#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d9v s SER 2 N 0.00 5.25 -0.16 1.61 0.15 -1.26 -4.93 113.70 114.36 2d9v s SER 2 Ca 0.00 2.00 -0.29 0.00 0.70 0.00 0.00 55.95 58.35 2d9v s SER 2 Cb 0.00 -2.55 -0.04 0.00 -1.71 0.00 0.00 66.02 61.71 2d9v s SER 2 CO 0.00 -1.53 1.77 -0.94 1.20 0.00 0.00 173.24 173.74 2d9v s SER 3 N -2.53 6.28 -0.13 5.45 1.04 -1.26 -4.23 113.70 118.33 2d9v s SER 3 Ca 0.67 1.91 -0.07 0.00 0.48 0.00 0.00 55.95 58.95 2d9v s SER 3 Cb -0.20 -2.53 0.03 0.00 0.10 0.00 0.00 66.02 63.41 2d9v s SER 3 CO 0.39 -1.29 0.13 0.61 0.98 0.00 0.00 173.24 174.07 2d9v n GLY 4 N 4.74 -4.33 3.64 7.32 0.00 -1.26 -5.09 105.19 110.21 2d9v n GLY 4 Ca 0.20 0.88 -0.02 0.00 0.00 0.00 0.00 46.02 47.08 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 -0.53 -1.09 -0.23 1.61 0.01 -1.26 -5.13 113.70 107.08 2d9v s SER 5 Ca -0.15 1.53 -0.00 0.00 1.31 0.00 0.00 55.95 58.63 2d9v s SER 5 Cb 0.01 2.13 0.06 0.00 0.21 0.00 0.00 66.02 68.44 2d9v s SER 5 CO 0.50 -0.22 -0.02 -0.55 0.41 0.00 0.00 173.24 173.36 2d9v s SER 6 N 2.68 3.66 0.00 2.44 0.15 -1.26 -4.83 113.70 116.54 2d9v s SER 6 Ca -0.06 -1.13 0.00 0.00 0.70 0.00 0.00 55.95 55.46 2d9v s SER 6 Cb -0.11 -1.04 0.00 0.00 -1.71 0.00 0.00 66.02 63.16 2d9v s SER 6 CO -0.19 -0.26 0.00 0.61 1.20 0.00 0.00 173.24 174.60 2d9v n GLY 7 N 4.76 2.21 3.84 9.45 0.00 -1.26 -4.97 105.19 119.21 2d9v n GLY 7 Ca -0.11 -0.40 -0.37 0.00 0.00 0.00 0.00 46.02 45.14 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 4.40 -0.16 0.99 2.96 -1.26 -0.65 118.68 124.96 2d9v s LEU 8 Ca 0.00 0.67 -0.13 0.00 -0.22 0.00 0.00 54.13 54.45 2d9v s LEU 8 Cb 0.00 -2.32 -0.05 0.00 0.50 0.00 0.00 46.19 44.32 2d9v s LEU 8 CO 0.00 0.33 -0.23 0.52 -1.32 0.00 0.00 176.35 175.64 2d9v n VAL 9 N 2.18 1.45 -3.57 1.68 0.31 -0.31 -4.82 118.33 115.25 2d9v n VAL 9 Ca -0.16 0.17 -0.17 0.00 -0.01 0.00 0.00 64.34 64.17 2d9v n VAL 9 Cb 0.53 -2.36 -0.07 0.00 -0.91 0.00 0.00 33.84 31.04 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 -2.49 0.97 0.00 5.55 3.52 -1.26 -4.83 118.95 120.40 2d9v s ARG 10 Ca -0.21 0.39 0.00 0.00 -0.13 0.00 0.00 55.73 55.79 2d9v s ARG 10 Cb 0.03 0.46 0.00 0.00 -1.56 0.00 0.00 34.95 33.88 2d9v s ARG 10 CO 0.31 -0.26 0.00 0.41 -0.81 0.00 0.00 175.30 174.95 2d9v n GLY 11 N 1.38 7.46 0.00 8.12 0.00 -1.26 -3.20 105.19 117.69 2d9v n GLY 11 Ca -0.18 -2.00 0.00 0.00 0.00 0.00 0.00 46.02 43.85 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 4.97 3.56 3.87 -0.02 0.00 -1.24 -4.97 105.19 111.35 2d9v n GLY 12 Ca 0.00 -1.84 -0.37 0.00 0.00 0.00 0.00 46.02 43.82 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 -2.60 3.63 -0.02 1.61 0.52 -1.26 -2.74 118.94 118.07 2d9v s TRP 13 Ca 0.00 0.67 -0.05 0.00 0.02 0.00 0.00 56.10 56.74 2d9v s TRP 13 Cb 0.00 -2.05 0.01 0.00 -1.15 0.00 0.00 33.47 30.28 2d9v s TRP 13 CO 0.00 0.68 0.11 -0.51 0.02 0.00 0.00 176.95 177.24 2d9v s LEU 14 N -1.26 1.63 -0.20 2.99 1.43 -1.02 -4.91 118.68 117.33 2d9v s LEU 14 Ca 0.21 0.03 -0.29 0.00 -1.03 0.00 0.00 54.13 53.05 2d9v s LEU 14 Cb -0.14 0.45 -0.01 0.00 0.03 0.00 0.00 46.19 46.52 2d9v s LEU 14 CO 0.10 -0.16 1.34 0.26 0.23 0.00 0.00 176.35 178.12 2d9v s TRP 15 N -0.50 2.65 -0.12 0.29 0.52 -1.04 -2.80 118.94 117.93 2d9v s TRP 15 Ca -0.06 0.85 -0.02 0.00 0.02 0.00 0.00 56.10 56.89 2d9v s TRP 15 Cb -0.04 -3.70 -0.03 0.00 -1.15 0.00 0.00 33.47 28.56 2d9v s TRP 15 CO 0.00 -2.02 -0.04 0.50 0.02 0.00 0.00 176.95 175.42 2d9v s ARG 16 N 3.85 3.33 -0.06 4.98 3.52 0.60 -1.62 118.95 133.54 2d9v s ARG 16 Ca 0.58 -0.51 -0.22 0.00 -0.13 0.00 0.00 55.73 55.46 2d9v s ARG 16 Cb -0.22 -2.81 -0.04 0.00 -1.56 0.00 0.00 34.95 30.32 2d9v s ARG 16 CO 0.20 0.43 0.66 -1.14 -0.81 0.00 0.00 175.30 174.63 2d9v s GLN 17 N -0.15 4.41 0.72 5.12 0.74 -0.89 0.91 119.66 130.52 2d9v s GLN 17 Ca 0.03 0.81 -0.12 0.00 0.05 0.00 0.00 55.36 56.13 2d9v s GLN 17 Cb -0.13 -3.43 0.18 0.00 1.10 0.00 0.00 33.01 30.73 2d9v s GLN 17 CO 0.02 0.13 0.58 -1.13 -0.55 0.00 0.00 175.29 174.34 2d9v n SER 18 N 3.57 -2.02 -0.00 6.67 3.41 -0.53 -4.82 113.62 119.90 2d9v n SER 18 Ca -0.03 -0.77 0.02 0.00 -0.26 0.00 0.00 58.87 57.83 2d9v n SER 18 Cb 0.51 -0.56 -0.04 0.00 -0.26 0.00 0.00 64.21 63.87 2d9v n SER 18 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2d9v n SER 19 N -4.18 3.03 0.00 4.04 7.64 -1.26 -4.43 113.62 118.46 2d9v n SER 19 Ca 0.08 -0.14 0.00 0.00 1.01 0.00 0.00 58.87 59.82 2d9v n SER 19 Cb 0.33 1.17 0.00 0.00 -1.01 0.00 0.00 64.21 64.70 2d9v n SER 19 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2d9v n ILE 20 N -1.54 0.00 1.39 0.44 3.06 -1.26 -4.68 119.36 116.78 2d9v n ILE 20 Ca -0.00 0.00 0.14 0.00 -2.50 0.00 0.00 62.75 60.38 2d9v n ILE 20 Cb 0.11 -0.71 0.57 0.00 0.54 0.00 0.00 39.64 40.16 2d9v n ILE 20 CO 0.00 0.00 0.00 -0.11 -2.50 0.00 0.00 176.55 173.94 2d9v n LEU 21 N -1.98 0.62 -3.76 9.51 7.94 -1.26 -4.91 117.00 123.16 2d9v n LEU 21 Ca 0.00 -0.07 -0.30 0.00 -1.11 0.00 0.00 56.01 54.53 2d9v n LEU 21 Cb 0.43 -0.16 -0.06 0.00 0.53 0.00 0.00 43.42 44.17 2d9v n LEU 21 CO 0.00 0.11 -0.11 0.54 -1.11 0.00 0.00 177.39 176.82 2d9v n ARG 22 N -0.84 -1.11 -4.16 1.96 1.74 -1.26 -4.87 116.66 108.12 2d9v n ARG 22 Ca 0.14 0.10 -0.17 0.00 -0.77 0.00 0.00 57.85 57.15 2d9v n ARG 22 Cb 0.29 -3.99 -0.12 0.00 -1.02 0.00 0.00 32.46 27.62 2d9v n ARG 22 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2d9v s ARG 23 N -5.96 0.73 0.43 5.56 0.52 -1.26 -4.89 118.95 114.08 2d9v s ARG 23 Ca 0.59 -0.83 -0.23 0.00 -0.52 0.00 0.00 55.73 54.74 2d9v s ARG 23 Cb -0.34 -0.66 -0.09 0.00 0.52 0.00 0.00 34.95 34.39 2d9v s ARG 23 CO 0.72 0.14 1.05 -1.58 0.02 0.00 0.00 175.30 175.66 2d9v s TRP 24 N -1.20 3.15 -0.04 -0.53 0.52 -1.26 -1.45 118.94 118.12 2d9v s TRP 24 Ca -0.04 1.61 -0.03 0.00 0.02 0.00 0.00 56.10 57.67 2d9v s TRP 24 Cb -0.09 -3.12 0.01 0.00 -1.15 0.00 0.00 33.47 29.12 2d9v s TRP 24 CO 0.01 -0.76 0.09 -1.59 0.02 0.00 0.00 176.95 174.73 2d9v s LYS 25 N -2.76 0.09 0.26 4.98 -2.85 0.26 -4.89 119.74 114.83 2d9v s LYS 25 Ca 0.61 0.16 -0.30 0.00 -1.00 0.00 0.00 55.97 55.45 2d9v s LYS 25 Cb -0.20 0.01 -0.09 0.00 -2.06 0.00 0.00 37.83 35.48 2d9v s LYS 25 CO 0.25 -0.04 1.22 1.03 0.10 0.00 0.00 175.35 177.91 2d9v s ARG 26 N 0.24 4.48 0.32 1.78 0.52 -1.26 -0.29 118.95 124.74 2d9v s ARG 26 Ca -0.02 1.98 -0.06 0.00 -0.52 0.00 0.00 55.73 57.11 2d9v s ARG 26 Cb -0.03 -3.17 0.00 0.00 0.52 0.00 0.00 34.95 32.28 2d9v s ARG 26 CO -0.01 -0.05 0.49 -0.80 0.02 0.00 0.00 175.30 174.95 2d9v s ASN 27 N -0.31 0.58 -0.26 0.23 -0.87 -1.12 -4.92 114.94 108.26 2d9v s ASN 27 Ca 0.50 -1.33 0.01 0.00 -1.57 0.00 0.00 52.86 50.47 2d9v s ASN 27 Cb -0.35 0.65 0.08 0.00 -0.02 0.00 0.00 41.25 41.61 2d9v s ASN 27 CO 0.43 -1.28 0.01 0.86 -2.57 0.00 0.00 177.10 174.54 2d9v s TRP 28 N -3.24 2.30 0.15 2.20 -0.00 -1.15 -2.44 118.94 116.76 2d9v s TRP 28 Ca 0.28 -1.85 -0.07 0.00 -0.00 0.00 0.00 56.10 54.46 2d9v s TRP 28 Cb -0.01 -1.76 -0.06 0.00 -0.00 0.00 0.00 33.47 31.65 2d9v s TRP 28 CO 0.17 -0.81 0.42 -0.06 -0.00 0.00 0.00 176.95 176.66 2d9v s PHE 29 N 1.42 3.48 -0.16 5.86 0.40 -1.11 -2.57 117.98 125.31 2d9v s PHE 29 Ca 0.01 0.66 -0.08 0.00 -0.60 0.00 0.00 56.93 56.92 2d9v s PHE 29 Cb -0.18 -2.08 0.06 0.00 0.51 0.00 0.00 43.02 41.33 2d9v s PHE 29 CO -0.11 0.41 0.37 0.00 0.70 0.00 0.00 175.22 176.59 2d9v s ALA 30 N -1.65 -0.93 -0.02 5.36 0.00 -1.16 -3.69 121.76 119.67 2d9v s ALA 30 Ca 0.41 1.38 -0.17 0.00 0.00 0.00 0.00 51.96 53.58 2d9v s ALA 30 Cb -0.12 -0.94 -0.05 0.00 0.00 0.00 0.00 23.12 22.00 2d9v s ALA 30 CO 0.23 -0.36 0.46 -1.17 0.00 0.00 0.00 175.76 174.92 2d9v s LEU 31 N 1.65 4.43 0.06 0.00 2.96 -1.20 -3.21 118.68 123.36 2d9v s LEU 31 Ca -0.07 0.97 0.04 0.00 -0.22 0.00 0.00 54.13 54.85 2d9v s LEU 31 Cb -0.10 -2.67 -0.04 0.00 0.50 0.00 0.00 46.19 43.88 2d9v s LEU 31 CO -0.12 0.22 -0.02 0.26 -1.32 0.00 0.00 176.35 175.38 2d9v s TRP 32 N -0.58 2.97 0.61 5.38 0.52 -1.08 -1.16 118.94 125.60 2d9v s TRP 32 Ca 0.25 -0.02 0.32 0.00 0.02 0.00 0.00 56.10 56.67 2d9v s TRP 32 Cb -0.17 -1.57 1.84 0.00 -1.15 0.00 0.00 33.47 32.43 2d9v s TRP 32 CO 0.13 0.46 2.20 -0.07 0.02 0.00 0.00 176.95 179.69 2d9v h LEU 33 N 3.81 0.00 0.00 2.99 3.38 -1.23 0.91 115.31 125.16 2d9v h LEU 33 Ca -0.48 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.49 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 0.58 0.00 0.00 0.47 0.09 0.00 0.00 178.44 179.58 2d9v n ASP 34 N -3.66 0.00 -1.10 -0.43 8.00 -1.26 -4.84 116.55 113.25 2d9v n ASP 34 Ca -0.01 0.15 -0.02 0.00 0.71 0.00 0.00 54.79 55.62 2d9v n ASP 34 Cb 0.19 -0.30 0.01 0.00 -0.02 0.00 0.00 41.12 41.00 2d9v n ASP 34 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2d9v n GLY 35 N -0.34 0.48 2.78 0.44 0.00 0.31 -4.84 105.19 104.03 2d9v n GLY 35 Ca 0.05 -0.47 -0.15 0.00 0.00 0.00 0.00 46.02 45.45 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 -3.03 -0.05 -0.45 2.61 -4.23 -1.23 -0.83 115.64 108.43 2d9v s THR 36 Ca 0.01 0.20 -0.16 0.00 -1.18 0.00 0.00 61.69 60.56 2d9v s THR 36 Cb -0.01 -0.07 0.05 0.00 1.34 0.00 0.00 72.50 73.81 2d9v s THR 36 CO 0.06 0.08 0.38 -0.22 -0.54 0.00 0.00 174.62 174.39 2d9v s LEU 37 N 0.97 5.30 -0.11 4.79 2.96 0.77 -2.64 118.68 130.73 2d9v s LEU 37 Ca -0.08 -1.06 0.03 0.00 -0.22 0.00 0.00 54.13 52.80 2d9v s LEU 37 Cb -0.12 -2.22 0.00 0.00 0.50 0.00 0.00 46.19 44.36 2d9v s LEU 37 CO -0.03 -0.59 -0.23 -0.83 -1.32 0.00 0.00 176.35 173.36 2d9v s GLY 38 N 2.18 1.30 -0.01 7.98 0.00 -1.20 -1.03 107.32 116.54 2d9v s GLY 38 Ca 0.06 -0.97 0.05 0.00 0.00 0.00 0.00 44.72 43.86 2d9v s GLY 38 CO 0.09 -0.22 -0.16 -2.52 0.00 0.00 0.00 173.10 170.30 2d9v s TYR 39 N 0.49 2.65 0.17 1.90 -0.85 -1.18 -2.98 117.35 117.55 2d9v s TYR 39 Ca -0.15 -0.20 0.09 0.00 -0.52 0.00 0.00 57.07 56.28 2d9v s TYR 39 Cb -0.17 -1.56 -0.04 0.00 0.38 0.00 0.00 41.96 40.56 2d9v s TYR 39 CO 0.06 0.21 -0.18 0.71 -1.52 0.00 0.00 175.55 174.82 2d9v s TYR 40 N -0.81 1.86 0.14 -3.49 1.51 -1.06 -3.36 117.35 112.13 2d9v s TYR 40 Ca 0.13 -0.46 -0.32 0.00 -1.01 0.00 0.00 57.07 55.41 2d9v s TYR 40 Cb -0.11 -0.92 -0.09 0.00 -0.11 0.00 0.00 41.96 40.73 2d9v s TYR 40 CO 0.03 0.36 1.55 0.45 -1.11 0.00 0.00 175.55 176.83 2d9v h HIS 41 N 3.15 -1.69 -5.70 2.71 3.86 -1.89 -3.05 115.15 112.54 2d9v h HIS 41 Ca -0.42 0.09 -0.33 0.00 -1.16 0.00 0.00 60.37 58.55 2d9v h HIS 41 Cb 1.21 0.80 0.02 0.00 1.06 0.00 0.00 27.41 30.50 2d9v h HIS 41 CO 0.69 -0.47 -0.06 -0.40 0.86 0.00 0.00 177.93 178.55 2d9v n ASP 42 N -5.36 1.48 -0.56 2.45 5.68 -1.26 -4.23 116.55 114.75 2d9v n ASP 42 Ca -0.02 -2.05 0.02 0.00 -0.50 0.00 0.00 54.79 52.23 2d9v n ASP 42 Cb 0.33 -0.26 0.08 0.00 -1.14 0.00 0.00 41.12 40.13 2d9v n ASP 42 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 2d9v n GLU 43 N -1.81 1.62 -4.53 0.11 0.28 -1.26 -4.44 120.64 110.61 2d9v n GLU 43 Ca 0.10 -0.63 -0.29 0.00 -0.16 0.00 0.00 57.16 56.17 2d9v n GLU 43 Cb 0.40 -1.41 -0.17 0.00 1.43 0.00 0.00 31.44 31.70 2d9v n GLU 43 CO 0.00 0.00 0.00 0.95 -0.16 0.00 0.00 177.13 177.92 2d9v s THR 44 N -1.58 1.63 -0.93 3.84 -4.23 -1.26 -5.06 115.64 108.06 2d9v s THR 44 Ca 0.11 -0.72 -0.25 0.00 -1.18 0.00 0.00 61.69 59.65 2d9v s THR 44 Cb 0.07 -1.47 -0.10 0.00 1.34 0.00 0.00 72.50 72.34 2d9v s THR 44 CO 0.05 0.47 2.11 0.00 -0.54 0.00 0.00 174.62 176.71 2d9v s ALA 45 N 0.92 1.22 0.00 3.99 0.00 -1.26 -4.29 121.76 122.33 2d9v s ALA 45 Ca -0.07 -1.37 0.00 0.00 0.00 0.00 0.00 51.96 50.52 2d9v s ALA 45 Cb -0.15 -4.60 0.00 0.00 0.00 0.00 0.00 23.12 18.37 2d9v s ALA 45 CO -0.01 -5.49 0.00 1.04 0.00 0.00 0.00 175.76 171.30 2d9v n GLN 46 N 8.68 0.00 -3.74 0.00 1.13 -1.26 -4.98 117.38 117.21 2d9v n GLN 46 Ca 0.43 0.00 -0.35 0.00 -1.94 0.00 0.00 57.00 55.15 2d9v n GLN 46 Cb 0.46 -0.34 -0.09 0.00 0.11 0.00 0.00 30.24 30.37 2d9v n GLN 46 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 2d9v s ASP 47 N -4.41 5.30 0.03 1.08 1.01 -1.26 -5.06 116.67 113.34 2d9v s ASP 47 Ca 0.00 -3.27 -0.33 0.00 0.71 0.00 0.00 52.55 49.66 2d9v s ASP 47 Cb 0.00 -1.82 -0.12 0.00 1.01 0.00 0.00 42.92 42.00 2d9v s ASP 47 CO 0.00 -0.26 1.83 1.21 0.21 0.00 0.00 175.17 178.16 2d9v n GLU 48 N 2.89 2.41 -0.11 8.23 2.13 -1.26 -4.08 120.64 130.85 2d9v n GLU 48 Ca 0.13 0.88 -0.21 0.00 0.66 0.00 0.00 57.16 58.62 2d9v n GLU 48 Cb 0.37 -2.74 -0.09 0.00 0.27 0.00 0.00 31.44 29.25 2d9v n GLU 48 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 2d9v n GLU 49 N 5.91 0.55 -3.78 5.31 2.13 -1.21 -5.03 120.64 124.51 2d9v n GLU 49 Ca 0.20 0.42 -0.04 0.00 0.66 0.00 0.00 57.16 58.40 2d9v n GLU 49 Cb 0.33 -1.61 -0.01 0.00 0.27 0.00 0.00 31.44 30.41 2d9v n GLU 49 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 2d9v s ASP 50 N -6.81 -0.16 -0.22 4.31 1.01 -1.24 -5.07 116.67 108.50 2d9v s ASP 50 Ca -0.30 -0.49 -0.12 0.00 0.71 0.00 0.00 52.55 52.35 2d9v s ASP 50 Cb 0.08 0.53 0.07 0.00 1.01 0.00 0.00 42.92 44.62 2d9v s ASP 50 CO 0.48 -0.99 0.53 -0.60 0.21 0.00 0.00 175.17 174.80 2d9v s ARG 51 N -3.19 0.52 0.01 8.23 3.52 -1.26 -3.10 118.95 123.67 2d9v s ARG 51 Ca 0.13 1.02 0.08 0.00 -0.13 0.00 0.00 55.73 56.84 2d9v s ARG 51 Cb -0.02 0.13 -0.02 0.00 -1.56 0.00 0.00 34.95 33.48 2d9v s ARG 51 CO 0.04 -0.17 -0.25 0.14 -0.81 0.00 0.00 175.30 174.25 2d9v s VAL 52 N 1.70 2.01 0.28 7.11 -7.23 -0.20 -4.96 120.40 119.13 2d9v s VAL 52 Ca -0.09 -1.19 -0.29 0.00 -1.81 0.00 0.00 61.98 58.60 2d9v s VAL 52 Cb -0.08 -1.69 -0.10 0.00 0.56 0.00 0.00 36.38 35.07 2d9v s VAL 52 CO -0.16 0.47 1.37 -0.69 -0.31 0.00 0.00 175.10 175.78 2d9v s VAL 53 N -0.68 2.72 -0.16 1.32 1.01 -1.26 -0.16 120.40 123.19 2d9v s VAL 53 Ca 0.10 0.66 -0.01 0.00 0.00 0.00 0.00 61.98 62.73 2d9v s VAL 53 Cb -0.10 -3.42 -0.10 0.00 0.00 0.00 0.00 36.38 32.77 2d9v s VAL 53 CO 0.00 0.13 -0.16 -0.38 0.00 0.00 0.00 175.10 174.69 2d9v n ILE 54 N 1.61 0.91 -1.69 2.22 2.08 -0.01 -4.64 119.36 119.85 2d9v n ILE 54 Ca 0.03 -0.32 -0.52 0.00 0.56 0.00 0.00 62.75 62.50 2d9v n ILE 54 Cb 0.41 -1.23 -0.06 0.00 -0.75 0.00 0.00 39.64 38.01 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 -3.16 2.15 -3.97 1.39 -0.00 -1.07 -1.72 115.22 108.84 2d9v n HIS 55 Ca -0.29 0.29 -0.27 0.00 0.46 0.00 0.00 57.72 57.90 2d9v n HIS 55 Cb 0.78 -2.55 -0.08 0.00 -0.12 0.00 0.00 29.99 28.03 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 5.57 -1.00 0.00 1.57 3.72 0.32 -4.73 117.46 122.91 2d9v n PHE 56 Ca 0.23 0.50 0.00 0.00 -0.05 0.00 0.00 57.45 58.14 2d9v n PHE 56 Cb 0.22 -2.13 0.00 0.00 -0.94 0.00 0.00 39.48 36.63 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 -2.20 3.59 -4.62 4.37 5.15 -0.70 -4.94 115.26 115.91 2d9v n ASN 57 Ca -0.20 0.00 -0.43 0.00 -0.60 0.00 0.00 54.58 53.35 2d9v n ASN 57 Cb 0.53 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 -1.72 3.63 0.04 3.44 1.01 -1.24 0.38 120.40 125.94 2d9v s VAL 58 Ca 0.00 0.68 -0.13 0.00 0.00 0.00 0.00 61.98 62.53 2d9v s VAL 58 Cb 0.00 -3.72 -0.34 0.00 0.00 0.00 0.00 36.38 32.32 2d9v s VAL 58 CO 0.00 -0.37 1.02 -0.09 0.00 0.00 0.00 175.10 175.66 2d9v h ARG 59 N 11.47 0.48 -2.45 2.72 2.43 -0.79 -3.48 114.38 124.77 2d9v h ARG 59 Ca -0.33 -0.82 0.13 0.00 -0.81 0.00 0.00 59.98 58.14 2d9v h ARG 59 Cb 1.16 0.31 -0.10 0.00 -0.42 0.00 0.00 29.97 30.91 2d9v h ARG 59 CO 1.02 1.39 0.44 -0.51 -1.51 0.00 0.00 179.97 180.80 2d9v s ASP 60 N -7.49 -0.27 -0.14 -3.80 1.01 -1.24 -4.99 116.67 99.75 2d9v s ASP 60 Ca -0.08 -0.29 -0.05 0.00 0.71 0.00 0.00 52.55 52.84 2d9v s ASP 60 Cb 0.05 0.50 0.07 0.00 1.01 0.00 0.00 42.92 44.54 2d9v s ASP 60 CO 0.93 -0.88 0.29 -0.63 0.21 0.00 0.00 175.17 175.09 2d9v s ILE 61 N -3.35 -0.45 0.12 0.77 1.01 -1.26 0.11 121.20 118.15 2d9v s ILE 61 Ca 0.09 0.26 0.03 0.00 0.00 0.00 0.00 60.65 61.04 2d9v s ILE 61 Cb -0.02 -0.48 -0.04 0.00 0.01 0.00 0.00 42.46 41.94 2d9v s ILE 61 CO -0.02 0.11 0.16 -0.54 0.00 0.00 0.00 174.94 174.66 2d9v s LYS 62 N 2.45 3.11 -0.13 2.79 -0.14 0.96 -4.95 119.74 123.83 2d9v s LYS 62 Ca 0.01 -0.68 -0.10 0.00 -1.36 0.00 0.00 55.97 53.84 2d9v s LYS 62 Cb -0.12 -2.81 0.04 0.00 -1.68 0.00 0.00 37.83 33.26 2d9v s LYS 62 CO -0.09 0.54 0.33 0.08 -0.76 0.00 0.00 175.35 175.45 2d9v s VAL 63 N -1.60 -0.01 0.00 3.17 1.01 -1.26 -0.74 120.40 120.96 2d9v s VAL 63 Ca 0.32 0.05 0.00 0.00 0.00 0.00 0.00 61.98 62.35 2d9v s VAL 63 Cb -0.11 -0.48 0.00 0.00 0.00 0.00 0.00 36.38 35.79 2d9v s VAL 63 CO 0.25 0.02 0.00 0.61 0.00 0.00 0.00 175.10 175.98 2d9v n GLY 64 N 3.46 1.05 0.36 4.51 0.00 0.91 -3.17 105.19 112.31 2d9v n GLY 64 Ca -0.18 -0.74 0.30 0.00 0.00 0.00 0.00 46.02 45.40 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 0.14 -0.95 1.61 5.75 -1.91 0.10 115.11 119.86 2d9v h GLN 65 Ca 0.00 -0.01 0.34 0.00 -0.15 0.00 0.00 58.65 58.83 2d9v h GLN 65 Cb 0.00 -0.03 -0.11 0.00 1.07 0.00 0.00 27.48 28.41 2d9v h GLN 65 CO 0.00 0.09 0.59 0.39 -2.65 0.00 0.00 178.83 177.25 2d9v n GLU 66 N -5.03 -0.03 -1.03 1.69 1.02 -1.19 -4.50 120.64 111.57 2d9v n GLU 66 Ca 0.35 0.92 -0.36 0.00 -0.02 0.00 0.00 57.16 58.05 2d9v n GLU 66 Cb 1.22 -1.78 0.04 0.00 -0.02 0.00 0.00 31.44 30.90 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 2.02 0.00 -0.03 0.00 0.00 -1.26 -4.89 117.38 113.22 2d9v n GLN 68 Ca 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 57.00 57.01 2d9v n GLN 68 Cb 0.54 -0.13 0.02 0.00 0.00 0.00 0.00 30.24 30.68 2d9v n GLN 68 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.06 176.66 2d9v n ASP 69 N -2.44 2.07 -4.67 1.69 5.75 -1.26 -5.01 116.55 112.68 2d9v n ASP 69 Ca 0.00 -1.91 -0.43 0.00 -0.01 0.00 0.00 54.79 52.44 2d9v n ASP 69 Cb 0.00 -0.04 -0.02 0.00 -1.03 0.00 0.00 41.12 40.03 2d9v n ASP 69 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 2d9v s VAL 70 N -0.92 4.28 -0.18 2.12 1.01 -1.26 -5.01 120.40 120.43 2d9v s VAL 70 Ca 0.04 1.56 -0.15 0.00 0.00 0.00 0.00 61.98 63.43 2d9v s VAL 70 Cb 0.02 -4.01 -0.04 0.00 0.00 0.00 0.00 36.38 32.35 2d9v s VAL 70 CO 0.03 -0.10 0.33 -1.10 0.00 0.00 0.00 175.10 174.26 2d9v s GLN 71 N 3.18 4.21 0.43 2.72 -1.52 -1.26 -5.01 119.66 122.41 2d9v s GLN 71 Ca 0.55 0.12 -0.24 0.00 -1.95 0.00 0.00 55.36 53.84 2d9v s GLN 71 Cb -0.22 -3.48 -0.08 0.00 -0.22 0.00 0.00 33.01 29.00 2d9v s GLN 71 CO 0.16 0.10 1.18 -1.25 -0.25 0.00 0.00 175.29 175.23 2d9v s PRO 72 N 0.88 3.91 0.63 2.91 0.04 -1.26 -5.01 135.00 137.09 2d9v s PRO 72 Ca 0.17 1.84 -0.16 0.00 0.04 0.00 0.00 61.00 62.89 2d9v s PRO 72 Cb -0.14 -2.56 -0.02 0.00 0.04 0.00 0.00 34.50 31.83 2d9v s PRO 72 CO 0.06 -0.44 1.12 -1.25 0.04 0.00 0.00 177.00 176.52 2d9v s PRO 73 N -2.47 2.94 0.15 0.56 0.04 -1.26 -4.95 135.00 130.01 2d9v s PRO 73 Ca 0.60 1.45 -0.31 0.00 0.04 0.00 0.00 61.00 62.78 2d9v s PRO 73 Cb -0.30 -1.96 -0.11 0.00 0.04 0.00 0.00 34.50 32.17 2d9v s PRO 73 CO 0.38 -1.15 1.72 -2.00 0.04 0.00 0.00 177.00 175.99 2d9v s GLU 74 N -3.89 4.16 0.00 4.56 2.12 -1.26 -2.62 118.70 121.77 2d9v s GLU 74 Ca 0.68 2.51 0.00 0.00 0.36 0.00 0.00 54.97 58.53 2d9v s GLU 74 Cb -0.21 -3.34 0.00 0.00 0.26 0.00 0.00 34.13 30.84 2d9v s GLU 74 CO 0.38 -0.75 0.00 0.41 -0.54 0.00 0.00 175.26 174.76 2d9v n GLY 75 N 4.02 3.03 1.06 -1.50 0.00 -1.26 -5.04 105.19 105.50 2d9v n GLY 75 Ca 0.16 -0.82 -0.09 0.00 0.00 0.00 0.00 46.02 45.27 2d9v n GLY 75 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2d9v n ARG 76 N 0.00 -1.78 -4.58 1.61 5.12 -1.08 -5.08 116.66 110.86 2d9v n ARG 76 Ca 0.00 -0.53 -0.30 0.00 -1.93 0.00 0.00 57.85 55.09 2d9v n ARG 76 Cb 0.00 -0.51 -0.08 0.00 -1.16 0.00 0.00 32.46 30.71 2d9v n ARG 76 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 2d9v s SER 77 N -2.40 4.12 0.00 0.55 0.15 -1.26 -4.90 113.70 109.95 2d9v s SER 77 Ca 0.22 -1.47 0.27 0.00 0.70 0.00 0.00 55.95 55.66 2d9v s SER 77 Cb -0.02 0.11 0.88 0.00 -1.71 0.00 0.00 66.02 65.27 2d9v s SER 77 CO 0.17 -0.71 1.67 0.54 1.20 0.00 0.00 173.24 176.11 2d9v n ARG 78 N -1.20 0.05 0.08 5.44 1.74 -1.26 -3.40 116.66 118.10 2d9v n ARG 78 Ca -0.11 -0.02 0.13 0.00 -0.77 0.00 0.00 57.85 57.08 2d9v n ARG 78 Cb 0.67 -1.50 0.34 0.00 -1.02 0.00 0.00 32.46 30.94 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 -1.46 0.69 0.06 0.55 8.00 -1.26 -3.42 116.55 119.70 2d9v n ASP 79 Ca 0.07 0.37 0.12 0.00 0.71 0.00 0.00 54.79 56.06 2d9v n ASP 79 Cb 0.33 -0.40 0.23 0.00 -0.02 0.00 0.00 41.12 41.27 2d9v n ASP 79 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2d9v n GLY 80 N 1.35 -1.44 3.68 0.44 0.00 -1.22 -4.03 105.19 103.96 2d9v n GLY 80 Ca 0.05 -0.22 -0.46 0.00 0.00 0.00 0.00 46.02 45.38 2d9v n GLY 80 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2d9v n LEU 81 N -2.04 3.39 -3.74 0.99 4.32 -1.22 -0.31 117.00 118.39 2d9v n LEU 81 Ca 0.04 1.02 -0.20 0.00 -0.02 0.00 0.00 56.01 56.85 2d9v n LEU 81 Cb 0.42 -1.42 -0.17 0.00 -1.62 0.00 0.00 43.42 40.63 2d9v n LEU 81 CO 0.35 -0.12 -0.36 -0.22 -1.22 0.00 0.00 177.39 175.82 2d9v s LEU 82 N 2.57 0.54 -0.06 2.23 2.96 0.12 -0.06 118.68 126.97 2d9v s LEU 82 Ca 0.85 -0.00 0.06 0.00 -0.22 0.00 0.00 54.13 54.82 2d9v s LEU 82 Cb -0.65 -0.27 -0.01 0.00 0.50 0.00 0.00 46.19 45.76 2d9v s LEU 82 CO 0.44 -0.20 -0.24 -0.89 -1.32 0.00 0.00 176.35 174.14 2d9v s THR 83 N 1.83 1.98 -0.04 3.68 2.01 0.08 -1.65 115.64 123.53 2d9v s THR 83 Ca 0.02 -1.02 0.06 0.00 0.31 0.00 0.00 61.69 61.06 2d9v s THR 83 Cb -0.12 -1.68 -0.02 0.00 0.01 0.00 0.00 72.50 70.68 2d9v s THR 83 CO -0.04 0.55 -0.23 -0.69 -0.69 0.00 0.00 174.62 173.53 2d9v s VAL 84 N -0.06 2.31 -0.12 3.82 1.01 -1.05 -0.03 120.40 126.27 2d9v s VAL 84 Ca -0.06 -1.00 -0.03 0.00 0.00 0.00 0.00 61.98 60.89 2d9v s VAL 84 Cb -0.14 -1.84 -0.03 0.00 0.00 0.00 0.00 36.38 34.37 2d9v s VAL 84 CO 0.04 0.58 -0.01 0.20 0.00 0.00 0.00 175.10 175.91 2d9v s ASN 85 N -0.50 5.04 0.11 3.32 0.01 0.12 -0.18 114.94 122.86 2d9v s ASN 85 Ca 0.07 0.01 0.07 0.00 -0.71 0.00 0.00 52.86 52.29 2d9v s ASN 85 Cb -0.11 -1.63 -0.04 0.00 0.41 0.00 0.00 41.25 39.88 2d9v s ASN 85 CO 0.01 0.27 -0.07 -0.76 -1.51 0.00 0.00 177.10 175.04 2d9v s LEU 86 N -0.22 3.17 0.34 0.60 1.43 -1.01 -0.10 118.68 122.89 2d9v s LEU 86 Ca 0.05 -0.35 0.07 0.00 -1.03 0.00 0.00 54.13 52.86 2d9v s LEU 86 Cb -0.13 -1.92 0.60 0.00 0.03 0.00 0.00 46.19 44.78 2d9v s LEU 86 CO 0.02 0.16 1.82 0.03 0.23 0.00 0.00 176.35 178.61 2d9v h ARG 87 N 3.41 0.32 0.00 1.70 3.08 -0.40 -2.21 114.38 120.28 2d9v h ARG 87 Ca -0.48 -0.10 0.00 0.00 0.07 0.00 0.00 59.98 59.47 2d9v h ARG 87 Cb 1.17 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.19 2d9v h ARG 87 CO 0.55 0.52 0.08 1.05 -1.07 0.00 0.00 179.97 181.09 2d9v h GLU 88 N 0.29 0.00 -0.91 0.04 4.11 -1.96 -3.45 114.58 112.70 2d9v h GLU 88 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.48 2d9v h GLU 88 Cb 0.54 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.79 2d9v h GLU 88 CO 0.04 0.00 0.00 0.41 0.07 0.00 0.00 179.01 179.53 2d9v n GLY 89 N -1.24 0.59 3.55 1.06 0.00 -0.83 -5.13 105.19 103.19 2d9v n GLY 89 Ca -0.02 -0.60 0.01 0.00 0.00 0.00 0.00 46.02 45.41 2d9v n GLY 89 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2d9v s SER 90 N -2.07 -0.27 0.23 1.61 0.15 -1.24 -5.02 113.70 107.09 2d9v s SER 90 Ca 0.00 0.41 -0.05 0.00 0.70 0.00 0.00 55.95 57.01 2d9v s SER 90 Cb 0.00 1.17 -0.05 0.00 -1.71 0.00 0.00 66.02 65.43 2d9v s SER 90 CO 0.00 -0.06 0.48 0.00 1.20 0.00 0.00 173.24 174.86 2d9v s ARG 91 N 1.45 3.63 -0.16 5.44 1.70 -1.26 -2.41 118.95 127.33 2d9v s ARG 91 Ca -0.07 -0.04 -0.03 0.00 -0.47 0.00 0.00 55.73 55.12 2d9v s ARG 91 Cb -0.03 -2.73 -0.02 0.00 -0.57 0.00 0.00 34.95 31.60 2d9v s ARG 91 CO -0.13 0.32 -0.06 -0.51 -1.08 0.00 0.00 175.30 173.84 2d9v s LEU 92 N -3.22 3.04 -0.57 -1.89 1.43 0.74 -4.95 118.68 113.26 2d9v s LEU 92 Ca 0.43 -0.24 -0.17 0.00 -1.03 0.00 0.00 54.13 53.12 2d9v s LEU 92 Cb -0.11 -1.73 0.12 0.00 0.03 0.00 0.00 46.19 44.50 2d9v s LEU 92 CO 0.27 0.12 0.61 -1.00 0.23 0.00 0.00 176.35 176.59 2d9v s HIS 93 N 0.62 3.14 0.20 0.29 3.76 -1.26 -2.52 115.29 119.52 2d9v s HIS 93 Ca -0.04 -1.15 0.06 0.00 -0.15 0.00 0.00 55.06 53.78 2d9v s HIS 93 Cb -0.15 -3.91 -0.05 0.00 1.11 0.00 0.00 32.58 29.59 2d9v s HIS 93 CO 0.03 -1.16 -0.11 -0.51 -0.85 0.00 0.00 174.74 172.14 2d9v s LEU 94 N 2.10 2.50 -0.03 0.89 1.43 -0.66 -2.10 118.68 122.82 2d9v s LEU 94 Ca 0.08 -1.06 -0.06 0.00 -1.03 0.00 0.00 54.13 52.05 2d9v s LEU 94 Cb -0.27 -0.53 0.01 0.00 0.03 0.00 0.00 46.19 45.43 2d9v s LEU 94 CO 0.04 -0.27 0.15 0.00 0.23 0.00 0.00 176.35 176.49 2d9v s ALA 96 N -0.68 3.78 -0.04 0.00 0.00 0.58 -2.49 121.76 122.90 2d9v s ALA 96 Ca -0.08 -1.85 -0.26 0.00 0.00 0.00 0.00 51.96 49.78 2d9v s ALA 96 Cb -0.05 -0.44 -0.21 0.00 0.00 0.00 0.00 23.12 22.42 2d9v s ALA 96 CO 0.01 -0.20 1.17 0.93 0.00 0.00 0.00 175.76 177.66 2d9v h GLU 97 N 1.30 0.04 -5.10 0.00 5.08 -1.91 -3.40 114.58 110.59 2d9v h GLU 97 Ca -0.42 -0.03 -0.40 0.00 -1.00 0.00 0.00 59.36 57.51 2d9v h GLU 97 Cb 1.27 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.38 2d9v h GLU 97 CO 0.68 0.63 -0.63 0.95 -1.00 0.00 0.00 179.01 179.63 2d9v s THR 98 N -3.81 0.99 0.23 1.13 -4.23 -1.26 -4.66 115.64 104.03 2d9v s THR 98 Ca -0.16 -2.02 -0.07 0.00 -1.18 0.00 0.00 61.69 58.26 2d9v s THR 98 Cb 0.01 -2.56 0.18 0.00 1.34 0.00 0.00 72.50 71.47 2d9v s THR 98 CO 0.69 -0.15 1.82 0.08 -0.54 0.00 0.00 174.62 176.51 2d9v h ARG 99 N 2.33 0.74 -0.08 3.99 0.11 -1.92 -2.67 114.38 116.89 2d9v h ARG 99 Ca -0.39 -0.04 0.02 0.00 0.10 0.00 0.00 59.98 59.66 2d9v h ARG 99 Cb 1.24 -0.17 -0.04 0.00 1.11 0.00 0.00 29.97 32.11 2d9v h ARG 99 CO 0.65 0.49 -0.35 0.22 0.10 0.00 0.00 179.97 181.09 2d9v h ASP 100 N 0.76 -1.10 -0.65 0.08 3.58 -1.96 0.74 116.42 117.88 2d9v h ASP 100 Ca 0.34 0.13 0.14 0.00 0.42 0.00 0.00 57.03 58.06 2d9v h ASP 100 Cb 0.24 0.43 -0.11 0.00 1.72 0.00 0.00 39.33 41.60 2d9v h ASP 100 CO -0.20 -0.31 -0.05 0.44 -2.88 0.00 0.00 179.24 176.24 2d9v h ASP 101 N -0.37 -0.39 -0.27 2.28 5.19 -1.94 0.18 116.42 121.09 2d9v h ASP 101 Ca 0.02 0.17 0.06 0.00 -0.62 0.00 0.00 57.03 56.66 2d9v h ASP 101 Cb 0.43 0.32 -0.06 0.00 0.18 0.00 0.00 39.33 40.21 2d9v h ASP 101 CO -0.28 -0.16 -0.09 0.00 -3.12 0.00 0.00 179.24 175.59 2d9v h ALA 102 N 1.61 0.15 -0.24 3.45 0.00 -1.01 -2.17 119.26 121.05 2d9v h ALA 102 Ca 0.33 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.34 2d9v h ALA 102 Cb 0.54 0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 2d9v h ALA 102 CO -0.59 -0.49 0.11 0.82 0.00 0.00 0.00 179.25 179.10 2d9v h ILE 103 N -0.04 1.14 -0.68 0.00 2.04 0.61 -2.64 117.51 117.94 2d9v h ILE 103 Ca 0.14 -0.42 0.14 0.00 1.00 0.00 0.00 64.86 65.72 2d9v h ILE 103 Cb 0.24 0.98 -0.13 0.00 -0.74 0.00 0.00 36.82 37.17 2d9v h ILE 103 CO -0.30 0.14 -0.11 0.00 0.00 0.00 0.00 178.15 177.88 2d9v h ALA 104 N 0.97 0.54 -0.44 1.87 0.00 -0.26 0.28 119.26 122.23 2d9v h ALA 104 Ca 0.08 0.25 -0.01 0.00 0.00 0.00 0.00 54.91 55.24 2d9v h ALA 104 Cb 0.12 0.47 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 2d9v h ALA 104 CO -0.01 -0.42 0.25 -1.49 0.00 0.00 0.00 179.25 177.58 2d9v h TRP 105 N 0.03 0.59 -0.99 0.00 4.06 -1.25 -1.76 115.95 116.64 2d9v h TRP 105 Ca 0.34 -0.01 0.17 0.00 2.06 0.00 0.00 58.89 61.45 2d9v h TRP 105 Cb 0.55 -0.19 -0.09 0.00 -1.00 0.00 0.00 29.16 28.43 2d9v h TRP 105 CO -0.50 0.44 0.62 -0.22 -3.56 0.00 0.00 178.44 175.22 2d9v h LYS 106 N 0.57 0.77 -0.15 0.49 3.64 -0.62 0.28 116.57 121.55 2d9v h LYS 106 Ca 0.15 -0.05 -0.20 0.00 -1.27 0.00 0.00 60.65 59.29 2d9v h LYS 106 Cb 0.04 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 31.68 2d9v h LYS 106 CO -0.03 0.51 -0.71 1.15 -2.27 0.00 0.00 179.45 178.11 2d9v h THR 107 N 0.80 1.31 0.00 1.00 2.02 -0.83 0.19 112.91 117.39 2d9v h THR 107 Ca 0.53 -1.97 -0.08 0.00 0.77 0.00 0.00 66.41 65.66 2d9v h THR 107 Cb 0.78 1.95 -0.01 0.00 -1.74 0.00 0.00 68.15 69.13 2d9v h THR 107 CO -0.31 0.62 -0.38 0.00 0.37 0.00 0.00 175.52 175.81 2d9v h ALA 108 N 0.74 1.07 0.07 6.16 0.00 -0.22 -1.69 119.26 125.39 2d9v h ALA 108 Ca -0.03 -0.35 -0.28 0.00 0.00 0.00 0.00 54.91 54.26 2d9v h ALA 108 Cb 1.31 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 19.02 2d9v h ALA 108 CO 0.14 0.48 -1.48 -0.07 0.00 0.00 0.00 179.25 178.32 2d9v h LEU 109 N 0.00 0.22 -1.66 0.00 3.38 -0.46 -3.12 115.31 113.68 2d9v h LEU 109 Ca -0.00 -0.75 -0.03 0.00 0.09 0.00 0.00 57.88 57.19 2d9v h LEU 109 Cb 0.84 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.51 2d9v h LEU 109 CO 0.05 1.62 -0.14 0.24 0.09 0.00 0.00 178.44 180.30 2d9v h MET 110 N -0.50 0.04 0.13 1.13 2.86 -0.66 -0.90 114.93 117.03 2d9v h MET 110 Ca -0.35 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.28 2d9v h MET 110 Cb 1.63 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 33.28 2d9v h MET 110 CO -0.05 0.18 -0.06 0.93 1.06 0.00 0.00 176.91 178.97 2d9v h GLU 111 N 0.04 -0.17 -0.86 1.72 4.39 -1.45 -2.82 114.58 115.42 2d9v h GLU 111 Ca 0.01 0.01 0.23 0.00 0.34 0.00 0.00 59.36 59.95 2d9v h GLU 111 Cb 0.28 0.04 -0.05 0.00 -0.10 0.00 0.00 28.75 28.92 2d9v h GLU 111 CO 0.02 -0.12 0.60 0.00 -1.16 0.00 0.00 179.01 178.35 2d9v h ALA 112 N -1.47 2.59 -0.45 3.43 0.00 -1.56 0.18 119.26 121.99 2d9v h ALA 112 Ca -0.02 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.74 2d9v h ALA 112 Cb 0.14 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2d9v h ALA 112 CO 0.03 -0.85 -0.26 -0.97 0.00 0.00 0.00 179.25 177.20 2d9v h ASN 113 N 0.14 1.00 -1.20 0.00 -1.24 -1.25 -3.24 115.58 109.79 2d9v h ASN 113 Ca 0.42 -0.42 -0.61 0.00 0.71 0.00 0.00 56.30 56.41 2d9v h ASN 113 Cb 1.45 -0.28 -0.39 0.00 0.73 0.00 0.00 38.32 39.83 2d9v h ASN 113 CO -0.07 1.20 -0.35 -0.24 -1.29 0.00 0.00 177.43 176.68 2d9v n SER 114 N -4.11 5.51 -3.15 1.15 2.88 0.39 0.12 113.62 116.41 2d9v n SER 114 Ca -0.01 -3.75 0.04 0.00 -1.33 0.00 0.00 58.87 53.82 2d9v n SER 114 Cb 0.48 -0.55 -0.01 0.00 -0.75 0.00 0.00 64.21 63.39 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 -5.02 -0.83 1.20 2.46 2.01 0.19 -4.93 115.64 110.72 2d9v s THR 115 Ca 0.52 0.00 -0.19 0.00 0.31 0.00 0.00 61.69 62.33 2d9v s THR 115 Cb 0.42 -0.94 0.29 0.00 0.01 0.00 0.00 72.50 72.28 2d9v s THR 115 CO -0.10 0.00 1.11 -2.16 -0.69 0.00 0.00 174.62 172.78 2d9v s PRO 116 N 2.88 -1.21 0.22 4.92 0.04 -1.26 -4.59 135.00 135.99 2d9v s PRO 116 Ca 0.15 -0.06 0.11 0.00 0.04 0.00 0.00 61.00 61.24 2d9v s PRO 116 Cb -0.12 -1.60 -0.05 0.00 0.04 0.00 0.00 34.50 32.78 2d9v s PRO 116 CO -0.21 -3.70 -0.18 0.00 0.04 0.00 0.00 177.00 172.95 2d9v s ALA 117 N -3.00 2.73 0.16 8.56 0.00 -1.26 -5.03 121.76 123.91 2d9v s ALA 117 Ca 0.71 -1.68 0.31 0.00 0.00 0.00 0.00 51.96 51.29 2d9v s ALA 117 Cb -0.10 -0.42 1.27 0.00 0.00 0.00 0.00 23.12 23.87 2d9v s ALA 117 CO 0.56 0.38 1.96 -1.00 0.00 0.00 0.00 175.76 177.66 2d9v h PRO 118 N 2.76 0.00 -6.25 0.00 0.13 -1.98 -3.43 132.00 123.22 2d9v h PRO 118 Ca -0.44 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.12 2d9v h PRO 118 Cb 1.23 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.31 2d9v h PRO 118 CO 0.54 0.08 -0.05 0.00 -0.23 0.00 0.00 178.00 178.34 2d9v s ALA 119 N -3.72 3.59 -0.39 -0.56 0.00 -1.26 -5.05 121.76 114.36 2d9v s ALA 119 Ca 0.00 -0.00 0.03 0.00 0.00 0.00 0.00 51.96 52.00 2d9v s ALA 119 Cb 0.10 -2.61 0.16 0.00 0.00 0.00 0.00 23.12 20.77 2d9v s ALA 119 CO 0.57 0.41 0.37 0.20 0.00 0.00 0.00 175.76 177.32 2d9v s GLY 120 N -1.23 0.33 0.32 0.00 0.00 -1.26 -5.12 107.32 100.36 2d9v s GLY 120 Ca 0.31 -1.48 0.04 0.00 0.00 0.00 0.00 44.72 43.58 2d9v s GLY 120 CO 0.19 2.55 0.16 0.00 0.00 0.00 0.00 173.10 176.00 2d9v s ALA 121 N 0.93 2.10 -0.17 3.20 0.00 -1.26 -5.14 121.76 121.42 2d9v s ALA 121 Ca 0.23 -1.71 -0.15 0.00 0.00 0.00 0.00 51.96 50.33 2d9v s ALA 121 Cb -0.10 1.11 -0.04 0.00 0.00 0.00 0.00 23.12 24.08 2d9v s ALA 121 CO -0.07 -0.49 0.33 0.99 0.00 0.00 0.00 175.76 176.53 2d9v s THR 122 N -3.53 5.27 0.36 0.00 2.01 -1.26 -5.06 115.64 113.44 2d9v s THR 122 Ca 0.34 0.62 -0.27 0.00 0.31 0.00 0.00 61.69 62.69 2d9v s THR 122 Cb 0.05 -3.67 -0.09 0.00 0.01 0.00 0.00 72.50 68.79 2d9v s THR 122 CO 0.18 0.35 1.26 0.68 -0.69 0.00 0.00 174.62 176.40 2d9v s VAL 123 N 0.69 2.84 -2.00 3.82 -7.23 -1.26 -4.89 120.40 112.38 2d9v s VAL 123 Ca 0.18 0.79 0.14 0.00 -1.81 0.00 0.00 61.98 61.28 2d9v s VAL 123 Cb -0.14 -3.48 0.39 0.00 0.56 0.00 0.00 36.38 33.71 2d9v s VAL 123 CO 0.05 0.14 1.23 -0.81 -0.31 0.00 0.00 175.10 175.41 2d9v n PRO 124 N 0.47 0.49 -0.24 4.82 -0.04 -1.26 -4.01 135.00 135.24 2d9v n PRO 124 Ca 0.02 0.00 0.19 0.00 -0.04 0.00 0.00 63.50 63.67 2d9v n PRO 124 Cb 0.44 -1.43 0.36 0.00 -0.04 0.00 0.00 33.50 32.82 2d9v n PRO 124 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2d9v n SER 125 N -0.93 0.15 0.00 3.54 2.88 -1.26 -4.80 113.62 113.19 2d9v n SER 125 Ca 0.10 1.22 0.00 0.00 -1.33 0.00 0.00 58.87 58.86 2d9v n SER 125 Cb 0.05 -0.55 0.00 0.00 -0.75 0.00 0.00 64.21 62.96 2d9v n SER 125 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2d9v n GLY 126 N -1.24 0.96 3.56 0.46 0.00 -1.26 -4.24 105.19 103.43 2d9v n GLY 126 Ca 0.24 -0.75 -0.27 0.00 0.00 0.00 0.00 46.02 45.24 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 2.55 0.18 1.61 0.04 -1.26 -4.88 135.00 133.25 2d9v s PRO 127 Ca 0.00 -0.22 -0.22 0.00 0.04 0.00 0.00 61.00 60.60 2d9v s PRO 127 Cb 0.00 -5.01 0.06 0.00 0.04 0.00 0.00 34.50 29.58 2d9v s PRO 127 CO 0.00 -3.34 0.61 0.45 0.04 0.00 0.00 177.00 174.76 2d9v s SER 128 N 8.06 -0.49 -0.10 6.66 0.15 -1.26 -5.18 113.70 121.54 2d9v s SER 128 Ca 0.70 -0.14 -0.17 0.00 0.70 0.00 0.00 55.95 57.04 2d9v s SER 128 Cb -0.07 0.62 0.04 0.00 -1.71 0.00 0.00 66.02 64.89 2d9v s SER 128 CO 0.01 -1.03 0.42 -0.55 1.20 0.00 0.00 173.24 173.29 2d9v s SER 129 N -2.79 -0.39 0.00 5.45 0.15 -1.26 -5.14 113.70 109.72 2d9v s SER 129 Ca 0.03 0.59 0.00 0.00 0.70 0.00 0.00 55.95 57.28 2d9v s SER 129 Cb -0.02 0.66 0.00 0.00 -1.71 0.00 0.00 66.02 64.95 2d9v s SER 129 CO -0.09 -0.30 0.30 0.61 1.20 0.00 0.00 173.24 174.96