#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d9v s SER 2 N 0.00 7.11 -1.71 1.61 0.01 -1.26 -4.63 113.70 114.83 2d9v s SER 2 Ca 0.00 -3.15 -0.14 0.00 1.31 0.00 0.00 55.95 53.97 2d9v s SER 2 Cb 0.00 -2.29 0.13 0.00 0.21 0.00 0.00 66.02 64.07 2d9v s SER 2 CO 0.00 -0.54 0.47 -0.24 0.41 0.00 0.00 173.24 173.34 2d9v n SER 3 N 4.19 -1.30 0.00 2.44 2.88 -1.26 -4.77 113.62 115.80 2d9v n SER 3 Ca 0.27 -1.18 0.00 0.00 -1.33 0.00 0.00 58.87 56.63 2d9v n SER 3 Cb 0.42 -2.02 0.00 0.00 -0.75 0.00 0.00 64.21 61.86 2d9v n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2d9v n GLY 4 N -1.63 0.00 3.29 0.46 0.00 -1.26 -5.05 105.19 101.00 2d9v n GLY 4 Ca -0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.65 2d9v n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2d9v s SER 5 N -3.86 3.50 0.17 1.61 0.15 -1.26 -5.12 113.70 108.89 2d9v s SER 5 Ca 0.00 -0.46 -0.18 0.00 0.70 0.00 0.00 55.95 56.01 2d9v s SER 5 Cb 0.00 -1.50 -0.08 0.00 -1.71 0.00 0.00 66.02 62.73 2d9v s SER 5 CO 0.00 0.16 0.65 -0.94 1.20 0.00 0.00 173.24 174.31 2d9v s SER 6 N 0.34 7.00 0.00 5.45 1.04 -1.26 -4.26 113.70 122.01 2d9v s SER 6 Ca -0.15 1.29 0.00 0.00 0.48 0.00 0.00 55.95 57.57 2d9v s SER 6 Cb -0.17 -2.37 0.00 0.00 0.10 0.00 0.00 66.02 63.58 2d9v s SER 6 CO 0.08 0.10 0.00 0.61 0.98 0.00 0.00 173.24 175.01 2d9v n GLY 7 N 0.95 3.07 3.87 7.32 0.00 -1.26 -5.04 105.19 114.10 2d9v n GLY 7 Ca -0.05 -0.83 -0.36 0.00 0.00 0.00 0.00 46.02 44.79 2d9v n GLY 7 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2d9v s LEU 8 N 0.00 4.40 -0.19 0.99 2.96 -1.26 -0.75 118.68 124.83 2d9v s LEU 8 Ca 0.00 0.71 -0.16 0.00 -0.22 0.00 0.00 54.13 54.45 2d9v s LEU 8 Cb 0.00 -2.63 -0.07 0.00 0.50 0.00 0.00 46.19 43.99 2d9v s LEU 8 CO 0.00 0.28 -0.30 0.52 -1.32 0.00 0.00 176.35 175.52 2d9v n VAL 9 N 1.38 1.49 -3.57 1.68 0.31 0.15 -4.82 118.33 114.95 2d9v n VAL 9 Ca -0.13 0.05 -0.12 0.00 -0.01 0.00 0.00 64.34 64.14 2d9v n VAL 9 Cb 0.53 -2.26 -0.06 0.00 -0.91 0.00 0.00 33.84 31.14 2d9v n VAL 9 CO 0.00 0.00 0.00 -0.60 -1.32 0.00 0.00 176.83 174.91 2d9v s ARG 10 N -2.72 0.67 0.00 5.55 3.52 -1.26 -3.58 118.95 121.14 2d9v s ARG 10 Ca -0.29 0.23 0.00 0.00 -0.13 0.00 0.00 55.73 55.55 2d9v s ARG 10 Cb 0.06 0.32 0.00 0.00 -1.56 0.00 0.00 34.95 33.77 2d9v s ARG 10 CO 0.41 -0.20 0.00 0.41 -0.81 0.00 0.00 175.30 175.12 2d9v n GLY 11 N 0.97 7.09 0.00 8.12 0.00 -1.26 -3.27 105.19 116.84 2d9v n GLY 11 Ca -0.12 -1.85 0.00 0.00 0.00 0.00 0.00 46.02 44.04 2d9v n GLY 11 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2d9v n GLY 12 N 3.57 3.93 3.74 -0.02 0.00 -1.24 -4.98 105.19 110.19 2d9v n GLY 12 Ca 0.00 -0.82 -0.42 0.00 0.00 0.00 0.00 46.02 44.79 2d9v n GLY 12 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2d9v s TRP 13 N 0.00 2.98 0.00 1.61 0.52 -1.26 -3.85 118.94 118.94 2d9v s TRP 13 Ca 0.00 0.83 0.01 0.00 0.02 0.00 0.00 56.10 56.96 2d9v s TRP 13 Cb 0.00 -3.91 -0.01 0.00 -1.15 0.00 0.00 33.47 28.40 2d9v s TRP 13 CO 0.00 -3.14 -0.05 -0.51 0.02 0.00 0.00 176.95 173.27 2d9v s LEU 14 N 0.16 2.06 -0.27 2.99 1.43 -0.74 -4.86 118.68 119.44 2d9v s LEU 14 Ca 0.64 -0.16 -0.29 0.00 -1.03 0.00 0.00 54.13 53.29 2d9v s LEU 14 Cb -0.44 -0.19 0.00 0.00 0.03 0.00 0.00 46.19 45.60 2d9v s LEU 14 CO 0.40 -0.00 1.24 0.26 0.23 0.00 0.00 176.35 178.48 2d9v s TRP 15 N -0.35 2.82 -0.12 0.29 0.52 -0.18 -2.25 118.94 119.67 2d9v s TRP 15 Ca -0.01 0.98 -0.02 0.00 0.02 0.00 0.00 56.10 57.07 2d9v s TRP 15 Cb -0.03 -3.76 -0.03 0.00 -1.15 0.00 0.00 33.47 28.50 2d9v s TRP 15 CO -0.00 -1.50 -0.05 0.50 0.02 0.00 0.00 176.95 175.92 2d9v s ARG 16 N 3.90 3.26 0.60 4.98 3.52 0.53 0.09 118.95 135.84 2d9v s ARG 16 Ca 0.54 -0.52 -0.07 0.00 -0.13 0.00 0.00 55.73 55.54 2d9v s ARG 16 Cb -0.17 -2.78 -0.00 0.00 -1.56 0.00 0.00 34.95 30.44 2d9v s ARG 16 CO 0.19 0.44 0.93 -1.14 -0.81 0.00 0.00 175.30 174.92 2d9v s GLN 17 N -0.19 3.09 0.47 5.12 0.74 -1.21 0.55 119.66 128.22 2d9v s GLN 17 Ca 0.03 0.20 0.05 0.00 0.05 0.00 0.00 55.36 55.70 2d9v s GLN 17 Cb -0.13 -2.22 -0.02 0.00 1.10 0.00 0.00 33.01 31.74 2d9v s GLN 17 CO 0.02 -0.66 0.18 -1.12 -0.55 0.00 0.00 175.29 173.17 2d9v s SER 18 N -4.27 4.37 -0.22 6.67 0.01 -1.02 -4.87 113.70 114.38 2d9v s SER 18 Ca 0.54 -1.27 0.01 0.00 1.31 0.00 0.00 55.95 56.53 2d9v s SER 18 Cb -0.11 -0.02 -0.14 0.00 0.21 0.00 0.00 66.02 65.96 2d9v s SER 18 CO 0.47 -0.75 -0.20 -0.24 0.41 0.00 0.00 173.24 172.94 2d9v n SER 19 N -1.36 2.28 -0.04 2.44 2.88 -1.26 -3.63 113.62 114.94 2d9v n SER 19 Ca -0.06 -0.09 -0.18 0.00 -1.33 0.00 0.00 58.87 57.22 2d9v n SER 19 Cb 0.65 -0.36 -0.14 0.00 -0.75 0.00 0.00 64.21 63.61 2d9v n SER 19 CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43 2d9v n ILE 20 N -3.19 1.66 0.14 2.46 2.08 -1.26 -4.26 119.36 116.98 2d9v n ILE 20 Ca -0.39 -0.68 0.11 0.00 0.56 0.00 0.00 62.75 62.36 2d9v n ILE 20 Cb 0.90 -1.45 0.05 0.00 -0.75 0.00 0.00 39.64 38.38 2d9v n ILE 20 CO 0.00 0.00 0.00 -0.07 0.56 0.00 0.00 176.55 177.04 2d9v h LEU 21 N 0.04 0.00 -1.54 1.39 -0.00 -2.00 -3.47 115.31 109.72 2d9v h LEU 21 Ca -0.44 0.00 -0.56 0.00 -0.00 0.00 0.00 57.88 56.87 2d9v h LEU 21 Cb 2.02 0.00 -0.19 0.00 -0.00 0.00 0.00 40.66 42.49 2d9v h LEU 21 CO 0.04 0.04 -0.89 0.54 -0.00 0.00 0.00 178.44 178.18 2d9v n ARG 22 N -2.83 -2.44 -4.03 1.13 1.74 -1.24 -4.92 116.66 104.07 2d9v n ARG 22 Ca 0.01 0.30 -0.10 0.00 -0.77 0.00 0.00 57.85 57.28 2d9v n ARG 22 Cb 0.56 -4.59 -0.11 0.00 -1.02 0.00 0.00 32.46 27.31 2d9v n ARG 22 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 2d9v s ARG 23 N -6.95 0.45 0.25 5.56 3.52 -1.26 -4.81 118.95 115.70 2d9v s ARG 23 Ca 0.40 -0.76 -0.30 0.00 -0.13 0.00 0.00 55.73 54.94 2d9v s ARG 23 Cb -0.22 -0.05 -0.09 0.00 -1.56 0.00 0.00 34.95 33.03 2d9v s ARG 23 CO 0.94 -0.02 1.02 -1.58 -0.81 0.00 0.00 175.30 174.86 2d9v s TRP 24 N -1.75 3.77 0.01 5.12 0.52 -1.26 -2.42 118.94 122.93 2d9v s TRP 24 Ca -0.10 1.80 0.02 0.00 0.02 0.00 0.00 56.10 57.83 2d9v s TRP 24 Cb -0.08 -3.14 -0.01 0.00 -1.15 0.00 0.00 33.47 29.09 2d9v s TRP 24 CO -0.01 -0.07 -0.06 -1.59 0.02 0.00 0.00 176.95 175.24 2d9v s LYS 25 N -1.26 0.44 -0.01 4.98 -2.85 0.19 -4.87 119.74 116.35 2d9v s LYS 25 Ca 0.43 -0.35 -0.30 0.00 -1.00 0.00 0.00 55.97 54.75 2d9v s LYS 25 Cb -0.29 -0.35 -0.04 0.00 -2.06 0.00 0.00 37.83 35.09 2d9v s LYS 25 CO 0.36 0.09 1.23 1.03 0.10 0.00 0.00 175.35 178.16 2d9v s ARG 26 N -0.56 4.37 -0.06 1.78 0.52 -1.26 -0.34 118.95 123.40 2d9v s ARG 26 Ca -0.02 1.74 -0.03 0.00 -0.52 0.00 0.00 55.73 56.91 2d9v s ARG 26 Cb -0.04 -3.50 0.03 0.00 0.52 0.00 0.00 34.95 31.96 2d9v s ARG 26 CO -0.00 -0.41 0.12 -0.80 0.02 0.00 0.00 175.30 174.24 2d9v s ASN 27 N 1.41 -0.08 -0.54 0.23 -0.87 -0.96 -4.94 114.94 109.18 2d9v s ASN 27 Ca 0.58 0.25 -0.21 0.00 -1.57 0.00 0.00 52.86 51.91 2d9v s ASN 27 Cb -0.27 0.16 0.06 0.00 -0.02 0.00 0.00 41.25 41.17 2d9v s ASN 27 CO 0.25 -0.13 0.77 0.86 -2.57 0.00 0.00 177.10 176.28 2d9v s TRP 28 N 1.00 2.92 0.05 2.20 -0.11 -1.15 -1.79 118.94 122.06 2d9v s TRP 28 Ca -0.08 -0.40 -0.18 0.00 1.22 0.00 0.00 56.10 56.66 2d9v s TRP 28 Cb -0.10 -3.84 -0.06 0.00 -1.50 0.00 0.00 33.47 27.97 2d9v s TRP 28 CO -0.05 -1.23 0.52 -0.06 -4.62 0.00 0.00 176.95 171.52 2d9v s PHE 29 N 3.23 3.78 -0.04 5.86 0.40 -1.25 -2.52 117.98 127.43 2d9v s PHE 29 Ca 0.21 1.19 -0.01 0.00 -0.60 0.00 0.00 56.93 57.71 2d9v s PHE 29 Cb -0.17 -2.45 0.03 0.00 0.51 0.00 0.00 43.02 40.95 2d9v s PHE 29 CO 0.14 0.59 0.07 0.00 0.70 0.00 0.00 175.22 176.72 2d9v s ALA 30 N -1.04 0.06 -0.05 5.36 0.00 -0.73 -3.69 121.76 121.66 2d9v s ALA 30 Ca 0.28 0.35 -0.17 0.00 0.00 0.00 0.00 51.96 52.41 2d9v s ALA 30 Cb -0.19 -0.47 -0.05 0.00 0.00 0.00 0.00 23.12 22.42 2d9v s ALA 30 CO 0.17 -0.30 0.47 -1.17 0.00 0.00 0.00 175.76 174.94 2d9v s LEU 31 N 1.60 4.37 0.13 0.00 2.96 -1.20 -2.73 118.68 123.81 2d9v s LEU 31 Ca -0.03 0.93 0.03 0.00 -0.22 0.00 0.00 54.13 54.84 2d9v s LEU 31 Cb -0.12 -2.70 -0.04 0.00 0.50 0.00 0.00 46.19 43.83 2d9v s LEU 31 CO -0.04 0.13 0.20 0.26 -1.32 0.00 0.00 176.35 175.59 2d9v s TRP 32 N -0.12 3.36 0.38 5.38 0.52 -0.57 -0.67 118.94 127.22 2d9v s TRP 32 Ca 0.26 0.10 0.07 0.00 0.02 0.00 0.00 56.10 56.55 2d9v s TRP 32 Cb -0.16 -1.64 0.76 0.00 -1.15 0.00 0.00 33.47 31.29 2d9v s TRP 32 CO 0.13 0.53 1.97 -0.07 0.02 0.00 0.00 176.95 179.53 2d9v h LEU 33 N 2.57 0.43 -1.97 2.99 3.38 -1.26 -1.72 115.31 119.72 2d9v h LEU 33 Ca -0.47 -0.05 0.04 0.00 0.09 0.00 0.00 57.88 57.49 2d9v h LEU 33 Cb 1.18 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.82 2d9v h LEU 33 CO 0.68 0.42 0.38 0.44 0.09 0.00 0.00 178.44 180.45 2d9v h ASP 34 N 0.47 0.00 0.00 -0.43 3.32 -1.89 -3.45 116.42 114.45 2d9v h ASP 34 Ca 0.12 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.17 2d9v h ASP 34 Cb 0.15 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.70 2d9v h ASP 34 CO -0.01 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 178.12 2d9v n GLY 35 N -1.32 1.13 3.23 2.75 0.00 -0.65 -4.89 105.19 105.45 2d9v n GLY 35 Ca 0.01 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.89 2d9v n GLY 35 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2d9v s THR 36 N -2.00 1.08 -0.15 2.61 -4.23 -1.23 -0.19 115.64 111.54 2d9v s THR 36 Ca 0.00 -1.96 -0.00 0.00 -1.18 0.00 0.00 61.69 58.55 2d9v s THR 36 Cb 0.00 -1.73 0.03 0.00 1.34 0.00 0.00 72.50 72.14 2d9v s THR 36 CO 0.00 -0.71 -0.10 -0.22 -0.54 0.00 0.00 174.62 173.05 2d9v s LEU 37 N -2.99 1.58 -0.03 4.79 2.96 0.19 -1.50 118.68 123.67 2d9v s LEU 37 Ca 0.14 -0.51 0.04 0.00 -0.22 0.00 0.00 54.13 53.57 2d9v s LEU 37 Cb 0.02 -1.02 -0.00 0.00 0.50 0.00 0.00 46.19 45.68 2d9v s LEU 37 CO -0.00 -0.12 -0.14 -0.83 -1.32 0.00 0.00 176.35 173.95 2d9v s GLY 38 N 1.58 0.72 -0.20 7.98 0.00 -1.11 -0.16 107.32 116.14 2d9v s GLY 38 Ca 0.03 -0.56 0.01 0.00 0.00 0.00 0.00 44.72 44.20 2d9v s GLY 38 CO -0.09 -0.34 -0.16 -2.52 0.00 0.00 0.00 173.10 169.98 2d9v s TYR 39 N -0.07 2.80 0.51 1.90 -0.85 -1.25 -1.78 117.35 118.61 2d9v s TYR 39 Ca 0.00 -1.76 0.07 0.00 -0.52 0.00 0.00 57.07 54.86 2d9v s TYR 39 Cb -0.08 -1.86 0.05 0.00 0.38 0.00 0.00 41.96 40.44 2d9v s TYR 39 CO 0.01 -0.81 0.70 0.71 -1.52 0.00 0.00 175.55 174.64 2d9v s TYR 40 N 1.28 2.22 0.25 -3.49 1.51 -1.05 -3.96 117.35 114.11 2d9v s TYR 40 Ca 0.01 -0.47 -0.04 0.00 -1.01 0.00 0.00 57.07 55.56 2d9v s TYR 40 Cb -0.15 -2.40 0.35 0.00 -0.11 0.00 0.00 41.96 39.65 2d9v s TYR 40 CO -0.10 -0.82 1.88 1.12 -1.11 0.00 0.00 175.55 176.51 2d9v h HIS 41 N 0.33 1.12 -4.49 2.71 2.07 -1.89 -3.04 115.15 111.96 2d9v h HIS 41 Ca -0.36 0.03 -0.36 0.00 -2.85 0.00 0.00 60.37 56.82 2d9v h HIS 41 Cb 1.28 -0.37 -0.11 0.00 2.57 0.00 0.00 27.41 30.79 2d9v h HIS 41 CO 0.37 0.59 -0.34 0.16 -3.07 0.00 0.00 177.93 175.64 2d9v s ASP 42 N -5.87 1.23 0.21 3.10 1.47 -1.26 -4.44 116.67 111.10 2d9v s ASP 42 Ca -0.13 -1.61 -0.17 0.00 1.18 0.00 0.00 52.55 51.83 2d9v s ASP 42 Cb 0.19 0.60 0.21 0.00 -0.34 0.00 0.00 42.92 43.58 2d9v s ASP 42 CO 0.80 -1.18 1.59 -0.08 0.68 0.00 0.00 175.17 176.99 2d9v h GLU 43 N 2.14 -0.08 -5.66 2.11 4.81 -1.90 -3.32 114.58 112.68 2d9v h GLU 43 Ca -0.27 0.01 -0.29 0.00 -0.13 0.00 0.00 59.36 58.68 2d9v h GLU 43 Cb 1.24 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.61 2d9v h GLU 43 CO 0.38 -0.05 0.83 0.95 -0.73 0.00 0.00 179.01 180.38 2d9v s THR 44 N -6.08 3.24 -0.67 0.32 -4.23 -1.26 -4.87 115.64 102.10 2d9v s THR 44 Ca -0.14 -0.09 -0.25 0.00 -1.18 0.00 0.00 61.69 60.02 2d9v s THR 44 Cb 0.19 -3.58 -0.12 0.00 1.34 0.00 0.00 72.50 70.33 2d9v s THR 44 CO 0.72 -0.55 2.43 0.00 -0.54 0.00 0.00 174.62 176.68 2d9v n ALA 45 N 15.26 0.60 0.00 3.99 0.00 -1.25 -4.55 120.51 134.57 2d9v n ALA 45 Ca 0.37 -1.03 0.00 0.00 0.00 0.00 0.00 53.44 52.78 2d9v n ALA 45 Cb 0.48 -3.11 0.00 0.00 0.00 0.00 0.00 19.45 16.82 2d9v n ALA 45 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2d9v n GLN 46 N 8.69 0.00 -3.37 0.00 6.02 -1.26 -4.92 117.38 122.54 2d9v n GLN 46 Ca 0.45 0.00 -0.45 0.00 -0.01 0.00 0.00 57.00 56.99 2d9v n GLN 46 Cb 0.44 -0.72 -0.02 0.00 1.02 0.00 0.00 30.24 30.96 2d9v n GLN 46 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 2d9v s ASP 47 N -4.25 6.94 -0.71 1.08 -1.08 -1.26 -5.00 116.67 112.39 2d9v s ASP 47 Ca 0.00 -3.23 -0.25 0.00 -0.52 0.00 0.00 52.55 48.55 2d9v s ASP 47 Cb 0.00 -2.18 -0.13 0.00 -1.46 0.00 0.00 42.92 39.15 2d9v s ASP 47 CO 0.00 -0.39 2.41 1.21 0.52 0.00 0.00 175.17 178.92 2d9v n GLU 48 N 3.19 0.66 -0.06 4.34 2.13 -1.26 -4.19 120.64 125.46 2d9v n GLU 48 Ca 0.19 -0.52 -0.12 0.00 0.66 0.00 0.00 57.16 57.37 2d9v n GLU 48 Cb 0.42 -3.43 -0.06 0.00 0.27 0.00 0.00 31.44 28.65 2d9v n GLU 48 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 2d9v h GLU 49 N 14.78 0.31 -2.37 5.31 4.39 -1.95 -3.48 114.58 131.57 2d9v h GLU 49 Ca -0.07 -0.10 0.19 0.00 0.34 0.00 0.00 59.36 59.71 2d9v h GLU 49 Cb 1.10 -0.03 -0.06 0.00 -0.10 0.00 0.00 28.75 29.67 2d9v h GLU 49 CO 1.09 0.54 0.59 -0.51 -1.16 0.00 0.00 179.01 179.57 2d9v s ASP 50 N -5.84 -0.05 -0.21 1.42 1.01 -1.26 -5.08 116.67 106.67 2d9v s ASP 50 Ca -0.14 -0.54 -0.06 0.00 0.71 0.00 0.00 52.55 52.52 2d9v s ASP 50 Cb 0.06 0.45 0.10 0.00 1.01 0.00 0.00 42.92 44.54 2d9v s ASP 50 CO 0.73 -0.88 0.42 -0.60 0.21 0.00 0.00 175.17 175.05 2d9v s ARG 51 N -2.49 0.33 -0.14 8.23 3.52 -1.26 -3.83 118.95 123.32 2d9v s ARG 51 Ca 0.19 1.00 -0.01 0.00 -0.13 0.00 0.00 55.73 56.78 2d9v s ARG 51 Cb -0.02 0.27 -0.02 0.00 -1.56 0.00 0.00 34.95 33.63 2d9v s ARG 51 CO 0.03 -0.29 -0.11 0.14 -0.81 0.00 0.00 175.30 174.27 2d9v s VAL 52 N 2.62 3.26 0.36 7.11 -7.23 0.77 -4.91 120.40 122.37 2d9v s VAL 52 Ca -0.00 -0.59 -0.28 0.00 -1.81 0.00 0.00 61.98 59.30 2d9v s VAL 52 Cb -0.12 -2.39 -0.11 0.00 0.56 0.00 0.00 36.38 34.32 2d9v s VAL 52 CO -0.13 0.51 1.43 -0.69 -0.31 0.00 0.00 175.10 175.91 2d9v s VAL 53 N 0.39 2.28 -0.17 1.32 1.01 -1.26 0.52 120.40 124.49 2d9v s VAL 53 Ca -0.09 0.28 -0.00 0.00 0.00 0.00 0.00 61.98 62.17 2d9v s VAL 53 Cb -0.15 -3.18 -0.10 0.00 0.00 0.00 0.00 36.38 32.94 2d9v s VAL 53 CO 0.05 0.07 -0.16 -0.38 0.00 0.00 0.00 175.10 174.68 2d9v n ILE 54 N 0.61 0.95 -1.47 2.22 2.08 0.74 -4.63 119.36 119.85 2d9v n ILE 54 Ca 0.01 -0.35 -0.61 0.00 0.56 0.00 0.00 62.75 62.36 2d9v n ILE 54 Cb 0.40 -1.17 -0.10 0.00 -0.75 0.00 0.00 39.64 38.02 2d9v n ILE 54 CO 0.00 0.00 0.00 1.57 0.56 0.00 0.00 176.55 178.68 2d9v n HIS 55 N -3.09 1.47 -3.90 1.39 -0.00 -0.94 -0.19 115.22 109.96 2d9v n HIS 55 Ca -0.30 0.82 -0.31 0.00 -0.00 0.00 0.00 57.72 57.93 2d9v n HIS 55 Cb 0.80 -2.31 -0.07 0.00 -0.00 0.00 0.00 29.99 28.41 2d9v n HIS 55 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.34 177.53 2d9v n PHE 56 N 6.47 -0.94 -0.68 1.57 3.72 -1.22 -4.73 117.46 121.65 2d9v n PHE 56 Ca 0.44 0.52 0.05 0.00 -0.05 0.00 0.00 57.45 58.41 2d9v n PHE 56 Cb -0.00 -1.70 0.07 0.00 -0.94 0.00 0.00 39.48 36.90 2d9v n PHE 56 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 2d9v n ASN 57 N -1.91 2.02 -4.42 4.37 5.15 0.73 -4.92 115.26 116.28 2d9v n ASN 57 Ca -0.02 -2.53 -0.36 0.00 -0.60 0.00 0.00 54.58 51.06 2d9v n ASN 57 Cb 0.42 -0.23 -0.13 0.00 -0.53 0.00 0.00 39.78 39.31 2d9v n ASN 57 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2d9v s VAL 58 N -1.89 4.18 -0.16 3.44 1.01 -1.26 -1.14 120.40 124.59 2d9v s VAL 58 Ca 0.17 -0.25 -0.23 0.00 0.00 0.00 0.00 61.98 61.67 2d9v s VAL 58 Cb 0.14 -2.96 -0.23 0.00 0.00 0.00 0.00 36.38 33.33 2d9v s VAL 58 CO 0.02 0.33 0.49 -0.09 0.00 0.00 0.00 175.10 175.85 2d9v h ARG 59 N 8.22 0.06 -3.18 2.72 2.43 -1.34 -3.46 114.38 119.84 2d9v h ARG 59 Ca -0.38 -0.10 0.02 0.00 -0.81 0.00 0.00 59.98 58.70 2d9v h ARG 59 Cb 1.17 0.04 -0.08 0.00 -0.42 0.00 0.00 29.97 30.68 2d9v h ARG 59 CO 0.58 1.05 0.12 -0.51 -1.51 0.00 0.00 179.97 179.71 2d9v s ASP 60 N -6.68 -0.26 -0.22 -3.80 1.01 -1.25 -5.00 116.67 100.45 2d9v s ASP 60 Ca -0.23 -0.58 -0.03 0.00 0.71 0.00 0.00 52.55 52.42 2d9v s ASP 60 Cb 0.02 0.66 0.12 0.00 1.01 0.00 0.00 42.92 44.73 2d9v s ASP 60 CO 0.67 -1.21 0.34 -0.63 0.21 0.00 0.00 175.17 174.55 2d9v s ILE 61 N -3.91 -0.53 -0.03 0.77 1.01 -1.26 -0.63 121.20 116.61 2d9v s ILE 61 Ca 0.12 -0.05 -0.02 0.00 0.00 0.00 0.00 60.65 60.70 2d9v s ILE 61 Cb -0.03 -0.75 -0.04 0.00 0.01 0.00 0.00 42.46 41.65 2d9v s ILE 61 CO 0.03 -0.12 0.09 -0.54 0.00 0.00 0.00 174.94 174.41 2d9v s LYS 62 N 2.49 3.16 -0.03 2.79 1.02 -0.90 -4.99 119.74 123.29 2d9v s LYS 62 Ca 0.10 -0.40 0.01 0.00 0.02 0.00 0.00 55.97 55.70 2d9v s LYS 62 Cb -0.15 -2.93 0.02 0.00 -0.52 0.00 0.00 37.83 34.25 2d9v s LYS 62 CO -0.14 0.68 -0.02 0.08 -0.92 0.00 0.00 175.35 175.03 2d9v s VAL 63 N -1.15 0.28 0.00 3.17 1.01 -1.26 -1.66 120.40 120.78 2d9v s VAL 63 Ca 0.21 -0.01 0.00 0.00 0.00 0.00 0.00 61.98 62.18 2d9v s VAL 63 Cb -0.12 -0.33 0.00 0.00 0.00 0.00 0.00 36.38 35.93 2d9v s VAL 63 CO 0.12 0.15 0.00 0.61 0.00 0.00 0.00 175.10 175.97 2d9v n GLY 64 N 3.87 3.03 0.09 4.51 0.00 -0.91 -3.19 105.19 112.59 2d9v n GLY 64 Ca -0.24 -0.21 -0.09 0.00 0.00 0.00 0.00 46.02 45.48 2d9v n GLY 64 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2d9v h GLN 65 N 0.00 0.04 -0.71 1.61 4.20 -1.90 -2.58 115.11 115.77 2d9v h GLN 65 Ca 0.00 -0.00 0.22 0.00 0.06 0.00 0.00 58.65 58.93 2d9v h GLN 65 Cb 0.00 -0.01 -0.13 0.00 0.30 0.00 0.00 27.48 27.64 2d9v h GLN 65 CO 0.00 0.02 0.09 0.39 -0.67 0.00 0.00 178.83 178.67 2d9v n GLU 66 N -5.13 -0.05 -2.44 1.46 1.02 -1.19 -4.10 120.64 110.20 2d9v n GLU 66 Ca -0.04 1.05 -0.42 0.00 -0.02 0.00 0.00 57.16 57.74 2d9v n GLU 66 Cb 0.09 -1.72 -0.03 0.00 -0.02 0.00 0.00 31.44 29.76 2d9v n GLU 66 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2d9v s GLN 68 N 1.33 2.02 -1.45 0.00 -0.21 -1.26 -4.71 119.66 115.38 2d9v s GLN 68 Ca 0.58 -1.87 -0.10 0.00 0.02 0.00 0.00 55.36 53.99 2d9v s GLN 68 Cb -0.28 -1.84 0.04 0.00 1.00 0.00 0.00 33.01 31.93 2d9v s GLN 68 CO 0.28 0.06 0.94 -0.25 -2.12 0.00 0.00 175.29 174.20 2d9v n ASP 69 N -0.97 -5.66 -3.68 5.90 8.00 -1.26 -4.98 116.55 113.90 2d9v n ASP 69 Ca -0.04 -0.54 -0.12 0.00 0.71 0.00 0.00 54.79 54.80 2d9v n ASP 69 Cb 0.64 -4.51 -0.12 0.00 -0.02 0.00 0.00 41.12 37.10 2d9v n ASP 69 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2d9v s VAL 70 N -3.25 -0.34 -0.16 2.53 1.01 -1.26 -5.15 120.40 113.78 2d9v s VAL 70 Ca 0.53 0.21 -0.06 0.00 0.00 0.00 0.00 61.98 62.66 2d9v s VAL 70 Cb -0.25 -0.50 -0.04 0.00 0.00 0.00 0.00 36.38 35.59 2d9v s VAL 70 CO 0.66 0.09 0.06 -1.58 0.00 0.00 0.00 175.10 174.32 2d9v s GLN 71 N 2.10 3.77 0.48 2.72 0.74 -1.26 -5.09 119.66 123.12 2d9v s GLN 71 Ca -0.03 -0.33 -0.22 0.00 0.05 0.00 0.00 55.36 54.83 2d9v s GLN 71 Cb -0.11 -3.14 -0.07 0.00 1.10 0.00 0.00 33.01 30.78 2d9v s GLN 71 CO -0.10 0.39 1.16 -1.25 -0.55 0.00 0.00 175.29 174.94 2d9v s PRO 72 N 0.04 3.67 1.25 1.67 0.04 -1.26 -5.04 135.00 135.36 2d9v s PRO 72 Ca 0.05 1.73 -0.21 0.00 0.04 0.00 0.00 61.00 62.62 2d9v s PRO 72 Cb -0.12 -2.31 0.31 0.00 0.04 0.00 0.00 34.50 32.41 2d9v s PRO 72 CO 0.01 -0.62 1.12 -1.25 0.04 0.00 0.00 177.00 176.30 2d9v s PRO 73 N -2.83 -1.60 0.19 0.56 0.04 -1.26 -4.97 135.00 125.12 2d9v s PRO 73 Ca 0.66 -0.21 -0.30 0.00 0.04 0.00 0.00 61.00 61.19 2d9v s PRO 73 Cb -0.27 -1.56 -0.09 0.00 0.04 0.00 0.00 34.50 32.62 2d9v s PRO 73 CO 0.33 -3.94 1.29 -2.00 0.04 0.00 0.00 177.00 172.72 2d9v s GLU 74 N -5.52 4.40 0.00 4.56 2.12 -1.26 -3.77 118.70 119.23 2d9v s GLU 74 Ca 0.72 2.02 0.00 0.00 0.36 0.00 0.00 54.97 58.07 2d9v s GLU 74 Cb -0.07 -3.21 0.00 0.00 0.26 0.00 0.00 34.13 31.11 2d9v s GLU 74 CO 0.56 -0.24 0.00 0.41 -0.54 0.00 0.00 175.26 175.45 2d9v n GLY 75 N 2.40 2.15 3.36 -1.50 0.00 -1.26 -5.00 105.19 105.34 2d9v n GLY 75 Ca 0.06 -0.43 -0.29 0.00 0.00 0.00 0.00 46.02 45.37 2d9v n GLY 75 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2d9v n ARG 76 N 0.00 -2.89 -4.52 1.61 3.00 -1.25 -5.05 116.66 107.56 2d9v n ARG 76 Ca 0.00 -0.83 -0.26 0.00 -0.01 0.00 0.00 57.85 56.75 2d9v n ARG 76 Cb 0.00 -2.00 -0.10 0.00 0.00 0.00 0.00 32.46 30.36 2d9v n ARG 76 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.63 176.51 2d9v s SER 77 N -2.39 3.78 0.14 0.55 0.01 -1.26 -4.76 113.70 109.77 2d9v s SER 77 Ca 0.65 -1.18 -0.18 0.00 1.31 0.00 0.00 55.95 56.55 2d9v s SER 77 Cb -0.20 -0.37 0.00 0.00 0.21 0.00 0.00 66.02 65.66 2d9v s SER 77 CO 0.63 -0.20 1.74 0.03 0.41 0.00 0.00 173.24 175.84 2d9v h ARG 78 N 2.00 0.16 -1.33 12.44 3.08 -1.95 -1.37 114.38 127.41 2d9v h ARG 78 Ca -0.42 -0.01 0.39 0.00 0.07 0.00 0.00 59.98 60.01 2d9v h ARG 78 Cb 1.25 -0.04 -0.06 0.00 0.08 0.00 0.00 29.97 31.20 2d9v h ARG 78 CO 0.70 0.11 0.94 0.38 -1.07 0.00 0.00 179.97 181.03 2d9v h ASP 79 N 0.17 0.06 -0.43 7.04 3.04 -1.94 0.59 116.42 124.95 2d9v h ASP 79 Ca 0.12 0.02 -0.04 0.00 -3.24 0.00 0.00 57.03 53.88 2d9v h ASP 79 Cb 0.11 0.01 -0.02 0.00 -1.04 0.00 0.00 39.33 38.39 2d9v h ASP 79 CO -0.15 -0.00 0.13 1.23 -2.04 0.00 0.00 179.24 178.41 2d9v h GLY 80 N 0.05 0.79 -4.14 7.15 0.00 -1.47 -3.25 103.07 102.19 2d9v h GLY 80 Ca 0.66 -0.43 -0.59 0.00 0.00 0.00 0.00 47.33 46.96 2d9v h GLY 80 CO -0.07 0.41 -0.89 1.04 0.00 0.00 0.00 176.54 177.04 2d9v n LEU 81 N -4.30 -2.67 -3.17 3.11 4.32 0.20 -1.43 117.00 113.07 2d9v n LEU 81 Ca 0.03 0.79 0.04 0.00 -0.02 0.00 0.00 56.01 56.85 2d9v n LEU 81 Cb 0.20 -0.84 -0.01 0.00 -1.62 0.00 0.00 43.42 41.15 2d9v n LEU 81 CO 0.39 -3.95 0.26 -0.22 -1.22 0.00 0.00 177.39 172.66 2d9v s LEU 82 N 4.08 -1.16 -0.05 2.23 2.96 0.13 -2.15 118.68 124.73 2d9v s LEU 82 Ca 0.57 0.76 0.06 0.00 -0.22 0.00 0.00 54.13 55.30 2d9v s LEU 82 Cb -0.62 1.99 -0.02 0.00 0.50 0.00 0.00 46.19 48.04 2d9v s LEU 82 CO 0.59 -0.22 -0.22 -0.89 -1.32 0.00 0.00 176.35 174.30 2d9v s THR 83 N 2.88 2.39 -0.09 3.68 2.01 -0.67 -1.44 115.64 124.39 2d9v s THR 83 Ca 0.15 -0.96 0.03 0.00 0.31 0.00 0.00 61.69 61.22 2d9v s THR 83 Cb -0.14 -1.88 -0.01 0.00 0.01 0.00 0.00 72.50 70.47 2d9v s THR 83 CO -0.19 0.58 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.45 2d9v s VAL 84 N -0.40 2.65 -0.13 3.82 1.01 -0.80 -2.11 120.40 124.43 2d9v s VAL 84 Ca 0.04 -0.83 -0.09 0.00 0.00 0.00 0.00 61.98 61.10 2d9v s VAL 84 Cb -0.12 -2.05 -0.04 0.00 0.00 0.00 0.00 36.38 34.17 2d9v s VAL 84 CO 0.02 0.55 0.17 0.20 0.00 0.00 0.00 175.10 176.04 2d9v s ASN 85 N 0.02 6.39 0.03 3.32 0.01 0.20 0.43 114.94 125.33 2d9v s ASN 85 Ca -0.06 0.46 0.03 0.00 -0.71 0.00 0.00 52.86 52.58 2d9v s ASN 85 Cb -0.15 -2.09 -0.04 0.00 0.41 0.00 0.00 41.25 39.38 2d9v s ASN 85 CO 0.05 0.34 -0.04 -0.76 -1.51 0.00 0.00 177.10 175.18 2d9v s LEU 86 N -0.66 3.31 0.11 0.60 1.43 0.28 -0.99 118.68 122.76 2d9v s LEU 86 Ca 0.14 -0.13 -0.22 0.00 -1.03 0.00 0.00 54.13 52.89 2d9v s LEU 86 Cb -0.12 -1.94 -0.09 0.00 0.03 0.00 0.00 46.19 44.07 2d9v s LEU 86 CO 0.03 0.25 1.71 0.03 0.23 0.00 0.00 176.35 178.61 2d9v h ARG 87 N 4.20 -0.07 -0.84 1.70 2.47 -1.43 -2.59 114.38 117.82 2d9v h ARG 87 Ca -0.48 0.00 0.24 0.00 -1.26 0.00 0.00 59.98 58.48 2d9v h ARG 87 Cb 1.17 0.02 -0.16 0.00 -1.65 0.00 0.00 29.97 29.35 2d9v h ARG 87 CO 0.56 -0.04 0.04 -0.85 0.56 0.00 0.00 179.97 180.24 2d9v n GLU 88 N -5.18 -0.07 0.00 0.04 0.28 -1.26 -4.71 120.64 109.74 2d9v n GLU 88 Ca -0.05 1.25 0.00 0.00 -0.16 0.00 0.00 57.16 58.20 2d9v n GLU 88 Cb 0.11 -2.00 0.00 0.00 1.43 0.00 0.00 31.44 30.97 2d9v n GLU 88 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2d9v n GLY 89 N -1.41 0.43 3.53 -1.84 0.00 -0.98 -5.17 105.19 99.75 2d9v n GLY 89 Ca 0.21 -0.08 -0.16 0.00 0.00 0.00 0.00 46.02 45.98 2d9v n GLY 89 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2d9v s SER 90 N 0.00 -0.65 0.21 1.61 0.15 -1.22 -5.02 113.70 108.77 2d9v s SER 90 Ca 0.00 0.90 0.07 0.00 0.70 0.00 0.00 55.95 57.62 2d9v s SER 90 Cb 0.00 0.80 -0.04 0.00 -1.71 0.00 0.00 66.02 65.07 2d9v s SER 90 CO 0.00 -0.49 0.06 0.00 1.20 0.00 0.00 173.24 174.02 2d9v s ARG 91 N -0.71 2.57 -0.31 5.44 1.70 -1.26 -0.56 118.95 125.82 2d9v s ARG 91 Ca -0.08 -1.13 0.01 0.00 -0.47 0.00 0.00 55.73 54.06 2d9v s ARG 91 Cb -0.02 -2.40 0.07 0.00 -0.57 0.00 0.00 34.95 32.04 2d9v s ARG 91 CO 0.07 0.43 0.01 -0.51 -1.08 0.00 0.00 175.30 174.21 2d9v s LEU 92 N -3.35 4.18 -0.18 -1.89 1.43 0.17 -4.95 118.68 114.09 2d9v s LEU 92 Ca 0.30 -1.65 -0.29 0.00 -1.03 0.00 0.00 54.13 51.46 2d9v s LEU 92 Cb -0.08 -1.66 -0.00 0.00 0.03 0.00 0.00 46.19 44.47 2d9v s LEU 92 CO 0.21 -0.31 1.12 -1.00 0.23 0.00 0.00 176.35 176.60 2d9v s HIS 93 N 1.10 3.19 0.09 0.29 3.76 -1.26 -1.91 115.29 120.55 2d9v s HIS 93 Ca -0.00 1.32 -0.09 0.00 -0.15 0.00 0.00 55.06 56.14 2d9v s HIS 93 Cb -0.20 -3.35 -0.00 0.00 1.11 0.00 0.00 32.58 30.14 2d9v s HIS 93 CO -0.04 -0.89 0.19 -0.51 -0.85 0.00 0.00 174.74 172.64 2d9v s LEU 94 N 3.10 1.40 -0.14 0.89 1.43 -0.52 -3.33 118.68 121.51 2d9v s LEU 94 Ca 0.49 -0.65 -0.06 0.00 -1.03 0.00 0.00 54.13 52.87 2d9v s LEU 94 Cb -0.18 1.05 0.06 0.00 0.03 0.00 0.00 46.19 47.15 2d9v s LEU 94 CO 0.11 -0.73 0.30 0.00 0.23 0.00 0.00 176.35 176.26 2d9v s ALA 96 N 1.90 3.97 0.13 0.00 0.00 -0.52 -1.01 121.76 126.23 2d9v s ALA 96 Ca -0.04 -1.88 -0.04 0.00 0.00 0.00 0.00 51.96 49.99 2d9v s ALA 96 Cb -0.11 -1.85 -0.08 0.00 0.00 0.00 0.00 23.12 21.08 2d9v s ALA 96 CO -0.10 -1.35 1.31 1.05 0.00 0.00 0.00 175.76 176.67 2d9v h GLU 97 N -0.38 0.41 -4.22 0.00 4.11 -1.89 -3.41 114.58 109.20 2d9v h GLU 97 Ca -0.34 -0.43 -0.26 0.00 0.07 0.00 0.00 59.36 58.40 2d9v h GLU 97 Cb 1.27 0.12 -0.10 0.00 0.50 0.00 0.00 28.75 30.54 2d9v h GLU 97 CO 0.39 1.10 -0.28 0.95 0.07 0.00 0.00 179.01 181.24 2d9v s THR 98 N -3.29 0.00 0.12 -1.06 -4.23 -1.26 -4.46 115.64 101.46 2d9v s THR 98 Ca -0.06 -1.68 -0.14 0.00 -1.18 0.00 0.00 61.69 58.64 2d9v s THR 98 Cb 0.09 -2.53 -0.04 0.00 1.34 0.00 0.00 72.50 71.37 2d9v s THR 98 CO 0.86 0.00 1.51 0.08 -0.54 0.00 0.00 174.62 176.54 2d9v h ARG 99 N 2.21 0.77 -0.23 3.99 0.11 -1.90 -2.84 114.38 116.50 2d9v h ARG 99 Ca -0.29 -0.32 0.04 0.00 0.10 0.00 0.00 59.98 59.51 2d9v h ARG 99 Cb 1.24 -0.03 -0.07 0.00 1.11 0.00 0.00 29.97 32.22 2d9v h ARG 99 CO 0.40 0.94 -0.52 0.22 0.10 0.00 0.00 179.97 181.10 2d9v h ASP 100 N 0.58 -1.69 -0.82 0.08 3.58 -1.97 0.24 116.42 116.42 2d9v h ASP 100 Ca 0.09 0.21 0.08 0.00 0.42 0.00 0.00 57.03 57.83 2d9v h ASP 100 Cb 0.68 0.68 -0.07 0.00 1.72 0.00 0.00 39.33 42.34 2d9v h ASP 100 CO 0.05 -0.45 0.48 0.44 -2.88 0.00 0.00 179.24 176.88 2d9v h ASP 101 N -0.51 0.73 -0.07 2.28 5.19 -1.99 -2.32 116.42 119.74 2d9v h ASP 101 Ca 0.06 0.03 0.02 0.00 -0.62 0.00 0.00 57.03 56.52 2d9v h ASP 101 Cb 0.65 -0.11 -0.02 0.00 0.18 0.00 0.00 39.33 40.03 2d9v h ASP 101 CO -0.49 0.44 -0.03 0.00 -3.12 0.00 0.00 179.24 176.05 2d9v h ALA 102 N 1.42 0.03 -0.59 3.45 0.00 -0.92 -2.70 119.26 119.96 2d9v h ALA 102 Ca 0.38 0.03 0.11 0.00 0.00 0.00 0.00 54.91 55.42 2d9v h ALA 102 Cb 0.27 0.07 -0.08 0.00 0.00 0.00 0.00 17.79 18.05 2d9v h ALA 102 CO -0.21 -0.50 0.14 0.82 0.00 0.00 0.00 179.25 179.50 2d9v h ILE 103 N -0.02 0.68 -0.66 0.00 2.04 -0.07 -1.62 117.51 117.85 2d9v h ILE 103 Ca 0.04 -0.10 0.14 0.00 1.00 0.00 0.00 64.86 65.94 2d9v h ILE 103 Cb 0.08 0.37 -0.12 0.00 -0.74 0.00 0.00 36.82 36.41 2d9v h ILE 103 CO -0.08 0.05 -0.12 0.00 0.00 0.00 0.00 178.15 178.00 2d9v h ALA 104 N 1.45 0.50 -0.31 1.87 0.00 -1.12 -0.20 119.26 121.46 2d9v h ALA 104 Ca 0.30 0.25 -0.01 0.00 0.00 0.00 0.00 54.91 55.45 2d9v h ALA 104 Cb 0.43 0.47 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 2d9v h ALA 104 CO -0.37 -0.42 0.16 -1.49 0.00 0.00 0.00 179.25 177.13 2d9v h TRP 105 N 0.03 0.43 -0.81 0.00 4.06 -1.23 -0.39 115.95 118.04 2d9v h TRP 105 Ca 0.33 -0.01 0.15 0.00 2.06 0.00 0.00 58.89 61.42 2d9v h TRP 105 Cb 0.52 -0.14 -0.10 0.00 -1.00 0.00 0.00 29.16 28.45 2d9v h TRP 105 CO -0.50 0.36 0.36 -0.22 -3.56 0.00 0.00 178.44 174.89 2d9v h LYS 106 N 0.37 0.49 -0.16 0.49 3.64 -0.52 0.21 116.57 121.09 2d9v h LYS 106 Ca 0.11 -0.03 -0.20 0.00 -1.27 0.00 0.00 60.65 59.26 2d9v h LYS 106 Cb 0.08 -0.11 0.01 0.00 -0.41 0.00 0.00 32.23 31.80 2d9v h LYS 106 CO -0.02 0.32 -0.66 1.15 -2.27 0.00 0.00 179.45 177.97 2d9v h THR 107 N 0.50 1.30 -0.19 1.00 2.02 -0.96 0.53 112.91 117.12 2d9v h THR 107 Ca 0.45 -1.89 -0.02 0.00 0.77 0.00 0.00 66.41 65.72 2d9v h THR 107 Cb 0.70 1.99 -0.01 0.00 -1.74 0.00 0.00 68.15 69.08 2d9v h THR 107 CO -0.41 0.59 0.01 0.00 0.37 0.00 0.00 175.52 176.09 2d9v h ALA 108 N 0.55 1.67 0.10 6.16 0.00 0.13 0.17 119.26 128.04 2d9v h ALA 108 Ca -0.04 -0.11 -0.25 0.00 0.00 0.00 0.00 54.91 54.51 2d9v h ALA 108 Cb 1.30 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.99 2d9v h ALA 108 CO 0.14 0.25 -1.30 -0.07 0.00 0.00 0.00 179.25 178.27 2d9v h LEU 109 N 0.27 0.34 -1.07 0.00 3.38 -0.60 -3.19 115.31 114.43 2d9v h LEU 109 Ca 0.06 -0.84 -0.04 0.00 0.09 0.00 0.00 57.88 57.16 2d9v h LEU 109 Cb 0.17 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.78 2d9v h LEU 109 CO 0.00 1.57 0.23 0.24 0.09 0.00 0.00 178.44 180.57 2d9v h MET 110 N -0.39 0.90 0.42 1.13 2.86 -0.75 -1.54 114.93 117.55 2d9v h MET 110 Ca -0.28 -0.15 -0.02 0.00 -2.06 0.00 0.00 59.70 57.19 2d9v h MET 110 Cb 1.68 -0.15 0.00 0.00 0.06 0.00 0.00 31.60 33.19 2d9v h MET 110 CO 0.04 0.74 -0.20 0.93 1.06 0.00 0.00 176.91 179.48 2d9v h GLU 111 N 0.88 -0.55 -1.00 1.72 5.08 -0.81 -0.47 114.58 119.43 2d9v h GLU 111 Ca 0.21 0.04 0.24 0.00 -1.00 0.00 0.00 59.36 58.84 2d9v h GLU 111 Cb 0.19 0.12 -0.09 0.00 0.50 0.00 0.00 28.75 29.47 2d9v h GLU 111 CO -0.02 -0.37 0.64 0.00 -1.00 0.00 0.00 179.01 178.27 2d9v h ALA 112 N -1.61 2.09 -0.32 3.43 0.00 -1.57 0.94 119.26 122.22 2d9v h ALA 112 Ca -0.06 0.06 -0.13 0.00 0.00 0.00 0.00 54.91 54.78 2d9v h ALA 112 Cb 0.44 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2d9v h ALA 112 CO 0.10 -0.47 -0.34 -0.97 0.00 0.00 0.00 179.25 177.56 2d9v h ASN 113 N 0.48 0.75 -0.53 0.00 -1.24 -1.22 -3.13 115.58 110.69 2d9v h ASN 113 Ca 0.57 -0.32 -0.32 0.00 0.71 0.00 0.00 56.30 56.94 2d9v h ASN 113 Cb 1.30 -0.21 -0.20 0.00 0.73 0.00 0.00 38.32 39.94 2d9v h ASN 113 CO -0.30 1.03 -0.06 -1.54 -1.29 0.00 0.00 177.43 175.28 2d9v n SER 114 N -4.06 3.53 -3.32 1.15 3.41 0.77 -3.38 113.62 111.71 2d9v n SER 114 Ca -0.01 -3.78 -0.09 0.00 -0.26 0.00 0.00 58.87 54.73 2d9v n SER 114 Cb 0.50 -0.64 -0.07 0.00 -0.26 0.00 0.00 64.21 63.74 2d9v n SER 114 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2d9v s THR 115 N -3.67 -0.62 1.22 6.66 2.01 0.29 -4.93 115.64 116.61 2d9v s THR 115 Ca 0.49 -0.19 -0.20 0.00 0.31 0.00 0.00 61.69 62.10 2d9v s THR 115 Cb 0.42 -0.91 0.30 0.00 0.01 0.00 0.00 72.50 72.32 2d9v s THR 115 CO 0.01 -0.21 1.11 -2.16 -0.69 0.00 0.00 174.62 172.68 2d9v s PRO 116 N 2.55 -1.39 -0.24 4.92 0.04 -1.26 -4.58 135.00 135.03 2d9v s PRO 116 Ca 0.11 -0.12 -0.27 0.00 0.04 0.00 0.00 61.00 60.77 2d9v s PRO 116 Cb -0.14 -1.58 0.12 0.00 0.04 0.00 0.00 34.50 32.94 2d9v s PRO 116 CO -0.23 -3.81 1.00 0.00 0.04 0.00 0.00 177.00 174.00 2d9v s ALA 117 N -3.01 -1.95 -2.00 8.56 0.00 -1.26 -5.01 121.76 117.09 2d9v s ALA 117 Ca 0.71 1.78 0.15 0.00 0.00 0.00 0.00 51.96 54.61 2d9v s ALA 117 Cb -0.09 -1.19 0.92 0.00 0.00 0.00 0.00 23.12 22.77 2d9v s ALA 117 CO 0.56 -0.26 1.33 -0.35 0.00 0.00 0.00 175.76 177.04 2d9v n PRO 118 N 1.79 0.49 -1.18 0.00 -0.04 -1.26 -4.80 135.00 129.99 2d9v n PRO 118 Ca -0.12 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.03 2d9v n PRO 118 Cb 0.56 -1.49 0.12 0.00 -0.04 0.00 0.00 33.50 32.65 2d9v n PRO 118 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2d9v s ALA 119 N -2.00 1.87 0.00 0.55 0.00 -1.26 -5.02 121.76 115.90 2d9v s ALA 119 Ca 0.23 0.16 0.00 0.00 0.00 0.00 0.00 51.96 52.35 2d9v s ALA 119 Cb 0.11 -3.26 0.00 0.00 0.00 0.00 0.00 23.12 19.97 2d9v s ALA 119 CO 0.18 -2.11 0.00 0.41 0.00 0.00 0.00 175.76 174.24 2d9v n GLY 120 N -1.03 2.22 3.24 0.00 0.00 -1.26 -5.02 105.19 103.33 2d9v n GLY 120 Ca 0.08 -0.33 -0.11 0.00 0.00 0.00 0.00 46.02 45.66 2d9v n GLY 120 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2d9v s ALA 121 N -1.00 -0.60 -0.02 4.61 0.00 -1.26 -4.85 121.76 118.64 2d9v s ALA 121 Ca 0.00 -0.12 0.16 0.00 0.00 0.00 0.00 51.96 52.00 2d9v s ALA 121 Cb 0.00 0.37 -0.25 0.00 0.00 0.00 0.00 23.12 23.24 2d9v s ALA 121 CO 0.00 -0.44 0.35 -2.37 0.00 0.00 0.00 175.76 173.30 2d9v n THR 122 N 0.44 0.00 -4.07 0.00 5.66 -1.26 -4.95 114.28 110.11 2d9v n THR 122 Ca -0.18 -0.36 -0.35 0.00 -3.05 0.00 0.00 64.05 60.11 2d9v n THR 122 Cb 0.60 0.14 -0.09 0.00 -1.55 0.00 0.00 70.33 69.43 2d9v n THR 122 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 2d9v s VAL 123 N -3.10 4.78 0.79 1.08 0.11 -1.26 -5.11 120.40 117.68 2d9v s VAL 123 Ca -0.06 -0.05 -0.13 0.00 -2.93 0.00 0.00 61.98 58.81 2d9v s VAL 123 Cb 0.10 -3.12 0.20 0.00 -1.53 0.00 0.00 36.38 32.03 2d9v s VAL 123 CO 0.66 0.51 0.70 -0.81 -3.33 0.00 0.00 175.10 172.83 2d9v n PRO 124 N 3.07 -2.38 -3.64 1.54 -0.04 -1.26 -5.10 135.00 127.18 2d9v n PRO 124 Ca -0.17 -1.12 -0.09 0.00 -0.04 0.00 0.00 63.50 62.08 2d9v n PRO 124 Cb 0.53 -1.05 -0.07 0.00 -0.04 0.00 0.00 33.50 32.87 2d9v n PRO 124 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2d9v s SER 125 N -3.39 -0.86 0.37 3.54 0.15 -1.26 -5.18 113.70 107.08 2d9v s SER 125 Ca 0.45 1.45 0.08 0.00 0.70 0.00 0.00 55.95 58.63 2d9v s SER 125 Cb -0.04 1.36 -0.04 0.00 -1.71 0.00 0.00 66.02 65.58 2d9v s SER 125 CO 0.35 -0.24 0.16 -0.83 1.20 0.00 0.00 173.24 173.88 2d9v s GLY 126 N 1.25 2.09 0.14 9.45 0.00 -1.26 -5.10 107.32 113.89 2d9v s GLY 126 Ca -0.07 -1.93 -0.31 0.00 0.00 0.00 0.00 44.72 42.42 2d9v s GLY 126 CO -0.13 -1.81 1.34 2.56 0.00 0.00 0.00 173.10 175.06 2d9v s PRO 127 N -3.87 4.36 -0.53 2.90 0.04 -1.26 -4.99 135.00 131.65 2d9v s PRO 127 Ca 0.39 2.04 -0.19 0.00 0.04 0.00 0.00 61.00 63.28 2d9v s PRO 127 Cb -0.00 -3.24 0.07 0.00 0.04 0.00 0.00 34.50 31.37 2d9v s PRO 127 CO 0.23 -0.35 0.64 0.45 0.04 0.00 0.00 177.00 178.01 2d9v s SER 128 N 0.82 6.21 -1.80 6.66 0.15 -1.26 -4.47 113.70 120.02 2d9v s SER 128 Ca 0.61 -1.04 -0.18 0.00 0.70 0.00 0.00 55.95 56.04 2d9v s SER 128 Cb -0.36 -2.29 0.18 0.00 -1.71 0.00 0.00 66.02 61.84 2d9v s SER 128 CO 0.33 -0.94 0.49 -1.54 1.20 0.00 0.00 173.24 172.77 2d9v n SER 129 N 6.21 -1.34 -0.66 5.45 3.41 -1.26 -5.28 113.62 120.15 2d9v n SER 129 Ca -0.07 -1.23 0.08 0.00 -0.26 0.00 0.00 58.87 57.39 2d9v n SER 129 Cb 0.45 -1.71 0.07 0.00 -0.26 0.00 0.00 64.21 62.75 2d9v n SER 129 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49