#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2w2b s LYS 3 N 0.00 3.94 -0.21 -2.82 -2.85 -1.26 -5.03 119.74 111.51 2w2b s LYS 3 Ca 0.00 1.74 -0.10 0.00 -1.00 0.00 0.00 55.97 56.61 2w2b s LYS 3 Cb 0.00 -2.53 -0.05 0.00 -2.06 0.00 0.00 37.83 33.19 2w2b s LYS 3 CO 0.00 -0.39 0.14 0.99 0.10 0.00 0.00 175.35 176.19 2w2b s THR 4 N -1.52 5.37 -0.18 3.79 2.01 -1.26 -4.95 115.64 118.90 2w2b s THR 4 Ca 0.60 0.18 -0.24 0.00 0.31 0.00 0.00 61.69 62.54 2w2b s THR 4 Cb -0.28 -3.47 -0.02 0.00 0.01 0.00 0.00 72.50 68.74 2w2b s THR 4 CO 0.35 0.41 0.77 -0.36 -0.69 0.00 0.00 174.62 175.09 2w2b s PHE 5 N 0.59 3.40 0.00 4.92 0.40 -1.26 -4.89 117.98 121.14 2w2b s PHE 5 Ca 0.08 1.15 0.00 0.00 -0.60 0.00 0.00 56.93 57.56 2w2b s PHE 5 Cb -0.12 -2.95 0.00 0.00 0.51 0.00 0.00 43.02 40.46 2w2b s PHE 5 CO 0.00 -0.22 0.00 1.63 0.70 0.00 0.00 175.22 177.33 2w2b n LYS 6 N 5.19 1.11 -4.32 0.44 5.02 -1.26 -3.73 118.16 120.61 2w2b n LYS 6 Ca 0.03 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 56.06 2w2b n LYS 6 Cb 0.49 -0.77 -0.09 0.00 -0.02 0.00 0.00 35.03 34.65 2w2b n LYS 6 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2w2b s THR 7 N -1.53 2.38 0.25 -0.18 -4.23 -1.26 -3.13 115.64 107.93 2w2b s THR 7 Ca 0.00 -1.88 -0.06 0.00 -1.18 0.00 0.00 61.69 58.58 2w2b s THR 7 Cb 0.00 -2.91 0.23 0.00 1.34 0.00 0.00 72.50 71.15 2w2b s THR 7 CO 0.00 -0.09 1.89 0.25 -0.54 0.00 0.00 174.62 176.13 2w2b h LEU 8 N 1.66 1.09 -1.48 4.79 5.85 -1.98 -2.53 115.31 122.71 2w2b h LEU 8 Ca -0.43 -0.08 -0.00 0.00 0.84 0.00 0.00 57.88 58.21 2w2b h LEU 8 Cb 1.25 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.98 2w2b h LEU 8 CO 0.71 0.85 0.30 -0.78 -0.34 0.00 0.00 178.44 179.19 2w2b h ASP 9 N 1.24 0.57 -0.53 1.25 3.58 -1.96 -0.48 116.42 120.10 2w2b h ASP 9 Ca 0.32 -0.02 -0.01 0.00 0.42 0.00 0.00 57.03 57.74 2w2b h ASP 9 Cb -0.02 -0.14 -0.03 0.00 1.72 0.00 0.00 39.33 40.86 2w2b h ASP 9 CO -0.06 0.43 0.32 0.44 -2.88 0.00 0.00 179.24 177.50 2w2b h ASP 10 N 0.67 0.65 0.05 2.28 3.32 -1.85 -3.24 116.42 118.31 2w2b h ASP 10 Ca 0.18 -0.04 -0.09 0.00 0.02 0.00 0.00 57.03 57.10 2w2b h ASP 10 Cb -0.04 -0.16 0.01 0.00 0.22 0.00 0.00 39.33 39.35 2w2b h ASP 10 CO -0.04 0.51 -0.41 0.15 -1.72 0.00 0.00 179.24 177.74 2w2b h PHE 11 N 0.75 0.21 -3.74 4.55 3.57 -1.14 -3.44 116.94 117.70 2w2b h PHE 11 Ca 0.20 -0.15 -0.55 0.00 3.53 0.00 0.00 57.97 60.99 2w2b h PHE 11 Cb -0.01 -0.01 0.11 0.00 2.79 0.00 0.00 35.95 38.83 2w2b h PHE 11 CO 0.00 1.16 0.67 1.28 -2.23 0.00 0.00 178.31 179.19 2w2b n LEU 12 N -4.40 4.45 0.00 0.59 4.77 -0.30 -1.94 117.00 120.17 2w2b n LEU 12 Ca -0.13 1.19 0.00 0.00 -0.03 0.00 0.00 56.01 57.04 2w2b n LEU 12 Cb 0.63 -1.57 0.00 0.00 -2.33 0.00 0.00 43.42 40.15 2w2b n LEU 12 CO 0.39 -0.14 0.00 0.61 -1.33 0.00 0.00 177.39 176.92 2w2b n GLY 13 N 0.59 0.85 3.78 -0.72 0.00 0.98 -4.78 105.19 105.88 2w2b n GLY 13 Ca 0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.66 2w2b n GLY 13 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2w2b s THR 14 N -3.39 4.69 -0.21 2.61 2.01 -0.82 -1.18 115.64 119.35 2w2b s THR 14 Ca 0.00 1.41 -0.04 0.00 0.31 0.00 0.00 61.69 63.37 2w2b s THR 14 Cb 0.00 -4.00 -0.01 0.00 0.01 0.00 0.00 72.50 68.50 2w2b s THR 14 CO 0.00 0.48 -0.04 -2.28 -0.69 0.00 0.00 174.62 172.09 2w2b s HIS 15 N -0.73 2.96 0.02 4.92 2.46 0.21 -2.06 115.29 123.06 2w2b s HIS 15 Ca 0.33 -0.87 0.06 0.00 0.47 0.00 0.00 55.06 55.05 2w2b s HIS 15 Cb -0.20 -2.09 -0.03 0.00 -0.13 0.00 0.00 32.58 30.13 2w2b s HIS 15 CO 0.21 -0.50 -0.17 -0.06 -2.47 0.00 0.00 174.74 171.75 2w2b s PHE 16 N 1.37 2.60 -0.04 3.88 0.40 0.41 -0.70 117.98 125.91 2w2b s PHE 16 Ca 0.04 -0.23 0.05 0.00 -0.60 0.00 0.00 56.93 56.20 2w2b s PHE 16 Cb -0.14 -1.51 -0.01 0.00 0.51 0.00 0.00 43.02 41.87 2w2b s PHE 16 CO -0.02 0.24 -0.20 0.42 0.70 0.00 0.00 175.22 176.36 2w2b s ILE 17 N -0.88 1.62 0.03 0.64 1.01 -0.66 -1.30 121.20 121.66 2w2b s ILE 17 Ca 0.14 -0.84 -0.06 0.00 0.00 0.00 0.00 60.65 59.88 2w2b s ILE 17 Cb -0.11 -1.37 -0.01 0.00 0.01 0.00 0.00 42.46 40.98 2w2b s ILE 17 CO 0.04 0.46 0.12 -0.72 0.00 0.00 0.00 174.94 174.85 2w2b s TYR 18 N -0.18 0.15 -0.09 3.97 -0.85 -0.18 -1.01 117.35 119.15 2w2b s TYR 18 Ca 0.00 -0.40 0.03 0.00 -0.52 0.00 0.00 57.07 56.19 2w2b s TYR 18 Cb -0.11 -0.10 0.00 0.00 0.38 0.00 0.00 41.96 42.13 2w2b s TYR 18 CO 0.01 -0.36 -0.20 0.99 -1.52 0.00 0.00 175.55 174.47 2w2b s THR 19 N -2.38 1.79 0.70 -3.49 2.01 0.07 -0.94 115.64 113.40 2w2b s THR 19 Ca -0.07 -0.86 -0.08 0.00 0.31 0.00 0.00 61.69 61.00 2w2b s THR 19 Cb -0.02 -1.56 0.05 0.00 0.01 0.00 0.00 72.50 70.98 2w2b s THR 19 CO -0.03 0.50 1.03 -0.36 -0.69 0.00 0.00 174.62 175.06 2w2b s PHE 20 N 0.48 2.98 0.54 4.92 0.40 -0.50 -1.01 117.98 125.79 2w2b s PHE 20 Ca -0.17 0.54 0.20 0.00 -0.60 0.00 0.00 56.93 56.90 2w2b s PHE 20 Cb -0.17 -3.17 1.39 0.00 0.51 0.00 0.00 43.02 41.58 2w2b s PHE 20 CO 0.07 -1.37 2.15 -0.44 0.70 0.00 0.00 175.22 176.32 2w2b h ASP 21 N -0.61 0.00 0.17 1.36 3.32 -1.90 -0.35 116.42 118.40 2w2b h ASP 21 Ca -0.45 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.60 2w2b h ASP 21 Cb 1.31 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.86 2w2b h ASP 21 CO 0.61 0.00 0.00 -0.46 -1.72 0.00 0.00 179.24 177.67 2w2b n ASN 22 N -4.38 0.00 0.00 6.45 0.23 -1.26 -4.90 115.26 111.40 2w2b n ASN 22 Ca -0.02 -0.68 0.00 0.00 -0.53 0.00 0.00 54.58 53.36 2w2b n ASN 22 Cb 0.14 -0.09 0.00 0.00 -2.08 0.00 0.00 39.78 37.76 2w2b n ASN 22 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2w2b n GLY 23 N 0.95 0.92 3.75 4.83 0.00 -0.14 -5.04 105.19 110.45 2w2b n GLY 23 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 2w2b n GLY 23 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2w2b s TRP 24 N -2.55 3.14 -0.21 1.61 0.51 -1.26 -4.75 118.94 115.43 2w2b s TRP 24 Ca 0.00 1.25 -0.04 0.00 -2.12 0.00 0.00 56.10 55.19 2w2b s TRP 24 Cb 0.00 -3.67 -0.01 0.00 -0.81 0.00 0.00 33.47 28.98 2w2b s TRP 24 CO 0.00 -2.03 -0.05 -2.00 -0.51 0.00 0.00 176.95 172.36 2w2b s GLU 25 N -0.77 3.40 0.22 4.98 2.12 -1.26 -1.41 118.70 125.99 2w2b s GLU 25 Ca 0.54 -0.62 0.10 0.00 0.36 0.00 0.00 54.97 55.36 2w2b s GLU 25 Cb -0.39 -2.97 -0.04 0.00 0.26 0.00 0.00 34.13 30.99 2w2b s GLU 25 CO 0.44 -0.13 -0.15 0.71 -0.54 0.00 0.00 175.26 175.60 2w2b s TYR 26 N 1.30 2.47 -0.01 5.30 1.51 -0.12 -1.07 117.35 126.73 2w2b s TYR 26 Ca 0.04 -0.29 0.01 0.00 -1.01 0.00 0.00 57.07 55.82 2w2b s TYR 26 Cb -0.14 -1.16 0.01 0.00 -0.11 0.00 0.00 41.96 40.55 2w2b s TYR 26 CO -0.02 0.57 -0.01 -2.00 -1.11 0.00 0.00 175.55 172.98 2w2b s GLU 27 N -3.06 0.16 -0.12 -0.62 2.12 -0.21 -1.01 118.70 115.96 2w2b s GLU 27 Ca 0.26 -0.02 -0.19 0.00 0.36 0.00 0.00 54.97 55.38 2w2b s GLU 27 Cb -0.07 -0.21 0.05 0.00 0.26 0.00 0.00 34.13 34.15 2w2b s GLU 27 CO 0.14 -0.01 0.48 -0.46 -0.54 0.00 0.00 175.26 174.87 2w2b s TRP 28 N 0.22 -0.47 -0.05 5.30 -0.00 -0.42 -0.85 118.94 122.68 2w2b s TRP 28 Ca -0.02 1.02 -0.00 0.00 -0.00 0.00 0.00 56.10 57.10 2w2b s TRP 28 Cb -0.04 0.20 0.03 0.00 -0.00 0.00 0.00 33.47 33.66 2w2b s TRP 28 CO -0.01 -0.35 -0.00 -0.47 -0.00 0.00 0.00 176.95 176.12 2w2b s TYR 29 N -0.38 0.54 -1.12 5.86 5.04 0.31 -0.44 117.35 127.15 2w2b s TYR 29 Ca -0.05 -0.09 -0.19 0.00 -2.44 0.00 0.00 57.07 54.29 2w2b s TYR 29 Cb -0.03 -0.64 0.09 0.00 0.35 0.00 0.00 41.96 41.73 2w2b s TYR 29 CO 0.03 -0.23 1.47 0.00 -1.34 0.00 0.00 175.55 175.48 2w2b s ALA 30 N 1.50 3.26 0.14 3.97 0.00 -0.88 -1.99 121.76 127.76 2w2b s ALA 30 Ca -0.02 -2.76 -0.13 0.00 0.00 0.00 0.00 51.96 49.04 2w2b s ALA 30 Cb -0.13 -4.40 -0.01 0.00 0.00 0.00 0.00 23.12 18.58 2w2b s ALA 30 CO -0.03 -3.24 1.55 -0.22 0.00 0.00 0.00 175.76 173.82 2w2b h LYS 31 N 8.45 0.83 0.00 0.00 3.64 -1.64 0.28 116.57 128.12 2w2b h LYS 31 Ca 0.29 -0.31 -0.02 0.00 -1.27 0.00 0.00 60.65 59.34 2w2b h LYS 31 Cb 0.94 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 32.71 2w2b h LYS 31 CO 1.34 0.93 0.02 0.27 -2.27 0.00 0.00 179.45 179.74 2w2b n ASN 32 N -4.31 -0.28 0.00 4.20 0.23 -1.12 -0.43 115.26 113.55 2w2b n ASN 32 Ca -0.00 -1.25 0.06 0.00 -0.53 0.00 0.00 54.58 52.86 2w2b n ASN 32 Cb 0.36 0.48 0.35 0.00 -2.08 0.00 0.00 39.78 38.89 2w2b n ASN 32 CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 2w2b n ASP 33 N -1.47 0.00 -0.21 0.53 3.85 -1.26 -3.05 116.55 114.95 2w2b n ASP 33 Ca -0.01 -0.06 0.00 0.00 -0.71 0.00 0.00 54.79 54.01 2w2b n ASP 33 Cb 0.09 -0.20 0.00 0.00 -1.35 0.00 0.00 41.12 39.66 2w2b n ASP 33 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2w2b n HIS 34 N -1.20 0.00 -3.79 2.11 1.44 -1.26 -4.03 115.22 108.49 2w2b n HIS 34 Ca 0.07 0.00 -0.13 0.00 -2.01 0.00 0.00 57.72 55.65 2w2b n HIS 34 Cb 0.08 0.01 -0.14 0.00 0.12 0.00 0.00 29.99 30.07 2w2b n HIS 34 CO 0.00 0.00 0.00 0.99 -2.81 0.00 0.00 176.34 174.52 2w2b s THR 35 N 0.00 -0.03 0.06 0.61 2.01 -1.17 -1.28 115.64 115.83 2w2b s THR 35 Ca 0.00 0.11 0.06 0.00 0.31 0.00 0.00 61.69 62.17 2w2b s THR 35 Cb 0.00 -0.17 -0.03 0.00 0.01 0.00 0.00 72.50 72.32 2w2b s THR 35 CO 0.00 0.05 -0.16 0.68 -0.69 0.00 0.00 174.62 174.50 2w2b s VAL 36 N 0.69 1.26 0.07 3.82 -7.23 0.20 -1.69 120.40 117.53 2w2b s VAL 36 Ca -0.05 -1.18 0.10 0.00 -1.81 0.00 0.00 61.98 59.04 2w2b s VAL 36 Cb -0.07 -1.15 -0.03 0.00 0.56 0.00 0.00 36.38 35.68 2w2b s VAL 36 CO -0.03 -0.04 -0.25 -1.81 -0.31 0.00 0.00 175.10 172.66 2w2b s ASP 37 N -1.40 3.33 0.17 4.85 1.01 -0.84 -1.59 116.67 122.19 2w2b s ASP 37 Ca 0.02 -0.62 -0.11 0.00 0.71 0.00 0.00 52.55 52.55 2w2b s ASP 37 Cb -0.09 -0.32 0.00 0.00 1.01 0.00 0.00 42.92 43.52 2w2b s ASP 37 CO 0.02 0.23 0.33 -0.72 0.21 0.00 0.00 175.17 175.24 2w2b s TYR 38 N -0.92 0.26 -0.21 4.23 1.13 -0.06 -0.53 117.35 121.25 2w2b s TYR 38 Ca 0.13 -0.62 -0.13 0.00 -1.41 0.00 0.00 57.07 55.04 2w2b s TYR 38 Cb -0.10 0.05 0.06 0.00 -1.10 0.00 0.00 41.96 40.87 2w2b s TYR 38 CO 0.04 -0.75 0.52 0.50 -2.51 0.00 0.00 175.55 173.35 2w2b s ARG 39 N -3.94 0.53 -0.19 -3.49 3.52 -0.03 -0.96 118.95 114.38 2w2b s ARG 39 Ca 0.14 0.92 -0.04 0.00 -0.13 0.00 0.00 55.73 56.63 2w2b s ARG 39 Cb 0.02 0.08 -0.02 0.00 -1.56 0.00 0.00 34.95 33.47 2w2b s ARG 39 CO -0.01 -0.14 -0.03 0.42 -0.81 0.00 0.00 175.30 174.72 2w2b s ILE 40 N 1.32 3.68 -0.09 4.11 -1.09 -0.09 -1.05 121.20 127.99 2w2b s ILE 40 Ca -0.08 -0.41 0.19 0.00 -2.23 0.00 0.00 60.65 58.12 2w2b s ILE 40 Cb -0.07 -2.65 -0.28 0.00 -1.58 0.00 0.00 42.46 37.88 2w2b s ILE 40 CO -0.13 0.44 0.29 1.41 -1.23 0.00 0.00 174.94 175.72 2w2b n HIS 41 N 4.27 0.00 -4.05 3.97 8.25 -0.23 -0.88 115.22 126.55 2w2b n HIS 41 Ca -0.18 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.20 2w2b n HIS 41 Cb 0.52 -0.65 -0.09 0.00 1.12 0.00 0.00 29.99 30.89 2w2b n HIS 41 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 2w2b s GLY 42 N -4.71 0.53 0.00 -1.41 0.00 -1.17 -4.73 107.32 95.82 2w2b s GLY 42 Ca -0.08 -1.14 0.00 0.00 0.00 0.00 0.00 44.72 43.50 2w2b s GLY 42 CO 0.81 -1.20 0.00 0.61 0.00 0.00 0.00 173.10 173.32 2w2b n GLY 43 N 0.00 -1.18 0.13 0.20 0.00 -1.26 -3.94 105.19 99.13 2w2b n GLY 43 Ca -0.12 -1.41 -0.02 0.00 0.00 0.00 0.00 46.02 44.48 2w2b n GLY 43 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2w2b n MET 44 N 0.00 -0.11 -1.14 1.61 2.00 -1.26 -2.08 117.12 116.14 2w2b n MET 44 Ca 0.00 0.48 0.00 0.00 0.00 0.00 0.00 57.70 58.18 2w2b n MET 44 Cb 0.00 -0.71 0.13 0.00 0.00 0.00 0.00 33.22 32.65 2w2b n MET 44 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 175.97 177.30 2w2b n VAL 45 N -4.42 1.79 -1.65 2.03 0.24 -1.26 -4.68 118.33 110.37 2w2b n VAL 45 Ca 0.02 -2.97 -0.50 0.00 -2.04 0.00 0.00 64.34 58.85 2w2b n VAL 45 Cb 0.10 -0.07 -0.05 0.00 -1.47 0.00 0.00 33.84 32.35 2w2b n VAL 45 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2w2b n ALA 46 N -0.71 0.31 0.00 2.33 0.00 -0.89 -1.41 120.51 120.15 2w2b n ALA 46 Ca 0.20 0.43 0.00 0.00 0.00 0.00 0.00 53.44 54.07 2w2b n ALA 46 Cb 0.83 -2.28 0.00 0.00 0.00 0.00 0.00 19.45 18.00 2w2b n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2w2b n GLY 47 N 3.47 2.22 3.75 0.00 0.00 -0.06 -4.96 105.19 109.61 2w2b n GLY 47 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 2w2b n GLY 47 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2w2b s ARG 48 N -0.23 4.27 0.03 1.61 3.52 -0.50 -4.33 118.95 123.31 2w2b s ARG 48 Ca 0.00 2.31 -0.11 0.00 -0.13 0.00 0.00 55.73 57.81 2w2b s ARG 48 Cb 0.00 -3.09 0.01 0.00 -1.56 0.00 0.00 34.95 30.31 2w2b s ARG 48 CO 0.00 -0.39 0.22 1.67 -0.81 0.00 0.00 175.30 175.99 2w2b s TRP 49 N -0.31 -0.01 -0.09 5.12 1.48 -1.01 -0.91 118.94 123.20 2w2b s TRP 49 Ca 0.57 -0.14 -0.06 0.00 -1.06 0.00 0.00 56.10 55.41 2w2b s TRP 49 Cb -0.42 0.01 0.04 0.00 -1.16 0.00 0.00 33.47 31.93 2w2b s TRP 49 CO 0.47 -0.42 0.22 0.08 -4.06 0.00 0.00 176.95 173.24 2w2b s VAL 50 N -2.25 -0.03 0.16 -0.66 1.01 -0.14 -2.08 120.40 116.42 2w2b s VAL 50 Ca -0.07 0.10 0.10 0.00 0.00 0.00 0.00 61.98 62.11 2w2b s VAL 50 Cb -0.02 -0.33 -0.04 0.00 0.00 0.00 0.00 36.38 35.98 2w2b s VAL 50 CO -0.02 0.04 -0.21 0.42 0.00 0.00 0.00 175.10 175.33 2w2b s THR 51 N 0.87 2.02 -1.40 3.92 -4.23 -1.26 -0.88 115.64 114.68 2w2b s THR 51 Ca -0.06 -1.88 -0.01 0.00 -1.18 0.00 0.00 61.69 58.56 2w2b s THR 51 Cb -0.08 -1.90 0.00 0.00 1.34 0.00 0.00 72.50 71.86 2w2b s THR 51 CO -0.05 -0.18 0.08 0.47 -0.54 0.00 0.00 174.62 174.40 2w2b n ASP 52 N 0.46 -4.99 -4.67 3.99 8.00 -1.20 -4.90 116.55 113.24 2w2b n ASP 52 Ca -0.14 -0.05 -0.43 0.00 0.71 0.00 0.00 54.79 54.88 2w2b n ASP 52 Cb 0.56 -4.05 -0.02 0.00 -0.02 0.00 0.00 41.12 37.59 2w2b n ASP 52 CO 0.00 0.00 0.00 -1.58 -0.39 0.00 0.00 177.20 175.23 2w2b s GLN 53 N -4.94 4.25 0.20 -1.24 2.00 -0.62 -4.86 119.66 114.45 2w2b s GLN 53 Ca 0.04 1.77 -0.30 0.00 -2.00 0.00 0.00 55.36 54.87 2w2b s GLN 53 Cb -0.02 -3.74 -0.08 0.00 0.80 0.00 0.00 33.01 29.97 2w2b s GLN 53 CO 0.05 -0.67 1.04 0.15 -0.50 0.00 0.00 175.29 175.37 2w2b s LYS 54 N 3.22 4.68 0.04 1.67 -0.14 -1.26 -0.63 119.74 127.32 2w2b s LYS 54 Ca 0.58 1.65 -0.13 0.00 -1.36 0.00 0.00 55.97 56.71 2w2b s LYS 54 Cb -0.25 -3.27 0.02 0.00 -1.68 0.00 0.00 37.83 32.64 2w2b s LYS 54 CO 0.19 0.22 0.28 0.00 -0.76 0.00 0.00 175.35 175.29 2w2b s ALA 55 N -0.61 -0.62 -0.14 5.17 0.00 -0.41 -4.63 121.76 120.52 2w2b s ALA 55 Ca 0.46 -0.04 -0.21 0.00 0.00 0.00 0.00 51.96 52.16 2w2b s ALA 55 Cb -0.28 0.31 -0.03 0.00 0.00 0.00 0.00 23.12 23.11 2w2b s ALA 55 CO 0.35 -0.40 0.64 0.34 0.00 0.00 0.00 175.76 176.69 2w2b s ASP 56 N -2.05 6.80 -0.13 0.00 2.15 -0.14 -4.37 116.67 118.93 2w2b s ASP 56 Ca -0.05 0.97 -0.00 0.00 0.43 0.00 0.00 52.55 53.89 2w2b s ASP 56 Cb -0.01 -2.36 0.02 0.00 -0.30 0.00 0.00 42.92 40.27 2w2b s ASP 56 CO -0.03 -0.18 -0.11 -0.63 -0.17 0.00 0.00 175.17 174.05 2w2b s ILE 57 N 1.33 1.30 0.12 4.11 1.01 -1.26 -1.13 121.20 126.69 2w2b s ILE 57 Ca 0.32 -0.48 0.05 0.00 0.00 0.00 0.00 60.65 60.53 2w2b s ILE 57 Cb -0.16 -1.28 -0.04 0.00 0.01 0.00 0.00 42.46 40.99 2w2b s ILE 57 CO 0.13 0.40 -0.11 0.68 0.00 0.00 0.00 174.94 176.03 2w2b s VAL 58 N 1.59 1.11 -0.24 2.92 -7.23 -0.56 -4.98 120.40 113.02 2w2b s VAL 58 Ca 0.05 -1.77 -0.18 0.00 -1.81 0.00 0.00 61.98 58.27 2w2b s VAL 58 Cb -0.13 -1.54 -0.03 0.00 0.56 0.00 0.00 36.38 35.25 2w2b s VAL 58 CO -0.09 -0.57 0.51 -0.32 -0.31 0.00 0.00 175.10 174.31 2w2b s MET 59 N -3.01 4.10 0.07 4.82 1.75 -1.26 -0.92 119.30 124.86 2w2b s MET 59 Ca 0.09 0.33 -0.16 0.00 -1.25 0.00 0.00 55.69 54.70 2w2b s MET 59 Cb -0.02 -3.62 -0.13 0.00 2.84 0.00 0.00 34.83 33.89 2w2b s MET 59 CO 0.01 -0.29 1.32 -0.07 -0.65 0.00 0.00 175.02 175.35 2w2b h LEU 60 N 8.52 0.70 -7.63 4.11 3.38 -1.11 -3.48 115.31 119.80 2w2b h LEU 60 Ca -0.30 -0.56 0.17 0.00 0.09 0.00 0.00 57.88 57.27 2w2b h LEU 60 Cb 1.15 -0.20 -0.08 0.00 0.09 0.00 0.00 40.66 41.61 2w2b h LEU 60 CO 0.72 1.13 0.47 0.28 0.09 0.00 0.00 178.44 181.14 2w2b s THR 61 N -4.00 0.00 -0.41 0.22 -1.32 -1.22 -5.04 115.64 103.86 2w2b s THR 61 Ca -0.12 -0.63 -0.43 0.00 -1.21 0.00 0.00 61.69 59.29 2w2b s THR 61 Cb 0.07 -1.93 -0.18 0.00 -1.51 0.00 0.00 72.50 68.96 2w2b s THR 61 CO 0.83 0.00 1.77 1.21 -2.21 0.00 0.00 174.62 176.23 2w2b n GLU 62 N -0.46 0.48 -1.00 7.08 2.13 -1.26 -0.83 120.64 126.77 2w2b n GLU 62 Ca -0.06 0.17 -0.00 0.00 0.66 0.00 0.00 57.16 57.93 2w2b n GLU 62 Cb 0.61 -1.78 -0.00 0.00 0.27 0.00 0.00 31.44 30.54 2w2b n GLU 62 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2w2b n GLY 63 N 4.77 0.42 3.04 8.31 0.00 -1.18 -4.94 105.19 115.60 2w2b n GLY 63 Ca 0.34 -0.03 -0.27 0.00 0.00 0.00 0.00 46.02 46.05 2w2b n GLY 63 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2w2b s ILE 64 N -1.83 1.36 -0.02 -0.61 -1.09 -0.01 -4.18 121.20 114.82 2w2b s ILE 64 Ca 0.00 -0.57 0.04 0.00 -2.23 0.00 0.00 60.65 57.89 2w2b s ILE 64 Cb 0.00 -1.25 -0.01 0.00 -1.58 0.00 0.00 42.46 39.62 2w2b s ILE 64 CO 0.00 0.41 -0.14 -0.31 -1.23 0.00 0.00 174.94 173.67 2w2b s TYR 65 N 0.93 1.36 -0.08 3.97 1.51 -0.76 -0.44 117.35 123.84 2w2b s TYR 65 Ca -0.08 -0.31 0.04 0.00 -1.01 0.00 0.00 57.07 55.71 2w2b s TYR 65 Cb -0.15 -0.90 0.00 0.00 -0.11 0.00 0.00 41.96 40.80 2w2b s TYR 65 CO -0.00 -0.07 -0.22 0.21 -1.11 0.00 0.00 175.55 174.36 2w2b s LYS 66 N -0.15 2.68 -0.09 -0.62 2.20 -0.10 -0.33 119.74 123.35 2w2b s LYS 66 Ca 0.02 -0.80 0.03 0.00 -0.36 0.00 0.00 55.97 54.86 2w2b s LYS 66 Cb -0.08 -2.09 0.01 0.00 -1.51 0.00 0.00 37.83 34.16 2w2b s LYS 66 CO 0.00 0.19 -0.18 0.42 -0.36 0.00 0.00 175.35 175.42 2w2b s ILE 67 N 0.29 1.62 -0.07 5.43 1.09 0.72 -1.50 121.20 128.78 2w2b s ILE 67 Ca -0.15 -0.76 0.04 0.00 -1.10 0.00 0.00 60.65 58.68 2w2b s ILE 67 Cb -0.17 -1.43 0.00 0.00 -1.06 0.00 0.00 42.46 39.80 2w2b s ILE 67 CO 0.07 0.46 -0.19 -0.44 -0.10 0.00 0.00 174.94 174.74 2w2b s SER 68 N 0.56 2.50 0.18 3.58 0.01 -0.28 -0.51 113.70 119.74 2w2b s SER 68 Ca -0.15 -0.43 -0.17 0.00 1.31 0.00 0.00 55.95 56.51 2w2b s SER 68 Cb -0.17 -1.00 0.03 0.00 0.21 0.00 0.00 66.02 65.09 2w2b s SER 68 CO 0.05 0.13 0.48 -1.66 0.41 0.00 0.00 173.24 172.66 2w2b s TRP 69 N 0.31 -0.09 0.06 2.43 -2.14 -0.64 -0.96 118.94 117.91 2w2b s TRP 69 Ca -0.13 -0.25 0.06 0.00 2.66 0.00 0.00 56.10 58.45 2w2b s TRP 69 Cb -0.15 0.33 -0.03 0.00 -3.10 0.00 0.00 33.47 30.52 2w2b s TRP 69 CO 0.05 -0.86 -0.17 -0.08 -2.66 0.00 0.00 176.95 173.23 2w2b s THR 70 N -3.87 1.34 0.25 0.66 -1.32 -1.26 -0.77 115.64 110.67 2w2b s THR 70 Ca 0.09 -1.24 0.08 0.00 -1.21 0.00 0.00 61.69 59.41 2w2b s THR 70 Cb -0.00 -1.22 -0.04 0.00 -1.51 0.00 0.00 72.50 69.73 2w2b s THR 70 CO -0.04 -0.04 0.13 -1.61 -2.21 0.00 0.00 174.62 170.85 2w2b s GLU 71 N -1.48 2.73 0.64 7.08 2.02 0.37 -4.95 118.70 125.11 2w2b s GLU 71 Ca 0.03 -1.16 0.33 0.00 0.02 0.00 0.00 54.97 54.18 2w2b s GLU 71 Cb -0.09 -2.44 1.79 0.00 0.10 0.00 0.00 34.13 33.49 2w2b s GLU 71 CO 0.02 0.39 2.06 -1.35 0.02 0.00 0.00 175.26 176.40 2w2b h PRO 72 N 1.65 0.00 0.00 0.39 0.11 -1.95 0.11 132.00 132.32 2w2b h PRO 72 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2w2b h PRO 72 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2w2b h PRO 72 CO 0.61 0.00 -0.15 1.79 -0.21 0.00 0.00 178.00 180.04 2w2b h THR 73 N 0.00 0.00 0.00 -1.15 1.35 -1.93 -3.20 112.91 107.98 2w2b h THR 73 Ca 0.04 -0.57 0.00 0.00 -0.55 0.00 0.00 66.41 65.33 2w2b h THR 73 Cb 0.53 1.48 0.00 0.00 -1.73 0.00 0.00 68.15 68.44 2w2b h THR 73 CO -0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 2w2b n GLY 74 N 1.28 0.91 3.75 5.82 0.00 0.40 -4.65 105.19 112.69 2w2b n GLY 74 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 2w2b n GLY 74 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2w2b s THR 75 N -2.21 2.18 -0.07 2.61 2.01 -1.26 -4.65 115.64 114.25 2w2b s THR 75 Ca 0.00 0.15 -0.02 0.00 0.31 0.00 0.00 61.69 62.13 2w2b s THR 75 Cb 0.00 -3.10 -0.03 0.00 0.01 0.00 0.00 72.50 69.38 2w2b s THR 75 CO 0.00 0.03 0.03 -1.81 -0.69 0.00 0.00 174.62 172.18 2w2b s ASP 76 N 0.44 5.45 -0.03 3.53 1.01 -0.81 -0.48 116.67 125.77 2w2b s ASP 76 Ca 0.62 0.18 0.02 0.00 0.71 0.00 0.00 52.55 54.08 2w2b s ASP 76 Cb -0.47 -1.57 0.01 0.00 1.01 0.00 0.00 42.92 41.91 2w2b s ASP 76 CO 0.48 0.36 -0.06 -0.69 0.21 0.00 0.00 175.17 175.47 2w2b s VAL 77 N -0.96 0.60 -0.22 -1.27 1.01 0.05 -0.37 120.40 119.23 2w2b s VAL 77 Ca 0.15 -0.21 -0.00 0.00 0.00 0.00 0.00 61.98 61.92 2w2b s VAL 77 Cb -0.12 -0.58 0.06 0.00 0.00 0.00 0.00 36.38 35.75 2w2b s VAL 77 CO 0.05 0.22 -0.03 0.00 0.00 0.00 0.00 175.10 175.34 2w2b s ALA 78 N 0.57 1.65 -0.10 5.51 0.00 -0.34 -1.61 121.76 127.43 2w2b s ALA 78 Ca -0.08 -1.13 -0.00 0.00 0.00 0.00 0.00 51.96 50.75 2w2b s ALA 78 Cb -0.11 -1.34 -0.03 0.00 0.00 0.00 0.00 23.12 21.64 2w2b s ALA 78 CO 0.00 -1.16 -0.08 -0.51 0.00 0.00 0.00 175.76 174.01 2w2b s LEU 79 N 1.55 3.06 -0.15 0.00 1.43 0.33 -0.79 118.68 124.11 2w2b s LEU 79 Ca -0.04 -0.12 0.01 0.00 -1.03 0.00 0.00 54.13 52.95 2w2b s LEU 79 Cb -0.18 -1.68 0.02 0.00 0.03 0.00 0.00 46.19 44.37 2w2b s LEU 79 CO -0.07 0.28 -0.17 -1.81 0.23 0.00 0.00 176.35 174.80 2w2b s ASP 80 N -0.29 2.86 -0.16 2.29 1.11 0.80 -0.20 116.67 123.08 2w2b s ASP 80 Ca 0.04 -0.55 -0.06 0.00 0.18 0.00 0.00 52.55 52.16 2w2b s ASP 80 Cb -0.13 -1.30 -0.04 0.00 1.07 0.00 0.00 42.92 42.52 2w2b s ASP 80 CO 0.02 -0.01 0.05 -0.36 1.18 0.00 0.00 175.17 176.05 2w2b s PHE 81 N 1.24 3.24 -0.61 4.23 0.40 0.56 -0.33 117.98 126.71 2w2b s PHE 81 Ca 0.01 0.08 0.06 0.00 -0.60 0.00 0.00 56.93 56.49 2w2b s PHE 81 Cb -0.14 -2.00 0.25 0.00 0.51 0.00 0.00 43.02 41.64 2w2b s PHE 81 CO -0.09 0.23 0.71 -1.33 0.70 0.00 0.00 175.22 175.44 2w2b n MET 82 N 3.17 2.27 0.24 0.44 2.81 0.30 -1.83 117.12 124.52 2w2b n MET 82 Ca -0.17 -4.48 0.09 0.00 -1.81 0.00 0.00 57.70 51.32 2w2b n MET 82 Cb 0.53 -2.13 0.58 0.00 -0.71 0.00 0.00 33.22 31.49 2w2b n MET 82 CO 0.00 0.00 0.00 -1.00 1.51 0.00 0.00 175.97 176.48 2w2b h PRO 83 N 4.21 0.00 0.00 0.03 0.13 -1.73 -1.04 132.00 133.60 2w2b h PRO 83 Ca 0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 2w2b h PRO 83 Cb 0.69 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.82 2w2b h PRO 83 CO 0.78 0.19 0.00 -0.91 -0.23 0.00 0.00 178.00 177.84 2w2b h ASN 84 N 0.00 0.00 -0.19 1.44 2.35 -1.91 -2.16 115.58 115.11 2w2b h ASN 84 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2w2b h ASN 84 Cb 0.43 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.80 2w2b h ASN 84 CO 0.03 0.00 0.00 -0.62 -1.65 0.00 0.00 177.43 175.19 2w2b n GLU 85 N -2.86 2.28 -3.96 0.81 1.02 -0.43 -4.98 120.64 112.51 2w2b n GLU 85 Ca -0.01 -1.68 -0.30 0.00 -0.02 0.00 0.00 57.16 55.15 2w2b n GLU 85 Cb 0.18 -1.18 0.01 0.00 -0.02 0.00 0.00 31.44 30.43 2w2b n GLU 85 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2w2b n LYS 86 N 0.26 -4.93 -4.24 3.49 5.02 -0.81 -4.95 118.16 112.00 2w2b n LYS 86 Ca 0.07 0.55 -0.20 0.00 -2.02 0.00 0.00 58.31 56.71 2w2b n LYS 86 Cb 0.33 -5.34 -0.12 0.00 -0.02 0.00 0.00 35.03 29.88 2w2b n LYS 86 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2w2b s LYS 87 N -6.63 0.90 0.02 1.97 -0.14 -1.01 -0.88 119.74 113.97 2w2b s LYS 87 Ca 0.59 -0.95 0.02 0.00 -1.36 0.00 0.00 55.97 54.28 2w2b s LYS 87 Cb -0.30 -0.96 -0.01 0.00 -1.68 0.00 0.00 37.83 34.88 2w2b s LYS 87 CO 0.85 0.22 -0.07 -1.17 -0.76 0.00 0.00 175.35 174.42 2w2b s LEU 88 N -1.63 2.13 -0.12 3.17 0.20 -0.55 -0.53 118.68 121.35 2w2b s LEU 88 Ca 0.00 -0.32 0.01 0.00 0.69 0.00 0.00 54.13 54.51 2w2b s LEU 88 Cb -0.10 -0.23 0.02 0.00 -0.43 0.00 0.00 46.19 45.45 2w2b s LEU 88 CO 0.02 -0.06 -0.14 -2.28 -0.29 0.00 0.00 176.35 173.60 2w2b s HIS 89 N -0.75 1.96 -0.06 5.38 5.65 0.56 -0.61 115.29 127.42 2w2b s HIS 89 Ca -0.04 -0.97 0.05 0.00 0.25 0.00 0.00 55.06 54.35 2w2b s HIS 89 Cb -0.06 -1.44 -0.01 0.00 -1.18 0.00 0.00 32.58 29.89 2w2b s HIS 89 CO 0.00 -0.52 -0.22 0.20 -0.65 0.00 0.00 174.74 173.55 2w2b s GLY 90 N 1.16 1.36 -0.19 1.59 0.00 -0.20 -0.14 107.32 110.90 2w2b s GLY 90 Ca -0.03 -1.02 -0.02 0.00 0.00 0.00 0.00 44.72 43.65 2w2b s GLY 90 CO -0.04 -0.62 -0.10 -1.59 0.00 0.00 0.00 173.10 170.75 2w2b s THR 91 N -0.20 2.97 -0.16 0.90 2.01 0.03 -1.04 115.64 120.16 2w2b s THR 91 Ca -0.02 -0.65 -0.02 0.00 0.31 0.00 0.00 61.69 61.32 2w2b s THR 91 Cb -0.13 -2.30 -0.02 0.00 0.01 0.00 0.00 72.50 70.06 2w2b s THR 91 CO 0.03 0.48 -0.09 -0.63 -0.69 0.00 0.00 174.62 173.72 2w2b s ILE 92 N 1.15 3.33 -0.54 1.82 1.01 -0.55 -1.20 121.20 126.23 2w2b s ILE 92 Ca 0.01 -0.55 -0.09 0.00 0.00 0.00 0.00 60.65 60.02 2w2b s ILE 92 Cb -0.14 -2.44 0.14 0.00 0.01 0.00 0.00 42.46 40.02 2w2b s ILE 92 CO -0.03 0.49 0.41 -0.36 0.00 0.00 0.00 174.94 175.46 2w2b s PHE 93 N 0.60 3.46 0.01 3.97 0.40 0.50 -0.81 117.98 126.11 2w2b s PHE 93 Ca -0.05 -2.00 -0.24 0.00 -0.60 0.00 0.00 56.93 54.04 2w2b s PHE 93 Cb -0.15 -3.50 -0.05 0.00 0.51 0.00 0.00 43.02 39.82 2w2b s PHE 93 CO 0.03 -0.97 0.71 -0.06 0.70 0.00 0.00 175.22 175.63 2w2b s PHE 94 N 1.02 3.69 0.70 0.36 0.08 0.33 -1.93 117.98 122.23 2w2b s PHE 94 Ca 0.09 1.37 -0.16 0.00 0.12 0.00 0.00 56.93 58.34 2w2b s PHE 94 Cb -0.24 -2.77 0.02 0.00 -0.57 0.00 0.00 43.02 39.47 2w2b s PHE 94 CO -0.02 0.26 1.23 -2.14 -0.10 0.00 0.00 175.22 174.45 2w2b s PRO 95 N 0.08 2.28 0.29 0.24 0.02 -1.26 -1.13 135.00 135.52 2w2b s PRO 95 Ca 0.37 1.85 0.03 0.00 0.02 0.00 0.00 61.00 63.27 2w2b s PRO 95 Cb -0.19 -1.84 0.69 0.00 0.02 0.00 0.00 34.50 33.18 2w2b s PRO 95 CO 0.21 -1.75 1.71 -0.22 -0.33 0.00 0.00 177.00 176.62 2w2b h LYS 96 N -0.01 0.43 0.00 5.54 1.63 -1.06 -1.54 116.57 121.57 2w2b h LYS 96 Ca -0.49 -0.03 -0.03 0.00 -0.85 0.00 0.00 60.65 59.25 2w2b h LYS 96 Cb 1.31 -0.10 -0.00 0.00 -0.60 0.00 0.00 32.23 32.84 2w2b h LYS 96 CO 0.51 0.29 -0.16 0.11 -3.45 0.00 0.00 179.45 176.75 2w2b h TRP 97 N 0.45 0.00 -0.11 1.91 5.08 -1.42 -0.69 115.95 121.17 2w2b h TRP 97 Ca 0.54 0.00 -0.19 0.00 1.08 0.00 0.00 58.89 60.33 2w2b h TRP 97 Cb 0.98 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.14 2w2b h TRP 97 CO -0.13 0.16 -0.70 0.28 -1.28 0.00 0.00 178.44 176.77 2w2b h VAL 98 N 0.00 1.35 -0.72 0.12 2.07 -1.57 0.21 116.25 117.71 2w2b h VAL 98 Ca -0.00 -2.05 -0.07 0.00 0.82 0.00 0.00 66.70 65.40 2w2b h VAL 98 Cb 0.29 2.03 -0.03 0.00 -1.52 0.00 0.00 31.29 32.05 2w2b h VAL 98 CO 0.02 0.62 0.17 -0.08 0.02 0.00 0.00 177.57 178.33 2w2b h GLU 99 N 0.35 1.15 -0.10 1.57 4.81 -1.24 -1.73 114.58 119.39 2w2b h GLU 99 Ca -0.03 -0.28 -0.18 0.00 -0.13 0.00 0.00 59.36 58.74 2w2b h GLU 99 Cb 1.28 -0.15 0.01 0.00 0.63 0.00 0.00 28.75 30.52 2w2b h GLU 99 CO 0.13 1.01 -0.66 1.49 -0.73 0.00 0.00 179.01 180.24 2w2b h GLU 100 N 1.09 0.62 -2.16 1.92 4.57 -0.96 -3.38 114.58 116.27 2w2b h GLU 100 Ca 0.22 -0.54 -0.54 0.00 -1.18 0.00 0.00 59.36 57.32 2w2b h GLU 100 Cb 0.38 0.12 -0.41 0.00 -0.16 0.00 0.00 28.75 28.68 2w2b h GLU 100 CO 0.00 1.15 -0.88 0.72 -1.18 0.00 0.00 179.01 178.83 2w2b n HIS 101 N -4.10 2.32 0.26 0.92 8.25 0.72 -4.94 115.22 118.65 2w2b n HIS 101 Ca -0.08 -3.92 0.10 0.00 -0.26 0.00 0.00 57.72 53.55 2w2b n HIS 101 Cb 0.69 -0.46 0.68 0.00 1.12 0.00 0.00 29.99 32.01 2w2b n HIS 101 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2w2b h PRO 102 N 3.07 0.00 -0.05 -0.41 0.13 -1.51 -2.48 132.00 130.76 2w2b h PRO 102 Ca 0.12 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 65.26 2w2b h PRO 102 Cb 0.71 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.84 2w2b h PRO 102 CO 0.68 0.09 0.05 1.05 -0.23 0.00 0.00 178.00 179.63 2w2b h GLU 103 N 0.00 0.00 -0.42 0.86 9.09 -1.86 -0.42 114.58 121.83 2w2b h GLU 103 Ca -0.00 0.00 0.02 0.00 0.05 0.00 0.00 59.36 59.43 2w2b h GLU 103 Cb 0.18 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.25 2w2b h GLU 103 CO 0.01 0.00 0.28 0.82 0.05 0.00 0.00 179.01 180.17 2w2b h ILE 104 N 0.00 1.06 -0.00 -1.06 2.04 -1.84 -1.74 117.51 115.96 2w2b h ILE 104 Ca 0.02 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 65.71 2w2b h ILE 104 Cb 0.12 0.52 0.00 0.00 -0.74 0.00 0.00 36.82 36.71 2w2b h ILE 104 CO -0.00 0.09 -0.22 0.35 0.00 0.00 0.00 178.15 178.37 2w2b n THR 105 N -4.48 0.00 -2.73 -0.27 -2.24 -0.17 -4.67 114.28 99.72 2w2b n THR 105 Ca 0.04 -0.06 -0.42 0.00 -2.27 0.00 0.00 64.05 61.34 2w2b n THR 105 Cb 0.12 0.05 -0.03 0.00 -2.10 0.00 0.00 70.33 68.38 2w2b n THR 105 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2w2b s VAL 106 N -2.65 4.28 0.09 2.28 1.01 -0.66 -4.67 120.40 120.07 2w2b s VAL 106 Ca 0.22 -1.05 -0.26 0.00 0.00 0.00 0.00 61.98 60.89 2w2b s VAL 106 Cb 0.19 -4.92 0.09 0.00 0.00 0.00 0.00 36.38 31.74 2w2b s VAL 106 CO 0.54 -1.73 1.13 0.28 0.00 0.00 0.00 175.10 175.32 2w2b s THR 107 N 3.99 0.00 -0.68 3.92 -1.32 -1.26 -4.82 115.64 115.47 2w2b s THR 107 Ca 0.39 -0.44 -0.27 0.00 -1.21 0.00 0.00 61.69 60.16 2w2b s THR 107 Cb -0.03 -2.35 0.01 0.00 -1.51 0.00 0.00 72.50 68.62 2w2b s THR 107 CO -0.08 0.00 1.45 -0.47 -2.21 0.00 0.00 174.62 173.31 2w2b s TYR 108 N -2.56 2.13 0.45 9.09 5.04 -1.26 -2.41 117.35 127.82 2w2b s TYR 108 Ca 0.18 0.25 0.13 0.00 -2.44 0.00 0.00 57.07 55.19 2w2b s TYR 108 Cb 0.00 -4.45 1.05 0.00 0.35 0.00 0.00 41.96 38.91 2w2b s TYR 108 CO 0.01 -2.11 2.03 0.37 -1.34 0.00 0.00 175.55 174.50 2w2b h GLN 109 N 11.44 0.34 -0.08 4.97 4.15 -1.75 -2.38 115.11 131.81 2w2b h GLN 109 Ca -0.27 -0.02 0.02 0.00 0.77 0.00 0.00 58.65 59.15 2w2b h GLN 109 Cb 1.09 -0.08 -0.00 0.00 0.21 0.00 0.00 27.48 28.69 2w2b h GLN 109 CO 1.25 0.23 0.09 -0.91 -1.93 0.00 0.00 178.83 177.56 2w2b h ASN 110 N 0.35 0.00 -0.11 -0.69 4.21 -1.90 0.72 115.58 118.16 2w2b h ASN 110 Ca 0.20 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.71 2w2b h ASN 110 Cb 0.34 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.54 2w2b h ASN 110 CO -0.05 0.00 0.00 -0.62 -1.29 0.00 0.00 177.43 175.47 2w2b n GLU 111 N -3.86 1.90 -1.91 0.81 1.02 -0.89 -4.37 120.64 113.34 2w2b n GLU 111 Ca -0.01 -1.34 0.02 0.00 -0.02 0.00 0.00 57.16 55.81 2w2b n GLU 111 Cb 0.19 -1.45 0.03 0.00 -0.02 0.00 0.00 31.44 30.18 2w2b n GLU 111 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 2w2b n HIS 112 N 0.59 0.30 -0.06 -0.32 8.25 0.22 -4.93 115.22 119.26 2w2b n HIS 112 Ca 0.17 -1.04 -0.08 0.00 -0.26 0.00 0.00 57.72 56.51 2w2b n HIS 112 Cb 0.42 -0.06 -0.01 0.00 1.12 0.00 0.00 29.99 31.46 2w2b n HIS 112 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 2w2b h ILE 113 N 6.31 0.94 -0.78 1.59 1.08 -1.68 -2.36 117.51 122.61 2w2b h ILE 113 Ca -0.24 -0.07 0.08 0.00 -0.39 0.00 0.00 64.86 64.24 2w2b h ILE 113 Cb 1.65 0.71 -0.07 0.00 -3.07 0.00 0.00 36.82 36.04 2w2b h ILE 113 CO 0.08 0.04 0.44 0.44 -0.69 0.00 0.00 178.15 178.46 2w2b h ASP 114 N 0.21 0.63 -0.80 1.72 3.32 -1.91 -1.37 116.42 118.22 2w2b h ASP 114 Ca 0.11 0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.19 2w2b h ASP 114 Cb 0.07 -0.08 -0.04 0.00 0.22 0.00 0.00 39.33 39.51 2w2b h ASP 114 CO -0.11 0.38 0.45 0.25 -1.72 0.00 0.00 179.24 178.48 2w2b h LEU 115 N 0.76 1.00 -0.38 1.55 5.85 -1.86 0.10 115.31 122.32 2w2b h LEU 115 Ca 0.37 -0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.98 2w2b h LEU 115 Cb 0.31 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 2w2b h LEU 115 CO -0.23 0.80 0.17 0.24 -0.34 0.00 0.00 178.44 179.08 2w2b h MET 116 N 1.11 0.56 -0.63 1.25 2.86 -0.85 -1.06 114.93 118.18 2w2b h MET 116 Ca 0.28 -0.09 -0.09 0.00 -2.06 0.00 0.00 59.70 57.74 2w2b h MET 116 Cb 0.02 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 31.56 2w2b h MET 116 CO -0.05 0.52 0.03 0.93 1.06 0.00 0.00 176.91 179.40 2w2b h GLU 117 N 0.48 1.10 -0.58 1.72 5.08 -0.99 -1.62 114.58 119.76 2w2b h GLU 117 Ca 0.13 -0.33 -0.02 0.00 -1.00 0.00 0.00 59.36 58.14 2w2b h GLU 117 Cb 0.15 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.27 2w2b h GLU 117 CO -0.01 1.05 0.29 1.96 -1.00 0.00 0.00 179.01 181.30 2w2b h GLN 118 N 1.01 0.82 -0.61 2.33 4.20 -0.69 -3.01 115.11 119.16 2w2b h GLN 118 Ca 0.18 -0.11 -0.07 0.00 0.06 0.00 0.00 58.65 58.72 2w2b h GLN 118 Cb 0.53 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 28.14 2w2b h GLN 118 CO 0.03 0.65 0.12 0.77 -0.67 0.00 0.00 178.83 179.73 2w2b h SER 119 N 0.78 0.94 0.68 1.46 0.02 -0.96 -1.58 113.55 114.90 2w2b h SER 119 Ca 0.20 -0.25 -0.02 0.00 -0.84 0.00 0.00 61.79 60.88 2w2b h SER 119 Cb 0.09 -0.25 -0.00 0.00 0.14 0.00 0.00 62.40 62.38 2w2b h SER 119 CO -0.03 0.95 -0.11 0.08 -1.14 0.00 0.00 176.83 176.58 2w2b h ARG 120 N 0.90 0.00 0.04 3.45 0.11 -1.21 -1.04 114.38 116.62 2w2b h ARG 120 Ca 0.19 0.00 -0.31 0.00 0.10 0.00 0.00 59.98 59.96 2w2b h ARG 120 Cb 0.39 0.00 -0.04 0.00 1.11 0.00 0.00 29.97 31.43 2w2b h ARG 120 CO 0.01 0.11 -1.74 0.93 0.10 0.00 0.00 179.97 179.39 2w2b h GLU 121 N 0.00 0.08 -0.00 0.08 4.39 -1.39 -3.40 114.58 114.33 2w2b h GLU 121 Ca -0.00 -0.13 -0.17 0.00 0.34 0.00 0.00 59.36 59.40 2w2b h GLU 121 Cb 0.49 0.05 0.01 0.00 -0.10 0.00 0.00 28.75 29.20 2w2b h GLU 121 CO 0.01 0.72 -0.66 -0.22 -1.16 0.00 0.00 179.01 177.70 2w2b h LYS 122 N 0.02 0.45 -6.69 2.33 3.64 -0.92 -3.47 116.57 111.92 2w2b h LYS 122 Ca -0.30 -0.48 -0.48 0.00 -1.27 0.00 0.00 60.65 58.12 2w2b h LYS 122 Cb 2.01 0.14 0.04 0.00 -0.41 0.00 0.00 32.23 34.00 2w2b h LYS 122 CO 0.09 1.13 -0.09 0.71 -2.27 0.00 0.00 179.45 179.03 2w2b s TYR 123 N -3.22 1.65 0.41 1.91 2.02 -0.43 -5.08 117.35 114.62 2w2b s TYR 123 Ca -0.13 -0.60 -0.25 0.00 -0.37 0.00 0.00 57.07 55.73 2w2b s TYR 123 Cb 0.04 -2.36 -0.08 0.00 -0.40 0.00 0.00 41.96 39.15 2w2b s TYR 123 CO 0.84 -1.14 1.16 0.00 -1.57 0.00 0.00 175.55 174.84 2w2b s ALA 124 N -2.70 3.11 -0.20 3.71 0.00 -1.26 -4.88 121.76 119.54 2w2b s ALA 124 Ca 0.62 0.94 0.14 0.00 0.00 0.00 0.00 51.96 53.66 2w2b s ALA 124 Cb -0.06 -3.37 -0.22 0.00 0.00 0.00 0.00 23.12 19.46 2w2b s ALA 124 CO 0.39 -0.54 0.01 2.41 0.00 0.00 0.00 175.76 178.03 2w2b n THR 125 N -0.07 1.33 -4.46 0.00 -1.04 -1.26 -1.19 114.28 107.59 2w2b n THR 125 Ca 0.05 -0.76 -0.29 0.00 -2.04 0.00 0.00 64.05 61.01 2w2b n THR 125 Cb 0.47 -0.66 -0.13 0.00 -1.82 0.00 0.00 70.33 68.19 2w2b n THR 125 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 2w2b s TYR 126 N -2.47 2.33 0.43 -1.42 2.02 -1.26 -0.83 117.35 116.15 2w2b s TYR 126 Ca -0.14 -0.37 -0.22 0.00 -0.37 0.00 0.00 57.07 55.97 2w2b s TYR 126 Cb 0.06 -1.28 -0.09 0.00 -0.40 0.00 0.00 41.96 40.25 2w2b s TYR 126 CO 0.74 0.31 1.01 -1.25 -1.57 0.00 0.00 175.55 174.79 2w2b s PRO 127 N -1.94 4.11 0.50 -1.71 0.04 -1.26 -4.80 135.00 129.93 2w2b s PRO 127 Ca 0.14 1.33 -0.21 0.00 0.04 0.00 0.00 61.00 62.30 2w2b s PRO 127 Cb -0.10 -2.32 -0.07 0.00 0.04 0.00 0.00 34.50 32.05 2w2b s PRO 127 CO 0.06 -0.16 1.14 0.15 0.04 0.00 0.00 177.00 178.23 2w2b s LYS 128 N -2.89 3.59 -0.37 4.56 -0.14 -1.25 -3.76 119.74 119.48 2w2b s LYS 128 Ca 0.61 1.67 -0.16 0.00 -1.36 0.00 0.00 55.97 56.73 2w2b s LYS 128 Cb -0.16 -2.21 0.00 0.00 -1.68 0.00 0.00 37.83 33.78 2w2b s LYS 128 CO 0.20 -0.66 0.40 -1.17 -0.76 0.00 0.00 175.35 173.37 2w2b s LEU 129 N -3.39 4.57 -0.22 3.17 2.96 -0.28 -4.94 118.68 120.55 2w2b s LEU 129 Ca 0.68 -0.36 -0.07 0.00 -0.22 0.00 0.00 54.13 54.16 2w2b s LEU 129 Cb -0.25 -2.38 -0.03 0.00 0.50 0.00 0.00 46.19 44.02 2w2b s LEU 129 CO 0.30 -0.44 0.07 -0.69 -1.32 0.00 0.00 176.35 174.27 2w2b s VAL 130 N 2.10 4.51 -0.47 1.68 1.01 -1.26 -0.51 120.40 127.46 2w2b s VAL 130 Ca 0.13 -0.12 0.03 0.00 0.00 0.00 0.00 61.98 62.02 2w2b s VAL 130 Cb -0.17 -3.07 0.13 0.00 0.00 0.00 0.00 36.38 33.27 2w2b s VAL 130 CO 0.12 0.39 0.23 -0.69 0.00 0.00 0.00 175.10 175.15 2w2b s VAL 131 N 1.06 2.07 -0.42 2.92 1.01 0.01 -4.98 120.40 122.07 2w2b s VAL 131 Ca 0.04 -2.90 -0.15 0.00 0.00 0.00 0.00 61.98 58.98 2w2b s VAL 131 Cb -0.14 -2.45 0.03 0.00 0.00 0.00 0.00 36.38 33.82 2w2b s VAL 131 CO 0.03 -0.81 0.32 -2.16 0.00 0.00 0.00 175.10 172.47 2w2b s PRO 132 N 0.11 2.96 0.04 2.72 0.04 -1.26 -1.48 135.00 138.13 2w2b s PRO 132 Ca 0.16 -1.10 -0.12 0.00 0.04 0.00 0.00 61.00 59.98 2w2b s PRO 132 Cb -0.25 -4.00 0.01 0.00 0.04 0.00 0.00 34.50 30.31 2w2b s PRO 132 CO -0.01 -0.81 0.25 -1.83 0.04 0.00 0.00 177.00 174.64 2w2b s GLU 133 N 1.66 0.75 0.46 4.56 -1.05 -0.20 -4.99 118.70 119.88 2w2b s GLU 133 Ca 0.05 -0.54 -0.20 0.00 -0.15 0.00 0.00 54.97 54.13 2w2b s GLU 133 Cb -0.20 0.32 -0.10 0.00 -0.44 0.00 0.00 34.13 33.71 2w2b s GLU 133 CO 0.09 -0.23 0.96 -0.06 0.95 0.00 0.00 175.26 176.97 2w2b s PHE 134 N -2.49 3.35 0.06 4.83 0.08 -1.26 -1.04 117.98 121.51 2w2b s PHE 134 Ca -0.05 1.57 0.03 0.00 0.12 0.00 0.00 56.93 58.59 2w2b s PHE 134 Cb -0.01 -2.84 -0.03 0.00 -0.57 0.00 0.00 43.02 39.57 2w2b s PHE 134 CO -0.03 -0.21 -0.09 0.00 -0.10 0.00 0.00 175.22 174.79 2w2b s ALA 135 N -2.31 0.77 -0.15 5.36 0.00 0.22 -4.36 121.76 121.29 2w2b s ALA 135 Ca 0.61 -0.93 -0.17 0.00 0.00 0.00 0.00 51.96 51.47 2w2b s ALA 135 Cb -0.09 0.04 -0.04 0.00 0.00 0.00 0.00 23.12 23.02 2w2b s ALA 135 CO 0.19 -0.03 0.42 -0.80 0.00 0.00 0.00 175.76 175.53 2w2b s ASN 136 N -1.92 6.56 -0.16 0.00 0.01 -0.18 -1.48 114.94 117.77 2w2b s ASN 136 Ca -0.04 0.66 -0.28 0.00 -0.71 0.00 0.00 52.86 52.49 2w2b s ASN 136 Cb -0.07 -2.25 -0.01 0.00 0.41 0.00 0.00 41.25 39.34 2w2b s ASN 136 CO -0.00 -0.00 0.94 -0.63 -1.51 0.00 0.00 177.10 175.89 2w2b s ILE 137 N 0.81 4.80 -0.49 0.60 1.01 -0.06 -0.75 121.20 127.12 2w2b s ILE 137 Ca 0.22 1.87 0.14 0.00 0.00 0.00 0.00 60.65 62.88 2w2b s ILE 137 Cb -0.14 -4.24 -0.17 0.00 0.01 0.00 0.00 42.46 37.92 2w2b s ILE 137 CO 0.08 -0.03 0.52 0.35 0.00 0.00 0.00 174.94 175.86 2w2b n THR 138 N 4.81 0.00 -3.72 2.92 -2.24 -0.18 -4.88 114.28 110.99 2w2b n THR 138 Ca 0.08 -0.21 -0.12 0.00 -2.27 0.00 0.00 64.05 61.53 2w2b n THR 138 Cb 0.48 0.78 -0.11 0.00 -2.10 0.00 0.00 70.33 69.37 2w2b n THR 138 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2w2b s TYR 139 N -2.50 -0.48 -0.10 4.78 5.04 -1.07 -4.97 117.35 118.05 2w2b s TYR 139 Ca 0.02 1.07 -0.02 0.00 -2.44 0.00 0.00 57.07 55.71 2w2b s TYR 139 Cb 0.10 0.18 0.03 0.00 0.35 0.00 0.00 41.96 42.62 2w2b s TYR 139 CO 0.58 -0.28 0.00 -1.64 -1.34 0.00 0.00 175.55 172.88 2w2b s MET 140 N 1.08 0.69 0.03 4.97 -1.94 -1.26 -1.66 119.30 121.22 2w2b s MET 140 Ca -0.07 -0.02 0.09 0.00 -1.71 0.00 0.00 55.69 53.97 2w2b s MET 140 Cb -0.08 -1.25 -0.03 0.00 2.01 0.00 0.00 34.83 35.49 2w2b s MET 140 CO -0.09 -0.37 -0.26 0.20 -0.01 0.00 0.00 175.02 174.50 2w2b s GLY 141 N 1.93 1.39 -0.75 -0.03 0.00 0.12 -4.95 107.32 105.03 2w2b s GLY 141 Ca 0.04 -1.24 -0.20 0.00 0.00 0.00 0.00 44.72 43.32 2w2b s GLY 141 CO -0.06 -1.11 0.97 -0.35 0.00 0.00 0.00 173.10 172.56 2w2b s ASP 142 N -1.14 6.36 0.05 1.64 -1.08 -1.26 -0.62 116.67 120.62 2w2b s ASP 142 Ca 0.12 -1.52 0.26 0.00 -0.52 0.00 0.00 52.55 50.89 2w2b s ASP 142 Cb -0.10 -2.38 0.66 0.00 -1.46 0.00 0.00 42.92 39.64 2w2b s ASP 142 CO 0.02 -1.22 1.54 0.00 0.52 0.00 0.00 175.17 176.03 2w2b n ALA 143 N 6.92 3.00 -0.59 3.66 0.00 -0.33 -4.94 120.51 128.23 2w2b n ALA 143 Ca 0.06 -0.24 0.08 0.00 0.00 0.00 0.00 53.44 53.34 2w2b n ALA 143 Cb 0.46 -1.25 -0.03 0.00 0.00 0.00 0.00 19.45 18.64 2w2b n ALA 143 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2w2b n GLY 144 N 1.44 -2.13 3.87 0.00 0.00 -1.10 -4.74 105.19 102.53 2w2b n GLY 144 Ca 0.05 -1.34 -0.30 0.00 0.00 0.00 0.00 46.02 44.42 2w2b n GLY 144 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2w2b s GLN 145 N -2.37 3.80 -1.46 1.61 -0.21 -1.26 -4.34 119.66 115.42 2w2b s GLN 145 Ca 0.00 0.48 -0.11 0.00 0.02 0.00 0.00 55.36 55.75 2w2b s GLN 145 Cb 0.00 -2.40 0.06 0.00 1.00 0.00 0.00 33.01 31.66 2w2b s GLN 145 CO 0.00 -0.01 0.98 0.09 -2.12 0.00 0.00 175.29 174.23 2w2b n ASN 146 N -1.18 -4.44 -4.38 5.90 3.02 0.43 -4.94 115.26 109.67 2w2b n ASN 146 Ca 0.02 -0.74 -0.45 0.00 -0.03 0.00 0.00 54.58 53.38 2w2b n ASN 146 Cb 0.54 -4.13 -0.06 0.00 -0.61 0.00 0.00 39.78 35.52 2w2b n ASN 146 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2w2b s ASN 147 N -3.50 6.18 0.00 6.41 3.84 -1.26 -4.94 114.94 121.67 2w2b s ASN 147 Ca 0.53 -1.33 0.25 0.00 0.21 0.00 0.00 52.86 52.52 2w2b s ASN 147 Cb -0.26 -2.24 1.23 0.00 -0.55 0.00 0.00 41.25 39.44 2w2b s ASN 147 CO 0.81 -0.83 1.82 -0.62 -2.79 0.00 0.00 177.10 175.48 2w2b n GLU 148 N 5.66 0.34 0.11 0.43 -0.58 -1.26 -3.15 120.64 122.18 2w2b n GLU 148 Ca -0.11 0.05 0.03 0.00 -0.42 0.00 0.00 57.16 56.72 2w2b n GLU 148 Cb 0.43 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.80 2w2b n GLU 148 CO 0.00 0.00 0.00 -0.44 -0.48 0.00 0.00 177.13 176.21 2w2b h ASP 149 N 0.00 0.00 0.09 1.62 5.19 -1.92 -3.40 116.42 118.00 2w2b h ASP 149 Ca 0.00 0.00 0.02 0.00 -0.62 0.00 0.00 57.03 56.43 2w2b h ASP 149 Cb 0.24 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 39.71 2w2b h ASP 149 CO 0.00 0.45 -0.32 0.58 -3.12 0.00 0.00 179.24 176.83 2w2b h VAL 150 N 0.00 0.31 -3.36 -1.35 2.07 -1.83 -3.28 116.25 108.81 2w2b h VAL 150 Ca -0.05 0.00 -0.64 0.00 0.82 0.00 0.00 66.70 66.83 2w2b h VAL 150 Cb 1.39 0.31 -0.41 0.00 -1.52 0.00 0.00 31.29 31.06 2w2b h VAL 150 CO 0.05 0.00 -0.64 -0.63 0.02 0.00 0.00 177.57 176.37 2w2b s ILE 151 N -6.01 2.52 -0.02 4.57 -1.09 -1.26 -4.90 121.20 115.01 2w2b s ILE 151 Ca -0.16 -3.27 0.02 0.00 -2.23 0.00 0.00 60.65 55.02 2w2b s ILE 151 Cb 0.08 -2.75 0.04 0.00 -1.58 0.00 0.00 42.46 38.24 2w2b s ILE 151 CO 0.65 -0.80 0.83 -1.54 -1.23 0.00 0.00 174.94 172.85 2w2b n SER 152 N 3.15 0.57 -3.61 3.58 3.41 -1.24 -4.90 113.62 114.57 2w2b n SER 152 Ca 0.05 -1.76 -0.09 0.00 -0.26 0.00 0.00 58.87 56.81 2w2b n SER 152 Cb 0.32 -0.13 -0.02 0.00 -0.26 0.00 0.00 64.21 64.13 2w2b n SER 152 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 2w2b s GLU 153 N -0.50 1.31 0.66 4.33 -1.05 -1.26 -5.10 118.70 117.08 2w2b s GLU 153 Ca 0.04 -0.60 -0.17 0.00 -0.15 0.00 0.00 54.97 54.08 2w2b s GLU 153 Cb 0.04 0.52 -0.00 0.00 -0.44 0.00 0.00 34.13 34.25 2w2b s GLU 153 CO 0.00 -0.59 1.24 0.00 0.95 0.00 0.00 175.26 176.87 2w2b s ALA 154 N -3.59 2.34 0.59 -0.84 0.00 -1.26 -4.97 121.76 114.03 2w2b s ALA 154 Ca 0.06 1.04 -0.18 0.00 0.00 0.00 0.00 51.96 52.88 2w2b s ALA 154 Cb -0.02 -3.49 -0.04 0.00 0.00 0.00 0.00 23.12 19.56 2w2b s ALA 154 CO -0.04 -1.56 1.17 -1.25 0.00 0.00 0.00 175.76 174.08 2w2b s PRO 155 N -3.54 3.05 0.17 0.00 0.04 -1.26 -5.06 135.00 128.40 2w2b s PRO 155 Ca 0.78 1.71 0.05 0.00 0.04 0.00 0.00 61.00 63.58 2w2b s PRO 155 Cb -0.33 -1.95 -0.05 0.00 0.04 0.00 0.00 34.50 32.22 2w2b s PRO 155 CO 0.39 -1.11 -0.10 1.52 0.04 0.00 0.00 177.00 177.75 2w2b s TYR 156 N -1.75 1.38 0.17 0.56 -0.85 -1.26 -4.97 117.35 110.64 2w2b s TYR 156 Ca 0.75 -0.75 -0.27 0.00 -0.52 0.00 0.00 57.07 56.28 2w2b s TYR 156 Cb -0.27 -0.71 0.01 0.00 0.38 0.00 0.00 41.96 41.37 2w2b s TYR 156 CO 0.32 0.11 1.56 -0.22 -1.52 0.00 0.00 175.55 175.80 2w2b h LYS 157 N 2.70 -0.20 -0.52 -3.49 3.64 -1.97 -1.51 116.57 115.22 2w2b h LYS 157 Ca -0.37 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.02 2w2b h LYS 157 Cb 1.20 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.06 2w2b h LYS 157 CO 0.63 -0.13 0.00 0.39 -2.27 0.00 0.00 179.45 178.07 2w2b n GLU 158 N -5.38 2.36 -0.03 1.90 -0.58 -1.26 -4.56 120.64 113.09 2w2b n GLU 158 Ca 0.01 -1.63 -0.09 0.00 -0.42 0.00 0.00 57.16 55.04 2w2b n GLU 158 Cb 0.34 -1.51 -0.03 0.00 -0.57 0.00 0.00 31.44 29.67 2w2b n GLU 158 CO 0.00 0.00 0.00 1.98 -0.48 0.00 0.00 177.13 178.63 2w2b h MET 159 N 2.46 0.01 -0.86 3.49 1.85 -1.69 0.00 114.93 120.19 2w2b h MET 159 Ca 0.00 -0.00 0.08 0.00 -0.61 0.00 0.00 59.70 59.17 2w2b h MET 159 Cb 0.80 -0.00 -0.07 0.00 0.43 0.00 0.00 31.60 32.76 2w2b h MET 159 CO 0.08 0.01 0.52 -1.35 -0.40 0.00 0.00 176.91 175.77 2w2b h PRO 160 N 0.01 0.89 -0.57 0.39 0.11 -1.81 -0.09 132.00 130.93 2w2b h PRO 160 Ca 0.08 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.13 2w2b h PRO 160 Cb 0.12 -0.20 -0.03 0.00 0.11 0.00 0.00 31.00 31.00 2w2b h PRO 160 CO -0.17 0.59 0.31 -0.91 -0.21 0.00 0.00 178.00 177.61 2w2b h ASN 161 N 0.92 0.72 -0.88 -2.05 2.35 -1.77 -0.89 115.58 113.98 2w2b h ASN 161 Ca 0.39 -0.10 0.04 0.00 -0.55 0.00 0.00 56.30 56.08 2w2b h ASN 161 Cb 0.26 -0.18 -0.05 0.00 0.05 0.00 0.00 38.32 38.40 2w2b h ASN 161 CO -0.21 0.61 0.57 0.44 -1.65 0.00 0.00 177.43 177.19 2w2b h ASP 162 N 0.77 0.94 0.18 5.81 3.32 -0.27 0.14 116.42 127.32 2w2b h ASP 162 Ca 0.20 -0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.24 2w2b h ASP 162 Cb 0.05 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.39 2w2b h ASP 162 CO -0.03 0.64 -0.09 0.40 -1.72 0.00 0.00 179.24 178.44 2w2b h ILE 163 N 1.10 0.93 -0.17 0.35 2.04 -0.80 0.43 117.51 121.39 2w2b h ILE 163 Ca 0.35 -0.61 -0.04 0.00 1.00 0.00 0.00 64.86 65.57 2w2b h ILE 163 Cb 0.02 1.29 -0.01 0.00 -0.74 0.00 0.00 36.82 37.38 2w2b h ILE 163 CO -0.12 0.14 -0.05 0.03 0.00 0.00 0.00 178.15 178.14 2w2b h ARG 164 N -0.55 0.25 -0.00 2.37 3.08 -0.97 -2.60 114.38 115.96 2w2b h ARG 164 Ca -0.02 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.98 2w2b h ARG 164 Cb 0.41 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.42 2w2b h ARG 164 CO 0.04 0.32 -0.03 0.09 -1.07 0.00 0.00 179.97 179.33 2w2b n ASN 165 N -4.34 0.44 -0.21 7.04 3.02 0.47 -4.92 115.26 116.76 2w2b n ASN 165 Ca -0.00 -0.94 -0.03 0.00 -0.03 0.00 0.00 54.58 53.58 2w2b n ASN 165 Cb 0.21 -0.04 -0.01 0.00 -0.61 0.00 0.00 39.78 39.33 2w2b n ASN 165 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2w2b n GLY 166 N 1.13 0.55 0.16 7.41 0.00 -0.98 -4.93 105.19 108.52 2w2b n GLY 166 Ca 0.20 -0.94 0.10 0.00 0.00 0.00 0.00 46.02 45.38 2w2b n GLY 166 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2w2b n LYS 167 N -2.73 0.48 -0.10 1.61 5.02 0.10 -4.60 118.16 117.94 2w2b n LYS 167 Ca -0.03 -0.32 -0.23 0.00 -2.02 0.00 0.00 58.31 55.71 2w2b n LYS 167 Cb 0.14 -1.48 -0.12 0.00 -0.02 0.00 0.00 35.03 33.55 2w2b n LYS 167 CO 0.00 0.00 0.00 0.98 -0.52 0.00 0.00 177.40 177.86 2w2b n TYR 168 N -1.02 0.47 -4.06 2.13 9.36 -0.96 -4.96 117.16 118.13 2w2b n TYR 168 Ca 0.06 0.14 -0.30 0.00 3.32 0.00 0.00 57.90 61.12 2w2b n TYR 168 Cb 0.37 -1.05 -0.07 0.00 -0.63 0.00 0.00 39.34 37.96 2w2b n TYR 168 CO 0.00 0.00 0.00 -0.06 0.22 0.00 0.00 176.86 177.02 2w2b s PHE 169 N -2.49 3.17 0.43 2.98 0.08 -1.26 -4.64 117.98 116.24 2w2b s PHE 169 Ca -0.32 0.06 -0.07 0.00 0.12 0.00 0.00 56.93 56.72 2w2b s PHE 169 Cb 0.10 -1.60 0.10 0.00 -0.57 0.00 0.00 43.02 41.04 2w2b s PHE 169 CO 0.60 0.52 0.59 -0.40 -0.10 0.00 0.00 175.22 176.43 2w2b n ASP 170 N 0.40 0.09 0.24 1.36 5.68 0.81 -4.88 116.55 120.25 2w2b n ASP 170 Ca -0.09 -1.24 0.17 0.00 -0.50 0.00 0.00 54.79 53.13 2w2b n ASP 170 Cb 0.52 -0.45 0.83 0.00 -1.14 0.00 0.00 41.12 40.88 2w2b n ASP 170 CO 0.00 0.00 0.00 0.06 -1.33 0.00 0.00 177.20 175.93 2w2b h GLN 171 N 0.00 0.00 -0.40 0.11 3.07 -1.98 -1.49 115.11 114.42 2w2b h GLN 171 Ca -0.19 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.55 2w2b h GLN 171 Cb 0.53 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.09 2w2b h GLN 171 CO 0.14 0.00 0.00 0.09 0.09 0.00 0.00 178.83 179.15 2w2b n ASN 172 N -2.71 3.99 -2.77 0.06 3.02 -1.26 -4.96 115.26 110.64 2w2b n ASN 172 Ca -0.01 -2.61 -0.19 0.00 -0.03 0.00 0.00 54.58 51.73 2w2b n ASN 172 Cb 0.12 -0.48 0.04 0.00 -0.61 0.00 0.00 39.78 38.85 2w2b n ASN 172 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2w2b n TYR 173 N 0.22 -1.93 -4.46 3.10 4.19 -0.56 -5.02 117.16 112.69 2w2b n TYR 173 Ca 0.20 0.59 -0.25 0.00 3.31 0.00 0.00 57.90 61.75 2w2b n TYR 173 Cb 0.79 -4.14 -0.10 0.00 0.49 0.00 0.00 39.34 36.39 2w2b n TYR 173 CO 0.00 0.00 0.00 -1.01 0.91 0.00 0.00 176.86 176.76 2w2b s HIS 174 N -3.15 2.42 -0.11 2.98 3.76 -1.26 -4.72 115.29 115.22 2w2b s HIS 174 Ca 0.34 -0.43 -0.21 0.00 -0.15 0.00 0.00 55.06 54.62 2w2b s HIS 174 Cb -0.15 -1.30 -0.04 0.00 1.11 0.00 0.00 32.58 32.20 2w2b s HIS 174 CO 0.42 0.60 0.59 1.03 -0.85 0.00 0.00 174.74 176.52 2w2b s ARG 175 N -3.61 4.36 0.17 1.40 0.52 -1.26 -0.14 118.95 120.39 2w2b s ARG 175 Ca 0.32 0.64 -0.13 0.00 -0.52 0.00 0.00 55.73 56.05 2w2b s ARG 175 Cb -0.00 -3.46 0.08 0.00 0.52 0.00 0.00 34.95 32.08 2w2b s ARG 175 CO 0.17 0.06 1.77 1.25 0.02 0.00 0.00 175.30 178.57 2w2b h LEU 176 N 6.95 0.75 -8.00 2.53 5.85 -1.96 -3.40 115.31 118.03 2w2b h LEU 176 Ca -0.40 -0.12 -0.60 0.00 0.84 0.00 0.00 57.88 57.61 2w2b h LEU 176 Cb 1.18 -0.19 -0.35 0.00 0.37 0.00 0.00 40.66 41.67 2w2b h LEU 176 CO 0.76 0.65 -0.84 0.20 -0.34 0.00 0.00 178.44 178.87 2w2b s ASN 177 N -5.95 2.57 0.00 1.25 -0.87 -1.26 -5.17 114.94 105.51 2w2b s ASN 177 Ca -0.13 -0.46 0.00 0.00 -1.57 0.00 0.00 52.86 50.70 2w2b s ASN 177 Cb 0.13 -1.15 0.00 0.00 -0.02 0.00 0.00 41.25 40.21 2w2b s ASN 177 CO 0.78 0.01 0.09 1.17 -2.57 0.00 0.00 177.10 176.57