#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 1.03 -0.16 1.61 0.01 -1.26 -5.16 113.70 109.78 2d9v s SER 2 Ca 0.00 -1.53 -0.02 0.00 1.31 0.00 0.00 55.95 55.72 2d9v s SER 2 Cb 0.00 0.63 0.05 0.00 0.21 0.00 0.00 66.02 66.91 2d9v s SER 2 CO 0.00 -1.23 -0.00 -0.55 0.41 0.00 0.00 173.24 171.87 2d9v s SER 3 N -3.26 2.58 0.17 2.44 0.15 -1.26 -5.04 113.70 109.48 2d9v s SER 3 Ca 0.33 -0.60 0.00 0.00 0.70 0.00 0.00 55.95 56.38 2d9v s SER 3 Cb 0.00 -0.67 0.00 0.00 -1.71 0.00 0.00 66.02 63.65 2d9v s SER 3 CO 0.21 -0.24 0.00 0.61 1.20 0.00 0.00 173.24 175.02 2d9v n GLY 4 N 5.01 -4.65 3.59 9.45 0.00 -1.26 -4.76 105.19 112.57 2d9v n GLY 4 Ca -0.09 -0.49 -0.41 0.00 0.00 0.00 0.00 46.02 45.02 2d9v n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2d9v s SER 5 N -0.72 5.37 0.04 1.61 0.01 -1.26 -4.86 113.70 113.89 2d9v s SER 5 Ca 0.00 1.44 -0.25 0.00 1.31 0.00 0.00 55.95 58.46 2d9v s SER 5 Cb 0.00 -2.51 -0.17 0.00 0.21 0.00 0.00 66.02 63.54 2d9v s SER 5 CO 0.00 -2.10 1.51 -1.28 0.41 0.00 0.00 173.24 171.78 2d9v h SER 6 N 15.28 -0.03 0.00 2.44 0.87 -2.04 -3.48 113.55 126.59 2d9v h SER 6 Ca -0.35 -0.22 0.00 0.00 -1.23 0.00 0.00 61.79 60.00 2d9v h SER 6 Cb 1.22 0.01 0.00 0.00 -0.44 0.00 0.00 62.40 63.19 2d9v h SER 6 CO 1.04 0.20 0.00 0.61 -0.53 0.00 0.00 176.83 178.15 2d9v n GLY 7 N -0.49 3.17 3.83 5.77 0.00 -1.26 -5.07 105.19 111.14 2d9v n GLY 7 Ca -0.08 -1.05 -0.36 0.00 0.00 0.00 0.00 46.02 44.53 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 4.22 -0.12 0.99 0.20 -1.26 -0.19 118.68 122.53 2d9v s LEU 8 Ca 0.00 0.39 -0.05 0.00 0.69 0.00 0.00 54.13 55.16 2d9v s LEU 8 Cb 0.00 -2.02 -0.02 0.00 -0.43 0.00 0.00 46.19 43.72 2d9v s LEU 8 CO 0.00 0.39 -0.10 0.58 -0.29 0.00 0.00 176.35 176.93 2d9v h VAL 9 N 4.06 0.00 -2.67 1.68 2.07 -1.33 -3.47 116.25 116.59 2d9v h VAL 9 Ca -0.53 -0.91 0.08 0.00 0.82 0.00 0.00 66.70 66.16 2d9v h VAL 9 Cb 1.22 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 30.89 2d9v h VAL 9 CO 0.58 0.00 0.35 -0.60 0.02 0.00 0.00 177.57 177.92 2d9v s ARG 10 N -1.91 1.29 0.00 1.57 3.52 -1.26 -5.04 118.95 117.12 2d9v s ARG 10 Ca -0.09 -0.61 0.00 0.00 -0.13 0.00 0.00 55.73 54.90 2d9v s ARG 10 Cb 0.01 0.50 0.00 0.00 -1.56 0.00 0.00 34.95 33.90 2d9v s ARG 10 CO 0.13 -0.58 0.00 0.41 -0.81 0.00 0.00 175.30 174.45 2d9v n GLY 11 N -0.39 7.13 0.00 8.12 0.00 -1.26 -3.35 105.19 115.43 2d9v n GLY 11 Ca -0.09 -1.86 0.00 0.00 0.00 0.00 0.00 46.02 44.07 2d9v n GLY 11 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2d9v n GLY 12 N 3.66 3.69 3.76 -0.02 0.00 -1.26 -4.99 105.19 110.02 2d9v n GLY 12 Ca 0.00 -0.92 -0.37 0.00 0.00 0.00 0.00 46.02 44.73 2d9v n GLY 12 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2d9v s TRP 13 N 0.00 2.52 -0.11 1.61 0.52 -1.26 -3.82 118.94 118.40 2d9v s TRP 13 Ca 0.00 1.48 -0.09 0.00 0.02 0.00 0.00 56.10 57.51 2d9v s TRP 13 Cb 0.00 -3.54 0.03 0.00 -1.15 0.00 0.00 33.47 28.81 2d9v s TRP 13 CO 0.00 -2.18 0.28 -0.51 0.02 0.00 0.00 176.95 174.56 2d9v s LEU 14 N -3.56 0.78 -0.21 2.99 1.43 -0.47 -4.84 118.68 114.80 2d9v s LEU 14 Ca 0.71 0.56 -0.29 0.00 -1.03 0.00 0.00 54.13 54.08 2d9v s LEU 14 Cb -0.33 0.92 0.00 0.00 0.03 0.00 0.00 46.19 46.81 2d9v s LEU 14 CO 0.38 -0.12 1.12 0.26 0.23 0.00 0.00 176.35 178.22 2d9v s TRP 15 N 0.46 3.17 -0.10 0.29 0.52 0.51 -2.51 118.94 121.28 2d9v s TRP 15 Ca -0.03 1.31 -0.02 0.00 0.02 0.00 0.00 56.10 57.39 2d9v s TRP 15 Cb -0.04 -3.35 -0.03 0.00 -1.15 0.00 0.00 33.47 28.90 2d9v s TRP 15 CO -0.02 -0.90 -0.02 0.50 0.02 0.00 0.00 176.95 176.53 2d9v s ARG 16 N 3.30 3.12 -0.24 4.98 3.52 0.04 0.14 118.95 133.82 2d9v s ARG 16 Ca 0.48 -0.46 -0.09 0.00 -0.13 0.00 0.00 55.73 55.52 2d9v s ARG 16 Cb -0.17 -2.79 -0.04 0.00 -1.56 0.00 0.00 34.95 30.39 2d9v s ARG 16 CO 0.09 0.57 0.13 -1.14 -0.81 0.00 0.00 175.30 174.14 2d9v s GLN 17 N -0.53 3.96 0.71 5.12 0.74 -1.02 -0.65 119.66 127.99 2d9v s GLN 17 Ca 0.09 -0.33 -0.08 0.00 0.05 0.00 0.00 55.36 55.08 2d9v s GLN 17 Cb -0.12 -3.46 0.05 0.00 1.10 0.00 0.00 33.01 30.58 2d9v s GLN 17 CO 0.02 0.02 1.04 0.45 -0.55 0.00 0.00 175.29 176.27 2d9v s SER 18 N 1.14 4.98 -0.17 6.67 0.15 -1.07 -4.77 113.70 120.62 2d9v s SER 18 Ca 0.06 0.67 -0.04 0.00 0.70 0.00 0.00 55.95 57.35 2d9v s SER 18 Cb -0.14 -1.37 -0.23 0.00 -1.71 0.00 0.00 66.02 62.57 2d9v s SER 18 CO 0.05 -1.53 0.14 -1.20 1.20 0.00 0.00 173.24 171.89 2d9v n SER 19 N -2.96 2.07 -0.06 5.45 7.64 -1.26 -2.85 113.62 121.65 2d9v n SER 19 Ca 0.07 0.09 -0.17 0.00 1.01 0.00 0.00 58.87 59.87 2d9v n SER 19 Cb 0.60 -0.70 -0.13 0.00 -1.01 0.00 0.00 64.21 62.97 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 0.01 1.51 0.00 0.44 5.03 -2.00 -3.33 117.51 119.17 2d9v h ILE 20 Ca -0.48 -2.33 0.00 0.00 -0.12 0.00 0.00 64.86 61.93 2d9v h ILE 20 Cb 1.97 3.06 0.00 0.00 -3.03 0.00 0.00 36.82 38.81 2d9v h ILE 20 CO 0.01 0.56 -0.05 -0.11 -0.68 0.00 0.00 178.15 177.88 2d9v n LEU 21 N -4.48 0.40 -3.79 1.44 7.94 -1.26 -4.92 117.00 112.33 2d9v n LEU 21 Ca -0.17 0.50 -0.24 0.00 -1.11 0.00 0.00 56.01 54.99 2d9v n LEU 21 Cb 0.59 -0.40 -0.07 0.00 0.53 0.00 0.00 43.42 44.07 2d9v n LEU 21 CO 0.32 -0.07 -0.30 -2.11 -1.11 0.00 0.00 177.39 174.12 2d9v n ARG 22 N -1.85 -0.92 -4.04 1.96 1.85 -1.13 -4.89 116.66 107.64 2d9v n ARG 22 Ca 0.06 0.07 -0.11 0.00 -1.00 0.00 0.00 57.85 56.87 2d9v n ARG 22 Cb 0.38 -2.76 -0.11 0.00 -1.05 0.00 0.00 32.46 28.92 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 -6.02 0.48 0.03 2.89 3.52 -1.26 -4.86 118.95 113.73 2d9v s ARG 23 Ca 0.13 -0.76 -0.27 0.00 -0.13 0.00 0.00 55.73 54.70 2d9v s ARG 23 Cb -0.08 -0.13 -0.05 0.00 -1.56 0.00 0.00 34.95 33.14 2d9v s ARG 23 CO 0.73 0.01 0.85 -1.58 -0.81 0.00 0.00 175.30 174.49 2d9v s TRP 24 N -1.64 3.71 0.02 5.12 0.52 -1.26 -2.61 118.94 122.80 2d9v s TRP 24 Ca -0.10 1.56 0.04 0.00 0.02 0.00 0.00 56.10 57.62 2d9v s TRP 24 Cb -0.08 -2.94 -0.02 0.00 -1.15 0.00 0.00 33.47 29.28 2d9v s TRP 24 CO -0.01 0.16 -0.12 -1.59 0.02 0.00 0.00 176.95 175.41 2d9v s LYS 25 N 0.34 0.86 0.09 4.98 -2.85 0.18 -4.88 119.74 118.46 2d9v s LYS 25 Ca 0.43 -0.62 -0.30 0.00 -1.00 0.00 0.00 55.97 54.49 2d9v s LYS 25 Cb -0.21 -0.83 -0.05 0.00 -2.06 0.00 0.00 37.83 34.68 2d9v s LYS 25 CO 0.25 0.21 0.99 1.03 0.10 0.00 0.00 175.35 177.93 2d9v s ARG 26 N -0.86 4.64 -0.08 1.78 0.52 -1.26 -0.78 118.95 122.91 2d9v s ARG 26 Ca 0.01 1.49 -0.12 0.00 -0.52 0.00 0.00 55.73 56.59 2d9v s ARG 26 Cb -0.07 -3.39 0.03 0.00 0.52 0.00 0.00 34.95 32.04 2d9v s ARG 26 CO 0.01 0.11 0.30 -0.80 0.02 0.00 0.00 175.30 174.94 2d9v s ASN 27 N 0.28 -0.27 -0.64 0.23 0.02 -1.04 -4.97 114.94 108.55 2d9v s ASN 27 Ca 0.49 0.45 -0.18 0.00 -1.02 0.00 0.00 52.86 52.60 2d9v s ASN 27 Cb -0.24 0.53 0.12 0.00 0.02 0.00 0.00 41.25 41.69 2d9v s ASN 27 CO 0.30 -0.20 0.72 0.86 0.02 0.00 0.00 177.10 178.79 2d9v s TRP 28 N -0.28 3.12 -0.35 2.20 -0.11 -1.22 -1.37 118.94 120.92 2d9v s TRP 28 Ca -0.04 -1.15 -0.26 0.00 1.22 0.00 0.00 56.10 55.87 2d9v s TRP 28 Cb -0.03 -3.99 0.01 0.00 -1.50 0.00 0.00 33.47 27.96 2d9v s TRP 28 CO 0.01 -1.24 0.93 -0.06 -4.62 0.00 0.00 176.95 171.97 2d9v s PHE 29 N 2.28 3.11 -0.15 5.86 0.40 -1.25 -3.19 117.98 125.04 2d9v s PHE 29 Ca 0.13 0.87 -0.01 0.00 -0.60 0.00 0.00 56.93 57.32 2d9v s PHE 29 Cb -0.22 -3.59 -0.01 0.00 0.51 0.00 0.00 43.02 39.71 2d9v s PHE 29 CO 0.03 -0.77 -0.12 0.00 0.70 0.00 0.00 175.22 175.05 2d9v s ALA 30 N 3.43 2.61 -0.06 5.36 0.00 -0.98 -4.25 121.76 127.87 2d9v s ALA 30 Ca 0.39 -0.99 -0.15 0.00 0.00 0.00 0.00 51.96 51.21 2d9v s ALA 30 Cb -0.12 -1.30 -0.05 0.00 0.00 0.00 0.00 23.12 21.65 2d9v s ALA 30 CO 0.17 0.05 0.40 -1.17 0.00 0.00 0.00 175.76 175.20 2d9v s LEU 31 N 0.69 4.39 0.02 0.00 2.96 -1.21 -2.77 118.68 122.75 2d9v s LEU 31 Ca -0.06 0.84 0.02 0.00 -0.22 0.00 0.00 54.13 54.71 2d9v s LEU 31 Cb -0.15 -2.56 -0.04 0.00 0.50 0.00 0.00 46.19 43.94 2d9v s LEU 31 CO 0.02 0.22 0.02 0.26 -1.32 0.00 0.00 176.35 175.55 2d9v s TRP 32 N -0.44 3.12 0.56 5.38 0.52 -0.84 -0.84 118.94 126.40 2d9v s TRP 32 Ca 0.23 0.09 0.25 0.00 0.02 0.00 0.00 56.10 56.69 2d9v s TRP 32 Cb -0.16 -1.66 1.53 0.00 -1.15 0.00 0.00 33.47 32.03 2d9v s TRP 32 CO 0.11 0.49 2.11 -0.07 0.02 0.00 0.00 176.95 179.61 2d9v h LEU 33 N 4.07 0.00 -1.84 2.99 3.38 -0.91 0.30 115.31 123.30 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 0.00 0.04 0.44 0.09 0.00 0.00 178.44 179.60 2d9v h ASP 34 N 0.00 0.00 -0.39 -0.43 3.32 -1.91 -3.45 116.42 113.55 2d9v h ASP 34 Ca 0.09 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.14 2d9v h ASP 34 Cb 0.41 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.96 2d9v h ASP 34 CO -0.00 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 178.13 2d9v n GLY 35 N -1.23 0.88 3.19 2.75 0.00 0.09 -4.88 105.19 105.99 2d9v n GLY 35 Ca -0.02 -0.21 -0.11 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.19 0.70 -0.21 2.61 -4.23 -1.21 -0.99 115.64 110.12 2d9v s THR 36 Ca 0.00 -1.95 -0.00 0.00 -1.18 0.00 0.00 61.69 58.56 2d9v s THR 36 Cb 0.00 -1.80 0.06 0.00 1.34 0.00 0.00 72.50 72.09 2d9v s THR 36 CO 0.00 -0.77 -0.04 -0.22 -0.54 0.00 0.00 174.62 173.05 2d9v s LEU 37 N -3.08 2.14 -0.07 4.79 2.96 0.16 -1.98 118.68 123.60 2d9v s LEU 37 Ca 0.15 -1.01 0.03 0.00 -0.22 0.00 0.00 54.13 53.09 2d9v s LEU 37 Cb 0.05 -1.03 0.00 0.00 0.50 0.00 0.00 46.19 45.72 2d9v s LEU 37 CO -0.02 -0.23 -0.17 -0.83 -1.32 0.00 0.00 176.35 173.77 2d9v s GLY 38 N 1.52 0.98 -0.16 7.98 0.00 -1.11 -0.49 107.32 116.03 2d9v s GLY 38 Ca -0.04 -0.65 -0.01 0.00 0.00 0.00 0.00 44.72 44.02 2d9v s GLY 38 CO -0.07 -0.16 -0.11 -2.52 0.00 0.00 0.00 173.10 170.25 2d9v s TYR 39 N 0.37 2.86 0.44 1.90 -0.85 -1.23 -2.32 117.35 118.52 2d9v s TYR 39 Ca -0.12 -0.76 0.06 0.00 -0.52 0.00 0.00 57.07 55.73 2d9v s TYR 39 Cb -0.15 -1.92 -0.05 0.00 0.38 0.00 0.00 41.96 40.22 2d9v s TYR 39 CO 0.05 -0.32 0.12 0.71 -1.52 0.00 0.00 175.55 174.59 2d9v s TYR 40 N 0.69 2.39 0.07 -3.49 1.51 -1.19 -3.53 117.35 113.80 2d9v s TYR 40 Ca -0.05 -0.69 -0.26 0.00 -1.01 0.00 0.00 57.07 55.06 2d9v s TYR 40 Cb -0.15 -1.85 -0.12 0.00 -0.11 0.00 0.00 41.96 39.73 2d9v s TYR 40 CO 0.02 0.21 1.41 0.45 -1.11 0.00 0.00 175.55 176.53 2d9v h HIS 41 N 1.46 -1.10 -5.00 2.71 3.86 -1.87 -3.24 115.15 111.98 2d9v h HIS 41 Ca -0.43 0.02 -0.61 0.00 -1.16 0.00 0.00 60.37 58.19 2d9v h HIS 41 Cb 1.26 0.45 -0.12 0.00 1.06 0.00 0.00 27.41 30.06 2d9v h HIS 41 CO 0.82 -0.47 -0.48 -0.40 0.86 0.00 0.00 177.93 178.27 2d9v n ASP 42 N -4.68 2.25 -0.31 2.45 5.68 -1.26 -4.46 116.55 116.22 2d9v n ASP 42 Ca -0.07 -3.21 0.17 0.00 -0.50 0.00 0.00 54.79 51.17 2d9v n ASP 42 Cb 0.32 0.72 0.36 0.00 -1.14 0.00 0.00 41.12 41.38 2d9v n ASP 42 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 2d9v h GLU 43 N 0.00 0.25 -6.40 0.11 3.07 -1.94 -3.35 114.58 106.31 2d9v h GLU 43 Ca -0.37 -0.01 -0.55 0.00 -0.50 0.00 0.00 59.36 57.92 2d9v h GLU 43 Cb 1.25 -0.06 -0.05 0.00 -0.84 0.00 0.00 28.75 29.05 2d9v h GLU 43 CO 0.60 0.16 1.13 0.95 -1.40 0.00 0.00 179.01 180.45 2d9v s THR 44 N -5.84 3.76 -0.81 1.13 -4.23 -1.26 -4.92 115.64 103.47 2d9v s THR 44 Ca -0.11 0.70 -0.25 0.00 -1.18 0.00 0.00 61.69 60.84 2d9v s THR 44 Cb 0.28 -4.25 -0.09 0.00 1.34 0.00 0.00 72.50 69.78 2d9v s THR 44 CO 0.78 -0.95 2.17 0.00 -0.54 0.00 0.00 174.62 176.08 2d9v s ALA 45 N 6.18 1.27 -0.10 3.99 0.00 -1.26 -4.59 121.76 127.25 2d9v s ALA 45 Ca 0.59 -1.06 -0.04 0.00 0.00 0.00 0.00 51.96 51.45 2d9v s ALA 45 Cb -0.13 -4.54 -0.04 0.00 0.00 0.00 0.00 23.12 18.41 2d9v s ALA 45 CO 0.28 -5.23 -0.12 1.04 0.00 0.00 0.00 175.76 171.73 2d9v n GLN 46 N 8.87 0.21 -3.53 0.00 6.02 -1.26 -4.91 117.38 122.78 2d9v n GLN 46 Ca 0.42 0.09 -0.41 0.00 -0.01 0.00 0.00 57.00 57.08 2d9v n GLN 46 Cb 0.46 -0.88 -0.07 0.00 1.02 0.00 0.00 30.24 30.77 2d9v n GLN 46 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2d9v s ASP 47 N -5.77 5.88 -0.53 1.08 1.01 -1.26 -4.91 116.67 112.16 2d9v s ASP 47 Ca -0.13 -2.43 -0.27 0.00 0.71 0.00 0.00 52.55 50.43 2d9v s ASP 47 Cb 0.05 -2.03 -0.04 0.00 1.01 0.00 0.00 42.92 41.92 2d9v s ASP 47 CO 0.18 -0.56 2.05 -0.70 0.21 0.00 0.00 175.17 176.34 2d9v s GLU 48 N 0.58 2.53 0.03 8.23 2.12 -1.26 -4.17 118.70 126.75 2d9v s GLU 48 Ca 0.13 0.99 -0.20 0.00 0.36 0.00 0.00 54.97 56.25 2d9v s GLU 48 Cb -0.20 -4.44 -0.15 0.00 0.26 0.00 0.00 34.13 29.60 2d9v s GLU 48 CO -0.04 -2.82 1.31 0.93 -0.54 0.00 0.00 175.26 174.10 2d9v h GLU 49 N 16.34 0.37 -1.88 4.30 3.07 -1.96 -3.49 114.58 131.33 2d9v h GLU 49 Ca -0.26 -0.21 0.27 0.00 -0.50 0.00 0.00 59.36 58.65 2d9v h GLU 49 Cb 1.20 0.02 -0.09 0.00 -0.84 0.00 0.00 28.75 29.04 2d9v h GLU 49 CO 1.17 0.79 0.73 0.34 -1.40 0.00 0.00 179.01 180.64 2d9v s ASP 50 N -6.20 -0.07 -0.20 1.42 -1.08 -1.26 -5.07 116.67 104.21 2d9v s ASP 50 Ca -0.14 -0.27 -0.08 0.00 -0.52 0.00 0.00 52.55 51.54 2d9v s ASP 50 Cb 0.05 0.28 0.09 0.00 -1.46 0.00 0.00 42.92 41.87 2d9v s ASP 50 CO 0.76 -0.53 0.44 -0.60 0.52 0.00 0.00 175.17 175.76 2d9v s ARG 51 N -2.55 0.36 -0.05 4.34 3.52 -1.26 -3.47 118.95 119.85 2d9v s ARG 51 Ca 0.17 1.02 0.04 0.00 -0.13 0.00 0.00 55.73 56.82 2d9v s ARG 51 Cb 0.02 0.29 -0.03 0.00 -1.56 0.00 0.00 34.95 33.68 2d9v s ARG 51 CO -0.01 -0.23 -0.14 0.14 -0.81 0.00 0.00 175.30 174.25 2d9v s VAL 52 N 2.39 3.10 0.22 7.11 -7.23 0.35 -4.92 120.40 121.42 2d9v s VAL 52 Ca -0.04 -0.72 -0.30 0.00 -1.81 0.00 0.00 61.98 59.12 2d9v s VAL 52 Cb -0.11 -2.22 -0.09 0.00 0.56 0.00 0.00 36.38 34.52 2d9v s VAL 52 CO -0.13 0.59 1.30 -0.69 -0.31 0.00 0.00 175.10 175.85 2d9v s VAL 53 N -0.74 3.16 -0.20 1.32 1.01 -1.26 0.38 120.40 124.07 2d9v s VAL 53 Ca 0.12 0.99 -0.02 0.00 0.00 0.00 0.00 61.98 63.06 2d9v s VAL 53 Cb -0.11 -3.63 -0.11 0.00 0.00 0.00 0.00 36.38 32.53 2d9v s VAL 53 CO 0.01 0.16 -0.20 -0.38 0.00 0.00 0.00 175.10 174.69 2d9v n ILE 54 N 2.35 1.10 -1.69 2.22 2.08 -0.16 -4.62 119.36 120.65 2d9v n ILE 54 Ca 0.05 -0.38 -0.54 0.00 0.56 0.00 0.00 62.75 62.45 2d9v n ILE 54 Cb 0.43 -1.37 -0.06 0.00 -0.75 0.00 0.00 39.64 37.89 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 -3.33 2.08 -3.95 1.39 -0.00 -0.88 -1.45 115.22 109.08 2d9v n HIS 55 Ca -0.36 0.38 -0.29 0.00 0.46 0.00 0.00 57.72 57.92 2d9v n HIS 55 Cb 0.84 -2.51 -0.07 0.00 -0.12 0.00 0.00 29.99 28.13 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 5.28 -0.98 0.00 1.57 3.72 0.23 -4.72 117.46 122.57 2d9v n PHE 56 Ca 0.24 0.52 0.00 0.00 -0.05 0.00 0.00 57.45 58.15 2d9v n PHE 56 Cb 0.19 -1.94 0.00 0.00 -0.94 0.00 0.00 39.48 36.79 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 -2.07 4.15 -4.57 4.37 5.15 -0.53 -4.92 115.26 116.84 2d9v n ASN 57 Ca -0.12 0.00 -0.42 0.00 -0.60 0.00 0.00 54.58 53.45 2d9v n ASN 57 Cb 0.48 0.65 -0.03 0.00 -0.53 0.00 0.00 39.78 40.36 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 3.92 0.13 3.44 1.01 -1.23 0.80 120.40 126.72 2d9v s VAL 58 Ca 0.00 0.74 -0.10 0.00 0.00 0.00 0.00 61.98 62.62 2d9v s VAL 58 Cb 0.00 -4.79 -0.11 0.00 0.00 0.00 0.00 36.38 31.47 2d9v s VAL 58 CO 0.00 -1.52 1.38 -0.09 0.00 0.00 0.00 175.10 174.87 2d9v h ARG 59 N 9.71 0.76 -2.72 2.72 9.65 -1.50 -3.48 114.38 129.52 2d9v h ARG 59 Ca -0.26 -0.55 0.06 0.00 -1.10 0.00 0.00 59.98 58.13 2d9v h ARG 59 Cb 1.05 0.09 -0.11 0.00 -1.39 0.00 0.00 29.97 29.62 2d9v h ARG 59 CO 1.22 1.17 0.33 0.16 2.80 0.00 0.00 179.97 185.65 2d9v s ASP 60 N -7.02 -0.40 -0.14 -3.80 -4.77 -1.25 -5.01 116.67 94.29 2d9v s ASP 60 Ca -0.10 -0.18 -0.06 0.00 -3.30 0.00 0.00 52.55 48.92 2d9v s ASP 60 Cb 0.10 0.55 0.06 0.00 -1.09 0.00 0.00 42.92 42.54 2d9v s ASP 60 CO 0.89 -0.95 0.30 -0.63 0.70 0.00 0.00 175.17 175.48 2d9v s ILE 61 N -3.55 -0.34 0.11 2.11 1.01 -1.26 -0.00 121.20 119.28 2d9v s ILE 61 Ca 0.06 0.22 0.06 0.00 0.00 0.00 0.00 60.65 60.99 2d9v s ILE 61 Cb -0.02 -0.48 -0.04 0.00 0.01 0.00 0.00 42.46 41.93 2d9v s ILE 61 CO -0.06 0.09 -0.05 -0.54 0.00 0.00 0.00 174.94 174.38 2d9v s LYS 62 N 2.12 2.31 -0.03 2.79 1.02 0.27 -5.00 119.74 123.22 2d9v s LYS 62 Ca -0.02 -0.99 -0.01 0.00 0.02 0.00 0.00 55.97 54.97 2d9v s LYS 62 Cb -0.11 -2.39 0.02 0.00 -0.52 0.00 0.00 37.83 34.83 2d9v s LYS 62 CO -0.10 0.51 0.07 0.08 -0.92 0.00 0.00 175.35 174.99 2d9v s VAL 63 N -1.35 -0.03 0.00 3.17 1.01 -1.26 -1.22 120.40 120.71 2d9v s VAL 63 Ca 0.24 0.13 0.00 0.00 0.00 0.00 0.00 61.98 62.35 2d9v s VAL 63 Cb -0.11 -0.12 0.00 0.00 0.00 0.00 0.00 36.38 36.15 2d9v s VAL 63 CO 0.16 0.05 0.00 0.61 0.00 0.00 0.00 175.10 175.92 2d9v n GLY 64 N 3.77 1.80 0.44 4.51 0.00 -0.20 -2.99 105.19 112.52 2d9v n GLY 64 Ca -0.22 -0.62 0.36 0.00 0.00 0.00 0.00 46.02 45.54 2d9v n GLY 64 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2d9v h GLN 65 N 0.00 0.08 -0.80 1.61 4.15 -1.92 0.71 115.11 118.95 2d9v h GLN 65 Ca 0.00 -0.01 0.14 0.00 0.77 0.00 0.00 58.65 59.56 2d9v h GLN 65 Cb 0.00 -0.02 -0.09 0.00 0.21 0.00 0.00 27.48 27.58 2d9v h GLN 65 CO 0.00 0.06 0.37 0.93 -1.93 0.00 0.00 178.83 178.26 2d9v h GLU 66 N 0.09 0.52 -7.13 1.69 5.08 -1.92 -3.42 114.58 109.49 2d9v h GLU 66 Ca 0.82 -0.03 -0.49 0.00 -1.00 0.00 0.00 59.36 58.66 2d9v h GLU 66 Cb 2.50 -0.12 0.21 0.00 0.50 0.00 0.00 28.75 31.85 2d9v h GLU 66 CO -0.47 0.35 -0.03 0.00 -1.00 0.00 0.00 179.01 177.85 2d9v n GLN 68 N -4.12 -3.08 -0.57 0.00 1.13 -1.26 -4.78 117.38 104.70 2d9v n GLN 68 Ca 0.07 -0.68 -0.04 0.00 -1.94 0.00 0.00 57.00 54.42 2d9v n GLN 68 Cb 0.54 -0.92 0.01 0.00 0.11 0.00 0.00 30.24 29.97 2d9v n GLN 68 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 2d9v n ASP 69 N -4.01 5.52 -4.77 1.08 -0.08 -1.26 -4.92 116.55 108.11 2d9v n ASP 69 Ca 0.06 -2.54 -0.34 0.00 -1.51 0.00 0.00 54.79 50.47 2d9v n ASP 69 Cb 0.28 -1.10 0.02 0.00 2.34 0.00 0.00 41.12 42.67 2d9v n ASP 69 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 2d9v s VAL 70 N -0.49 3.24 -0.29 5.18 1.01 -1.26 -5.01 120.40 122.78 2d9v s VAL 70 Ca 0.07 0.67 -0.12 0.00 0.00 0.00 0.00 61.98 62.59 2d9v s VAL 70 Cb 0.05 -3.21 -0.04 0.00 0.00 0.00 0.00 36.38 33.18 2d9v s VAL 70 CO -0.00 -0.27 0.24 -1.58 0.00 0.00 0.00 175.10 173.49 2d9v s GLN 71 N -3.70 3.89 0.49 2.72 0.74 -1.26 -5.05 119.66 117.48 2d9v s GLN 71 Ca 0.70 -0.30 -0.22 0.00 0.05 0.00 0.00 55.36 55.58 2d9v s GLN 71 Cb -0.22 -3.68 -0.07 0.00 1.10 0.00 0.00 33.01 30.14 2d9v s GLN 71 CO 0.34 -0.25 1.15 -1.25 -0.55 0.00 0.00 175.29 174.74 2d9v s PRO 72 N 1.82 3.62 0.58 1.67 0.04 -1.26 -5.01 135.00 136.46 2d9v s PRO 72 Ca 0.08 1.72 -0.18 0.00 0.04 0.00 0.00 61.00 62.67 2d9v s PRO 72 Cb -0.16 -2.27 -0.04 0.00 0.04 0.00 0.00 34.50 32.06 2d9v s PRO 72 CO 0.11 -0.65 1.12 -1.25 0.04 0.00 0.00 177.00 176.37 2d9v s PRO 73 N -2.89 3.19 0.34 0.56 0.04 -1.26 -4.92 135.00 130.05 2d9v s PRO 73 Ca 0.67 1.54 -0.21 0.00 0.04 0.00 0.00 61.00 63.04 2d9v s PRO 73 Cb -0.27 -1.99 -0.15 0.00 0.04 0.00 0.00 34.50 32.13 2d9v s PRO 73 CO 0.32 -0.97 0.15 -1.91 0.04 0.00 0.00 177.00 174.63 2d9v n GLU 74 N -1.64 0.00 0.00 4.56 2.13 -1.26 -1.41 120.64 123.02 2d9v n GLU 74 Ca 0.11 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.93 2d9v n GLU 74 Cb 0.51 -0.92 0.00 0.00 0.27 0.00 0.00 31.44 31.30 2d9v n GLU 74 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2d9v n GLY 75 N 2.11 1.44 3.48 8.31 0.00 -1.26 -4.93 105.19 114.33 2d9v n GLY 75 Ca 0.11 -0.02 -0.29 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.17 -4.49 1.61 3.00 -0.50 -5.05 116.66 109.06 2d9v n ARG 76 Ca 0.00 -0.60 -0.23 0.00 -0.01 0.00 0.00 57.85 57.01 2d9v n ARG 76 Cb 0.00 -2.15 -0.11 0.00 0.00 0.00 0.00 32.46 30.20 2d9v n ARG 76 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.63 176.51 2d9v s SER 77 N -2.38 2.87 0.33 0.55 0.01 -1.26 -4.75 113.70 109.06 2d9v s SER 77 Ca 0.67 -1.32 0.02 0.00 1.31 0.00 0.00 55.95 56.64 2d9v s SER 77 Cb -0.24 -0.19 0.56 0.00 0.21 0.00 0.00 66.02 66.36 2d9v s SER 77 CO 0.65 -0.49 1.89 0.03 0.41 0.00 0.00 173.24 175.73 2d9v h ARG 78 N 2.07 0.68 0.00 12.44 3.08 -1.96 -1.22 114.38 129.47 2d9v h ARG 78 Ca -0.41 -0.12 0.00 0.00 0.07 0.00 0.00 59.98 59.52 2d9v h ARG 78 Cb 1.24 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 31.18 2d9v h ARG 78 CO 0.72 0.60 0.00 -0.25 -1.07 0.00 0.00 179.97 179.97 2d9v n ASP 79 N -4.32 0.00 0.04 7.04 9.92 -1.26 -1.34 116.55 126.63 2d9v n ASP 79 Ca 0.03 0.50 -0.01 0.00 -0.53 0.00 0.00 54.79 54.78 2d9v n ASP 79 Cb 0.19 -0.50 -0.08 0.00 -0.64 0.00 0.00 41.12 40.10 2d9v n ASP 79 CO 0.00 0.00 0.00 1.23 0.13 0.00 0.00 177.20 178.56 2d9v h GLY 80 N 0.63 0.00 -4.24 0.44 0.00 -1.40 -3.38 103.07 95.12 2d9v h GLY 80 Ca 0.00 0.00 -0.61 0.00 0.00 0.00 0.00 47.33 46.72 2d9v h GLY 80 CO 0.00 0.00 -0.04 1.04 0.00 0.00 0.00 176.54 177.54 2d9v n LEU 81 N -2.99 1.31 -3.37 3.11 4.32 -0.45 -1.24 117.00 117.69 2d9v n LEU 81 Ca -0.08 1.08 -0.08 0.00 -0.02 0.00 0.00 56.01 56.91 2d9v n LEU 81 Cb 0.86 -1.23 -0.08 0.00 -1.62 0.00 0.00 43.42 41.34 2d9v n LEU 81 CO 0.43 -1.89 -0.03 -0.22 -1.22 0.00 0.00 177.39 174.46 2d9v s LEU 82 N 0.74 -0.69 -0.11 2.23 2.96 -0.50 -1.03 118.68 122.28 2d9v s LEU 82 Ca 0.61 0.35 -0.01 0.00 -0.22 0.00 0.00 54.13 54.87 2d9v s LEU 82 Cb -0.66 1.21 -0.02 0.00 0.50 0.00 0.00 46.19 47.21 2d9v s LEU 82 CO 0.58 -0.29 -0.08 -0.89 -1.32 0.00 0.00 176.35 174.35 2d9v s THR 83 N 2.57 3.52 -0.02 3.68 2.01 -0.36 -1.50 115.64 125.54 2d9v s THR 83 Ca 0.12 -0.52 0.07 0.00 0.31 0.00 0.00 61.69 61.68 2d9v s THR 83 Cb -0.15 -2.48 -0.02 0.00 0.01 0.00 0.00 72.50 69.86 2d9v s THR 83 CO -0.16 0.54 -0.25 -0.69 -0.69 0.00 0.00 174.62 173.38 2d9v s VAL 84 N -0.10 2.16 -0.16 3.82 1.01 -0.15 -0.56 120.40 126.41 2d9v s VAL 84 Ca 0.00 -1.07 -0.07 0.00 0.00 0.00 0.00 61.98 60.85 2d9v s VAL 84 Cb -0.13 -1.75 -0.04 0.00 0.00 0.00 0.00 36.38 34.45 2d9v s VAL 84 CO 0.03 0.58 0.07 0.20 0.00 0.00 0.00 175.10 175.98 2d9v s ASN 85 N -0.61 5.77 -0.02 3.32 0.02 1.00 0.62 114.94 125.04 2d9v s ASN 85 Ca 0.10 0.18 0.03 0.00 -1.02 0.00 0.00 52.86 52.14 2d9v s ASN 85 Cb -0.10 -1.92 -0.03 0.00 0.02 0.00 0.00 41.25 39.21 2d9v s ASN 85 CO -0.01 0.25 -0.07 -0.76 0.02 0.00 0.00 177.10 176.53 2d9v s LEU 86 N -0.08 3.15 0.37 0.60 1.43 -0.89 -1.30 118.68 121.96 2d9v s LEU 86 Ca 0.07 -0.11 0.13 0.00 -1.03 0.00 0.00 54.13 53.19 2d9v s LEU 86 Cb -0.12 -1.76 0.94 0.00 0.03 0.00 0.00 46.19 45.28 2d9v s LEU 86 CO 0.01 0.31 1.83 0.03 0.23 0.00 0.00 176.35 178.76 2d9v h ARG 87 N 4.78 0.54 -0.69 1.70 3.08 0.09 0.22 114.38 124.10 2d9v h ARG 87 Ca -0.48 -0.03 0.20 0.00 0.07 0.00 0.00 59.98 59.73 2d9v h ARG 87 Cb 1.17 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 31.07 2d9v h ARG 87 CO 0.53 0.36 0.49 1.05 -1.07 0.00 0.00 179.97 181.33 2d9v h GLU 88 N 0.56 0.02 0.00 0.04 4.11 -1.95 -3.46 114.58 113.90 2d9v h GLU 88 Ca 0.51 -0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.94 2d9v h GLU 88 Cb 1.06 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.30 2d9v h GLU 88 CO -0.25 0.02 0.00 0.41 0.07 0.00 0.00 179.01 179.26 2d9v n GLY 89 N -1.66 3.70 3.77 1.06 0.00 0.77 -5.11 105.19 107.72 2d9v n GLY 89 Ca 0.14 -0.91 -0.33 0.00 0.00 0.00 0.00 46.02 44.91 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 5.19 0.02 1.61 0.01 -1.26 -4.67 113.70 114.61 2d9v s SER 90 Ca 0.00 2.05 0.08 0.00 1.31 0.00 0.00 55.95 59.38 2d9v s SER 90 Cb 0.00 -2.56 -0.03 0.00 0.21 0.00 0.00 66.02 63.64 2d9v s SER 90 CO 0.00 -1.58 -0.22 -0.13 0.41 0.00 0.00 173.24 171.72 2d9v s ARG 91 N -3.94 2.01 -0.28 12.44 0.52 -1.26 -2.11 118.95 126.34 2d9v s ARG 91 Ca 0.68 -1.00 -0.23 0.00 -0.52 0.00 0.00 55.73 54.67 2d9v s ARG 91 Cb -0.21 -2.10 -0.01 0.00 0.52 0.00 0.00 34.95 33.15 2d9v s ARG 91 CO 0.39 0.54 0.75 -0.51 0.02 0.00 0.00 175.30 176.49 2d9v s LEU 92 N -1.17 4.09 -0.41 2.53 1.43 0.20 -4.89 118.68 120.46 2d9v s LEU 92 Ca 0.12 0.74 -0.15 0.00 -1.03 0.00 0.00 54.13 53.81 2d9v s LEU 92 Cb -0.10 -3.03 0.02 0.00 0.03 0.00 0.00 46.19 43.11 2d9v s LEU 92 CO 0.03 -0.52 0.32 -1.00 0.23 0.00 0.00 176.35 175.40 2d9v s HIS 93 N 2.79 3.23 0.33 0.29 3.76 -1.26 -0.98 115.29 123.45 2d9v s HIS 93 Ca 0.31 -0.54 0.03 0.00 -0.15 0.00 0.00 55.06 54.71 2d9v s HIS 93 Cb -0.15 -2.63 -0.04 0.00 1.11 0.00 0.00 32.58 30.88 2d9v s HIS 93 CO 0.10 -0.59 0.13 -0.51 -0.85 0.00 0.00 174.74 173.02 2d9v s LEU 94 N 1.75 1.85 -0.21 0.89 1.43 -0.56 -2.42 118.68 121.40 2d9v s LEU 94 Ca 0.06 -1.54 -0.10 0.00 -1.03 0.00 0.00 54.13 51.52 2d9v s LEU 94 Cb -0.19 -0.01 0.08 0.00 0.03 0.00 0.00 46.19 46.10 2d9v s LEU 94 CO 0.11 -0.83 0.49 0.00 0.23 0.00 0.00 176.35 176.34 2d9v s ALA 96 N 1.97 3.55 0.08 0.00 0.00 -0.38 -0.36 121.76 126.61 2d9v s ALA 96 Ca -0.07 -1.43 -0.01 0.00 0.00 0.00 0.00 51.96 50.45 2d9v s ALA 96 Cb -0.09 -2.19 -0.26 0.00 0.00 0.00 0.00 23.12 20.57 2d9v s ALA 96 CO -0.15 -1.31 1.14 1.05 0.00 0.00 0.00 175.76 176.50 2d9v h GLU 97 N -0.46 0.19 0.00 0.00 4.11 -1.88 -3.43 114.58 113.12 2d9v h GLU 97 Ca -0.40 -0.33 -0.34 0.00 0.07 0.00 0.00 59.36 58.36 2d9v h GLU 97 Cb 1.28 0.12 -0.08 0.00 0.50 0.00 0.00 28.75 30.58 2d9v h GLU 97 CO 0.47 1.14 -0.29 0.25 0.07 0.00 0.00 179.01 180.66 2d9v n THR 98 N -3.47 0.00 0.57 -1.06 -2.24 -1.26 -4.56 114.28 102.26 2d9v n THR 98 Ca -0.07 -1.46 0.12 0.00 -2.27 0.00 0.00 64.05 60.37 2d9v n THR 98 Cb 1.00 0.54 0.15 0.00 -2.10 0.00 0.00 70.33 69.93 2d9v n THR 98 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 2d9v n ARG 99 N -0.55 0.29 -0.02 -0.78 1.85 -1.26 -3.74 116.66 112.45 2d9v n ARG 99 Ca -0.03 0.07 -0.17 0.00 -1.00 0.00 0.00 57.85 56.73 2d9v n ARG 99 Cb 0.38 -1.67 -0.14 0.00 -1.05 0.00 0.00 32.46 29.98 2d9v n ARG 99 CO 0.00 0.00 0.00 0.22 -0.01 0.00 0.00 177.63 177.84 2d9v h ASP 100 N 0.00 0.20 -0.86 2.89 3.58 -1.97 -3.20 116.42 117.06 2d9v h ASP 100 Ca 0.00 -0.97 0.01 0.00 0.42 0.00 0.00 57.03 56.49 2d9v h ASP 100 Cb 0.74 -0.06 -0.04 0.00 1.72 0.00 0.00 39.33 41.68 2d9v h ASP 100 CO 0.00 1.17 0.57 0.44 -2.88 0.00 0.00 179.24 178.54 2d9v h ASP 101 N -0.74 0.98 0.46 2.28 5.19 -1.98 -2.39 116.42 120.21 2d9v h ASP 101 Ca -0.07 -0.02 -0.02 0.00 -0.62 0.00 0.00 57.03 56.30 2d9v h ASP 101 Cb 1.28 -0.24 -0.00 0.00 0.18 0.00 0.00 39.33 40.54 2d9v h ASP 101 CO 0.06 0.70 -0.28 0.00 -3.12 0.00 0.00 179.24 176.60 2d9v h ALA 102 N 1.47 -0.71 -0.60 3.45 0.00 -1.67 -2.68 119.26 118.52 2d9v h ALA 102 Ca 0.32 -0.14 0.10 0.00 0.00 0.00 0.00 54.91 55.18 2d9v h ALA 102 Cb -0.12 0.34 -0.07 0.00 0.00 0.00 0.00 17.79 17.94 2d9v h ALA 102 CO -0.07 -0.91 0.20 0.82 0.00 0.00 0.00 179.25 179.29 2d9v h ILE 103 N -0.70 0.74 -0.49 0.00 2.04 -1.50 -1.92 117.51 115.67 2d9v h ILE 103 Ca -0.05 -0.13 0.10 0.00 1.00 0.00 0.00 64.86 65.78 2d9v h ILE 103 Cb 0.58 0.34 -0.10 0.00 -0.74 0.00 0.00 36.82 36.90 2d9v h ILE 103 CO 0.06 0.07 -0.18 0.00 0.00 0.00 0.00 178.15 178.09 2d9v h ALA 104 N 1.43 0.21 -0.78 1.87 0.00 -1.22 -0.21 119.26 120.56 2d9v h ALA 104 Ca 0.31 0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.39 2d9v h ALA 104 Cb 0.40 0.48 -0.04 0.00 0.00 0.00 0.00 17.79 18.63 2d9v h ALA 104 CO -0.33 -0.51 0.47 -1.49 0.00 0.00 0.00 179.25 177.39 2d9v h TRP 105 N -0.07 1.04 -0.77 0.00 4.06 -1.04 -0.78 115.95 118.37 2d9v h TRP 105 Ca 0.23 -0.00 0.07 0.00 2.06 0.00 0.00 58.89 61.25 2d9v h TRP 105 Cb 0.44 -0.34 -0.06 0.00 -1.00 0.00 0.00 29.16 28.19 2d9v h TRP 105 CO -0.47 0.70 0.45 -0.22 -3.56 0.00 0.00 178.44 175.33 2d9v h LYS 106 N 1.07 0.77 -0.19 0.49 3.64 -0.38 0.12 116.57 122.08 2d9v h LYS 106 Ca 0.28 -0.05 -0.13 0.00 -1.27 0.00 0.00 60.65 59.48 2d9v h LYS 106 Cb -0.03 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 31.61 2d9v h LYS 106 CO -0.05 0.51 -0.39 1.15 -2.27 0.00 0.00 179.45 178.39 2d9v h THR 107 N 0.79 1.33 0.00 1.00 2.02 -0.77 0.11 112.91 117.40 2d9v h THR 107 Ca 0.35 -1.63 -0.03 0.00 0.77 0.00 0.00 66.41 65.88 2d9v h THR 107 Cb 0.25 1.88 -0.00 0.00 -1.74 0.00 0.00 68.15 68.54 2d9v h THR 107 CO -0.21 0.50 -0.15 0.00 0.37 0.00 0.00 175.52 176.04 2d9v h ALA 108 N 0.59 1.73 0.00 6.16 0.00 -0.65 -1.79 119.26 125.31 2d9v h ALA 108 Ca 0.01 -0.14 -0.10 0.00 0.00 0.00 0.00 54.91 54.68 2d9v h ALA 108 Cb 1.00 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 2d9v h ALA 108 CO 0.09 0.19 -0.59 -0.07 0.00 0.00 0.00 179.25 178.87 2d9v h LEU 109 N 0.00 0.00 -0.80 0.00 3.38 -0.70 -3.16 115.31 114.03 2d9v h LEU 109 Ca -0.00 -0.56 0.17 0.00 0.09 0.00 0.00 57.88 57.58 2d9v h LEU 109 Cb 0.27 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 40.91 2d9v h LEU 109 CO 0.02 1.12 0.29 0.24 0.09 0.00 0.00 178.44 180.20 2d9v h MET 110 N -1.00 0.37 0.57 1.13 2.86 -0.73 0.81 114.93 118.94 2d9v h MET 110 Ca -0.14 -0.02 -0.03 0.00 -2.06 0.00 0.00 59.70 57.45 2d9v h MET 110 Cb 0.95 -0.08 0.01 0.00 0.06 0.00 0.00 31.60 32.53 2d9v h MET 110 CO -0.09 0.25 -0.27 0.93 1.06 0.00 0.00 176.91 178.78 2d9v h GLU 111 N 0.38 -0.74 -1.04 1.72 4.39 -1.48 -2.38 114.58 115.43 2d9v h GLU 111 Ca 0.46 0.05 0.29 0.00 0.34 0.00 0.00 59.36 60.50 2d9v h GLU 111 Cb 0.78 0.17 -0.12 0.00 -0.10 0.00 0.00 28.75 29.48 2d9v h GLU 111 CO -0.47 -0.49 0.64 0.00 -1.16 0.00 0.00 179.01 177.52 2d9v h ALA 112 N -1.54 2.05 -0.74 3.43 0.00 -1.43 0.52 119.26 121.55 2d9v h ALA 112 Ca -0.08 0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 2d9v h ALA 112 Cb 0.59 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.41 2d9v h ALA 112 CO 0.13 -0.55 0.39 -0.97 0.00 0.00 0.00 179.25 178.24 2d9v h ASN 113 N 0.42 0.93 -0.95 0.00 -1.24 -0.74 -3.05 115.58 110.96 2d9v h ASN 113 Ca 0.67 -0.11 -0.58 0.00 0.71 0.00 0.00 56.30 56.99 2d9v h ASN 113 Cb 1.54 -0.24 -0.40 0.00 0.73 0.00 0.00 38.32 39.95 2d9v h ASN 113 CO -0.45 0.78 -0.48 -0.24 -1.29 0.00 0.00 177.43 175.75 2d9v n SER 114 N -4.45 5.41 -3.21 1.15 2.88 0.12 0.76 113.62 116.28 2d9v n SER 114 Ca 0.06 -3.75 -0.01 0.00 -1.33 0.00 0.00 58.87 53.84 2d9v n SER 114 Cb 0.10 -0.48 -0.03 0.00 -0.75 0.00 0.00 64.21 63.06 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 -4.79 -0.87 0.90 2.46 2.01 0.14 -4.94 115.64 110.56 2d9v s THR 115 Ca 0.53 -0.07 -0.15 0.00 0.31 0.00 0.00 61.69 62.31 2d9v s THR 115 Cb 0.42 -0.97 0.22 0.00 0.01 0.00 0.00 72.50 72.19 2d9v s THR 115 CO -0.02 -0.07 0.80 -0.81 -0.69 0.00 0.00 174.62 173.83 2d9v n PRO 116 N 5.40 -2.60 -4.01 4.92 -0.04 -1.26 -4.55 135.00 132.86 2d9v n PRO 116 Ca 0.01 -1.28 -0.09 0.00 -0.04 0.00 0.00 63.50 62.10 2d9v n PRO 116 Cb 0.51 -1.20 -0.11 0.00 -0.04 0.00 0.00 33.50 32.67 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 -3.00 0.24 -0.73 0.55 0.00 -1.26 -5.03 121.76 112.53 2d9v s ALA 117 Ca 0.52 -0.69 0.19 0.00 0.00 0.00 0.00 51.96 51.98 2d9v s ALA 117 Cb -0.05 0.15 0.80 0.00 0.00 0.00 0.00 23.12 24.02 2d9v s ALA 117 CO 0.40 -0.16 1.59 -0.35 0.00 0.00 0.00 175.76 177.23 2d9v n PRO 118 N 1.39 0.10 -2.13 0.00 -0.04 -1.26 -4.77 135.00 128.29 2d9v n PRO 118 Ca -0.23 0.34 -0.28 0.00 -0.04 0.00 0.00 63.50 63.30 2d9v n PRO 118 Cb 0.56 -1.69 0.05 0.00 -0.04 0.00 0.00 33.50 32.38 2d9v n PRO 118 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2d9v s ALA 119 N -3.16 3.05 0.10 0.55 0.00 -1.26 -5.10 121.76 115.93 2d9v s ALA 119 Ca 0.05 -0.64 0.01 0.00 0.00 0.00 0.00 51.96 51.38 2d9v s ALA 119 Cb 0.09 -2.78 0.01 0.00 0.00 0.00 0.00 23.12 20.44 2d9v s ALA 119 CO 0.33 -1.15 0.05 0.41 0.00 0.00 0.00 175.76 175.39 2d9v n GLY 120 N -2.90 3.34 3.40 0.00 0.00 -1.26 -5.06 105.19 102.70 2d9v n GLY 120 Ca 0.07 -2.21 -0.45 0.00 0.00 0.00 0.00 46.02 43.43 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 -2.15 3.99 0.05 4.61 0.00 -1.26 -4.91 121.76 122.09 2d9v s ALA 121 Ca 0.04 -3.27 0.09 0.00 0.00 0.00 0.00 51.96 48.81 2d9v s ALA 121 Cb -0.00 -3.82 -0.03 0.00 0.00 0.00 0.00 23.12 19.26 2d9v s ALA 121 CO 0.02 -2.58 -0.24 0.99 0.00 0.00 0.00 175.76 173.95 2d9v s THR 122 N 0.94 1.93 -0.41 0.00 2.01 -1.26 -5.11 115.64 113.75 2d9v s THR 122 Ca 0.30 -1.35 -0.23 0.00 0.31 0.00 0.00 61.69 60.73 2d9v s THR 122 Cb -0.07 -1.67 0.02 0.00 0.01 0.00 0.00 72.50 70.79 2d9v s THR 122 CO -0.07 0.26 0.76 -0.69 -0.69 0.00 0.00 174.62 174.19 2d9v s VAL 123 N -0.84 4.71 -0.67 3.82 1.01 -1.26 -4.99 120.40 122.18 2d9v s VAL 123 Ca 0.10 0.56 -0.26 0.00 0.00 0.00 0.00 61.98 62.38 2d9v s VAL 123 Cb -0.09 -4.25 -0.03 0.00 0.00 0.00 0.00 36.38 32.01 2d9v s VAL 123 CO 0.02 -0.58 1.88 -2.16 0.00 0.00 0.00 175.10 174.27 2d9v s PRO 124 N 3.13 2.61 0.88 2.72 0.04 -1.26 -4.97 135.00 138.16 2d9v s PRO 124 Ca 0.29 0.44 -0.13 0.00 0.04 0.00 0.00 61.00 61.64 2d9v s PRO 124 Cb -0.13 -4.52 0.06 0.00 0.04 0.00 0.00 34.50 29.95 2d9v s PRO 124 CO 0.20 -2.86 0.75 -1.13 0.04 0.00 0.00 177.00 174.00 2d9v n SER 125 N 13.00 -0.77 0.00 6.66 3.41 -1.26 -4.77 113.62 129.89 2d9v n SER 125 Ca 0.24 0.44 0.00 0.00 -0.26 0.00 0.00 58.87 59.29 2d9v n SER 125 Cb 0.51 -1.33 0.00 0.00 -0.26 0.00 0.00 64.21 63.13 2d9v n SER 125 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2d9v n GLY 126 N 1.05 -0.01 3.77 5.00 0.00 -1.26 -5.13 105.19 108.62 2d9v n GLY 126 Ca 0.10 -0.13 -0.33 0.00 0.00 0.00 0.00 46.02 45.67 2d9v n GLY 126 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2d9v s PRO 127 N 0.00 2.66 0.06 1.61 0.04 -1.26 -5.07 135.00 133.04 2d9v s PRO 127 Ca 0.00 1.34 -0.19 0.00 0.04 0.00 0.00 61.00 62.18 2d9v s PRO 127 Cb 0.00 -1.94 0.04 0.00 0.04 0.00 0.00 34.50 32.64 2d9v s PRO 127 CO 0.00 -1.35 0.45 0.45 0.04 0.00 0.00 177.00 176.59 2d9v s SER 128 N -2.79 -0.33 1.33 6.66 0.15 -1.26 -5.17 113.70 112.30 2d9v s SER 128 Ca 0.65 -0.01 -0.18 0.00 0.70 0.00 0.00 55.95 57.11 2d9v s SER 128 Cb -0.20 0.46 0.34 0.00 -1.71 0.00 0.00 66.02 64.92 2d9v s SER 128 CO 0.45 -0.73 0.96 -0.44 1.20 0.00 0.00 173.24 174.68 2d9v s SER 129 N -2.17 -0.41 0.00 5.45 0.01 -1.26 -5.16 113.70 110.16 2d9v s SER 129 Ca -0.04 1.19 0.00 0.00 1.31 0.00 0.00 55.95 58.42 2d9v s SER 129 Cb -0.00 -1.78 0.00 0.00 0.21 0.00 0.00 66.02 64.44 2d9v s SER 129 CO -0.04 -5.01 0.00 0.61 0.41 0.00 0.00 173.24 169.20