#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x9r s LEU 5 N 0.00 2.91 0.00 1.04 1.98 -1.26 -4.99 118.68 118.36 2x9r s LEU 5 Ca 0.00 2.15 0.00 0.00 -2.89 0.00 0.00 54.13 53.39 2x9r s LEU 5 Cb 0.00 -4.56 0.00 0.00 0.66 0.00 0.00 46.19 42.29 2x9r s LEU 5 CO 0.00 -2.90 0.00 2.29 -1.89 0.00 0.00 176.35 173.85 2x9r n LYS 6 N -4.04 2.25 -3.65 1.98 0.00 -1.26 -4.95 118.16 108.49 2x9r n LYS 6 Ca 0.12 0.00 -0.29 0.00 -0.00 0.00 0.00 58.31 58.14 2x9r n LYS 6 Cb 0.52 -0.79 -0.12 0.00 -0.00 0.00 0.00 35.03 34.64 2x9r n LYS 6 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 2x9r s LYS 7 N -1.59 1.35 0.00 -1.58 3.01 -1.26 -5.07 119.74 114.61 2x9r s LYS 7 Ca 0.00 -2.22 0.00 0.00 -1.01 0.00 0.00 55.97 52.74 2x9r s LYS 7 Cb 0.00 -2.23 0.00 0.00 -1.01 0.00 0.00 37.83 34.59 2x9r s LYS 7 CO 0.00 -1.24 0.00 0.41 0.51 0.00 0.00 175.35 175.03 2x9r n GLY 8 N 3.14 0.83 0.74 -3.33 0.00 -1.26 -4.98 105.19 100.32 2x9r n GLY 8 Ca 0.16 -1.85 -0.00 0.00 0.00 0.00 0.00 46.02 44.33 2x9r n GLY 8 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2x9r n VAL 9 N 9.00 0.00 -0.69 1.61 0.31 -1.26 -5.01 118.33 122.29 2x9r n VAL 9 Ca 0.00 -0.17 0.00 0.00 -0.01 0.00 0.00 64.34 64.16 2x9r n VAL 9 Cb 0.00 0.43 0.00 0.00 -0.91 0.00 0.00 33.84 33.36 2x9r n VAL 9 CO 0.00 0.00 0.00 2.22 -1.32 0.00 0.00 176.83 177.73 2x9r n PHE 10 N 0.09 0.00 -2.66 3.52 -1.74 -1.26 -4.57 117.46 110.84 2x9r n PHE 10 Ca -0.03 0.00 -0.43 0.00 -0.56 0.00 0.00 57.45 56.43 2x9r n PHE 10 Cb 0.71 0.00 -0.02 0.00 1.52 0.00 0.00 39.48 41.69 2x9r n PHE 10 CO 0.00 0.00 0.00 0.54 -0.56 0.00 0.00 176.76 176.74 2x9r s VAL 11 N -0.20 4.39 0.33 1.97 0.11 -1.26 -4.65 120.40 121.09 2x9r s VAL 11 Ca 0.00 1.37 -0.20 0.00 -2.93 0.00 0.00 61.98 60.22 2x9r s VAL 11 Cb 0.00 -4.49 -0.14 0.00 -1.53 0.00 0.00 36.38 30.22 2x9r s VAL 11 CO 0.00 -0.74 0.16 0.47 -3.33 0.00 0.00 175.10 171.66 2x9r n ASP 12 N 7.29 -2.32 0.01 3.54 10.43 -1.26 -4.77 116.55 129.48 2x9r n ASP 12 Ca 0.11 0.79 -0.02 0.00 2.57 0.00 0.00 54.79 58.24 2x9r n ASP 12 Cb 0.48 -0.81 -0.01 0.00 1.84 0.00 0.00 41.12 42.62 2x9r n ASP 12 CO 0.00 0.00 0.00 0.44 -1.07 0.00 0.00 177.20 176.57 2x9r h ASP 13 N 0.41 -0.19 -0.57 -2.24 3.32 -2.01 -2.30 116.42 112.84 2x9r h ASP 13 Ca -0.32 0.02 0.17 0.00 0.02 0.00 0.00 57.03 56.92 2x9r h ASP 13 Cb 1.31 0.07 -0.02 0.00 0.22 0.00 0.00 39.33 40.90 2x9r h ASP 13 CO 0.44 -0.06 0.70 1.12 -1.72 0.00 0.00 179.24 179.72 2x9r h HIS 14 N -0.09 0.00 0.21 4.55 2.07 -1.99 -2.27 115.15 117.64 2x9r h HIS 14 Ca -0.00 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.51 2x9r h HIS 14 Cb 0.09 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.07 2x9r h HIS 14 CO -0.32 0.00 -0.10 1.25 -3.07 0.00 0.00 177.93 175.69 2x9r h LEU 15 N 0.00 -0.24 0.00 6.12 7.12 -1.74 -2.84 115.31 123.72 2x9r h LEU 15 Ca 0.27 0.01 0.00 0.00 0.13 0.00 0.00 57.88 58.29 2x9r h LEU 15 Cb 1.67 0.06 0.00 0.00 -0.53 0.00 0.00 40.66 41.86 2x9r h LEU 15 CO -0.00 -0.17 0.00 0.18 -0.13 0.00 0.00 178.44 178.32 2x9r n LEU 16 N -2.79 0.00 -0.14 2.25 4.32 -0.89 -2.12 117.00 117.64 2x9r n LEU 16 Ca -0.04 0.97 0.09 0.00 -0.02 0.00 0.00 56.01 57.01 2x9r n LEU 16 Cb 0.11 -0.49 0.17 0.00 -1.62 0.00 0.00 43.42 41.59 2x9r n LEU 16 CO 0.09 -0.49 0.37 1.21 -1.22 0.00 0.00 177.39 177.34 2x9r n GLU 17 N -1.97 -0.03 0.00 3.23 2.13 -1.01 0.12 120.64 123.10 2x9r n GLU 17 Ca 0.00 0.59 0.00 0.00 0.66 0.00 0.00 57.16 58.41 2x9r n GLU 17 Cb 0.00 -0.99 0.00 0.00 0.27 0.00 0.00 31.44 30.72 2x9r n GLU 17 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 2x9r n LYS 18 N -4.21 0.00 -0.27 5.31 3.00 -1.07 -3.51 118.16 117.40 2x9r n LYS 18 Ca 0.12 0.00 0.07 0.00 -0.00 0.00 0.00 58.31 58.50 2x9r n LYS 18 Cb 0.40 -0.65 0.14 0.00 0.00 0.00 0.00 35.03 34.92 2x9r n LYS 18 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 2x9r n VAL 19 N -0.43 -0.31 -0.09 3.15 0.31 0.29 -1.11 118.33 120.13 2x9r n VAL 19 Ca 0.00 1.69 -0.11 0.00 -0.01 0.00 0.00 64.34 65.91 2x9r n VAL 19 Cb 0.00 -2.38 -0.06 0.00 -0.91 0.00 0.00 33.84 30.49 2x9r n VAL 19 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2x9r h LEU 20 N 0.00 -1.48 -1.55 7.52 3.38 0.71 0.21 115.31 124.11 2x9r h LEU 20 Ca 0.39 0.21 -0.03 0.00 0.09 0.00 0.00 57.88 58.54 2x9r h LEU 20 Cb 0.67 0.63 -0.01 0.00 0.09 0.00 0.00 40.66 42.04 2x9r h LEU 20 CO -0.75 -0.40 -0.03 1.05 0.09 0.00 0.00 178.44 178.40 2x9r h GLU 21 N -0.39 0.24 0.00 1.13 4.11 -1.16 -0.57 114.58 117.94 2x9r h GLU 21 Ca 0.11 -0.04 -0.00 0.00 0.07 0.00 0.00 59.36 59.50 2x9r h GLU 21 Cb 0.60 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.81 2x9r h GLU 21 CO -0.53 0.30 -0.01 -0.07 0.07 0.00 0.00 179.01 178.78 2x9r h LEU 22 N 0.24 0.00 -0.09 3.06 -0.00 -0.12 -1.85 115.31 116.54 2x9r h LEU 22 Ca 0.06 0.00 -0.15 0.00 -0.00 0.00 0.00 57.88 57.78 2x9r h LEU 22 Cb 0.22 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 40.86 2x9r h LEU 22 CO 0.01 0.01 -0.73 0.78 -0.00 0.00 0.00 178.44 178.51 2x9r h ASN 23 N 0.00 0.00 -2.22 -0.43 2.35 0.53 0.31 115.58 116.12 2x9r h ASN 23 Ca -0.00 0.00 -0.52 0.00 -0.55 0.00 0.00 56.30 55.23 2x9r h ASN 23 Cb 0.13 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.45 2x9r h ASN 23 CO 0.00 0.73 1.25 0.00 -1.65 0.00 0.00 177.43 177.76 2x9r s ALA 24 N -2.91 2.42 0.00 -0.83 0.00 -0.70 -2.24 121.76 117.50 2x9r s ALA 24 Ca 0.02 -0.74 0.00 0.00 0.00 0.00 0.00 51.96 51.24 2x9r s ALA 24 Cb 0.09 -4.25 0.00 0.00 0.00 0.00 0.00 23.12 18.96 2x9r s ALA 24 CO 0.78 -3.56 0.00 1.63 0.00 0.00 0.00 175.76 174.61 2x9r n LYS 25 N 9.10 0.00 -2.64 0.00 5.02 -1.26 -4.58 118.16 123.80 2x9r n LYS 25 Ca 0.16 0.00 -0.01 0.00 -2.02 0.00 0.00 58.31 56.44 2x9r n LYS 25 Cb 0.51 -1.71 -0.00 0.00 -0.02 0.00 0.00 35.03 33.80 2x9r n LYS 25 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2x9r n GLY 26 N -2.00 -4.35 1.52 0.72 0.00 -0.95 -5.02 105.19 95.12 2x9r n GLY 26 Ca 0.00 0.55 -0.13 0.00 0.00 0.00 0.00 46.02 46.43 2x9r n GLY 26 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2x9r n GLU 27 N 0.75 -2.21 0.00 1.61 4.71 0.11 -5.01 120.64 120.60 2x9r n GLU 27 Ca -0.04 -0.75 0.00 0.00 -0.01 0.00 0.00 57.16 56.36 2x9r n GLU 27 Cb 0.06 -0.75 0.00 0.00 -1.01 0.00 0.00 31.44 29.74 2x9r n GLU 27 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 2x9r n LYS 28 N -3.12 0.00 0.02 3.49 4.76 -1.26 -5.03 118.16 117.02 2x9r n LYS 28 Ca 0.07 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.51 2x9r n LYS 28 Cb 0.26 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.45 2x9r n LYS 28 CO 0.00 0.00 0.00 2.89 -1.37 0.00 0.00 177.40 178.92 2x9r n ARG 29 N 0.00 0.00 -1.53 1.97 -4.01 -1.26 -4.97 116.66 106.86 2x9r n ARG 29 Ca 0.00 0.00 -0.34 0.00 -1.04 0.00 0.00 57.85 56.47 2x9r n ARG 29 Cb 0.00 0.00 -0.10 0.00 -3.04 0.00 0.00 32.46 29.32 2x9r n ARG 29 CO 0.00 0.00 0.00 -0.11 -3.04 0.00 0.00 177.63 174.48 2x9r n LEU 30 N -2.61 1.08 -3.79 2.89 0.00 -1.26 -4.43 117.00 108.87 2x9r n LEU 30 Ca 0.00 -0.38 -0.30 0.00 0.00 0.00 0.00 56.01 55.33 2x9r n LEU 30 Cb 0.00 -1.23 -0.14 0.00 0.00 0.00 0.00 43.42 42.04 2x9r n LEU 30 CO 0.00 -1.38 -0.30 -0.51 0.00 0.00 0.00 177.39 175.20 2x9r s ILE 31 N 10.02 1.36 1.28 1.96 2.07 -1.26 -5.03 121.20 131.60 2x9r s ILE 31 Ca 1.15 -1.97 -0.16 0.00 -1.41 0.00 0.00 60.65 58.27 2x9r s ILE 31 Cb -0.65 -2.00 0.33 0.00 0.13 0.00 0.00 42.46 40.28 2x9r s ILE 31 CO 0.36 -0.73 0.97 0.29 -1.91 0.00 0.00 174.94 173.93 2x9r n LYS 32 N 4.32 -3.28 -3.64 3.50 5.02 -1.26 -1.44 118.16 121.38 2x9r n LYS 32 Ca 0.02 -0.94 -0.01 0.00 -2.02 0.00 0.00 58.31 55.37 2x9r n LYS 32 Cb 0.40 -2.09 -0.01 0.00 -0.02 0.00 0.00 35.03 33.30 2x9r n LYS 32 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 2x9r s THR 33 N -2.31 0.00 0.00 -0.18 -1.32 -0.91 -4.64 115.64 106.27 2x9r s THR 33 Ca 0.69 -0.26 0.00 0.00 -1.21 0.00 0.00 61.69 60.91 2x9r s THR 33 Cb -0.22 -1.82 0.00 0.00 -1.51 0.00 0.00 72.50 68.95 2x9r s THR 33 CO 0.64 0.00 0.40 0.79 -2.21 0.00 0.00 174.62 174.23 2x9r n TRP 34 N -0.42 0.00 -2.26 9.09 8.01 -1.26 -3.74 117.44 126.86 2x9r n TRP 34 Ca -0.07 0.00 -0.37 0.00 -1.31 0.00 0.00 57.50 55.75 2x9r n TRP 34 Cb 0.62 0.05 0.02 0.00 -2.01 0.00 0.00 31.31 29.99 2x9r n TRP 34 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.69 175.55 2x9r n SER 35 N 0.00 6.84 0.33 -0.99 3.41 -1.26 -4.68 113.62 117.27 2x9r n SER 35 Ca 0.00 -3.77 0.21 0.00 -0.26 0.00 0.00 58.87 55.05 2x9r n SER 35 Cb 0.52 -0.96 1.16 0.00 -0.26 0.00 0.00 64.21 64.67 2x9r n SER 35 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 175.04 174.96 2x9r h ARG 36 N 3.23 0.00 -1.14 4.33 0.11 -1.90 -1.51 114.38 117.49 2x9r h ARG 36 Ca 0.49 0.00 -0.16 0.00 0.10 0.00 0.00 59.98 60.41 2x9r h ARG 36 Cb 0.27 0.00 -0.09 0.00 1.11 0.00 0.00 29.97 31.26 2x9r h ARG 36 CO 1.24 0.00 0.20 2.89 0.10 0.00 0.00 179.97 184.40 2x9r n ARG 37 N -3.22 1.38 0.00 0.08 -4.01 -1.26 0.05 116.66 109.67 2x9r n ARG 37 Ca -0.03 -0.87 0.00 0.00 -1.04 0.00 0.00 57.85 55.92 2x9r n ARG 37 Cb 0.08 -1.34 0.00 0.00 -3.04 0.00 0.00 32.46 28.16 2x9r n ARG 37 CO 0.00 0.00 0.00 -1.13 -3.04 0.00 0.00 177.63 173.46 2x9r n SER 38 N 0.19 1.67 -4.14 2.89 3.41 -0.57 -4.81 113.62 112.27 2x9r n SER 38 Ca 0.17 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.68 2x9r n SER 38 Cb 0.78 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.63 2x9r n SER 38 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2x9r s THR 39 N 1.17 0.56 -0.94 6.66 2.01 -1.26 -3.95 115.64 119.89 2x9r s THR 39 Ca 0.00 -1.81 -0.04 0.00 0.31 0.00 0.00 61.69 60.15 2x9r s THR 39 Cb 0.00 -1.52 0.23 0.00 0.01 0.00 0.00 72.50 71.23 2x9r s THR 39 CO 0.00 -0.85 0.85 -0.63 -0.69 0.00 0.00 174.62 173.30 2x9r s ILE 40 N -3.44 4.79 0.65 1.82 1.01 -1.22 -4.88 121.20 119.94 2x9r s ILE 40 Ca 0.08 -3.68 -0.17 0.00 0.00 0.00 0.00 60.65 56.88 2x9r s ILE 40 Cb 0.04 -3.94 -0.00 0.00 0.01 0.00 0.00 42.46 38.56 2x9r s ILE 40 CO -0.05 -1.10 1.22 -0.69 0.00 0.00 0.00 174.94 174.31 2x9r s VAL 41 N -1.23 2.44 1.06 2.92 1.01 -1.26 -4.52 120.40 120.81 2x9r s VAL 41 Ca 0.28 0.25 -0.16 0.00 0.00 0.00 0.00 61.98 62.34 2x9r s VAL 41 Cb -0.09 -2.98 0.14 0.00 0.00 0.00 0.00 36.38 33.45 2x9r s VAL 41 CO -0.11 -0.08 0.12 -2.65 0.00 0.00 0.00 175.10 172.38 2x9r n PRO 42 N -2.07 -2.01 0.00 2.72 -0.02 -1.26 -3.38 135.00 128.97 2x9r n PRO 42 Ca 0.14 -0.59 0.00 0.00 -2.02 0.00 0.00 63.50 61.03 2x9r n PRO 42 Cb 0.50 -1.53 0.00 0.00 -0.02 0.00 0.00 33.50 32.45 2x9r n PRO 42 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 2x9r n GLU 43 N -1.74 0.00 0.17 -0.52 2.13 -1.26 -4.81 120.64 114.61 2x9r n GLU 43 Ca 0.04 0.00 0.06 0.00 0.66 0.00 0.00 57.16 57.92 2x9r n GLU 43 Cb 0.47 -0.89 0.14 0.00 0.27 0.00 0.00 31.44 31.43 2x9r n GLU 43 CO 0.00 0.00 0.00 0.52 -0.41 0.00 0.00 177.13 177.24 2x9r h MET 44 N 1.66 0.00 -3.47 5.31 2.86 -1.92 -3.48 114.93 115.89 2x9r h MET 44 Ca 0.00 0.00 -0.44 0.00 -2.06 0.00 0.00 59.70 57.20 2x9r h MET 44 Cb 0.00 0.00 0.04 0.00 0.06 0.00 0.00 31.60 31.70 2x9r h MET 44 CO 0.00 0.34 -0.03 1.33 1.06 0.00 0.00 176.91 179.62 2x9r n VAL 45 N -3.23 0.20 0.00 -2.22 0.24 -1.26 -1.14 118.33 110.92 2x9r n VAL 45 Ca 0.02 -0.05 0.00 0.00 -2.04 0.00 0.00 64.34 62.27 2x9r n VAL 45 Cb 0.63 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 33.00 2x9r n VAL 45 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2x9r n GLY 46 N 0.92 2.73 3.62 7.63 0.00 -0.95 -5.01 105.19 114.12 2x9r n GLY 46 Ca 0.11 -0.70 -0.43 0.00 0.00 0.00 0.00 46.02 45.00 2x9r n GLY 46 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2x9r s HIS 47 N -0.64 2.34 0.30 1.61 4.02 -0.29 -4.64 115.29 117.99 2x9r s HIS 47 Ca 0.00 0.69 -0.22 0.00 1.02 0.00 0.00 55.06 56.55 2x9r s HIS 47 Cb 0.00 -4.09 -0.09 0.00 -1.02 0.00 0.00 32.58 27.38 2x9r s HIS 47 CO 0.00 -2.26 0.84 0.95 1.02 0.00 0.00 174.74 175.29 2x9r s THR 48 N 5.24 4.41 0.01 1.30 -4.23 -1.26 -4.18 115.64 116.93 2x9r s THR 48 Ca 0.65 1.50 0.07 0.00 -1.18 0.00 0.00 61.69 62.73 2x9r s THR 48 Cb -0.18 -3.87 -0.02 0.00 1.34 0.00 0.00 72.50 69.77 2x9r s THR 48 CO 0.29 0.08 -0.23 -0.63 -0.54 0.00 0.00 174.62 173.59 2x9r s ILE 49 N -1.68 1.80 -1.22 2.99 1.01 -0.90 -4.01 121.20 119.19 2x9r s ILE 49 Ca 0.49 -1.09 -0.12 0.00 0.00 0.00 0.00 60.65 59.93 2x9r s ILE 49 Cb -0.16 -1.52 0.18 0.00 0.01 0.00 0.00 42.46 40.97 2x9r s ILE 49 CO 0.21 0.40 1.52 0.00 0.00 0.00 0.00 174.94 177.07 2x9r n ALA 50 N 2.22 4.30 -1.77 9.38 0.00 -0.52 -2.45 120.51 131.67 2x9r n ALA 50 Ca -0.16 -4.31 -0.38 0.00 0.00 0.00 0.00 53.44 48.58 2x9r n ALA 50 Cb 0.52 -2.97 -0.04 0.00 0.00 0.00 0.00 19.45 16.97 2x9r n ALA 50 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2x9r s VAL 51 N 0.91 3.46 -0.45 0.00 1.01 -1.15 -2.15 120.40 122.03 2x9r s VAL 51 Ca 0.41 1.28 -0.20 0.00 0.00 0.00 0.00 61.98 63.46 2x9r s VAL 51 Cb -0.00 -3.74 0.03 0.00 0.00 0.00 0.00 36.38 32.66 2x9r s VAL 51 CO 0.00 0.17 0.63 -0.47 0.00 0.00 0.00 175.10 175.42 2x9r s TYR 52 N -1.39 3.07 -2.00 5.22 5.04 -1.25 0.39 117.35 126.43 2x9r s TYR 52 Ca 0.52 -0.14 0.08 0.00 -2.44 0.00 0.00 57.07 55.09 2x9r s TYR 52 Cb -0.28 -3.33 0.46 0.00 0.35 0.00 0.00 41.96 39.15 2x9r s TYR 52 CO 0.36 -0.88 1.20 0.27 -1.34 0.00 0.00 175.55 175.17 2x9r n ASN 53 N 6.21 0.00 0.00 4.32 0.23 -0.74 -4.79 115.26 120.49 2x9r n ASN 53 Ca -0.03 -1.54 0.00 0.00 -0.53 0.00 0.00 54.58 52.48 2x9r n ASN 53 Cb 0.48 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.18 2x9r n ASN 53 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2x9r n GLY 54 N 0.50 2.21 0.50 4.83 0.00 -1.26 -4.67 105.19 107.30 2x9r n GLY 54 Ca 0.06 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.94 2x9r n GLY 54 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2x9r n LYS 55 N -0.19 0.33 -3.44 1.61 4.81 -1.26 -5.12 118.16 114.90 2x9r n LYS 55 Ca 0.00 0.14 -0.11 0.00 -0.87 0.00 0.00 58.31 57.47 2x9r n LYS 55 Cb 0.00 -1.06 -0.02 0.00 0.02 0.00 0.00 35.03 33.96 2x9r n LYS 55 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2x9r n GLN 56 N -3.83 0.55 -2.96 1.64 10.64 -1.26 -5.12 117.38 117.03 2x9r n GLN 56 Ca -0.24 -2.17 -0.41 0.00 -1.83 0.00 0.00 57.00 52.34 2x9r n GLN 56 Cb 0.59 2.10 -0.05 0.00 -0.86 0.00 0.00 30.24 32.03 2x9r n GLN 56 CO 0.00 0.00 0.00 -1.01 -1.83 0.00 0.00 177.06 174.22 2x9r s HIS 57 N -3.39 3.43 -0.32 2.61 3.76 -1.25 -1.78 115.29 118.34 2x9r s HIS 57 Ca 0.23 1.18 -0.11 0.00 -0.15 0.00 0.00 55.06 56.20 2x9r s HIS 57 Cb -0.01 -2.94 -0.01 0.00 1.11 0.00 0.00 32.58 30.73 2x9r s HIS 57 CO 0.16 -0.18 0.19 0.14 -0.85 0.00 0.00 174.74 174.20 2x9r s VAL 58 N 1.92 4.87 -0.91 -0.90 -7.23 0.16 -4.85 120.40 113.47 2x9r s VAL 58 Ca 0.36 -0.35 -0.25 0.00 -1.81 0.00 0.00 61.98 59.93 2x9r s VAL 58 Cb -0.17 -3.50 -0.18 0.00 0.56 0.00 0.00 36.38 33.10 2x9r s VAL 58 CO 0.13 0.03 1.93 -0.81 -0.31 0.00 0.00 175.10 176.06 2x9r n PRO 59 N 5.03 1.04 -3.03 4.82 -0.04 -1.26 -2.93 135.00 138.63 2x9r n PRO 59 Ca -0.13 -1.97 -0.41 0.00 -0.04 0.00 0.00 63.50 60.94 2x9r n PRO 59 Cb 0.49 -3.44 -0.06 0.00 -0.04 0.00 0.00 33.50 30.46 2x9r n PRO 59 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2x9r s VAL 60 N 10.59 4.87 0.67 0.52 0.11 -1.03 -4.94 120.40 131.20 2x9r s VAL 60 Ca 0.69 1.07 -0.13 0.00 -2.93 0.00 0.00 61.98 60.67 2x9r s VAL 60 Cb 0.04 -4.07 0.00 0.00 -1.53 0.00 0.00 36.38 30.82 2x9r s VAL 60 CO 0.17 -0.17 1.08 -0.47 -3.33 0.00 0.00 175.10 172.38 2x9r s TYR 61 N 2.77 2.86 -0.06 1.54 5.04 -1.26 -2.13 117.35 126.12 2x9r s TYR 61 Ca 0.29 1.51 0.06 0.00 -2.44 0.00 0.00 57.07 56.49 2x9r s TYR 61 Cb -0.15 -3.02 -0.01 0.00 0.35 0.00 0.00 41.96 39.14 2x9r s TYR 61 CO 0.12 -1.40 -0.25 -1.50 -1.34 0.00 0.00 175.55 171.18 2x9r s ILE 62 N -2.67 2.02 0.18 3.14 1.10 -1.26 -4.92 121.20 118.79 2x9r s ILE 62 Ca 0.62 -1.05 -0.00 0.00 -0.51 0.00 0.00 60.65 59.72 2x9r s ILE 62 Cb -0.17 -1.71 -0.04 0.00 0.15 0.00 0.00 42.46 40.69 2x9r s ILE 62 CO 0.46 0.56 0.08 0.28 -2.11 0.00 0.00 174.94 174.21 2x9r s THR 63 N -0.15 0.26 0.00 4.00 -1.32 -1.26 -2.24 115.64 114.92 2x9r s THR 63 Ca -0.04 -1.97 0.00 0.00 -1.21 0.00 0.00 61.69 58.48 2x9r s THR 63 Cb -0.14 -2.30 0.00 0.00 -1.51 0.00 0.00 72.50 68.55 2x9r s THR 63 CO 0.04 -0.24 0.39 -1.84 -2.21 0.00 0.00 174.62 170.76 2x9r n GLU 64 N -0.24 0.00 -0.06 7.08 0.28 -1.26 -3.11 120.64 123.33 2x9r n GLU 64 Ca -0.02 0.31 -0.01 0.00 -0.16 0.00 0.00 57.16 57.28 2x9r n GLU 64 Cb 0.65 -0.89 -0.01 0.00 1.43 0.00 0.00 31.44 32.61 2x9r n GLU 64 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 177.13 177.24 2x9r n ASN 65 N -0.71 -0.15 -4.57 -1.84 6.94 -1.26 -3.72 115.26 109.96 2x9r n ASN 65 Ca 0.00 0.27 -0.40 0.00 -0.02 0.00 0.00 54.58 54.43 2x9r n ASN 65 Cb 0.00 -0.04 -0.03 0.00 -2.36 0.00 0.00 39.78 37.35 2x9r n ASN 65 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2x9r s MET 66 N -5.10 2.96 0.00 -3.83 0.23 -1.18 -4.76 119.30 107.62 2x9r s MET 66 Ca -0.02 0.66 0.00 0.00 -1.03 0.00 0.00 55.69 55.30 2x9r s MET 66 Cb 0.02 -4.27 0.00 0.00 -1.53 0.00 0.00 34.83 29.05 2x9r s MET 66 CO 0.10 -2.34 0.00 1.33 -2.03 0.00 0.00 175.02 172.08 2x9r n VAL 67 N 7.10 0.00 0.01 5.16 0.24 -1.24 -4.64 118.33 124.96 2x9r n VAL 67 Ca 0.18 0.00 0.22 0.00 -2.04 0.00 0.00 64.34 62.70 2x9r n VAL 67 Cb 0.50 -0.19 0.65 0.00 -1.47 0.00 0.00 33.84 33.33 2x9r n VAL 67 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 2x9r h GLY 68 N 0.00 0.00 -1.38 7.63 0.00 -1.86 -3.35 103.07 104.11 2x9r h GLY 68 Ca 0.00 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 46.82 2x9r h GLY 68 CO 0.00 0.00 -0.00 1.42 0.00 0.00 0.00 176.54 177.96 2x9r n HIS 69 N -3.51 0.09 -3.44 5.60 -0.00 -1.26 -4.76 115.22 107.94 2x9r n HIS 69 Ca 0.12 0.29 -0.21 0.00 -0.00 0.00 0.00 57.72 57.92 2x9r n HIS 69 Cb 0.89 -1.91 0.03 0.00 -0.00 0.00 0.00 29.99 29.01 2x9r n HIS 69 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.34 177.97 2x9r n LYS 70 N -3.80 0.68 0.07 -0.41 4.76 -1.26 -3.42 118.16 114.79 2x9r n LYS 70 Ca 0.10 -3.04 -0.12 0.00 -2.87 0.00 0.00 58.31 52.37 2x9r n LYS 70 Cb 0.53 0.05 -0.13 0.00 -1.84 0.00 0.00 35.03 33.64 2x9r n LYS 70 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 2x9r h LEU 71 N 0.00 0.24 -1.32 -0.35 3.38 -1.68 -3.22 115.31 112.36 2x9r h LEU 71 Ca -0.29 -0.28 -0.00 0.00 0.09 0.00 0.00 57.88 57.41 2x9r h LEU 71 Cb 1.17 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.84 2x9r h LEU 71 CO 0.43 1.22 -0.00 1.23 0.09 0.00 0.00 178.44 181.41 2x9r h GLY 72 N 2.23 0.00 -2.96 0.83 0.00 -0.67 -2.81 103.07 99.69 2x9r h GLY 72 Ca -0.12 0.00 -0.24 0.00 0.00 0.00 0.00 47.33 46.97 2x9r h GLY 72 CO 0.16 0.00 0.31 -2.21 0.00 0.00 0.00 176.54 174.80 2x9r n GLU 73 N -3.10 1.58 0.00 4.80 2.13 -1.21 -3.51 120.64 121.33 2x9r n GLU 73 Ca 0.01 -1.36 0.00 0.00 0.66 0.00 0.00 57.16 56.47 2x9r n GLU 73 Cb 0.33 -1.53 0.00 0.00 0.27 0.00 0.00 31.44 30.51 2x9r n GLU 73 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 2x9r n PHE 74 N -0.16 0.00 -3.71 4.31 3.72 -1.06 -4.86 117.46 115.70 2x9r n PHE 74 Ca 0.27 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.37 2x9r n PHE 74 Cb 0.97 0.02 -0.13 0.00 -0.94 0.00 0.00 39.48 39.40 2x9r n PHE 74 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2x9r s ALA 75 N 0.00 2.03 0.76 4.37 0.00 -1.23 -4.95 121.76 122.74 2x9r s ALA 75 Ca 0.00 -2.45 -0.16 0.00 0.00 0.00 0.00 51.96 49.36 2x9r s ALA 75 Cb 0.00 -1.85 -0.05 0.00 0.00 0.00 0.00 23.12 21.22 2x9r s ALA 75 CO 0.00 -2.01 0.31 -0.35 0.00 0.00 0.00 175.76 173.71 2x9r n PRO 76 N 3.75 0.16 0.00 0.00 -0.04 -1.26 -4.79 135.00 132.81 2x9r n PRO 76 Ca 0.07 0.09 0.02 0.00 -0.04 0.00 0.00 63.50 63.64 2x9r n PRO 76 Cb 0.36 -1.66 -0.01 0.00 -0.04 0.00 0.00 33.50 32.14 2x9r n PRO 76 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2x9r n THR 77 N -2.47 0.00 -4.35 0.52 -2.24 -1.26 -4.80 114.28 99.68 2x9r n THR 77 Ca 0.08 -0.44 -0.18 0.00 -2.27 0.00 0.00 64.05 61.24 2x9r n THR 77 Cb 0.51 1.01 -0.10 0.00 -2.10 0.00 0.00 70.33 69.65 2x9r n THR 77 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2x9r s ARG 78 N -1.09 1.38 0.11 -0.78 0.52 -1.26 -5.01 118.95 112.81 2x9r s ARG 78 Ca 0.02 -1.70 0.10 0.00 -0.52 0.00 0.00 55.73 53.62 2x9r s ARG 78 Cb 0.02 -0.67 -0.04 0.00 0.52 0.00 0.00 34.95 34.79 2x9r s ARG 78 CO 0.11 -0.10 -0.25 0.99 0.02 0.00 0.00 175.30 176.08 2x9r s THR 79 N -3.39 2.04 -0.79 0.02 2.01 -1.26 -4.79 115.64 109.49 2x9r s THR 79 Ca 0.29 -1.62 -0.02 0.00 0.31 0.00 0.00 61.69 60.65 2x9r s THR 79 Cb 0.06 -1.81 -0.02 0.00 0.01 0.00 0.00 72.50 70.73 2x9r s THR 79 CO 0.10 0.08 0.67 0.00 -0.69 0.00 0.00 174.62 174.78 2x9r n TYR 80 N 1.11 -1.63 -0.52 4.92 9.36 -1.26 -5.02 117.16 124.12 2x9r n TYR 80 Ca -0.18 0.63 -0.18 0.00 3.32 0.00 0.00 57.90 61.49 2x9r n TYR 80 Cb 0.53 -3.91 0.16 0.00 -0.63 0.00 0.00 39.34 35.49 2x9r n TYR 80 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 2x9r n ARG 81 N -2.96 -2.90 0.00 2.98 5.12 -1.26 -5.30 116.66 112.34 2x9r n ARG 81 Ca -0.13 -0.96 0.00 0.00 -1.93 0.00 0.00 57.85 54.83 2x9r n ARG 81 Cb 0.60 -1.04 0.00 0.00 -1.16 0.00 0.00 32.46 30.87 2x9r n ARG 81 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11