#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 0.44 0.59 1.61 0.01 -1.26 -5.03 113.70 110.06 2d9v s SER 2 Ca 0.00 -1.17 0.31 0.00 1.31 0.00 0.00 55.95 56.40 2d9v s SER 2 Cb 0.00 0.26 1.81 0.00 0.21 0.00 0.00 66.02 68.31 2d9v s SER 2 CO 0.00 -0.69 2.24 0.77 0.41 0.00 0.00 173.24 175.97 2d9v h SER 3 N 2.90 0.00 -5.04 2.44 4.64 -2.03 -3.47 113.55 112.98 2d9v h SER 3 Ca -0.35 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 60.98 2d9v h SER 3 Cb 1.19 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 63.16 2d9v h SER 3 CO 0.61 0.02 -1.48 0.61 -0.87 0.00 0.00 176.83 175.71 2d9v n GLY 4 N -1.19 -5.06 3.40 -0.77 0.00 -1.26 -5.07 105.19 95.24 2d9v n GLY 4 Ca -0.03 1.62 -0.13 0.00 0.00 0.00 0.00 46.02 47.47 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 -0.62 -0.52 -0.11 1.61 0.15 -1.26 -5.16 113.70 107.79 2d9v s SER 5 Ca -0.26 1.00 -0.03 0.00 0.70 0.00 0.00 55.95 57.37 2d9v s SER 5 Cb 0.02 1.02 -0.03 0.00 -1.71 0.00 0.00 66.02 65.31 2d9v s SER 5 CO 0.69 -0.17 -0.00 -0.55 1.20 0.00 0.00 173.24 174.41 2d9v s SER 6 N 0.27 5.17 0.00 5.45 0.15 -1.26 -4.74 113.70 118.74 2d9v s SER 6 Ca -0.00 0.08 0.00 0.00 0.70 0.00 0.00 55.95 56.73 2d9v s SER 6 Cb -0.03 -1.56 0.00 0.00 -1.71 0.00 0.00 66.02 62.71 2d9v s SER 6 CO 0.01 0.32 0.00 0.61 1.20 0.00 0.00 173.24 175.38 2d9v n GLY 7 N 2.52 2.02 3.82 9.45 0.00 -1.26 -5.00 105.19 116.74 2d9v n GLY 7 Ca -0.18 0.21 -0.25 0.00 0.00 0.00 0.00 46.02 45.80 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 3.88 0.00 0.99 2.96 -1.26 -2.03 118.68 123.22 2d9v s LEU 8 Ca 0.00 -0.10 -0.04 0.00 -0.22 0.00 0.00 54.13 53.76 2d9v s LEU 8 Cb 0.00 -2.48 -0.02 0.00 0.50 0.00 0.00 46.19 44.19 2d9v s LEU 8 CO 0.00 0.05 -0.09 0.52 -1.32 0.00 0.00 176.35 175.51 2d9v n VAL 9 N -0.51 1.08 -3.76 1.68 0.31 -0.91 -4.89 118.33 111.32 2d9v n VAL 9 Ca -0.08 0.23 -0.12 0.00 -0.01 0.00 0.00 64.34 64.35 2d9v n VAL 9 Cb 0.55 -1.74 -0.08 0.00 -0.91 0.00 0.00 33.84 31.66 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 -2.21 0.75 -0.38 5.55 3.52 -1.26 -5.02 118.95 119.89 2d9v s ARG 10 Ca -0.08 -0.38 0.03 0.00 -0.13 0.00 0.00 55.73 55.17 2d9v s ARG 10 Cb 0.02 0.33 0.16 0.00 -1.56 0.00 0.00 34.95 33.89 2d9v s ARG 10 CO 0.12 -0.23 0.39 0.20 -0.81 0.00 0.00 175.30 174.97 2d9v s GLY 11 N -1.76 0.04 0.08 8.12 0.00 -1.26 -2.86 107.32 109.68 2d9v s GLY 11 Ca -0.09 -1.11 0.07 0.00 0.00 0.00 0.00 44.72 43.59 2d9v s GLY 11 CO -0.00 2.72 -0.18 -0.32 0.00 0.00 0.00 173.10 175.31 2d9v s GLY 12 N 1.26 1.06 0.58 0.20 0.00 -1.16 -4.96 107.32 104.30 2d9v s GLY 12 Ca 0.19 -1.10 -0.18 0.00 0.00 0.00 0.00 44.72 43.63 2d9v s GLY 12 CO -0.04 -1.09 1.11 -0.98 0.00 0.00 0.00 173.10 172.10 2d9v s TRP 13 N -1.10 2.72 -0.19 1.90 0.52 -1.26 -2.97 118.94 118.57 2d9v s TRP 13 Ca 0.04 1.55 -0.15 0.00 0.02 0.00 0.00 56.10 57.55 2d9v s TRP 13 Cb -0.10 -3.20 0.05 0.00 -1.15 0.00 0.00 33.47 29.08 2d9v s TRP 13 CO 0.03 -1.48 0.48 -0.51 0.02 0.00 0.00 176.95 175.50 2d9v s LEU 14 N -4.15 0.03 -0.18 2.99 1.43 0.33 -4.93 118.68 114.20 2d9v s LEU 14 Ca 0.69 0.99 -0.29 0.00 -1.03 0.00 0.00 54.13 54.50 2d9v s LEU 14 Cb -0.21 1.65 -0.00 0.00 0.03 0.00 0.00 46.19 47.65 2d9v s LEU 14 CO 0.31 -0.18 1.13 0.26 0.23 0.00 0.00 176.35 178.11 2d9v s TRP 15 N 0.57 3.17 -0.07 0.29 0.52 -0.97 -1.95 118.94 120.49 2d9v s TRP 15 Ca -0.03 1.29 0.01 0.00 0.02 0.00 0.00 56.10 57.40 2d9v s TRP 15 Cb -0.04 -3.36 -0.03 0.00 -1.15 0.00 0.00 33.47 28.89 2d9v s TRP 15 CO -0.03 -0.97 -0.08 0.50 0.02 0.00 0.00 176.95 176.39 2d9v s ARG 16 N 3.11 2.81 -0.10 4.98 3.52 0.54 -0.36 118.95 133.45 2d9v s ARG 16 Ca 0.49 -0.58 -0.16 0.00 -0.13 0.00 0.00 55.73 55.35 2d9v s ARG 16 Cb -0.19 -2.58 -0.05 0.00 -1.56 0.00 0.00 34.95 30.58 2d9v s ARG 16 CO 0.12 0.60 0.40 -1.14 -0.81 0.00 0.00 175.30 174.47 2d9v s GLN 17 N -0.65 4.21 0.45 5.12 0.74 -1.10 -0.54 119.66 127.90 2d9v s GLN 17 Ca 0.10 0.33 -0.01 0.00 0.05 0.00 0.00 55.36 55.83 2d9v s GLN 17 Cb -0.11 -3.38 0.09 0.00 1.10 0.00 0.00 33.01 30.71 2d9v s GLN 17 CO 0.02 0.31 0.61 0.43 -0.55 0.00 0.00 175.29 176.11 2d9v n SER 18 N 3.20 0.77 -0.06 6.67 7.64 -1.12 -4.77 113.62 125.94 2d9v n SER 18 Ca -0.10 -1.66 -0.07 0.00 1.01 0.00 0.00 58.87 58.05 2d9v n SER 18 Cb 0.52 -0.40 -0.02 0.00 -1.01 0.00 0.00 64.21 63.29 2d9v n SER 18 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2d9v n SER 19 N -2.98 1.49 -0.05 6.43 2.88 -1.26 -3.79 113.62 116.34 2d9v n SER 19 Ca 0.10 0.25 -0.14 0.00 -1.33 0.00 0.00 58.87 57.75 2d9v n SER 19 Cb 0.36 -0.66 -0.07 0.00 -0.75 0.00 0.00 64.21 63.08 2d9v n SER 19 CO 0.00 0.00 0.00 0.40 -1.23 0.00 0.00 175.04 174.21 2d9v h ILE 20 N -0.74 1.36 0.00 2.46 5.03 -2.00 -3.06 117.51 120.56 2d9v h ILE 20 Ca 0.00 -1.48 0.00 0.00 -0.12 0.00 0.00 64.86 63.26 2d9v h ILE 20 Cb 0.74 1.97 0.00 0.00 -3.03 0.00 0.00 36.82 36.49 2d9v h ILE 20 CO 0.00 0.44 0.00 -0.07 -0.68 0.00 0.00 178.15 177.84 2d9v h LEU 21 N 0.04 0.00 -1.05 1.44 3.38 -2.01 -3.46 115.31 113.66 2d9v h LEU 21 Ca 0.01 0.00 -0.44 0.00 0.09 0.00 0.00 57.88 57.55 2d9v h LEU 21 Cb 0.82 0.00 -0.27 0.00 0.09 0.00 0.00 40.66 41.30 2d9v h LEU 21 CO 0.06 0.00 -0.63 -2.11 0.09 0.00 0.00 178.44 175.85 2d9v n ARG 22 N -2.53 -0.85 -4.13 1.13 1.85 -1.16 -4.86 116.66 106.12 2d9v n ARG 22 Ca 0.03 0.10 -0.16 0.00 -1.00 0.00 0.00 57.85 56.83 2d9v n ARG 22 Cb 0.36 -3.37 -0.12 0.00 -1.05 0.00 0.00 32.46 28.28 2d9v n ARG 22 CO 0.00 0.00 0.00 0.50 -0.01 0.00 0.00 177.63 178.12 2d9v s ARG 23 N -5.41 0.72 0.08 2.89 3.52 -1.26 -4.86 118.95 114.62 2d9v s ARG 23 Ca 0.58 -0.92 -0.30 0.00 -0.13 0.00 0.00 55.73 54.96 2d9v s ARG 23 Cb -0.34 -0.57 -0.05 0.00 -1.56 0.00 0.00 34.95 32.43 2d9v s ARG 23 CO 0.71 0.11 1.03 -1.58 -0.81 0.00 0.00 175.30 174.77 2d9v s TRP 24 N -1.55 3.66 0.04 5.12 0.52 -1.26 -2.81 118.94 122.67 2d9v s TRP 24 Ca -0.03 1.65 0.05 0.00 0.02 0.00 0.00 56.10 57.79 2d9v s TRP 24 Cb -0.09 -3.17 -0.02 0.00 -1.15 0.00 0.00 33.47 29.04 2d9v s TRP 24 CO 0.01 -0.25 -0.15 -1.59 0.02 0.00 0.00 176.95 174.99 2d9v s LYS 25 N 0.44 1.02 0.27 4.98 -2.85 0.30 -4.88 119.74 119.03 2d9v s LYS 25 Ca 0.51 -0.79 -0.29 0.00 -1.00 0.00 0.00 55.97 54.39 2d9v s LYS 25 Cb -0.25 -1.06 -0.09 0.00 -2.06 0.00 0.00 37.83 34.37 2d9v s LYS 25 CO 0.30 0.26 1.09 1.03 0.10 0.00 0.00 175.35 178.13 2d9v s ARG 26 N -1.15 4.65 -0.15 1.78 0.52 -1.26 -0.34 118.95 123.01 2d9v s ARG 26 Ca 0.03 1.78 -0.13 0.00 -0.52 0.00 0.00 55.73 56.89 2d9v s ARG 26 Cb -0.08 -3.20 0.04 0.00 0.52 0.00 0.00 34.95 32.23 2d9v s ARG 26 CO 0.01 0.23 0.39 -0.80 0.02 0.00 0.00 175.30 175.15 2d9v s ASN 27 N -0.87 -0.42 -0.60 0.23 -0.87 -0.82 -4.92 114.94 106.66 2d9v s ASN 27 Ca 0.44 0.80 -0.19 0.00 -1.57 0.00 0.00 52.86 52.34 2d9v s ASN 27 Cb -0.32 0.79 0.11 0.00 -0.02 0.00 0.00 41.25 41.81 2d9v s ASN 27 CO 0.40 -0.15 0.71 0.86 -2.57 0.00 0.00 177.10 176.36 2d9v s TRP 28 N 0.41 3.02 -0.04 2.20 -0.00 -0.91 -0.51 118.94 123.11 2d9v s TRP 28 Ca -0.02 -1.00 -0.19 0.00 -0.00 0.00 0.00 56.10 54.89 2d9v s TRP 28 Cb -0.04 -4.01 -0.05 0.00 -0.00 0.00 0.00 33.47 29.37 2d9v s TRP 28 CO -0.02 -1.29 0.54 -0.06 -0.00 0.00 0.00 176.95 176.12 2d9v s PHE 29 N 2.61 3.64 -0.04 5.86 0.40 -1.16 -1.72 117.98 127.58 2d9v s PHE 29 Ca 0.12 1.09 0.01 0.00 -0.60 0.00 0.00 56.93 57.55 2d9v s PHE 29 Cb -0.24 -2.56 0.02 0.00 0.51 0.00 0.00 43.02 40.76 2d9v s PHE 29 CO 0.05 0.33 -0.03 0.00 0.70 0.00 0.00 175.22 176.28 2d9v s ALA 30 N -0.06 0.51 -0.12 5.36 0.00 -0.58 -2.97 121.76 123.90 2d9v s ALA 30 Ca 0.29 0.04 -0.12 0.00 0.00 0.00 0.00 51.96 52.17 2d9v s ALA 30 Cb -0.17 -0.36 -0.05 0.00 0.00 0.00 0.00 23.12 22.54 2d9v s ALA 30 CO 0.15 -0.03 0.28 -1.17 0.00 0.00 0.00 175.76 174.99 2d9v s LEU 31 N 0.91 4.32 0.12 0.00 2.96 -1.13 -2.34 118.68 123.52 2d9v s LEU 31 Ca -0.11 0.58 0.03 0.00 -0.22 0.00 0.00 54.13 54.41 2d9v s LEU 31 Cb -0.14 -2.34 -0.04 0.00 0.50 0.00 0.00 46.19 44.17 2d9v s LEU 31 CO -0.01 0.21 0.15 0.26 -1.32 0.00 0.00 176.35 175.64 2d9v s TRP 32 N -0.16 3.25 0.45 5.38 0.52 -0.71 -2.15 118.94 125.51 2d9v s TRP 32 Ca 0.17 0.07 0.12 0.00 0.02 0.00 0.00 56.10 56.47 2d9v s TRP 32 Cb -0.13 -1.60 1.02 0.00 -1.15 0.00 0.00 33.47 31.61 2d9v s TRP 32 CO 0.05 0.53 2.06 -0.07 0.02 0.00 0.00 176.95 179.55 2d9v h LEU 33 N 2.75 0.31 -2.43 2.99 3.38 -1.74 -0.48 115.31 120.09 2d9v h LEU 33 Ca -0.47 -0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.51 2d9v h LEU 33 Cb 1.18 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.86 2d9v h LEU 33 CO 0.66 0.21 0.18 -0.78 0.09 0.00 0.00 178.44 178.80 2d9v h ASP 34 N 0.36 0.00 -0.07 -0.43 1.82 -1.85 -3.45 116.42 112.80 2d9v h ASP 34 Ca 0.14 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.78 2d9v h ASP 34 Cb 0.13 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.14 2d9v h ASP 34 CO -0.03 0.00 0.00 0.61 -1.61 0.00 0.00 179.24 178.21 2d9v n GLY 35 N -1.22 1.07 3.27 -0.78 0.00 -0.19 -4.85 105.19 102.49 2d9v n GLY 35 Ca -0.01 -0.05 -0.19 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.07 1.46 -0.24 2.61 -4.23 -1.23 -0.13 115.64 111.80 2d9v s THR 36 Ca 0.00 -1.81 0.02 0.00 -1.18 0.00 0.00 61.69 58.72 2d9v s THR 36 Cb 0.00 -1.65 0.06 0.00 1.34 0.00 0.00 72.50 72.24 2d9v s THR 36 CO 0.00 -0.42 -0.10 -0.22 -0.54 0.00 0.00 174.62 173.33 2d9v s LEU 37 N -2.60 3.06 -0.08 4.79 2.96 0.45 -1.74 118.68 125.52 2d9v s LEU 37 Ca 0.12 -1.25 0.05 0.00 -0.22 0.00 0.00 54.13 52.83 2d9v s LEU 37 Cb -0.04 -1.44 -0.00 0.00 0.50 0.00 0.00 46.19 45.20 2d9v s LEU 37 CO 0.04 -0.18 -0.24 -0.83 -1.32 0.00 0.00 176.35 173.81 2d9v s GLY 38 N 1.20 1.31 -0.11 7.98 0.00 -0.99 -1.15 107.32 115.56 2d9v s GLY 38 Ca -0.07 -1.00 0.02 0.00 0.00 0.00 0.00 44.72 43.67 2d9v s GLY 38 CO -0.06 -0.48 -0.19 -2.52 0.00 0.00 0.00 173.10 169.85 2d9v s TYR 39 N 0.10 2.67 0.51 1.90 1.13 -1.23 -1.53 117.35 120.90 2d9v s TYR 39 Ca -0.12 -0.85 0.04 0.00 -1.41 0.00 0.00 57.07 54.73 2d9v s TYR 39 Cb -0.16 -1.77 -0.00 0.00 -1.10 0.00 0.00 41.96 38.93 2d9v s TYR 39 CO 0.06 -0.32 0.16 0.71 -2.51 0.00 0.00 175.55 173.66 2d9v s TYR 40 N 0.33 1.90 -0.01 -3.49 1.51 -0.70 -3.41 117.35 113.47 2d9v s TYR 40 Ca -0.15 -0.86 -0.13 0.00 -1.01 0.00 0.00 57.07 54.93 2d9v s TYR 40 Cb -0.17 -1.77 -0.07 0.00 -0.11 0.00 0.00 41.96 39.85 2d9v s TYR 40 CO 0.07 -0.01 0.68 0.45 -1.11 0.00 0.00 175.55 175.64 2d9v h HIS 41 N 1.17 -0.42 -2.01 2.71 3.86 -1.82 -2.40 115.15 116.24 2d9v h HIS 41 Ca -0.41 -0.01 -0.58 0.00 -1.16 0.00 0.00 60.37 58.20 2d9v h HIS 41 Cb 1.30 0.14 -0.13 0.00 1.06 0.00 0.00 27.41 29.78 2d9v h HIS 41 CO 1.20 -0.26 -0.53 0.34 0.86 0.00 0.00 177.93 179.54 2d9v s ASP 42 N -4.04 3.15 0.56 2.45 2.15 -1.26 -4.29 116.67 115.39 2d9v s ASP 42 Ca -0.07 -1.63 0.41 0.00 0.43 0.00 0.00 52.55 51.69 2d9v s ASP 42 Cb 0.01 0.41 1.39 0.00 -0.30 0.00 0.00 42.92 44.43 2d9v s ASP 42 CO 0.20 -0.86 1.42 -1.84 -0.17 0.00 0.00 175.17 173.92 2d9v n GLU 43 N -0.98 0.00 -2.28 4.34 -0.00 -1.26 -4.02 120.64 116.43 2d9v n GLU 43 Ca -0.09 1.02 -0.42 0.00 -0.00 0.00 0.00 57.16 57.67 2d9v n GLU 43 Cb 0.66 -2.43 -0.03 0.00 -0.00 0.00 0.00 31.44 29.64 2d9v n GLU 43 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.13 178.08 2d9v s THR 44 N -4.63 3.74 -0.22 3.84 -4.23 -1.26 -4.88 115.64 107.99 2d9v s THR 44 Ca -0.04 0.68 -0.04 0.00 -1.18 0.00 0.00 61.69 61.11 2d9v s THR 44 Cb 0.21 -4.19 -0.03 0.00 1.34 0.00 0.00 72.50 69.83 2d9v s THR 44 CO 0.72 -0.89 2.85 0.00 -0.54 0.00 0.00 174.62 176.75 2d9v n ALA 45 N 9.76 5.92 0.44 3.99 0.00 -1.26 -4.04 120.51 135.32 2d9v n ALA 45 Ca 0.16 -2.05 0.09 0.00 0.00 0.00 0.00 53.44 51.64 2d9v n ALA 45 Cb 0.49 -1.94 -0.12 0.00 0.00 0.00 0.00 19.45 17.88 2d9v n ALA 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2d9v n GLN 46 N 1.41 0.90 -3.14 0.00 10.64 -1.26 -4.62 117.38 121.30 2d9v n GLN 46 Ca 0.38 -0.08 -0.31 0.00 -1.83 0.00 0.00 57.00 55.16 2d9v n GLN 46 Cb 0.67 -1.38 -0.04 0.00 -0.86 0.00 0.00 30.24 28.63 2d9v n GLN 46 CO 0.00 0.00 0.00 -0.25 -1.83 0.00 0.00 177.06 174.98 2d9v n ASP 47 N -1.75 4.78 -4.51 2.61 8.00 -1.26 -5.04 116.55 119.39 2d9v n ASP 47 Ca 0.00 -3.53 -0.45 0.00 0.71 0.00 0.00 54.79 51.52 2d9v n ASP 47 Cb 0.37 -0.79 -0.06 0.00 -0.02 0.00 0.00 41.12 40.62 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 0.55 1.25 0.01 -1.24 2.13 -1.26 -4.43 120.64 117.65 2d9v n GLU 48 Ca 0.31 0.28 -0.18 0.00 0.66 0.00 0.00 57.16 58.24 2d9v n GLU 48 Cb 0.38 -2.81 -0.11 0.00 0.27 0.00 0.00 31.44 29.17 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 14.54 0.49 -2.17 5.31 4.39 -1.95 -3.49 114.58 131.71 2d9v h GLU 49 Ca -0.29 -0.52 0.21 0.00 0.34 0.00 0.00 59.36 59.11 2d9v h GLU 49 Cb 1.29 0.14 -0.08 0.00 -0.10 0.00 0.00 28.75 30.00 2d9v h GLU 49 CO 1.05 1.16 0.60 0.34 -1.16 0.00 0.00 179.01 181.00 2d9v s ASP 50 N -6.88 -0.10 -0.23 1.42 2.15 -1.26 -5.07 116.67 106.70 2d9v s ASP 50 Ca -0.12 -0.39 -0.07 0.00 0.43 0.00 0.00 52.55 52.39 2d9v s ASP 50 Cb 0.04 0.41 0.11 0.00 -0.30 0.00 0.00 42.92 43.18 2d9v s ASP 50 CO 0.85 -0.76 0.48 -0.60 -0.17 0.00 0.00 175.17 174.97 2d9v s ARG 51 N -2.82 0.40 0.35 4.34 3.52 -1.26 -3.52 118.95 119.97 2d9v s ARG 51 Ca 0.15 1.09 0.08 0.00 -0.13 0.00 0.00 55.73 56.92 2d9v s ARG 51 Cb -0.00 0.41 -0.04 0.00 -1.56 0.00 0.00 34.95 33.76 2d9v s ARG 51 CO 0.01 -0.30 0.22 0.14 -0.81 0.00 0.00 175.30 174.57 2d9v s VAL 52 N 2.69 3.09 -0.00 7.11 -7.23 -0.30 -4.92 120.40 120.84 2d9v s VAL 52 Ca -0.00 -1.55 -0.18 0.00 -1.81 0.00 0.00 61.98 58.44 2d9v s VAL 52 Cb -0.13 -3.05 -0.06 0.00 0.56 0.00 0.00 36.38 33.71 2d9v s VAL 52 CO -0.15 -0.14 0.52 -0.69 -0.31 0.00 0.00 175.10 174.32 2d9v s VAL 53 N -2.40 4.94 -0.15 1.32 1.01 -1.26 -0.41 120.40 123.44 2d9v s VAL 53 Ca 0.40 1.08 0.02 0.00 0.00 0.00 0.00 61.98 63.48 2d9v s VAL 53 Cb -0.03 -3.84 -0.11 0.00 0.00 0.00 0.00 36.38 32.40 2d9v s VAL 53 CO 0.25 0.48 -0.12 -0.38 0.00 0.00 0.00 175.10 175.33 2d9v n ILE 54 N 2.39 0.87 -1.66 2.22 2.08 0.82 -4.57 119.36 121.52 2d9v n ILE 54 Ca -0.10 -0.35 -0.45 0.00 0.56 0.00 0.00 62.75 62.41 2d9v n ILE 54 Cb 0.51 -1.01 -0.04 0.00 -0.75 0.00 0.00 39.64 38.36 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 -2.90 2.41 -4.21 1.39 -0.00 -0.89 -2.37 115.22 108.65 2d9v n HIS 55 Ca -0.26 -0.22 -0.33 0.00 0.46 0.00 0.00 57.72 57.36 2d9v n HIS 55 Cb 0.80 -2.75 -0.08 0.00 -0.12 0.00 0.00 29.99 27.84 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 7.46 -1.11 0.00 1.57 3.72 0.22 -4.74 117.46 124.58 2d9v n PHE 56 Ca 0.22 0.59 0.00 0.00 -0.05 0.00 0.00 57.45 58.21 2d9v n PHE 56 Cb 0.36 -2.17 0.00 0.00 -0.94 0.00 0.00 39.48 36.73 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 -2.42 4.37 -4.68 4.37 5.15 -1.00 -4.94 115.26 116.12 2d9v n ASN 57 Ca -0.12 0.00 -0.42 0.00 -0.60 0.00 0.00 54.58 53.44 2d9v n ASN 57 Cb 0.54 0.36 -0.03 0.00 -0.53 0.00 0.00 39.78 40.12 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 -1.91 3.95 -0.08 3.44 1.01 -1.25 0.14 120.40 125.69 2d9v s VAL 58 Ca 0.00 1.25 -0.15 0.00 0.00 0.00 0.00 61.98 63.08 2d9v s VAL 58 Cb 0.00 -3.80 -0.28 0.00 0.00 0.00 0.00 36.38 32.29 2d9v s VAL 58 CO 0.00 -0.05 0.61 -0.09 0.00 0.00 0.00 175.10 175.57 2d9v h ARG 59 N 8.11 0.29 -2.16 2.72 9.65 -1.38 -3.46 114.38 128.16 2d9v h ARG 59 Ca -0.34 -0.50 0.06 0.00 -1.10 0.00 0.00 59.98 58.10 2d9v h ARG 59 Cb 1.15 0.18 -0.17 0.00 -1.39 0.00 0.00 29.97 29.75 2d9v h ARG 59 CO 0.92 1.24 0.42 0.16 2.80 0.00 0.00 179.97 185.51 2d9v s ASP 60 N -7.10 -0.44 -0.02 -3.80 -4.77 -1.25 -5.01 116.67 94.27 2d9v s ASP 60 Ca -0.18 0.22 0.01 0.00 -3.30 0.00 0.00 52.55 49.29 2d9v s ASP 60 Cb 0.04 0.42 0.01 0.00 -1.09 0.00 0.00 42.92 42.31 2d9v s ASP 60 CO 0.79 -0.60 -0.01 -0.63 0.70 0.00 0.00 175.17 175.42 2d9v s ILE 61 N -2.38 0.21 0.29 2.11 1.01 -1.26 -0.01 121.20 121.17 2d9v s ILE 61 Ca 0.00 -0.02 0.11 0.00 0.00 0.00 0.00 60.65 60.74 2d9v s ILE 61 Cb -0.01 -0.24 -0.05 0.00 0.01 0.00 0.00 42.46 42.16 2d9v s ILE 61 CO -0.04 0.11 -0.16 -0.54 0.00 0.00 0.00 174.94 174.31 2d9v s LYS 62 N 0.51 1.69 -0.08 2.79 -0.14 -0.83 -5.02 119.74 118.68 2d9v s LYS 62 Ca -0.05 -1.81 -0.05 0.00 -1.36 0.00 0.00 55.97 52.70 2d9v s LYS 62 Cb -0.08 -1.69 0.03 0.00 -1.68 0.00 0.00 37.83 34.41 2d9v s LYS 62 CO -0.01 0.26 0.19 0.08 -0.76 0.00 0.00 175.35 175.11 2d9v s VAL 63 N -2.58 -0.02 0.00 3.17 1.01 -1.26 -2.35 120.40 118.36 2d9v s VAL 63 Ca 0.30 0.09 0.00 0.00 0.00 0.00 0.00 61.98 62.37 2d9v s VAL 63 Cb -0.02 -0.29 0.00 0.00 0.00 0.00 0.00 36.38 36.07 2d9v s VAL 63 CO 0.15 0.04 0.00 0.61 0.00 0.00 0.00 175.10 175.89 2d9v n GLY 64 N 3.66 3.04 0.37 4.51 0.00 -0.45 -2.03 105.19 114.29 2d9v n GLY 64 Ca -0.20 -0.10 -0.02 0.00 0.00 0.00 0.00 46.02 45.70 2d9v n GLY 64 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 2d9v h GLN 65 N 0.00 -0.04 -0.95 1.61 3.07 -1.88 0.20 115.11 117.12 2d9v h GLN 65 Ca 0.00 0.00 0.19 0.00 0.09 0.00 0.00 58.65 58.93 2d9v h GLN 65 Cb 0.00 0.01 -0.18 0.00 0.08 0.00 0.00 27.48 27.39 2d9v h GLN 65 CO 0.00 -0.03 -0.24 0.39 0.09 0.00 0.00 178.83 179.04 2d9v n GLU 66 N -5.47 -0.09 -0.84 0.06 -0.58 -0.86 -4.44 120.64 108.42 2d9v n GLU 66 Ca 0.09 1.48 -0.30 0.00 -0.42 0.00 0.00 57.16 58.00 2d9v n GLU 66 Cb 0.39 -2.20 0.17 0.00 -0.57 0.00 0.00 31.44 29.23 2d9v n GLU 66 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2d9v n GLN 68 N -4.24 -1.98 -0.79 0.00 3.00 -1.26 -4.73 117.38 107.38 2d9v n GLN 68 Ca 0.08 -0.56 -0.07 0.00 -0.01 0.00 0.00 57.00 56.44 2d9v n GLN 68 Cb 0.53 -0.88 -0.09 0.00 0.00 0.00 0.00 30.24 29.81 2d9v n GLN 68 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.06 176.81 2d9v n ASP 69 N -2.78 5.35 -4.77 1.08 9.92 -1.26 -4.92 116.55 119.17 2d9v n ASP 69 Ca 0.05 -2.48 -0.41 0.00 -0.53 0.00 0.00 54.79 51.42 2d9v n ASP 69 Cb 0.23 -1.28 -0.02 0.00 -0.64 0.00 0.00 41.12 39.41 2d9v n ASP 69 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 2d9v s VAL 70 N 0.39 2.61 -0.39 2.53 1.01 -1.26 -4.96 120.40 120.33 2d9v s VAL 70 Ca 0.36 0.61 -0.25 0.00 0.00 0.00 0.00 61.98 62.70 2d9v s VAL 70 Cb 0.18 -3.39 0.02 0.00 0.00 0.00 0.00 36.38 33.19 2d9v s VAL 70 CO -0.01 0.14 0.89 -1.10 0.00 0.00 0.00 175.10 175.03 2d9v s GLN 71 N -1.74 3.74 0.54 2.72 -0.21 -1.26 -5.03 119.66 118.42 2d9v s GLN 71 Ca 0.50 0.41 -0.20 0.00 0.02 0.00 0.00 55.36 56.10 2d9v s GLN 71 Cb -0.41 -3.84 -0.06 0.00 1.00 0.00 0.00 33.01 29.71 2d9v s GLN 71 CO 0.54 -1.00 1.13 -1.25 -2.12 0.00 0.00 175.29 172.59 2d9v s PRO 72 N 3.46 3.39 0.66 2.91 0.04 -1.26 -5.02 135.00 139.18 2d9v s PRO 72 Ca 0.36 1.62 -0.15 0.00 0.04 0.00 0.00 61.00 62.88 2d9v s PRO 72 Cb -0.12 -2.03 0.00 0.00 0.04 0.00 0.00 34.50 32.39 2d9v s PRO 72 CO 0.20 -0.82 1.11 -1.25 0.04 0.00 0.00 177.00 176.28 2d9v s PRO 73 N -3.24 2.78 0.51 0.56 0.04 -1.26 -4.97 135.00 129.42 2d9v s PRO 73 Ca 0.72 1.38 -0.21 0.00 0.04 0.00 0.00 61.00 62.93 2d9v s PRO 73 Cb -0.24 -1.95 -0.08 0.00 0.04 0.00 0.00 34.50 32.27 2d9v s PRO 73 CO 0.27 -1.27 0.94 -1.91 0.04 0.00 0.00 177.00 175.07 2d9v n GLU 74 N -2.47 1.08 0.00 4.56 4.07 -1.26 -2.30 120.64 124.32 2d9v n GLU 74 Ca 0.10 0.40 0.00 0.00 -0.06 0.00 0.00 57.16 57.60 2d9v n GLU 74 Cb 0.52 -2.06 0.00 0.00 -0.06 0.00 0.00 31.44 29.84 2d9v n GLU 74 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2d9v n GLY 75 N 1.29 1.76 2.01 8.31 0.00 -1.26 -4.95 105.19 112.34 2d9v n GLY 75 Ca 0.11 -0.17 -0.17 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.00 -4.18 1.61 3.00 -0.97 -5.09 116.66 109.02 2d9v n ARG 76 Ca 0.00 -1.01 -0.13 0.00 -0.01 0.00 0.00 57.85 56.70 2d9v n ARG 76 Cb 0.00 -0.90 -0.10 0.00 0.00 0.00 0.00 32.46 31.45 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 -3.26 1.37 0.18 0.55 0.01 -1.26 -4.87 113.70 106.42 2d9v s SER 77 Ca 0.40 -0.92 -0.18 0.00 1.31 0.00 0.00 55.95 56.57 2d9v s SER 77 Cb -0.04 0.04 0.13 0.00 0.21 0.00 0.00 66.02 66.36 2d9v s SER 77 CO 0.31 -0.35 1.63 0.03 0.41 0.00 0.00 173.24 175.26 2d9v h ARG 78 N 3.21 -0.10 -1.34 12.44 3.08 -1.95 0.17 114.38 129.89 2d9v h ARG 78 Ca -0.36 0.01 0.41 0.00 0.07 0.00 0.00 59.98 60.10 2d9v h ARG 78 Cb 1.18 0.02 -0.10 0.00 0.08 0.00 0.00 29.97 31.15 2d9v h ARG 78 CO 0.59 -0.07 0.90 -0.44 -1.07 0.00 0.00 179.97 179.89 2d9v h ASP 79 N -0.10 0.20 -0.82 7.04 3.32 -1.94 0.66 116.42 124.78 2d9v h ASP 79 Ca 0.22 0.08 0.03 0.00 0.02 0.00 0.00 57.03 57.38 2d9v h ASP 79 Cb 0.44 0.06 -0.05 0.00 0.22 0.00 0.00 39.33 40.01 2d9v h ASP 79 CO -0.53 -0.07 0.54 1.23 -1.72 0.00 0.00 179.24 178.69 2d9v h GLY 80 N 0.12 1.16 -3.49 2.75 0.00 -0.83 -3.12 103.07 99.66 2d9v h GLY 80 Ca 0.75 -0.40 -0.49 0.00 0.00 0.00 0.00 47.33 47.19 2d9v h GLY 80 CO -0.26 0.35 -0.57 1.04 0.00 0.00 0.00 176.54 177.10 2d9v n LEU 81 N -4.45 -1.60 -3.20 3.11 4.32 0.23 -1.07 117.00 114.34 2d9v n LEU 81 Ca 0.11 0.72 0.04 0.00 -0.02 0.00 0.00 56.01 56.86 2d9v n LEU 81 Cb 0.11 -0.69 -0.02 0.00 -1.62 0.00 0.00 43.42 41.21 2d9v n LEU 81 CO 0.35 -2.75 0.27 -0.22 -1.22 0.00 0.00 177.39 173.82 2d9v s LEU 82 N 2.81 -1.15 0.05 2.23 2.96 0.27 -1.34 118.68 124.51 2d9v s LEU 82 Ca 0.46 0.82 0.08 0.00 -0.22 0.00 0.00 54.13 55.28 2d9v s LEU 82 Cb -0.58 2.01 -0.03 0.00 0.50 0.00 0.00 46.19 48.08 2d9v s LEU 82 CO 0.45 -0.22 -0.23 -0.89 -1.32 0.00 0.00 176.35 174.15 2d9v s THR 83 N 2.87 2.45 -0.09 3.68 2.01 -0.99 -1.05 115.64 124.51 2d9v s THR 83 Ca 0.13 -1.34 0.03 0.00 0.31 0.00 0.00 61.69 60.82 2d9v s THR 83 Cb -0.13 -2.01 0.01 0.00 0.01 0.00 0.00 72.50 70.38 2d9v s THR 83 CO -0.19 0.32 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.20 2d9v s VAL 84 N -0.89 1.57 0.06 3.82 1.01 -0.84 -1.95 120.40 123.17 2d9v s VAL 84 Ca 0.13 -0.73 -0.12 0.00 0.00 0.00 0.00 61.98 61.27 2d9v s VAL 84 Cb -0.10 -1.40 -0.06 0.00 0.00 0.00 0.00 36.38 34.82 2d9v s VAL 84 CO 0.04 0.45 0.42 0.20 0.00 0.00 0.00 175.10 176.21 2d9v s ASN 85 N 0.61 6.72 0.13 3.32 0.01 0.99 0.29 114.94 127.00 2d9v s ASN 85 Ca -0.15 0.89 0.07 0.00 -0.71 0.00 0.00 52.86 52.96 2d9v s ASN 85 Cb -0.16 -2.22 -0.04 0.00 0.41 0.00 0.00 41.25 39.24 2d9v s ASN 85 CO 0.05 0.22 -0.07 -0.76 -1.51 0.00 0.00 177.10 175.03 2d9v s LEU 86 N -1.59 3.12 0.32 0.60 1.43 0.64 -1.11 118.68 122.08 2d9v s LEU 86 Ca 0.30 -0.39 0.15 0.00 -1.03 0.00 0.00 54.13 53.15 2d9v s LEU 86 Cb -0.15 -1.87 0.48 0.00 0.03 0.00 0.00 46.19 44.68 2d9v s LEU 86 CO 0.16 0.15 1.65 0.08 0.23 0.00 0.00 176.35 178.62 2d9v h ARG 87 N 3.34 0.00 -0.20 1.70 0.11 0.93 -3.04 114.38 117.21 2d9v h ARG 87 Ca -0.48 0.00 -0.05 0.00 0.10 0.00 0.00 59.98 59.55 2d9v h ARG 87 Cb 1.18 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.24 2d9v h ARG 87 CO 0.54 0.50 -0.09 1.05 0.10 0.00 0.00 179.97 182.07 2d9v h GLU 88 N 0.00 0.31 0.00 0.08 4.11 -1.96 -3.46 114.58 113.65 2d9v h GLU 88 Ca -0.01 -0.07 0.00 0.00 0.07 0.00 0.00 59.36 59.36 2d9v h GLU 88 Cb 1.04 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.25 2d9v h GLU 88 CO 0.07 0.42 0.00 0.41 0.07 0.00 0.00 179.01 179.97 2d9v n GLY 89 N -0.89 0.37 3.58 1.06 0.00 -1.15 -5.17 105.19 103.00 2d9v n GLY 89 Ca -0.00 -0.78 -0.09 0.00 0.00 0.00 0.00 46.02 45.15 2d9v n GLY 89 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2d9v s SER 90 N 0.00 -0.31 0.17 1.61 0.01 -1.25 -5.02 113.70 108.91 2d9v s SER 90 Ca 0.00 0.30 0.09 0.00 1.31 0.00 0.00 55.95 57.65 2d9v s SER 90 Cb 0.00 0.26 -0.04 0.00 0.21 0.00 0.00 66.02 66.45 2d9v s SER 90 CO 0.00 -0.31 -0.15 0.00 0.41 0.00 0.00 173.24 173.19 2d9v s ARG 91 N -1.31 1.86 -0.36 12.44 1.70 -1.26 -0.26 118.95 131.76 2d9v s ARG 91 Ca 0.01 -1.31 -0.04 0.00 -0.47 0.00 0.00 55.73 53.92 2d9v s ARG 91 Cb -0.01 -2.07 0.07 0.00 -0.57 0.00 0.00 34.95 32.37 2d9v s ARG 91 CO -0.01 0.44 0.13 -0.51 -1.08 0.00 0.00 175.30 174.27 2d9v s LEU 92 N -2.61 4.65 -0.42 -1.89 1.43 0.15 -4.93 118.68 115.06 2d9v s LEU 92 Ca 0.22 -1.55 -0.29 0.00 -1.03 0.00 0.00 54.13 51.48 2d9v s LEU 92 Cb -0.09 -1.82 0.02 0.00 0.03 0.00 0.00 46.19 44.33 2d9v s LEU 92 CO 0.13 -0.42 1.16 -1.00 0.23 0.00 0.00 176.35 176.45 2d9v s HIS 93 N 1.27 2.86 0.19 0.29 3.76 -1.26 -1.99 115.29 120.40 2d9v s HIS 93 Ca 0.01 0.85 -0.00 0.00 -0.15 0.00 0.00 55.06 55.78 2d9v s HIS 93 Cb -0.21 -4.19 -0.04 0.00 1.11 0.00 0.00 32.58 29.25 2d9v s HIS 93 CO -0.01 -1.23 0.08 -0.51 -0.85 0.00 0.00 174.74 172.22 2d9v s LEU 94 N 4.32 1.61 -0.14 0.89 1.43 -0.22 -2.71 118.68 123.85 2d9v s LEU 94 Ca 0.49 -1.30 -0.11 0.00 -1.03 0.00 0.00 54.13 52.18 2d9v s LEU 94 Cb -0.10 0.20 0.04 0.00 0.03 0.00 0.00 46.19 46.37 2d9v s LEU 94 CO 0.27 -0.74 0.37 0.00 0.23 0.00 0.00 176.35 176.48 2d9v s ALA 96 N 0.60 3.56 0.17 0.00 0.00 -0.23 -2.29 121.76 123.57 2d9v s ALA 96 Ca -0.03 -1.24 -0.14 0.00 0.00 0.00 0.00 51.96 50.55 2d9v s ALA 96 Cb -0.05 -1.35 0.12 0.00 0.00 0.00 0.00 23.12 21.84 2d9v s ALA 96 CO -0.04 0.48 1.75 1.05 0.00 0.00 0.00 175.76 179.00 2d9v h GLU 97 N 2.33 0.30 -5.05 0.00 4.11 -1.92 -3.38 114.58 110.98 2d9v h GLU 97 Ca -0.48 -0.02 -0.56 0.00 0.07 0.00 0.00 59.36 58.37 2d9v h GLU 97 Cb 1.20 -0.07 -0.13 0.00 0.50 0.00 0.00 28.75 30.25 2d9v h GLU 97 CO 0.63 0.20 -0.52 0.95 0.07 0.00 0.00 179.01 180.34 2d9v s THR 98 N -6.15 0.63 0.11 -1.06 -4.23 -1.26 -4.39 115.64 99.30 2d9v s THR 98 Ca -0.13 -2.00 0.17 0.00 -1.18 0.00 0.00 61.69 58.55 2d9v s THR 98 Cb 0.13 -2.35 0.11 0.00 1.34 0.00 0.00 72.50 71.73 2d9v s THR 98 CO 0.72 0.00 1.66 0.08 -0.54 0.00 0.00 174.62 176.54 2d9v h ARG 99 N 1.77 0.00 0.49 3.99 0.11 -1.87 -3.03 114.38 115.84 2d9v h ARG 99 Ca -0.36 0.00 -0.02 0.00 0.10 0.00 0.00 59.98 59.70 2d9v h ARG 99 Cb 1.27 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.36 2d9v h ARG 99 CO 0.58 0.43 -0.23 0.22 0.10 0.00 0.00 179.97 181.06 2d9v h ASP 100 N 0.00 -0.55 -0.73 0.08 3.58 -1.96 -2.56 116.42 114.28 2d9v h ASP 100 Ca -0.00 -0.07 0.11 0.00 0.42 0.00 0.00 57.03 57.48 2d9v h ASP 100 Cb 1.03 0.14 -0.05 0.00 1.72 0.00 0.00 39.33 42.17 2d9v h ASP 100 CO 0.06 -0.17 0.48 0.44 -2.88 0.00 0.00 179.24 177.16 2d9v h ASP 101 N -1.01 0.51 0.46 2.28 5.19 -1.98 -2.32 116.42 119.56 2d9v h ASP 101 Ca -0.07 0.02 -0.02 0.00 -0.62 0.00 0.00 57.03 56.34 2d9v h ASP 101 Cb 0.59 -0.09 0.00 0.00 0.18 0.00 0.00 39.33 40.02 2d9v h ASP 101 CO 0.11 0.30 -0.22 0.00 -3.12 0.00 0.00 179.24 176.31 2d9v h ALA 102 N 1.64 -0.62 -0.65 3.45 0.00 -1.48 -2.96 119.26 118.64 2d9v h ALA 102 Ca 0.34 -0.14 0.11 0.00 0.00 0.00 0.00 54.91 55.21 2d9v h ALA 102 Cb 0.56 0.24 -0.08 0.00 0.00 0.00 0.00 17.79 18.51 2d9v h ALA 102 CO -0.12 -0.83 0.25 0.82 0.00 0.00 0.00 179.25 179.37 2d9v h ILE 103 N -0.65 0.74 -0.77 0.00 2.04 -1.00 -1.90 117.51 115.97 2d9v h ILE 103 Ca -0.06 -0.15 0.15 0.00 1.00 0.00 0.00 64.86 65.80 2d9v h ILE 103 Cb 0.49 0.28 -0.15 0.00 -0.74 0.00 0.00 36.82 36.71 2d9v h ILE 103 CO 0.10 0.08 -0.22 0.00 0.00 0.00 0.00 178.15 178.11 2d9v h ALA 104 N 1.45 0.44 -0.65 1.87 0.00 -1.29 0.29 119.26 121.37 2d9v h ALA 104 Ca 0.34 0.29 -0.07 0.00 0.00 0.00 0.00 54.91 55.46 2d9v h ALA 104 Cb 0.44 0.64 -0.03 0.00 0.00 0.00 0.00 17.79 18.84 2d9v h ALA 104 CO -0.33 -0.45 0.12 -1.49 0.00 0.00 0.00 179.25 177.10 2d9v h TRP 105 N -0.02 1.13 -0.40 0.00 4.06 -1.30 0.13 115.95 119.55 2d9v h TRP 105 Ca 0.36 -0.15 0.02 0.00 2.06 0.00 0.00 58.89 61.18 2d9v h TRP 105 Cb 0.57 -0.31 -0.03 0.00 -1.00 0.00 0.00 29.16 28.39 2d9v h TRP 105 CO -0.63 0.94 0.23 -0.22 -3.56 0.00 0.00 178.44 175.20 2d9v h LYS 106 N 0.98 0.46 -0.13 0.49 3.64 -0.12 0.18 116.57 122.07 2d9v h LYS 106 Ca 0.20 -0.03 -0.12 0.00 -1.27 0.00 0.00 60.65 59.44 2d9v h LYS 106 Cb 0.41 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.13 2d9v h LYS 106 CO 0.01 0.30 -0.37 1.15 -2.27 0.00 0.00 179.45 178.27 2d9v h THR 107 N 0.47 1.37 0.00 1.00 2.02 -0.58 0.85 112.91 118.04 2d9v h THR 107 Ca 0.16 -1.67 -0.02 0.00 0.77 0.00 0.00 66.41 65.65 2d9v h THR 107 Cb 0.01 2.09 -0.00 0.00 -1.74 0.00 0.00 68.15 68.51 2d9v h THR 107 CO -0.07 0.50 -0.09 0.00 0.37 0.00 0.00 175.52 176.23 2d9v h ALA 108 N 0.51 1.69 0.00 6.16 0.00 -0.58 -1.59 119.26 125.46 2d9v h ALA 108 Ca -0.01 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.75 2d9v h ALA 108 Cb 0.99 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 2d9v h ALA 108 CO 0.08 0.11 -0.54 -0.07 0.00 0.00 0.00 179.25 178.83 2d9v h LEU 109 N 0.00 0.00 -0.92 0.00 3.38 -0.59 -3.20 115.31 113.99 2d9v h LEU 109 Ca -0.00 -0.27 0.22 0.00 0.09 0.00 0.00 57.88 57.92 2d9v h LEU 109 Cb 0.18 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 40.80 2d9v h LEU 109 CO 0.01 0.94 0.44 0.24 0.09 0.00 0.00 178.44 180.16 2d9v h MET 110 N -1.00 0.44 0.33 1.13 2.86 -0.80 0.12 114.93 118.02 2d9v h MET 110 Ca -0.10 -0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 57.50 2d9v h MET 110 Cb 0.69 -0.10 0.00 0.00 0.06 0.00 0.00 31.60 32.25 2d9v h MET 110 CO -0.06 0.29 -0.16 0.93 1.06 0.00 0.00 176.91 178.97 2d9v h GLU 111 N 0.45 -0.43 -1.12 1.72 5.08 -1.45 -2.43 114.58 116.39 2d9v h GLU 111 Ca 0.58 0.03 0.31 0.00 -1.00 0.00 0.00 59.36 59.28 2d9v h GLU 111 Cb 1.08 0.10 -0.09 0.00 0.50 0.00 0.00 28.75 30.34 2d9v h GLU 111 CO -0.51 -0.29 0.73 0.00 -1.00 0.00 0.00 179.01 177.95 2d9v h ALA 112 N -1.71 2.47 -0.59 3.43 0.00 -1.44 0.65 119.26 122.06 2d9v h ALA 112 Ca -0.05 0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 2d9v h ALA 112 Cb 0.34 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 2d9v h ALA 112 CO 0.08 -0.91 0.14 -0.97 0.00 0.00 0.00 179.25 177.59 2d9v h ASN 113 N 0.27 0.85 -0.61 0.00 -1.24 -0.67 -3.05 115.58 111.13 2d9v h ASN 113 Ca 0.63 -0.16 -0.44 0.00 0.71 0.00 0.00 56.30 57.04 2d9v h ASN 113 Cb 1.83 -0.22 -0.33 0.00 0.73 0.00 0.00 38.32 40.33 2d9v h ASN 113 CO -0.28 0.83 -0.61 -0.24 -1.29 0.00 0.00 177.43 175.84 2d9v n SER 114 N -4.26 4.41 -3.28 1.15 2.88 0.19 0.70 113.62 115.41 2d9v n SER 114 Ca 0.04 -3.78 -0.06 0.00 -1.33 0.00 0.00 58.87 53.74 2d9v n SER 114 Cb 0.24 -0.43 -0.05 0.00 -0.75 0.00 0.00 64.21 63.21 2d9v n SER 114 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 2d9v s THR 115 N -4.30 -0.72 1.05 2.46 2.01 0.11 -4.96 115.64 111.29 2d9v s THR 115 Ca 0.49 -0.14 -0.14 0.00 0.31 0.00 0.00 61.69 62.22 2d9v s THR 115 Cb 0.41 -0.93 0.21 0.00 0.01 0.00 0.00 72.50 72.20 2d9v s THR 115 CO 0.02 -0.15 1.10 -2.16 -0.69 0.00 0.00 174.62 172.73 2d9v s PRO 116 N 2.62 0.00 0.10 4.92 0.04 -1.26 -4.56 135.00 136.86 2d9v s PRO 116 Ca 0.12 0.37 0.07 0.00 0.04 0.00 0.00 61.00 61.61 2d9v s PRO 116 Cb -0.14 -1.70 -0.04 0.00 0.04 0.00 0.00 34.50 32.67 2d9v s PRO 116 CO -0.23 -2.99 -0.12 0.00 0.04 0.00 0.00 177.00 173.70 2d9v s ALA 117 N -2.97 2.88 0.08 8.56 0.00 -1.26 -5.05 121.76 124.00 2d9v s ALA 117 Ca 0.67 -1.25 -0.17 0.00 0.00 0.00 0.00 51.96 51.21 2d9v s ALA 117 Cb -0.17 -0.85 -0.11 0.00 0.00 0.00 0.00 23.12 21.99 2d9v s ALA 117 CO 0.57 0.63 1.39 -1.00 0.00 0.00 0.00 175.76 177.35 2d9v h PRO 118 N 3.74 0.56 -5.13 0.00 0.13 -1.97 -3.48 132.00 125.85 2d9v h PRO 118 Ca -0.49 -0.29 -0.32 0.00 -0.87 0.00 0.00 66.00 64.03 2d9v h PRO 118 Cb 1.17 0.01 0.13 0.00 0.13 0.00 0.00 31.00 32.44 2d9v h PRO 118 CO 0.51 0.88 -0.61 0.00 -0.23 0.00 0.00 178.00 178.54 2d9v n ALA 119 N -2.46 -1.39 -3.03 -0.56 0.00 -1.26 -4.96 120.51 106.85 2d9v n ALA 119 Ca -0.05 0.17 -0.24 0.00 0.00 0.00 0.00 53.44 53.33 2d9v n ALA 119 Cb 0.42 -3.65 -0.04 0.00 0.00 0.00 0.00 19.45 16.19 2d9v n ALA 119 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2d9v n GLY 120 N -1.50 4.95 3.55 0.00 0.00 -1.26 -5.05 105.19 105.88 2d9v n GLY 120 Ca -0.10 -2.43 -0.37 0.00 0.00 0.00 0.00 46.02 43.11 2d9v n GLY 120 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2d9v n ALA 121 N -0.05 0.85 -0.67 4.61 0.00 -1.26 -4.80 120.51 119.19 2d9v n ALA 121 Ca 0.29 -0.88 -0.07 0.00 0.00 0.00 0.00 53.44 52.78 2d9v n ALA 121 Cb 0.48 -3.17 0.01 0.00 0.00 0.00 0.00 19.45 16.77 2d9v n ALA 121 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 2d9v n THR 122 N 7.98 2.33 -4.09 0.00 5.66 -1.26 -4.81 114.28 120.09 2d9v n THR 122 Ca 0.37 -0.99 -0.15 0.00 -3.05 0.00 0.00 64.05 60.23 2d9v n THR 122 Cb 0.53 -1.45 -0.15 0.00 -1.55 0.00 0.00 70.33 67.72 2d9v n THR 122 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 2d9v s VAL 123 N -0.90 0.33 -0.74 1.08 1.01 -1.26 -5.09 120.40 114.83 2d9v s VAL 123 Ca 0.14 -0.16 -0.26 0.00 0.00 0.00 0.00 61.98 61.70 2d9v s VAL 123 Cb 0.10 -0.29 -0.03 0.00 0.00 0.00 0.00 36.38 36.16 2d9v s VAL 123 CO -0.00 0.10 1.90 -2.16 0.00 0.00 0.00 175.10 174.94 2d9v s PRO 124 N 0.02 2.60 0.07 2.72 0.04 -1.26 -4.86 135.00 134.33 2d9v s PRO 124 Ca 0.00 0.21 -0.34 0.00 0.04 0.00 0.00 61.00 60.91 2d9v s PRO 124 Cb -0.03 -4.68 -0.19 0.00 0.04 0.00 0.00 34.50 29.63 2d9v s PRO 124 CO -0.00 -3.02 1.61 1.03 0.04 0.00 0.00 177.00 176.66 2d9v h SER 125 N 13.35 -0.89 -0.05 6.66 0.87 -1.98 -3.49 113.55 128.01 2d9v h SER 125 Ca -0.10 0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.49 2d9v h SER 125 Cb 1.09 0.24 0.00 0.00 -0.44 0.00 0.00 62.40 63.29 2d9v h SER 125 CO 1.22 -0.62 0.00 0.61 -0.53 0.00 0.00 176.83 177.50 2d9v n GLY 126 N -1.54 4.76 0.27 5.77 0.00 -1.26 -4.95 105.19 108.24 2d9v n GLY 126 Ca -0.14 -1.04 0.16 0.00 0.00 0.00 0.00 46.02 44.99 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 0.00 -4.73 1.61 0.13 -2.04 -3.46 132.00 123.51 2d9v h PRO 127 Ca 0.00 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.62 2d9v h PRO 127 Cb 0.00 0.00 0.11 0.00 0.13 0.00 0.00 31.00 31.24 2d9v h PRO 127 CO 0.00 0.05 -0.59 0.43 -0.23 0.00 0.00 178.00 177.66 2d9v n SER 128 N -3.18 -1.66 -4.68 1.44 7.64 -1.26 -4.80 113.62 107.12 2d9v n SER 128 Ca 0.00 0.76 -0.43 0.00 1.01 0.00 0.00 58.87 60.21 2d9v n SER 128 Cb 0.32 -0.72 -0.02 0.00 -1.01 0.00 0.00 64.21 62.77 2d9v n SER 128 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2d9v s SER 129 N -0.79 7.05 0.00 6.43 0.01 -1.26 -5.22 113.70 119.93 2d9v s SER 129 Ca 0.48 1.69 0.00 0.00 1.31 0.00 0.00 55.95 59.43 2d9v s SER 129 Cb -0.61 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.07 2d9v s SER 129 CO 0.47 -0.62 0.00 0.61 0.41 0.00 0.00 173.24 174.10