#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 4wbc n ASP 2 N 0.00 1.06 -4.69 -2.24 -0.08 -1.26 -5.04 116.55 104.30 4wbc n ASP 2 Ca 0.00 -2.96 -0.30 0.00 -1.51 0.00 0.00 54.79 50.02 4wbc n ASP 2 Cb 0.00 -0.63 0.15 0.00 2.34 0.00 0.00 41.12 42.98 4wbc n ASP 2 CO 0.00 0.00 0.00 -1.81 0.12 0.00 0.00 177.20 175.51 4wbc s ASP 3 N -1.96 3.24 0.22 1.67 1.01 -1.26 -2.50 116.67 117.10 4wbc s ASP 3 Ca 0.38 1.66 -0.30 0.00 0.71 0.00 0.00 52.55 55.00 4wbc s ASP 3 Cb 0.25 -2.31 -0.10 0.00 1.01 0.00 0.00 42.92 41.78 4wbc s ASP 3 CO -0.09 -2.81 1.40 -0.76 0.21 0.00 0.00 175.17 173.12 4wbc s LEU 4 N -6.36 4.39 -0.06 1.23 1.43 -0.27 -4.87 118.68 114.19 4wbc s LEU 4 Ca 0.64 2.57 0.03 0.00 -1.03 0.00 0.00 54.13 56.33 4wbc s LEU 4 Cb -0.19 -3.62 -0.03 0.00 0.03 0.00 0.00 46.19 42.38 4wbc s LEU 4 CO 0.58 -0.65 -0.12 -0.69 0.23 0.00 0.00 176.35 175.70 4wbc s VAL 5 N 0.12 3.21 0.90 -1.59 1.01 -1.26 -0.93 120.40 121.86 4wbc s VAL 5 Ca 0.59 -0.66 -0.12 0.00 0.00 0.00 0.00 61.98 61.79 4wbc s VAL 5 Cb -0.40 -2.28 0.18 0.00 0.00 0.00 0.00 36.38 33.88 4wbc s VAL 5 CO 0.41 0.59 1.24 1.51 0.00 0.00 0.00 175.10 178.84 4wbc s ASP 6 N -0.66 3.47 0.58 3.32 3.84 0.72 -4.71 116.67 123.23 4wbc s ASP 6 Ca 0.10 0.12 0.31 0.00 -0.00 0.00 0.00 52.55 53.08 4wbc s ASP 6 Cb -0.11 -0.26 1.78 0.00 -1.38 0.00 0.00 42.92 42.94 4wbc s ASP 6 CO 0.01 -2.49 2.21 0.00 -0.00 0.00 0.00 175.17 174.90 4wbc h ALA 7 N -1.35 1.37 -0.45 2.11 0.00 -0.66 -2.18 119.26 118.10 4wbc h ALA 7 Ca -0.42 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.45 4wbc h ALA 7 Cb 1.25 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.03 4wbc h ALA 7 CO 0.39 0.05 0.00 0.39 0.00 0.00 0.00 179.25 180.08 4wbc n GLU 8 N -3.66 2.46 -0.45 0.00 1.02 -1.26 -4.90 120.64 113.84 4wbc n GLU 8 Ca -0.03 -2.22 0.00 0.00 -0.02 0.00 0.00 57.16 54.90 4wbc n GLU 8 Cb 0.13 -1.51 0.00 0.00 -0.02 0.00 0.00 31.44 30.05 4wbc n GLU 8 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 4wbc n GLY 9 N 1.49 0.76 3.91 0.62 0.00 -0.82 -5.06 105.19 106.09 4wbc n GLY 9 Ca 0.20 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.91 4wbc n GLY 9 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 4wbc s ASN 10 N -2.30 6.28 0.27 1.61 0.01 -1.26 -4.80 114.94 114.74 4wbc s ASN 10 Ca 0.00 0.24 -0.31 0.00 -0.71 0.00 0.00 52.86 52.09 4wbc s ASN 10 Cb 0.00 -1.91 -0.12 0.00 0.41 0.00 0.00 41.25 39.63 4wbc s ASN 10 CO 0.00 0.17 1.64 -0.76 -1.51 0.00 0.00 177.10 176.64 4wbc s LEU 11 N -2.51 4.35 0.23 0.60 1.43 -1.26 -0.20 118.68 121.32 4wbc s LEU 11 Ca 0.34 2.94 -0.32 0.00 -1.03 0.00 0.00 54.13 56.06 4wbc s LEU 11 Cb -0.13 -3.62 -0.12 0.00 0.03 0.00 0.00 46.19 42.34 4wbc s LEU 11 CO 0.27 -0.94 1.65 0.52 0.23 0.00 0.00 176.35 178.08 4wbc n VAL 12 N 2.70 0.35 -3.08 -1.59 0.31 -0.11 -4.72 118.33 112.18 4wbc n VAL 12 Ca 0.10 -0.09 -0.39 0.00 -0.01 0.00 0.00 64.34 63.95 4wbc n VAL 12 Cb 0.37 -1.88 -0.05 0.00 -0.91 0.00 0.00 33.84 31.36 4wbc n VAL 12 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 4wbc s GLU 13 N 0.56 4.42 0.01 5.55 2.02 -1.26 -3.79 118.70 126.20 4wbc s GLU 13 Ca 0.72 0.92 -0.30 0.00 0.02 0.00 0.00 54.97 56.33 4wbc s GLU 13 Cb -0.54 -3.34 -0.07 0.00 0.10 0.00 0.00 34.13 30.28 4wbc s GLU 13 CO 0.39 0.35 1.62 1.21 0.02 0.00 0.00 175.26 178.84 4wbc s ASN 14 N -0.20 6.66 0.00 -0.19 2.47 0.46 -0.74 114.94 123.40 4wbc s ASN 14 Ca 0.35 2.33 0.00 0.00 0.42 0.00 0.00 52.86 55.96 4wbc s ASN 14 Cb -0.20 -2.55 0.00 0.00 -1.45 0.00 0.00 41.25 37.05 4wbc s ASN 14 CO 0.21 -0.88 0.00 0.61 -3.72 0.00 0.00 177.10 173.32 4wbc n GLY 15 N 4.01 1.15 3.90 1.21 0.00 0.21 -4.94 105.19 110.73 4wbc n GLY 15 Ca 0.16 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.90 4wbc n GLY 15 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 4wbc s GLY 16 N -1.78 1.62 -0.18 -0.02 0.00 0.08 -4.63 107.32 102.42 4wbc s GLY 16 Ca 0.00 -0.59 -0.06 0.00 0.00 0.00 0.00 44.72 44.07 4wbc s GLY 16 CO 0.00 -0.21 0.04 -0.51 0.00 0.00 0.00 173.10 172.42 4wbc s THR 17 N -3.30 4.55 0.09 0.90 -4.23 -1.26 -1.60 115.64 110.79 4wbc s THR 17 Ca 0.58 -0.12 0.04 0.00 -1.18 0.00 0.00 61.69 61.02 4wbc s THR 17 Cb -0.11 -3.04 -0.03 0.00 1.34 0.00 0.00 72.50 70.66 4wbc s THR 17 CO 0.48 0.47 -0.11 -0.31 -0.54 0.00 0.00 174.62 174.61 4wbc s TYR 18 N 0.37 1.11 -0.06 3.99 1.51 0.32 -1.76 117.35 122.82 4wbc s TYR 18 Ca 0.01 -0.58 -0.19 0.00 -1.01 0.00 0.00 57.07 55.30 4wbc s TYR 18 Cb -0.13 -0.61 -0.05 0.00 -0.11 0.00 0.00 41.96 41.07 4wbc s TYR 18 CO 0.01 0.03 0.54 0.71 -1.11 0.00 0.00 175.55 175.72 4wbc s TYR 19 N -2.00 3.59 -0.71 2.71 1.51 0.16 0.63 117.35 123.24 4wbc s TYR 19 Ca 0.02 1.04 -0.14 0.00 -1.01 0.00 0.00 57.07 56.99 4wbc s TYR 19 Cb -0.06 -2.58 0.18 0.00 -0.11 0.00 0.00 41.96 39.40 4wbc s TYR 19 CO 0.01 0.26 0.65 -0.51 -1.11 0.00 0.00 175.55 174.85 4wbc s LEU 20 N 0.23 6.49 -0.05 -1.29 1.02 -1.26 -1.33 118.68 122.49 4wbc s LEU 20 Ca 0.29 -2.37 -0.03 0.00 0.02 0.00 0.00 54.13 52.05 4wbc s LEU 20 Cb -0.17 -2.19 -0.04 0.00 0.02 0.00 0.00 46.19 43.81 4wbc s LEU 20 CO 0.14 -0.67 0.10 -0.76 0.02 0.00 0.00 176.35 175.18 4wbc s LEU 21 N 0.68 4.03 0.32 1.79 1.43 -0.76 -3.87 118.68 122.30 4wbc s LEU 21 Ca 0.12 0.26 -0.29 0.00 -1.03 0.00 0.00 54.13 53.19 4wbc s LEU 21 Cb -0.18 -2.19 -0.11 0.00 0.03 0.00 0.00 46.19 43.74 4wbc s LEU 21 CO -0.04 0.32 1.54 -2.16 0.23 0.00 0.00 176.35 176.24 4wbc s PRO 22 N -1.44 4.14 0.21 1.29 0.04 -1.26 -0.87 135.00 137.11 4wbc s PRO 22 Ca 0.20 2.54 -0.10 0.00 0.04 0.00 0.00 61.00 63.68 4wbc s PRO 22 Cb -0.12 -3.01 0.30 0.00 0.04 0.00 0.00 34.50 31.71 4wbc s PRO 22 CO 0.10 -0.57 1.70 1.25 0.04 0.00 0.00 177.00 179.52 4wbc h HIS 23 N 4.20 0.16 -3.35 0.56 -0.00 -1.07 -3.40 115.15 112.26 4wbc h HIS 23 Ca -0.48 0.04 -0.59 0.00 -0.00 0.00 0.00 60.37 59.33 4wbc h HIS 23 Cb 1.23 0.02 -0.09 0.00 -0.00 0.00 0.00 27.41 28.57 4wbc h HIS 23 CO 0.57 -0.06 0.54 0.42 -0.00 0.00 0.00 177.93 179.40 4wbc s ILE 24 N -6.11 4.73 0.32 6.26 -1.09 -1.26 -4.92 121.20 119.13 4wbc s ILE 24 Ca -0.13 1.45 0.08 0.00 -2.23 0.00 0.00 60.65 59.81 4wbc s ILE 24 Cb 0.18 -4.21 0.31 0.00 -1.58 0.00 0.00 42.46 37.16 4wbc s ILE 24 CO 0.74 -0.26 1.79 -0.50 -1.23 0.00 0.00 174.94 175.48 4wbc h TRP 25 N 7.97 0.99 -0.00 3.97 6.55 -1.92 -0.46 115.95 133.05 4wbc h TRP 25 Ca -0.23 0.03 0.00 0.00 0.95 0.00 0.00 58.89 59.64 4wbc h TRP 25 Cb 1.08 -0.30 0.00 0.00 -0.86 0.00 0.00 29.16 29.08 4wbc h TRP 25 CO 0.78 0.24 -0.00 0.00 -1.05 0.00 0.00 178.44 178.41 4wbc n ALA 26 N -2.36 2.61 0.03 1.49 0.00 -1.26 -3.97 120.51 117.04 4wbc n ALA 26 Ca 0.22 -0.18 0.04 0.00 0.00 0.00 0.00 53.44 53.52 4wbc n ALA 26 Cb 0.58 -1.50 0.22 0.00 0.00 0.00 0.00 19.45 18.75 4wbc n ALA 26 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 4wbc n HIS 27 N -1.10 1.09 0.00 0.00 8.25 -0.18 -5.00 115.22 118.28 4wbc n HIS 27 Ca 0.20 -0.39 0.00 0.00 -0.26 0.00 0.00 57.72 57.27 4wbc n HIS 27 Cb 0.17 -0.30 0.00 0.00 1.12 0.00 0.00 29.99 30.98 4wbc n HIS 27 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 4wbc n GLY 28 N 0.41 -0.49 0.00 -1.41 0.00 -1.25 -4.97 105.19 97.48 4wbc n GLY 28 Ca 0.15 -2.20 0.00 0.00 0.00 0.00 0.00 46.02 43.97 4wbc n GLY 28 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4wbc n GLY 29 N 0.00 4.75 1.13 -0.02 0.00 0.56 -4.31 105.19 107.30 4wbc n GLY 29 Ca 0.00 -1.76 -0.09 0.00 0.00 0.00 0.00 46.02 44.17 4wbc n GLY 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4wbc n GLY 30 N 5.00 -1.38 3.84 -0.02 0.00 -0.02 -4.34 105.19 108.27 4wbc n GLY 30 Ca 0.00 -1.66 -0.37 0.00 0.00 0.00 0.00 46.02 43.99 4wbc n GLY 30 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 4wbc s ILE 31 N -1.83 5.00 0.00 -0.61 -1.09 -1.25 -0.58 121.20 120.84 4wbc s ILE 31 Ca 0.22 0.80 0.00 0.00 -2.23 0.00 0.00 60.65 59.44 4wbc s ILE 31 Cb -0.01 -3.72 0.00 0.00 -1.58 0.00 0.00 42.46 37.16 4wbc s ILE 31 CO 0.16 0.50 0.00 -1.84 -1.23 0.00 0.00 174.94 172.53 4wbc n GLU 32 N 1.57 0.00 -4.32 2.79 0.28 0.13 0.10 120.64 121.19 4wbc n GLU 32 Ca -0.12 0.00 -0.22 0.00 -0.16 0.00 0.00 57.16 56.66 4wbc n GLU 32 Cb 0.52 0.00 -0.11 0.00 1.43 0.00 0.00 31.44 33.28 4wbc n GLU 32 CO 0.00 0.00 0.00 0.95 -0.16 0.00 0.00 177.13 177.92 4wbc s THR 33 N -2.28 1.78 0.06 3.84 -4.23 -1.26 -1.01 115.64 112.55 4wbc s THR 33 Ca 0.00 -1.83 0.02 0.00 -1.18 0.00 0.00 61.69 58.70 4wbc s THR 33 Cb 0.00 -1.77 -0.03 0.00 1.34 0.00 0.00 72.50 72.03 4wbc s THR 33 CO 0.00 -0.26 -0.07 0.00 -0.54 0.00 0.00 174.62 173.75 4wbc s ALA 34 N -1.86 0.72 -0.46 3.99 0.00 0.12 -4.90 121.76 119.37 4wbc s ALA 34 Ca 0.13 -1.00 -0.18 0.00 0.00 0.00 0.00 51.96 50.91 4wbc s ALA 34 Cb -0.07 0.10 0.04 0.00 0.00 0.00 0.00 23.12 23.19 4wbc s ALA 34 CO 0.06 -0.12 0.54 0.21 0.00 0.00 0.00 175.76 176.45 4wbc s LYS 35 N -2.52 3.13 0.38 0.00 2.20 -1.26 -1.30 119.74 120.37 4wbc s LYS 35 Ca -0.01 -0.77 0.08 0.00 -0.36 0.00 0.00 55.97 54.91 4wbc s LYS 35 Cb -0.04 -4.02 -0.07 0.00 -1.51 0.00 0.00 37.83 32.19 4wbc s LYS 35 CO -0.02 -1.02 -0.04 0.95 -0.36 0.00 0.00 175.35 174.86 4wbc s THR 36 N 2.40 2.11 0.00 3.43 -4.23 -1.26 -4.96 115.64 113.13 4wbc s THR 36 Ca 0.15 -2.10 0.00 0.00 -1.18 0.00 0.00 61.69 58.56 4wbc s THR 36 Cb -0.18 -2.83 0.00 0.00 1.34 0.00 0.00 72.50 70.83 4wbc s THR 36 CO 0.14 -0.10 0.00 0.61 -0.54 0.00 0.00 174.62 174.73 4wbc n GLY 37 N -0.89 3.17 1.22 3.99 0.00 -1.26 -1.67 105.19 109.76 4wbc n GLY 37 Ca -0.05 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.08 4wbc n GLY 37 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 4wbc n ASN 38 N 3.59 3.57 -4.59 1.61 3.02 -1.26 -4.98 115.26 116.22 4wbc n ASN 38 Ca 0.00 -1.99 -0.44 0.00 -0.03 0.00 0.00 54.58 52.12 4wbc n ASN 38 Cb 0.00 -0.41 -0.01 0.00 -0.61 0.00 0.00 39.78 38.74 4wbc n ASN 38 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 4wbc n GLU 39 N 1.47 1.33 0.19 3.52 1.02 -0.67 -4.90 120.64 122.59 4wbc n GLU 39 Ca 0.22 0.47 0.12 0.00 -0.02 0.00 0.00 57.16 57.95 4wbc n GLU 39 Cb 0.57 -1.85 0.19 0.00 -0.02 0.00 0.00 31.44 30.33 4wbc n GLU 39 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 4wbc h PRO 40 N 1.91 0.00 -2.99 3.49 0.13 -1.94 -3.45 132.00 129.15 4wbc h PRO 40 Ca -0.40 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.74 4wbc h PRO 40 Cb 1.34 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.46 4wbc h PRO 40 CO 0.60 0.00 0.27 0.00 -0.23 0.00 0.00 178.00 178.64 4wbc s PRO 42 N -2.72 2.62 0.00 0.00 0.02 -1.26 -4.59 135.00 129.06 4wbc s PRO 42 Ca 0.14 1.32 0.00 0.00 0.02 0.00 0.00 61.00 62.48 4wbc s PRO 42 Cb -0.05 -4.43 0.00 0.00 0.02 0.00 0.00 34.50 30.03 4wbc s PRO 42 CO 0.10 -2.70 0.26 1.28 -0.33 0.00 0.00 177.00 175.62 4wbc n LEU 43 N 13.44 0.53 -4.67 -5.54 4.77 -1.09 -4.76 117.00 119.68 4wbc n LEU 43 Ca 0.29 -0.57 -0.39 0.00 -0.03 0.00 0.00 56.01 55.31 4wbc n LEU 43 Cb 0.51 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.53 4wbc n LEU 43 CO 0.70 0.13 0.16 -0.89 -1.33 0.00 0.00 177.39 176.16 4wbc s THR 44 N -0.08 5.16 -0.11 -5.08 2.01 -0.42 -0.67 115.64 116.44 4wbc s THR 44 Ca 0.00 0.83 -0.27 0.00 0.31 0.00 0.00 61.69 62.56 4wbc s THR 44 Cb 0.00 -3.78 -0.02 0.00 0.01 0.00 0.00 72.50 68.71 4wbc s THR 44 CO 0.00 0.22 0.90 -0.69 -0.69 0.00 0.00 174.62 174.36 4wbc s VAL 45 N 1.40 4.86 0.11 3.82 1.01 -1.08 -0.70 120.40 129.82 4wbc s VAL 45 Ca 0.22 1.81 -0.02 0.00 0.00 0.00 0.00 61.98 63.99 4wbc s VAL 45 Cb -0.15 -4.21 -0.04 0.00 0.00 0.00 0.00 36.38 31.98 4wbc s VAL 45 CO 0.09 0.06 0.05 0.68 0.00 0.00 0.00 175.10 175.98 4wbc s VAL 46 N 1.80 0.14 -0.14 2.92 -7.23 -0.18 -1.69 120.40 116.01 4wbc s VAL 46 Ca 0.43 -1.82 -0.13 0.00 -1.81 0.00 0.00 61.98 58.65 4wbc s VAL 46 Cb -0.18 -1.85 -0.05 0.00 0.56 0.00 0.00 36.38 34.86 4wbc s VAL 46 CO 0.17 -0.62 0.28 -0.60 -0.31 0.00 0.00 175.10 174.02 4wbc s ARG 47 N -4.00 4.16 0.39 4.82 3.52 0.44 0.19 118.95 128.47 4wbc s ARG 47 Ca 0.18 0.09 -0.27 0.00 -0.13 0.00 0.00 55.73 55.60 4wbc s ARG 47 Cb 0.07 -3.39 -0.10 0.00 -1.56 0.00 0.00 34.95 29.98 4wbc s ARG 47 CO -0.02 0.33 1.41 0.45 -0.81 0.00 0.00 175.30 176.66 4wbc s SER 48 N 0.20 6.31 0.40 -2.12 0.15 0.25 -4.27 113.70 114.62 4wbc s SER 48 Ca 0.17 2.90 0.21 0.00 0.70 0.00 0.00 55.95 59.93 4wbc s SER 48 Cb -0.13 -2.66 0.32 0.00 -1.71 0.00 0.00 66.02 61.84 4wbc s SER 48 CO 0.04 -0.88 1.58 1.55 1.20 0.00 0.00 173.24 176.74 4wbc h PRO 49 N 2.87 0.00 -6.32 5.44 0.13 -1.92 0.16 132.00 132.36 4wbc h PRO 49 Ca -0.50 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.08 4wbc h PRO 49 Cb 1.24 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.33 4wbc h PRO 49 CO 0.63 0.15 1.19 1.21 -0.23 0.00 0.00 178.00 180.96 4wbc s ASN 50 N -6.26 5.95 0.56 1.44 3.84 -1.26 -4.51 114.94 114.70 4wbc s ASN 50 Ca 0.06 0.74 0.26 0.00 0.21 0.00 0.00 52.86 54.12 4wbc s ASN 50 Cb 0.06 -2.54 1.55 0.00 -0.55 0.00 0.00 41.25 39.77 4wbc s ASN 50 CO 0.69 -1.76 2.10 -0.33 -2.79 0.00 0.00 177.10 175.00 4wbc h GLU 51 N 12.24 0.00 -0.00 0.43 3.07 -1.85 0.79 114.58 129.26 4wbc h GLU 51 Ca -0.29 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.57 4wbc h GLU 51 Cb 1.13 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.04 4wbc h GLU 51 CO 1.12 0.00 -0.19 1.55 -1.40 0.00 0.00 179.01 180.08 4wbc n VAL 52 N -4.06 0.00 -2.97 3.13 3.14 -1.26 -4.66 118.33 111.65 4wbc n VAL 52 Ca 0.02 -0.03 -0.40 0.00 -2.96 0.00 0.00 64.34 60.97 4wbc n VAL 52 Cb 0.33 -0.09 -0.04 0.00 -1.06 0.00 0.00 33.84 32.98 4wbc n VAL 52 CO 0.00 0.00 0.00 -0.55 -6.46 0.00 0.00 176.83 169.82 4wbc s SER 53 N -2.75 7.04 0.00 6.55 0.15 0.27 -4.91 113.70 120.04 4wbc s SER 53 Ca 0.20 1.26 0.31 0.00 0.70 0.00 0.00 55.95 58.41 4wbc s SER 53 Cb 0.19 -2.44 1.80 0.00 -1.71 0.00 0.00 66.02 63.86 4wbc s SER 53 CO 0.55 -0.18 2.15 0.29 1.20 0.00 0.00 173.24 177.26 4wbc n LYS 54 N 4.01 0.90 0.00 5.44 5.02 -1.26 -0.84 118.16 131.43 4wbc n LYS 54 Ca 0.01 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.30 4wbc n LYS 54 Cb 0.51 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.02 4wbc n LYS 54 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 4wbc n GLY 55 N 0.96 0.61 3.90 0.72 0.00 -1.26 -3.96 105.19 106.16 4wbc n GLY 55 Ca 0.22 -0.79 -0.31 0.00 0.00 0.00 0.00 46.02 45.15 4wbc n GLY 55 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 4wbc s GLU 56 N 0.00 3.61 0.18 1.61 0.41 0.29 -4.83 118.70 119.97 4wbc s GLU 56 Ca 0.00 -0.11 -0.31 0.00 -0.41 0.00 0.00 54.97 54.14 4wbc s GLU 56 Cb 0.00 -2.82 -0.09 0.00 -1.78 0.00 0.00 34.13 29.43 4wbc s GLU 56 CO 0.00 0.43 1.45 -1.25 -0.49 0.00 0.00 175.26 175.40 4wbc s PRO 57 N -2.85 4.28 -0.13 0.39 0.05 -1.26 -4.56 135.00 130.92 4wbc s PRO 57 Ca 0.41 2.23 0.02 0.00 0.05 0.00 0.00 61.00 63.71 4wbc s PRO 57 Cb -0.12 -3.17 0.00 0.00 0.05 0.00 0.00 34.50 31.27 4wbc s PRO 57 CO 0.26 -0.46 -0.21 0.42 0.05 0.00 0.00 177.00 177.06 4wbc s ILE 58 N 0.62 2.25 -0.01 0.56 -1.09 0.21 -1.88 121.20 121.86 4wbc s ILE 58 Ca 0.63 -0.93 -0.30 0.00 -2.23 0.00 0.00 60.65 57.82 4wbc s ILE 58 Cb -0.40 -1.90 -0.04 0.00 -1.58 0.00 0.00 42.46 38.53 4wbc s ILE 58 CO 0.36 0.54 1.27 -0.60 -1.23 0.00 0.00 174.94 175.28 4wbc s ARG 59 N 0.65 4.34 -0.28 2.79 3.52 0.21 -0.52 118.95 129.66 4wbc s ARG 59 Ca -0.10 1.79 -0.02 0.00 -0.13 0.00 0.00 55.73 57.26 4wbc s ARG 59 Cb -0.16 -3.52 0.04 0.00 -1.56 0.00 0.00 34.95 29.75 4wbc s ARG 59 CO 0.02 -0.45 -0.01 0.42 -0.81 0.00 0.00 175.30 174.46 4wbc s ILE 60 N 2.03 3.05 -0.15 4.11 1.01 -0.62 -1.55 121.20 129.07 4wbc s ILE 60 Ca 0.59 -1.18 0.00 0.00 0.00 0.00 0.00 60.65 60.06 4wbc s ILE 60 Cb -0.28 -2.66 0.03 0.00 0.01 0.00 0.00 42.46 39.56 4wbc s ILE 60 CO 0.25 0.02 -0.12 -0.44 0.00 0.00 0.00 174.94 174.65 4wbc s SER 61 N 1.31 2.69 0.81 3.58 0.01 -0.63 0.64 113.70 122.11 4wbc s SER 61 Ca -0.02 -0.51 -0.11 0.00 1.31 0.00 0.00 55.95 56.62 4wbc s SER 61 Cb -0.18 -1.12 0.08 0.00 0.21 0.00 0.00 66.02 65.00 4wbc s SER 61 CO -0.02 -0.08 1.09 -0.55 0.41 0.00 0.00 173.24 174.09 4wbc s SER 62 N 1.52 4.27 0.52 2.44 0.15 -1.26 -0.54 113.70 120.80 4wbc s SER 62 Ca 0.04 1.56 0.33 0.00 0.70 0.00 0.00 55.95 58.58 4wbc s SER 62 Cb -0.13 -2.29 1.42 0.00 -1.71 0.00 0.00 66.02 63.31 4wbc s SER 62 CO -0.10 -2.14 1.98 0.06 1.20 0.00 0.00 173.24 174.24 4wbc h GLN 63 N -1.21 0.00 -6.73 5.44 3.07 -1.93 -3.46 115.11 110.29 4wbc h GLN 63 Ca -0.46 0.00 -0.44 0.00 0.09 0.00 0.00 58.65 57.84 4wbc h GLN 63 Cb 1.25 0.00 0.04 0.00 0.08 0.00 0.00 27.48 28.86 4wbc h GLN 63 CO 0.55 0.00 -0.09 -0.06 0.09 0.00 0.00 178.83 179.32 4wbc s PHE 64 N -3.66 2.72 -0.53 0.06 0.08 -1.26 -5.03 117.98 110.35 4wbc s PHE 64 Ca 0.01 -0.16 0.24 0.00 0.12 0.00 0.00 56.93 57.13 4wbc s PHE 64 Cb 0.09 -2.64 0.28 0.00 -0.57 0.00 0.00 43.02 40.18 4wbc s PHE 64 CO 0.50 -0.81 1.30 -0.07 -0.10 0.00 0.00 175.22 176.05 4wbc h LEU 65 N 0.20 0.00 -9.67 -0.37 3.38 -1.95 -3.48 115.31 103.42 4wbc h LEU 65 Ca -0.41 -0.13 -0.54 0.00 0.09 0.00 0.00 57.88 56.89 4wbc h LEU 65 Cb 1.29 0.00 0.21 0.00 0.09 0.00 0.00 40.66 42.25 4wbc h LEU 65 CO 0.49 0.06 -0.65 -1.54 0.09 0.00 0.00 178.44 176.90 4wbc n SER 66 N -2.35 -2.22 0.14 -0.43 3.41 -1.26 -4.91 113.62 106.00 4wbc n SER 66 Ca 0.03 0.39 -0.01 0.00 -0.26 0.00 0.00 58.87 59.02 4wbc n SER 66 Cb 0.47 -1.17 0.21 0.00 -0.26 0.00 0.00 64.21 63.47 4wbc n SER 66 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 4wbc h LEU 67 N -1.16 0.06-10.12 1.04 3.38 -1.94 -3.42 115.31 103.14 4wbc h LEU 67 Ca -0.44 -0.03 -0.68 0.00 0.09 0.00 0.00 57.88 56.82 4wbc h LEU 67 Cb 1.30 -0.02 -0.12 0.00 0.09 0.00 0.00 40.66 41.91 4wbc h LEU 67 CO 0.36 0.59 -0.49 -0.36 0.09 0.00 0.00 178.44 178.63 4wbc s PHE 68 N -3.80 1.74 -0.35 1.13 0.40 -1.26 -0.40 117.98 115.43 4wbc s PHE 68 Ca -0.02 -0.99 -0.02 0.00 -0.60 0.00 0.00 56.93 55.29 4wbc s PHE 68 Cb 0.13 -1.61 0.08 0.00 0.51 0.00 0.00 43.02 42.13 4wbc s PHE 68 CO 0.76 0.14 0.10 0.42 0.70 0.00 0.00 175.22 177.34 4wbc s ILE 69 N -2.90 3.16 0.75 0.64 1.01 -1.25 -4.60 121.20 118.01 4wbc s ILE 69 Ca 0.03 -1.70 -0.15 0.00 0.00 0.00 0.00 60.65 58.84 4wbc s ILE 69 Cb 0.00 -2.99 0.05 0.00 0.01 0.00 0.00 42.46 39.53 4wbc s ILE 69 CO 0.02 -0.39 1.21 -2.16 0.00 0.00 0.00 174.94 173.62 4wbc s PRO 70 N 1.20 1.97 0.16 2.79 0.04 -1.26 -1.11 135.00 138.79 4wbc s PRO 70 Ca 0.02 1.78 -0.34 0.00 0.04 0.00 0.00 61.00 62.50 4wbc s PRO 70 Cb -0.21 -1.81 -0.14 0.00 0.04 0.00 0.00 34.50 32.38 4wbc s PRO 70 CO -0.02 -1.97 1.52 -2.13 0.04 0.00 0.00 177.00 174.44 4wbc n ARG 71 N -2.88 1.96 -0.86 4.56 0.63 -1.04 -2.43 116.66 116.59 4wbc n ARG 71 Ca 0.14 0.71 0.00 0.00 -0.92 0.00 0.00 57.85 57.77 4wbc n ARG 71 Cb 0.50 -2.44 0.00 0.00 0.45 0.00 0.00 32.46 30.97 4wbc n ARG 71 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 4wbc n GLY 72 N 3.14 0.66 3.73 5.14 0.00 -1.26 -4.99 105.19 111.61 4wbc n GLY 72 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 4wbc n GLY 72 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 4wbc s SER 73 N -2.24 7.52 0.47 1.61 0.15 -1.02 -5.03 113.70 115.16 4wbc s SER 73 Ca 0.00 1.82 -0.22 0.00 0.70 0.00 0.00 55.95 58.24 4wbc s SER 73 Cb 0.00 -2.59 -0.07 0.00 -1.71 0.00 0.00 66.02 61.65 4wbc s SER 73 CO 0.00 -0.03 1.16 -0.76 1.20 0.00 0.00 173.24 174.81 4wbc s LEU 74 N -0.20 3.98 0.11 3.45 1.43 -1.26 -4.57 118.68 121.62 4wbc s LEU 74 Ca 0.46 2.29 0.03 0.00 -1.03 0.00 0.00 54.13 55.88 4wbc s LEU 74 Cb -0.24 -4.28 -0.04 0.00 0.03 0.00 0.00 46.19 41.66 4wbc s LEU 74 CO 0.30 -0.95 -0.08 0.68 0.23 0.00 0.00 176.35 176.53 4wbc s VAL 75 N -1.57 0.89 -0.00 -1.59 -7.23 0.26 -3.21 120.40 107.95 4wbc s VAL 75 Ca 0.65 -1.92 0.02 0.00 -1.81 0.00 0.00 61.98 58.92 4wbc s VAL 75 Cb -0.28 -1.67 -0.03 0.00 0.56 0.00 0.00 36.38 34.95 4wbc s VAL 75 CO 0.34 -0.77 -0.04 0.00 -0.31 0.00 0.00 175.10 174.31 4wbc s ALA 76 N -3.30 3.12 -0.10 1.32 0.00 0.30 -2.38 121.76 120.72 4wbc s ALA 76 Ca 0.12 -0.99 0.04 0.00 0.00 0.00 0.00 51.96 51.13 4wbc s ALA 76 Cb 0.03 -1.22 0.00 0.00 0.00 0.00 0.00 23.12 21.93 4wbc s ALA 76 CO -0.02 0.62 -0.22 -0.51 0.00 0.00 0.00 175.76 175.64 4wbc s LEU 77 N -1.44 2.01 0.01 0.00 1.43 -1.26 -1.60 118.68 117.83 4wbc s LEU 77 Ca 0.18 -0.52 -0.02 0.00 -1.03 0.00 0.00 54.13 52.74 4wbc s LEU 77 Cb -0.11 -1.31 -0.01 0.00 0.03 0.00 0.00 46.19 44.79 4wbc s LEU 77 CO 0.08 0.13 0.03 -0.83 0.23 0.00 0.00 176.35 175.99 4wbc s GLY 78 N 0.45 0.14 0.09 -3.19 0.00 -0.60 -0.73 107.32 103.48 4wbc s GLY 78 Ca -0.17 -0.35 -0.31 0.00 0.00 0.00 0.00 44.72 43.89 4wbc s GLY 78 CO 0.07 -0.44 1.53 -1.36 0.00 0.00 0.00 173.10 172.90 4wbc s PHE 79 N -1.24 2.84 0.37 1.90 0.40 -0.75 0.63 117.98 122.13 4wbc s PHE 79 Ca -0.13 0.62 0.04 0.00 -0.60 0.00 0.00 56.93 56.86 4wbc s PHE 79 Cb -0.08 -3.84 0.70 0.00 0.51 0.00 0.00 43.02 40.32 4wbc s PHE 79 CO -0.00 -3.17 2.01 0.00 0.70 0.00 0.00 175.22 174.76 4wbc h ALA 80 N 7.53 1.57 -2.97 5.36 0.00 -1.72 -3.34 119.26 125.69 4wbc h ALA 80 Ca -0.42 -0.06 -0.62 0.00 0.00 0.00 0.00 54.91 53.82 4wbc h ALA 80 Cb 1.20 -0.21 -0.41 0.00 0.00 0.00 0.00 17.79 18.37 4wbc h ALA 80 CO 0.91 0.37 -0.69 -0.80 0.00 0.00 0.00 179.25 179.04 4wbc s ASN 81 N -6.58 3.85 0.56 0.00 0.02 -1.26 -4.59 114.94 106.94 4wbc s ASN 81 Ca -0.09 -3.29 -0.14 0.00 -1.02 0.00 0.00 52.86 48.31 4wbc s ASN 81 Cb 0.17 -1.27 -0.06 0.00 0.02 0.00 0.00 41.25 40.11 4wbc s ASN 81 CO 0.75 -0.17 1.01 -2.16 0.02 0.00 0.00 177.10 176.55 4wbc s PRO 82 N -0.57 3.78 0.51 -0.60 0.04 -1.25 -5.00 135.00 131.89 4wbc s PRO 82 Ca 0.23 0.89 -0.19 0.00 0.04 0.00 0.00 61.00 61.97 4wbc s PRO 82 Cb -0.11 -2.11 -0.12 0.00 0.04 0.00 0.00 34.50 32.20 4wbc s PRO 82 CO -0.11 -0.42 0.29 -2.30 0.04 0.00 0.00 177.00 174.51 4wbc n PRO 83 N -2.05 0.32 0.04 0.56 -0.02 -1.26 -4.87 135.00 127.71 4wbc n PRO 83 Ca 0.06 0.12 0.01 0.00 -2.02 0.00 0.00 63.50 61.68 4wbc n PRO 83 Cb 0.54 -1.39 0.34 0.00 -0.02 0.00 0.00 33.50 32.97 4wbc n PRO 83 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 4wbc h SER 84 N 0.27 0.41 0.99 2.55 0.87 -1.96 -2.83 113.55 113.86 4wbc h SER 84 Ca -0.43 -0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.07 4wbc h SER 84 Cb 1.42 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 63.27 4wbc h SER 84 CO 0.46 0.47 0.00 0.00 -0.53 0.00 0.00 176.83 177.24 4wbc s ALA 86 N -3.53 3.30 -0.05 0.00 0.00 -1.07 -4.53 121.76 115.87 4wbc s ALA 86 Ca 0.03 0.86 0.20 0.00 0.00 0.00 0.00 51.96 53.04 4wbc s ALA 86 Cb 0.09 -3.32 0.47 0.00 0.00 0.00 0.00 23.12 20.36 4wbc s ALA 86 CO 0.51 -0.22 1.63 0.00 0.00 0.00 0.00 175.76 177.68 4wbc h ALA 87 N 3.34 0.86 -2.81 0.00 0.00 -1.12 -3.47 119.26 116.07 4wbc h ALA 87 Ca -0.47 -0.31 -0.17 0.00 0.00 0.00 0.00 54.91 53.96 4wbc h ALA 87 Cb 1.21 -0.05 -0.10 0.00 0.00 0.00 0.00 17.79 18.85 4wbc h ALA 87 CO 0.65 0.42 -0.25 -1.54 0.00 0.00 0.00 179.25 178.53 4wbc s SER 88 N -6.33 0.30 0.37 0.00 1.04 -1.26 -4.85 113.70 102.98 4wbc s SER 88 Ca 0.03 -1.21 0.20 0.00 0.48 0.00 0.00 55.95 55.44 4wbc s SER 88 Cb 0.09 0.57 0.50 0.00 0.10 0.00 0.00 66.02 67.27 4wbc s SER 88 CO 0.69 -1.13 1.64 -0.65 0.98 0.00 0.00 173.24 174.77 4wbc h PRO 89 N 2.28 0.00 -6.67 4.02 0.11 -1.90 -3.44 132.00 126.41 4wbc h PRO 89 Ca -0.29 0.00 -0.53 0.00 0.11 0.00 0.00 66.00 65.30 4wbc h PRO 89 Cb 1.25 0.00 0.04 0.00 0.11 0.00 0.00 31.00 32.39 4wbc h PRO 89 CO 0.40 0.31 0.71 -1.58 -0.21 0.00 0.00 178.00 177.63 4wbc s TRP 90 N -3.32 3.18 0.51 0.65 0.52 -1.26 -1.81 118.94 117.42 4wbc s TRP 90 Ca 0.03 1.09 -0.19 0.00 0.02 0.00 0.00 56.10 57.04 4wbc s TRP 90 Cb 0.08 -3.69 -0.07 0.00 -1.15 0.00 0.00 33.47 28.64 4wbc s TRP 90 CO 0.69 -2.27 1.04 -1.58 0.02 0.00 0.00 176.95 174.85 4wbc s TRP 91 N 0.32 3.00 0.25 -1.98 0.52 0.09 -4.46 118.94 116.67 4wbc s TRP 91 Ca 0.60 1.56 -0.02 0.00 0.02 0.00 0.00 56.10 58.26 4wbc s TRP 91 Cb -0.38 -3.05 -0.03 0.00 -1.15 0.00 0.00 33.47 28.86 4wbc s TRP 91 CO 0.38 -0.90 0.25 -0.08 0.02 0.00 0.00 176.95 176.62 4wbc s THR 92 N -2.10 0.00 -0.16 2.01 -1.32 0.12 -4.57 115.64 109.62 4wbc s THR 92 Ca 0.66 -1.86 0.01 0.00 -1.21 0.00 0.00 61.69 59.29 4wbc s THR 92 Cb -0.16 -2.47 0.02 0.00 -1.51 0.00 0.00 72.50 68.38 4wbc s THR 92 CO 0.24 0.00 -0.18 -0.69 -2.21 0.00 0.00 174.62 171.78 4wbc s VAL 93 N -3.88 1.87 -0.23 5.08 1.01 -1.26 -0.19 120.40 122.79 4wbc s VAL 93 Ca 0.36 -0.83 -0.05 0.00 0.00 0.00 0.00 61.98 61.46 4wbc s VAL 93 Cb 0.04 -1.70 -0.01 0.00 0.00 0.00 0.00 36.38 34.71 4wbc s VAL 93 CO 0.15 0.51 -0.01 -0.69 0.00 0.00 0.00 175.10 175.06 4wbc s VAL 94 N 1.29 3.56 0.82 2.92 1.01 0.25 -4.89 120.40 125.36 4wbc s VAL 94 Ca 0.03 -0.47 -0.13 0.00 0.00 0.00 0.00 61.98 61.41 4wbc s VAL 94 Cb -0.13 -2.66 0.09 0.00 0.00 0.00 0.00 36.38 33.68 4wbc s VAL 94 CO -0.11 0.37 1.21 0.47 0.00 0.00 0.00 175.10 177.04 4wbc n ASP 95 N 4.82 0.99 -3.65 3.32 9.92 -1.26 -1.40 116.55 129.28 4wbc n ASP 95 Ca -0.17 0.57 -0.09 0.00 -0.53 0.00 0.00 54.79 54.57 4wbc n ASP 95 Cb 0.51 -1.51 -0.03 0.00 -0.64 0.00 0.00 41.12 39.45 4wbc n ASP 95 CO 0.00 0.00 0.00 -0.94 0.13 0.00 0.00 177.20 176.39 4wbc s SER 96 N -2.18 -0.00 0.20 -2.24 1.04 -1.09 -4.84 113.70 104.60 4wbc s SER 96 Ca 0.73 -0.94 -0.10 0.00 0.48 0.00 0.00 55.95 56.12 4wbc s SER 96 Cb -0.29 0.69 0.25 0.00 0.10 0.00 0.00 66.02 66.78 4wbc s SER 96 CO 0.51 -1.34 1.77 -0.65 0.98 0.00 0.00 173.24 174.51 4wbc h PRO 97 N 2.11 0.47 0.00 4.02 0.11 -2.02 -1.97 132.00 134.71 4wbc h PRO 97 Ca -0.25 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.83 4wbc h PRO 97 Cb 1.25 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.25 4wbc h PRO 97 CO 0.33 0.31 -0.10 0.94 -0.21 0.00 0.00 178.00 179.27 4wbc n GLN 98 N -4.93 0.13 0.00 1.05 -0.06 -1.26 -5.03 117.38 107.28 4wbc n GLN 98 Ca 0.08 0.09 0.00 0.00 -2.00 0.00 0.00 57.00 55.17 4wbc n GLN 98 Cb 0.23 -1.63 0.00 0.00 -4.06 0.00 0.00 30.24 24.78 4wbc n GLN 98 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 4wbc n GLY 99 N 1.41 2.26 3.70 1.69 0.00 -0.74 -5.08 105.19 108.44 4wbc n GLY 99 Ca 0.06 -1.92 -0.44 0.00 0.00 0.00 0.00 46.02 43.72 4wbc n GLY 99 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 4wbc n PRO 100 N -1.74 2.52 -4.51 1.61 -0.02 -1.26 -2.66 135.00 128.94 4wbc n PRO 100 Ca 0.00 0.91 -0.30 0.00 -2.02 0.00 0.00 63.50 62.09 4wbc n PRO 100 Cb 0.00 -2.72 -0.13 0.00 -0.02 0.00 0.00 33.50 30.63 4wbc n PRO 100 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 4wbc s ALA 101 N 1.01 2.54 -0.22 3.55 0.00 -0.50 -0.85 121.76 127.29 4wbc s ALA 101 Ca 0.76 -1.32 -0.27 0.00 0.00 0.00 0.00 51.96 51.14 4wbc s ALA 101 Cb -0.57 -0.60 -0.00 0.00 0.00 0.00 0.00 23.12 21.94 4wbc s ALA 101 CO 0.35 0.57 0.92 0.08 0.00 0.00 0.00 175.76 177.68 4wbc s VAL 102 N -1.01 4.78 0.23 0.00 1.01 -0.43 -0.59 120.40 124.39 4wbc s VAL 102 Ca 0.15 1.78 0.01 0.00 0.00 0.00 0.00 61.98 63.92 4wbc s VAL 102 Cb -0.10 -4.21 -0.05 0.00 0.00 0.00 0.00 36.38 32.02 4wbc s VAL 102 CO 0.07 -0.10 0.10 -0.54 0.00 0.00 0.00 175.10 174.62 4wbc s LYS 103 N 2.87 1.31 0.53 2.72 -0.14 0.73 -2.64 119.74 125.12 4wbc s LYS 103 Ca 0.40 -1.70 0.06 0.00 -1.36 0.00 0.00 55.97 53.37 4wbc s LYS 103 Cb -0.15 -0.09 0.05 0.00 -1.68 0.00 0.00 37.83 35.96 4wbc s LYS 103 CO 0.08 -0.31 0.73 -0.51 -0.76 0.00 0.00 175.35 174.57 4wbc s LEU 104 N -3.25 3.34 0.03 3.17 1.43 0.15 0.10 118.68 123.66 4wbc s LEU 104 Ca 0.37 -0.47 0.00 0.00 -1.03 0.00 0.00 54.13 53.00 4wbc s LEU 104 Cb 0.07 -2.31 -0.02 0.00 0.03 0.00 0.00 46.19 43.96 4wbc s LEU 104 CO 0.12 -1.14 -0.03 -0.55 0.23 0.00 0.00 176.35 174.98 4wbc s SER 105 N -4.51 0.36 0.00 2.29 0.15 -1.26 -4.89 113.70 105.85 4wbc s SER 105 Ca 0.59 -0.62 0.28 0.00 0.70 0.00 0.00 55.95 56.90 4wbc s SER 105 Cb -0.08 0.11 0.97 0.00 -1.71 0.00 0.00 66.02 65.31 4wbc s SER 105 CO 0.37 -0.36 1.70 0.00 1.20 0.00 0.00 173.24 176.15 4wbc n GLN 106 N 1.25 1.30 -4.58 5.44 6.02 -1.26 -0.84 117.38 124.70 4wbc n GLN 106 Ca -0.22 -0.74 -0.27 0.00 -0.01 0.00 0.00 57.00 55.77 4wbc n GLN 106 Cb 0.56 -1.48 -0.09 0.00 1.02 0.00 0.00 30.24 30.25 4wbc n GLN 106 CO 0.00 0.00 0.00 1.14 -1.01 0.00 0.00 177.06 177.19 4wbc s GLN 107 N -2.21 1.93 -0.01 -1.09 -2.07 -1.26 -3.98 119.66 110.97 4wbc s GLN 107 Ca 0.33 -2.16 -0.24 0.00 -1.82 0.00 0.00 55.36 51.48 4wbc s GLN 107 Cb 0.20 -1.10 -0.05 0.00 -1.09 0.00 0.00 33.01 30.98 4wbc s GLN 107 CO 0.41 -0.30 0.71 0.15 -1.32 0.00 0.00 175.29 174.95 4wbc s LYS 108 N -3.80 4.44 0.16 9.60 -0.14 -1.26 -4.50 119.74 124.23 4wbc s LYS 108 Ca 0.24 0.93 0.03 0.00 -1.36 0.00 0.00 55.97 55.81 4wbc s LYS 108 Cb 0.05 -3.40 -0.04 0.00 -1.68 0.00 0.00 37.83 32.77 4wbc s LYS 108 CO 0.12 0.19 0.27 -0.51 -0.76 0.00 0.00 175.35 174.67 4wbc s LEU 109 N 0.33 4.28 0.77 3.17 1.43 -1.26 -5.10 118.68 122.30 4wbc s LEU 109 Ca 0.37 0.13 -0.12 0.00 -1.03 0.00 0.00 54.13 53.48 4wbc s LEU 109 Cb -0.19 -2.85 0.06 0.00 0.03 0.00 0.00 46.19 43.24 4wbc s LEU 109 CO 0.20 0.05 1.13 -2.16 0.23 0.00 0.00 176.35 175.80 4wbc s PRO 110 N -3.27 2.04 0.51 1.29 0.04 -1.26 -4.90 135.00 129.46 4wbc s PRO 110 Ca 0.34 1.44 0.16 0.00 0.04 0.00 0.00 61.00 62.98 4wbc s PRO 110 Cb -0.11 -1.85 1.24 0.00 0.04 0.00 0.00 34.50 33.82 4wbc s PRO 110 CO 0.28 -1.85 2.14 0.93 0.04 0.00 0.00 177.00 178.54 4wbc h GLU 111 N -0.88 0.02 0.00 4.56 5.08 -2.00 -0.21 114.58 121.15 4wbc h GLU 111 Ca -0.45 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 4wbc h GLU 111 Cb 1.26 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 4wbc h GLU 111 CO 0.49 0.03 0.00 1.57 -1.00 0.00 0.00 179.01 180.10 4wbc h LYS 112 N 0.02 0.00 -0.02 2.33 2.10 -1.91 -0.61 116.57 118.49 4wbc h LYS 112 Ca 0.01 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.66 4wbc h LYS 112 Cb 0.02 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.35 4wbc h LYS 112 CO 0.00 0.00 -0.46 -0.25 -2.00 0.00 0.00 179.45 176.74 4wbc n ASP 113 N -2.34 1.97 -0.01 7.07 10.43 -0.09 -4.51 116.55 129.06 4wbc n ASP 113 Ca 0.01 -1.47 -0.00 0.00 2.57 0.00 0.00 54.79 55.89 4wbc n ASP 113 Cb 0.17 0.45 -0.01 0.00 1.84 0.00 0.00 41.12 43.57 4wbc n ASP 113 CO 0.00 0.00 0.00 2.30 -1.07 0.00 0.00 177.20 178.43 4wbc n ILE 114 N -0.06 0.09 -1.76 0.53 -5.35 -0.80 -4.42 119.36 107.60 4wbc n ILE 114 Ca 0.10 -0.07 -0.40 0.00 -0.27 0.00 0.00 62.75 62.10 4wbc n ILE 114 Cb 0.46 -0.58 -0.01 0.00 -1.74 0.00 0.00 39.64 37.77 4wbc n ILE 114 CO 0.00 0.00 0.00 -0.11 -1.76 0.00 0.00 176.55 174.68 4wbc n LEU 115 N -1.93 7.93 -0.08 7.28 7.94 -0.30 -4.14 117.00 133.69 4wbc n LEU 115 Ca -0.02 -4.55 0.03 0.00 -1.11 0.00 0.00 56.01 50.36 4wbc n LEU 115 Cb 0.42 -1.50 0.04 0.00 0.53 0.00 0.00 43.42 42.92 4wbc n LEU 115 CO 0.04 1.82 0.45 1.33 -1.11 0.00 0.00 177.39 179.92 4wbc n VAL 116 N 3.15 1.00 -4.42 1.96 0.24 -1.22 -4.78 118.33 114.25 4wbc n VAL 116 Ca 0.63 -1.12 -0.25 0.00 -2.04 0.00 0.00 64.34 61.57 4wbc n VAL 116 Cb 0.28 0.35 -0.11 0.00 -1.47 0.00 0.00 33.84 32.89 4wbc n VAL 116 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 4wbc s PHE 117 N -1.30 2.20 -0.17 6.34 0.08 -1.00 0.03 117.98 124.16 4wbc s PHE 117 Ca 0.10 -0.37 -0.13 0.00 0.12 0.00 0.00 56.93 56.65 4wbc s PHE 117 Cb 0.09 -1.05 0.05 0.00 -0.57 0.00 0.00 43.02 41.54 4wbc s PHE 117 CO 0.01 0.53 0.44 0.21 -0.10 0.00 0.00 175.22 176.31 4wbc s LYS 118 N -2.97 0.47 0.25 0.44 2.20 -0.67 0.92 119.74 120.37 4wbc s LYS 118 Ca 0.23 0.73 -0.18 0.00 -0.36 0.00 0.00 55.97 56.39 4wbc s LYS 118 Cb -0.06 0.12 -0.08 0.00 -1.51 0.00 0.00 37.83 36.29 4wbc s LYS 118 CO 0.11 -0.11 0.71 -0.06 -0.36 0.00 0.00 175.35 175.64 4wbc s PHE 119 N 0.85 3.56 -0.10 4.03 0.08 -1.26 0.07 117.98 125.20 4wbc s PHE 119 Ca -0.05 1.30 -0.01 0.00 0.12 0.00 0.00 56.93 58.30 4wbc s PHE 119 Cb -0.06 -2.57 0.03 0.00 -0.57 0.00 0.00 43.02 39.85 4wbc s PHE 119 CO -0.07 0.27 -0.03 -2.00 -0.10 0.00 0.00 175.22 173.29 4wbc s GLU 120 N -2.29 1.07 0.19 0.44 2.12 0.33 -4.75 118.70 115.81 4wbc s GLU 120 Ca 0.46 -0.12 -0.33 0.00 0.36 0.00 0.00 54.97 55.34 4wbc s GLU 120 Cb -0.15 -1.38 -0.14 0.00 0.26 0.00 0.00 34.13 32.73 4wbc s GLU 120 CO 0.20 -0.32 1.56 1.17 -0.54 0.00 0.00 175.26 177.33 4wbc n LYS 121 N 5.03 2.21 -3.40 4.30 4.81 -1.26 -0.03 118.16 129.82 4wbc n LYS 121 Ca -0.10 0.79 -0.37 0.00 -0.87 0.00 0.00 58.31 57.76 4wbc n LYS 121 Cb 0.50 -2.55 -0.06 0.00 0.02 0.00 0.00 35.03 32.94 4wbc n LYS 121 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 4wbc s VAL 122 N 0.69 5.23 0.67 3.15 1.01 0.16 -4.80 120.40 126.51 4wbc s VAL 122 Ca 0.76 0.80 -0.15 0.00 0.00 0.00 0.00 61.98 63.39 4wbc s VAL 122 Cb -0.65 -3.75 0.00 0.00 0.00 0.00 0.00 36.38 31.99 4wbc s VAL 122 CO 0.40 0.35 1.13 -0.44 0.00 0.00 0.00 175.10 176.54 4wbc s SER 123 N 0.56 4.95 -0.79 3.32 0.01 -1.26 -4.39 113.70 116.10 4wbc s SER 123 Ca 0.22 2.08 -0.03 0.00 1.31 0.00 0.00 55.95 59.53 4wbc s SER 123 Cb -0.14 -2.56 -0.04 0.00 0.21 0.00 0.00 66.02 63.49 4wbc s SER 123 CO 0.08 -1.74 0.69 1.57 0.41 0.00 0.00 173.24 174.25 4wbc n HIS 124 N -2.41 -1.76 -3.78 2.43 -0.00 -1.26 -5.05 115.22 103.38 4wbc n HIS 124 Ca 0.11 0.64 -0.13 0.00 0.46 0.00 0.00 57.72 58.80 4wbc n HIS 124 Cb 0.52 -3.81 -0.09 0.00 -0.12 0.00 0.00 29.99 26.48 4wbc n HIS 124 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 4wbc s SER 125 N -3.44 -0.15 -0.17 0.26 0.15 -1.26 -5.06 113.70 104.04 4wbc s SER 125 Ca 0.26 0.03 -0.15 0.00 0.70 0.00 0.00 55.95 56.79 4wbc s SER 125 Cb -0.03 0.29 -0.12 0.00 -1.71 0.00 0.00 66.02 64.45 4wbc s SER 125 CO 0.54 -0.44 0.10 0.78 1.20 0.00 0.00 173.24 175.42 4wbc h ASN 126 N 3.92 0.00 -4.16 5.45 2.35 -1.96 -3.47 115.58 117.71 4wbc h ASN 126 Ca -0.30 -0.31 -0.50 0.00 -0.55 0.00 0.00 56.30 54.64 4wbc h ASN 126 Cb 1.18 0.00 0.07 0.00 0.05 0.00 0.00 38.32 39.62 4wbc h ASN 126 CO 0.40 1.07 0.39 -0.51 -1.65 0.00 0.00 177.43 177.13 4wbc s ILE 127 N -2.22 3.54 -0.36 2.81 2.07 -1.26 -4.96 121.20 120.82 4wbc s ILE 127 Ca -0.20 0.79 -0.29 0.00 -1.41 0.00 0.00 60.65 59.54 4wbc s ILE 127 Cb 0.03 -3.30 0.01 0.00 0.13 0.00 0.00 42.46 39.33 4wbc s ILE 127 CO 0.40 -0.37 1.34 -1.00 -1.91 0.00 0.00 174.94 173.40 4wbc s HIS 128 N -2.25 2.56 -0.04 3.50 3.76 -1.26 -5.00 115.29 116.57 4wbc s HIS 128 Ca 0.67 0.77 0.07 0.00 -0.15 0.00 0.00 55.06 56.41 4wbc s HIS 128 Cb -0.19 -4.12 -0.01 0.00 1.11 0.00 0.00 32.58 29.37 4wbc s HIS 128 CO 0.34 -1.81 -0.24 0.08 -0.85 0.00 0.00 174.74 172.26 4wbc s VAL 129 N 4.85 1.95 0.01 -0.90 1.01 -1.26 -4.56 120.40 121.50 4wbc s VAL 129 Ca 0.58 -1.03 0.03 0.00 0.00 0.00 0.00 61.98 61.56 4wbc s VAL 129 Cb -0.15 -1.64 -0.01 0.00 0.00 0.00 0.00 36.38 34.58 4wbc s VAL 129 CO 0.28 0.55 -0.10 -0.31 0.00 0.00 0.00 175.10 175.52 4wbc s TYR 130 N -0.32 0.88 0.58 5.22 2.02 0.23 -0.66 117.35 125.30 4wbc s TYR 130 Ca 0.02 -0.26 -0.09 0.00 -0.37 0.00 0.00 57.07 56.37 4wbc s TYR 130 Cb -0.12 -0.54 -0.03 0.00 -0.40 0.00 0.00 41.96 40.87 4wbc s TYR 130 CO 0.02 -0.01 0.94 0.15 -1.57 0.00 0.00 175.55 175.07 4wbc s LYS 131 N -0.68 3.47 -0.24 -0.62 1.02 0.96 -0.46 119.74 123.20 4wbc s LYS 131 Ca 0.01 0.48 0.00 0.00 0.02 0.00 0.00 55.97 56.47 4wbc s LYS 131 Cb -0.06 -2.19 0.03 0.00 -0.52 0.00 0.00 37.83 35.09 4wbc s LYS 131 CO 0.00 -0.49 -0.10 -1.17 -0.92 0.00 0.00 175.35 172.68 4wbc s LEU 132 N -5.02 3.04 0.09 3.17 2.96 -1.26 -0.52 118.68 121.15 4wbc s LEU 132 Ca 0.52 -0.96 -0.02 0.00 -0.22 0.00 0.00 54.13 53.45 4wbc s LEU 132 Cb -0.11 -1.60 -0.05 0.00 0.50 0.00 0.00 46.19 44.94 4wbc s LEU 132 CO 0.50 -0.12 0.29 -0.76 -1.32 0.00 0.00 176.35 174.94 4wbc s LEU 133 N 1.26 4.32 -0.16 -0.68 1.43 0.11 -0.46 118.68 124.50 4wbc s LEU 133 Ca -0.01 0.43 -0.06 0.00 -1.03 0.00 0.00 54.13 53.45 4wbc s LEU 133 Cb -0.17 -3.10 -0.04 0.00 0.03 0.00 0.00 46.19 42.91 4wbc s LEU 133 CO -0.06 0.12 0.05 -0.47 0.23 0.00 0.00 176.35 176.22 4wbc s TYR 134 N -1.57 3.25 -0.34 0.29 5.04 0.69 -1.67 117.35 123.05 4wbc s TYR 134 Ca 0.37 0.10 -0.00 0.00 -2.44 0.00 0.00 57.07 55.10 4wbc s TYR 134 Cb -0.13 -2.02 0.08 0.00 0.35 0.00 0.00 41.96 40.25 4wbc s TYR 134 CO 0.26 0.23 0.07 0.00 -1.34 0.00 0.00 175.55 174.78 4wbc s GLN 136 N 1.12 0.32 0.20 0.00 -2.07 -1.07 -4.68 119.66 113.49 4wbc s GLN 136 Ca 0.03 0.07 -0.29 0.00 -1.82 0.00 0.00 55.36 53.35 4wbc s GLN 136 Cb -0.21 -1.76 -0.08 0.00 -1.09 0.00 0.00 33.01 29.87 4wbc s GLN 136 CO -0.04 -2.71 0.92 -1.01 -1.32 0.00 0.00 175.29 171.13 4wbc s HIS 137 N -3.29 3.93 -0.52 9.60 3.76 -1.26 0.26 115.29 127.78 4wbc s HIS 137 Ca 0.68 1.85 -0.02 0.00 -0.15 0.00 0.00 55.06 57.41 4wbc s HIS 137 Cb -0.12 -2.96 0.27 0.00 1.11 0.00 0.00 32.58 30.87 4wbc s HIS 137 CO 0.54 0.41 2.19 -3.47 -0.85 0.00 0.00 174.74 173.56 4wbc n ASP 138 N 1.82 6.96 -2.55 1.40 4.64 -0.96 -4.73 116.55 123.13 4wbc n ASP 138 Ca -0.02 -3.40 -0.11 0.00 -1.38 0.00 0.00 54.79 49.89 4wbc n ASP 138 Cb 0.48 -1.08 -0.00 0.00 -1.04 0.00 0.00 41.12 39.48 4wbc n ASP 138 CO 0.00 0.00 0.00 -0.62 -0.82 0.00 0.00 177.20 175.76 4wbc n GLU 139 N -0.01 -2.50 0.00 -0.67 4.71 -1.26 -3.54 120.64 117.37 4wbc n GLU 139 Ca 0.47 0.45 0.00 0.00 -0.01 0.00 0.00 57.16 58.07 4wbc n GLU 139 Cb 0.55 -5.04 0.00 0.00 -1.01 0.00 0.00 31.44 25.94 4wbc n GLU 139 CO 0.00 0.00 0.00 -1.91 0.09 0.00 0.00 177.13 175.31 4wbc n GLU 140 N -2.83 0.00 0.00 3.49 4.07 -1.26 -5.11 120.64 119.00 4wbc n GLU 140 Ca -0.10 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.00 4wbc n GLU 140 Cb 0.58 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.96 4wbc n GLU 140 CO 0.00 0.00 0.00 -3.47 -0.06 0.00 0.00 177.13 173.60 4wbc n ASP 141 N 0.00 0.00 -3.81 4.31 4.64 -1.23 -5.14 116.55 115.32 4wbc n ASP 141 Ca 0.00 0.00 -0.12 0.00 -1.38 0.00 0.00 54.79 53.29 4wbc n ASP 141 Cb 0.00 0.00 -0.09 0.00 -1.04 0.00 0.00 41.12 39.99 4wbc n ASP 141 CO 0.00 0.00 0.00 0.54 -0.82 0.00 0.00 177.20 176.92 4wbc s VAL 142 N 4.02 0.07 -0.05 5.18 0.11 -1.26 -2.27 120.40 126.20 4wbc s VAL 142 Ca 0.00 -0.62 -0.02 0.00 -2.93 0.00 0.00 61.98 58.41 4wbc s VAL 142 Cb 0.00 -0.63 0.03 0.00 -1.53 0.00 0.00 36.38 34.25 4wbc s VAL 142 CO 0.00 -0.34 0.08 -0.75 -3.33 0.00 0.00 175.10 170.76 4wbc s LYS 143 N -1.63 -0.05 -1.22 1.54 2.20 0.14 -4.55 119.74 116.17 4wbc s LYS 143 Ca -0.12 0.40 -0.14 0.00 -0.36 0.00 0.00 55.97 55.75 4wbc s LYS 143 Cb -0.05 -0.44 0.16 0.00 -1.51 0.00 0.00 37.83 35.99 4wbc s LYS 143 CO 0.02 -0.31 1.48 0.00 -0.36 0.00 0.00 175.35 176.17 4wbc n ASP 145 N 6.03 1.16 -4.49 0.00 3.85 -1.24 -4.90 116.55 116.96 4wbc n ASP 145 Ca 0.38 -1.08 -0.29 0.00 -0.71 0.00 0.00 54.79 53.10 4wbc n ASP 145 Cb 0.43 0.44 -0.11 0.00 -1.35 0.00 0.00 41.12 40.53 4wbc n ASP 145 CO 0.00 0.00 0.00 -1.10 -1.01 0.00 0.00 177.20 175.09 4wbc s GLN 146 N -1.20 1.77 0.14 0.11 -0.21 -1.22 -5.03 119.66 114.03 4wbc s GLN 146 Ca 0.07 -1.24 0.05 0.00 0.02 0.00 0.00 55.36 54.27 4wbc s GLN 146 Cb 0.07 -2.08 -0.04 0.00 1.00 0.00 0.00 33.01 31.96 4wbc s GLN 146 CO 0.21 0.46 0.06 0.71 -2.12 0.00 0.00 175.29 174.61 4wbc s TYR 147 N -1.28 3.03 -0.05 0.91 1.51 -1.26 -0.22 117.35 119.99 4wbc s TYR 147 Ca 0.19 -0.04 -0.17 0.00 -1.01 0.00 0.00 57.07 56.04 4wbc s TYR 147 Cb -0.10 -1.49 -0.05 0.00 -0.11 0.00 0.00 41.96 40.21 4wbc s TYR 147 CO 0.11 0.51 0.46 0.42 -1.11 0.00 0.00 175.55 175.93 4wbc s ILE 148 N -1.61 5.08 0.00 2.71 -1.09 0.39 0.38 121.20 127.05 4wbc s ILE 148 Ca 0.29 0.93 0.00 0.00 -2.23 0.00 0.00 60.65 59.64 4wbc s ILE 148 Cb -0.10 -3.78 0.00 0.00 -1.58 0.00 0.00 42.46 36.99 4wbc s ILE 148 CO 0.21 0.45 0.00 0.61 -1.23 0.00 0.00 174.94 174.98 4wbc n GLY 149 N 2.55 5.45 3.44 6.18 0.00 -0.15 -1.80 105.19 120.86 4wbc n GLY 149 Ca -0.10 -1.63 -0.32 0.00 0.00 0.00 0.00 46.02 43.97 4wbc n GLY 149 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 4wbc s ILE 150 N -0.78 2.78 -0.23 -0.61 -1.09 -1.26 -2.19 121.20 117.83 4wbc s ILE 150 Ca 0.00 -1.00 -0.02 0.00 -2.23 0.00 0.00 60.65 57.40 4wbc s ILE 150 Cb 0.00 -2.11 0.07 0.00 -1.58 0.00 0.00 42.46 38.84 4wbc s ILE 150 CO 0.00 0.47 0.05 -2.28 -1.23 0.00 0.00 174.94 171.95 4wbc s HIS 151 N -0.81 1.25 -0.10 3.97 5.65 -0.30 -4.94 115.29 120.01 4wbc s HIS 151 Ca 0.13 -1.12 -0.30 0.00 0.25 0.00 0.00 55.06 54.02 4wbc s HIS 151 Cb -0.10 -1.21 -0.03 0.00 -1.18 0.00 0.00 32.58 30.05 4wbc s HIS 151 CO 0.03 -0.69 1.33 0.50 -0.65 0.00 0.00 174.74 175.26 4wbc s ARG 152 N 1.78 4.25 0.74 2.88 3.52 -1.26 -2.49 118.95 128.38 4wbc s ARG 152 Ca 0.01 1.79 -0.05 0.00 -0.13 0.00 0.00 55.73 57.35 4wbc s ARG 152 Cb -0.17 -3.73 0.11 0.00 -1.56 0.00 0.00 34.95 29.60 4wbc s ARG 152 CO -0.13 -0.66 1.04 0.16 -0.81 0.00 0.00 175.30 174.90 4wbc s ASP 153 N 2.08 4.35 0.14 -2.12 1.47 -0.75 -4.92 116.67 116.92 4wbc s ASP 153 Ca 0.59 0.06 0.09 0.00 1.18 0.00 0.00 52.55 54.47 4wbc s ASP 153 Cb -0.25 -0.51 0.50 0.00 -0.34 0.00 0.00 42.92 42.31 4wbc s ASP 153 CO 0.20 -1.87 1.28 -2.11 0.68 0.00 0.00 175.17 173.35 4wbc n ARG 154 N -2.99 0.06 -0.19 2.11 0.00 -1.26 0.14 116.66 114.52 4wbc n ARG 154 Ca 0.12 0.56 0.11 0.00 -0.00 0.00 0.00 57.85 58.64 4wbc n ARG 154 Cb 0.60 -1.70 0.21 0.00 -0.00 0.00 0.00 32.46 31.58 4wbc n ARG 154 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 4wbc n ASN 155 N -1.82 3.42 0.00 2.89 5.03 -1.26 -4.96 115.26 118.56 4wbc n ASN 155 Ca -0.01 -1.97 0.00 0.00 0.87 0.00 0.00 54.58 53.47 4wbc n ASN 155 Cb 0.01 -0.25 0.00 0.00 -1.02 0.00 0.00 39.78 38.52 4wbc n ASN 155 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 4wbc n GLY 156 N 1.43 1.27 3.72 7.41 0.00 0.12 -5.03 105.19 114.11 4wbc n GLY 156 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 4wbc n GLY 156 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 4wbc s ASN 157 N -3.12 6.73 -1.09 1.61 0.01 -1.26 -4.66 114.94 113.16 4wbc s ASN 157 Ca 0.00 2.46 -0.13 0.00 -0.71 0.00 0.00 52.86 54.48 4wbc s ASN 157 Cb 0.00 -2.59 0.21 0.00 0.41 0.00 0.00 41.25 39.28 4wbc s ASN 157 CO 0.00 -0.72 1.19 -0.13 -1.51 0.00 0.00 177.10 175.94 4wbc s ARG 158 N 1.02 4.02 0.20 -0.60 0.52 -1.26 -1.80 118.95 121.05 4wbc s ARG 158 Ca 0.66 -2.71 -0.30 0.00 -0.52 0.00 0.00 55.73 52.86 4wbc s ARG 158 Cb -0.40 -4.78 -0.08 0.00 0.52 0.00 0.00 34.95 30.21 4wbc s ARG 158 CO 0.31 -1.51 1.25 1.03 0.02 0.00 0.00 175.30 176.41 4wbc s ARG 159 N 0.46 4.44 -0.22 3.54 0.52 -1.04 -0.42 118.95 126.23 4wbc s ARG 159 Ca 0.34 1.97 -0.25 0.00 -0.52 0.00 0.00 55.73 57.27 4wbc s ARG 159 Cb -0.07 -3.21 -0.01 0.00 0.52 0.00 0.00 34.95 32.19 4wbc s ARG 159 CO -0.05 -0.16 0.84 -0.51 0.02 0.00 0.00 175.30 175.44 4wbc s LEU 160 N -0.28 4.11 0.15 2.53 1.02 -0.68 -1.14 118.68 124.39 4wbc s LEU 160 Ca 0.54 1.10 -0.03 0.00 0.02 0.00 0.00 54.13 55.76 4wbc s LEU 160 Cb -0.35 -3.22 -0.03 0.00 0.02 0.00 0.00 46.19 42.61 4wbc s LEU 160 CO 0.38 -0.49 0.13 0.68 0.02 0.00 0.00 176.35 177.07 4wbc s VAL 161 N 2.64 0.07 0.20 -1.59 -7.23 -0.93 -1.31 120.40 112.26 4wbc s VAL 161 Ca 0.36 -1.81 -0.30 0.00 -1.81 0.00 0.00 61.98 58.43 4wbc s VAL 161 Cb -0.16 -2.09 -0.09 0.00 0.56 0.00 0.00 36.38 34.60 4wbc s VAL 161 CO 0.09 -0.33 1.31 -0.69 -0.31 0.00 0.00 175.10 175.17 4wbc s VAL 162 N -4.05 3.20 0.30 1.32 1.01 -0.03 -0.98 120.40 121.17 4wbc s VAL 162 Ca 0.25 0.99 0.09 0.00 0.00 0.00 0.00 61.98 63.32 4wbc s VAL 162 Cb 0.06 -3.63 -0.06 0.00 0.00 0.00 0.00 36.38 32.75 4wbc s VAL 162 CO 0.04 0.15 -0.11 0.28 0.00 0.00 0.00 175.10 175.45 4wbc s THR 163 N 0.10 2.07 -0.04 3.92 -1.32 0.16 -4.77 115.64 115.76 4wbc s THR 163 Ca 0.57 -2.23 -0.00 0.00 -1.21 0.00 0.00 61.69 58.82 4wbc s THR 163 Cb -0.36 -2.47 -0.02 0.00 -1.51 0.00 0.00 72.50 68.14 4wbc s THR 163 CO 0.38 -0.31 -0.04 1.21 -2.21 0.00 0.00 174.62 173.66 4wbc n GLU 164 N -0.66 0.10 -0.07 7.08 2.13 -1.26 -4.08 120.64 123.88 4wbc n GLU 164 Ca -0.05 0.03 -0.04 0.00 0.66 0.00 0.00 57.16 57.75 4wbc n GLU 164 Cb 0.62 -0.95 -0.02 0.00 0.27 0.00 0.00 31.44 31.37 4wbc n GLU 164 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 4wbc h GLU 165 N -0.05 0.00 -3.29 5.31 4.39 -1.98 -3.47 114.58 115.50 4wbc h GLU 165 Ca -0.09 0.00 -0.63 0.00 0.34 0.00 0.00 59.36 58.98 4wbc h GLU 165 Cb 1.12 0.00 -0.40 0.00 -0.10 0.00 0.00 28.75 29.37 4wbc h GLU 165 CO -0.03 0.06 -0.69 -0.80 -1.16 0.00 0.00 179.01 176.39 4wbc s ASN 166 N -5.75 4.03 0.45 1.42 -0.87 -1.26 -5.10 114.94 107.86 4wbc s ASN 166 Ca -0.12 -2.73 -0.26 0.00 -1.57 0.00 0.00 52.86 48.19 4wbc s ASN 166 Cb 0.02 -1.33 -0.08 0.00 -0.02 0.00 0.00 41.25 39.83 4wbc s ASN 166 CO 0.19 -0.26 1.44 -2.16 -2.57 0.00 0.00 177.10 173.74 4wbc s PRO 167 N 0.16 3.71 0.89 -0.60 0.04 -1.26 -4.53 135.00 133.42 4wbc s PRO 167 Ca 0.17 2.44 -0.11 0.00 0.04 0.00 0.00 61.00 63.54 4wbc s PRO 167 Cb -0.25 -2.68 0.13 0.00 0.04 0.00 0.00 34.50 31.74 4wbc s PRO 167 CO -0.01 -0.80 1.09 -0.48 0.04 0.00 0.00 177.00 176.84 4wbc s LEU 168 N -2.67 2.38 -0.05 -3.56 0.05 -0.74 -4.95 118.68 109.14 4wbc s LEU 168 Ca 0.60 1.64 -0.02 0.00 0.05 0.00 0.00 54.13 56.41 4wbc s LEU 168 Cb -0.44 -4.08 0.03 0.00 -2.05 0.00 0.00 46.19 39.65 4wbc s LEU 168 CO 0.57 -2.69 0.04 -1.61 -0.55 0.00 0.00 176.35 172.12 4wbc s GLU 169 N -4.86 0.08 0.34 1.48 2.02 -1.26 -4.17 118.70 112.33 4wbc s GLU 169 Ca 0.64 0.30 0.08 0.00 0.02 0.00 0.00 54.97 56.01 4wbc s GLU 169 Cb -0.19 -0.59 -0.07 0.00 0.10 0.00 0.00 34.13 33.38 4wbc s GLU 169 CO 0.57 -0.31 -0.06 -0.51 0.02 0.00 0.00 175.26 174.97 4wbc s LEU 170 N 2.03 2.69 -0.03 1.80 1.43 0.39 -0.49 118.68 126.51 4wbc s LEU 170 Ca 0.04 -1.24 0.04 0.00 -1.03 0.00 0.00 54.13 51.94 4wbc s LEU 170 Cb -0.12 -0.89 -0.01 0.00 0.03 0.00 0.00 46.19 45.20 4wbc s LEU 170 CO -0.03 -0.29 -0.15 0.68 0.23 0.00 0.00 176.35 176.79 4wbc s VAL 171 N -2.73 1.19 -0.39 -1.59 -7.23 -0.05 -0.60 120.40 109.00 4wbc s VAL 171 Ca 0.33 -0.61 -0.15 0.00 -1.81 0.00 0.00 61.98 59.74 4wbc s VAL 171 Cb 0.04 -1.01 0.01 0.00 0.56 0.00 0.00 36.38 35.98 4wbc s VAL 171 CO 0.16 0.34 0.30 -0.76 -0.31 0.00 0.00 175.10 174.83 4wbc s LEU 172 N -0.11 4.89 -0.24 1.32 1.43 -1.26 -1.84 118.68 122.88 4wbc s LEU 172 Ca 0.01 -0.71 -0.09 0.00 -1.03 0.00 0.00 54.13 52.31 4wbc s LEU 172 Cb -0.08 -2.18 -0.04 0.00 0.03 0.00 0.00 46.19 43.91 4wbc s LEU 172 CO 0.01 -0.40 0.11 -0.22 0.23 0.00 0.00 176.35 176.08 4wbc s LEU 173 N 1.75 3.78 0.32 1.79 0.20 -0.45 0.08 118.68 126.15 4wbc s LEU 173 Ca 0.06 -0.03 -0.29 0.00 0.69 0.00 0.00 54.13 54.56 4wbc s LEU 173 Cb -0.18 -2.01 -0.11 0.00 -0.43 0.00 0.00 46.19 43.46 4wbc s LEU 173 CO 0.11 0.04 1.46 -0.75 -0.29 0.00 0.00 176.35 176.91 4wbc s LYS 174 N 1.21 4.21 0.10 1.98 2.47 -1.26 0.38 119.74 128.82 4wbc s LYS 174 Ca 0.06 2.42 -0.04 0.00 -1.56 0.00 0.00 55.97 56.86 4wbc s LYS 174 Cb -0.14 -3.04 -0.05 0.00 -1.46 0.00 0.00 37.83 33.14 4wbc s LYS 174 CO 0.05 -0.45 0.31 0.00 0.16 0.00 0.00 175.35 175.42 4wbc s ALA 175 N -0.60 3.87 0.31 3.13 0.00 -0.72 -4.81 121.76 122.94 4wbc s ALA 175 Ca 0.56 -0.65 0.07 0.00 0.00 0.00 0.00 51.96 51.94 4wbc s ALA 175 Cb -0.44 -2.03 0.78 0.00 0.00 0.00 0.00 23.12 21.43 4wbc s ALA 175 CO 0.52 0.72 1.78 -0.22 0.00 0.00 0.00 175.76 178.56 4wbc h LYS 176 N 3.04 0.71 -2.49 0.00 3.64 -1.95 -3.44 116.57 116.08 4wbc h LYS 176 Ca -0.46 -0.04 0.15 0.00 -1.27 0.00 0.00 60.65 59.03 4wbc h LYS 176 Cb 1.17 -0.16 -0.08 0.00 -0.41 0.00 0.00 32.23 32.75 4wbc h LYS 176 CO 0.73 0.47 0.43 0.45 -2.27 0.00 0.00 179.45 179.25 4wbc s SER 177 N -5.43 -0.20 0.00 4.20 0.15 -1.26 -5.10 113.70 106.06 4wbc s SER 177 Ca -0.11 -0.44 0.00 0.00 0.70 0.00 0.00 55.95 56.10 4wbc s SER 177 Cb 0.25 0.54 0.00 0.00 -1.71 0.00 0.00 66.02 65.10 4wbc s SER 177 CO 0.80 -1.00 0.00 -0.62 1.20 0.00 0.00 173.24 173.62 4wbc n GLU 178 N -0.46 0.00 -2.04 5.44 4.71 -1.26 -4.75 120.64 122.27 4wbc n GLU 178 Ca -0.06 0.00 -0.27 0.00 -0.01 0.00 0.00 57.16 56.83 4wbc n GLU 178 Cb 0.60 -0.07 -0.05 0.00 -1.01 0.00 0.00 31.44 30.92 4wbc n GLU 178 CO 0.00 0.00 0.00 -0.08 0.09 0.00 0.00 177.13 177.14 4wbc s THR 179 N 0.00 3.45 0.00 2.62 -1.32 -1.26 -4.74 115.64 114.39 4wbc s THR 179 Ca 0.00 -0.40 0.00 0.00 -1.21 0.00 0.00 61.69 60.08 4wbc s THR 179 Cb 0.00 -4.03 0.00 0.00 -1.51 0.00 0.00 72.50 66.96 4wbc s THR 179 CO 0.00 -0.94 0.00 0.00 -2.21 0.00 0.00 174.62 171.47