#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 6.23 0.08 1.61 0.01 -1.26 -5.10 113.70 115.28 2d9v s SER 2 Ca 0.00 0.34 -0.18 0.00 1.31 0.00 0.00 55.95 57.42 2d9v s SER 2 Cb 0.00 -1.95 -0.07 0.00 0.21 0.00 0.00 66.02 64.22 2d9v s SER 2 CO 0.00 0.31 0.55 -0.55 0.41 0.00 0.00 173.24 173.96 2d9v s SER 3 N -1.64 6.99 0.00 2.44 0.15 -1.26 -4.96 113.70 115.41 2d9v s SER 3 Ca 0.23 1.19 0.00 0.00 0.70 0.00 0.00 55.95 58.07 2d9v s SER 3 Cb -0.12 -2.33 0.00 0.00 -1.71 0.00 0.00 66.02 61.85 2d9v s SER 3 CO 0.14 0.24 0.00 0.61 1.20 0.00 0.00 173.24 175.43 2d9v n GLY 4 N 1.51 -0.60 3.75 9.45 0.00 -1.26 -5.00 105.19 113.05 2d9v n GLY 4 Ca -0.10 0.16 -0.27 0.00 0.00 0.00 0.00 46.02 45.81 2d9v n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2d9v n SER 5 N -0.98 -1.49 -0.10 1.61 3.41 -1.26 -4.74 113.62 110.07 2d9v n SER 5 Ca 0.00 -0.63 -0.21 0.00 -0.26 0.00 0.00 58.87 57.77 2d9v n SER 5 Cb 0.00 -1.34 -0.07 0.00 -0.26 0.00 0.00 64.21 62.53 2d9v n SER 5 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2d9v n SER 6 N -2.04 1.49 0.00 4.04 7.64 -1.26 -5.06 113.62 118.43 2d9v n SER 6 Ca 0.08 0.26 0.00 0.00 1.01 0.00 0.00 58.87 60.21 2d9v n SER 6 Cb 0.45 -0.62 0.00 0.00 -1.01 0.00 0.00 64.21 63.04 2d9v n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2d9v n GLY 7 N 1.71 3.67 3.77 0.23 0.00 -1.26 -5.07 105.19 108.24 2d9v n GLY 7 Ca -0.39 -0.91 -0.34 0.00 0.00 0.00 0.00 46.02 44.39 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 3.90 -0.16 0.99 2.96 -1.26 -0.83 118.68 124.27 2d9v s LEU 8 Ca 0.00 0.19 -0.14 0.00 -0.22 0.00 0.00 54.13 53.96 2d9v s LEU 8 Cb 0.00 -2.15 -0.06 0.00 0.50 0.00 0.00 46.19 44.48 2d9v s LEU 8 CO 0.00 0.31 -0.30 0.52 -1.32 0.00 0.00 176.35 175.57 2d9v n VAL 9 N 1.50 1.42 -4.01 1.68 0.31 -0.14 -4.91 118.33 114.17 2d9v n VAL 9 Ca -0.15 0.06 -0.08 0.00 -0.01 0.00 0.00 64.34 64.15 2d9v n VAL 9 Cb 0.53 -2.13 -0.10 0.00 -0.91 0.00 0.00 33.84 31.23 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 -2.68 0.49 -0.44 5.55 3.52 -1.26 -4.99 118.95 119.14 2d9v s ARG 10 Ca -0.26 -0.89 0.05 0.00 -0.13 0.00 0.00 55.73 54.50 2d9v s ARG 10 Cb 0.06 0.18 0.17 0.00 -1.56 0.00 0.00 34.95 33.80 2d9v s ARG 10 CO 0.37 -0.10 0.50 0.20 -0.81 0.00 0.00 175.30 175.46 2d9v s GLY 11 N -2.20 -0.01 0.24 8.12 0.00 -1.26 -2.70 107.32 109.50 2d9v s GLY 11 Ca -0.04 -1.34 0.10 0.00 0.00 0.00 0.00 44.72 43.44 2d9v s GLY 11 CO -0.05 2.85 -0.17 -0.32 0.00 0.00 0.00 173.10 175.41 2d9v s GLY 12 N 0.69 1.64 0.01 0.20 0.00 -1.18 -4.97 107.32 103.70 2d9v s GLY 12 Ca 0.28 -1.76 -0.24 0.00 0.00 0.00 0.00 44.72 43.00 2d9v s GLY 12 CO -0.10 -1.85 0.72 -0.98 0.00 0.00 0.00 173.10 170.88 2d9v s TRP 13 N -2.76 3.69 0.02 1.90 0.52 -1.26 -2.61 118.94 118.43 2d9v s TRP 13 Ca 0.26 1.37 0.01 0.00 0.02 0.00 0.00 56.10 57.76 2d9v s TRP 13 Cb -0.03 -2.78 -0.01 0.00 -1.15 0.00 0.00 33.47 29.50 2d9v s TRP 13 CO 0.11 0.24 -0.05 -0.51 0.02 0.00 0.00 176.95 176.75 2d9v s LEU 14 N 0.14 2.13 -0.15 2.99 1.43 -0.76 -4.90 118.68 119.57 2d9v s LEU 14 Ca 0.37 -0.31 -0.27 0.00 -1.03 0.00 0.00 54.13 52.89 2d9v s LEU 14 Cb -0.19 -0.16 -0.01 0.00 0.03 0.00 0.00 46.19 45.86 2d9v s LEU 14 CO 0.21 -0.09 0.93 0.26 0.23 0.00 0.00 176.35 177.88 2d9v s TRP 15 N -0.76 3.45 0.15 0.29 0.52 -0.95 -2.76 118.94 118.88 2d9v s TRP 15 Ca -0.05 1.42 0.07 0.00 0.02 0.00 0.00 56.10 57.56 2d9v s TRP 15 Cb -0.06 -3.11 -0.04 0.00 -1.15 0.00 0.00 33.47 29.11 2d9v s TRP 15 CO -0.00 -0.26 -0.02 0.50 0.02 0.00 0.00 176.95 177.19 2d9v s ARG 16 N 2.20 2.38 -0.06 4.98 3.52 -0.29 0.10 118.95 131.77 2d9v s ARG 16 Ca 0.43 -1.05 0.00 0.00 -0.13 0.00 0.00 55.73 54.98 2d9v s ARG 16 Cb -0.17 -2.37 -0.03 0.00 -1.56 0.00 0.00 34.95 30.81 2d9v s ARG 16 CO 0.14 0.48 -0.05 -1.14 -0.81 0.00 0.00 175.30 173.92 2d9v s GLN 17 N -2.73 2.79 0.40 5.12 0.74 -1.19 -1.26 119.66 123.53 2d9v s GLN 17 Ca 0.26 -0.53 -0.00 0.00 0.05 0.00 0.00 55.36 55.14 2d9v s GLN 17 Cb -0.10 -2.64 0.08 0.00 1.10 0.00 0.00 33.01 31.45 2d9v s GLN 17 CO 0.18 0.67 0.54 0.45 -0.55 0.00 0.00 175.29 176.58 2d9v n SER 18 N 2.12 0.73 0.00 6.67 2.88 -1.18 -4.89 113.62 119.95 2d9v n SER 18 Ca -0.18 -1.62 0.00 0.00 -1.33 0.00 0.00 58.87 55.75 2d9v n SER 18 Cb 0.53 -0.35 0.00 0.00 -0.75 0.00 0.00 64.21 63.64 2d9v n SER 18 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2d9v n SER 19 N -2.95 0.33 -0.11 -3.46 3.41 -1.26 -4.17 113.62 105.41 2d9v n SER 19 Ca 0.09 -0.34 -0.15 0.00 -0.26 0.00 0.00 58.87 58.22 2d9v n SER 19 Cb 0.32 0.74 -0.11 0.00 -0.26 0.00 0.00 64.21 64.90 2d9v n SER 19 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 2d9v n ILE 20 N -0.77 1.28 -0.01 -1.33 -0.00 -1.26 -4.60 119.36 112.66 2d9v n ILE 20 Ca 0.00 -0.53 0.09 0.00 -0.00 0.00 0.00 62.75 62.31 2d9v n ILE 20 Cb 0.00 -1.18 -0.15 0.00 -0.00 0.00 0.00 39.64 38.31 2d9v n ILE 20 CO 0.00 0.00 0.00 0.18 -0.00 0.00 0.00 176.55 176.73 2d9v n LEU 21 N -3.08 0.00 -2.23 1.39 4.77 -1.26 -4.98 117.00 111.61 2d9v n LEU 21 Ca -0.38 0.00 -0.20 0.00 -0.03 0.00 0.00 56.01 55.40 2d9v n LEU 21 Cb 0.95 0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 42.03 2d9v n LEU 21 CO 0.25 0.02 -0.24 0.54 -1.33 0.00 0.00 177.39 176.62 2d9v n ARG 22 N -2.21 -1.68 -4.34 3.23 1.74 -1.26 -4.97 116.66 107.17 2d9v n ARG 22 Ca -0.05 1.01 -0.29 0.00 -0.77 0.00 0.00 57.85 57.76 2d9v n ARG 22 Cb 0.54 -5.61 -0.12 0.00 -1.02 0.00 0.00 32.46 26.25 2d9v n ARG 22 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2d9v s ARG 23 N -4.76 1.65 0.70 5.56 0.52 -1.26 -4.85 118.95 116.51 2d9v s ARG 23 Ca 0.00 -1.26 -0.11 0.00 -0.52 0.00 0.00 55.73 53.84 2d9v s ARG 23 Cb 0.00 -2.03 0.01 0.00 0.52 0.00 0.00 34.95 33.45 2d9v s ARG 23 CO 0.00 0.46 1.07 -1.58 0.02 0.00 0.00 175.30 175.27 2d9v s TRP 24 N -1.16 3.17 0.14 -0.53 0.52 -1.26 -3.11 118.94 116.70 2d9v s TRP 24 Ca 0.17 1.30 -0.21 0.00 0.02 0.00 0.00 56.10 57.39 2d9v s TRP 24 Cb -0.10 -2.92 0.06 0.00 -1.15 0.00 0.00 33.47 29.36 2d9v s TRP 24 CO 0.09 -1.24 0.53 -1.59 0.02 0.00 0.00 176.95 174.76 2d9v s LYS 25 N -5.12 1.20 0.05 4.98 0.00 -0.39 -4.95 119.74 115.50 2d9v s LYS 25 Ca 0.58 -0.53 -0.18 0.00 0.00 0.00 0.00 55.97 55.84 2d9v s LYS 25 Cb -0.13 0.54 -0.06 0.00 0.00 0.00 0.00 37.83 38.18 2d9v s LYS 25 CO 0.54 -0.50 0.51 1.03 0.00 0.00 0.00 175.35 176.93 2d9v s ARG 26 N -3.69 4.09 -0.05 1.78 0.52 -1.26 -1.14 118.95 119.20 2d9v s ARG 26 Ca 0.01 0.61 -0.22 0.00 -0.52 0.00 0.00 55.73 55.62 2d9v s ARG 26 Cb -0.00 -3.22 0.05 0.00 0.52 0.00 0.00 34.95 32.29 2d9v s ARG 26 CO -0.12 0.66 0.48 1.21 0.02 0.00 0.00 175.30 177.55 2d9v s ASN 27 N -1.12 -0.42 -0.47 0.23 2.47 -1.11 -4.92 114.94 109.59 2d9v s ASN 27 Ca 0.27 0.44 -0.17 0.00 0.42 0.00 0.00 52.86 53.83 2d9v s ASN 27 Cb -0.18 0.48 0.06 0.00 -1.45 0.00 0.00 41.25 40.16 2d9v s ASN 27 CO 0.17 -0.49 0.47 0.86 -3.72 0.00 0.00 177.10 174.39 2d9v s TRP 28 N -1.11 3.17 -0.18 0.43 -0.00 -0.81 -1.83 118.94 118.62 2d9v s TRP 28 Ca -0.11 -0.73 -0.16 0.00 -0.00 0.00 0.00 56.10 55.10 2d9v s TRP 28 Cb -0.03 -3.23 -0.04 0.00 -0.00 0.00 0.00 33.47 30.17 2d9v s TRP 28 CO 0.06 -0.85 0.39 -0.06 -0.00 0.00 0.00 176.95 176.49 2d9v s PHE 29 N 2.01 3.42 0.03 5.86 0.40 -1.07 -2.27 117.98 126.35 2d9v s PHE 29 Ca 0.08 0.66 0.05 0.00 -0.60 0.00 0.00 56.93 57.12 2d9v s PHE 29 Cb -0.22 -2.49 -0.02 0.00 0.51 0.00 0.00 43.02 40.80 2d9v s PHE 29 CO 0.09 0.08 -0.14 0.00 0.70 0.00 0.00 175.22 175.95 2d9v s ALA 30 N 1.00 1.18 -0.10 5.36 0.00 -1.08 -3.10 121.76 125.01 2d9v s ALA 30 Ca 0.20 -0.78 -0.01 0.00 0.00 0.00 0.00 51.96 51.36 2d9v s ALA 30 Cb -0.14 -0.21 -0.03 0.00 0.00 0.00 0.00 23.12 22.74 2d9v s ALA 30 CO 0.07 0.24 -0.05 -1.17 0.00 0.00 0.00 175.76 174.85 2d9v s LEU 31 N -0.97 3.25 0.02 0.00 2.96 -1.10 -2.97 118.68 119.88 2d9v s LEU 31 Ca 0.03 -0.03 0.02 0.00 -0.22 0.00 0.00 54.13 53.92 2d9v s LEU 31 Cb -0.07 -1.74 -0.04 0.00 0.50 0.00 0.00 46.19 44.84 2d9v s LEU 31 CO 0.01 0.30 0.02 0.26 -1.32 0.00 0.00 176.35 175.62 2d9v s TRP 32 N -0.43 3.09 0.52 5.38 0.52 -0.87 -0.97 118.94 126.19 2d9v s TRP 32 Ca 0.07 0.07 0.17 0.00 0.02 0.00 0.00 56.10 56.43 2d9v s TRP 32 Cb -0.12 -1.65 1.30 0.00 -1.15 0.00 0.00 33.47 31.85 2d9v s TRP 32 CO 0.02 0.48 2.15 -0.07 0.02 0.00 0.00 176.95 179.55 2d9v h LEU 33 N 4.07 0.00 -1.41 2.99 3.38 -1.31 -1.04 115.31 121.99 2d9v h LEU 33 Ca -0.49 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.48 2d9v h LEU 33 Cb 1.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.92 2d9v h LEU 33 CO 0.59 0.01 0.18 0.44 0.09 0.00 0.00 178.44 179.74 2d9v h ASP 34 N 0.00 0.00 -0.36 -0.43 5.19 -1.95 -3.45 116.42 115.43 2d9v h ASP 34 Ca -0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2d9v h ASP 34 Cb 0.01 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.52 2d9v h ASP 34 CO 0.00 0.00 0.00 0.61 -3.12 0.00 0.00 179.24 176.73 2d9v n GLY 35 N -1.26 0.94 3.11 2.75 0.00 -0.40 -4.87 105.19 105.47 2d9v n GLY 35 Ca -0.01 -0.22 -0.13 0.00 0.00 0.00 0.00 46.02 45.66 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 -2.27 0.67 -0.23 2.61 -4.23 -1.21 -0.59 115.64 110.38 2d9v s THR 36 Ca 0.00 -1.41 0.01 0.00 -1.18 0.00 0.00 61.69 59.12 2d9v s THR 36 Cb 0.00 -1.04 0.06 0.00 1.34 0.00 0.00 72.50 72.86 2d9v s THR 36 CO 0.00 -0.53 -0.08 -0.22 -0.54 0.00 0.00 174.62 173.25 2d9v s LEU 37 N -2.11 2.75 -0.02 4.79 2.96 0.06 -2.05 118.68 125.06 2d9v s LEU 37 Ca -0.01 -1.17 0.07 0.00 -0.22 0.00 0.00 54.13 52.79 2d9v s LEU 37 Cb -0.05 -1.29 -0.02 0.00 0.50 0.00 0.00 46.19 45.33 2d9v s LEU 37 CO -0.01 -0.20 -0.22 -0.83 -1.32 0.00 0.00 176.35 173.77 2d9v s GLY 38 N 1.31 1.08 -0.04 7.98 0.00 -1.16 -1.09 107.32 115.40 2d9v s GLY 38 Ca -0.06 -0.94 0.06 0.00 0.00 0.00 0.00 44.72 43.78 2d9v s GLY 38 CO -0.06 -0.76 -0.21 -2.52 0.00 0.00 0.00 173.10 169.55 2d9v s TYR 39 N -0.47 2.50 0.06 1.90 1.13 -1.23 -2.65 117.35 118.59 2d9v s TYR 39 Ca 0.07 -0.43 0.05 0.00 -1.41 0.00 0.00 57.07 55.35 2d9v s TYR 39 Cb -0.09 -1.58 -0.03 0.00 -1.10 0.00 0.00 41.96 39.16 2d9v s TYR 39 CO -0.00 -0.02 -0.13 0.71 -2.51 0.00 0.00 175.55 173.59 2d9v s TYR 40 N -0.49 1.16 0.05 -3.49 1.51 -0.96 -3.39 117.35 111.73 2d9v s TYR 40 Ca 0.06 -0.42 -0.09 0.00 -1.01 0.00 0.00 57.07 55.62 2d9v s TYR 40 Cb -0.11 -0.67 -0.02 0.00 -0.11 0.00 0.00 41.96 41.05 2d9v s TYR 40 CO 0.01 0.04 0.88 0.72 -1.11 0.00 0.00 175.55 176.08 2d9v n HIS 41 N 1.55 -0.13 -4.71 2.71 8.25 -1.26 -1.93 115.22 119.70 2d9v n HIS 41 Ca -0.20 0.36 -0.32 0.00 -0.26 0.00 0.00 57.72 57.30 2d9v n HIS 41 Cb 0.54 -0.44 -0.07 0.00 1.12 0.00 0.00 29.99 31.14 2d9v n HIS 41 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2d9v s ASP 42 N -3.94 3.80 0.57 0.41 2.15 -1.26 -3.47 116.67 114.92 2d9v s ASP 42 Ca -0.03 -1.71 0.37 0.00 0.43 0.00 0.00 52.55 51.61 2d9v s ASP 42 Cb 0.03 0.65 1.48 0.00 -0.30 0.00 0.00 42.92 44.79 2d9v s ASP 42 CO 0.18 -0.94 1.68 1.05 -0.17 0.00 0.00 175.17 176.97 2d9v h GLU 43 N 1.41 0.00 -6.38 4.34 4.11 -1.92 -3.37 114.58 112.78 2d9v h GLU 43 Ca -0.41 0.00 -0.57 0.00 0.07 0.00 0.00 59.36 58.45 2d9v h GLU 43 Cb 1.31 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.50 2d9v h GLU 43 CO 0.67 0.00 0.90 0.95 0.07 0.00 0.00 179.01 181.60 2d9v s THR 44 N -4.79 4.35 -0.74 -1.06 -4.23 -1.26 -4.92 115.64 102.99 2d9v s THR 44 Ca -0.04 1.53 -0.07 0.00 -1.18 0.00 0.00 61.69 61.92 2d9v s THR 44 Cb 0.21 -4.36 -0.15 0.00 1.34 0.00 0.00 72.50 69.54 2d9v s THR 44 CO 0.73 -0.55 3.23 0.00 -0.54 0.00 0.00 174.62 177.50 2d9v n ALA 45 N 7.24 6.87 -0.04 3.99 0.00 -1.26 -4.26 120.51 133.04 2d9v n ALA 45 Ca 0.13 -2.71 -0.16 0.00 0.00 0.00 0.00 53.44 50.69 2d9v n ALA 45 Cb 0.47 -2.73 -0.14 0.00 0.00 0.00 0.00 19.45 17.05 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 2.72 0.70 -3.40 0.00 6.02 -1.26 -4.60 117.38 117.56 2d9v n GLN 46 Ca 0.58 0.21 -0.39 0.00 -0.01 0.00 0.00 57.00 57.40 2d9v n GLN 46 Cb 0.59 -1.66 -0.03 0.00 1.02 0.00 0.00 30.24 30.15 2d9v n GLN 46 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 2d9v n ASP 47 N -3.24 4.99 -4.61 1.08 8.00 -1.26 -5.03 116.55 116.48 2d9v n ASP 47 Ca -0.32 -3.21 -0.43 0.00 0.71 0.00 0.00 54.79 51.54 2d9v n ASP 47 Cb 1.05 -1.14 -0.03 0.00 -0.02 0.00 0.00 41.12 40.98 2d9v n ASP 47 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 2d9v n GLU 48 N 1.99 2.12 0.00 -1.24 2.13 -1.26 -4.27 120.64 120.12 2d9v n GLU 48 Ca 0.24 0.63 -0.18 0.00 0.66 0.00 0.00 57.16 58.51 2d9v n GLU 48 Cb 0.37 -3.20 -0.14 0.00 0.27 0.00 0.00 31.44 28.74 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 14.32 0.19 -2.21 5.31 5.08 -1.96 -3.50 114.58 131.81 2d9v h GLU 49 Ca -0.43 -0.32 0.21 0.00 -1.00 0.00 0.00 59.36 57.83 2d9v h GLU 49 Cb 1.24 0.12 -0.07 0.00 0.50 0.00 0.00 28.75 30.54 2d9v h GLU 49 CO 0.96 1.15 0.61 0.34 -1.00 0.00 0.00 179.01 181.07 2d9v s ASP 50 N -6.73 -0.08 -0.23 1.42 -1.08 -1.26 -5.08 116.67 103.64 2d9v s ASP 50 Ca -0.16 -0.43 -0.06 0.00 -0.52 0.00 0.00 52.55 51.38 2d9v s ASP 50 Cb -0.00 0.40 0.11 0.00 -1.46 0.00 0.00 42.92 41.98 2d9v s ASP 50 CO 0.77 -0.77 0.46 -0.60 0.52 0.00 0.00 175.17 175.55 2d9v s ARG 51 N -2.66 0.38 0.42 4.34 3.52 -1.26 -3.57 118.95 120.12 2d9v s ARG 51 Ca 0.17 1.01 0.08 0.00 -0.13 0.00 0.00 55.73 56.86 2d9v s ARG 51 Cb -0.00 0.29 -0.02 0.00 -1.56 0.00 0.00 34.95 33.66 2d9v s ARG 51 CO 0.02 -0.34 0.37 0.14 -0.81 0.00 0.00 175.30 174.68 2d9v s VAL 52 N 2.66 2.59 -0.02 7.11 -7.23 -0.25 -4.94 120.40 120.32 2d9v s VAL 52 Ca 0.02 -1.38 -0.11 0.00 -1.81 0.00 0.00 61.98 58.70 2d9v s VAL 52 Cb -0.13 -2.96 -0.05 0.00 0.56 0.00 0.00 36.38 33.80 2d9v s VAL 52 CO -0.15 0.00 0.33 -0.69 -0.31 0.00 0.00 175.10 174.28 2d9v s VAL 53 N -2.50 5.18 -0.12 1.32 1.01 -1.26 -0.76 120.40 123.27 2d9v s VAL 53 Ca 0.47 0.57 0.01 0.00 0.00 0.00 0.00 61.98 63.04 2d9v s VAL 53 Cb -0.03 -3.61 -0.08 0.00 0.00 0.00 0.00 36.38 32.66 2d9v s VAL 53 CO 0.27 0.54 -0.11 -0.38 0.00 0.00 0.00 175.10 175.42 2d9v n ILE 54 N 1.69 0.72 -1.68 2.22 2.08 0.24 -4.64 119.36 119.98 2d9v n ILE 54 Ca -0.15 -0.28 -0.48 0.00 0.56 0.00 0.00 62.75 62.41 2d9v n ILE 54 Cb 0.53 -0.94 -0.04 0.00 -0.75 0.00 0.00 39.64 38.44 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 -2.85 2.36 -3.93 1.39 -0.00 -0.98 -2.22 115.22 108.98 2d9v n HIS 55 Ca -0.22 -0.06 -0.29 0.00 -0.00 0.00 0.00 57.72 57.15 2d9v n HIS 55 Cb 0.74 -2.69 -0.07 0.00 -0.00 0.00 0.00 29.99 27.97 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 6.82 -0.96 0.00 1.57 3.01 0.61 -4.71 117.46 123.80 2d9v n PHE 56 Ca 0.22 0.51 0.00 0.00 1.01 0.00 0.00 57.45 59.20 2d9v n PHE 56 Cb 0.31 -1.87 0.00 0.00 -0.01 0.00 0.00 39.48 37.91 2d9v n PHE 56 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 2d9v n ASN 57 N -2.02 0.95 -4.49 4.37 5.15 -0.94 -4.92 115.26 113.36 2d9v n ASN 57 Ca -0.09 -0.26 -0.43 0.00 -0.60 0.00 0.00 54.58 53.20 2d9v n ASN 57 Cb 0.46 0.72 -0.03 0.00 -0.53 0.00 0.00 39.78 40.40 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 -0.91 4.22 0.12 3.44 1.01 -1.25 0.53 120.40 127.56 2d9v s VAL 58 Ca 0.00 -0.48 -0.16 0.00 0.00 0.00 0.00 61.98 61.34 2d9v s VAL 58 Cb 0.00 -4.80 -0.02 0.00 0.00 0.00 0.00 36.38 31.56 2d9v s VAL 58 CO 0.00 -1.61 1.61 -0.09 0.00 0.00 0.00 175.10 175.01 2d9v h ARG 59 N 9.56 0.61 -2.65 2.72 9.65 -1.00 -3.47 114.38 129.79 2d9v h ARG 59 Ca -0.14 -0.15 0.10 0.00 -1.10 0.00 0.00 59.98 58.68 2d9v h ARG 59 Cb 1.05 -0.08 -0.09 0.00 -1.39 0.00 0.00 29.97 29.46 2d9v h ARG 59 CO 1.22 0.66 0.36 0.34 2.80 0.00 0.00 179.97 185.35 2d9v s ASP 60 N -6.00 -0.31 -0.10 -3.80 2.15 -1.24 -5.02 116.67 102.35 2d9v s ASP 60 Ca -0.13 -0.31 -0.04 0.00 0.43 0.00 0.00 52.55 52.50 2d9v s ASP 60 Cb 0.10 0.56 0.05 0.00 -0.30 0.00 0.00 42.92 43.33 2d9v s ASP 60 CO 0.77 -1.00 0.19 -0.63 -0.17 0.00 0.00 175.17 174.33 2d9v s ILE 61 N -3.53 -0.30 -0.03 4.11 1.01 -1.26 -0.61 121.20 120.58 2d9v s ILE 61 Ca 0.08 0.32 -0.00 0.00 0.00 0.00 0.00 60.65 61.06 2d9v s ILE 61 Cb -0.03 -0.34 -0.04 0.00 0.01 0.00 0.00 42.46 42.07 2d9v s ILE 61 CO -0.01 0.13 0.02 -0.54 0.00 0.00 0.00 174.94 174.54 2d9v s LYS 62 N 2.27 2.91 -0.03 2.79 1.02 -0.56 -5.00 119.74 123.14 2d9v s LYS 62 Ca 0.02 -0.51 -0.01 0.00 0.02 0.00 0.00 55.97 55.48 2d9v s LYS 62 Cb -0.12 -2.75 0.02 0.00 -0.52 0.00 0.00 37.83 34.46 2d9v s LYS 62 CO -0.07 0.66 0.07 0.08 -0.92 0.00 0.00 175.35 175.17 2d9v s VAL 63 N -1.04 -0.04 0.00 3.17 1.01 -1.26 -1.18 120.40 121.07 2d9v s VAL 63 Ca 0.18 0.14 0.00 0.00 0.00 0.00 0.00 61.98 62.30 2d9v s VAL 63 Cb -0.12 -0.13 0.00 0.00 0.00 0.00 0.00 36.38 36.14 2d9v s VAL 63 CO 0.08 0.06 0.00 0.61 0.00 0.00 0.00 175.10 175.85 2d9v n GLY 64 N 3.82 2.31 0.31 4.51 0.00 0.03 -2.88 105.19 113.30 2d9v n GLY 64 Ca -0.22 -0.49 0.31 0.00 0.00 0.00 0.00 46.02 45.61 2d9v n GLY 64 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2d9v n GLN 65 N 13.43 -0.05 -0.37 1.61 10.64 -1.26 -0.20 117.38 141.17 2d9v n GLN 65 Ca 0.00 1.28 -0.01 0.00 -1.83 0.00 0.00 57.00 56.44 2d9v n GLN 65 Cb 0.00 -2.32 0.04 0.00 -0.86 0.00 0.00 30.24 27.10 2d9v n GLN 65 CO 0.00 0.00 0.00 0.93 -1.83 0.00 0.00 177.06 176.16 2d9v h GLU 66 N 0.00 -0.01 0.12 2.61 4.39 -1.91 -2.81 114.58 116.97 2d9v h GLU 66 Ca 0.80 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 60.49 2d9v h GLU 66 Cb 2.16 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.81 2d9v h GLU 66 CO -0.70 -0.01 -0.06 0.00 -1.16 0.00 0.00 179.01 177.09 2d9v n GLN 68 N -3.06 -2.42 0.00 0.00 -0.06 -1.06 -4.67 117.38 106.10 2d9v n GLN 68 Ca -0.02 0.18 0.00 0.00 -2.00 0.00 0.00 57.00 55.16 2d9v n GLN 68 Cb 0.07 -4.74 0.00 0.00 -4.06 0.00 0.00 30.24 21.50 2d9v n GLN 68 CO 0.00 0.00 0.00 -0.40 -0.20 0.00 0.00 177.06 176.46 2d9v n ASP 69 N -1.92 3.89 -4.88 1.69 5.75 -1.26 -5.06 116.55 114.76 2d9v n ASP 69 Ca 0.02 0.00 -0.33 0.00 -0.01 0.00 0.00 54.79 54.47 2d9v n ASP 69 Cb 0.50 0.38 -0.05 0.00 -1.03 0.00 0.00 41.12 40.92 2d9v n ASP 69 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 2d9v s VAL 70 N -1.78 5.03 -0.28 2.12 1.01 -1.26 -5.06 120.40 120.18 2d9v s VAL 70 Ca 0.00 0.39 -0.21 0.00 0.00 0.00 0.00 61.98 62.16 2d9v s VAL 70 Cb 0.00 -3.64 -0.01 0.00 0.00 0.00 0.00 36.38 32.73 2d9v s VAL 70 CO 0.00 0.09 0.68 -1.10 0.00 0.00 0.00 175.10 174.77 2d9v s GLN 71 N -2.44 4.04 0.23 2.72 -0.21 -1.26 -5.04 119.66 117.70 2d9v s GLN 71 Ca 0.41 0.54 -0.30 0.00 0.02 0.00 0.00 55.36 56.03 2d9v s GLN 71 Cb -0.13 -3.68 -0.09 0.00 1.00 0.00 0.00 33.01 30.11 2d9v s GLN 71 CO 0.21 -0.51 1.28 -1.25 -2.12 0.00 0.00 175.29 172.90 2d9v s PRO 72 N 2.65 4.41 1.05 2.91 0.04 -1.26 -5.03 135.00 139.77 2d9v s PRO 72 Ca 0.28 2.05 -0.18 0.00 0.04 0.00 0.00 61.00 63.19 2d9v s PRO 72 Cb -0.15 -3.18 0.26 0.00 0.04 0.00 0.00 34.50 31.47 2d9v s PRO 72 CO 0.10 -0.18 0.92 -0.35 0.04 0.00 0.00 177.00 177.53 2d9v n PRO 73 N 2.16 -2.84 -2.46 0.56 -0.04 -1.26 -4.97 135.00 126.15 2d9v n PRO 73 Ca 0.04 -1.48 -0.42 0.00 -0.04 0.00 0.00 63.50 61.60 2d9v n PRO 73 Cb 0.43 -1.39 -0.03 0.00 -0.04 0.00 0.00 33.50 32.47 2d9v n PRO 73 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 2d9v s GLU 74 N -5.10 4.47 0.00 0.54 -6.30 -1.26 -3.87 118.70 107.18 2d9v s GLU 74 Ca 0.60 1.74 0.00 0.00 -2.50 0.00 0.00 54.97 54.81 2d9v s GLU 74 Cb -0.06 -3.34 0.00 0.00 0.00 0.00 0.00 34.13 30.73 2d9v s GLU 74 CO 0.46 -0.18 0.00 0.41 0.02 0.00 0.00 175.26 175.97 2d9v n GLY 75 N 2.96 2.49 1.55 -1.50 0.00 -1.26 -5.02 105.19 104.41 2d9v n GLY 75 Ca 0.08 -0.57 -0.09 0.00 0.00 0.00 0.00 46.02 45.43 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 -1.14 -4.19 1.61 3.00 -1.25 -5.04 116.66 109.64 2d9v n ARG 76 Ca 0.00 -0.43 -0.14 0.00 -0.01 0.00 0.00 57.85 57.27 2d9v n ARG 76 Cb 0.00 -0.78 -0.11 0.00 0.00 0.00 0.00 32.46 31.57 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 -1.89 1.49 0.09 0.55 0.01 -1.26 -4.91 113.70 107.78 2d9v s SER 77 Ca 0.20 -0.88 -0.25 0.00 1.31 0.00 0.00 55.95 56.33 2d9v s SER 77 Cb -0.03 0.01 -0.14 0.00 0.21 0.00 0.00 66.02 66.07 2d9v s SER 77 CO 0.17 -0.30 1.71 0.03 0.41 0.00 0.00 173.24 175.26 2d9v h ARG 78 N 3.30 -0.17 0.00 12.44 3.08 -1.96 -1.04 114.38 130.03 2d9v h ARG 78 Ca -0.37 0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.69 2d9v h ARG 78 Cb 1.19 0.04 0.00 0.00 0.08 0.00 0.00 29.97 31.27 2d9v h ARG 78 CO 0.57 -0.11 0.16 -0.25 -1.07 0.00 0.00 179.97 179.27 2d9v n ASP 79 N -5.18 0.36 0.14 7.04 8.00 -1.26 -0.25 116.55 125.39 2d9v n ASP 79 Ca -0.08 0.60 0.02 0.00 0.71 0.00 0.00 54.79 56.04 2d9v n ASP 79 Cb 0.11 -0.60 0.08 0.00 -0.02 0.00 0.00 41.12 40.69 2d9v n ASP 79 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 2d9v h GLY 80 N 0.00 0.00 -5.74 0.44 0.00 -1.40 -3.28 103.07 93.09 2d9v h GLY 80 Ca 0.00 0.00 -0.69 0.00 0.00 0.00 0.00 47.33 46.64 2d9v h GLY 80 CO 0.00 0.00 0.69 1.04 0.00 0.00 0.00 176.54 178.27 2d9v n LEU 81 N -3.30 2.16 -3.79 3.11 4.32 0.65 -0.19 117.00 119.95 2d9v n LEU 81 Ca 0.01 1.09 -0.25 0.00 -0.02 0.00 0.00 56.01 56.84 2d9v n LEU 81 Cb 0.71 -1.21 -0.17 0.00 -1.62 0.00 0.00 43.42 41.13 2d9v n LEU 81 CO 0.40 -0.70 -0.39 -0.22 -1.22 0.00 0.00 177.39 175.27 2d9v s LEU 82 N 1.84 0.91 -0.02 2.23 2.96 0.21 -0.79 118.68 126.02 2d9v s LEU 82 Ca 0.89 -0.36 0.07 0.00 -0.22 0.00 0.00 54.13 54.52 2d9v s LEU 82 Cb -0.95 -0.57 -0.02 0.00 0.50 0.00 0.00 46.19 45.14 2d9v s LEU 82 CO 0.53 -0.21 -0.24 -0.89 -1.32 0.00 0.00 176.35 174.22 2d9v s THR 83 N 1.88 1.90 0.13 3.68 2.01 -0.32 -0.95 115.64 123.97 2d9v s THR 83 Ca 0.03 -1.02 0.10 0.00 0.31 0.00 0.00 61.69 61.10 2d9v s THR 83 Cb -0.14 -1.58 -0.04 0.00 0.01 0.00 0.00 72.50 70.75 2d9v s THR 83 CO -0.07 0.54 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.51 2d9v s VAL 84 N -0.53 2.67 -0.19 3.82 1.01 -0.51 -1.50 120.40 125.18 2d9v s VAL 84 Ca 0.08 -1.61 -0.01 0.00 0.00 0.00 0.00 61.98 60.44 2d9v s VAL 84 Cb -0.10 -2.22 0.00 0.00 0.00 0.00 0.00 36.38 34.07 2d9v s VAL 84 CO -0.01 0.08 -0.12 0.20 0.00 0.00 0.00 175.10 175.25 2d9v s ASN 85 N -2.17 3.71 -0.10 3.32 0.01 0.22 -0.37 114.94 119.55 2d9v s ASN 85 Ca 0.17 -0.51 -0.04 0.00 -0.71 0.00 0.00 52.86 51.77 2d9v s ASN 85 Cb -0.10 -1.60 -0.04 0.00 0.41 0.00 0.00 41.25 39.92 2d9v s ASN 85 CO 0.09 0.00 0.07 -0.76 -1.51 0.00 0.00 177.10 174.99 2d9v s LEU 86 N 1.31 3.97 0.11 0.60 1.43 -1.17 -0.34 118.68 124.58 2d9v s LEU 86 Ca 0.04 0.30 -0.21 0.00 -1.03 0.00 0.00 54.13 53.23 2d9v s LEU 86 Cb -0.14 -1.94 -0.08 0.00 0.03 0.00 0.00 46.19 44.06 2d9v s LEU 86 CO -0.07 0.39 1.75 0.03 0.23 0.00 0.00 176.35 178.68 2d9v h ARG 87 N 5.12 0.14 -1.32 1.70 3.08 -0.25 -2.31 114.38 120.53 2d9v h ARG 87 Ca -0.52 -0.01 0.43 0.00 0.07 0.00 0.00 59.98 59.95 2d9v h ARG 87 Cb 1.21 -0.03 -0.10 0.00 0.08 0.00 0.00 29.97 31.13 2d9v h ARG 87 CO 0.56 0.09 0.89 -0.85 -1.07 0.00 0.00 179.97 179.59 2d9v n GLU 88 N -5.04 -0.02 0.00 0.04 0.28 -1.26 -4.66 120.64 109.98 2d9v n GLU 88 Ca -0.04 1.01 0.00 0.00 -0.16 0.00 0.00 57.16 57.97 2d9v n GLU 88 Cb 0.05 -2.09 0.00 0.00 1.43 0.00 0.00 31.44 30.83 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 -1.54 0.80 3.38 -1.84 0.00 -0.87 -5.14 105.19 99.97 2d9v n GLY 89 Ca 0.35 -0.14 0.02 0.00 0.00 0.00 0.00 46.02 46.25 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 -0.33 -0.86 0.47 1.61 0.15 -1.21 -5.05 113.70 108.48 2d9v s SER 90 Ca 0.00 0.94 -0.07 0.00 0.70 0.00 0.00 55.95 57.52 2d9v s SER 90 Cb 0.00 1.88 -0.05 0.00 -1.71 0.00 0.00 66.02 66.14 2d9v s SER 90 CO 0.00 -0.16 0.79 0.00 1.20 0.00 0.00 173.24 175.07 2d9v s ARG 91 N 2.72 3.62 -0.20 5.44 1.70 -1.26 -3.06 118.95 127.90 2d9v s ARG 91 Ca 0.01 0.32 -0.03 0.00 -0.47 0.00 0.00 55.73 55.56 2d9v s ARG 91 Cb -0.10 -2.36 -0.01 0.00 -0.57 0.00 0.00 34.95 31.91 2d9v s ARG 91 CO -0.18 -0.17 -0.08 -0.51 -1.08 0.00 0.00 175.30 173.28 2d9v s LEU 92 N -4.49 2.78 -0.39 -1.89 1.43 0.51 -4.94 118.68 111.69 2d9v s LEU 92 Ca 0.49 -0.40 -0.16 0.00 -1.03 0.00 0.00 54.13 53.03 2d9v s LEU 92 Cb -0.10 -1.69 0.01 0.00 0.03 0.00 0.00 46.19 44.44 2d9v s LEU 92 CO 0.41 0.02 0.39 -1.00 0.23 0.00 0.00 176.35 176.40 2d9v s HIS 93 N 1.22 3.19 0.20 0.29 3.76 -1.26 -1.42 115.29 121.26 2d9v s HIS 93 Ca 0.02 -0.26 0.02 0.00 -0.15 0.00 0.00 55.06 54.69 2d9v s HIS 93 Cb -0.14 -2.77 -0.05 0.00 1.11 0.00 0.00 32.58 30.73 2d9v s HIS 93 CO -0.03 -0.58 0.03 -0.51 -0.85 0.00 0.00 174.74 172.80 2d9v s LEU 94 N 2.03 1.99 -0.05 0.89 1.43 -0.12 -3.19 118.68 121.66 2d9v s LEU 94 Ca 0.11 -1.23 -0.02 0.00 -1.03 0.00 0.00 54.13 51.96 2d9v s LEU 94 Cb -0.17 -0.04 0.03 0.00 0.03 0.00 0.00 46.19 46.04 2d9v s LEU 94 CO 0.12 -0.61 0.07 0.00 0.23 0.00 0.00 176.35 176.16 2d9v s ALA 96 N 2.17 3.52 0.18 0.00 0.00 0.73 -2.25 121.76 126.12 2d9v s ALA 96 Ca 0.05 -0.84 -0.05 0.00 0.00 0.00 0.00 51.96 51.11 2d9v s ALA 96 Cb -0.12 -2.38 0.08 0.00 0.00 0.00 0.00 23.12 20.70 2d9v s ALA 96 CO -0.04 -0.55 1.50 1.05 0.00 0.00 0.00 175.76 177.73 2d9v h GLU 97 N 0.14 0.65 -3.85 0.00 4.11 -1.91 -3.40 114.58 110.32 2d9v h GLU 97 Ca -0.46 -0.39 -0.10 0.00 0.07 0.00 0.00 59.36 58.48 2d9v h GLU 97 Cb 1.25 0.04 -0.12 0.00 0.50 0.00 0.00 28.75 30.41 2d9v h GLU 97 CO 0.59 1.00 -0.29 0.95 0.07 0.00 0.00 179.01 181.33 2d9v s THR 98 N -4.10 0.05 0.39 -1.06 -4.23 -1.26 -4.34 115.64 101.10 2d9v s THR 98 Ca -0.08 -1.37 0.07 0.00 -1.18 0.00 0.00 61.69 59.13 2d9v s THR 98 Cb 0.11 -1.88 0.28 0.00 1.34 0.00 0.00 72.50 72.35 2d9v s THR 98 CO 0.85 -0.25 2.02 0.08 -0.54 0.00 0.00 174.62 176.78 2d9v h ARG 99 N 2.50 0.62 0.19 3.99 0.11 -1.91 -2.00 114.38 117.88 2d9v h ARG 99 Ca -0.31 -0.04 0.01 0.00 0.10 0.00 0.00 59.98 59.74 2d9v h ARG 99 Cb 1.23 -0.14 -0.02 0.00 1.11 0.00 0.00 29.97 32.15 2d9v h ARG 99 CO 0.47 0.41 -0.21 0.22 0.10 0.00 0.00 179.97 180.96 2d9v h ASP 100 N 0.64 -0.56 -0.65 0.08 3.58 -1.96 -0.09 116.42 117.45 2d9v h ASP 100 Ca 0.21 0.06 -0.01 0.00 0.42 0.00 0.00 57.03 57.70 2d9v h ASP 100 Cb 0.07 0.20 -0.03 0.00 1.72 0.00 0.00 39.33 41.29 2d9v h ASP 100 CO -0.05 -0.31 0.34 0.44 -2.88 0.00 0.00 179.24 176.78 2d9v h ASP 101 N -0.44 0.81 0.26 2.28 5.19 -1.89 -2.38 116.42 120.26 2d9v h ASP 101 Ca 0.01 -0.10 0.00 0.00 -0.62 0.00 0.00 57.03 56.32 2d9v h ASP 101 Cb 0.42 -0.21 -0.02 0.00 0.18 0.00 0.00 39.33 39.70 2d9v h ASP 101 CO -0.07 0.68 -0.28 0.00 -3.12 0.00 0.00 179.24 176.46 2d9v h ALA 102 N 1.16 -0.58 -0.75 3.45 0.00 -1.06 -2.57 119.26 118.91 2d9v h ALA 102 Ca 0.23 -0.08 0.12 0.00 0.00 0.00 0.00 54.91 55.17 2d9v h ALA 102 Cb 0.06 0.41 -0.08 0.00 0.00 0.00 0.00 17.79 18.17 2d9v h ALA 102 CO -0.03 -0.86 0.36 0.82 0.00 0.00 0.00 179.25 179.54 2d9v h ILE 103 N -0.58 0.77 -0.92 0.00 2.04 -0.91 -0.86 117.51 117.05 2d9v h ILE 103 Ca -0.01 -0.20 0.21 0.00 1.00 0.00 0.00 64.86 65.87 2d9v h ILE 103 Cb 0.54 0.15 -0.12 0.00 -0.74 0.00 0.00 36.82 36.66 2d9v h ILE 103 CO -0.07 0.10 0.46 0.00 0.00 0.00 0.00 178.15 178.65 2d9v h ALA 104 N 1.49 1.51 -0.27 1.87 0.00 -1.02 0.27 119.26 123.10 2d9v h ALA 104 Ca 0.39 0.13 -0.10 0.00 0.00 0.00 0.00 54.91 55.34 2d9v h ALA 104 Cb 0.50 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 2d9v h ALA 104 CO -0.32 -0.26 -0.22 -1.49 0.00 0.00 0.00 179.25 176.96 2d9v h TRP 105 N 0.51 0.75 -0.97 0.00 4.06 -0.99 -1.50 115.95 117.80 2d9v h TRP 105 Ca 0.56 -0.21 0.07 0.00 2.06 0.00 0.00 58.89 61.38 2d9v h TRP 105 Cb 1.02 -0.16 -0.07 0.00 -1.00 0.00 0.00 29.16 28.95 2d9v h TRP 105 CO -0.09 0.92 0.63 -0.22 -3.56 0.00 0.00 178.44 176.11 2d9v h LYS 106 N 0.36 1.07 -0.05 0.49 3.64 -0.58 0.30 116.57 121.80 2d9v h LYS 106 Ca 0.05 -0.06 -0.07 0.00 -1.27 0.00 0.00 60.65 59.30 2d9v h LYS 106 Cb 0.77 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 32.35 2d9v h LYS 106 CO 0.06 0.71 -0.23 1.15 -2.27 0.00 0.00 179.45 178.86 2d9v h THR 107 N 1.10 1.45 0.00 1.00 2.02 -1.07 0.27 112.91 117.67 2d9v h THR 107 Ca 0.43 -1.67 -0.04 0.00 0.77 0.00 0.00 66.41 65.90 2d9v h THR 107 Cb 0.22 2.39 -0.01 0.00 -1.74 0.00 0.00 68.15 69.01 2d9v h THR 107 CO -0.17 0.47 -0.17 0.00 0.37 0.00 0.00 175.52 176.01 2d9v h ALA 108 N 0.41 1.61 0.00 6.16 0.00 -0.89 -2.22 119.26 124.33 2d9v h ALA 108 Ca -0.01 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.67 2d9v h ALA 108 Cb 0.88 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 2d9v h ALA 108 CO 0.05 0.22 -0.54 -0.07 0.00 0.00 0.00 179.25 178.90 2d9v h LEU 109 N 0.00 0.00 -1.76 0.00 3.38 -0.40 -3.13 115.31 113.40 2d9v h LEU 109 Ca -0.00 -0.34 0.02 0.00 0.09 0.00 0.00 57.88 57.65 2d9v h LEU 109 Cb 0.33 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.07 2d9v h LEU 109 CO 0.02 0.97 0.44 0.24 0.09 0.00 0.00 178.44 180.21 2d9v h MET 110 N -1.00 0.00 0.00 1.13 2.86 -0.47 -1.28 114.93 116.17 2d9v h MET 110 Ca -0.11 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.53 2d9v h MET 110 Cb 0.74 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.40 2d9v h MET 110 CO -0.06 0.00 -0.09 0.93 1.06 0.00 0.00 176.91 178.75 2d9v h GLU 111 N 0.00 0.00 -1.13 1.72 4.39 -1.52 -3.24 114.58 114.80 2d9v h GLU 111 Ca 0.04 0.00 0.33 0.00 0.34 0.00 0.00 59.36 60.07 2d9v h GLU 111 Cb 0.92 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 29.53 2d9v h GLU 111 CO -0.00 0.00 0.87 0.00 -1.16 0.00 0.00 179.01 178.72 2d9v h ALA 112 N -1.50 3.04 -0.40 3.43 0.00 -1.38 0.59 119.26 123.04 2d9v h ALA 112 Ca 0.00 -0.04 -0.15 0.00 0.00 0.00 0.00 54.91 54.72 2d9v h ALA 112 Cb 0.09 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2d9v h ALA 112 CO 0.00 -1.45 -0.35 -0.97 0.00 0.00 0.00 179.25 176.48 2d9v h ASN 113 N 0.00 1.00 -0.90 0.00 -1.24 -1.36 -3.24 115.58 109.84 2d9v h ASN 113 Ca 0.54 -0.44 -0.59 0.00 0.71 0.00 0.00 56.30 56.52 2d9v h ASN 113 Cb 2.27 -0.28 -0.39 0.00 0.73 0.00 0.00 38.32 40.65 2d9v h ASN 113 CO -0.01 1.24 -0.39 -1.20 -1.29 0.00 0.00 177.43 175.78 2d9v n SER 114 N -4.07 5.58 -3.22 1.15 7.64 0.19 -0.28 113.62 120.61 2d9v n SER 114 Ca -0.02 -3.76 -0.01 0.00 1.01 0.00 0.00 58.87 56.09 2d9v n SER 114 Cb 0.53 -0.51 -0.03 0.00 -1.01 0.00 0.00 64.21 63.19 2d9v n SER 114 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2d9v s THR 115 N -4.74 -0.84 0.89 0.44 2.01 -0.02 -4.97 115.64 108.41 2d9v s THR 115 Ca 0.54 -0.08 -0.15 0.00 0.31 0.00 0.00 61.69 62.31 2d9v s THR 115 Cb 0.43 -0.96 0.22 0.00 0.01 0.00 0.00 72.50 72.20 2d9v s THR 115 CO -0.00 -0.09 0.79 -0.81 -0.69 0.00 0.00 174.62 173.82 2d9v n PRO 116 N 5.40 -2.57 -3.65 4.92 -0.04 -1.26 -4.64 135.00 133.16 2d9v n PRO 116 Ca 0.01 -1.27 -0.36 0.00 -0.04 0.00 0.00 63.50 61.83 2d9v n PRO 116 Cb 0.51 -1.19 -0.07 0.00 -0.04 0.00 0.00 33.50 32.71 2d9v n PRO 116 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2d9v s ALA 117 N -3.01 4.06 0.24 0.55 0.00 -1.26 -4.89 121.76 117.45 2d9v s ALA 117 Ca 0.51 -3.68 0.22 0.00 0.00 0.00 0.00 51.96 49.02 2d9v s ALA 117 Cb -0.05 -2.79 0.94 0.00 0.00 0.00 0.00 23.12 21.22 2d9v s ALA 117 CO 0.39 -2.14 1.85 -1.00 0.00 0.00 0.00 175.76 174.86 2d9v h PRO 118 N 6.31 0.00 -6.16 0.00 0.13 -2.02 -3.43 132.00 126.84 2d9v h PRO 118 Ca 0.11 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.68 2d9v h PRO 118 Cb 0.85 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.95 2d9v h PRO 118 CO 0.81 0.27 0.90 0.00 -0.23 0.00 0.00 178.00 179.74 2d9v s ALA 119 N -3.82 3.65 0.00 -0.56 0.00 -1.26 -4.83 121.76 114.94 2d9v s ALA 119 Ca -0.01 0.48 0.00 0.00 0.00 0.00 0.00 51.96 52.44 2d9v s ALA 119 Cb 0.12 -3.62 0.00 0.00 0.00 0.00 0.00 23.12 19.62 2d9v s ALA 119 CO 0.65 -1.15 0.00 0.41 0.00 0.00 0.00 175.76 175.67 2d9v n GLY 120 N 3.61 -0.14 3.78 0.00 0.00 -1.26 -5.00 105.19 106.18 2d9v n GLY 120 Ca 0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.00 3.45 -0.01 4.61 0.00 -1.26 -5.07 121.76 121.48 2d9v s ALA 121 Ca 0.00 0.34 -0.01 0.00 0.00 0.00 0.00 51.96 52.29 2d9v s ALA 121 Cb 0.00 -2.94 0.00 0.00 0.00 0.00 0.00 23.12 20.18 2d9v s ALA 121 CO 0.00 0.28 0.02 -0.08 0.00 0.00 0.00 175.76 175.98 2d9v s THR 122 N -1.06 0.01 0.39 0.00 -1.32 -1.26 -5.14 115.64 107.27 2d9v s THR 122 Ca 0.36 -0.09 -0.26 0.00 -1.21 0.00 0.00 61.69 60.48 2d9v s THR 122 Cb -0.23 -0.07 -0.11 0.00 -1.51 0.00 0.00 72.50 70.59 2d9v s THR 122 CO 0.26 -0.05 1.22 1.33 -2.21 0.00 0.00 174.62 175.17 2d9v n VAL 123 N 2.91 2.37 -1.19 5.08 0.24 -1.26 -4.97 118.33 121.52 2d9v n VAL 123 Ca -0.13 -0.50 -0.29 0.00 -2.04 0.00 0.00 64.34 61.38 2d9v n VAL 123 Cb 0.59 -1.48 0.16 0.00 -1.47 0.00 0.00 33.84 31.64 2d9v n VAL 123 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 2d9v s PRO 124 N -2.06 0.85 -0.03 7.34 0.04 -1.26 -5.04 135.00 134.84 2d9v s PRO 124 Ca 0.60 0.67 -0.02 0.00 0.04 0.00 0.00 61.00 62.29 2d9v s PRO 124 Cb -0.54 -1.77 -0.01 0.00 0.04 0.00 0.00 34.50 32.22 2d9v s PRO 124 CO 0.59 -2.48 -0.04 0.45 0.04 0.00 0.00 177.00 175.56 2d9v n SER 125 N -4.03 0.35 0.00 6.66 2.88 -1.26 -5.12 113.62 113.11 2d9v n SER 125 Ca 0.06 0.26 0.00 0.00 -1.33 0.00 0.00 58.87 57.86 2d9v n SER 125 Cb 0.56 -0.57 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2d9v n SER 125 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2d9v n GLY 126 N 1.66 2.13 0.25 0.46 0.00 -1.26 -5.02 105.19 103.42 2d9v n GLY 126 Ca -0.02 -0.82 -0.11 0.00 0.00 0.00 0.00 46.02 45.07 2d9v n GLY 126 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2d9v h PRO 127 N 0.00 0.83 -5.00 1.61 0.13 -2.08 -3.43 132.00 124.06 2d9v h PRO 127 Ca 0.00 -0.44 -0.44 0.00 -0.87 0.00 0.00 66.00 64.26 2d9v h PRO 127 Cb 0.00 0.01 -0.10 0.00 0.13 0.00 0.00 31.00 31.04 2d9v h PRO 127 CO 0.00 1.07 1.88 0.45 -0.23 0.00 0.00 178.00 181.17 2d9v n SER 128 N -4.05 -0.47 -3.65 1.44 2.88 -1.26 -4.74 113.62 103.78 2d9v n SER 128 Ca -0.02 -0.14 -0.01 0.00 -1.33 0.00 0.00 58.87 57.37 2d9v n SER 128 Cb 0.54 -0.75 -0.01 0.00 -0.75 0.00 0.00 64.21 63.24 2d9v n SER 128 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2d9v s SER 129 N 5.11 -0.11 0.00 -3.46 1.04 -1.26 -5.20 113.70 109.82 2d9v s SER 129 Ca 1.34 -0.19 0.00 0.00 0.48 0.00 0.00 55.95 57.58 2d9v s SER 129 Cb -1.08 0.26 0.00 0.00 0.10 0.00 0.00 66.02 65.30 2d9v s SER 129 CO 0.52 -0.47 0.46 0.61 0.98 0.00 0.00 173.24 175.34