#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 5.44 -0.04 1.61 0.01 -1.26 -4.94 113.70 114.52 2d9v s SER 2 Ca 0.00 -0.52 0.06 0.00 1.31 0.00 0.00 55.95 56.80 2d9v s SER 2 Cb 0.00 -2.55 -0.01 0.00 0.21 0.00 0.00 66.02 63.67 2d9v s SER 2 CO 0.00 -2.41 -0.23 -0.44 0.41 0.00 0.00 173.24 170.57 2d9v s SER 3 N 7.32 2.73 -0.43 2.44 0.01 -1.26 -5.06 113.70 119.45 2d9v s SER 3 Ca 0.63 -0.44 0.02 0.00 1.31 0.00 0.00 55.95 57.47 2d9v s SER 3 Cb -0.07 -0.61 0.23 0.00 0.21 0.00 0.00 66.02 65.77 2d9v s SER 3 CO 0.04 0.24 0.97 0.61 0.41 0.00 0.00 173.24 175.51 2d9v n GLY 4 N 2.86 -0.90 3.10 3.44 0.00 -1.26 -5.10 105.19 107.33 2d9v n GLY 4 Ca -0.17 0.67 -0.36 0.00 0.00 0.00 0.00 46.02 46.16 2d9v n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2d9v s SER 5 N -0.12 5.20 1.05 1.61 1.04 -1.26 -5.09 113.70 116.13 2d9v s SER 5 Ca 0.28 -2.36 -0.12 0.00 0.48 0.00 0.00 55.95 54.23 2d9v s SER 5 Cb 0.14 -1.83 0.19 0.00 0.10 0.00 0.00 66.02 64.63 2d9v s SER 5 CO -0.13 -0.47 0.43 -1.54 0.98 0.00 0.00 173.24 172.51 2d9v n SER 6 N 4.14 -2.91 0.00 7.02 3.41 -1.26 -4.38 113.62 119.64 2d9v n SER 6 Ca 0.02 -0.43 0.00 0.00 -0.26 0.00 0.00 58.87 58.19 2d9v n SER 6 Cb 0.40 -0.59 0.00 0.00 -0.26 0.00 0.00 64.21 63.75 2d9v n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2d9v n GLY 7 N -2.26 2.88 3.81 5.00 0.00 -1.26 -5.03 105.19 108.33 2d9v n GLY 7 Ca 0.07 -0.75 -0.38 0.00 0.00 0.00 0.00 46.02 44.96 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 4.41 -0.12 0.99 2.96 -1.26 -0.62 118.68 125.03 2d9v s LEU 8 Ca 0.00 0.85 -0.08 0.00 -0.22 0.00 0.00 54.13 54.68 2d9v s LEU 8 Cb 0.00 -2.55 -0.03 0.00 0.50 0.00 0.00 46.19 44.11 2d9v s LEU 8 CO 0.00 0.25 -0.17 0.52 -1.32 0.00 0.00 176.35 175.63 2d9v n VAL 9 N 2.37 1.19 -3.71 1.68 0.31 -0.52 -4.94 118.33 114.71 2d9v n VAL 9 Ca -0.13 0.26 -0.12 0.00 -0.01 0.00 0.00 64.34 64.34 2d9v n VAL 9 Cb 0.52 -2.24 -0.07 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 -2.10 0.88 -0.02 5.55 3.52 -1.26 -5.04 118.95 120.47 2d9v s ARG 10 Ca -0.14 -0.47 0.02 0.00 -0.13 0.00 0.00 55.73 55.01 2d9v s ARG 10 Cb 0.02 0.38 0.01 0.00 -1.56 0.00 0.00 34.95 33.80 2d9v s ARG 10 CO 0.20 -0.30 -0.05 0.20 -0.81 0.00 0.00 175.30 174.55 2d9v s GLY 11 N -2.11 0.34 -0.27 8.12 0.00 -1.26 -3.67 107.32 108.47 2d9v s GLY 11 Ca -0.04 -0.17 -0.26 0.00 0.00 0.00 0.00 44.72 44.25 2d9v s GLY 11 CO -0.04 0.03 1.21 -0.32 0.00 0.00 0.00 173.10 173.99 2d9v s GLY 12 N 0.25 0.05 0.19 0.20 0.00 -1.25 -5.07 107.32 101.70 2d9v s GLY 12 Ca -0.03 2.93 -0.30 0.00 0.00 0.00 0.00 44.72 47.32 2d9v s GLY 12 CO -0.00 1.70 1.35 -0.98 0.00 0.00 0.00 173.10 175.17 2d9v s TRP 13 N -0.14 3.21 0.02 1.90 0.52 -1.26 -3.17 118.94 120.02 2d9v s TRP 13 Ca 0.05 1.14 0.04 0.00 0.02 0.00 0.00 56.10 57.34 2d9v s TRP 13 Cb -0.04 -3.66 -0.02 0.00 -1.15 0.00 0.00 33.47 28.61 2d9v s TRP 13 CO -0.09 -2.12 -0.12 -0.51 0.02 0.00 0.00 176.95 174.13 2d9v s LEU 14 N 0.06 2.11 -0.22 2.99 1.43 0.37 -4.87 118.68 120.56 2d9v s LEU 14 Ca 0.59 -0.35 -0.25 0.00 -1.03 0.00 0.00 54.13 53.08 2d9v s LEU 14 Cb -0.38 -0.56 -0.01 0.00 0.03 0.00 0.00 46.19 45.28 2d9v s LEU 14 CO 0.38 0.06 0.85 0.26 0.23 0.00 0.00 176.35 178.13 2d9v s TRP 15 N -0.62 3.35 0.04 0.29 0.52 0.38 -1.64 118.94 121.25 2d9v s TRP 15 Ca 0.02 1.21 0.08 0.00 0.02 0.00 0.00 56.10 57.43 2d9v s TRP 15 Cb -0.06 -3.06 -0.03 0.00 -1.15 0.00 0.00 33.47 29.16 2d9v s TRP 15 CO 0.00 -0.36 -0.23 0.50 0.02 0.00 0.00 176.95 176.88 2d9v s ARG 16 N 2.68 1.92 -0.13 4.98 3.52 -0.32 0.21 118.95 131.82 2d9v s ARG 16 Ca 0.37 -1.05 -0.03 0.00 -0.13 0.00 0.00 55.73 54.89 2d9v s ARG 16 Cb -0.16 -2.06 -0.03 0.00 -1.56 0.00 0.00 34.95 31.14 2d9v s ARG 16 CO 0.09 0.53 -0.03 -1.14 -0.81 0.00 0.00 175.30 173.93 2d9v s GLN 17 N -1.27 3.40 0.81 5.12 0.74 -1.11 0.25 119.66 127.61 2d9v s GLN 17 Ca 0.13 -0.49 -0.14 0.00 0.05 0.00 0.00 55.36 54.91 2d9v s GLN 17 Cb -0.10 -2.85 0.20 0.00 1.10 0.00 0.00 33.01 31.35 2d9v s GLN 17 CO 0.03 0.41 0.85 0.45 -0.55 0.00 0.00 175.29 176.48 2d9v n SER 18 N 3.04 -1.02 -0.14 6.67 2.88 -0.65 -4.77 113.62 119.62 2d9v n SER 18 Ca -0.18 -1.13 -0.28 0.00 -1.33 0.00 0.00 58.87 55.95 2d9v n SER 18 Cb 0.53 -0.72 -0.10 0.00 -0.75 0.00 0.00 64.21 63.16 2d9v n SER 18 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2d9v n SER 19 N -4.04 1.92 -0.08 -3.46 7.64 -1.26 -3.87 113.62 110.47 2d9v n SER 19 Ca 0.11 0.28 -0.16 0.00 1.01 0.00 0.00 58.87 60.12 2d9v n SER 19 Cb 0.42 -0.76 -0.12 0.00 -1.01 0.00 0.00 64.21 62.74 2d9v n SER 19 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 2d9v h ILE 20 N -0.88 1.38 0.00 0.44 2.04 -1.99 -3.33 117.51 115.18 2d9v h ILE 20 Ca -0.68 -2.20 0.00 0.00 1.00 0.00 0.00 64.86 62.98 2d9v h ILE 20 Cb 1.63 2.78 0.00 0.00 -0.74 0.00 0.00 36.82 40.49 2d9v h ILE 20 CO -0.39 0.47 0.00 -0.07 0.00 0.00 0.00 178.15 178.16 2d9v h LEU 21 N -1.00 0.00 1.87 1.44 -0.00 -2.00 -3.45 115.31 112.17 2d9v h LEU 21 Ca -0.12 0.00 -0.07 0.00 -0.00 0.00 0.00 57.88 57.69 2d9v h LEU 21 Cb 1.05 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.68 2d9v h LEU 21 CO -0.07 0.00 -0.09 0.54 -0.00 0.00 0.00 178.44 178.81 2d9v n ARG 22 N -2.64 -2.80 -4.29 1.13 1.74 -1.25 -4.88 116.66 103.67 2d9v n ARG 22 Ca 0.01 0.08 -0.25 0.00 -0.77 0.00 0.00 57.85 56.93 2d9v n ARG 22 Cb 0.26 -4.60 -0.08 0.00 -1.02 0.00 0.00 32.46 27.01 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 -5.14 2.18 0.12 5.56 3.52 -1.26 -4.81 118.95 119.12 2d9v s ARG 23 Ca 0.05 -1.33 -0.17 0.00 -0.13 0.00 0.00 55.73 54.15 2d9v s ARG 23 Cb -0.03 -2.17 -0.07 0.00 -1.56 0.00 0.00 34.95 31.12 2d9v s ARG 23 CO 0.06 0.41 0.59 -1.58 -0.81 0.00 0.00 175.30 173.97 2d9v s TRP 24 N -1.98 3.71 -0.05 5.12 0.52 -1.26 -1.64 118.94 123.36 2d9v s TRP 24 Ca 0.28 1.21 -0.05 0.00 0.02 0.00 0.00 56.10 57.56 2d9v s TRP 24 Cb -0.08 -2.47 0.01 0.00 -1.15 0.00 0.00 33.47 29.79 2d9v s TRP 24 CO 0.17 0.49 0.15 -1.59 0.02 0.00 0.00 176.95 176.19 2d9v s LYS 25 N -1.57 0.21 0.24 4.98 -2.85 0.14 -4.94 119.74 115.96 2d9v s LYS 25 Ca 0.34 0.13 -0.30 0.00 -1.00 0.00 0.00 55.97 55.15 2d9v s LYS 25 Cb -0.17 0.10 -0.09 0.00 -2.06 0.00 0.00 37.83 35.61 2d9v s LYS 25 CO 0.19 -0.03 1.13 1.03 0.10 0.00 0.00 175.35 177.77 2d9v s ARG 26 N -0.10 4.58 -0.16 1.78 0.52 -1.26 -1.17 118.95 123.15 2d9v s ARG 26 Ca -0.02 1.83 -0.14 0.00 -0.52 0.00 0.00 55.73 56.88 2d9v s ARG 26 Cb -0.02 -3.21 0.04 0.00 0.52 0.00 0.00 34.95 32.28 2d9v s ARG 26 CO 0.00 0.10 0.41 -0.80 0.02 0.00 0.00 175.30 175.04 2d9v s ASN 27 N -0.49 -0.44 -0.58 0.23 -0.87 -0.65 -4.89 114.94 107.25 2d9v s ASN 27 Ca 0.47 0.84 -0.23 0.00 -1.57 0.00 0.00 52.86 52.38 2d9v s ASN 27 Cb -0.32 0.84 0.06 0.00 -0.02 0.00 0.00 41.25 41.81 2d9v s ASN 27 CO 0.40 -0.15 0.89 0.86 -2.57 0.00 0.00 177.10 176.53 2d9v s TRP 28 N 0.28 2.79 -0.22 2.20 -0.00 -0.19 -0.48 118.94 123.32 2d9v s TRP 28 Ca -0.01 -0.31 -0.19 0.00 -0.00 0.00 0.00 56.10 55.59 2d9v s TRP 28 Cb -0.03 -4.07 -0.03 0.00 -0.00 0.00 0.00 33.47 29.35 2d9v s TRP 28 CO -0.00 -1.41 0.57 -0.06 -0.00 0.00 0.00 176.95 176.05 2d9v s PHE 29 N 3.76 3.33 -0.02 5.86 0.40 -1.19 -1.65 117.98 128.47 2d9v s PHE 29 Ca 0.25 0.79 0.07 0.00 -0.60 0.00 0.00 56.93 57.43 2d9v s PHE 29 Cb -0.15 -2.75 -0.02 0.00 0.51 0.00 0.00 43.02 40.61 2d9v s PHE 29 CO 0.14 -0.20 -0.22 0.00 0.70 0.00 0.00 175.22 175.64 2d9v s ALA 30 N 2.02 1.88 -0.14 5.36 0.00 -0.85 -3.76 121.76 126.28 2d9v s ALA 30 Ca 0.25 -0.96 -0.04 0.00 0.00 0.00 0.00 51.96 51.21 2d9v s ALA 30 Cb -0.16 -0.50 -0.03 0.00 0.00 0.00 0.00 23.12 22.43 2d9v s ALA 30 CO 0.09 0.44 0.01 -1.17 0.00 0.00 0.00 175.76 175.13 2d9v s LEU 31 N -0.45 3.55 0.06 0.00 2.96 -1.24 -2.39 118.68 121.16 2d9v s LEU 31 Ca 0.06 0.04 0.01 0.00 -0.22 0.00 0.00 54.13 54.03 2d9v s LEU 31 Cb -0.09 -1.85 -0.04 0.00 0.50 0.00 0.00 46.19 44.70 2d9v s LEU 31 CO -0.00 0.25 0.11 0.26 -1.32 0.00 0.00 176.35 175.65 2d9v s TRP 32 N -0.11 3.29 0.56 5.38 0.52 -0.89 -1.44 118.94 126.26 2d9v s TRP 32 Ca 0.04 0.15 0.23 0.00 0.02 0.00 0.00 56.10 56.55 2d9v s TRP 32 Cb -0.13 -1.68 1.54 0.00 -1.15 0.00 0.00 33.47 32.05 2d9v s TRP 32 CO 0.02 0.55 2.18 -0.07 0.02 0.00 0.00 176.95 179.64 2d9v h LEU 33 N 3.42 0.00 -1.61 2.99 3.38 -1.20 -0.41 115.31 121.89 2d9v h LEU 33 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.50 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 0.68 0.00 0.03 0.44 0.09 0.00 0.00 178.44 179.67 2d9v h ASP 34 N 0.00 0.00 -0.23 -0.43 5.19 -1.94 -3.45 116.42 115.56 2d9v h ASP 34 Ca 0.02 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.43 2d9v h ASP 34 Cb 0.11 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.62 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 -1.27 1.14 3.18 2.75 0.00 -0.16 -4.84 105.19 105.99 2d9v n GLY 35 Ca -0.02 -0.32 -0.22 0.00 0.00 0.00 0.00 46.02 45.46 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 -2.23 1.32 -0.25 2.61 -4.23 -1.23 0.12 115.64 111.76 2d9v s THR 36 Ca 0.00 -1.07 -0.05 0.00 -1.18 0.00 0.00 61.69 59.39 2d9v s THR 36 Cb 0.00 -1.17 -0.00 0.00 1.34 0.00 0.00 72.50 72.66 2d9v s THR 36 CO 0.00 0.09 0.01 -0.22 -0.54 0.00 0.00 174.62 173.95 2d9v s LEU 37 N -1.14 3.29 -0.07 4.79 2.96 0.48 -2.09 118.68 126.91 2d9v s LEU 37 Ca 0.04 -0.54 0.01 0.00 -0.22 0.00 0.00 54.13 53.42 2d9v s LEU 37 Cb -0.08 -1.79 0.02 0.00 0.50 0.00 0.00 46.19 44.83 2d9v s LEU 37 CO 0.01 -0.09 -0.09 -0.83 -1.32 0.00 0.00 176.35 174.04 2d9v s GLY 38 N 1.48 0.71 0.11 7.98 0.00 -1.01 -0.55 107.32 116.04 2d9v s GLY 38 Ca 0.04 -0.35 0.06 0.00 0.00 0.00 0.00 44.72 44.47 2d9v s GLY 38 CO -0.01 0.40 -0.04 -2.52 0.00 0.00 0.00 173.10 170.93 2d9v s TYR 39 N 1.02 2.86 0.30 1.90 -0.85 -1.23 -2.00 117.35 119.35 2d9v s TYR 39 Ca -0.08 -0.10 0.03 0.00 -0.52 0.00 0.00 57.07 56.40 2d9v s TYR 39 Cb -0.15 -1.46 -0.04 0.00 0.38 0.00 0.00 41.96 40.69 2d9v s TYR 39 CO -0.00 0.47 0.17 0.71 -1.52 0.00 0.00 175.55 175.38 2d9v s TYR 40 N -1.35 1.60 0.15 -3.49 1.51 -0.66 -2.46 117.35 112.65 2d9v s TYR 40 Ca 0.24 -1.41 0.05 0.00 -1.01 0.00 0.00 57.07 54.94 2d9v s TYR 40 Cb -0.11 -0.83 -0.06 0.00 -0.11 0.00 0.00 41.96 40.85 2d9v s TYR 40 CO 0.17 -0.57 1.35 0.45 -1.11 0.00 0.00 175.55 175.83 2d9v h HIS 41 N 2.22 0.14 -2.87 2.71 3.86 -1.83 -0.49 115.15 118.89 2d9v h HIS 41 Ca -0.33 -0.09 0.03 0.00 -1.16 0.00 0.00 60.37 58.83 2d9v h HIS 41 Cb 1.25 -0.01 -0.00 0.00 1.06 0.00 0.00 27.41 29.70 2d9v h HIS 41 CO 1.10 0.96 0.37 0.34 0.86 0.00 0.00 177.93 181.56 2d9v s ASP 42 N -6.85 0.02 0.59 2.45 2.15 -1.26 -4.56 116.67 109.21 2d9v s ASP 42 Ca -0.01 -1.04 0.36 0.00 0.43 0.00 0.00 52.55 52.29 2d9v s ASP 42 Cb 0.10 0.75 1.24 0.00 -0.30 0.00 0.00 42.92 44.71 2d9v s ASP 42 CO 0.82 -1.50 1.40 1.21 -0.17 0.00 0.00 175.17 176.92 2d9v n GLU 43 N -0.59 0.01 -1.93 4.34 2.13 -1.26 -4.02 120.64 119.31 2d9v n GLU 43 Ca -0.07 1.04 -0.34 0.00 0.66 0.00 0.00 57.16 58.45 2d9v n GLU 43 Cb 0.60 -2.52 -0.04 0.00 0.27 0.00 0.00 31.44 29.75 2d9v n GLU 43 CO 0.00 0.00 0.00 0.95 -0.41 0.00 0.00 177.13 177.67 2d9v s THR 44 N -4.60 3.29 -0.14 6.31 -4.23 -1.26 -4.79 115.64 110.22 2d9v s THR 44 Ca -0.04 0.05 0.30 0.00 -1.18 0.00 0.00 61.69 60.82 2d9v s THR 44 Cb 0.19 -3.74 0.34 0.00 1.34 0.00 0.00 72.50 70.63 2d9v s THR 44 CO 0.64 -0.71 1.87 0.00 -0.54 0.00 0.00 174.62 175.88 2d9v h ALA 45 N 14.99 1.00 0.00 3.99 0.00 -2.02 -2.86 119.26 134.36 2d9v h ALA 45 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2d9v h ALA 45 Cb 1.14 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2d9v h ALA 45 CO 1.20 0.00 0.00 0.00 0.00 0.00 0.00 179.25 180.45 2d9v n GLN 46 N -2.77 0.11 -1.76 0.00 10.64 -1.26 -1.94 117.38 120.41 2d9v n GLN 46 Ca 0.01 0.61 -0.35 0.00 -1.83 0.00 0.00 57.00 55.44 2d9v n GLN 46 Cb 0.29 -1.87 0.05 0.00 -0.86 0.00 0.00 30.24 27.84 2d9v n GLN 46 CO 0.00 0.00 0.00 -3.47 -1.83 0.00 0.00 177.06 171.76 2d9v n ASP 47 N -2.12 7.07 -4.45 2.61 2.03 -1.08 -5.00 116.55 115.61 2d9v n ASP 47 Ca -0.01 -3.80 -0.48 0.00 0.52 0.00 0.00 54.79 51.02 2d9v n ASP 47 Cb 0.03 -0.90 -0.08 0.00 -0.72 0.00 0.00 41.12 39.44 2d9v n ASP 47 CO 0.00 0.00 0.00 -1.84 -1.92 0.00 0.00 177.20 173.44 2d9v n GLU 48 N -0.70 0.84 0.04 -0.67 0.28 -0.82 -4.37 120.64 115.24 2d9v n GLU 48 Ca 0.55 0.18 -0.11 0.00 -0.16 0.00 0.00 57.16 57.62 2d9v n GLU 48 Cb 0.51 -2.40 0.02 0.00 1.43 0.00 0.00 31.44 31.00 2d9v n GLU 48 CO 0.00 0.00 0.00 1.49 -0.16 0.00 0.00 177.13 178.46 2d9v h GLU 49 N 13.21 0.46 -1.83 3.44 4.81 -1.82 -3.48 114.58 129.37 2d9v h GLU 49 Ca -0.22 -0.37 0.31 0.00 -0.13 0.00 0.00 59.36 58.95 2d9v h GLU 49 Cb 1.32 0.08 -0.09 0.00 0.63 0.00 0.00 28.75 30.68 2d9v h GLU 49 CO 1.10 1.00 0.82 0.34 -0.73 0.00 0.00 179.01 181.54 2d9v s ASP 50 N -6.99 -0.03 -0.24 1.04 2.15 -1.24 -5.04 116.67 106.31 2d9v s ASP 50 Ca -0.06 -0.22 -0.08 0.00 0.43 0.00 0.00 52.55 52.61 2d9v s ASP 50 Cb 0.10 0.20 0.11 0.00 -0.30 0.00 0.00 42.92 43.04 2d9v s ASP 50 CO 0.85 -0.39 0.52 -0.60 -0.17 0.00 0.00 175.17 175.38 2d9v s ARG 51 N -2.29 0.44 0.34 4.34 3.52 -1.26 -3.54 118.95 120.49 2d9v s ARG 51 Ca 0.20 1.21 0.09 0.00 -0.13 0.00 0.00 55.73 57.10 2d9v s ARG 51 Cb 0.02 0.56 -0.05 0.00 -1.56 0.00 0.00 34.95 33.91 2d9v s ARG 51 CO -0.02 -0.24 0.03 0.14 -0.81 0.00 0.00 175.30 174.41 2d9v s VAL 52 N 2.74 2.70 -0.00 7.11 -7.23 0.29 -4.95 120.40 121.05 2d9v s VAL 52 Ca -0.03 -1.92 -0.19 0.00 -1.81 0.00 0.00 61.98 58.03 2d9v s VAL 52 Cb -0.12 -2.83 -0.06 0.00 0.56 0.00 0.00 36.38 33.94 2d9v s VAL 52 CO -0.16 -0.20 0.55 -0.69 -0.31 0.00 0.00 175.10 174.29 2d9v s VAL 53 N -2.50 4.93 -0.17 1.32 1.01 -1.26 -0.39 120.40 123.34 2d9v s VAL 53 Ca 0.35 1.14 -0.02 0.00 0.00 0.00 0.00 61.98 63.45 2d9v s VAL 53 Cb -0.00 -3.88 -0.10 0.00 0.00 0.00 0.00 36.38 32.40 2d9v s VAL 53 CO 0.20 0.46 -0.17 -0.38 0.00 0.00 0.00 175.10 175.21 2d9v n ILE 54 N 2.52 0.93 -1.64 2.22 2.08 0.12 -4.60 119.36 120.99 2d9v n ILE 54 Ca -0.09 -0.32 -0.55 0.00 0.56 0.00 0.00 62.75 62.36 2d9v n ILE 54 Cb 0.51 -1.29 -0.07 0.00 -0.75 0.00 0.00 39.64 38.05 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 -3.23 1.97 -3.85 1.39 -0.00 -0.72 -1.56 115.22 109.22 2d9v n HIS 55 Ca -0.30 0.41 -0.25 0.00 0.46 0.00 0.00 57.72 58.04 2d9v n HIS 55 Cb 0.78 -2.50 -0.07 0.00 -0.12 0.00 0.00 29.99 28.08 2d9v n HIS 55 CO 0.00 0.00 0.00 1.19 0.46 0.00 0.00 176.34 177.99 2d9v n PHE 56 N 6.60 -0.93 0.00 1.57 3.72 0.19 -4.72 117.46 123.89 2d9v n PHE 56 Ca 0.30 0.47 0.00 0.00 -0.05 0.00 0.00 57.45 58.17 2d9v n PHE 56 Cb 0.17 -1.96 0.00 0.00 -0.94 0.00 0.00 39.48 36.75 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 -2.00 4.12 -4.58 4.37 5.15 -0.60 -4.96 115.26 116.75 2d9v n ASN 57 Ca -0.18 0.00 -0.42 0.00 -0.60 0.00 0.00 54.58 53.38 2d9v n ASN 57 Cb 0.49 0.64 -0.02 0.00 -0.53 0.00 0.00 39.78 40.35 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 -1.73 3.81 0.12 3.44 1.01 -1.24 0.19 120.40 126.00 2d9v s VAL 58 Ca 0.00 0.74 -0.09 0.00 0.00 0.00 0.00 61.98 62.62 2d9v s VAL 58 Cb 0.00 -4.33 -0.15 0.00 0.00 0.00 0.00 36.38 31.90 2d9v s VAL 58 CO 0.00 -1.01 1.33 -0.09 0.00 0.00 0.00 175.10 175.34 2d9v h ARG 59 N 11.12 0.66 -2.81 2.72 9.65 -1.77 -3.48 114.38 130.48 2d9v h ARG 59 Ca -0.27 -0.56 0.09 0.00 -1.10 0.00 0.00 59.98 58.14 2d9v h ARG 59 Cb 1.10 0.12 -0.05 0.00 -1.39 0.00 0.00 29.97 29.75 2d9v h ARG 59 CO 1.15 1.17 0.32 -0.51 2.80 0.00 0.00 179.97 184.90 2d9v s ASP 60 N -7.08 -0.19 -0.22 -3.80 1.01 -1.26 -5.03 116.67 100.11 2d9v s ASP 60 Ca -0.09 -0.63 -0.06 0.00 0.71 0.00 0.00 52.55 52.48 2d9v s ASP 60 Cb 0.09 0.67 0.10 0.00 1.01 0.00 0.00 42.92 44.80 2d9v s ASP 60 CO 0.89 -1.26 0.43 -0.63 0.21 0.00 0.00 175.17 174.81 2d9v s ILE 61 N -3.45 -0.68 -0.04 0.77 1.01 -1.26 -1.09 121.20 116.46 2d9v s ILE 61 Ca 0.12 0.12 -0.01 0.00 0.00 0.00 0.00 60.65 60.88 2d9v s ILE 61 Cb -0.05 -0.72 -0.04 0.00 0.01 0.00 0.00 42.46 41.67 2d9v s ILE 61 CO 0.06 0.03 0.05 -0.54 0.00 0.00 0.00 174.94 174.55 2d9v s LYS 62 N 2.63 3.04 -0.02 2.79 1.02 -0.36 -4.98 119.74 123.86 2d9v s LYS 62 Ca 0.01 -0.44 -0.01 0.00 0.02 0.00 0.00 55.97 55.55 2d9v s LYS 62 Cb -0.13 -2.85 0.02 0.00 -0.52 0.00 0.00 37.83 34.36 2d9v s LYS 62 CO -0.14 0.68 0.04 0.08 -0.92 0.00 0.00 175.35 175.09 2d9v s VAL 63 N -1.06 -0.03 0.00 3.17 1.01 -1.26 -0.63 120.40 121.60 2d9v s VAL 63 Ca 0.19 0.12 0.00 0.00 0.00 0.00 0.00 61.98 62.28 2d9v s VAL 63 Cb -0.12 -0.08 0.00 0.00 0.00 0.00 0.00 36.38 36.18 2d9v s VAL 63 CO 0.09 0.05 0.00 0.61 0.00 0.00 0.00 175.10 175.84 2d9v n GLY 64 N 3.68 3.18 0.31 4.51 0.00 -0.98 -2.83 105.19 113.05 2d9v n GLY 64 Ca -0.21 -0.24 0.05 0.00 0.00 0.00 0.00 46.02 45.63 2d9v n GLY 64 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2d9v n GLN 65 N 13.85 -0.08 -0.32 1.61 7.27 -1.26 0.27 117.38 138.72 2d9v n GLN 65 Ca 0.00 1.36 0.03 0.00 0.07 0.00 0.00 57.00 58.46 2d9v n GLN 65 Cb 0.00 -2.03 0.10 0.00 2.41 0.00 0.00 30.24 30.72 2d9v n GLN 65 CO 0.00 0.00 0.00 0.39 0.07 0.00 0.00 177.06 177.52 2d9v n GLU 66 N -5.42 -0.12 -2.42 3.69 1.02 -1.13 -3.96 120.64 112.31 2d9v n GLU 66 Ca 0.14 1.36 -0.43 0.00 -0.02 0.00 0.00 57.16 58.21 2d9v n GLU 66 Cb 0.43 -2.02 -0.02 0.00 -0.02 0.00 0.00 31.44 29.81 2d9v n GLU 66 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2d9v n GLN 68 N 7.13 -0.40 -1.29 0.00 -0.06 -1.25 -4.71 117.38 116.80 2d9v n GLN 68 Ca 0.15 -0.48 -0.18 0.00 -2.00 0.00 0.00 57.00 54.49 2d9v n GLN 68 Cb 0.46 -0.87 0.12 0.00 -4.06 0.00 0.00 30.24 25.89 2d9v n GLN 68 CO 0.00 0.00 0.00 -3.47 -0.20 0.00 0.00 177.06 173.39 2d9v n ASP 69 N -0.04 4.40 -3.67 1.69 -0.08 -1.26 -4.96 116.55 112.62 2d9v n ASP 69 Ca 0.00 -3.77 -0.14 0.00 -1.51 0.00 0.00 54.79 49.37 2d9v n ASP 69 Cb 0.09 -0.65 -0.08 0.00 2.34 0.00 0.00 41.12 42.82 2d9v n ASP 69 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 2d9v s VAL 70 N -3.98 -0.00 -0.19 5.18 0.11 -1.26 -5.15 120.40 115.11 2d9v s VAL 70 Ca 0.52 0.00 -0.13 0.00 -2.93 0.00 0.00 61.98 59.44 2d9v s VAL 70 Cb 0.44 -0.82 -0.05 0.00 -1.53 0.00 0.00 36.38 34.42 2d9v s VAL 70 CO 0.01 0.00 0.28 -1.58 -3.33 0.00 0.00 175.10 170.48 2d9v s GLN 71 N 0.32 4.20 0.37 1.54 0.74 -1.26 -5.07 119.66 120.51 2d9v s GLN 71 Ca -0.00 0.02 -0.26 0.00 0.05 0.00 0.00 55.36 55.17 2d9v s GLN 71 Cb -0.04 -3.48 -0.09 0.00 1.10 0.00 0.00 33.01 30.50 2d9v s GLN 71 CO 0.01 0.14 1.20 -1.25 -0.55 0.00 0.00 175.29 174.83 2d9v s PRO 72 N 0.79 4.16 0.84 1.67 0.04 -1.26 -5.02 135.00 136.22 2d9v s PRO 72 Ca 0.15 1.94 -0.11 0.00 0.04 0.00 0.00 61.00 63.01 2d9v s PRO 72 Cb -0.13 -2.81 0.10 0.00 0.04 0.00 0.00 34.50 31.69 2d9v s PRO 72 CO 0.04 -0.25 1.09 -1.25 0.04 0.00 0.00 177.00 176.67 2d9v s PRO 73 N -2.10 1.71 0.17 0.56 0.04 -1.26 -4.97 135.00 129.14 2d9v s PRO 73 Ca 0.54 0.98 -0.31 0.00 0.04 0.00 0.00 61.00 62.25 2d9v s PRO 73 Cb -0.33 -1.85 -0.09 0.00 0.04 0.00 0.00 34.50 32.27 2d9v s PRO 73 CO 0.42 -1.97 1.46 -2.00 0.04 0.00 0.00 177.00 174.96 2d9v s GLU 74 N -4.92 4.27 0.00 4.56 2.12 -1.26 -3.40 118.70 120.07 2d9v s GLU 74 Ca 0.62 2.23 0.00 0.00 0.36 0.00 0.00 54.97 58.18 2d9v s GLU 74 Cb -0.18 -3.18 0.00 0.00 0.26 0.00 0.00 34.13 31.03 2d9v s GLU 74 CO 0.56 -0.49 0.00 0.41 -0.54 0.00 0.00 175.26 175.21 2d9v n GLY 75 N 3.28 2.74 3.05 -1.50 0.00 -1.26 -5.03 105.19 106.46 2d9v n GLY 75 Ca 0.11 -0.67 -0.28 0.00 0.00 0.00 0.00 46.02 45.19 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 -3.83 -4.47 1.61 3.00 -1.22 -5.07 116.66 106.68 2d9v n ARG 76 Ca 0.00 -1.46 -0.23 0.00 -0.01 0.00 0.00 57.85 56.15 2d9v n ARG 76 Cb 0.00 -1.62 -0.10 0.00 0.00 0.00 0.00 32.46 30.74 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 -3.60 3.14 0.22 0.55 0.01 -1.26 -4.86 113.70 107.90 2d9v s SER 77 Ca 0.63 -1.19 -0.08 0.00 1.31 0.00 0.00 55.95 56.62 2d9v s SER 77 Cb -0.09 -0.24 0.29 0.00 0.21 0.00 0.00 66.02 66.19 2d9v s SER 77 CO 0.51 -0.28 1.81 0.03 0.41 0.00 0.00 173.24 175.71 2d9v h ARG 78 N 2.19 0.70 0.00 12.44 3.08 -1.97 0.69 114.38 131.49 2d9v h ARG 78 Ca -0.41 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.60 2d9v h ARG 78 Cb 1.24 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 31.13 2d9v h ARG 78 CO 0.68 0.46 0.24 -0.44 -1.07 0.00 0.00 179.97 179.84 2d9v h ASP 79 N 0.72 0.00 0.67 7.04 3.32 -1.95 0.14 116.42 126.36 2d9v h ASP 79 Ca 0.33 0.00 -0.21 0.00 0.02 0.00 0.00 57.03 57.17 2d9v h ASP 79 Cb 0.24 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 2d9v h ASP 79 CO -0.20 0.00 -0.94 1.23 -1.72 0.00 0.00 179.24 177.60 2d9v h GLY 80 N 0.00 0.18 -3.24 2.75 0.00 -1.14 -3.37 103.07 98.26 2d9v h GLY 80 Ca 0.00 -0.36 -0.58 0.00 0.00 0.00 0.00 47.33 46.39 2d9v h GLY 80 CO 0.00 0.32 -0.73 1.04 0.00 0.00 0.00 176.54 177.16 2d9v n LEU 81 N -3.59 -1.06 -3.18 3.11 4.32 0.50 -0.55 117.00 116.56 2d9v n LEU 81 Ca -0.04 0.63 0.04 0.00 -0.02 0.00 0.00 56.01 56.63 2d9v n LEU 81 Cb 0.86 -1.06 -0.02 0.00 -1.62 0.00 0.00 43.42 41.58 2d9v n LEU 81 CO 0.48 -3.82 0.37 -0.22 -1.22 0.00 0.00 177.39 172.98 2d9v s LEU 82 N 2.32 -0.94 -0.11 2.23 2.96 0.13 -2.33 118.68 122.93 2d9v s LEU 82 Ca 0.62 0.64 -0.00 0.00 -0.22 0.00 0.00 54.13 55.17 2d9v s LEU 82 Cb -0.41 1.81 -0.02 0.00 0.50 0.00 0.00 46.19 48.07 2d9v s LEU 82 CO 0.61 -0.18 -0.10 -0.89 -1.32 0.00 0.00 176.35 174.47 2d9v s THR 83 N 2.88 3.38 -0.14 3.68 2.01 0.20 -0.95 115.64 126.71 2d9v s THR 83 Ca 0.10 -0.57 -0.01 0.00 0.31 0.00 0.00 61.69 61.52 2d9v s THR 83 Cb -0.12 -2.41 -0.01 0.00 0.01 0.00 0.00 72.50 69.96 2d9v s THR 83 CO -0.16 0.54 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.50 2d9v s VAL 84 N -0.06 3.11 -0.02 3.82 1.01 -0.53 -1.22 120.40 126.51 2d9v s VAL 84 Ca -0.01 -0.63 -0.14 0.00 0.00 0.00 0.00 61.98 61.20 2d9v s VAL 84 Cb -0.14 -2.32 -0.05 0.00 0.00 0.00 0.00 36.38 33.87 2d9v s VAL 84 CO 0.03 0.51 0.37 0.20 0.00 0.00 0.00 175.10 176.22 2d9v s ASN 85 N 0.45 6.75 0.05 3.32 0.01 -0.25 0.46 114.94 125.73 2d9v s ASN 85 Ca -0.09 0.89 0.08 0.00 -0.71 0.00 0.00 52.86 53.03 2d9v s ASN 85 Cb -0.16 -2.23 -0.03 0.00 0.41 0.00 0.00 41.25 39.25 2d9v s ASN 85 CO 0.04 0.33 -0.22 -0.76 -1.51 0.00 0.00 177.10 174.99 2d9v s LEU 86 N -1.03 2.42 0.15 0.60 1.43 -0.01 -2.36 118.68 119.89 2d9v s LEU 86 Ca 0.22 -0.51 -0.15 0.00 -1.03 0.00 0.00 54.13 52.66 2d9v s LEU 86 Cb -0.16 -1.41 0.02 0.00 0.03 0.00 0.00 46.19 44.66 2d9v s LEU 86 CO 0.12 0.25 1.74 0.03 0.23 0.00 0.00 176.35 178.72 2d9v h ARG 87 N 4.58 0.61 -0.83 1.70 3.08 -0.54 -2.92 114.38 120.05 2d9v h ARG 87 Ca -0.47 -0.08 0.22 0.00 0.07 0.00 0.00 59.98 59.72 2d9v h ARG 87 Cb 1.15 -0.12 -0.16 0.00 0.08 0.00 0.00 29.97 30.93 2d9v h ARG 87 CO 0.45 0.50 -0.02 -0.85 -1.07 0.00 0.00 179.97 178.99 2d9v n GLU 88 N -4.69 -0.07 0.00 0.04 0.28 -1.26 -4.70 120.64 110.24 2d9v n GLU 88 Ca 0.01 1.26 0.00 0.00 -0.16 0.00 0.00 57.16 58.26 2d9v n GLU 88 Cb 0.09 -1.98 0.00 0.00 1.43 0.00 0.00 31.44 30.98 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 -1.44 0.36 3.45 -1.84 0.00 -1.10 -5.09 105.19 99.53 2d9v n GLY 89 Ca 0.19 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.10 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 -0.36 -0.52 0.33 1.61 0.15 -1.23 -5.05 113.70 108.64 2d9v s SER 90 Ca 0.00 -0.02 0.09 0.00 0.70 0.00 0.00 55.95 56.72 2d9v s SER 90 Cb 0.00 0.56 -0.06 0.00 -1.71 0.00 0.00 66.02 64.81 2d9v s SER 90 CO 0.00 -0.91 -0.04 0.00 1.20 0.00 0.00 173.24 173.49 2d9v s ARG 91 N -3.62 1.97 -0.27 5.44 1.70 -1.26 -0.83 118.95 122.08 2d9v s ARG 91 Ca 0.02 -1.79 0.02 0.00 -0.47 0.00 0.00 55.73 53.52 2d9v s ARG 91 Cb -0.01 -1.86 0.07 0.00 -0.57 0.00 0.00 34.95 32.58 2d9v s ARG 91 CO -0.11 0.17 -0.05 -0.51 -1.08 0.00 0.00 175.30 173.71 2d9v s LEU 92 N -3.66 3.46 -0.46 -1.89 1.43 0.17 -4.94 118.68 112.79 2d9v s LEU 92 Ca 0.33 -1.52 -0.27 0.00 -1.03 0.00 0.00 54.13 51.65 2d9v s LEU 92 Cb -0.00 -1.45 0.03 0.00 0.03 0.00 0.00 46.19 44.80 2d9v s LEU 92 CO 0.18 -0.25 1.02 -1.00 0.23 0.00 0.00 176.35 176.53 2d9v s HIS 93 N 1.15 2.90 0.27 0.29 3.76 -1.26 -1.46 115.29 120.94 2d9v s HIS 93 Ca -0.03 0.58 0.03 0.00 -0.15 0.00 0.00 55.06 55.49 2d9v s HIS 93 Cb -0.19 -4.13 -0.06 0.00 1.11 0.00 0.00 32.58 29.31 2d9v s HIS 93 CO -0.07 -1.14 0.03 -0.51 -0.85 0.00 0.00 174.74 172.21 2d9v s LEU 94 N 4.02 2.08 -0.17 0.89 1.43 -0.12 -2.74 118.68 124.07 2d9v s LEU 94 Ca 0.42 -1.30 -0.07 0.00 -1.03 0.00 0.00 54.13 52.15 2d9v s LEU 94 Cb -0.09 -0.25 0.07 0.00 0.03 0.00 0.00 46.19 45.95 2d9v s LEU 94 CO 0.28 -0.58 0.38 0.00 0.23 0.00 0.00 176.35 176.65 2d9v n ALA 96 N 5.02 -0.42 -0.08 0.00 0.00 0.29 -0.47 120.51 124.84 2d9v n ALA 96 Ca -0.13 -1.32 -0.12 0.00 0.00 0.00 0.00 53.44 51.87 2d9v n ALA 96 Cb 0.51 0.10 -0.15 0.00 0.00 0.00 0.00 19.45 19.91 2d9v n ALA 96 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2d9v n GLU 97 N -2.63 0.67 -4.10 0.00 0.00 -1.26 -4.71 120.64 108.61 2d9v n GLU 97 Ca 0.12 0.12 -0.13 0.00 0.00 0.00 0.00 57.16 57.26 2d9v n GLU 97 Cb 0.42 -1.60 -0.11 0.00 0.00 0.00 0.00 31.44 30.14 2d9v n GLU 97 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.13 178.08 2d9v s THR 98 N -2.53 0.66 0.25 3.84 -4.23 -1.26 -4.73 115.64 107.64 2d9v s THR 98 Ca -0.14 -1.27 -0.04 0.00 -1.18 0.00 0.00 61.69 59.07 2d9v s THR 98 Cb 0.07 -0.87 0.23 0.00 1.34 0.00 0.00 72.50 73.27 2d9v s THR 98 CO 0.78 -0.44 1.83 0.08 -0.54 0.00 0.00 174.62 176.33 2d9v h ARG 99 N 4.19 0.88 -0.07 3.99 0.11 -1.94 -1.97 114.38 119.58 2d9v h ARG 99 Ca -0.36 -0.05 0.03 0.00 0.10 0.00 0.00 59.98 59.69 2d9v h ARG 99 Cb 1.19 -0.20 -0.04 0.00 1.11 0.00 0.00 29.97 32.04 2d9v h ARG 99 CO 0.45 0.58 -0.14 0.22 0.10 0.00 0.00 179.97 181.18 2d9v h ASP 100 N 0.91 -0.41 -0.06 0.08 3.58 -1.96 -1.90 116.42 116.65 2d9v h ASP 100 Ca 0.41 0.07 0.03 0.00 0.42 0.00 0.00 57.03 57.96 2d9v h ASP 100 Cb 0.31 0.19 -0.03 0.00 1.72 0.00 0.00 39.33 41.52 2d9v h ASP 100 CO -0.22 -0.19 -0.09 0.44 -2.88 0.00 0.00 179.24 176.30 2d9v h ASP 101 N -0.20 -0.29 -0.47 2.28 3.32 -1.84 -1.48 116.42 117.75 2d9v h ASP 101 Ca 0.07 0.05 0.09 0.00 0.02 0.00 0.00 57.03 57.27 2d9v h ASP 101 Cb 0.29 0.14 -0.10 0.00 0.22 0.00 0.00 39.33 39.88 2d9v h ASP 101 CO -0.18 -0.13 -0.24 0.00 -1.72 0.00 0.00 179.24 176.97 2d9v h ALA 102 N 0.91 0.08 -0.94 3.45 0.00 -1.07 -0.07 119.26 121.61 2d9v h ALA 102 Ca 0.06 0.16 0.03 0.00 0.00 0.00 0.00 54.91 55.15 2d9v h ALA 102 Cb 0.21 0.57 -0.05 0.00 0.00 0.00 0.00 17.79 18.52 2d9v h ALA 102 CO -0.14 -0.59 0.61 0.82 0.00 0.00 0.00 179.25 179.95 2d9v h ILE 103 N -0.14 1.18 -0.54 0.00 2.04 -1.05 -2.47 117.51 116.54 2d9v h ILE 103 Ca 0.22 -0.41 0.10 0.00 1.00 0.00 0.00 64.86 65.76 2d9v h ILE 103 Cb 0.48 -0.13 -0.08 0.00 -0.74 0.00 0.00 36.82 36.35 2d9v h ILE 103 CO -0.55 0.22 0.09 0.00 0.00 0.00 0.00 178.15 177.90 2d9v h ALA 104 N 1.37 0.60 -0.27 1.87 0.00 0.05 -1.81 119.26 121.07 2d9v h ALA 104 Ca 0.36 0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.40 2d9v h ALA 104 Cb -0.04 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2d9v h ALA 104 CO -0.11 -0.32 0.17 -1.49 0.00 0.00 0.00 179.25 177.49 2d9v h TRP 105 N 0.22 0.36 -0.96 0.00 4.06 -0.96 -1.07 115.95 117.60 2d9v h TRP 105 Ca 0.27 -0.00 0.20 0.00 2.06 0.00 0.00 58.89 61.43 2d9v h TRP 105 Cb 0.39 -0.12 -0.11 0.00 -1.00 0.00 0.00 29.16 28.32 2d9v h TRP 105 CO -0.25 0.27 0.54 -0.22 -3.56 0.00 0.00 178.44 175.22 2d9v h LYS 106 N 0.35 0.61 -0.07 0.49 3.64 -1.05 0.43 116.57 120.96 2d9v h LYS 106 Ca 0.10 -0.04 -0.11 0.00 -1.27 0.00 0.00 60.65 59.33 2d9v h LYS 106 Cb 0.01 -0.14 0.01 0.00 -0.41 0.00 0.00 32.23 31.70 2d9v h LYS 106 CO -0.02 0.40 -0.40 1.15 -2.27 0.00 0.00 179.45 178.31 2d9v h THR 107 N 0.63 1.41 0.00 1.00 2.02 -0.99 0.10 112.91 117.08 2d9v h THR 107 Ca 0.58 -1.79 -0.03 0.00 0.77 0.00 0.00 66.41 65.93 2d9v h THR 107 Cb 0.98 2.32 -0.00 0.00 -1.74 0.00 0.00 68.15 69.70 2d9v h THR 107 CO -0.43 0.52 -0.15 0.00 0.37 0.00 0.00 175.52 175.83 2d9v h ALA 108 N 0.43 1.69 0.00 6.16 0.00 0.09 -0.14 119.26 127.49 2d9v h ALA 108 Ca -0.03 -0.14 -0.10 0.00 0.00 0.00 0.00 54.91 54.64 2d9v h ALA 108 Cb 1.06 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 2d9v h ALA 108 CO 0.08 0.19 -0.61 -0.07 0.00 0.00 0.00 179.25 178.84 2d9v h LEU 109 N 0.00 0.00 -1.74 0.00 3.38 -0.18 -3.17 115.31 113.60 2d9v h LEU 109 Ca -0.00 -0.59 0.07 0.00 0.09 0.00 0.00 57.88 57.45 2d9v h LEU 109 Cb 0.28 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.00 2d9v h LEU 109 CO 0.02 1.15 0.31 0.24 0.09 0.00 0.00 178.44 180.25 2d9v h MET 110 N -1.00 0.30 0.14 1.13 2.86 -0.75 -0.84 114.93 116.77 2d9v h MET 110 Ca -0.16 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.46 2d9v h MET 110 Cb 1.00 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 32.59 2d9v h MET 110 CO -0.09 0.20 -0.07 0.93 1.06 0.00 0.00 176.91 178.94 2d9v h GLU 111 N 0.31 -0.18 -0.84 1.72 4.39 -1.16 -2.84 114.58 115.99 2d9v h GLU 111 Ca 0.21 0.01 0.24 0.00 0.34 0.00 0.00 59.36 60.16 2d9v h GLU 111 Cb 0.42 0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.07 2d9v h GLU 111 CO -0.05 -0.12 0.68 0.00 -1.16 0.00 0.00 179.01 178.36 2d9v h ALA 112 N -1.81 2.73 -0.43 3.43 0.00 -1.50 0.20 119.26 121.87 2d9v h ALA 112 Ca -0.02 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 2d9v h ALA 112 Cb 0.14 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 2d9v h ALA 112 CO 0.03 -1.11 0.05 -0.97 0.00 0.00 0.00 179.25 177.25 2d9v h ASN 113 N 0.00 0.70 -1.05 0.00 -1.24 -1.15 -3.19 115.58 109.65 2d9v h ASN 113 Ca 0.40 -0.27 -0.60 0.00 0.71 0.00 0.00 56.30 56.54 2d9v h ASN 113 Cb 1.75 -0.19 -0.38 0.00 0.73 0.00 0.00 38.32 40.23 2d9v h ASN 113 CO -0.00 0.79 -0.28 -1.20 -1.29 0.00 0.00 177.43 175.45 2d9v n SER 114 N -4.47 5.71 -3.21 1.15 7.64 0.55 0.56 113.62 121.55 2d9v n SER 114 Ca -0.00 -3.76 -0.00 0.00 1.01 0.00 0.00 58.87 56.12 2d9v n SER 114 Cb 0.25 -0.56 -0.03 0.00 -1.01 0.00 0.00 64.21 62.87 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 -4.87 -0.88 1.15 0.44 2.01 -0.39 -4.98 115.64 108.12 2d9v s THR 115 Ca 0.54 -0.06 -0.17 0.00 0.31 0.00 0.00 61.69 62.30 2d9v s THR 115 Cb 0.43 -0.97 0.26 0.00 0.01 0.00 0.00 72.50 72.23 2d9v s THR 115 CO -0.05 -0.07 1.11 -2.16 -0.69 0.00 0.00 174.62 172.76 2d9v s PRO 116 N 2.75 -0.81 -0.04 4.92 0.04 -1.26 -4.62 135.00 135.97 2d9v s PRO 116 Ca 0.14 0.08 -0.03 0.00 0.04 0.00 0.00 61.00 61.23 2d9v s PRO 116 Cb -0.13 -1.63 -0.04 0.00 0.04 0.00 0.00 34.50 32.74 2d9v s PRO 116 CO -0.23 -3.46 0.13 0.00 0.04 0.00 0.00 177.00 173.47 2d9v s ALA 117 N -3.00 3.77 0.12 8.56 0.00 -1.26 -5.00 121.76 124.95 2d9v s ALA 117 Ca 0.69 -0.77 0.34 0.00 0.00 0.00 0.00 51.96 52.23 2d9v s ALA 117 Cb -0.12 -1.78 1.41 0.00 0.00 0.00 0.00 23.12 22.63 2d9v s ALA 117 CO 0.56 0.69 2.00 -1.00 0.00 0.00 0.00 175.76 178.01 2d9v h PRO 118 N 4.30 0.00 0.88 0.00 0.13 -1.99 -3.25 132.00 132.07 2d9v h PRO 118 Ca -0.51 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.58 2d9v h PRO 118 Cb 1.20 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.34 2d9v h PRO 118 CO 0.63 0.00 -0.42 0.00 -0.23 0.00 0.00 178.00 177.98 2d9v h ALA 119 N 2.01 -1.20 0.00 -0.56 0.00 -2.01 -3.49 119.26 114.00 2d9v h ALA 119 Ca 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.65 2d9v h ALA 119 Cb 0.48 0.46 0.00 0.00 0.00 0.00 0.00 17.79 18.73 2d9v h ALA 119 CO 0.00 -1.11 0.00 0.41 0.00 0.00 0.00 179.25 178.55 2d9v n GLY 120 N -1.26 1.00 3.67 0.00 0.00 -1.23 -5.17 105.19 102.21 2d9v n GLY 120 Ca -0.15 -0.68 -0.30 0.00 0.00 0.00 0.00 46.02 44.89 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 0.00 3.64 0.32 4.61 0.00 -1.26 -5.15 121.76 123.91 2d9v s ALA 121 Ca 0.00 -0.93 0.05 0.00 0.00 0.00 0.00 51.96 51.08 2d9v s ALA 121 Cb 0.00 0.23 -0.06 0.00 0.00 0.00 0.00 23.12 23.28 2d9v s ALA 121 CO 0.00 -0.11 0.02 0.95 0.00 0.00 0.00 175.76 176.61 2d9v s THR 122 N -2.94 1.41 0.00 0.00 -4.23 -1.26 -5.10 115.64 103.53 2d9v s THR 122 Ca 0.15 -2.04 -0.00 0.00 -1.18 0.00 0.00 61.69 58.62 2d9v s THR 122 Cb 0.03 -2.70 -0.04 0.00 1.34 0.00 0.00 72.50 71.14 2d9v s THR 122 CO 0.08 -0.10 0.10 0.68 -0.54 0.00 0.00 174.62 174.84 2d9v s VAL 123 N -3.15 4.85 1.23 2.29 -7.23 -1.26 -5.12 120.40 112.02 2d9v s VAL 123 Ca 0.34 -0.40 -0.20 0.00 -1.81 0.00 0.00 61.98 59.91 2d9v s VAL 123 Cb 0.07 -3.24 0.30 0.00 0.56 0.00 0.00 36.38 34.07 2d9v s VAL 123 CO 0.14 0.32 1.11 -2.16 -0.31 0.00 0.00 175.10 174.21 2d9v s PRO 124 N -1.85 -1.47 0.47 4.82 0.04 -1.26 -4.95 135.00 130.80 2d9v s PRO 124 Ca 0.24 -0.16 -0.23 0.00 0.04 0.00 0.00 61.00 60.90 2d9v s PRO 124 Cb -0.12 -1.58 -0.09 0.00 0.04 0.00 0.00 34.50 32.76 2d9v s PRO 124 CO 0.16 -3.86 1.01 0.45 0.04 0.00 0.00 177.00 174.80 2d9v n SER 125 N -4.85 1.19 -4.15 6.66 2.88 -1.26 -4.94 113.62 109.15 2d9v n SER 125 Ca 0.14 0.97 -0.38 0.00 -1.33 0.00 0.00 58.87 58.27 2d9v n SER 125 Cb 0.60 -1.37 -0.06 0.00 -0.75 0.00 0.00 64.21 62.63 2d9v n SER 125 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2d9v s GLY 126 N -0.86 3.01 0.45 0.46 0.00 -1.26 -4.87 107.32 104.24 2d9v s GLY 126 Ca 0.66 -3.74 0.24 0.00 0.00 0.00 0.00 44.72 41.88 2d9v s GLY 126 CO 0.54 1.21 1.87 -0.56 0.00 0.00 0.00 173.10 176.16 2d9v h PRO 127 N 6.32 0.00 -6.63 2.90 0.13 -2.05 -3.44 132.00 129.24 2d9v h PRO 127 Ca 0.14 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.76 2d9v h PRO 127 Cb 0.85 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.96 2d9v h PRO 127 CO 0.85 0.23 0.35 -1.54 -0.23 0.00 0.00 178.00 177.66 2d9v s SER 128 N -6.24 7.54 -0.37 1.44 1.04 -1.26 -5.03 113.70 110.83 2d9v s SER 128 Ca -0.00 1.84 -0.15 0.00 0.48 0.00 0.00 55.95 58.12 2d9v s SER 128 Cb 0.11 -2.59 -0.00 0.00 0.10 0.00 0.00 66.02 63.64 2d9v s SER 128 CO 0.63 0.02 0.31 -0.55 0.98 0.00 0.00 173.24 174.64 2d9v s SER 129 N -0.46 6.12 0.00 7.02 0.15 -1.26 -5.21 113.70 120.07 2d9v s SER 129 Ca 0.44 -0.51 0.00 0.00 0.70 0.00 0.00 55.95 56.58 2d9v s SER 129 Cb -0.24 -2.17 0.00 0.00 -1.71 0.00 0.00 66.02 61.90 2d9v s SER 129 CO 0.30 -0.36 0.00 0.61 1.20 0.00 0.00 173.24 175.00