz0 s THR 65 CO -0.01 -0.11 0.64 -0.76 -0.69 0.00 0.00 174.62 173.69 2yz0 s LEU 66 N 1.97 4.40 -0.33 4.42 1.43 -0.14 -2.73 118.68 127.70 2yz0 s LEU 66 Ca 0.11 -0.15 -0.08 0.00 -1.03 0.00 0.00 54.13 52.98 2yz0 s LEU 66 Cb -0.17 -2.75 0.02 0.00 0.03 0.00 0.00 46.19 43.33 2yz0 s LEU 66 CO 0.12 -0.71 0.12 -2.28 0.23 0.00 0.00 176.35 173.83 2yz0 s HIS 67 N 2.78 3.21 -0.09 0.29 5.65 -1.22 -0.85 115.29 125.06 2yz0 s HIS 67 Ca 0.23 -1.10 -0.04 0.00 0.25 0.00 0.00 55.06 54.40 2yz0 s HIS 67 Cb -0.14 -2.30 -0.04 0.00 -1.18 0.00 0.00 32.58 28.92 2yz0 s HIS 67 CO 0.17 -0.64 0.08 -0.06 -0.65 0.00 0.00 174.74 173.65 2yz0 s PHE 68 N 1.48 3.39 -0.10 3.88 0.08 -1.10 -3.28 117.98 122.34 2yz0 s PHE 68 Ca 0.01 0.35 0.03 0.00 0.12 0.00 0.00 56.93 57.44 2yz0 s PHE 68 Cb -0.18 -1.85 0.01 0.00 -0.57 0.00 0.00 43.02 40.42 2yz0 s PHE 68 CO 0.04 0.61 -0.20 0.00 -0.10 0.00 0.00 175.22 175.56 2yz0 s ALA 69 N -1.01 1.94 -0.43 5.36 0.00 -0.24 -2.94 121.76 124.44 2yz0 s ALA 69 Ca 0.16 -0.84 -0.19 0.00 0.00 0.00 0.00 51.96 51.09 2yz0 s ALA 69 Cb -0.12 -0.79 0.02 0.00 0.00 0.00 0.00 23.12 22.24 2yz0 s ALA 69 CO 0.05 0.16 0.53 -1.64 0.00 0.00 0.00 175.76 174.86 2yz0 s MET 70 N 0.55 3.18 0.83 0.00 1.00 -1.26 -2.91 119.30 120.69 2yz0 s MET 70 Ca -0.15 -0.59 -0.12 0.00 0.00 0.00 0.00 55.69 54.84 2yz0 s MET 70 Cb -0.17 -3.96 0.10 0.00 0.00 0.00 0.00 34.83 30.80 2yz0 s MET 70 CO 0.05 -0.92 1.16 0.95 0.00 0.00 0.00 175.02 176.26 2yz0 s THR 71 N 2.43 2.31 -2.00 2.05 -4.23 -1.26 -4.84 115.64 110.11 2yz0 s THR 71 Ca 0.17 0.12 0.12 0.00 -1.18 0.00 0.00 61.69 60.91 2yz0 s THR 71 Cb -0.16 -2.39 0.33 0.00 1.34 0.00 0.00 72.50 71.62 2yz0 s THR 71 CO 0.16 -0.12 1.13 -0.81 -0.54 0.00 0.00 174.62 174.44 2yz0 n PRO 72 N -3.62 0.49 0.00 3.99 -0.04 -1.26 -2.40 135.00 132.16 2yz0 n PRO 72 Ca 0.12 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.58 2yz0 n PRO 72 Cb 0.52 -1.37 0.00 0.00 -0.04 0.00 0.00 33.50 32.60 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 -0.87 2.15 -1.45 0.54 2.81 -1.26 -4.81 117.12 114.23 2yz0 n MET 73 Ca 0.09 0.00 -0.39 0.00 -1.81 0.00 0.00 57.70 55.59 2yz0 n MET 73 Cb 0.04 -1.00 0.03 0.00 -0.71 0.00 0.00 33.22 31.58 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 -1.77 -0.72 0.40 2.03 4.19 -1.01 -0.72 117.16 119.56 2yz0 n TYR 74 Ca 0.00 0.49 0.12 0.00 3.31 0.00 0.00 57.90 61.81 2yz0 n TYR 74 Cb 0.27 -1.96 0.48 0.00 0.49 0.00 0.00 39.34 38.63 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 0.23 0.18 -0.23 2.98 -0.04 -1.26 -4.79 135.00 132.08 2yz0 n PRO 75 Ca 0.11 0.42 0.12 0.00 -0.04 0.00 0.00 63.50 64.11 2yz0 n PRO 75 Cb 0.45 -1.85 0.24 0.00 -0.04 0.00 0.00 33.50 32.30 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 -2.20 0.50 -3.97 0.54 9.36 0.10 -4.39 117.16 117.10 2yz0 n TYR 76 Ca 0.02 0.80 -0.27 0.00 3.32 0.00 0.00 57.90 61.78 2yz0 n TYR 76 Cb 0.22 -1.05 -0.01 0.00 -0.63 0.00 0.00 39.34 37.87 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 -5.44 1.65 -0.11 2.97 -4.23 -1.23 -5.09 115.64 104.15 2yz0 s THR 77 Ca -0.08 -1.54 -0.14 0.00 -1.18 0.00 0.00 61.69 58.74 2yz0 s THR 77 Cb 0.20 -2.19 -0.05 0.00 1.34 0.00 0.00 72.50 71.81 2yz0 s THR 77 CO 0.52 0.00 0.35 0.00 -0.54 0.00 0.00 174.62 174.95 2yz0 s ALA 78 N -2.77 3.61 1.00 3.99 0.00 -1.26 -4.39 121.76 121.94 2yz0 s ALA 78 Ca 0.32 -0.35 0.00 0.00 0.00 0.00 0.00 51.96 51.93 2yz0 s ALA 78 Cb -0.02 -2.41 0.00 0.00 0.00 0.00 0.00 23.12 20.69 2yz0 s ALA 78 CO 0.20 0.21 0.00 -0.35 0.00 0.00 0.00 175.76 175.81 2yz0 n PRO 79 N 3.05 0.24 -3.75 0.00 -0.04 -1.26 -4.82 135.00 128.42 2yz0 n PRO 79 Ca -0.12 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.22 2yz0 n PRO 79 Cb 0.52 0.00 -0.11 0.00 -0.04 0.00 0.00 33.50 33.87 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 -1.12 0.33 0.01 0.54 2.12 -1.15 -4.99 118.70 114.44 2yz0 s GLU 80 Ca 0.00 0.50 -0.05 0.00 0.36 0.00 0.00 54.97 55.77 2yz0 s GLU 80 Cb 0.00 0.09 -0.01 0.00 0.26 0.00 0.00 34.13 34.47 2yz0 s GLU 80 CO 0.00 -0.08 0.09 0.42 -0.54 0.00 0.00 175.26 175.15 2yz0 s ILE 81 N 0.55 0.10 -0.02 -3.70 1.01 -1.26 -1.07 121.20 116.80 2yz0 s ILE 81 Ca -0.03 -0.79 -0.12 0.00 0.00 0.00 0.00 60.65 59.71 2yz0 s ILE 81 Cb -0.05 -0.45 0.02 0.00 0.01 0.00 0.00 42.46 41.99 2yz0 s ILE 81 CO -0.03 -0.43 0.25 -1.83 0.00 0.00 0.00 174.94 172.89 2yz0 s GLU 82 N -1.55 0.55 0.11 2.79 -1.05 -1.20 -5.01 118.70 113.34 2yz0 s GLU 82 Ca -0.14 -0.16 -0.20 0.00 -0.15 0.00 0.00 54.97 54.32 2yz0 s GLU 82 Cb -0.07 0.24 -0.07 0.00 -0.44 0.00 0.00 34.13 33.79 2yz0 s GLU 82 CO 0.00 -0.14 0.61 -0.06 0.95 0.00 0.00 175.26 176.63 2yz0 s PHE 83 N -1.09 3.79 0.41 4.83 0.08 -1.26 -3.41 117.98 121.32 2yz0 s PHE 83 Ca -0.12 1.32 0.04 0.00 0.12 0.00 0.00 56.93 58.29 2yz0 s PHE 83 Cb -0.05 -2.54 -0.04 0.00 -0.57 0.00 0.00 43.02 39.82 2yz0 s PHE 83 CO 0.03 0.54 0.06 0.15 -0.10 0.00 0.00 175.22 175.90 2yz0 s LYS 84 N -1.27 1.91 0.00 0.44 -0.14 -1.10 -4.90 119.74 114.68 2yz0 s LYS 84 Ca 0.32 -2.14 0.00 0.00 -1.36 0.00 0.00 55.97 52.79 2yz0 s LYS 84 Cb -0.19 -1.05 0.00 0.00 -1.68 0.00 0.00 37.83 34.91 2yz0 s LYS 84 CO 0.20 -0.30 0.00 0.09 -0.76 0.00 0.00 175.35 174.58 2yz0 n ASN 85 N -1.07 0.00 -3.15 2.83 5.03 -1.26 -3.22 115.26 114.42 2yz0 n ASN 85 Ca -0.08 0.00 -0.00 0.00 0.87 0.00 0.00 54.58 55.37 2yz0 n ASN 85 Cb 0.66 0.00 -0.00 0.00 -1.02 0.00 0.00 39.78 39.42 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 -2.68 -0.02 2.41 0.24 -1.13 -4.98 118.33 112.18 2yz0 n VAL 86 Ca 0.00 0.58 -0.02 0.00 -2.04 0.00 0.00 64.34 62.86 2yz0 n VAL 86 Cb 0.00 -3.26 -0.01 0.00 -1.47 0.00 0.00 33.84 29.11 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 1.31 0.10 -1.64 7.34 10.64 -1.24 -4.69 117.38 129.20 2yz0 n GLN 87 Ca -0.00 0.04 -0.32 0.00 -1.83 0.00 0.00 57.00 54.88 2yz0 n GLN 87 Cb 0.44 -0.62 -0.04 0.00 -0.86 0.00 0.00 30.24 29.16 2yz0 n GLN 87 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 2yz0 n ASN 88 N -2.90 7.29 -3.67 2.61 4.13 -1.26 -4.84 115.26 116.61 2yz0 n ASN 88 Ca -0.03 -3.04 -0.13 0.00 1.68 0.00 0.00 54.58 53.07 2yz0 n ASN 88 Cb 0.10 -1.34 -0.08 0.00 -1.54 0.00 0.00 39.78 36.91 2yz0 n ASN 88 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 2yz0 s VAL 89 N -0.96 -0.00 0.00 2.41 0.11 -1.26 -4.51 120.40 116.18 2yz0 s VAL 89 Ca 0.59 0.01 0.00 0.00 -2.93 0.00 0.00 61.98 59.64 2yz0 s VAL 89 Cb 0.27 -0.81 0.00 0.00 -1.53 0.00 0.00 36.38 34.30 2yz0 s VAL 89 CO -0.13 0.00 0.00 0.23 -3.33 0.00 0.00 175.10 171.88 2yz0 n MET 90 N 3.00 0.00 0.00 1.54 2.81 -1.26 -5.02 117.12 118.18 2yz0 n MET 90 Ca -0.15 0.35 0.00 0.00 -1.81 0.00 0.00 57.70 56.10 2yz0 n MET 90 Cb 0.56 -0.84 0.00 0.00 -0.71 0.00 0.00 33.22 32.23 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 -1.93 0.00 -0.25 7.83 5.68 -1.26 -4.98 116.55 121.64 2yz0 n ASP 91 Ca 0.00 0.00 0.02 0.00 -0.50 0.00 0.00 54.79 54.31 2yz0 n ASP 91 Cb 0.00 0.00 0.15 0.00 -1.14 0.00 0.00 41.12 40.13 2yz0 n ASP 91 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 2yz0 h SER 92 N 0.00 0.41 -0.21 -1.12 0.02 -2.00 -0.42 113.55 110.23 2yz0 h SER 92 Ca 0.00 0.07 -0.17 0.00 -0.84 0.00 0.00 61.79 60.86 2yz0 h SER 92 Cb 0.00 0.01 -0.00 0.00 0.14 0.00 0.00 62.40 62.54 2yz0 h SER 92 CO 0.00 0.22 -0.48 1.56 -1.14 0.00 0.00 176.83 176.99 2yz0 h GLN 93 N 0.56 0.79 -0.13 3.45 7.50 -1.99 -2.65 115.11 122.63 2yz0 h GLN 93 Ca 0.37 -0.46 0.01 0.00 0.50 0.00 0.00 58.65 59.07 2yz0 h GLN 93 Cb 0.43 0.04 -0.01 0.00 0.05 0.00 0.00 27.48 27.99 2yz0 h GLN 93 CO -0.30 1.09 0.04 -0.07 -1.50 0.00 0.00 178.83 178.08 2yz0 h LEU 94 N 0.62 0.05 -1.30 1.46 4.07 -1.65 -2.21 115.31 116.34 2yz0 h LEU 94 Ca 0.03 0.01 -0.03 0.00 0.08 0.00 0.00 57.88 57.97 2yz0 h LEU 94 Cb 1.05 0.01 -0.02 0.00 1.08 0.00 0.00 40.66 42.78 2yz0 h LEU 94 CO 0.10 0.05 0.09 1.56 -1.08 0.00 0.00 178.44 179.16 2yz0 h GLN 95 N 0.10 0.57 -0.72 1.13 4.20 -1.13 -2.33 115.11 116.93 2yz0 h GLN 95 Ca 0.05 -0.09 -0.01 0.00 0.06 0.00 0.00 58.65 58.66 2yz0 h GLN 95 Cb 0.03 -0.10 -0.04 0.00 0.30 0.00 0.00 27.48 27.68 2yz0 h GLN 95 CO -0.06 0.53 0.41 1.98 -0.67 0.00 0.00 178.83 181.02 2yz0 h MET 96 N 0.56 0.99 -0.46 1.46 4.05 -1.04 -2.51 114.93 117.98 2yz0 h MET 96 Ca 0.13 -0.10 -0.06 0.00 -0.28 0.00 0.00 59.70 59.39 2yz0 h MET 96 Cb 0.21 -0.20 -0.02 0.00 -0.80 0.00 0.00 31.60 30.79 2yz0 h MET 96 CO -0.00 0.72 0.06 -0.07 0.23 0.00 0.00 176.91 177.85 2yz0 h LEU 97 N 1.00 0.74 -1.34 3.39 3.38 -0.88 -2.77 115.31 118.83 2yz0 h LEU 97 Ca 0.26 -0.27 0.04 0.00 0.09 0.00 0.00 57.88 58.00 2yz0 h LEU 97 Cb 0.00 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.51 2yz0 h LEU 97 CO -0.04 0.82 0.47 0.11 0.09 0.00 0.00 178.44 179.89 2yz0 h LYS 98 N 0.63 0.83 -0.38 1.13 1.79 -1.30 -0.79 116.57 118.48 2yz0 h LYS 98 Ca 0.14 -0.05 -0.03 0.00 -2.18 0.00 0.00 60.65 58.53 2yz0 h LYS 98 Cb 0.40 -0.19 -0.02 0.00 -1.58 0.00 0.00 32.23 30.85 2yz0 h LYS 98 CO 0.01 0.55 0.11 1.03 -1.08 0.00 0.00 179.45 180.07 2yz0 h SER 99 N 0.85 0.56 0.70 0.86 0.87 -1.21 -2.58 113.55 113.61 2yz0 h SER 99 Ca 0.29 -0.21 -0.05 0.00 -1.23 0.00 0.00 61.79 60.58 2yz0 h SER 99 Cb 0.08 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 61.89 2yz0 h SER 99 CO -0.08 0.62 -0.26 -0.33 -0.53 0.00 0.00 176.83 176.25 2yz0 h GLU 100 N 0.46 0.00 -0.50 2.24 3.07 -1.16 -2.88 114.58 115.81 2yz0 h GLU 100 Ca 0.12 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.98 2yz0 h GLU 100 Cb 0.27 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.16 2yz0 h GLU 100 CO -0.00 0.26 0.33 0.74 -1.40 0.00 0.00 179.01 178.94 2yz0 h PHE 101 N 0.00 0.63 -0.29 4.33 -1.00 -0.74 0.36 116.94 120.23 2yz0 h PHE 101 Ca -0.00 0.01 -0.17 0.00 2.81 0.00 0.00 57.97 60.62 2yz0 h PHE 101 Cb 0.68 -0.21 -0.00 0.00 3.61 0.00 0.00 35.95 40.02 2yz0 h PHE 101 CO 0.00 0.40 -0.50 -0.22 -1.61 0.00 0.00 178.31 176.38 2yz0 h LYS 102 N 0.68 0.80 -0.25 1.51 1.63 -1.48 -2.06 116.57 117.40 2yz0 h LYS 102 Ca 0.18 -0.48 -0.12 0.00 -0.85 0.00 0.00 60.65 59.38 2yz0 h LYS 102 Cb -0.07 0.04 -0.00 0.00 -0.60 0.00 0.00 32.23 31.60 2yz0 h LYS 102 CO -0.04 1.11 -0.32 0.87 -3.45 0.00 0.00 179.45 177.62 2yz0 h LYS 103 N 0.63 0.66 -0.23 1.90 1.57 -1.44 -1.84 116.57 117.82 2yz0 h LYS 103 Ca 0.03 -0.37 -0.01 0.00 -1.87 0.00 0.00 60.65 58.42 2yz0 h LYS 103 Cb 1.08 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.41 2yz0 h LYS 103 CO 0.11 0.99 0.11 0.82 -0.57 0.00 0.00 179.45 180.91 2yz0 h ILE 104 N 0.37 1.13 -0.62 1.86 2.04 -0.96 -1.62 117.51 119.71 2yz0 h ILE 104 Ca 0.03 -0.38 -0.03 0.00 1.00 0.00 0.00 64.86 65.49 2yz0 h ILE 104 Cb 0.90 0.97 -0.03 0.00 -0.74 0.00 0.00 36.82 37.92 2yz0 h ILE 104 CO 0.08 0.13 0.28 -0.74 0.00 0.00 0.00 178.15 177.90 2yz0 h HIS 105 N 0.24 0.91 -0.67 1.37 2.76 -1.40 0.27 115.15 118.63 2yz0 h HIS 105 Ca 0.08 -0.05 0.02 0.00 -2.20 0.00 0.00 60.37 58.21 2yz0 h HIS 105 Cb 0.11 -0.28 -0.04 0.00 1.55 0.00 0.00 27.41 28.75 2yz0 h HIS 105 CO -0.03 0.70 0.43 -0.91 -1.30 0.00 0.00 177.93 176.82 2yz0 h ASN 106 N 0.86 0.73 1.04 3.26 2.35 -1.14 0.98 115.58 123.65 2yz0 h ASN 106 Ca 0.21 -0.01 -0.14 0.00 -0.55 0.00 0.00 56.30 55.82 2yz0 h ASN 106 Cb 0.15 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.33 2yz0 h ASN 106 CO -0.02 0.52 -0.64 0.00 -1.65 0.00 0.00 177.43 175.63 2yz0 h THR 107 N 0.86 1.23 -0.60 2.81 1.03 -1.03 -3.25 112.91 113.96 2yz0 h THR 107 Ca 0.25 -2.41 -0.41 0.00 -0.01 0.00 0.00 66.41 63.84 2yz0 h THR 107 Cb -0.05 2.39 -0.28 0.00 -1.07 0.00 0.00 68.15 69.14 2yz0 h THR 107 CO -0.08 0.63 -0.31 -1.20 -0.01 0.00 0.00 175.52 174.55 2yz0 n SER 108 N -3.43 4.36 -4.18 0.00 7.64 0.91 -4.92 113.62 113.99 2yz0 n SER 108 Ca 0.00 -3.79 -0.41 0.00 1.01 0.00 0.00 58.87 55.68 2yz0 n SER 108 Cb 0.72 -0.54 -0.01 0.00 -1.01 0.00 0.00 64.21 63.37 2yz0 n SER 108 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 2yz0 n ARG 109 N -0.90 2.80 0.00 1.43 0.63 0.33 -3.06 116.66 117.89 2yz0 n ARG 109 Ca 0.42 -2.84 0.00 0.00 -0.92 0.00 0.00 57.85 54.51 2yz0 n ARG 109 Cb 0.91 -3.39 0.00 0.00 0.45 0.00 0.00 32.46 30.43 2yz0 n ARG 109 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2yz0 n GLY 110 N 4.87 0.33 0.00 5.14 0.00 -1.26 -5.02 105.19 109.24 2yz0 n GLY 110 Ca 0.50 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.52 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 2.32 -1.66 1.61 10.64 -1.17 -4.88 117.38 124.24 2yz0 n GLN 111 Ca 0.00 0.00 -0.45 0.00 -1.83 0.00 0.00 57.00 54.72 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 0.39 -1.83 0.00 0.00 177.06 175.62 2yz0 n GLU 112 N 0.00 1.89 0.00 2.61 1.02 -1.26 -4.88 120.64 120.01 2yz0 n GLU 112 Ca 0.00 0.67 0.00 0.00 -0.02 0.00 0.00 57.16 57.81 2yz0 n GLU 112 Cb 0.00 -2.29 0.00 0.00 -0.02 0.00 0.00 31.44 29.13 2yz0 n GLU 112 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 2yz0 n ILE 113 N 1.66 0.00 -0.21 -3.67 -5.35 -1.26 -4.70 119.36 105.82 2yz0 n ILE 113 Ca 0.11 0.00 -0.03 0.00 -0.27 0.00 0.00 62.75 62.57 2yz0 n ILE 113 Cb 0.31 -0.24 0.08 0.00 -1.74 0.00 0.00 39.64 38.05 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 0.98 -0.39 7.28 5.03 -1.97 -0.54 117.51 127.89 2yz0 h ILE 114 Ca 0.00 -0.22 -0.06 0.00 -0.12 0.00 0.00 64.86 64.46 2yz0 h ILE 114 Cb 0.39 0.27 -0.02 0.00 -3.03 0.00 0.00 36.82 34.43 2yz0 h ILE 114 CO 0.00 0.12 0.01 0.15 -0.68 0.00 0.00 178.15 177.74 2yz0 h PHE 115 N 0.65 0.65 -0.26 1.37 3.57 -1.96 -1.03 116.94 119.93 2yz0 h PHE 115 Ca 0.28 -0.07 -0.07 0.00 3.53 0.00 0.00 57.97 61.64 2yz0 h PHE 115 Cb 0.15 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 38.70 2yz0 h PHE 115 CO -0.08 0.62 -0.09 0.93 -2.23 0.00 0.00 178.31 177.45 2yz0 h GLU 116 N 0.59 0.52 -0.58 1.11 4.39 -1.58 -0.35 114.58 118.68 2yz0 h GLU 116 Ca 0.12 -0.22 -0.09 0.00 0.34 0.00 0.00 59.36 59.52 2yz0 h GLU 116 Cb 0.37 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 28.97 2yz0 h GLU 116 CO 0.01 0.76 0.03 0.97 -1.16 0.00 0.00 179.01 179.62 2yz0 h ILE 117 N 0.26 1.26 -0.32 3.13 2.10 -0.93 0.63 117.51 123.64 2yz0 h ILE 117 Ca 0.06 -1.10 -0.08 0.00 1.08 0.00 0.00 64.86 64.83 2yz0 h ILE 117 Cb 0.58 0.82 -0.01 0.00 -1.09 0.00 0.00 36.82 37.13 2yz0 h ILE 117 CO 0.03 0.40 -0.09 0.71 -1.08 0.00 0.00 178.15 178.12 2yz0 h THR 118 N 0.90 1.28 -0.45 2.19 1.35 -1.16 0.46 112.91 117.48 2yz0 h THR 118 Ca 0.17 -1.15 -0.13 0.00 -0.55 0.00 0.00 66.41 64.74 2yz0 h THR 118 Cb 0.51 1.36 -0.01 0.00 -1.73 0.00 0.00 68.15 68.28 2yz0 h THR 118 CO 0.02 0.37 -0.24 -1.28 -0.25 0.00 0.00 175.52 174.15 2yz0 h SER 119 N 0.41 0.97 -0.08 5.36 0.87 -0.98 -0.49 113.55 119.61 2yz0 h SER 119 Ca 0.08 -0.38 -0.03 0.00 -1.23 0.00 0.00 61.79 60.24 2yz0 h SER 119 Cb 0.59 -0.27 -0.00 0.00 -0.44 0.00 0.00 62.40 62.28 2yz0 h SER 119 CO 0.03 1.16 -0.06 0.15 -0.53 0.00 0.00 176.83 177.59 2yz0 h PHE 120 N 0.81 0.22 -0.77 2.24 3.04 -0.82 -1.54 116.94 120.11 2yz0 h PHE 120 Ca 0.10 -0.06 -0.05 0.00 3.98 0.00 0.00 57.97 61.94 2yz0 h PHE 120 Cb 0.81 -0.05 -0.03 0.00 2.56 0.00 0.00 35.95 39.24 2yz0 h PHE 120 CO 0.05 0.58 0.27 1.79 -2.02 0.00 0.00 178.31 178.98 2yz0 h THR 121 N -0.21 1.26 0.05 4.41 1.35 -0.91 0.24 112.91 119.11 2yz0 h THR 121 Ca 0.02 -0.88 -0.00 0.00 -0.55 0.00 0.00 66.41 64.99 2yz0 h THR 121 Cb 0.53 0.38 0.00 0.00 -1.73 0.00 0.00 68.15 67.33 2yz0 h THR 121 CO 0.02 0.35 -0.02 -0.61 -0.25 0.00 0.00 175.52 175.00 2yz0 h GLN 122 N 1.14 -0.07 -0.39 4.72 -0.00 -1.08 0.49 115.11 119.92 2yz0 h GLN 122 Ca 0.25 0.00 -0.06 0.00 -0.00 0.00 0.00 58.65 58.85 2yz0 h GLN 122 Cb 0.27 0.02 -0.01 0.00 0.00 0.00 0.00 27.48 27.75 2yz0 h GLN 122 CO -0.01 0.17 0.02 1.05 0.00 0.00 0.00 178.83 180.06 2yz0 h GLU 123 N -0.30 0.68 -0.08 1.69 4.11 -1.18 -1.00 114.58 118.50 2yz0 h GLU 123 Ca -0.01 -0.21 -0.10 0.00 0.07 0.00 0.00 59.36 59.12 2yz0 h GLU 123 Cb 0.27 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 2yz0 h GLU 123 CO 0.01 0.76 -0.41 -0.22 0.07 0.00 0.00 179.01 179.22 2yz0 h LYS 124 N 0.51 0.17 -0.18 1.06 1.63 -0.51 -0.96 116.57 118.29 2yz0 h LYS 124 Ca 0.11 -0.08 -0.12 0.00 -0.85 0.00 0.00 60.65 59.71 2yz0 h LYS 124 Cb 0.44 -0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.07 2yz0 h LYS 124 CO 0.02 0.56 -0.37 1.25 -3.45 0.00 0.00 179.45 177.45 2yz0 h LEU 125 N 0.15 0.65 -0.15 5.20 5.85 0.20 -2.39 115.31 124.81 2yz0 h LEU 125 Ca 0.01 -0.55 -0.05 0.00 0.84 0.00 0.00 57.88 58.13 2yz0 h LEU 125 Cb 0.79 -0.19 -0.00 0.00 0.37 0.00 0.00 40.66 41.63 2yz0 h LEU 125 CO 0.06 1.08 -0.10 -0.78 -0.34 0.00 0.00 178.44 178.36 2yz0 h ASP 126 N 0.24 0.35 0.02 1.25 3.58 -1.10 -1.45 116.42 119.31 2yz0 h ASP 126 Ca 0.01 -0.44 -0.00 0.00 0.42 0.00 0.00 57.03 57.02 2yz0 h ASP 126 Cb 0.97 -0.10 -0.00 0.00 1.72 0.00 0.00 39.33 41.92 2yz0 h ASP 126 CO 0.08 0.71 -0.01 1.05 -2.88 0.00 0.00 179.24 178.19 2yz0 h GLU 127 N -0.01 0.00 0.01 0.28 -0.00 -0.98 -1.56 114.58 112.32 2yz0 h GLU 127 Ca 0.03 0.00 -0.00 0.00 -0.00 0.00 0.00 59.36 59.39 2yz0 h GLU 127 Cb 0.59 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.34 2yz0 h GLU 127 CO 0.03 0.01 -0.01 0.35 -0.00 0.00 0.00 179.01 179.39 2yz0 h PHE 128 N 0.00 -0.01 -0.86 2.06 3.04 -1.26 -1.76 116.94 118.15 2yz0 h PHE 128 Ca -0.00 -0.00 0.13 0.00 3.98 0.00 0.00 57.97 62.08 2yz0 h PHE 128 Cb 0.02 0.00 -0.06 0.00 2.56 0.00 0.00 35.95 38.47 2yz0 h PHE 128 CO 0.00 0.73 0.56 0.37 -2.02 0.00 0.00 178.31 177.95 2yz0 h GLN 129 N -0.97 0.68 0.00 1.11 -0.00 -1.01 -3.28 115.11 111.64 2yz0 h GLN 129 Ca -0.00 -0.04 0.00 0.00 -0.00 0.00 0.00 58.65 58.61 2yz0 h GLN 129 Cb 0.75 -0.15 0.00 0.00 0.00 0.00 0.00 27.48 28.08 2yz0 h GLN 129 CO 0.00 0.45 0.00 0.09 0.00 0.00 0.00 178.83 179.37 2yz0 n ASN 130 N -4.54 0.00 0.00 -0.69 3.02 -0.61 -4.70 115.26 107.73 2yz0 n ASN 130 Ca 0.16 0.12 0.00 0.00 -0.03 0.00 0.00 54.58 54.83 2yz0 n ASN 130 Cb 0.43 -0.12 0.00 0.00 -0.61 0.00 0.00 39.78 39.48 2yz0 n ASN 130 CO 0.00 0.00 0.00 0.55 -2.62 0.00 0.00 177.26 175.19 2yz0 n VAL 131 N -0.86 0.00 -2.54 2.41 3.14 -0.74 -5.00 118.33 114.74 2yz0 n VAL 131 Ca 0.00 0.00 -0.01 0.00 -2.96 0.00 0.00 64.34 61.37 2yz0 n VAL 131 Cb 0.00 0.00 -0.01 0.00 -1.06 0.00 0.00 33.84 32.77 2yz0 n VAL 131 CO 0.00 0.00 0.00 0.55 -6.46 0.00 0.00 176.83 170.92 2yz0 n VAL 132 N 0.00 0.00 -3.54 1.55 3.14 -0.74 -4.82 118.33 113.91 2yz0 n VAL 132 Ca 0.00 -0.14 -0.41 0.00 -2.96 0.00 0.00 64.34 60.83 2yz0 n VAL 132 Cb 0.00 0.51 -0.08 0.00 -1.06 0.00 0.00 33.84 33.21 2yz0 n VAL 132 CO 0.00 0.00 0.00 0.20 -6.46 0.00 0.00 176.83 170.57 2yz0 s ASN 133 N -0.02 5.76 -0.65 6.55 0.01 -1.24 -5.02 114.94 120.33 2yz0 s ASN 133 Ca 0.00 -2.06 -0.16 0.00 -0.71 0.00 0.00 52.86 49.93 2yz0 s ASN 133 Cb 0.01 -2.02 0.15 0.00 0.41 0.00 0.00 41.25 39.80 2yz0 s ASN 133 CO -0.00 -0.66 0.64 0.42 -1.51 0.00 0.00 177.10 175.99 2yz0 s THR 134 N 1.14 5.24 0.23 1.60 -4.23 -1.26 -2.74 115.64 115.62 2yz0 s THR 134 Ca 0.08 -1.70 0.02 0.00 -1.18 0.00 0.00 61.69 58.91 2yz0 s THR 134 Cb -0.25 -4.42 -0.05 0.00 1.34 0.00 0.00 72.50 69.12 2yz0 s THR 134 CO -0.02 -0.99 0.06 0.00 -0.54 0.00 0.00 174.62 173.13 2yz0 s GLN 135 N 1.42 1.33 -0.21 3.99 -2.07 -1.26 -5.09 119.66 117.76 2yz0 s GLN 135 Ca 0.10 -1.70 0.02 0.00 -1.82 0.00 0.00 55.36 51.96 2yz0 s GLN 135 Cb -0.22 -0.33 0.04 0.00 -1.09 0.00 0.00 33.01 31.40 2yz0 s GLN 135 CO -0.00 -0.22 -0.14 -1.54 -1.32 0.00 0.00 175.29 172.06 2yz0 s SER 136 N -3.28 3.68 0.52 12.60 1.04 -1.26 -4.53 113.70 122.46 2yz0 s SER 136 Ca 0.33 -0.99 0.07 0.00 0.48 0.00 0.00 55.95 55.84 2yz0 s SER 136 Cb 0.07 -1.44 0.05 0.00 0.10 0.00 0.00 66.02 64.80 2yz0 s SER 136 CO 0.10 -0.11 0.71 -0.76 0.98 0.00 0.00 173.24 174.17 2yz0 s LEU 137 N 1.25 3.37 0.00 2.42 2.01 -1.26 -5.19 118.68 121.28 2yz0 s LEU 137 Ca -0.02 -0.48 0.00 0.00 0.01 0.00 0.00 54.13 53.64 2yz0 s LEU 137 Cb -0.16 -2.32 0.00 0.00 0.01 0.00 0.00 46.19 43.71 2yz0 s LEU 137 CO -0.09 -1.10 0.00 -0.62 1.01 0.00 0.00 176.35 175.55