#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 -0.73 0.27 1.61 1.04 -1.26 -5.17 113.70 109.46 2d9v s SER 2 Ca 0.00 1.26 0.04 0.00 0.48 0.00 0.00 55.95 57.72 2d9v s SER 2 Cb 0.00 1.43 -0.06 0.00 0.10 0.00 0.00 66.02 67.49 2d9v s SER 2 CO 0.00 -0.22 0.02 -0.55 0.98 0.00 0.00 173.24 173.47 2d9v s SER 3 N 2.08 2.09 0.00 7.02 0.15 -1.26 -4.97 113.70 118.81 2d9v s SER 3 Ca -0.07 -1.29 0.00 0.00 0.70 0.00 0.00 55.95 55.29 2d9v s SER 3 Cb -0.09 -0.03 0.00 0.00 -1.71 0.00 0.00 66.02 64.19 2d9v s SER 3 CO -0.16 -0.54 0.00 0.61 1.20 0.00 0.00 173.24 174.34 2d9v n GLY 4 N -0.54 0.00 0.14 9.45 0.00 -1.26 -4.95 105.19 108.03 2d9v n GLY 4 Ca -0.04 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.71 2d9v n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2d9v n SER 5 N 1.46 1.96 -4.90 1.61 2.88 -1.26 -4.92 113.62 110.45 2d9v n SER 5 Ca 0.00 0.26 -0.28 0.00 -1.33 0.00 0.00 58.87 57.52 2d9v n SER 5 Cb 0.42 -0.76 -0.02 0.00 -0.75 0.00 0.00 64.21 63.11 2d9v n SER 5 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2d9v s SER 6 N -7.31 6.40 0.00 -3.46 0.01 -1.26 -4.43 113.70 103.65 2d9v s SER 6 Ca -0.38 0.85 0.00 0.00 1.31 0.00 0.00 55.95 57.74 2d9v s SER 6 Cb 0.14 -2.21 0.00 0.00 0.21 0.00 0.00 66.02 64.16 2d9v s SER 6 CO 0.52 -0.37 0.00 0.61 0.41 0.00 0.00 173.24 174.41 2d9v n GLY 7 N -1.50 2.88 3.68 3.44 0.00 -1.26 -5.01 105.19 107.42 2d9v n GLY 7 Ca -0.00 -0.74 -0.35 0.00 0.00 0.00 0.00 46.02 44.93 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 3.79 -0.15 0.99 0.20 -1.26 -0.68 118.68 121.56 2d9v s LEU 8 Ca 0.00 0.15 -0.13 0.00 0.69 0.00 0.00 54.13 54.84 2d9v s LEU 8 Cb 0.00 -1.92 -0.04 0.00 -0.43 0.00 0.00 46.19 43.80 2d9v s LEU 8 CO 0.00 0.29 -0.25 0.52 -0.29 0.00 0.00 176.35 176.62 2d9v n VAL 9 N 2.78 1.42 -3.95 1.68 0.31 0.10 -4.93 118.33 115.74 2d9v n VAL 9 Ca -0.18 0.19 -0.10 0.00 -0.01 0.00 0.00 64.34 64.24 2d9v n VAL 9 Cb 0.53 -2.35 -0.10 0.00 -0.91 0.00 0.00 33.84 31.01 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 -2.51 0.40 -0.20 5.55 6.06 -1.26 -4.99 118.95 122.00 2d9v s ARG 10 Ca -0.21 -0.58 -0.15 0.00 -2.50 0.00 0.00 55.73 52.29 2d9v s ARG 10 Cb 0.03 0.15 0.06 0.00 0.06 0.00 0.00 34.95 35.25 2d9v s ARG 10 CO 0.31 -0.08 0.51 0.20 -2.50 0.00 0.00 175.30 173.73 2d9v s GLY 11 N -1.56 -0.41 -0.17 8.12 0.00 -1.26 -1.50 107.32 110.53 2d9v s GLY 11 Ca -0.14 1.64 -0.35 0.00 0.00 0.00 0.00 44.72 45.87 2d9v s GLY 11 CO -0.01 1.59 1.30 -0.32 0.00 0.00 0.00 173.10 175.66 2d9v s GLY 12 N 0.88 -0.31 0.34 0.20 0.00 -0.97 -5.02 107.32 102.43 2d9v s GLY 12 Ca -0.05 1.45 -0.27 0.00 0.00 0.00 0.00 44.72 45.85 2d9v s GLY 12 CO -0.07 0.44 1.05 -0.98 0.00 0.00 0.00 173.10 173.54 2d9v s TRP 13 N -2.27 3.48 -0.19 1.90 0.52 -1.26 -2.18 118.94 118.94 2d9v s TRP 13 Ca 0.12 1.70 -0.15 0.00 0.02 0.00 0.00 56.10 57.78 2d9v s TRP 13 Cb 0.01 -3.15 0.05 0.00 -1.15 0.00 0.00 33.47 29.24 2d9v s TRP 13 CO -0.04 -0.42 0.49 -0.51 0.02 0.00 0.00 176.95 176.49 2d9v s LEU 14 N -2.04 -0.03 0.08 2.99 1.43 0.22 -4.89 118.68 116.43 2d9v s LEU 14 Ca 0.51 1.02 -0.30 0.00 -1.03 0.00 0.00 54.13 54.32 2d9v s LEU 14 Cb -0.25 1.68 -0.06 0.00 0.03 0.00 0.00 46.19 47.59 2d9v s LEU 14 CO 0.32 -0.18 1.17 0.26 0.23 0.00 0.00 176.35 178.15 2d9v s TRP 15 N 0.62 3.47 -0.05 0.29 0.52 -1.01 -2.28 118.94 120.51 2d9v s TRP 15 Ca -0.03 1.38 0.04 0.00 0.02 0.00 0.00 56.10 57.50 2d9v s TRP 15 Cb -0.05 -3.38 -0.02 0.00 -1.15 0.00 0.00 33.47 28.87 2d9v s TRP 15 CO -0.04 -1.09 -0.15 0.50 0.02 0.00 0.00 176.95 176.19 2d9v s ARG 16 N 0.82 2.51 -0.15 4.98 3.52 0.21 -1.05 118.95 129.80 2d9v s ARG 16 Ca 0.57 -0.71 -0.08 0.00 -0.13 0.00 0.00 55.73 55.37 2d9v s ARG 16 Cb -0.29 -2.36 -0.04 0.00 -1.56 0.00 0.00 34.95 30.70 2d9v s ARG 16 CO 0.30 0.60 0.13 -1.14 -0.81 0.00 0.00 175.30 174.39 2d9v s GLN 17 N -0.67 3.70 0.36 5.12 0.74 -0.53 -0.69 119.66 127.69 2d9v s GLN 17 Ca 0.10 -0.17 0.07 0.00 0.05 0.00 0.00 55.36 55.42 2d9v s GLN 17 Cb -0.11 -3.27 -0.01 0.00 1.10 0.00 0.00 33.01 30.72 2d9v s GLN 17 CO 0.01 0.61 0.44 0.45 -0.55 0.00 0.00 175.29 176.24 2d9v s SER 18 N -0.54 5.67 -0.01 6.67 0.15 -1.24 -4.63 113.70 119.78 2d9v s SER 18 Ca 0.12 -0.35 0.22 0.00 0.70 0.00 0.00 55.95 56.64 2d9v s SER 18 Cb -0.12 -1.02 -0.28 0.00 -1.71 0.00 0.00 66.02 62.90 2d9v s SER 18 CO 0.02 -0.49 0.63 -1.54 1.20 0.00 0.00 173.24 173.06 2d9v n SER 19 N -1.60 0.30 -0.07 5.45 3.41 -1.26 -3.30 113.62 116.55 2d9v n SER 19 Ca 0.01 -0.23 -0.08 0.00 -0.26 0.00 0.00 58.87 58.31 2d9v n SER 19 Cb 0.59 1.64 -0.08 0.00 -0.26 0.00 0.00 64.21 66.10 2d9v n SER 19 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 2d9v n ILE 20 N -2.09 0.83 0.15 -1.33 5.41 -1.26 -4.56 119.36 116.51 2d9v n ILE 20 Ca -0.02 -0.41 0.12 0.00 1.00 0.00 0.00 62.75 63.44 2d9v n ILE 20 Cb 0.51 -0.87 0.05 0.00 -0.71 0.00 0.00 39.64 38.62 2d9v n ILE 20 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 176.55 176.80 2d9v h LEU 21 N 0.00 0.00 -1.33 1.39 5.85 -1.99 -3.47 115.31 115.76 2d9v h LEU 21 Ca -0.33 -0.01 -0.59 0.00 0.84 0.00 0.00 57.88 57.79 2d9v h LEU 21 Cb 1.61 0.00 -0.28 0.00 0.37 0.00 0.00 40.66 42.36 2d9v h LEU 21 CO -0.02 0.00 -0.89 0.54 -0.34 0.00 0.00 178.44 177.73 2d9v n ARG 22 N -2.77 -1.75 -3.81 1.25 1.74 -1.21 -4.91 116.66 105.21 2d9v n ARG 22 Ca 0.01 0.23 -0.12 0.00 -0.77 0.00 0.00 57.85 57.20 2d9v n ARG 22 Cb 0.54 -4.70 -0.11 0.00 -1.02 0.00 0.00 32.46 27.18 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 -7.11 0.40 0.25 5.56 6.06 -1.26 -4.93 118.95 117.91 2d9v s ARG 23 Ca 0.65 0.03 -0.30 0.00 -2.50 0.00 0.00 55.73 53.61 2d9v s ARG 23 Cb -0.37 0.18 -0.09 0.00 0.06 0.00 0.00 34.95 34.73 2d9v s ARG 23 CO 0.98 -0.08 1.16 -1.58 -2.50 0.00 0.00 175.30 173.28 2d9v s TRP 24 N -0.55 3.45 -0.03 5.12 0.52 -1.26 -3.68 118.94 122.51 2d9v s TRP 24 Ca -0.07 1.56 0.03 0.00 0.02 0.00 0.00 56.10 57.64 2d9v s TRP 24 Cb -0.04 -3.39 0.00 0.00 -1.15 0.00 0.00 33.47 28.89 2d9v s TRP 24 CO 0.01 -0.96 -0.10 -1.59 0.02 0.00 0.00 176.95 174.33 2d9v s LYS 25 N -1.05 1.09 0.11 4.98 -2.85 0.14 -4.86 119.74 117.29 2d9v s LYS 25 Ca 0.48 -0.35 -0.31 0.00 -1.00 0.00 0.00 55.97 54.79 2d9v s LYS 25 Cb -0.33 -1.00 -0.07 0.00 -2.06 0.00 0.00 37.83 34.37 2d9v s LYS 25 CO 0.41 0.13 1.26 1.03 0.10 0.00 0.00 175.35 178.28 2d9v s ARG 26 N 0.17 4.41 -0.06 1.78 0.52 -1.26 -0.62 118.95 123.90 2d9v s ARG 26 Ca -0.03 1.89 -0.13 0.00 -0.52 0.00 0.00 55.73 56.94 2d9v s ARG 26 Cb -0.09 -3.29 0.02 0.00 0.52 0.00 0.00 34.95 32.12 2d9v s ARG 26 CO 0.01 -0.28 0.30 -0.80 0.02 0.00 0.00 175.30 174.55 2d9v s ASN 27 N 0.85 -0.23 -0.44 0.23 -0.87 -0.97 -4.96 114.94 108.56 2d9v s ASN 27 Ca 0.59 0.29 -0.16 0.00 -1.57 0.00 0.00 52.86 52.01 2d9v s ASN 27 Cb -0.33 0.44 0.04 0.00 -0.02 0.00 0.00 41.25 41.39 2d9v s ASN 27 CO 0.31 -0.31 0.39 0.86 -2.57 0.00 0.00 177.10 175.78 2d9v s TRP 28 N -0.73 3.21 0.10 2.20 -0.11 -0.94 -0.61 118.94 122.06 2d9v s TRP 28 Ca -0.08 -0.64 -0.10 0.00 1.22 0.00 0.00 56.10 56.50 2d9v s TRP 28 Cb -0.04 -2.91 -0.06 0.00 -1.50 0.00 0.00 33.47 28.96 2d9v s TRP 28 CO 0.03 -0.71 0.43 -0.06 -4.62 0.00 0.00 176.95 172.01 2d9v s PHE 29 N 1.85 3.57 -0.05 5.86 0.40 -0.93 -1.01 117.98 127.67 2d9v s PHE 29 Ca 0.07 0.83 -0.03 0.00 -0.60 0.00 0.00 56.93 57.20 2d9v s PHE 29 Cb -0.20 -2.19 0.03 0.00 0.51 0.00 0.00 43.02 41.16 2d9v s PHE 29 CO 0.10 0.49 0.12 0.00 0.70 0.00 0.00 175.22 176.62 2d9v s ALA 30 N -1.45 -0.22 -0.17 5.36 0.00 -0.27 -2.30 121.76 122.72 2d9v s ALA 30 Ca 0.35 0.51 -0.09 0.00 0.00 0.00 0.00 51.96 52.72 2d9v s ALA 30 Cb -0.14 -0.34 -0.05 0.00 0.00 0.00 0.00 23.12 22.60 2d9v s ALA 30 CO 0.19 -0.12 0.15 -1.17 0.00 0.00 0.00 175.76 174.81 2d9v s LEU 31 N 0.79 4.28 0.08 0.00 2.96 -0.57 -2.06 118.68 124.18 2d9v s LEU 31 Ca -0.06 0.34 0.04 0.00 -0.22 0.00 0.00 54.13 54.23 2d9v s LEU 31 Cb -0.08 -2.10 -0.04 0.00 0.50 0.00 0.00 46.19 44.46 2d9v s LEU 31 CO -0.04 0.26 0.06 0.26 -1.32 0.00 0.00 176.35 175.58 2d9v s TRP 32 N -0.17 3.13 0.43 5.38 0.52 -0.85 -0.72 118.94 126.66 2d9v s TRP 32 Ca 0.11 0.05 0.13 0.00 0.02 0.00 0.00 56.10 56.41 2d9v s TRP 32 Cb -0.12 -1.59 1.02 0.00 -1.15 0.00 0.00 33.47 31.63 2d9v s TRP 32 CO 0.01 0.51 1.99 -0.07 0.02 0.00 0.00 176.95 179.40 2d9v h LEU 33 N 3.32 0.37 -2.03 2.99 3.38 -1.23 0.16 115.31 122.27 2d9v h LEU 33 Ca -0.47 0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.52 2d9v h LEU 33 Cb 1.16 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.84 2d9v h LEU 33 CO 0.64 0.23 0.33 -2.24 0.09 0.00 0.00 178.44 177.49 2d9v h ASP 34 N 0.42 0.00 -0.03 -0.43 3.04 -1.88 -3.45 116.42 114.09 2d9v h ASP 34 Ca 0.27 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.06 2d9v h ASP 34 Cb 0.50 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.79 2d9v h ASP 34 CO -0.07 0.00 0.00 0.61 -2.04 0.00 0.00 179.24 177.74 2d9v n GLY 35 N -1.24 1.62 3.45 7.15 0.00 0.04 -4.84 105.19 111.37 2d9v n GLY 35 Ca -0.01 -0.12 -0.23 0.00 0.00 0.00 0.00 46.02 45.66 2d9v n GLY 35 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2d9v s THR 36 N -2.03 2.27 -0.26 2.61 -4.23 -1.22 0.24 115.64 113.02 2d9v s THR 36 Ca 0.00 -2.34 0.01 0.00 -1.18 0.00 0.00 61.69 58.19 2d9v s THR 36 Cb 0.00 -2.29 0.07 0.00 1.34 0.00 0.00 72.50 71.62 2d9v s THR 36 CO 0.00 -0.41 -0.03 -0.22 -0.54 0.00 0.00 174.62 173.42 2d9v s LEU 37 N -3.48 2.96 -0.07 4.79 2.96 0.62 -2.01 118.68 124.46 2d9v s LEU 37 Ca 0.29 -1.40 0.06 0.00 -0.22 0.00 0.00 54.13 52.85 2d9v s LEU 37 Cb -0.03 -1.25 -0.01 0.00 0.50 0.00 0.00 46.19 45.40 2d9v s LEU 37 CO 0.13 -0.27 -0.25 -0.83 -1.32 0.00 0.00 176.35 173.81 2d9v s GLY 38 N 1.31 1.31 -0.09 7.98 0.00 -0.87 -0.52 107.32 116.44 2d9v s GLY 38 Ca -0.02 -1.03 0.04 0.00 0.00 0.00 0.00 44.72 43.71 2d9v s GLY 38 CO -0.08 -0.59 -0.23 -2.52 0.00 0.00 0.00 173.10 169.68 2d9v s TYR 39 N -0.07 2.55 0.31 1.90 -0.85 -1.18 -1.11 117.35 118.90 2d9v s TYR 39 Ca -0.06 -0.88 0.10 0.00 -0.52 0.00 0.00 57.07 55.70 2d9v s TYR 39 Cb -0.15 -1.69 -0.05 0.00 0.38 0.00 0.00 41.96 40.46 2d9v s TYR 39 CO 0.05 -0.32 -0.02 0.71 -1.52 0.00 0.00 175.55 174.45 2d9v s TYR 40 N 0.16 2.56 0.27 -3.49 1.51 -0.18 -3.62 117.35 114.55 2d9v s TYR 40 Ca -0.13 -0.36 -0.04 0.00 -1.01 0.00 0.00 57.07 55.53 2d9v s TYR 40 Cb -0.16 -1.34 0.54 0.00 -0.11 0.00 0.00 41.96 40.89 2d9v s TYR 40 CO 0.07 0.55 1.61 0.45 -1.11 0.00 0.00 175.55 177.11 2d9v h HIS 41 N 1.89 -0.09 -4.14 2.71 3.86 -1.87 -2.50 115.15 115.01 2d9v h HIS 41 Ca -0.43 0.06 -0.15 0.00 -1.16 0.00 0.00 60.37 58.70 2d9v h HIS 41 Cb 1.25 0.18 -0.13 0.00 1.06 0.00 0.00 27.41 29.77 2d9v h HIS 41 CO 0.71 -0.32 -0.43 -0.51 0.86 0.00 0.00 177.93 178.24 2d9v s ASP 42 N -5.14 0.10 0.27 2.45 1.11 -1.26 -4.17 116.67 110.02 2d9v s ASP 42 Ca -0.13 -1.09 0.11 0.00 0.18 0.00 0.00 52.55 51.61 2d9v s ASP 42 Cb 0.25 0.42 0.86 0.00 1.07 0.00 0.00 42.92 45.52 2d9v s ASP 42 CO 0.76 -0.89 1.20 1.21 1.18 0.00 0.00 175.17 178.64 2d9v n GLU 43 N -0.24 -0.05 -1.97 8.23 2.13 -1.26 -3.48 120.64 124.00 2d9v n GLU 43 Ca -0.03 1.09 -0.25 0.00 0.66 0.00 0.00 57.16 58.63 2d9v n GLU 43 Cb 0.64 -1.87 -0.06 0.00 0.27 0.00 0.00 31.44 30.42 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 -5.36 3.39 -0.84 6.31 -4.23 -1.26 -4.86 115.64 108.79 2d9v s THR 44 Ca -0.08 -0.37 -0.22 0.00 -1.18 0.00 0.00 61.69 59.84 2d9v s THR 44 Cb 0.25 -3.92 -0.18 0.00 1.34 0.00 0.00 72.50 69.98 2d9v s THR 44 CO 0.60 -0.80 2.30 0.00 -0.54 0.00 0.00 174.62 176.18 2d9v n ALA 45 N 14.81 0.48 0.00 3.99 0.00 -1.23 -4.37 120.51 134.19 2d9v n ALA 45 Ca 0.42 -1.35 0.00 0.00 0.00 0.00 0.00 53.44 52.50 2d9v n ALA 45 Cb 0.46 -3.05 0.00 0.00 0.00 0.00 0.00 19.45 16.86 2d9v n ALA 45 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2d9v n GLN 46 N 8.00 0.00 -2.92 0.00 1.13 -1.26 -4.92 117.38 117.40 2d9v n GLN 46 Ca 0.49 0.00 -0.44 0.00 -1.94 0.00 0.00 57.00 55.11 2d9v n GLN 46 Cb 0.38 -0.31 0.00 0.00 0.11 0.00 0.00 30.24 30.42 2d9v n GLN 46 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 2d9v n ASP 47 N -2.81 5.25 -4.49 1.08 8.00 -1.26 -4.98 116.55 117.34 2d9v n ASP 47 Ca 0.00 -3.00 -0.46 0.00 0.71 0.00 0.00 54.79 52.05 2d9v n ASP 47 Cb 0.31 -1.55 -0.06 0.00 -0.02 0.00 0.00 41.12 39.80 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 5.22 1.09 -0.09 -1.24 2.13 -1.26 -3.98 120.64 122.51 2d9v n GLU 48 Ca 0.36 0.24 -0.17 0.00 0.66 0.00 0.00 57.16 58.25 2d9v n GLU 48 Cb 0.42 -2.68 -0.11 0.00 0.27 0.00 0.00 31.44 29.33 2d9v n GLU 48 CO 0.00 0.00 0.00 1.49 -0.41 0.00 0.00 177.13 178.21 2d9v h GLU 49 N 14.22 0.00 -1.96 5.31 4.22 -1.94 -3.50 114.58 130.92 2d9v h GLU 49 Ca -0.26 0.00 0.24 0.00 0.08 0.00 0.00 59.36 59.42 2d9v h GLU 49 Cb 1.30 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 30.45 2d9v h GLU 49 CO 1.08 0.93 0.64 -0.51 -2.18 0.00 0.00 179.01 178.97 2d9v s ASP 50 N -6.49 -0.11 -0.23 1.04 1.01 -1.25 -5.08 116.67 105.57 2d9v s ASP 50 Ca -0.23 -0.30 -0.09 0.00 0.71 0.00 0.00 52.55 52.64 2d9v s ASP 50 Cb 0.02 0.34 0.09 0.00 1.01 0.00 0.00 42.92 44.38 2d9v s ASP 50 CO 0.60 -0.64 0.51 -0.60 0.21 0.00 0.00 175.17 175.25 2d9v s ARG 51 N -2.85 0.45 0.45 8.23 3.52 -1.26 -3.08 118.95 124.41 2d9v s ARG 51 Ca 0.14 1.10 0.07 0.00 -0.13 0.00 0.00 55.73 56.91 2d9v s ARG 51 Cb 0.01 0.35 -0.01 0.00 -1.56 0.00 0.00 34.95 33.74 2d9v s ARG 51 CO -0.00 -0.21 0.34 0.14 -0.81 0.00 0.00 175.30 174.76 2d9v s VAL 52 N 2.27 2.34 -0.10 7.11 -7.23 0.32 -4.92 120.40 120.19 2d9v s VAL 52 Ca -0.06 -1.46 -0.11 0.00 -1.81 0.00 0.00 61.98 58.54 2d9v s VAL 52 Cb -0.10 -2.80 -0.05 0.00 0.56 0.00 0.00 36.38 33.99 2d9v s VAL 52 CO -0.15 0.00 0.26 -0.69 -0.31 0.00 0.00 175.10 174.21 2d9v s VAL 53 N -2.57 5.30 -0.15 1.32 1.01 -1.26 -0.28 120.40 123.76 2d9v s VAL 53 Ca 0.43 0.49 -0.01 0.00 0.00 0.00 0.00 61.98 62.90 2d9v s VAL 53 Cb -0.01 -3.56 -0.09 0.00 0.00 0.00 0.00 36.38 32.71 2d9v s VAL 53 CO 0.25 0.53 -0.15 -0.38 0.00 0.00 0.00 175.10 175.36 2d9v n ILE 54 N 2.47 0.87 -1.67 2.22 2.08 0.14 -4.63 119.36 120.84 2d9v n ILE 54 Ca -0.16 -0.31 -0.55 0.00 0.56 0.00 0.00 62.75 62.29 2d9v n ILE 54 Cb 0.53 -1.16 -0.07 0.00 -0.75 0.00 0.00 39.64 38.19 2d9v n ILE 54 CO 0.00 0.00 0.00 1.57 0.56 0.00 0.00 176.55 178.68 2d9v n HIS 55 N -3.09 2.07 -4.18 1.39 -0.00 -0.31 -1.22 115.22 109.88 2d9v n HIS 55 Ca -0.28 0.38 -0.36 0.00 0.46 0.00 0.00 57.72 57.93 2d9v n HIS 55 Cb 0.78 -2.52 -0.07 0.00 -0.12 0.00 0.00 29.99 28.05 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 6.22 -1.04 0.00 1.57 3.72 0.10 -4.71 117.46 123.32 2d9v n PHE 56 Ca 0.28 0.59 0.00 0.00 -0.05 0.00 0.00 57.45 58.27 2d9v n PHE 56 Cb 0.18 -1.83 0.00 0.00 -0.94 0.00 0.00 39.48 36.89 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 -2.18 2.26 -4.53 4.37 5.15 -0.36 -4.88 115.26 115.10 2d9v n ASN 57 Ca 0.02 -0.21 -0.42 0.00 -0.60 0.00 0.00 54.58 53.37 2d9v n ASN 57 Cb 0.45 0.87 -0.03 0.00 -0.53 0.00 0.00 39.78 40.53 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 -1.32 4.03 0.09 3.44 1.01 -1.23 -0.08 120.40 126.35 2d9v s VAL 58 Ca 0.00 -0.48 -0.19 0.00 0.00 0.00 0.00 61.98 61.31 2d9v s VAL 58 Cb 0.00 -4.93 -0.07 0.00 0.00 0.00 0.00 36.38 31.38 2d9v s VAL 58 CO 0.00 -1.79 1.58 -0.09 0.00 0.00 0.00 175.10 174.80 2d9v h ARG 59 N 9.70 0.40 -3.07 2.72 2.43 -1.65 -3.47 114.38 121.44 2d9v h ARG 59 Ca -0.01 -0.10 -0.01 0.00 -0.81 0.00 0.00 59.98 59.05 2d9v h ARG 59 Cb 1.03 -0.05 -0.11 0.00 -0.42 0.00 0.00 29.97 30.42 2d9v h ARG 59 CO 1.31 0.50 0.17 -0.51 -1.51 0.00 0.00 179.97 179.93 2d9v s ASP 60 N -5.79 -0.46 -0.05 -3.80 1.01 -1.26 -5.01 116.67 101.31 2d9v s ASP 60 Ca -0.14 -0.16 -0.02 0.00 0.71 0.00 0.00 52.55 52.94 2d9v s ASP 60 Cb 0.08 0.60 0.04 0.00 1.01 0.00 0.00 42.92 44.65 2d9v s ASP 60 CO 0.73 -1.02 0.09 -0.63 0.21 0.00 0.00 175.17 174.55 2d9v s ILE 61 N -3.79 -0.15 -0.17 0.77 1.01 -1.26 -0.74 121.20 116.87 2d9v s ILE 61 Ca 0.03 0.37 -0.06 0.00 0.00 0.00 0.00 60.65 60.99 2d9v s ILE 61 Cb -0.01 -0.19 -0.04 0.00 0.01 0.00 0.00 42.46 42.22 2d9v s ILE 61 CO -0.09 0.15 0.03 -0.54 0.00 0.00 0.00 174.94 174.49 2d9v s LYS 62 N 2.02 3.85 -0.02 2.79 1.02 -0.22 -4.95 119.74 124.23 2d9v s LYS 62 Ca 0.02 -0.39 0.02 0.00 0.02 0.00 0.00 55.97 55.64 2d9v s LYS 62 Cb -0.12 -3.11 0.00 0.00 -0.52 0.00 0.00 37.83 34.08 2d9v s LYS 62 CO -0.04 0.29 -0.08 0.08 -0.92 0.00 0.00 175.35 174.67 2d9v s VAL 63 N 0.30 0.73 0.00 3.17 1.01 -1.26 -0.20 120.40 124.16 2d9v s VAL 63 Ca 0.01 -0.34 0.00 0.00 0.00 0.00 0.00 61.98 61.65 2d9v s VAL 63 Cb -0.13 -0.65 0.00 0.00 0.00 0.00 0.00 36.38 35.60 2d9v s VAL 63 CO 0.01 0.23 0.00 0.61 0.00 0.00 0.00 175.10 175.95 2d9v n GLY 64 N 3.26 3.39 0.35 4.51 0.00 -0.64 -2.66 105.19 113.38 2d9v n GLY 64 Ca -0.18 -0.16 0.11 0.00 0.00 0.00 0.00 46.02 45.79 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 0.01 -0.76 1.61 4.15 -1.89 0.36 115.11 118.59 2d9v h GLN 65 Ca 0.00 -0.00 0.31 0.00 0.77 0.00 0.00 58.65 59.73 2d9v h GLN 65 Cb 0.00 -0.00 -0.13 0.00 0.21 0.00 0.00 27.48 27.56 2d9v h GLN 65 CO 0.00 0.00 0.42 0.39 -1.93 0.00 0.00 178.83 177.72 2d9v n GLU 66 N -5.54 -0.04 -1.08 1.69 1.02 -1.09 -4.53 120.64 111.07 2d9v n GLU 66 Ca 0.20 0.99 -0.34 0.00 -0.02 0.00 0.00 57.16 57.98 2d9v n GLU 66 Cb 0.64 -1.79 0.01 0.00 -0.02 0.00 0.00 31.44 30.27 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 1.24 0.00 -2.21 0.00 6.02 -1.26 -4.92 117.38 116.24 2d9v n GLN 68 Ca 0.08 0.00 -0.28 0.00 -0.01 0.00 0.00 57.00 56.79 2d9v n GLN 68 Cb 0.38 -0.12 0.02 0.00 1.02 0.00 0.00 30.24 31.54 2d9v n GLN 68 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 2d9v n ASP 69 N -3.08 5.27 -3.77 1.08 8.00 -1.26 -4.99 116.55 117.80 2d9v n ASP 69 Ca 0.00 -3.75 -0.15 0.00 0.71 0.00 0.00 54.79 51.61 2d9v n ASP 69 Cb 0.00 -0.53 -0.16 0.00 -0.02 0.00 0.00 41.12 40.42 2d9v n ASP 69 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2d9v s VAL 70 N -5.17 -0.05 -0.04 2.53 0.11 -1.26 -5.15 120.40 111.36 2d9v s VAL 70 Ca 0.50 0.20 0.05 0.00 -2.93 0.00 0.00 61.98 59.80 2d9v s VAL 70 Cb 0.41 -0.10 -0.02 0.00 -1.53 0.00 0.00 36.38 35.14 2d9v s VAL 70 CO -0.14 0.08 -0.20 0.00 -3.33 0.00 0.00 175.10 171.51 2d9v s GLN 71 N 1.00 2.41 0.58 1.54 -2.07 -1.26 -5.00 119.66 116.86 2d9v s GLN 71 Ca -0.08 -0.80 -0.18 0.00 -1.82 0.00 0.00 55.36 52.47 2d9v s GLN 71 Cb -0.12 -2.24 -0.04 0.00 -1.09 0.00 0.00 33.01 29.52 2d9v s GLN 71 CO -0.03 0.55 1.12 -1.25 -1.32 0.00 0.00 175.29 174.36 2d9v s PRO 72 N -0.57 3.17 0.00 9.60 0.04 -1.26 -5.05 135.00 140.94 2d9v s PRO 72 Ca 0.08 1.54 0.00 0.00 0.04 0.00 0.00 61.00 62.66 2d9v s PRO 72 Cb -0.11 -1.99 0.00 0.00 0.04 0.00 0.00 34.50 32.44 2d9v s PRO 72 CO 0.01 -0.98 0.00 -0.35 0.04 0.00 0.00 177.00 175.71 2d9v n PRO 73 N -1.67 -0.77 -2.58 0.56 -0.04 -1.26 -4.93 135.00 124.31 2d9v n PRO 73 Ca 0.11 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 63.14 2d9v n PRO 73 Cb 0.51 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 33.95 2d9v n PRO 73 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 2d9v s GLU 74 N -2.62 3.68 0.00 0.54 2.56 -1.26 -3.70 118.70 117.90 2d9v s GLU 74 Ca 0.00 0.54 0.00 0.00 0.00 0.00 0.00 54.97 55.51 2d9v s GLU 74 Cb 0.00 -3.93 0.00 0.00 2.00 0.00 0.00 34.13 32.20 2d9v s GLU 74 CO 0.00 -1.45 0.00 0.41 -0.56 0.00 0.00 175.26 173.66 2d9v n GLY 75 N 4.91 3.37 3.58 -1.50 0.00 -1.26 -5.09 105.19 109.20 2d9v n GLY 75 Ca 0.12 -0.99 -0.29 0.00 0.00 0.00 0.00 46.02 44.86 2d9v n GLY 75 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2d9v s ARG 76 N 0.00 -0.26 0.15 1.61 3.00 -1.24 -5.05 118.95 117.16 2d9v s ARG 76 Ca 0.00 0.71 0.08 0.00 0.00 0.00 0.00 55.73 56.52 2d9v s ARG 76 Cb 0.00 -1.64 -0.04 0.00 0.00 0.00 0.00 34.95 33.27 2d9v s ARG 76 CO 0.00 -3.25 -0.10 0.45 0.00 0.00 0.00 175.30 172.40 2d9v s SER 77 N -2.96 4.28 0.00 0.23 0.15 -1.26 -4.76 113.70 109.39 2d9v s SER 77 Ca 0.67 -0.51 0.01 0.00 0.70 0.00 0.00 55.95 56.82 2d9v s SER 77 Cb -0.22 -0.75 0.06 0.00 -1.71 0.00 0.00 66.02 63.40 2d9v s SER 77 CO 0.61 0.13 1.02 0.54 1.20 0.00 0.00 173.24 176.74 2d9v n ARG 78 N 0.30 0.00 0.08 5.44 1.74 -1.26 -0.44 116.66 122.52 2d9v n ARG 78 Ca -0.12 0.46 0.12 0.00 -0.77 0.00 0.00 57.85 57.54 2d9v n ARG 78 Cb 0.54 -1.50 0.27 0.00 -1.02 0.00 0.00 32.46 30.75 2d9v n ARG 78 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2d9v n ASP 79 N -1.48 0.77 0.10 0.55 8.00 -1.26 -3.55 116.55 119.67 2d9v n ASP 79 Ca 0.00 0.33 0.12 0.00 0.71 0.00 0.00 54.79 55.95 2d9v n ASP 79 Cb 0.01 -0.28 0.13 0.00 -0.02 0.00 0.00 41.12 40.97 2d9v n ASP 79 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 2d9v h GLY 80 N 4.50 0.00 -4.29 0.44 0.00 -1.02 -3.33 103.07 99.37 2d9v h GLY 80 Ca 0.00 0.00 -0.62 0.00 0.00 0.00 0.00 47.33 46.71 2d9v h GLY 80 CO 0.00 0.00 -0.27 1.04 0.00 0.00 0.00 176.54 177.31 2d9v n LEU 81 N -2.41 0.26 -3.57 3.11 4.32 -1.23 -0.89 117.00 116.59 2d9v n LEU 81 Ca 0.02 1.03 -0.04 0.00 -0.02 0.00 0.00 56.01 57.00 2d9v n LEU 81 Cb 0.48 -1.13 -0.06 0.00 -1.62 0.00 0.00 43.42 41.09 2d9v n LEU 81 CO 0.37 -2.48 0.14 -0.22 -1.22 0.00 0.00 177.39 173.97 2d9v s LEU 82 N 1.62 -0.95 -0.06 2.23 2.96 0.61 -1.63 118.68 123.46 2d9v s LEU 82 Ca 0.62 1.18 0.06 0.00 -0.22 0.00 0.00 54.13 55.77 2d9v s LEU 82 Cb -0.69 1.85 -0.01 0.00 0.50 0.00 0.00 46.19 47.84 2d9v s LEU 82 CO 0.58 -0.23 -0.25 -0.89 -1.32 0.00 0.00 176.35 174.24 2d9v s THR 83 N 2.76 2.05 -0.11 3.68 2.01 0.72 -0.34 115.64 126.42 2d9v s THR 83 Ca 0.00 -1.07 0.03 0.00 0.31 0.00 0.00 61.69 60.96 2d9v s THR 83 Cb -0.13 -1.73 -0.00 0.00 0.01 0.00 0.00 72.50 70.65 2d9v s THR 83 CO -0.17 0.57 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.43 2d9v s VAL 84 N -0.18 2.30 -0.09 3.82 1.01 -0.89 -1.05 120.40 125.32 2d9v s VAL 84 Ca -0.03 -0.93 -0.11 0.00 0.00 0.00 0.00 61.98 60.91 2d9v s VAL 84 Cb -0.14 -1.90 -0.05 0.00 0.00 0.00 0.00 36.38 34.29 2d9v s VAL 84 CO 0.03 0.55 0.26 0.20 0.00 0.00 0.00 175.10 176.15 2d9v s ASN 85 N 0.37 6.53 -0.08 3.32 0.01 0.08 0.50 114.94 125.68 2d9v s ASN 85 Ca -0.16 0.63 0.02 0.00 -0.71 0.00 0.00 52.86 52.64 2d9v s ASN 85 Cb -0.17 -2.16 -0.02 0.00 0.41 0.00 0.00 41.25 39.31 2d9v s ASN 85 CO 0.08 0.30 -0.13 -0.76 -1.51 0.00 0.00 177.10 175.07 2d9v s LEU 86 N -0.63 2.77 0.36 0.60 1.43 0.32 -1.68 118.68 121.85 2d9v s LEU 86 Ca 0.18 -0.22 0.15 0.00 -1.03 0.00 0.00 54.13 53.21 2d9v s LEU 86 Cb -0.14 -1.58 1.03 0.00 0.03 0.00 0.00 46.19 45.52 2d9v s LEU 86 CO 0.07 0.29 1.74 0.03 0.23 0.00 0.00 176.35 178.71 2d9v h ARG 87 N 5.76 0.45 -1.07 1.70 2.47 -0.79 0.16 114.38 123.05 2d9v h ARG 87 Ca -0.40 -0.03 0.32 0.00 -1.26 0.00 0.00 59.98 58.61 2d9v h ARG 87 Cb 1.17 -0.10 -0.13 0.00 -1.65 0.00 0.00 29.97 29.26 2d9v h ARG 87 CO 0.52 0.29 0.65 1.05 0.56 0.00 0.00 179.97 183.05 2d9v h GLU 88 N 0.46 0.32 0.00 0.04 4.11 -1.95 -3.44 114.58 114.12 2d9v h GLU 88 Ca 0.63 -0.02 0.00 0.00 0.07 0.00 0.00 59.36 60.04 2d9v h GLU 88 Cb 1.44 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.61 2d9v h GLU 88 CO -0.38 0.21 0.00 0.41 0.07 0.00 0.00 179.01 179.32 2d9v n GLY 89 N -1.39 1.60 3.10 1.06 0.00 0.55 -5.15 105.19 104.97 2d9v n GLY 89 Ca 0.30 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.23 2d9v n GLY 89 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2d9v s SER 90 N -1.95 0.21 0.21 1.61 1.04 -1.19 -5.00 113.70 108.63 2d9v s SER 90 Ca 0.00 -0.56 0.09 0.00 0.48 0.00 0.00 55.95 55.96 2d9v s SER 90 Cb 0.00 0.21 -0.04 0.00 0.10 0.00 0.00 66.02 66.29 2d9v s SER 90 CO 0.00 -0.49 -0.03 0.00 0.98 0.00 0.00 173.24 173.70 2d9v s ARG 91 N -2.53 2.25 -0.33 4.02 1.70 -1.26 -0.52 118.95 122.29 2d9v s ARG 91 Ca -0.06 -1.27 -0.02 0.00 -0.47 0.00 0.00 55.73 53.92 2d9v s ARG 91 Cb -0.02 -2.22 0.07 0.00 -0.57 0.00 0.00 34.95 32.21 2d9v s ARG 91 CO -0.04 0.42 0.05 -0.51 -1.08 0.00 0.00 175.30 174.13 2d9v s LEU 92 N -3.16 4.27 -0.63 -1.89 1.43 0.18 -4.93 118.68 113.95 2d9v s LEU 92 Ca 0.28 -1.52 -0.28 0.00 -1.03 0.00 0.00 54.13 51.59 2d9v s LEU 92 Cb -0.08 -1.73 0.02 0.00 0.03 0.00 0.00 46.19 44.43 2d9v s LEU 92 CO 0.18 -0.33 1.32 -1.00 0.23 0.00 0.00 176.35 176.75 2d9v s HIS 93 N 1.20 2.35 0.25 0.29 3.76 -1.26 -2.08 115.29 119.79 2d9v s HIS 93 Ca -0.01 0.29 0.06 0.00 -0.15 0.00 0.00 55.06 55.25 2d9v s HIS 93 Cb -0.20 -4.50 -0.05 0.00 1.11 0.00 0.00 32.58 28.93 2d9v s HIS 93 CO -0.02 -1.91 -0.07 -0.51 -0.85 0.00 0.00 174.74 171.38 2d9v s LEU 94 N 5.76 2.46 -0.14 0.89 1.43 0.54 -1.45 118.68 128.16 2d9v s LEU 94 Ca 0.44 -1.15 -0.08 0.00 -1.03 0.00 0.00 54.13 52.31 2d9v s LEU 94 Cb -0.09 -0.59 0.05 0.00 0.03 0.00 0.00 46.19 45.60 2d9v s LEU 94 CO 0.21 -0.33 0.33 0.00 0.23 0.00 0.00 176.35 176.80 2d9v s ALA 96 N 1.26 3.88 -0.05 0.00 0.00 -0.07 -2.40 121.76 124.38 2d9v s ALA 96 Ca -0.09 -1.81 -0.22 0.00 0.00 0.00 0.00 51.96 49.84 2d9v s ALA 96 Cb -0.09 -1.91 -0.30 0.00 0.00 0.00 0.00 23.12 20.82 2d9v s ALA 96 CO -0.10 -1.36 0.91 0.93 0.00 0.00 0.00 175.76 176.13 2d9v h GLU 97 N -0.41 0.29 -4.93 0.00 5.08 -1.90 -3.43 114.58 109.27 2d9v h GLU 97 Ca -0.35 -0.46 -0.36 0.00 -1.00 0.00 0.00 59.36 57.19 2d9v h GLU 97 Cb 1.27 0.17 -0.14 0.00 0.50 0.00 0.00 28.75 30.55 2d9v h GLU 97 CO 0.40 1.21 -0.63 0.95 -1.00 0.00 0.00 179.01 179.94 2d9v s THR 98 N -2.50 0.70 -0.89 1.13 -4.23 -1.26 -4.63 115.64 103.97 2d9v s THR 98 Ca -0.14 -2.00 0.09 0.00 -1.18 0.00 0.00 61.69 58.46 2d9v s THR 98 Cb 0.01 -2.53 0.08 0.00 1.34 0.00 0.00 72.50 71.39 2d9v s THR 98 CO 0.82 -0.12 1.28 -2.11 -0.54 0.00 0.00 174.62 173.95 2d9v n ARG 99 N -0.45 0.03 -0.07 3.99 1.85 -1.26 -2.60 116.66 118.14 2d9v n ARG 99 Ca -0.02 0.41 -0.10 0.00 -1.00 0.00 0.00 57.85 57.15 2d9v n ARG 99 Cb 0.65 -1.57 -0.06 0.00 -1.05 0.00 0.00 32.46 30.44 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 0.00 -0.84 2.89 3.58 -1.95 -3.27 116.42 116.84 2d9v h ASP 100 Ca 0.00 -0.36 0.12 0.00 0.42 0.00 0.00 57.03 57.21 2d9v h ASP 100 Cb 0.12 0.00 -0.06 0.00 1.72 0.00 0.00 39.33 41.11 2d9v h ASP 100 CO 0.00 0.92 0.54 0.44 -2.88 0.00 0.00 179.24 178.27 2d9v h ASP 101 N -1.00 0.64 0.72 2.28 3.32 -1.92 -2.60 116.42 117.86 2d9v h ASP 101 Ca -0.09 0.03 -0.03 0.00 0.02 0.00 0.00 57.03 56.96 2d9v h ASP 101 Cb 0.68 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 40.13 2d9v h ASP 101 CO -0.05 0.36 -0.37 0.00 -1.72 0.00 0.00 179.24 177.45 2d9v h ALA 102 N 1.60 -1.25 -0.88 3.45 0.00 -1.65 -2.93 119.26 117.60 2d9v h ALA 102 Ca 0.40 -0.22 0.23 0.00 0.00 0.00 0.00 54.91 55.33 2d9v h ALA 102 Cb 0.59 0.43 -0.14 0.00 0.00 0.00 0.00 17.79 18.67 2d9v h ALA 102 CO -0.17 -1.19 0.25 0.82 0.00 0.00 0.00 179.25 178.96 2d9v h ILE 103 N -1.00 0.33 -0.50 0.00 2.04 -1.54 -0.19 117.51 116.66 2d9v h ILE 103 Ca -0.10 -0.08 0.09 0.00 1.00 0.00 0.00 64.86 65.78 2d9v h ILE 103 Cb 0.78 0.09 -0.10 0.00 -0.74 0.00 0.00 36.82 36.84 2d9v h ILE 103 CO 0.14 0.04 -0.34 0.00 0.00 0.00 0.00 178.15 177.99 2d9v h ALA 104 N 1.77 -0.13 -0.56 1.87 0.00 -1.29 -0.20 119.26 120.72 2d9v h ALA 104 Ca 0.55 0.13 0.01 0.00 0.00 0.00 0.00 54.91 55.60 2d9v h ALA 104 Cb 1.10 0.76 -0.03 0.00 0.00 0.00 0.00 17.79 19.62 2d9v h ALA 104 CO -0.64 -0.71 0.37 -1.49 0.00 0.00 0.00 179.25 176.77 2d9v h TRP 105 N -0.21 0.70 -0.88 0.00 4.06 -0.94 -0.41 115.95 118.27 2d9v h TRP 105 Ca 0.20 0.02 0.13 0.00 2.06 0.00 0.00 58.89 61.30 2d9v h TRP 105 Cb 0.55 -0.23 -0.09 0.00 -1.00 0.00 0.00 29.16 28.39 2d9v h TRP 105 CO -0.60 0.43 0.50 -0.22 -3.56 0.00 0.00 178.44 174.99 2d9v h LYS 106 N 0.75 0.73 -0.11 0.49 3.64 -0.59 0.21 116.57 121.68 2d9v h LYS 106 Ca 0.21 -0.04 -0.14 0.00 -1.27 0.00 0.00 60.65 59.40 2d9v h LYS 106 Cb -0.07 -0.17 0.01 0.00 -0.41 0.00 0.00 32.23 31.59 2d9v h LYS 106 CO -0.06 0.48 -0.49 1.15 -2.27 0.00 0.00 179.45 178.27 2d9v h THR 107 N 0.75 1.36 0.00 1.00 2.02 -0.57 0.48 112.91 117.95 2d9v h THR 107 Ca 0.46 -1.80 -0.02 0.00 0.77 0.00 0.00 66.41 65.81 2d9v h THR 107 Cb 0.55 2.16 -0.00 0.00 -1.74 0.00 0.00 68.15 69.12 2d9v h THR 107 CO -0.31 0.54 -0.10 0.00 0.37 0.00 0.00 175.52 176.02 2d9v h ALA 108 N 0.49 1.40 0.00 6.16 0.00 -0.31 -0.82 119.26 126.18 2d9v h ALA 108 Ca -0.03 -0.09 -0.20 0.00 0.00 0.00 0.00 54.91 54.59 2d9v h ALA 108 Cb 1.13 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.87 2d9v h ALA 108 CO 0.10 0.13 -1.10 -0.07 0.00 0.00 0.00 179.25 178.31 2d9v h LEU 109 N 0.00 0.00 -1.38 0.00 3.38 -0.56 -3.21 115.31 113.55 2d9v h LEU 109 Ca -0.00 -0.56 0.08 0.00 0.09 0.00 0.00 57.88 57.49 2d9v h LEU 109 Cb 0.26 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.96 2d9v h LEU 109 CO 0.01 1.42 0.49 0.24 0.09 0.00 0.00 178.44 180.69 2d9v h MET 110 N -1.00 0.71 0.26 1.13 2.86 -0.82 0.14 114.93 118.20 2d9v h MET 110 Ca -0.30 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.28 2d9v h MET 110 Cb 1.26 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 32.76 2d9v h MET 110 CO -0.18 0.47 -0.12 0.93 1.06 0.00 0.00 176.91 179.06 2d9v h GLU 111 N 0.73 -0.33 -0.91 1.72 4.39 -1.31 -2.75 114.58 116.12 2d9v h GLU 111 Ca 0.33 0.02 0.17 0.00 0.34 0.00 0.00 59.36 60.22 2d9v h GLU 111 Cb 0.33 0.08 -0.10 0.00 -0.10 0.00 0.00 28.75 28.96 2d9v h GLU 111 CO -0.11 -0.22 0.49 0.00 -1.16 0.00 0.00 179.01 178.01 2d9v h ALA 112 N -1.68 1.43 -0.78 3.43 0.00 -1.53 0.12 119.26 120.25 2d9v h ALA 112 Ca -0.04 0.09 0.10 0.00 0.00 0.00 0.00 54.91 55.07 2d9v h ALA 112 Cb 0.26 -0.02 -0.08 0.00 0.00 0.00 0.00 17.79 17.96 2d9v h ALA 112 CO 0.06 -0.10 0.41 -0.97 0.00 0.00 0.00 179.25 178.65 2d9v h ASN 113 N 0.65 0.56 -0.88 0.00 -1.24 -0.78 -2.26 115.58 111.62 2d9v h ASN 113 Ca 0.51 0.06 -0.60 0.00 0.71 0.00 0.00 56.30 56.99 2d9v h ASN 113 Cb 0.78 -0.04 -0.38 0.00 0.73 0.00 0.00 38.32 39.41 2d9v h ASN 113 CO -0.39 0.31 -0.27 -0.24 -1.29 0.00 0.00 177.43 175.55 2d9v n SER 114 N -4.82 5.81 -3.21 1.15 2.88 -0.10 0.03 113.62 115.37 2d9v n SER 114 Ca 0.13 -3.76 -0.00 0.00 -1.33 0.00 0.00 58.87 53.90 2d9v n SER 114 Cb 0.30 -0.55 -0.03 0.00 -0.75 0.00 0.00 64.21 63.18 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 -4.72 -0.87 0.86 2.46 2.01 0.23 -4.95 115.64 110.65 2d9v s THR 115 Ca 0.55 -0.06 -0.11 0.00 0.31 0.00 0.00 61.69 62.38 2d9v s THR 115 Cb 0.44 -0.97 0.11 0.00 0.01 0.00 0.00 72.50 72.09 2d9v s THR 115 CO 0.01 -0.07 1.09 -2.16 -0.69 0.00 0.00 174.62 172.80 2d9v s PRO 116 N 2.74 1.55 -0.08 4.92 0.04 -1.26 -4.57 135.00 138.35 2d9v s PRO 116 Ca 0.14 0.92 0.04 0.00 0.04 0.00 0.00 61.00 62.14 2d9v s PRO 116 Cb -0.13 -1.83 0.00 0.00 0.04 0.00 0.00 34.50 32.58 2d9v s PRO 116 CO -0.23 -2.07 -0.19 0.00 0.04 0.00 0.00 177.00 174.55 2d9v s ALA 117 N -2.93 1.79 -0.13 8.56 0.00 -1.26 -5.01 121.76 122.79 2d9v s ALA 117 Ca 0.63 -0.76 0.30 0.00 0.00 0.00 0.00 51.96 52.12 2d9v s ALA 117 Cb -0.18 -0.68 1.24 0.00 0.00 0.00 0.00 23.12 23.50 2d9v s ALA 117 CO 0.57 0.24 1.88 -1.00 0.00 0.00 0.00 175.76 177.45 2d9v h PRO 118 N 6.67 0.00 -6.08 0.00 0.13 -1.97 -3.40 132.00 127.35 2d9v h PRO 118 Ca -0.26 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.35 2d9v h PRO 118 Cb 1.21 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.26 2d9v h PRO 118 CO 0.47 0.00 1.26 0.00 -0.23 0.00 0.00 178.00 179.50 2d9v s ALA 119 N -3.54 2.49 -0.28 -0.56 0.00 -1.26 -4.90 121.76 113.70 2d9v s ALA 119 Ca 0.02 -1.82 -0.15 0.00 0.00 0.00 0.00 51.96 50.01 2d9v s ALA 119 Cb 0.09 -4.46 0.09 0.00 0.00 0.00 0.00 23.12 18.84 2d9v s ALA 119 CO 0.47 -3.79 0.71 0.20 0.00 0.00 0.00 175.76 173.35 2d9v s GLY 120 N 5.51 -0.60 0.27 0.00 0.00 -1.26 -4.84 107.32 106.40 2d9v s GLY 120 Ca 0.50 2.48 0.03 0.00 0.00 0.00 0.00 44.72 47.73 2d9v s GLY 120 CO -0.01 2.52 0.03 0.00 0.00 0.00 0.00 173.10 175.65 2d9v s ALA 121 N 1.80 2.00 0.09 3.20 0.00 -1.26 -5.13 121.76 122.45 2d9v s ALA 121 Ca -0.09 -1.89 -0.28 0.00 0.00 0.00 0.00 51.96 49.70 2d9v s ALA 121 Cb -0.06 0.64 -0.06 0.00 0.00 0.00 0.00 23.12 23.64 2d9v s ALA 121 CO -0.19 -0.30 0.90 0.99 0.00 0.00 0.00 175.76 177.15 2d9v s THR 122 N -3.42 4.57 -0.15 0.00 2.01 -1.26 -5.05 115.64 112.33 2d9v s THR 122 Ca 0.33 1.93 -0.06 0.00 0.31 0.00 0.00 61.69 64.20 2d9v s THR 122 Cb 0.07 -4.25 0.07 0.00 0.01 0.00 0.00 72.50 68.40 2d9v s THR 122 CO 0.12 0.34 0.32 -0.69 -0.69 0.00 0.00 174.62 174.02 2d9v s VAL 123 N -0.05 -0.48 -0.92 3.82 1.01 -1.26 -5.09 120.40 117.43 2d9v s VAL 123 Ca 0.44 0.23 -0.24 0.00 0.00 0.00 0.00 61.98 62.41 2d9v s VAL 123 Cb -0.22 -0.53 -0.05 0.00 0.00 0.00 0.00 36.38 35.58 2d9v s VAL 123 CO 0.28 0.10 1.95 -2.16 0.00 0.00 0.00 175.10 175.26 2d9v s PRO 124 N 2.42 2.55 -0.14 2.72 0.04 -1.26 -4.89 135.00 136.44 2d9v s PRO 124 Ca -0.01 -0.35 -0.06 0.00 0.04 0.00 0.00 61.00 60.62 2d9v s PRO 124 Cb -0.12 -5.08 0.06 0.00 0.04 0.00 0.00 34.50 29.41 2d9v s PRO 124 CO -0.10 -3.42 0.31 -1.12 0.04 0.00 0.00 177.00 172.71 2d9v s SER 125 N 7.93 -0.09 0.01 6.66 0.01 -1.26 -5.12 113.70 121.84 2d9v s SER 125 Ca 0.70 0.69 -0.32 0.00 1.31 0.00 0.00 55.95 58.32 2d9v s SER 125 Cb -0.06 0.72 -0.11 0.00 0.21 0.00 0.00 66.02 66.78 2d9v s SER 125 CO 0.00 -0.21 1.88 0.61 0.41 0.00 0.00 173.24 175.94 2d9v n GLY 126 N 4.80 1.62 3.77 3.44 0.00 -1.26 -4.95 105.19 112.60 2d9v n GLY 126 Ca -0.16 0.80 -0.32 0.00 0.00 0.00 0.00 46.02 46.35 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 3.70 2.47 0.89 1.61 0.04 -1.26 -5.02 135.00 137.43 2d9v s PRO 127 Ca 0.88 1.26 -0.11 0.00 0.04 0.00 0.00 61.00 63.08 2d9v s PRO 127 Cb -0.56 -1.92 0.13 0.00 0.04 0.00 0.00 34.50 32.19 2d9v s PRO 127 CO 0.45 -1.49 1.10 -1.54 0.04 0.00 0.00 177.00 175.55 2d9v s SER 128 N -3.05 3.43 -0.16 6.66 1.04 -1.26 -5.05 113.70 115.31 2d9v s SER 128 Ca 0.64 1.70 -0.00 0.00 0.48 0.00 0.00 55.95 58.77 2d9v s SER 128 Cb -0.19 -2.35 0.04 0.00 0.10 0.00 0.00 66.02 63.63 2d9v s SER 128 CO 0.50 -2.70 -0.06 -0.55 0.98 0.00 0.00 173.24 171.41 2d9v s SER 129 N -3.20 2.74 0.00 7.02 0.15 -1.26 -5.28 113.70 113.87 2d9v s SER 129 Ca 0.64 -0.61 0.00 0.00 0.70 0.00 0.00 55.95 56.68 2d9v s SER 129 Cb -0.19 -0.91 0.00 0.00 -1.71 0.00 0.00 66.02 63.20 2d9v s SER 129 CO 0.58 -0.17 0.00 0.61 1.20 0.00 0.00 173.24 175.46