#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2w2f s LYS 3 N 0.00 3.57 -0.21 -0.78 -2.85 -1.26 -5.08 119.74 113.13 2w2f s LYS 3 Ca 0.00 -0.16 -0.16 0.00 -1.00 0.00 0.00 55.97 54.65 2w2f s LYS 3 Cb 0.00 -2.71 -0.04 0.00 -2.06 0.00 0.00 37.83 33.02 2w2f s LYS 3 CO 0.00 0.27 0.43 0.99 0.10 0.00 0.00 175.35 177.13 2w2f s THR 4 N -2.04 5.17 -0.29 3.79 2.01 -1.26 -4.83 115.64 118.19 2w2f s THR 4 Ca 0.41 0.75 -0.20 0.00 0.31 0.00 0.00 61.69 62.96 2w2f s THR 4 Cb -0.11 -3.75 -0.01 0.00 0.01 0.00 0.00 72.50 68.64 2w2f s THR 4 CO 0.30 0.22 0.62 -0.36 -0.69 0.00 0.00 174.62 174.71 2w2f s PHE 5 N 1.52 3.23 0.00 4.92 0.40 -1.26 -4.90 117.98 121.90 2w2f s PHE 5 Ca 0.20 0.64 0.00 0.00 -0.60 0.00 0.00 56.93 57.17 2w2f s PHE 5 Cb -0.15 -2.94 0.00 0.00 0.51 0.00 0.00 43.02 40.44 2w2f s PHE 5 CO 0.09 -0.43 0.00 1.63 0.70 0.00 0.00 175.22 177.21 2w2f n LYS 6 N 5.82 3.83 -4.47 0.44 5.02 -1.26 -3.58 118.16 123.96 2w2f n LYS 6 Ca -0.01 0.00 -0.22 0.00 -2.02 0.00 0.00 58.31 56.05 2w2f n LYS 6 Cb 0.49 -1.00 -0.10 0.00 -0.02 0.00 0.00 35.03 34.40 2w2f n LYS 6 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2w2f s THR 7 N -2.00 1.15 0.32 -0.18 -4.23 -1.26 -3.05 115.64 106.39 2w2f s THR 7 Ca 0.00 -2.00 0.05 0.00 -1.18 0.00 0.00 61.69 58.56 2w2f s THR 7 Cb 0.00 -2.74 0.10 0.00 1.34 0.00 0.00 72.50 71.20 2w2f s THR 7 CO 0.00 0.00 1.79 0.25 -0.54 0.00 0.00 174.62 176.12 2w2f h LEU 8 N 2.05 0.38 -0.70 4.79 5.85 -1.98 -2.96 115.31 122.73 2w2f h LEU 8 Ca -0.40 -0.11 -0.05 0.00 0.84 0.00 0.00 57.88 58.16 2w2f h LEU 8 Cb 1.25 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 42.15 2w2f h LEU 8 CO 0.69 0.60 0.23 -0.78 -0.34 0.00 0.00 178.44 178.84 2w2f h ASP 9 N 0.35 1.01 -0.62 1.25 3.58 -1.96 -2.11 116.42 117.91 2w2f h ASP 9 Ca 0.06 -0.20 0.10 0.00 0.42 0.00 0.00 57.03 57.41 2w2f h ASP 9 Cb 0.56 -0.26 -0.08 0.00 1.72 0.00 0.00 39.33 41.27 2w2f h ASP 9 CO 0.04 0.94 0.22 0.44 -2.88 0.00 0.00 179.24 178.00 2w2f h ASP 10 N 1.02 0.20 0.15 2.28 3.32 -1.93 -3.29 116.42 118.17 2w2f h ASP 10 Ca 0.23 0.09 -0.22 0.00 0.02 0.00 0.00 57.03 57.15 2w2f h ASP 10 Cb 0.28 0.07 0.02 0.00 0.22 0.00 0.00 39.33 39.92 2w2f h ASP 10 CO -0.01 0.11 -0.97 0.15 -1.72 0.00 0.00 179.24 176.80 2w2f h PHE 11 N 0.39 0.58 -2.94 4.55 3.57 -1.47 -3.44 116.94 118.18 2w2f h PHE 11 Ca 0.32 -0.42 -0.57 0.00 3.53 0.00 0.00 57.97 60.82 2w2f h PHE 11 Cb 0.42 -0.02 0.09 0.00 2.79 0.00 0.00 35.95 39.22 2w2f h PHE 11 CO -0.18 1.37 0.63 1.28 -2.23 0.00 0.00 178.31 179.18 2w2f n LEU 12 N -4.05 3.41 0.00 0.59 4.77 -0.81 -2.02 117.00 118.88 2w2f n LEU 12 Ca -0.16 1.16 0.00 0.00 -0.03 0.00 0.00 56.01 56.98 2w2f n LEU 12 Cb 0.87 -1.47 0.00 0.00 -2.33 0.00 0.00 43.42 40.49 2w2f n LEU 12 CO 0.49 -0.39 0.00 0.61 -1.33 0.00 0.00 177.39 176.77 2w2f n GLY 13 N 1.78 0.83 3.76 -0.72 0.00 0.53 -4.84 105.19 106.54 2w2f n GLY 13 Ca 0.09 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 2w2f n GLY 13 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2w2f s THR 14 N -2.55 4.32 -0.17 2.61 2.01 -0.86 -1.16 115.64 119.84 2w2f s THR 14 Ca 0.00 1.82 -0.02 0.00 0.31 0.00 0.00 61.69 63.80 2w2f s THR 14 Cb 0.00 -4.20 -0.01 0.00 0.01 0.00 0.00 72.50 68.30 2w2f s THR 14 CO 0.00 0.50 -0.09 -2.28 -0.69 0.00 0.00 174.62 172.06 2w2f s HIS 15 N -1.02 2.90 0.10 4.92 2.46 0.30 -2.49 115.29 122.46 2w2f s HIS 15 Ca 0.38 -0.79 0.10 0.00 0.47 0.00 0.00 55.06 55.22 2w2f s HIS 15 Cb -0.24 -1.97 -0.04 0.00 -0.13 0.00 0.00 32.58 30.20 2w2f s HIS 15 CO 0.28 -0.37 -0.25 -0.06 -2.47 0.00 0.00 174.74 171.87 2w2f s PHE 16 N 0.89 2.16 -0.03 3.88 0.40 0.82 -0.92 117.98 125.19 2w2f s PHE 16 Ca -0.02 -0.39 0.05 0.00 -0.60 0.00 0.00 56.93 55.97 2w2f s PHE 16 Cb -0.15 -1.21 -0.01 0.00 0.51 0.00 0.00 43.02 42.16 2w2f s PHE 16 CO 0.00 0.25 -0.19 0.42 0.70 0.00 0.00 175.22 176.40 2w2f s ILE 17 N -1.01 1.54 0.07 0.64 1.01 -0.58 -1.28 121.20 121.59 2w2f s ILE 17 Ca 0.11 -0.81 -0.12 0.00 0.00 0.00 0.00 60.65 59.84 2w2f s ILE 17 Cb -0.10 -1.29 0.01 0.00 0.01 0.00 0.00 42.46 41.09 2w2f s ILE 17 CO 0.05 0.44 0.27 -0.72 0.00 0.00 0.00 174.94 174.97 2w2f s TYR 18 N -0.27 -0.02 -0.13 3.97 -0.85 -0.34 -0.37 117.35 119.35 2w2f s TYR 18 Ca 0.03 -0.24 -0.00 0.00 -0.52 0.00 0.00 57.07 56.33 2w2f s TYR 18 Cb -0.09 0.06 0.03 0.00 0.38 0.00 0.00 41.96 42.33 2w2f s TYR 18 CO 0.01 -0.53 -0.09 0.99 -1.52 0.00 0.00 175.55 174.40 2w2f s THR 19 N -3.12 1.20 0.83 -3.49 2.01 0.04 -0.37 115.64 112.74 2w2f s THR 19 Ca -0.01 -0.42 -0.10 0.00 0.31 0.00 0.00 61.69 61.47 2w2f s THR 19 Cb 0.01 -1.20 0.09 0.00 0.01 0.00 0.00 72.50 71.42 2w2f s THR 19 CO -0.07 0.38 1.12 -0.31 -0.69 0.00 0.00 174.62 175.04 2w2f s TYR 20 N 1.64 2.16 0.59 4.92 2.02 -0.51 -0.79 117.35 127.37 2w2f s TYR 20 Ca 0.05 1.66 0.29 0.00 -0.37 0.00 0.00 57.07 58.70 2w2f s TYR 20 Cb -0.13 -3.18 1.64 0.00 -0.40 0.00 0.00 41.96 39.89 2w2f s TYR 20 CO -0.09 -2.24 2.08 -0.44 -1.57 0.00 0.00 175.55 173.29 2w2f h ASP 21 N -1.43 0.00 0.00 2.29 3.32 -1.54 0.44 116.42 119.50 2w2f h ASP 21 Ca -0.43 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.62 2w2f h ASP 21 Cb 1.25 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.80 2w2f h ASP 21 CO 0.47 0.00 0.00 -0.46 -1.72 0.00 0.00 179.24 177.53 2w2f n ASN 22 N -3.78 0.00 0.00 6.45 0.23 -1.26 -4.88 115.26 112.03 2w2f n ASN 22 Ca 0.02 -1.13 0.00 0.00 -0.53 0.00 0.00 54.58 52.94 2w2f n ASN 22 Cb 0.36 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.06 2w2f n ASN 22 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2w2f n GLY 23 N 0.78 0.70 3.65 4.83 0.00 0.14 -5.04 105.19 110.26 2w2f n GLY 23 Ca 0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.77 2w2f n GLY 23 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2w2f s TRP 24 N -2.67 3.26 -0.21 1.61 0.52 -1.24 -4.80 118.94 115.41 2w2f s TRP 24 Ca 0.00 1.32 -0.14 0.00 0.02 0.00 0.00 56.10 57.29 2w2f s TRP 24 Cb 0.00 -3.42 -0.04 0.00 -1.15 0.00 0.00 33.47 28.85 2w2f s TRP 24 CO 0.00 -0.59 0.33 -2.00 0.02 0.00 0.00 176.95 174.71 2w2f s GLU 25 N 3.35 4.15 0.22 4.98 2.12 -1.26 -1.42 118.70 130.84 2w2f s GLU 25 Ca 0.44 0.07 0.11 0.00 0.36 0.00 0.00 54.97 55.95 2w2f s GLU 25 Cb -0.14 -3.53 -0.05 0.00 0.26 0.00 0.00 34.13 30.68 2w2f s GLU 25 CO 0.10 0.00 -0.21 0.71 -0.54 0.00 0.00 175.26 175.32 2w2f s TYR 26 N 1.19 2.18 -0.00 5.30 1.51 0.50 -0.35 117.35 127.68 2w2f s TYR 26 Ca 0.16 -0.38 0.02 0.00 -1.01 0.00 0.00 57.07 55.86 2w2f s TYR 26 Cb -0.14 -1.03 -0.01 0.00 -0.11 0.00 0.00 41.96 40.67 2w2f s TYR 26 CO 0.07 0.54 -0.08 -2.00 -1.11 0.00 0.00 175.55 172.97 2w2f s GLU 27 N -3.04 0.62 -0.08 -0.62 2.12 -0.20 -1.20 118.70 116.30 2w2f s GLU 27 Ca 0.23 -0.32 -0.18 0.00 0.36 0.00 0.00 54.97 55.07 2w2f s GLU 27 Cb -0.06 -0.58 0.04 0.00 0.26 0.00 0.00 34.13 33.78 2w2f s GLU 27 CO 0.11 0.16 0.42 -0.46 -0.54 0.00 0.00 175.26 174.95 2w2f s TRP 28 N -0.28 -0.37 -0.10 5.30 -0.00 -0.40 -1.52 118.94 121.57 2w2f s TRP 28 Ca 0.02 0.75 -0.03 0.00 -0.00 0.00 0.00 56.10 56.84 2w2f s TRP 28 Cb -0.04 0.18 0.05 0.00 -0.00 0.00 0.00 33.47 33.66 2w2f s TRP 28 CO -0.00 -0.37 0.13 -0.47 -0.00 0.00 0.00 176.95 176.23 2w2f s TYR 29 N -0.73 -0.07 -1.09 5.86 5.04 0.30 -0.13 117.35 126.54 2w2f s TYR 29 Ca -0.08 0.33 -0.22 0.00 -2.44 0.00 0.00 57.07 54.66 2w2f s TYR 29 Cb -0.04 -0.40 0.05 0.00 0.35 0.00 0.00 41.96 41.92 2w2f s TYR 29 CO 0.04 -0.32 1.57 0.00 -1.34 0.00 0.00 175.55 175.50 2w2f s ALA 30 N 2.24 2.77 0.13 3.97 0.00 -1.04 -1.40 121.76 128.43 2w2f s ALA 30 Ca 0.04 -2.37 -0.11 0.00 0.00 0.00 0.00 51.96 49.51 2w2f s ALA 30 Cb -0.13 -4.57 -0.07 0.00 0.00 0.00 0.00 23.12 18.36 2w2f s ALA 30 CO -0.06 -3.66 1.44 -0.22 0.00 0.00 0.00 175.76 173.26 2w2f h LYS 31 N 9.34 0.91 -2.91 0.00 3.64 -1.74 0.15 116.57 125.97 2w2f h LYS 31 Ca 0.26 -0.53 0.02 0.00 -1.27 0.00 0.00 60.65 59.12 2w2f h LYS 31 Cb 0.97 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.83 2w2f h LYS 31 CO 1.42 1.18 0.33 0.54 -2.27 0.00 0.00 179.45 180.65 2w2f s ASN 32 N -6.91 -0.00 0.00 4.20 2.20 -1.21 0.31 114.94 113.53 2w2f s ASN 32 Ca -0.11 -1.04 0.06 0.00 -0.94 0.00 0.00 52.86 50.82 2w2f s ASN 32 Cb 0.11 0.78 0.30 0.00 -2.00 0.00 0.00 41.25 40.44 2w2f s ASN 32 CO 0.89 -1.55 0.94 -0.90 -2.94 0.00 0.00 177.10 173.54 2w2f n ASP 33 N -1.35 0.00 -0.02 3.54 3.85 -1.26 -2.69 116.55 118.62 2w2f n ASP 33 Ca -0.07 0.06 0.00 0.00 -0.71 0.00 0.00 54.79 54.07 2w2f n ASP 33 Cb 0.60 -0.18 0.00 0.00 -1.35 0.00 0.00 41.12 40.19 2w2f n ASP 33 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2w2f n HIS 34 N -1.18 0.00 -4.10 2.11 1.44 -1.26 -4.25 115.22 107.98 2w2f n HIS 34 Ca 0.03 0.00 -0.16 0.00 -2.01 0.00 0.00 57.72 55.59 2w2f n HIS 34 Cb 0.03 0.01 -0.15 0.00 0.12 0.00 0.00 29.99 30.01 2w2f n HIS 34 CO 0.00 0.00 0.00 0.99 -2.81 0.00 0.00 176.34 174.52 2w2f s THR 35 N 0.00 0.33 0.06 0.61 2.01 -1.09 -1.68 115.64 115.88 2w2f s THR 35 Ca 0.00 -0.16 0.05 0.00 0.31 0.00 0.00 61.69 61.89 2w2f s THR 35 Cb 0.00 -0.30 -0.03 0.00 0.01 0.00 0.00 72.50 72.18 2w2f s THR 35 CO 0.00 0.11 -0.14 0.68 -0.69 0.00 0.00 174.62 174.58 2w2f s VAL 36 N 0.04 1.06 0.00 3.82 -7.23 0.07 -2.01 120.40 116.16 2w2f s VAL 36 Ca 0.00 -1.19 0.07 0.00 -1.81 0.00 0.00 61.98 59.04 2w2f s VAL 36 Cb -0.03 -1.01 -0.03 0.00 0.56 0.00 0.00 36.38 35.87 2w2f s VAL 36 CO -0.00 -0.17 -0.20 -1.81 -0.31 0.00 0.00 175.10 172.61 2w2f s ASP 37 N -1.55 3.63 0.19 4.85 1.01 -0.49 -1.03 116.67 123.29 2w2f s ASP 37 Ca -0.02 -0.39 -0.03 0.00 0.71 0.00 0.00 52.55 52.82 2w2f s ASP 37 Cb -0.09 -0.58 -0.03 0.00 1.01 0.00 0.00 42.92 43.22 2w2f s ASP 37 CO 0.02 0.29 0.16 -0.72 0.21 0.00 0.00 175.17 175.14 2w2f s TYR 38 N -0.80 0.96 -0.23 4.23 1.13 -0.15 -0.54 117.35 121.95 2w2f s TYR 38 Ca 0.12 -1.24 -0.11 0.00 -1.41 0.00 0.00 57.07 54.44 2w2f s TYR 38 Cb -0.10 -0.43 0.09 0.00 -1.10 0.00 0.00 41.96 40.41 2w2f s TYR 38 CO 0.02 -0.66 0.54 0.50 -2.51 0.00 0.00 175.55 173.44 2w2f s ARG 39 N -4.11 0.50 -0.23 -3.49 3.52 -0.58 -1.33 118.95 113.23 2w2f s ARG 39 Ca 0.33 1.10 -0.09 0.00 -0.13 0.00 0.00 55.73 56.93 2w2f s ARG 39 Cb 0.06 0.27 -0.04 0.00 -1.56 0.00 0.00 34.95 33.68 2w2f s ARG 39 CO 0.09 -0.19 0.11 0.42 -0.81 0.00 0.00 175.30 174.93 2w2f s ILE 40 N 2.03 4.90 -0.06 4.11 1.01 0.54 -1.03 121.20 132.70 2w2f s ILE 40 Ca -0.07 0.02 0.17 0.00 0.00 0.00 0.00 60.65 60.77 2w2f s ILE 40 Cb -0.09 -3.28 -0.26 0.00 0.01 0.00 0.00 42.46 38.85 2w2f s ILE 40 CO -0.16 0.36 0.31 1.41 0.00 0.00 0.00 174.94 176.86 2w2f n HIS 41 N 4.37 0.00 -4.08 3.97 8.25 0.52 -0.88 115.22 127.37 2w2f n HIS 41 Ca -0.16 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.20 2w2f n HIS 41 Cb 0.52 -0.51 -0.07 0.00 1.12 0.00 0.00 29.99 31.05 2w2f n HIS 41 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 2w2f s GLY 42 N -4.30 0.90 0.00 -1.41 0.00 -0.91 -4.72 107.32 96.87 2w2f s GLY 42 Ca -0.07 -1.21 0.00 0.00 0.00 0.00 0.00 44.72 43.44 2w2f s GLY 42 CO 0.73 -0.97 0.00 0.61 0.00 0.00 0.00 173.10 173.47 2w2f n GLY 43 N -0.32 -1.60 0.25 0.20 0.00 -1.26 -3.89 105.19 98.57 2w2f n GLY 43 Ca -0.01 -1.38 0.01 0.00 0.00 0.00 0.00 46.02 44.65 2w2f n GLY 43 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2w2f h MET 44 N 0.00 0.48 -0.83 1.61 1.85 -2.01 -2.06 114.93 113.98 2w2f h MET 44 Ca 0.00 -0.03 -0.59 0.00 -0.61 0.00 0.00 59.70 58.47 2w2f h MET 44 Cb 0.00 -0.11 -0.38 0.00 0.43 0.00 0.00 31.60 31.54 2w2f h MET 44 CO 0.00 0.32 -0.23 1.33 -0.40 0.00 0.00 176.91 177.93 2w2f n VAL 45 N -4.94 2.91 -1.67 -5.77 0.24 -1.26 -4.81 118.33 103.03 2w2f n VAL 45 Ca 0.10 -3.76 -0.48 0.00 -2.04 0.00 0.00 64.34 58.17 2w2f n VAL 45 Cb 0.29 -1.14 -0.05 0.00 -1.47 0.00 0.00 33.84 31.48 2w2f n VAL 45 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2w2f n ALA 46 N -0.79 1.02 0.00 2.33 0.00 -0.78 -2.53 120.51 119.77 2w2f n ALA 46 Ca 0.50 0.37 0.00 0.00 0.00 0.00 0.00 53.44 54.31 2w2f n ALA 46 Cb 0.87 -2.41 0.00 0.00 0.00 0.00 0.00 19.45 17.90 2w2f n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2w2f n GLY 47 N 3.88 1.89 3.77 0.00 0.00 -0.06 -4.88 105.19 109.79 2w2f n GLY 47 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 2w2f n GLY 47 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2w2f s GLN 48 N -0.15 3.96 -0.08 1.61 0.74 -1.05 -3.96 119.66 120.73 2w2f s GLN 48 Ca 0.00 2.53 -0.16 0.00 0.05 0.00 0.00 55.36 57.78 2w2f s GLN 48 Cb 0.00 -2.86 0.03 0.00 1.10 0.00 0.00 33.01 31.28 2w2f s GLN 48 CO 0.00 -0.63 0.38 1.67 -0.55 0.00 0.00 175.29 176.16 2w2f s TRP 49 N -1.15 -0.34 -0.01 1.67 1.48 -0.92 -0.34 118.94 119.33 2w2f s TRP 49 Ca 0.56 0.73 0.01 0.00 -1.06 0.00 0.00 56.10 56.34 2w2f s TRP 49 Cb -0.46 0.15 0.00 0.00 -1.16 0.00 0.00 33.47 32.00 2w2f s TRP 49 CO 0.61 -0.32 -0.03 0.08 -4.06 0.00 0.00 176.95 173.23 2w2f s VAL 50 N -0.56 0.26 0.20 -0.66 1.01 -0.44 -2.21 120.40 117.99 2w2f s VAL 50 Ca -0.07 -0.12 0.11 0.00 0.00 0.00 0.00 61.98 61.90 2w2f s VAL 50 Cb -0.04 -0.23 -0.04 0.00 0.00 0.00 0.00 36.38 36.07 2w2f s VAL 50 CO 0.03 0.08 -0.19 0.42 0.00 0.00 0.00 175.10 175.44 2w2f s THR 51 N 0.05 2.64 -1.56 3.92 -4.23 -1.26 -0.98 115.64 114.22 2w2f s THR 51 Ca -0.00 -1.95 -0.03 0.00 -1.18 0.00 0.00 61.69 58.53 2w2f s THR 51 Cb -0.03 -2.30 0.01 0.00 1.34 0.00 0.00 72.50 71.53 2w2f s THR 51 CO -0.00 -0.14 0.32 0.47 -0.54 0.00 0.00 174.62 174.73 2w2f n ASP 52 N 0.10 -5.59 -4.67 3.99 8.00 -1.20 -4.93 116.55 112.24 2w2f n ASP 52 Ca -0.11 -0.15 -0.42 0.00 0.71 0.00 0.00 54.79 54.81 2w2f n ASP 52 Cb 0.56 -4.59 -0.03 0.00 -0.02 0.00 0.00 41.12 37.04 2w2f n ASP 52 CO 0.00 0.00 0.00 -1.58 -0.39 0.00 0.00 177.20 175.23 2w2f s GLN 53 N -5.44 4.19 0.12 -1.24 2.00 -0.19 -4.85 119.66 114.24 2w2f s GLN 53 Ca 0.18 2.22 -0.31 0.00 -2.00 0.00 0.00 55.36 55.45 2w2f s GLN 53 Cb -0.08 -3.92 -0.07 0.00 0.80 0.00 0.00 33.01 29.73 2w2f s GLN 53 CO 0.22 -0.82 1.32 0.15 -0.50 0.00 0.00 175.29 175.66 2w2f s LYS 54 N 3.78 4.36 -0.05 1.67 -0.14 -1.26 -0.75 119.74 127.36 2w2f s LYS 54 Ca 0.74 1.99 -0.15 0.00 -1.36 0.00 0.00 55.97 57.19 2w2f s LYS 54 Cb -0.35 -3.26 0.03 0.00 -1.68 0.00 0.00 37.83 32.57 2w2f s LYS 54 CO 0.30 -0.35 0.34 0.00 -0.76 0.00 0.00 175.35 174.88 2w2f s ALA 55 N 0.90 -0.85 -0.16 5.17 0.00 -0.68 -4.54 121.76 121.61 2w2f s ALA 55 Ca 0.61 0.55 -0.23 0.00 0.00 0.00 0.00 51.96 52.90 2w2f s ALA 55 Cb -0.35 -0.10 -0.03 0.00 0.00 0.00 0.00 23.12 22.64 2w2f s ALA 55 CO 0.31 -0.24 0.70 0.34 0.00 0.00 0.00 175.76 176.87 2w2f s ASP 56 N -0.92 6.83 -0.15 0.00 2.15 -0.15 -4.27 116.67 120.16 2w2f s ASP 56 Ca -0.10 1.01 0.00 0.00 0.43 0.00 0.00 52.55 53.89 2w2f s ASP 56 Cb -0.04 -2.39 0.03 0.00 -0.30 0.00 0.00 42.92 40.22 2w2f s ASP 56 CO 0.03 -0.26 -0.10 -0.63 -0.17 0.00 0.00 175.17 174.04 2w2f s ILE 57 N 1.68 1.36 0.14 4.11 1.01 -1.26 -0.62 121.20 127.62 2w2f s ILE 57 Ca 0.33 -0.63 0.05 0.00 0.00 0.00 0.00 60.65 60.40 2w2f s ILE 57 Cb -0.16 -1.38 -0.04 0.00 0.01 0.00 0.00 42.46 40.88 2w2f s ILE 57 CO 0.13 0.31 -0.11 0.68 0.00 0.00 0.00 174.94 175.95 2w2f s VAL 58 N 1.55 1.19 -0.25 2.92 -7.23 -0.48 -4.97 120.40 113.13 2w2f s VAL 58 Ca 0.03 -1.98 -0.16 0.00 -1.81 0.00 0.00 61.98 58.05 2w2f s VAL 58 Cb -0.14 -1.76 -0.03 0.00 0.56 0.00 0.00 36.38 35.00 2w2f s VAL 58 CO -0.09 -0.68 0.44 -0.32 -0.31 0.00 0.00 175.10 174.14 2w2f s MET 59 N -3.50 4.07 -0.01 4.82 1.75 -1.26 -0.97 119.30 124.20 2w2f s MET 59 Ca 0.15 0.18 -0.25 0.00 -1.25 0.00 0.00 55.69 54.52 2w2f s MET 59 Cb 0.01 -3.63 -0.19 0.00 2.84 0.00 0.00 34.83 33.85 2w2f s MET 59 CO 0.01 -0.27 1.29 -0.07 -0.65 0.00 0.00 175.02 175.33 2w2f h LEU 60 N 8.51 0.07 -8.09 4.11 3.38 -0.85 -3.48 115.31 118.96 2w2f h LEU 60 Ca -0.31 -0.48 -0.03 0.00 0.09 0.00 0.00 57.88 57.15 2w2f h LEU 60 Cb 1.15 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.85 2w2f h LEU 60 CO 0.68 0.54 0.16 0.28 0.09 0.00 0.00 178.44 180.20 2w2f s THR 61 N -4.28 0.00 -0.42 0.22 -1.32 -1.23 -5.05 115.64 103.56 2w2f s THR 61 Ca -0.16 -1.11 -0.42 0.00 -1.21 0.00 0.00 61.69 58.79 2w2f s THR 61 Cb 0.02 -2.53 -0.17 0.00 -1.51 0.00 0.00 72.50 68.32 2w2f s THR 61 CO 0.69 0.00 1.95 1.21 -2.21 0.00 0.00 174.62 176.26 2w2f n GLU 62 N -0.50 0.47 -1.04 7.08 2.13 -1.26 -1.09 120.64 126.43 2w2f n GLU 62 Ca -0.05 0.15 -0.02 0.00 0.66 0.00 0.00 57.16 57.90 2w2f n GLU 62 Cb 0.60 -1.83 -0.01 0.00 0.27 0.00 0.00 31.44 30.47 2w2f n GLU 62 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2w2f n GLY 63 N 5.87 0.46 3.12 8.31 0.00 -1.17 -4.92 105.19 116.85 2w2f n GLY 63 Ca 0.41 -0.15 -0.32 0.00 0.00 0.00 0.00 46.02 45.96 2w2f n GLY 63 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2w2f s ILE 64 N -1.79 1.89 -0.08 -0.61 -1.09 -0.25 -4.09 121.20 115.19 2w2f s ILE 64 Ca 0.00 -0.86 0.03 0.00 -2.23 0.00 0.00 60.65 57.58 2w2f s ILE 64 Cb 0.00 -1.70 0.01 0.00 -1.58 0.00 0.00 42.46 39.19 2w2f s ILE 64 CO 0.00 0.52 -0.15 -0.31 -1.23 0.00 0.00 174.94 173.76 2w2f s TYR 65 N 1.03 1.76 -0.12 3.97 1.51 -0.48 -0.09 117.35 124.93 2w2f s TYR 65 Ca -0.03 -0.68 -0.00 0.00 -1.01 0.00 0.00 57.07 55.34 2w2f s TYR 65 Cb -0.15 -1.25 -0.02 0.00 -0.11 0.00 0.00 41.96 40.44 2w2f s TYR 65 CO -0.05 -0.32 -0.11 0.21 -1.11 0.00 0.00 175.55 174.17 2w2f s LYS 66 N 0.60 3.24 -0.04 -0.62 2.20 -0.14 -0.03 119.74 124.95 2w2f s LYS 66 Ca -0.15 -0.64 0.04 0.00 -0.36 0.00 0.00 55.97 54.85 2w2f s LYS 66 Cb -0.16 -2.64 0.00 0.00 -1.51 0.00 0.00 37.83 33.51 2w2f s LYS 66 CO 0.05 0.33 -0.14 0.42 -0.36 0.00 0.00 175.35 175.64 2w2f s ILE 67 N 0.06 1.22 -0.06 5.43 1.09 0.18 -1.38 121.20 127.73 2w2f s ILE 67 Ca -0.04 -0.59 0.02 0.00 -1.10 0.00 0.00 60.65 58.94 2w2f s ILE 67 Cb -0.14 -1.06 0.01 0.00 -1.06 0.00 0.00 42.46 40.21 2w2f s ILE 67 CO 0.04 0.36 -0.12 -0.44 -0.10 0.00 0.00 174.94 174.68 2w2f s SER 68 N 0.16 1.78 0.18 3.58 0.01 0.21 -0.99 113.70 118.63 2w2f s SER 68 Ca -0.05 -0.30 -0.10 0.00 1.31 0.00 0.00 55.95 56.81 2w2f s SER 68 Cb -0.11 -0.82 -0.00 0.00 0.21 0.00 0.00 66.02 65.29 2w2f s SER 68 CO 0.02 0.04 0.33 -1.66 0.41 0.00 0.00 173.24 172.38 2w2f s TRP 69 N 0.64 0.34 -0.04 2.43 -2.14 -0.64 -0.97 118.94 118.57 2w2f s TRP 69 Ca -0.14 -0.70 0.05 0.00 2.66 0.00 0.00 56.10 57.97 2w2f s TRP 69 Cb -0.16 0.02 -0.01 0.00 -3.10 0.00 0.00 33.47 30.22 2w2f s TRP 69 CO 0.04 -0.77 -0.20 -0.08 -2.66 0.00 0.00 176.95 173.28 2w2f s THR 70 N -3.96 1.61 0.36 0.66 -1.32 -1.26 -1.21 115.64 110.52 2w2f s THR 70 Ca 0.17 -0.84 0.06 0.00 -1.21 0.00 0.00 61.69 59.87 2w2f s THR 70 Cb 0.02 -1.37 -0.01 0.00 -1.51 0.00 0.00 72.50 69.64 2w2f s THR 70 CO 0.01 0.46 0.50 -1.61 -2.21 0.00 0.00 174.62 171.77 2w2f s GLU 71 N -0.16 3.08 0.46 7.08 2.02 0.18 -4.93 118.70 126.42 2w2f s GLU 71 Ca -0.00 -0.98 0.32 0.00 0.02 0.00 0.00 54.97 54.33 2w2f s GLU 71 Cb -0.11 -2.78 1.58 0.00 0.10 0.00 0.00 34.13 32.92 2w2f s GLU 71 CO 0.02 -0.02 1.96 -1.35 0.02 0.00 0.00 175.26 175.89 2w2f h PRO 72 N 0.81 0.00 0.00 0.39 0.11 -1.97 0.13 132.00 131.46 2w2f h PRO 72 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2w2f h PRO 72 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 2w2f h PRO 72 CO 0.52 0.00 -0.08 1.79 -0.21 0.00 0.00 178.00 180.03 2w2f h THR 73 N 0.00 0.00 0.00 -1.15 1.35 -1.95 -3.31 112.91 107.85 2w2f h THR 73 Ca 0.00 -0.98 0.00 0.00 -0.55 0.00 0.00 66.41 64.88 2w2f h THR 73 Cb 0.16 1.94 0.00 0.00 -1.73 0.00 0.00 68.15 68.52 2w2f h THR 73 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 2w2f n GLY 74 N 1.12 0.54 3.74 5.82 0.00 0.44 -4.66 105.19 112.18 2w2f n GLY 74 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 2w2f n GLY 74 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2w2f s THR 75 N -2.00 2.34 -0.07 2.61 2.01 -1.26 -4.67 115.64 114.60 2w2f s THR 75 Ca 0.00 0.27 -0.02 0.00 0.31 0.00 0.00 61.69 62.25 2w2f s THR 75 Cb 0.00 -3.18 -0.04 0.00 0.01 0.00 0.00 72.50 69.30 2w2f s THR 75 CO 0.00 0.04 0.05 -1.81 -0.69 0.00 0.00 174.62 172.21 2w2f s ASP 76 N 0.58 5.56 -0.03 3.53 1.01 -0.69 -0.65 116.67 125.98 2w2f s ASP 76 Ca 0.64 0.20 0.00 0.00 0.71 0.00 0.00 52.55 54.11 2w2f s ASP 76 Cb -0.45 -1.62 0.03 0.00 1.01 0.00 0.00 42.92 41.88 2w2f s ASP 76 CO 0.43 0.36 -0.00 -0.69 0.21 0.00 0.00 175.17 175.48 2w2f s VAL 77 N -0.99 0.18 -0.20 -1.27 1.01 -0.35 -0.42 120.40 118.36 2w2f s VAL 77 Ca 0.16 0.07 -0.01 0.00 0.00 0.00 0.00 61.98 62.20 2w2f s VAL 77 Cb -0.12 -0.27 0.05 0.00 0.00 0.00 0.00 36.38 36.05 2w2f s VAL 77 CO 0.05 0.14 -0.02 0.00 0.00 0.00 0.00 175.10 175.28 2w2f s ALA 78 N 0.97 1.47 -0.12 5.51 0.00 -0.55 -1.61 121.76 127.42 2w2f s ALA 78 Ca -0.10 -0.96 -0.04 0.00 0.00 0.00 0.00 51.96 50.86 2w2f s ALA 78 Cb -0.13 -1.25 -0.03 0.00 0.00 0.00 0.00 23.12 21.70 2w2f s ALA 78 CO -0.02 -1.06 0.02 -0.51 0.00 0.00 0.00 175.76 174.19 2w2f s LEU 79 N 1.63 3.65 -0.30 0.00 1.43 -0.16 -1.29 118.68 123.63 2w2f s LEU 79 Ca -0.02 0.11 0.02 0.00 -1.03 0.00 0.00 54.13 53.20 2w2f s LEU 79 Cb -0.17 -1.87 0.07 0.00 0.03 0.00 0.00 46.19 44.25 2w2f s LEU 79 CO -0.07 0.29 -0.01 -1.81 0.23 0.00 0.00 176.35 174.98 2w2f s ASP 80 N -0.36 4.71 -0.17 2.29 1.11 0.57 -0.65 116.67 124.17 2w2f s ASP 80 Ca 0.08 -1.63 -0.19 0.00 0.18 0.00 0.00 52.55 50.99 2w2f s ASP 80 Cb -0.12 -1.64 -0.03 0.00 1.07 0.00 0.00 42.92 42.20 2w2f s ASP 80 CO 0.02 -0.29 0.53 -0.36 1.18 0.00 0.00 175.17 176.24 2w2f s PHE 81 N 1.09 3.42 -0.69 4.23 0.40 0.95 -1.42 117.98 125.96 2w2f s PHE 81 Ca -0.01 0.84 0.05 0.00 -0.60 0.00 0.00 56.93 57.21 2w2f s PHE 81 Cb -0.20 -2.65 0.23 0.00 0.51 0.00 0.00 43.02 40.91 2w2f s PHE 81 CO -0.05 -0.02 0.73 -1.33 0.70 0.00 0.00 175.22 175.25 2w2f n MET 82 N 4.44 2.48 0.26 0.44 2.81 0.30 -1.38 117.12 126.47 2w2f n MET 82 Ca -0.05 -4.62 0.14 0.00 -1.81 0.00 0.00 57.70 51.36 2w2f n MET 82 Cb 0.51 -2.29 0.62 0.00 -0.71 0.00 0.00 33.22 31.35 2w2f n MET 82 CO 0.00 0.00 0.00 -1.00 1.51 0.00 0.00 175.97 176.48 2w2f h PRO 83 N 4.62 0.00 0.00 0.03 0.13 -1.71 -1.28 132.00 133.79 2w2f h PRO 83 Ca 0.19 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.30 2w2f h PRO 83 Cb 0.69 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.81 2w2f h PRO 83 CO 0.84 0.11 -0.06 -0.91 -0.23 0.00 0.00 178.00 177.76 2w2f h ASN 84 N 0.00 0.00 -0.43 1.44 2.35 -1.88 -2.44 115.58 114.62 2w2f h ASN 84 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2w2f h ASN 84 Cb 0.56 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.93 2w2f h ASN 84 CO 0.01 0.06 0.00 -0.62 -1.65 0.00 0.00 177.43 175.23 2w2f n GLU 85 N -3.19 2.84 -3.95 0.81 1.02 -0.53 -4.98 120.64 112.65 2w2f n GLU 85 Ca 0.00 -2.18 -0.29 0.00 -0.02 0.00 0.00 57.16 54.67 2w2f n GLU 85 Cb 0.32 -1.33 0.01 0.00 -0.02 0.00 0.00 31.44 30.41 2w2f n GLU 85 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2w2f n LYS 86 N 0.76 -4.48 -4.09 3.49 5.02 -0.92 -4.95 118.16 112.98 2w2f n LYS 86 Ca 0.14 0.52 -0.14 0.00 -2.02 0.00 0.00 58.31 56.81 2w2f n LYS 86 Cb 0.47 -5.17 -0.12 0.00 -0.02 0.00 0.00 35.03 30.19 2w2f n LYS 86 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2w2f s LYS 87 N -6.56 0.54 0.03 1.97 -0.14 -0.91 -2.15 119.74 112.52 2w2f s LYS 87 Ca 0.44 -0.67 -0.00 0.00 -1.36 0.00 0.00 55.97 54.37 2w2f s LYS 87 Cb -0.23 -0.36 -0.03 0.00 -1.68 0.00 0.00 37.83 35.53 2w2f s LYS 87 CO 0.86 0.07 -0.03 -1.17 -0.76 0.00 0.00 175.35 174.32 2w2f s LEU 88 N -1.32 2.36 -0.13 3.17 0.20 -0.81 -0.54 118.68 121.60 2w2f s LEU 88 Ca -0.07 -0.74 0.02 0.00 0.69 0.00 0.00 54.13 54.03 2w2f s LEU 88 Cb -0.09 0.14 0.01 0.00 -0.43 0.00 0.00 46.19 45.83 2w2f s LEU 88 CO 0.00 -0.44 -0.18 -2.28 -0.29 0.00 0.00 176.35 173.16 2w2f s HIS 89 N -2.63 2.34 -0.06 5.38 5.65 -0.51 -0.03 115.29 125.43 2w2f s HIS 89 Ca -0.05 -1.20 0.04 0.00 0.25 0.00 0.00 55.06 54.11 2w2f s HIS 89 Cb -0.01 -1.64 -0.02 0.00 -1.18 0.00 0.00 32.58 29.72 2w2f s HIS 89 CO -0.05 -0.59 -0.18 0.20 -0.65 0.00 0.00 174.74 173.46 2w2f s GLY 90 N 1.03 1.44 -0.16 1.59 0.00 -0.34 -0.32 107.32 110.58 2w2f s GLY 90 Ca -0.04 -1.01 0.01 0.00 0.00 0.00 0.00 44.72 43.69 2w2f s GLY 90 CO -0.04 -0.69 -0.17 -1.59 0.00 0.00 0.00 173.10 170.60 2w2f s THR 91 N -0.45 2.42 -0.11 0.90 2.01 -0.41 -0.89 115.64 119.11 2w2f s THR 91 Ca 0.05 -0.85 0.02 0.00 0.31 0.00 0.00 61.69 61.23 2w2f s THR 91 Cb -0.12 -2.01 -0.01 0.00 0.01 0.00 0.00 72.50 70.37 2w2f s THR 91 CO 0.02 0.52 -0.17 -0.63 -0.69 0.00 0.00 174.62 173.67 2w2f s ILE 92 N 0.93 2.68 -0.39 1.82 1.01 -0.08 -1.49 121.20 125.69 2w2f s ILE 92 Ca -0.03 -0.81 -0.04 0.00 0.00 0.00 0.00 60.65 59.77 2w2f s ILE 92 Cb -0.15 -2.08 0.10 0.00 0.01 0.00 0.00 42.46 40.33 2w2f s ILE 92 CO -0.03 0.54 0.18 -0.36 0.00 0.00 0.00 174.94 175.27 2w2f s PHE 93 N 0.22 3.50 -0.10 3.97 0.40 0.43 -0.03 117.98 126.37 2w2f s PHE 93 Ca -0.11 -2.19 -0.18 0.00 -0.60 0.00 0.00 56.93 53.86 2w2f s PHE 93 Cb -0.16 -3.00 -0.04 0.00 0.51 0.00 0.00 43.02 40.33 2w2f s PHE 93 CO 0.06 -0.93 0.47 -0.06 0.70 0.00 0.00 175.22 175.46 2w2f s PHE 94 N 1.20 3.54 0.68 0.36 0.08 0.79 -1.71 117.98 122.94 2w2f s PHE 94 Ca 0.05 0.90 -0.17 0.00 0.12 0.00 0.00 56.93 57.84 2w2f s PHE 94 Cb -0.22 -2.51 0.00 0.00 -0.57 0.00 0.00 43.02 39.72 2w2f s PHE 94 CO -0.03 0.24 1.19 -2.30 -0.10 0.00 0.00 175.22 174.22 2w2f n PRO 95 N 3.40 0.84 -0.29 0.24 -0.02 -1.26 -1.10 135.00 136.80 2w2f n PRO 95 Ca -0.08 0.34 0.12 0.00 -2.02 0.00 0.00 63.50 61.86 2w2f n PRO 95 Cb 0.52 -2.43 0.28 0.00 -0.02 0.00 0.00 33.50 31.85 2w2f n PRO 95 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 2w2f h LYS 96 N 0.15 0.26 0.00 -0.52 1.63 -0.14 -1.78 116.57 116.17 2w2f h LYS 96 Ca -0.49 -0.02 -0.06 0.00 -0.85 0.00 0.00 60.65 59.23 2w2f h LYS 96 Cb 1.34 -0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 32.90 2w2f h LYS 96 CO 0.51 0.17 -0.29 0.11 -3.45 0.00 0.00 179.45 176.50 2w2f h TRP 97 N 0.26 0.00 -0.23 1.91 5.08 -1.43 -1.67 115.95 119.87 2w2f h TRP 97 Ca 0.54 0.00 -0.13 0.00 1.08 0.00 0.00 58.89 60.38 2w2f h TRP 97 Cb 1.05 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.21 2w2f h TRP 97 CO -0.23 0.29 -0.37 0.28 -1.28 0.00 0.00 178.44 177.13 2w2f h VAL 98 N 0.00 1.31 -0.21 0.12 2.07 -1.61 -2.25 116.25 115.68 2w2f h VAL 98 Ca -0.00 -1.57 -0.03 0.00 0.82 0.00 0.00 66.70 65.91 2w2f h VAL 98 Cb 0.60 1.75 -0.01 0.00 -1.52 0.00 0.00 31.29 32.11 2w2f h VAL 98 CO 0.04 0.49 -0.02 -0.08 0.02 0.00 0.00 177.57 178.03 2w2f h GLU 99 N 0.37 0.30 0.07 1.57 4.81 -1.34 -1.67 114.58 118.70 2w2f h GLU 99 Ca 0.02 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.20 2w2f h GLU 99 Cb 0.96 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.29 2w2f h GLU 99 CO 0.08 0.35 -0.03 1.49 -0.73 0.00 0.00 179.01 180.17 2w2f h GLU 100 N 0.30 -0.09 -2.09 1.92 4.57 -1.26 -3.40 114.58 114.53 2w2f h GLU 100 Ca 0.07 0.01 -0.56 0.00 -1.18 0.00 0.00 59.36 57.69 2w2f h GLU 100 Cb 0.23 0.02 -0.40 0.00 -0.16 0.00 0.00 28.75 28.44 2w2f h GLU 100 CO 0.01 0.48 -0.91 0.72 -1.18 0.00 0.00 179.01 178.12 2w2f n HIS 101 N -4.83 1.49 0.25 0.92 8.25 -0.86 -4.97 115.22 115.47 2w2f n HIS 101 Ca -0.08 -3.84 0.11 0.00 -0.26 0.00 0.00 57.72 53.65 2w2f n HIS 101 Cb 0.30 -0.44 0.66 0.00 1.12 0.00 0.00 29.99 31.63 2w2f n HIS 101 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2w2f h PRO 102 N 3.74 0.00 -1.08 -0.41 0.13 -1.52 -3.08 132.00 129.77 2w2f h PRO 102 Ca 0.12 0.00 0.31 0.00 -0.87 0.00 0.00 66.00 65.56 2w2f h PRO 102 Cb 0.78 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 31.86 2w2f h PRO 102 CO 0.63 0.15 0.76 1.05 -0.23 0.00 0.00 178.00 180.36 2w2f h GLU 103 N 0.00 0.09 -0.16 0.86 9.09 -1.87 -0.57 114.58 122.02 2w2f h GLU 103 Ca -0.00 -0.01 -0.04 0.00 0.05 0.00 0.00 59.36 59.36 2w2f h GLU 103 Cb 0.37 -0.02 -0.01 0.00 -1.65 0.00 0.00 28.75 27.44 2w2f h GLU 103 CO 0.02 0.06 -0.08 0.82 0.05 0.00 0.00 179.01 179.88 2w2f h ILE 104 N 0.09 1.15 0.00 -1.06 2.04 -1.94 -2.93 117.51 114.86 2w2f h ILE 104 Ca 0.54 -0.64 0.00 0.00 1.00 0.00 0.00 64.86 65.75 2w2f h ILE 104 Cb 1.95 1.12 0.00 0.00 -0.74 0.00 0.00 36.82 39.15 2w2f h ILE 104 CO -0.07 0.20 -0.61 0.35 0.00 0.00 0.00 178.15 178.02 2w2f n THR 105 N -4.32 0.04 -2.74 -0.27 -2.24 -0.22 -4.72 114.28 99.80 2w2f n THR 105 Ca -0.01 -0.04 -0.43 0.00 -2.27 0.00 0.00 64.05 61.30 2w2f n THR 105 Cb 0.23 0.31 0.00 0.00 -2.10 0.00 0.00 70.33 68.77 2w2f n THR 105 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2w2f n VAL 106 N -1.58 4.12 -3.82 2.28 0.31 -1.11 -4.62 118.33 113.91 2w2f n VAL 106 Ca 0.05 -4.42 -0.08 0.00 -0.01 0.00 0.00 64.34 59.88 2w2f n VAL 106 Cb 0.35 -2.42 0.02 0.00 -0.91 0.00 0.00 33.84 30.88 2w2f n VAL 106 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 2w2f s THR 107 N 2.58 0.00 -0.82 2.52 -1.32 -1.25 -4.63 115.64 112.72 2w2f s THR 107 Ca 0.47 -0.95 -0.25 0.00 -1.21 0.00 0.00 61.69 59.74 2w2f s THR 107 Cb 0.01 -2.76 -0.00 0.00 -1.51 0.00 0.00 72.50 68.23 2w2f s THR 107 CO 0.03 0.00 1.67 -0.47 -2.21 0.00 0.00 174.62 173.64 2w2f s TYR 108 N -2.50 2.03 0.50 9.09 5.04 -1.26 -2.16 117.35 128.09 2w2f s TYR 108 Ca 0.15 0.20 0.17 0.00 -2.44 0.00 0.00 57.07 55.15 2w2f s TYR 108 Cb -0.05 -4.33 1.23 0.00 0.35 0.00 0.00 41.96 39.17 2w2f s TYR 108 CO 0.10 -2.01 2.08 1.96 -1.34 0.00 0.00 175.55 176.34 2w2f h GLN 109 N 11.67 0.10 -0.60 4.97 4.20 -1.75 -1.42 115.11 132.29 2w2f h GLN 109 Ca -0.05 -0.01 0.17 0.00 0.06 0.00 0.00 58.65 58.83 2w2f h GLN 109 Cb 1.06 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.79 2w2f h GLN 109 CO 1.28 0.07 0.44 -0.91 -0.67 0.00 0.00 178.83 179.03 2w2f h ASN 110 N 0.10 0.00 0.48 1.46 4.21 -1.90 0.17 115.58 120.10 2w2f h ASN 110 Ca 0.11 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.62 2w2f h ASN 110 Cb 0.31 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.51 2w2f h ASN 110 CO -0.01 0.00 -0.36 -0.62 -1.29 0.00 0.00 177.43 175.15 2w2f n GLU 111 N -4.31 0.25 -2.20 0.81 1.02 -0.53 -4.24 120.64 111.44 2w2f n GLU 111 Ca 0.11 -0.13 -0.10 0.00 -0.02 0.00 0.00 57.16 57.03 2w2f n GLU 111 Cb 0.68 -1.50 0.05 0.00 -0.02 0.00 0.00 31.44 30.65 2w2f n GLU 111 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 2w2f n HIS 112 N -1.26 1.70 0.13 -0.32 8.25 0.01 -4.89 115.22 118.84 2w2f n HIS 112 Ca 0.08 -1.99 -0.13 0.00 -0.26 0.00 0.00 57.72 55.41 2w2f n HIS 112 Cb 0.33 -0.27 -0.07 0.00 1.12 0.00 0.00 29.99 31.10 2w2f n HIS 112 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 2w2f h ILE 113 N 3.86 0.78 -0.46 1.59 1.08 -1.64 -1.94 117.51 120.79 2w2f h ILE 113 Ca 0.08 0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.65 2w2f h ILE 113 Cb 1.41 0.78 -0.10 0.00 -3.07 0.00 0.00 36.82 35.85 2w2f h ILE 113 CO 0.41 0.00 -0.24 0.44 -0.69 0.00 0.00 178.15 178.07 2w2f h ASP 114 N -0.27 -0.81 -0.17 1.72 3.32 -1.90 -0.84 116.42 117.47 2w2f h ASP 114 Ca -0.02 0.18 0.05 0.00 0.02 0.00 0.00 57.03 57.26 2w2f h ASP 114 Cb 0.22 0.43 -0.05 0.00 0.22 0.00 0.00 39.33 40.15 2w2f h ASP 114 CO 0.03 -0.26 -0.15 0.25 -1.72 0.00 0.00 179.24 177.39 2w2f h LEU 115 N -0.14 -0.46 -0.76 1.55 5.85 -1.89 -0.40 115.31 119.06 2w2f h LEU 115 Ca 0.22 0.09 0.04 0.00 0.84 0.00 0.00 57.88 59.07 2w2f h LEU 115 Cb 0.48 0.23 -0.05 0.00 0.37 0.00 0.00 40.66 41.69 2w2f h LEU 115 CO -0.55 -0.19 0.47 0.24 -0.34 0.00 0.00 178.44 178.08 2w2f h MET 116 N -0.16 0.89 -0.10 1.25 2.86 -0.73 -0.48 114.93 118.45 2w2f h MET 116 Ca 0.11 -0.05 -0.17 0.00 -2.06 0.00 0.00 59.70 57.52 2w2f h MET 116 Cb 0.32 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 31.77 2w2f h MET 116 CO -0.27 0.59 -0.67 0.93 1.06 0.00 0.00 176.91 178.55 2w2f h GLU 117 N 0.91 0.41 -0.27 1.72 5.08 -0.96 -1.41 114.58 120.06 2w2f h GLU 117 Ca 0.31 -0.31 -0.17 0.00 -1.00 0.00 0.00 59.36 58.19 2w2f h GLU 117 Cb 0.06 0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.36 2w2f h GLU 117 CO -0.13 0.94 -0.51 1.96 -1.00 0.00 0.00 179.01 180.27 2w2f h GLN 118 N 0.30 0.77 -0.20 2.33 4.20 -0.69 -2.93 115.11 118.88 2w2f h GLN 118 Ca -0.02 -0.47 -0.05 0.00 0.06 0.00 0.00 58.65 58.18 2w2f h GLN 118 Cb 1.22 0.05 -0.01 0.00 0.30 0.00 0.00 27.48 29.04 2w2f h GLN 118 CO 0.12 1.09 -0.06 0.77 -0.67 0.00 0.00 178.83 180.08 2w2f h SER 119 N 0.60 0.40 0.03 1.46 0.02 -1.05 -2.51 113.55 112.50 2w2f h SER 119 Ca 0.02 -0.37 -0.01 0.00 -0.84 0.00 0.00 61.79 60.59 2w2f h SER 119 Cb 1.09 -0.11 -0.00 0.00 0.14 0.00 0.00 62.40 63.52 2w2f h SER 119 CO 0.11 0.68 -0.02 0.08 -1.14 0.00 0.00 176.83 176.54 2w2f h ARG 120 N 0.11 0.00 0.11 3.45 0.11 -1.28 -1.82 114.38 115.07 2w2f h ARG 120 Ca 0.05 0.00 -0.29 0.00 0.10 0.00 0.00 59.98 59.84 2w2f h ARG 120 Cb 0.51 0.00 0.03 0.00 1.11 0.00 0.00 29.97 31.62 2w2f h ARG 120 CO 0.02 0.02 -1.23 0.93 0.10 0.00 0.00 179.97 179.82 2w2f h GLU 121 N 0.00 0.60 0.00 0.08 4.39 -1.37 -3.39 114.58 114.89 2w2f h GLU 121 Ca -0.00 -0.79 -0.21 0.00 0.34 0.00 0.00 59.36 58.69 2w2f h GLU 121 Cb 0.05 0.26 -0.04 0.00 -0.10 0.00 0.00 28.75 28.92 2w2f h GLU 121 CO 0.00 1.36 -1.58 0.36 -1.16 0.00 0.00 179.01 177.99 2w2f n LYS 122 N -3.77 0.63 -2.61 2.33 2.85 -0.96 -4.95 118.16 111.68 2w2f n LYS 122 Ca -0.13 0.22 -0.24 0.00 -1.05 0.00 0.00 58.31 57.11 2w2f n LYS 122 Cb 0.98 -1.78 0.12 0.00 -0.65 0.00 0.00 35.03 33.70 2w2f n LYS 122 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 2w2f s TYR 123 N -2.81 1.31 0.18 5.58 2.02 -0.70 -5.07 117.35 117.86 2w2f s TYR 123 Ca -0.04 -0.36 -0.30 0.00 -0.37 0.00 0.00 57.07 56.00 2w2f s TYR 123 Cb 0.08 -2.99 -0.08 0.00 -0.40 0.00 0.00 41.96 38.57 2w2f s TYR 123 CO 0.82 -1.84 1.02 0.00 -1.57 0.00 0.00 175.55 173.98 2w2f s ALA 124 N -3.19 3.33 -0.14 3.71 0.00 -1.26 -4.93 121.76 119.28 2w2f s ALA 124 Ca 0.68 0.71 0.15 0.00 0.00 0.00 0.00 51.96 53.50 2w2f s ALA 124 Cb -0.04 -3.30 -0.24 0.00 0.00 0.00 0.00 23.12 19.54 2w2f s ALA 124 CO 0.45 -0.05 0.29 2.41 0.00 0.00 0.00 175.76 178.86 2w2f n THR 125 N 2.15 1.48 -4.51 0.00 -1.04 -1.26 -1.23 114.28 109.87 2w2f n THR 125 Ca 0.01 -0.82 -0.27 0.00 -2.04 0.00 0.00 64.05 60.93 2w2f n THR 125 Cb 0.47 -0.73 -0.13 0.00 -1.82 0.00 0.00 70.33 68.12 2w2f n THR 125 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 2w2f s TYR 126 N -2.53 2.07 0.51 -1.42 2.02 -1.26 0.37 117.35 117.10 2w2f s TYR 126 Ca -0.09 -0.40 -0.20 0.00 -0.37 0.00 0.00 57.07 56.01 2w2f s TYR 126 Cb 0.07 -1.17 -0.07 0.00 -0.40 0.00 0.00 41.96 40.39 2w2f s TYR 126 CO 0.82 0.21 1.08 -2.14 -1.57 0.00 0.00 175.55 173.96 2w2f s PRO 127 N -1.69 3.62 0.52 -1.71 0.02 -1.26 -4.80 135.00 129.71 2w2f s PRO 127 Ca 0.10 1.49 -0.22 0.00 0.02 0.00 0.00 61.00 62.39 2w2f s PRO 127 Cb -0.10 -2.08 -0.06 0.00 0.02 0.00 0.00 34.50 32.28 2w2f s PRO 127 CO 0.04 -0.60 1.27 0.15 -0.33 0.00 0.00 177.00 177.53 2w2f s LYS 128 N -3.21 3.33 -0.31 5.54 -0.14 -1.24 -3.61 119.74 120.10 2w2f s LYS 128 Ca 0.69 2.02 -0.20 0.00 -1.36 0.00 0.00 55.97 57.12 2w2f s LYS 128 Cb -0.20 -2.26 -0.01 0.00 -1.68 0.00 0.00 37.83 33.68 2w2f s LYS 128 CO 0.24 -0.97 0.64 -1.17 -0.76 0.00 0.00 175.35 173.32 2w2f s LEU 129 N -3.43 4.16 -0.24 3.17 2.96 -0.26 -4.94 118.68 120.10 2w2f s LEU 129 Ca 0.70 0.40 -0.07 0.00 -0.22 0.00 0.00 54.13 54.94 2w2f s LEU 129 Cb -0.35 -2.83 -0.03 0.00 0.50 0.00 0.00 46.19 43.49 2w2f s LEU 129 CO 0.41 -0.50 0.06 -0.69 -1.32 0.00 0.00 176.35 174.31 2w2f s VAL 130 N 2.64 4.24 -0.56 1.68 1.01 -1.26 -0.15 120.40 128.00 2w2f s VAL 130 Ca 0.25 -0.20 -0.01 0.00 0.00 0.00 0.00 61.98 62.03 2w2f s VAL 130 Cb -0.15 -2.97 0.14 0.00 0.00 0.00 0.00 36.38 33.41 2w2f s VAL 130 CO 0.12 0.36 0.35 -0.69 0.00 0.00 0.00 175.10 175.24 2w2f s VAL 131 N 1.50 3.34 -0.41 2.92 1.01 0.95 -4.97 120.40 124.75 2w2f s VAL 131 Ca 0.06 -2.89 -0.14 0.00 0.00 0.00 0.00 61.98 59.00 2w2f s VAL 131 Cb -0.15 -3.23 0.02 0.00 0.00 0.00 0.00 36.38 33.02 2w2f s VAL 131 CO 0.03 -0.82 0.29 -2.16 0.00 0.00 0.00 175.10 172.43 2w2f s PRO 132 N 0.09 2.94 -0.00 2.72 0.04 -1.26 -0.90 135.00 138.64 2w2f s PRO 132 Ca 0.15 -1.04 -0.01 0.00 0.04 0.00 0.00 61.00 60.15 2w2f s PRO 132 Cb -0.22 -3.94 -0.00 0.00 0.04 0.00 0.00 34.50 30.38 2w2f s PRO 132 CO -0.03 -0.75 0.02 -1.21 0.04 0.00 0.00 177.00 175.07 2w2f s GLU 133 N 1.66 0.09 0.61 4.56 0.41 -0.07 -5.00 118.70 120.96 2w2f s GLU 133 Ca 0.05 -0.09 -0.17 0.00 -0.41 0.00 0.00 54.97 54.34 2w2f s GLU 133 Cb -0.19 0.03 -0.02 0.00 -1.78 0.00 0.00 34.13 32.17 2w2f s GLU 133 CO 0.09 -0.01 1.13 -0.06 -0.49 0.00 0.00 175.26 175.92 2w2f s PHE 134 N -0.29 2.58 0.04 1.61 0.08 -1.26 -1.19 117.98 119.55 2w2f s PHE 134 Ca -0.03 1.55 0.01 0.00 0.12 0.00 0.00 56.93 58.58 2w2f s PHE 134 Cb -0.02 -3.26 -0.03 0.00 -0.57 0.00 0.00 43.02 39.14 2w2f s PHE 134 CO -0.00 -1.75 -0.05 0.00 -0.10 0.00 0.00 175.22 173.32 2w2f s ALA 135 N -2.03 0.44 -0.22 5.36 0.00 0.95 -1.29 121.76 124.97 2w2f s ALA 135 Ca 0.71 -0.80 -0.08 0.00 0.00 0.00 0.00 51.96 51.78 2w2f s ALA 135 Cb -0.23 0.12 -0.04 0.00 0.00 0.00 0.00 23.12 22.97 2w2f s ALA 135 CO 0.35 -0.13 0.09 1.21 0.00 0.00 0.00 175.76 177.29 2w2f s ASN 136 N -1.81 5.55 -0.24 0.00 2.47 0.03 -1.93 114.94 119.00 2w2f s ASN 136 Ca -0.08 -0.03 -0.28 0.00 0.42 0.00 0.00 52.86 52.88 2w2f s ASN 136 Cb -0.07 -1.98 0.01 0.00 -1.45 0.00 0.00 41.25 37.76 2w2f s ASN 136 CO -0.02 0.06 1.02 -0.63 -3.72 0.00 0.00 177.10 173.81 2w2f s ILE 137 N 1.04 4.68 -0.49 -5.21 1.01 -0.91 -0.78 121.20 120.54 2w2f s ILE 137 Ca 0.05 1.93 0.18 0.00 0.00 0.00 0.00 60.65 62.80 2w2f s ILE 137 Cb -0.14 -4.30 -0.23 0.00 0.01 0.00 0.00 42.46 37.80 2w2f s ILE 137 CO 0.03 -0.21 0.60 0.35 0.00 0.00 0.00 174.94 175.72 2w2f n THR 138 N 5.39 0.00 -3.73 2.92 -2.24 0.50 -4.92 114.28 112.20 2w2f n THR 138 Ca 0.11 -0.22 -0.12 0.00 -2.27 0.00 0.00 64.05 61.54 2w2f n THR 138 Cb 0.46 0.61 -0.11 0.00 -2.10 0.00 0.00 70.33 69.20 2w2f n THR 138 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2w2f s TYR 139 N -2.92 -0.46 -0.05 4.78 5.04 -1.06 -4.96 117.35 117.72 2w2f s TYR 139 Ca 0.01 1.07 -0.02 0.00 -2.44 0.00 0.00 57.07 55.69 2w2f s TYR 139 Cb 0.13 0.17 0.03 0.00 0.35 0.00 0.00 41.96 42.63 2w2f s TYR 139 CO 0.74 -0.24 0.04 -1.64 -1.34 0.00 0.00 175.55 173.11 2w2f s MET 140 N 0.57 0.12 0.08 4.97 -1.94 -1.26 -1.52 119.30 120.32 2w2f s MET 140 Ca -0.03 0.30 0.07 0.00 -1.71 0.00 0.00 55.69 54.32 2w2f s MET 140 Cb -0.05 -0.63 -0.03 0.00 2.01 0.00 0.00 34.83 36.13 2w2f s MET 140 CO -0.03 -0.32 -0.18 0.20 -0.01 0.00 0.00 175.02 174.67 2w2f s GLY 141 N 2.08 1.09 -0.50 -0.03 0.00 -0.09 -4.96 107.32 104.91 2w2f s GLY 141 Ca 0.05 -1.13 -0.23 0.00 0.00 0.00 0.00 44.72 43.41 2w2f s GLY 141 CO -0.04 -1.13 0.82 -0.35 0.00 0.00 0.00 173.10 172.41 2w2f s ASP 142 N -1.74 6.35 0.06 1.64 2.15 -1.26 -0.54 116.67 123.33 2w2f s ASP 142 Ca 0.04 -0.36 0.23 0.00 0.43 0.00 0.00 52.55 52.89 2w2f s ASP 142 Cb -0.10 -2.39 0.16 0.00 -0.30 0.00 0.00 42.92 40.30 2w2f s ASP 142 CO 0.03 -1.04 1.14 0.00 -0.17 0.00 0.00 175.17 175.13 2w2f n ALA 143 N 6.93 3.31 -0.05 3.66 0.00 -0.31 -4.94 120.51 129.10 2w2f n ALA 143 Ca 0.00 -0.36 0.01 0.00 0.00 0.00 0.00 53.44 53.09 2w2f n ALA 143 Cb 0.47 -1.03 -0.00 0.00 0.00 0.00 0.00 19.45 18.89 2w2f n ALA 143 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2w2f n GLY 144 N 1.37 -1.67 3.90 0.00 0.00 -1.14 -4.74 105.19 102.91 2w2f n GLY 144 Ca 0.03 -1.50 -0.31 0.00 0.00 0.00 0.00 46.02 44.23 2w2f n GLY 144 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2w2f s GLN 145 N -1.61 3.57 -1.34 1.61 -0.21 -1.26 -4.43 119.66 115.99 2w2f s GLN 145 Ca 0.00 -0.18 -0.07 0.00 0.02 0.00 0.00 55.36 55.13 2w2f s GLN 145 Cb 0.00 -2.88 0.02 0.00 1.00 0.00 0.00 33.01 31.14 2w2f s GLN 145 CO 0.00 0.49 1.09 0.09 -2.12 0.00 0.00 175.29 174.84 2w2f n ASN 146 N 0.06 -4.87 -4.44 5.90 3.02 0.15 -4.97 115.26 110.10 2w2f n ASN 146 Ca -0.03 -0.60 -0.44 0.00 -0.03 0.00 0.00 54.58 53.48 2w2f n ASN 146 Cb 0.52 -4.88 -0.06 0.00 -0.61 0.00 0.00 39.78 34.75 2w2f n ASN 146 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2w2f s ASN 147 N -3.63 6.23 0.08 6.41 3.84 -1.26 -4.94 114.94 121.67 2w2f s ASN 147 Ca 0.42 -0.92 0.23 0.00 0.21 0.00 0.00 52.86 52.80 2w2f s ASN 147 Cb -0.19 -2.31 0.93 0.00 -0.55 0.00 0.00 41.25 39.13 2w2f s ASN 147 CO 0.75 -0.95 1.72 -0.62 -2.79 0.00 0.00 177.10 175.20 2w2f n GLU 148 N 6.32 0.08 0.10 0.43 -0.58 -1.26 -3.40 120.64 122.33 2w2f n GLU 148 Ca -0.06 0.19 0.04 0.00 -0.42 0.00 0.00 57.16 56.91 2w2f n GLU 148 Cb 0.45 -1.62 -0.00 0.00 -0.57 0.00 0.00 31.44 29.70 2w2f n GLU 148 CO 0.00 0.00 0.00 -0.44 -0.48 0.00 0.00 177.13 176.21 2w2f h ASP 149 N 0.00 0.00 0.27 1.62 5.19 -1.92 -3.40 116.42 118.18 2w2f h ASP 149 Ca 0.00 0.00 0.01 0.00 -0.62 0.00 0.00 57.03 56.42 2w2f h ASP 149 Cb 0.44 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 39.92 2w2f h ASP 149 CO 0.00 0.38 -0.43 0.58 -3.12 0.00 0.00 179.24 176.66 2w2f h VAL 150 N 0.00 0.15 -3.56 -1.35 2.07 -1.81 -3.32 116.25 108.43 2w2f h VAL 150 Ca -0.06 0.00 -0.67 0.00 0.82 0.00 0.00 66.70 66.79 2w2f h VAL 150 Cb 1.34 0.15 -0.38 0.00 -1.52 0.00 0.00 31.29 30.88 2w2f h VAL 150 CO 0.04 0.00 -0.61 -0.63 0.02 0.00 0.00 177.57 176.39 2w2f s ILE 151 N -5.92 2.81 0.00 4.57 -1.09 -1.26 -4.88 121.20 115.43 2w2f s ILE 151 Ca -0.17 -2.48 0.00 0.00 -2.23 0.00 0.00 60.65 55.77 2w2f s ILE 151 Cb 0.06 -2.97 0.00 0.00 -1.58 0.00 0.00 42.46 37.97 2w2f s ILE 151 CO 0.62 -0.69 0.40 -1.54 -1.23 0.00 0.00 174.94 172.50 2w2f n SER 152 N 4.09 0.00 -3.86 3.58 3.41 -1.25 -4.89 113.62 114.70 2w2f n SER 152 Ca 0.03 -1.03 -0.10 0.00 -0.26 0.00 0.00 58.87 57.51 2w2f n SER 152 Cb 0.40 -0.01 -0.06 0.00 -0.26 0.00 0.00 64.21 64.28 2w2f n SER 152 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 2w2f s GLU 153 N 0.00 1.24 0.51 4.33 -1.05 -1.26 -5.09 118.70 117.38 2w2f s GLU 153 Ca 0.00 -1.03 -0.21 0.00 -0.15 0.00 0.00 54.97 53.58 2w2f s GLU 153 Cb 0.00 0.44 -0.06 0.00 -0.44 0.00 0.00 34.13 34.07 2w2f s GLU 153 CO 0.00 -0.49 1.18 0.00 0.95 0.00 0.00 175.26 176.90 2w2f s ALA 154 N -3.92 2.82 0.67 -0.84 0.00 -1.26 -4.98 121.76 114.23 2w2f s ALA 154 Ca 0.13 0.96 -0.17 0.00 0.00 0.00 0.00 51.96 52.88 2w2f s ALA 154 Cb 0.01 -3.41 0.00 0.00 0.00 0.00 0.00 23.12 19.73 2w2f s ALA 154 CO -0.02 -0.84 1.21 -1.25 0.00 0.00 0.00 175.76 174.87 2w2f s PRO 155 N -2.98 2.54 0.10 0.00 0.04 -1.26 -5.06 135.00 128.37 2w2f s PRO 155 Ca 0.69 1.80 0.03 0.00 0.04 0.00 0.00 61.00 63.56 2w2f s PRO 155 Cb -0.29 -1.88 -0.04 0.00 0.04 0.00 0.00 34.50 32.34 2w2f s PRO 155 CO 0.34 -1.54 -0.09 1.52 0.04 0.00 0.00 177.00 177.26 2w2f s TYR 156 N -1.79 1.01 0.24 0.56 -0.85 -1.26 -5.04 117.35 110.22 2w2f s TYR 156 Ca 0.76 -0.70 -0.14 0.00 -0.52 0.00 0.00 57.07 56.47 2w2f s TYR 156 Cb -0.30 -0.56 0.30 0.00 0.38 0.00 0.00 41.96 41.78 2w2f s TYR 156 CO 0.40 -0.03 1.57 -0.22 -1.52 0.00 0.00 175.55 175.75 2w2f h LYS 157 N 3.48 -0.03 -0.13 -3.49 3.64 -1.97 -1.36 116.57 116.72 2w2f h LYS 157 Ca -0.37 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.01 2w2f h LYS 157 Cb 1.19 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.01 2w2f h LYS 157 CO 0.55 -0.02 0.00 0.39 -2.27 0.00 0.00 179.45 178.10 2w2f n GLU 158 N -5.52 1.44 0.07 1.90 -0.58 -1.26 -4.43 120.64 112.27 2w2f n GLU 158 Ca 0.11 -0.66 -0.13 0.00 -0.42 0.00 0.00 57.16 56.06 2w2f n GLU 158 Cb 0.42 -1.29 -0.08 0.00 -0.57 0.00 0.00 31.44 29.91 2w2f n GLU 158 CO 0.00 0.00 0.00 1.98 -0.48 0.00 0.00 177.13 178.63 2w2f h MET 159 N 1.25 -0.13 -0.18 3.49 4.05 -1.66 0.37 114.93 122.13 2w2f h MET 159 Ca 0.00 0.01 -0.01 0.00 -0.28 0.00 0.00 59.70 59.42 2w2f h MET 159 Cb 0.28 0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 31.10 2w2f h MET 159 CO 0.00 0.04 0.06 -1.35 0.23 0.00 0.00 176.91 175.90 2w2f h PRO 160 N -0.27 0.24 0.08 0.39 0.11 -1.80 -0.54 132.00 130.20 2w2f h PRO 160 Ca -0.01 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.07 2w2f h PRO 160 Cb 0.23 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.29 2w2f h PRO 160 CO 0.02 0.21 -0.04 -0.91 -0.21 0.00 0.00 178.00 177.07 2w2f h ASN 161 N 0.24 -0.09 -0.37 -2.05 2.35 -1.79 -0.93 115.58 112.94 2w2f h ASN 161 Ca 0.06 -0.08 0.07 0.00 -0.55 0.00 0.00 56.30 55.80 2w2f h ASN 161 Cb 0.07 0.02 -0.06 0.00 0.05 0.00 0.00 38.32 38.40 2w2f h ASN 161 CO -0.01 0.02 -0.03 0.44 -1.65 0.00 0.00 177.43 176.21 2w2f h ASP 162 N -0.21 -0.22 -0.06 5.81 3.32 -0.16 0.80 116.42 125.71 2w2f h ASP 162 Ca -0.01 0.10 0.02 0.00 0.02 0.00 0.00 57.03 57.15 2w2f h ASP 162 Cb 0.17 0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.89 2w2f h ASP 162 CO 0.02 -0.07 -0.03 0.40 -1.72 0.00 0.00 179.24 177.83 2w2f h ILE 163 N 0.06 0.89 -0.60 0.35 2.04 -1.11 -0.12 117.51 119.03 2w2f h ILE 163 Ca 0.18 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 66.02 2w2f h ILE 163 Cb 0.26 0.89 -0.03 0.00 -0.74 0.00 0.00 36.82 37.20 2w2f h ILE 163 CO -0.33 0.00 0.29 0.03 0.00 0.00 0.00 178.15 178.14 2w2f h ARG 164 N -0.04 0.85 -0.01 2.37 3.08 -0.79 -2.65 114.38 117.19 2w2f h ARG 164 Ca 0.04 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 59.98 2w2f h ARG 164 Cb 0.09 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 29.98 2w2f h ARG 164 CO -0.08 0.66 0.00 0.09 -1.07 0.00 0.00 179.97 179.57 2w2f n ASN 165 N -4.35 0.35 -1.04 7.04 3.02 0.24 -4.90 115.26 115.62 2w2f n ASN 165 Ca 0.05 -1.18 -0.09 0.00 -0.03 0.00 0.00 54.58 53.33 2w2f n ASN 165 Cb 0.13 -0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.29 2w2f n ASN 165 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2w2f n GLY 166 N 1.01 0.11 0.73 7.41 0.00 -0.98 -4.93 105.19 108.54 2w2f n GLY 166 Ca 0.21 -0.50 0.07 0.00 0.00 0.00 0.00 46.02 45.80 2w2f n GLY 166 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2w2f n LYS 167 N -2.01 2.48 -0.07 1.61 5.02 -0.09 -4.71 118.16 120.39 2w2f n LYS 167 Ca -0.11 -2.00 -0.14 0.00 -2.02 0.00 0.00 58.31 54.04 2w2f n LYS 167 Cb 0.55 -1.31 -0.05 0.00 -0.02 0.00 0.00 35.03 34.20 2w2f n LYS 167 CO 0.00 0.00 0.00 0.98 -0.52 0.00 0.00 177.40 177.86 2w2f n TYR 168 N 0.73 0.00 -3.97 2.13 9.36 -1.21 -4.91 117.16 119.30 2w2f n TYR 168 Ca 0.13 0.00 -0.29 0.00 3.32 0.00 0.00 57.90 61.05 2w2f n TYR 168 Cb 0.44 -0.51 -0.04 0.00 -0.63 0.00 0.00 39.34 38.60 2w2f n TYR 168 CO 0.00 0.00 0.00 -0.06 0.22 0.00 0.00 176.86 177.02 2w2f s PHE 169 N -2.26 3.41 0.00 2.98 0.08 -1.26 -3.45 117.98 117.48 2w2f s PHE 169 Ca -0.19 0.16 0.00 0.00 0.12 0.00 0.00 56.93 57.02 2w2f s PHE 169 Cb 0.07 -1.69 0.00 0.00 -0.57 0.00 0.00 43.02 40.83 2w2f s PHE 169 CO 0.26 0.55 0.00 -0.40 -0.10 0.00 0.00 175.22 175.54 2w2f n ASP 170 N 0.09 0.00 0.33 1.36 5.68 0.22 -4.88 116.55 119.35 2w2f n ASP 170 Ca -0.06 -0.84 0.22 0.00 -0.50 0.00 0.00 54.79 53.61 2w2f n ASP 170 Cb 0.52 0.00 1.18 0.00 -1.14 0.00 0.00 41.12 41.68 2w2f n ASP 170 CO 0.00 0.00 0.00 -0.61 -1.33 0.00 0.00 177.20 175.26 2w2f h GLN 171 N 0.00 0.00 -0.72 0.11 4.15 -2.01 -1.46 115.11 115.19 2w2f h GLN 171 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 2w2f h GLN 171 Cb 0.00 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.69 2w2f h GLN 171 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 178.83 176.99 2w2f n ASN 172 N -3.03 3.92 -3.30 -0.69 3.02 -1.26 -4.92 115.26 109.00 2w2f n ASN 172 Ca -0.03 -2.03 -0.23 0.00 -0.03 0.00 0.00 54.58 52.26 2w2f n ASN 172 Cb 0.07 -0.49 0.01 0.00 -0.61 0.00 0.00 39.78 38.76 2w2f n ASN 172 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2w2f n TYR 173 N 1.58 -1.85 -4.28 3.10 4.19 -0.55 -5.01 117.16 114.34 2w2f n TYR 173 Ca 0.24 0.50 -0.26 0.00 3.31 0.00 0.00 57.90 61.69 2w2f n TYR 173 Cb 0.63 -3.35 -0.08 0.00 0.49 0.00 0.00 39.34 37.02 2w2f n TYR 173 CO 0.00 0.00 0.00 -1.01 0.91 0.00 0.00 176.86 176.76 2w2f s HIS 174 N -3.00 2.68 0.14 2.98 3.76 -1.26 -4.61 115.29 115.98 2w2f s HIS 174 Ca 0.38 -0.21 -0.31 0.00 -0.15 0.00 0.00 55.06 54.78 2w2f s HIS 174 Cb -0.20 -1.27 -0.08 0.00 1.11 0.00 0.00 32.58 32.14 2w2f s HIS 174 CO 0.47 0.55 1.34 1.03 -0.85 0.00 0.00 174.74 177.29 2w2f s ARG 175 N -3.11 4.36 0.00 1.40 0.52 -1.26 0.69 118.95 121.54 2w2f s ARG 175 Ca 0.27 2.04 0.31 0.00 -0.52 0.00 0.00 55.73 57.84 2w2f s ARG 175 Cb -0.08 -3.23 1.72 0.00 0.52 0.00 0.00 34.95 33.87 2w2f s ARG 175 CO 0.17 -0.35 2.12 -0.11 0.02 0.00 0.00 175.30 177.15