#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1w9s s LEU 8 N 0.00 3.79 0.01 -2.12 1.43 -1.26 -4.85 118.68 115.68 1w9s s LEU 8 Ca 0.00 1.13 0.01 0.00 -1.03 0.00 0.00 54.13 54.23 1w9s s LEU 8 Cb 0.00 -4.02 -0.04 0.00 0.03 0.00 0.00 46.19 42.16 1w9s s LEU 8 CO 0.00 -0.44 0.05 -0.54 0.23 0.00 0.00 176.35 175.66 1w9s s LYS 9 N -3.99 2.94 -0.41 1.70 1.02 0.14 -4.99 119.74 116.15 1w9s s LYS 9 Ca 0.51 -0.56 -0.15 0.00 0.02 0.00 0.00 55.97 55.79 1w9s s LYS 9 Cb -0.10 -2.77 0.02 0.00 -0.52 0.00 0.00 37.83 34.45 1w9s s LYS 9 CO 0.33 0.63 0.31 1.21 -0.92 0.00 0.00 175.35 176.92 1w9s s ASN 10 N -1.76 6.12 0.13 2.83 3.84 -1.26 -1.72 114.94 123.12 1w9s s ASN 10 Ca 0.22 -0.87 0.22 0.00 0.21 0.00 0.00 52.86 52.65 1w9s s ASN 10 Cb -0.12 -2.17 0.89 0.00 -0.55 0.00 0.00 41.25 39.30 1w9s s ASN 10 CO 0.14 -0.46 1.69 -0.81 -2.79 0.00 0.00 177.10 174.87 1w9s n PRO 11 N 5.21 0.12 -0.12 0.43 -0.04 -1.26 -2.93 135.00 136.40 1w9s n PRO 11 Ca -0.11 0.25 0.11 0.00 -0.04 0.00 0.00 63.50 63.72 1w9s n PRO 11 Cb 0.47 -1.68 0.29 0.00 -0.04 0.00 0.00 33.50 32.54 1w9s n PRO 11 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1w9s n TYR 12 N -1.89 0.32 -4.38 0.54 4.01 -1.26 -0.07 117.16 114.41 1w9s n TYR 12 Ca 0.04 -0.16 -0.20 0.00 -0.16 0.00 0.00 57.90 57.42 1w9s n TYR 12 Cb 0.27 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 39.20 1w9s n TYR 12 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 1w9s s GLU 13 N -1.68 1.44 0.28 -0.72 0.41 -1.15 -4.85 118.70 112.43 1w9s s GLU 13 Ca 0.35 -1.64 -0.30 0.00 -0.41 0.00 0.00 54.97 52.96 1w9s s GLU 13 Cb 0.20 -1.32 -0.13 0.00 -1.78 0.00 0.00 34.13 31.09 1w9s s GLU 13 CO 0.29 0.23 1.35 0.54 -0.49 0.00 0.00 175.26 177.18 1w9s n ARG 14 N -0.45 2.05 -4.25 1.61 1.74 -1.26 -4.73 116.66 111.37 1w9s n ARG 14 Ca -0.07 0.73 -0.34 0.00 -0.77 0.00 0.00 57.85 57.39 1w9s n ARG 14 Cb 0.60 -2.34 -0.13 0.00 -1.02 0.00 0.00 32.46 29.56 1w9s n ARG 14 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1w9s s ILE 15 N -0.49 3.52 0.07 0.55 1.01 0.35 -4.96 121.20 121.25 1w9s s ILE 15 Ca 0.63 -0.47 -0.30 0.00 0.00 0.00 0.00 60.65 60.51 1w9s s ILE 15 Cb -0.62 -2.56 -0.05 0.00 0.01 0.00 0.00 42.46 39.24 1w9s s ILE 15 CO 0.55 0.46 1.10 -1.10 0.00 0.00 0.00 174.94 175.96 1w9s s GLN 16 N 0.88 4.52 0.45 2.79 -1.52 -1.26 -1.26 119.66 124.25 1w9s s GLN 16 Ca -0.01 1.64 0.17 0.00 -1.95 0.00 0.00 55.36 55.22 1w9s s GLN 16 Cb -0.15 -3.37 1.06 0.00 -0.22 0.00 0.00 33.01 30.34 1w9s s GLN 16 CO 0.01 -0.10 1.98 0.00 -0.25 0.00 0.00 175.29 176.93 1w9s h ALA 17 N 6.37 1.53 0.00 6.09 0.00 -1.32 -1.58 119.26 130.36 1w9s h ALA 17 Ca -0.42 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.31 1w9s h ALA 17 Cb 1.22 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1w9s h ALA 17 CO 0.77 0.25 0.00 -0.85 0.00 0.00 0.00 179.25 179.42 1w9s n GLU 18 N -4.10 0.05 -0.98 0.00 0.00 -1.26 -3.73 120.64 110.62 1w9s n GLU 18 Ca -0.02 0.21 -0.17 0.00 0.00 0.00 0.00 57.16 57.18 1w9s n GLU 18 Cb 0.27 -1.59 0.01 0.00 0.00 0.00 0.00 31.44 30.14 1w9s n GLU 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1w9s n ALA 19 N -1.57 5.32 -1.92 -1.84 0.00 -0.59 -4.95 120.51 114.96 1w9s n ALA 19 Ca 0.04 -1.80 -0.31 0.00 0.00 0.00 0.00 53.44 51.37 1w9s n ALA 19 Cb 0.25 -1.51 -0.01 0.00 0.00 0.00 0.00 19.45 18.18 1w9s n ALA 19 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 1w9s s TYR 20 N -1.61 3.57 -0.10 0.00 1.13 -1.24 -4.93 117.35 114.16 1w9s s TYR 20 Ca 0.35 1.27 0.20 0.00 -1.41 0.00 0.00 57.07 57.49 1w9s s TYR 20 Cb 0.26 -2.68 -0.30 0.00 -1.10 0.00 0.00 41.96 38.14 1w9s s TYR 20 CO -0.04 -0.53 0.35 -0.25 -2.51 0.00 0.00 175.55 172.57 1w9s n ASP 21 N -2.31 0.04 -3.63 -0.18 8.00 0.82 -4.99 116.55 114.30 1w9s n ASP 21 Ca 0.05 0.02 -0.10 0.00 0.71 0.00 0.00 54.79 55.47 1w9s n ASP 21 Cb 0.54 1.57 -0.04 0.00 -0.02 0.00 0.00 41.12 43.16 1w9s n ASP 21 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1w9s s ALA 22 N -3.13 -0.97 0.22 2.24 0.00 -1.17 -5.00 121.76 113.95 1w9s s ALA 22 Ca -0.08 -0.04 -0.12 0.00 0.00 0.00 0.00 51.96 51.71 1w9s s ALA 22 Cb 0.11 0.74 -0.00 0.00 0.00 0.00 0.00 23.12 23.97 1w9s s ALA 22 CO 0.88 -0.68 0.44 0.00 0.00 0.00 0.00 175.76 176.40 1w9s s MET 23 N -3.81 1.45 -0.07 0.00 0.23 -1.26 -0.53 119.30 115.31 1w9s s MET 23 Ca 0.04 -1.20 -0.03 0.00 -1.03 0.00 0.00 55.69 53.48 1w9s s MET 23 Cb 0.01 0.46 0.04 0.00 -1.53 0.00 0.00 34.83 33.81 1w9s s MET 23 CO -0.11 -0.59 0.07 0.45 -2.03 0.00 0.00 175.02 172.81 1w9s s SER 24 N -2.99 1.39 0.00 -1.18 0.15 -0.15 -4.95 113.70 105.98 1w9s s SER 24 Ca 0.20 -0.07 0.00 0.00 0.70 0.00 0.00 55.95 56.79 1w9s s SER 24 Cb 0.00 -0.16 0.00 0.00 -1.71 0.00 0.00 66.02 64.16 1w9s s SER 24 CO 0.06 -0.27 0.00 0.61 1.20 0.00 0.00 173.24 174.84 1w9s n GLY 25 N 5.30 0.66 3.74 9.45 0.00 -1.26 -1.91 105.19 121.17 1w9s n GLY 25 Ca -0.04 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.71 1w9s n GLY 25 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1w9s s ILE 26 N -2.53 1.95 0.07 -0.61 -5.25 -1.26 -4.69 121.20 108.88 1w9s s ILE 26 Ca 0.00 -1.79 -0.04 0.00 -0.99 0.00 0.00 60.65 57.83 1w9s s ILE 26 Cb 0.00 -2.73 -0.03 0.00 2.95 0.00 0.00 42.46 42.65 1w9s s ILE 26 CO 0.00 0.00 0.07 -1.58 -1.79 0.00 0.00 174.94 171.64 1w9s s GLN 27 N -3.91 0.73 0.20 0.37 0.74 -0.87 -5.00 119.66 111.93 1w9s s GLN 27 Ca 0.32 -1.14 0.07 0.00 0.05 0.00 0.00 55.36 54.67 1w9s s GLN 27 Cb 0.04 0.27 -0.04 0.00 1.10 0.00 0.00 33.01 34.38 1w9s s GLN 27 CO 0.18 -0.19 0.06 0.95 -0.55 0.00 0.00 175.29 175.74 1w9s s THR 28 N -3.91 3.97 0.16 -0.34 -4.23 -1.26 -0.62 115.64 109.42 1w9s s THR 28 Ca 0.08 -1.41 -0.14 0.00 -1.18 0.00 0.00 61.69 59.04 1w9s s THR 28 Cb 0.07 -3.05 0.02 0.00 1.34 0.00 0.00 72.50 70.88 1w9s s THR 28 CO -0.09 -0.19 0.40 -1.83 -0.54 0.00 0.00 174.62 172.37 1w9s s GLU 29 N -3.22 1.20 0.31 3.99 -1.05 -0.49 -4.94 118.70 114.50 1w9s s GLU 29 Ca 0.30 -0.92 -0.29 0.00 -0.15 0.00 0.00 54.97 53.91 1w9s s GLU 29 Cb -0.09 0.46 -0.10 0.00 -0.44 0.00 0.00 34.13 33.96 1w9s s GLU 29 CO 0.21 -0.48 1.19 0.20 0.95 0.00 0.00 175.26 177.33 1w9s s GLY 30 N -2.88 3.02 0.03 -3.83 0.00 -1.26 -1.00 107.32 101.39 1w9s s GLY 30 Ca 0.09 1.05 -0.03 0.00 0.00 0.00 0.00 44.72 45.84 1w9s s GLY 30 CO -0.05 1.66 0.22 -1.08 0.00 0.00 0.00 173.10 173.85 1w9s s THR 31 N -1.18 5.38 -2.26 0.90 -1.32 -0.21 -4.72 115.64 112.23 1w9s s THR 31 Ca 0.48 -0.17 0.21 0.00 -1.21 0.00 0.00 61.69 60.99 1w9s s THR 31 Cb -0.35 -3.58 0.47 0.00 -1.51 0.00 0.00 72.50 67.53 1w9s s THR 31 CO 0.45 0.25 1.57 0.47 -2.21 0.00 0.00 174.62 175.15 1w9s n ASP 32 N 0.69 1.51 -4.76 8.08 8.00 -1.26 -4.49 116.55 124.33 1w9s n ASP 32 Ca -0.08 -1.67 -0.30 0.00 0.71 0.00 0.00 54.79 53.44 1w9s n ASP 32 Cb 0.52 -0.09 0.11 0.00 -0.02 0.00 0.00 41.12 41.64 1w9s n ASP 32 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1w9s s ASP 33 N -1.58 4.06 0.39 -2.24 2.15 -1.26 -4.88 116.67 113.29 1w9s s ASP 33 Ca 0.32 1.51 -0.26 0.00 0.43 0.00 0.00 52.55 54.55 1w9s s ASP 33 Cb 0.17 -2.22 -0.09 0.00 -0.30 0.00 0.00 42.92 40.48 1w9s s ASP 33 CO 0.26 -2.27 1.23 1.51 -0.17 0.00 0.00 175.17 175.73 1w9s s ASP 34 N -3.57 6.52 0.00 -0.34 3.84 -1.26 -2.06 116.67 119.80 1w9s s ASP 34 Ca 0.62 2.49 0.00 0.00 -0.00 0.00 0.00 52.55 55.66 1w9s s ASP 34 Cb -0.17 -2.63 0.00 0.00 -1.38 0.00 0.00 42.92 38.75 1w9s s ASP 34 CO 0.56 -0.69 0.00 0.61 -0.00 0.00 0.00 175.17 175.65 1w9s n GLY 35 N 0.71 0.96 7.00 2.12 0.00 -1.26 -4.95 105.19 109.77 1w9s n GLY 35 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1w9s n GLY 35 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1w9s n GLY 36 N -2.00 1.69 6.24 -0.02 0.00 -0.88 -5.00 105.19 105.23 1w9s n GLY 36 Ca 0.00 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.51 1w9s n GLY 36 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1w9s n GLY 37 N 0.00 -0.22 3.20 -0.02 0.00 -1.26 -4.78 105.19 102.11 1w9s n GLY 37 Ca 0.00 -1.16 -0.13 0.00 0.00 0.00 0.00 46.02 44.73 1w9s n GLY 37 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1w9s s ASP 38 N -4.00 1.42 0.20 1.61 1.01 -1.26 -1.04 116.67 114.60 1w9s s ASP 38 Ca 0.00 -0.95 0.07 0.00 0.71 0.00 0.00 52.55 52.38 1w9s s ASP 38 Cb 0.00 0.04 -0.05 0.00 1.01 0.00 0.00 42.92 43.92 1w9s s ASP 38 CO 0.00 -0.37 -0.13 0.54 0.21 0.00 0.00 175.17 175.42 1w9s s ASN 39 N -2.91 2.43 0.29 0.27 4.22 -0.17 -4.71 114.94 114.36 1w9s s ASN 39 Ca 0.11 -1.03 -0.10 0.00 -2.14 0.00 0.00 52.86 49.71 1w9s s ASN 39 Cb 0.02 -0.11 -0.07 0.00 1.28 0.00 0.00 41.25 42.37 1w9s s ASN 39 CO -0.02 -0.21 0.63 0.27 -2.04 0.00 0.00 177.10 175.73 1w9s s ILE 40 N -3.04 4.88 0.00 0.54 -4.36 -0.51 -1.39 121.20 117.31 1w9s s ILE 40 Ca 0.22 0.50 0.00 0.00 -0.26 0.00 0.00 60.65 61.11 1w9s s ILE 40 Cb 0.00 -3.66 0.00 0.00 1.25 0.00 0.00 42.46 40.05 1w9s s ILE 40 CO 0.06 -0.23 0.00 0.61 0.24 0.00 0.00 174.94 175.62 1w9s n GLY 41 N -0.57 3.08 3.94 6.27 0.00 0.21 -1.64 105.19 116.48 1w9s n GLY 41 Ca 0.01 -0.86 -0.26 0.00 0.00 0.00 0.00 46.02 44.90 1w9s n GLY 41 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1w9s n TRP 42 N 0.00 -1.73 -3.43 1.61 8.01 -1.26 -2.04 117.44 118.60 1w9s n TRP 42 Ca 0.00 0.78 -0.37 0.00 -1.31 0.00 0.00 57.50 56.59 1w9s n TRP 42 Cb 0.00 -3.78 -0.07 0.00 -2.01 0.00 0.00 31.31 25.46 1w9s n TRP 42 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.69 177.10 1w9s s ILE 43 N -3.81 5.25 0.21 -0.99 1.01 -1.26 -4.35 121.20 117.25 1w9s s ILE 43 Ca 0.11 0.74 0.06 0.00 0.00 0.00 0.00 60.65 61.57 1w9s s ILE 43 Cb -0.06 -3.72 -0.05 0.00 0.01 0.00 0.00 42.46 38.64 1w9s s ILE 43 CO 0.88 0.35 -0.11 0.20 0.00 0.00 0.00 174.94 176.26 1w9s s ASN 44 N 0.58 2.39 -0.15 3.58 -0.87 -1.26 -0.19 114.94 119.01 1w9s s ASN 44 Ca 0.21 -1.07 -0.37 0.00 -1.57 0.00 0.00 52.86 50.06 1w9s s ASN 44 Cb -0.14 -0.10 -0.14 0.00 -0.02 0.00 0.00 41.25 40.85 1w9s s ASN 44 CO 0.07 -0.27 1.77 -0.67 -2.57 0.00 0.00 177.10 175.43 1w9s n ASP 45 N -0.39 2.83 0.00 -1.22 2.03 -1.26 -1.30 116.55 117.23 1w9s n ASP 45 Ca -0.08 1.04 0.00 0.00 0.52 0.00 0.00 54.79 56.27 1w9s n ASP 45 Cb 0.61 -1.26 0.00 0.00 -0.72 0.00 0.00 41.12 39.76 1w9s n ASP 45 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1w9s n GLY 46 N 4.13 0.48 3.78 0.27 0.00 0.13 -4.97 105.19 109.01 1w9s n GLY 46 Ca 0.24 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.96 1w9s n GLY 46 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1w9s s ASP 47 N -2.37 4.08 0.20 1.61 1.01 -0.42 -4.81 116.67 115.98 1w9s s ASP 47 Ca 0.00 1.30 -0.22 0.00 0.71 0.00 0.00 52.55 54.34 1w9s s ASP 47 Cb 0.00 -2.01 0.05 0.00 1.01 0.00 0.00 42.92 41.97 1w9s s ASP 47 CO 0.00 -2.23 0.67 -1.66 0.21 0.00 0.00 175.17 172.16 1w9s s TRP 48 N -3.11 -0.38 0.03 4.23 1.48 -0.80 -0.97 118.94 119.41 1w9s s TRP 48 Ca 0.62 0.06 0.04 0.00 -1.06 0.00 0.00 56.10 55.76 1w9s s TRP 48 Cb -0.15 0.62 -0.02 0.00 -1.16 0.00 0.00 33.47 32.76 1w9s s TRP 48 CO 0.55 -1.00 -0.11 0.14 -4.06 0.00 0.00 176.95 172.47 1w9s s VAL 49 N -3.78 0.88 -0.09 -0.66 -7.23 -0.46 -0.97 120.40 108.08 1w9s s VAL 49 Ca 0.06 -0.84 0.03 0.00 -1.81 0.00 0.00 61.98 59.42 1w9s s VAL 49 Cb -0.03 -0.81 -0.01 0.00 0.56 0.00 0.00 36.38 36.09 1w9s s VAL 49 CO -0.04 -0.03 -0.20 -0.75 -0.31 0.00 0.00 175.10 173.77 1w9s s LYS 50 N -0.98 2.93 -0.26 4.82 2.20 0.31 -1.37 119.74 127.39 1w9s s LYS 50 Ca -0.00 -0.81 0.01 0.00 -0.36 0.00 0.00 55.97 54.80 1w9s s LYS 50 Cb -0.07 -2.36 0.05 0.00 -1.51 0.00 0.00 37.83 33.94 1w9s s LYS 50 CO 0.01 0.30 -0.08 0.71 -0.36 0.00 0.00 175.35 175.92 1w9s s TYR 51 N 0.07 3.21 0.47 4.03 1.51 0.08 -0.13 117.35 126.60 1w9s s TYR 51 Ca -0.09 -2.08 -0.19 0.00 -1.01 0.00 0.00 57.07 53.71 1w9s s TYR 51 Cb -0.15 -1.99 -0.09 0.00 -0.11 0.00 0.00 41.96 39.61 1w9s s TYR 51 CO 0.06 -0.84 0.97 -1.21 -1.11 0.00 0.00 175.55 173.42 1w9s s GLU 52 N 1.18 4.08 -1.31 -0.62 2.02 -1.26 -0.81 118.70 121.97 1w9s s GLU 52 Ca -0.06 1.05 -0.05 0.00 0.02 0.00 0.00 54.97 55.93 1w9s s GLU 52 Cb -0.19 -2.16 0.01 0.00 0.10 0.00 0.00 34.13 31.90 1w9s s GLU 52 CO -0.04 -0.16 1.01 0.54 0.02 0.00 0.00 175.26 176.62 1w9s n ARG 53 N -1.10 -6.62 -3.02 1.61 1.74 -1.10 -4.52 116.66 103.65 1w9s n ARG 53 Ca 0.07 0.77 -0.42 0.00 -0.77 0.00 0.00 57.85 57.50 1w9s n ARG 53 Cb 0.54 -5.70 -0.06 0.00 -1.02 0.00 0.00 32.46 26.22 1w9s n ARG 53 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1w9s s VAL 54 N -3.39 4.85 -0.29 1.55 1.01 0.05 -0.69 120.40 123.49 1w9s s VAL 54 Ca 0.28 0.98 -0.08 0.00 0.00 0.00 0.00 61.98 63.16 1w9s s VAL 54 Cb -0.13 -4.09 -0.00 0.00 0.00 0.00 0.00 36.38 32.16 1w9s s VAL 54 CO 0.76 -0.23 0.10 -2.28 0.00 0.00 0.00 175.10 173.44 1w9s s HIS 55 N 2.82 3.14 -0.32 5.22 2.46 -0.70 -0.89 115.29 127.02 1w9s s HIS 55 Ca 0.29 -0.73 -0.14 0.00 0.47 0.00 0.00 55.06 54.95 1w9s s HIS 55 Cb -0.14 -2.28 -0.02 0.00 -0.13 0.00 0.00 32.58 30.00 1w9s s HIS 55 CO 0.13 -0.49 0.30 -0.06 -2.47 0.00 0.00 174.74 172.15 1w9s s PHE 56 N 1.56 3.22 -0.55 3.88 0.40 0.20 -4.29 117.98 122.40 1w9s s PHE 56 Ca 0.04 -0.00 0.24 0.00 -0.60 0.00 0.00 56.93 56.61 1w9s s PHE 56 Cb -0.17 -2.56 0.47 0.00 0.51 0.00 0.00 43.02 41.27 1w9s s PHE 56 CO 0.04 -0.35 1.56 1.05 0.70 0.00 0.00 175.22 178.22 1w9s h GLU 57 N 8.42 0.00 -3.65 0.44 4.11 -1.94 -1.87 114.58 120.09 1w9s h GLU 57 Ca -0.31 0.00 -0.08 0.00 0.07 0.00 0.00 59.36 59.04 1w9s h GLU 57 Cb 1.16 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.27 1w9s h GLU 57 CO 0.65 0.00 -0.29 -0.98 0.07 0.00 0.00 179.01 178.46 1w9s s ARG 58 N -3.18 0.89 0.32 1.06 1.70 -1.26 -4.87 118.95 113.61 1w9s s ARG 58 Ca 0.07 -0.85 -0.29 0.00 -0.47 0.00 0.00 55.73 54.19 1w9s s ARG 58 Cb 0.09 0.37 -0.11 0.00 -0.57 0.00 0.00 34.95 34.74 1w9s s ARG 58 CO 0.67 -0.30 1.54 -0.51 -1.08 0.00 0.00 175.30 175.62 1w9s s ASP 59 N -2.75 6.39 0.02 -2.89 1.01 -1.26 -4.49 116.67 112.70 1w9s s ASP 59 Ca 0.03 2.96 -0.10 0.00 0.71 0.00 0.00 52.55 56.15 1w9s s ASP 59 Cb 0.03 -2.65 -0.05 0.00 1.01 0.00 0.00 42.92 41.26 1w9s s ASP 59 CO -0.10 -0.88 0.35 0.00 0.21 0.00 0.00 175.17 174.75 1w9s s ALA 60 N -0.40 3.76 -0.01 5.23 0.00 -0.17 -4.50 121.76 125.66 1w9s s ALA 60 Ca 0.59 -0.39 0.00 0.00 0.00 0.00 0.00 51.96 52.16 1w9s s ALA 60 Cb -0.47 -2.24 -0.01 0.00 0.00 0.00 0.00 23.12 20.41 1w9s s ALA 60 CO 0.53 0.56 0.02 -1.13 0.00 0.00 0.00 175.76 175.73 1w9s n SER 61 N 1.33 1.65 -3.71 0.00 3.41 0.14 -2.38 113.62 114.07 1w9s n SER 61 Ca -0.12 -0.34 -0.10 0.00 -0.26 0.00 0.00 58.87 58.06 1w9s n SER 61 Cb 0.53 1.01 -0.04 0.00 -0.26 0.00 0.00 64.21 65.45 1w9s n SER 61 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1w9s s SER 62 N -1.38 -0.27 0.05 4.04 1.04 -1.14 -1.75 113.70 114.29 1w9s s SER 62 Ca 0.00 -0.43 0.07 0.00 0.48 0.00 0.00 55.95 56.07 1w9s s SER 62 Cb 0.00 0.57 -0.03 0.00 0.10 0.00 0.00 66.02 66.66 1w9s s SER 62 CO 0.02 -1.02 -0.20 -0.51 0.98 0.00 0.00 173.24 172.50 1w9s s ILE 63 N -3.86 1.63 -0.09 -1.02 2.07 -0.05 -1.22 121.20 118.65 1w9s s ILE 63 Ca 0.08 -1.22 0.04 0.00 -1.41 0.00 0.00 60.65 58.14 1w9s s ILE 63 Cb -0.01 -1.43 0.00 0.00 0.13 0.00 0.00 42.46 41.16 1w9s s ILE 63 CO -0.05 0.16 -0.22 -1.61 -1.91 0.00 0.00 174.94 171.32 1w9s s GLU 64 N -1.25 2.84 -0.03 3.50 2.02 0.48 -1.48 118.70 124.78 1w9s s GLU 64 Ca 0.07 -0.81 0.03 0.00 0.02 0.00 0.00 54.97 54.28 1w9s s GLU 64 Cb -0.09 -2.16 0.00 0.00 0.10 0.00 0.00 34.13 31.99 1w9s s GLU 64 CO 0.02 0.15 -0.11 0.08 0.02 0.00 0.00 175.26 175.43 1w9s s VAL 65 N 0.40 0.94 -0.29 2.63 1.01 0.20 -0.83 120.40 124.46 1w9s s VAL 65 Ca -0.18 -0.43 -0.18 0.00 0.00 0.00 0.00 61.98 61.18 1w9s s VAL 65 Cb -0.18 -0.84 -0.02 0.00 0.00 0.00 0.00 36.38 35.35 1w9s s VAL 65 CO 0.08 0.29 0.53 -0.60 0.00 0.00 0.00 175.10 175.40 1w9s s ARG 66 N 0.26 3.95 0.10 2.72 6.06 -0.34 -1.21 118.95 130.49 1w9s s ARG 66 Ca -0.05 0.21 0.01 0.00 -2.50 0.00 0.00 55.73 53.40 1w9s s ARG 66 Cb -0.10 -3.70 -0.04 0.00 0.06 0.00 0.00 34.95 31.17 1w9s s ARG 66 CO 0.01 -0.44 -0.04 0.14 -2.50 0.00 0.00 175.30 172.47 1w9s s VAL 67 N 2.37 0.52 0.01 7.11 -7.23 0.32 -1.13 120.40 122.38 1w9s s VAL 67 Ca 0.21 -1.91 -0.09 0.00 -1.81 0.00 0.00 61.98 58.39 1w9s s VAL 67 Cb -0.15 -1.73 0.00 0.00 0.56 0.00 0.00 36.38 35.06 1w9s s VAL 67 CO 0.10 -0.82 0.17 0.00 -0.31 0.00 0.00 175.10 174.24 1w9s s ALA 68 N -3.74 -0.37 -0.27 1.32 0.00 -0.64 -1.18 121.76 116.88 1w9s s ALA 68 Ca 0.13 -0.15 -0.23 0.00 0.00 0.00 0.00 51.96 51.71 1w9s s ALA 68 Cb 0.06 0.16 0.08 0.00 0.00 0.00 0.00 23.12 23.42 1w9s s ALA 68 CO -0.04 -0.26 0.75 0.45 0.00 0.00 0.00 175.76 176.65 1w9s s SER 69 N -1.63 -0.77 0.00 0.00 0.15 -1.11 -0.21 113.70 110.14 1w9s s SER 69 Ca -0.11 1.40 0.23 0.00 0.70 0.00 0.00 55.95 58.16 1w9s s SER 69 Cb -0.05 1.39 0.49 0.00 -1.71 0.00 0.00 66.02 66.14 1w9s s SER 69 CO 0.00 -0.24 1.43 -0.67 1.20 0.00 0.00 173.24 174.97 1w9s n ASP 70 N 3.08 2.89 -2.71 5.45 2.03 -1.25 -1.19 116.55 124.86 1w9s n ASP 70 Ca -0.15 -1.91 -0.10 0.00 0.52 0.00 0.00 54.79 53.15 1w9s n ASP 70 Cb 0.56 -0.17 -0.02 0.00 -0.72 0.00 0.00 41.12 40.77 1w9s n ASP 70 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 1w9s n THR 71 N 1.14 0.00 0.14 5.18 -2.24 -1.26 -4.84 114.28 112.41 1w9s n THR 71 Ca 0.18 -0.75 0.03 0.00 -2.27 0.00 0.00 64.05 61.24 1w9s n THR 71 Cb 0.53 0.17 0.13 0.00 -2.10 0.00 0.00 70.33 69.07 1w9s n THR 71 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 1w9s n PRO 72 N -0.37 0.02 0.00 -0.78 -0.02 -1.26 -3.56 135.00 129.02 1w9s n PRO 72 Ca -0.06 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 61.87 1w9s n PRO 72 Cb 0.20 -1.55 0.00 0.00 -0.02 0.00 0.00 33.50 32.13 1w9s n PRO 72 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1w9s n GLY 73 N -1.09 -0.63 0.00 -1.23 0.00 -1.25 -3.55 105.19 97.44 1w9s n GLY 73 Ca 0.01 -1.55 0.00 0.00 0.00 0.00 0.00 46.02 44.48 1w9s n GLY 73 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1w9s n GLY 74 N 0.00 -0.81 3.16 -0.02 0.00 -0.07 -4.69 105.19 102.76 1w9s n GLY 74 Ca 0.00 -0.23 -0.08 0.00 0.00 0.00 0.00 46.02 45.70 1w9s n GLY 74 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1w9s s ARG 75 N -0.66 0.81 -0.16 1.61 1.70 0.22 -0.47 118.95 122.00 1w9s s ARG 75 Ca 0.00 -1.20 0.02 0.00 -0.47 0.00 0.00 55.73 54.07 1w9s s ARG 75 Cb 0.00 0.27 0.01 0.00 -0.57 0.00 0.00 34.95 34.66 1w9s s ARG 75 CO 0.00 -0.22 -0.20 0.42 -1.08 0.00 0.00 175.30 174.22 1w9s s ILE 76 N -3.94 2.13 -0.08 4.99 1.01 0.04 -1.31 121.20 124.03 1w9s s ILE 76 Ca 0.12 -0.94 -0.14 0.00 0.00 0.00 0.00 60.65 59.69 1w9s s ILE 76 Cb 0.07 -1.87 -0.05 0.00 0.01 0.00 0.00 42.46 40.61 1w9s s ILE 76 CO -0.06 0.54 0.34 -1.61 0.00 0.00 0.00 174.94 174.14 1w9s s GLU 77 N 1.05 4.01 -0.31 2.79 2.02 0.44 -0.91 118.70 127.77 1w9s s GLU 77 Ca -0.01 0.23 -0.11 0.00 0.02 0.00 0.00 54.97 55.10 1w9s s GLU 77 Cb -0.14 -3.31 -0.02 0.00 0.10 0.00 0.00 34.13 30.76 1w9s s GLU 77 CO -0.07 0.50 0.19 0.42 0.02 0.00 0.00 175.26 176.31 1w9s s ILE 78 N -0.37 4.96 0.13 -1.63 -1.09 -0.14 -1.22 121.20 121.84 1w9s s ILE 78 Ca 0.20 -0.22 0.05 0.00 -2.23 0.00 0.00 60.65 58.45 1w9s s ILE 78 Cb -0.15 -3.49 -0.04 0.00 -1.58 0.00 0.00 42.46 37.20 1w9s s ILE 78 CO 0.08 0.09 -0.11 -0.13 -1.23 0.00 0.00 174.94 173.64 1w9s s ARG 79 N 1.68 0.98 0.17 2.79 0.52 -0.57 -0.30 118.95 124.22 1w9s s ARG 79 Ca 0.06 -1.31 0.07 0.00 -0.52 0.00 0.00 55.73 54.02 1w9s s ARG 79 Cb -0.17 -0.66 -0.04 0.00 0.52 0.00 0.00 34.95 34.60 1w9s s ARG 79 CO 0.08 0.10 -0.14 0.95 0.02 0.00 0.00 175.30 176.32 1w9s s THR 80 N -2.77 1.53 0.00 0.02 -4.23 -1.26 -0.26 115.64 108.67 1w9s s THR 80 Ca 0.11 -2.04 0.00 0.00 -1.18 0.00 0.00 61.69 58.59 1w9s s THR 80 Cb -0.01 -1.86 0.00 0.00 1.34 0.00 0.00 72.50 71.97 1w9s s THR 80 CO 0.01 -0.56 0.00 0.61 -0.54 0.00 0.00 174.62 174.14 1w9s n GLY 81 N -0.06 2.17 3.85 3.99 0.00 -0.22 -4.01 105.19 110.92 1w9s n GLY 81 Ca -0.11 -0.39 -0.07 0.00 0.00 0.00 0.00 46.02 45.45 1w9s n GLY 81 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1w9s s SER 82 N 0.00 -0.23 0.51 1.61 1.04 -1.26 -4.95 113.70 110.42 1w9s s SER 82 Ca 0.00 -0.66 0.34 0.00 0.48 0.00 0.00 55.95 56.11 1w9s s SER 82 Cb 0.00 0.74 1.77 0.00 0.10 0.00 0.00 66.02 68.63 1w9s s SER 82 CO 0.00 -1.37 2.04 -0.65 0.98 0.00 0.00 173.24 174.24 1w9s h PRO 83 N 2.00 0.00 -0.24 4.02 0.11 -1.95 -1.52 132.00 134.42 1w9s h PRO 83 Ca -0.20 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.91 1w9s h PRO 83 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1w9s h PRO 83 CO 0.25 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.29 1w9s n THR 84 N -2.75 0.35 -0.77 -1.15 -2.24 -1.26 -4.99 114.28 101.46 1w9s n THR 84 Ca -0.02 -0.67 -0.32 0.00 -2.27 0.00 0.00 64.05 60.77 1w9s n THR 84 Cb 0.10 1.10 0.16 0.00 -2.10 0.00 0.00 70.33 69.60 1w9s n THR 84 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1w9s n GLY 85 N 1.23 -0.32 3.58 3.38 0.00 -0.58 -4.84 105.19 107.64 1w9s n GLY 85 Ca 0.15 -0.67 -0.50 0.00 0.00 0.00 0.00 46.02 45.01 1w9s n GLY 85 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1w9s n THR 86 N -4.04 0.69 -2.06 2.61 -1.04 -1.26 -4.51 114.28 104.66 1w9s n THR 86 Ca 0.12 -0.17 -0.42 0.00 -2.04 0.00 0.00 64.05 61.54 1w9s n THR 86 Cb 0.52 -0.83 -0.03 0.00 -1.82 0.00 0.00 70.33 68.17 1w9s n THR 86 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 1w9s s LEU 87 N 0.62 4.32 0.00 -4.42 2.96 -1.26 -4.07 118.68 116.84 1w9s s LEU 87 Ca 0.76 2.22 0.22 0.00 -0.22 0.00 0.00 54.13 57.11 1w9s s LEU 87 Cb -0.88 -3.54 -0.19 0.00 0.50 0.00 0.00 46.19 42.08 1w9s s LEU 87 CO 0.51 -0.87 0.81 0.18 -1.32 0.00 0.00 176.35 175.66 1w9s n LEU 88 N 6.51 0.60 0.00 -0.68 4.77 0.59 -5.02 117.00 123.77 1w9s n LEU 88 Ca 0.16 -0.23 0.00 0.00 -0.03 0.00 0.00 56.01 55.91 1w9s n LEU 88 Cb 0.43 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.49 1w9s n LEU 88 CO 0.61 0.12 0.00 0.61 -1.33 0.00 0.00 177.39 177.41 1w9s n GLY 89 N 1.40 0.50 3.31 -0.72 0.00 -1.24 -0.95 105.19 107.48 1w9s n GLY 89 Ca 0.01 -1.05 -0.10 0.00 0.00 0.00 0.00 46.02 44.88 1w9s n GLY 89 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1w9s s ASP 90 N 0.00 0.10 -0.03 1.61 3.84 -1.22 -0.96 116.67 120.01 1w9s s ASP 90 Ca 0.00 -1.11 0.01 0.00 -0.00 0.00 0.00 52.55 51.45 1w9s s ASP 90 Cb 0.00 0.42 0.02 0.00 -1.38 0.00 0.00 42.92 41.98 1w9s s ASP 90 CO 0.00 -0.90 -0.02 -0.69 -0.00 0.00 0.00 175.17 173.57 1w9s s VAL 91 N -4.05 0.30 0.02 2.11 1.01 -0.09 -4.11 120.40 115.59 1w9s s VAL 91 Ca 0.26 -0.01 -0.20 0.00 0.00 0.00 0.00 61.98 62.03 1w9s s VAL 91 Cb 0.04 -0.36 -0.06 0.00 0.00 0.00 0.00 36.38 36.01 1w9s s VAL 91 CO 0.06 0.16 0.59 -1.10 0.00 0.00 0.00 175.10 174.81 1w9s s GLN 92 N 0.85 4.29 -0.19 2.72 -1.52 -1.26 -0.78 119.66 123.76 1w9s s GLN 92 Ca -0.09 0.74 0.01 0.00 -1.95 0.00 0.00 55.36 54.07 1w9s s GLN 92 Cb -0.13 -3.31 0.03 0.00 -0.22 0.00 0.00 33.01 29.38 1w9s s GLN 92 CO -0.01 0.44 -0.18 0.08 -0.25 0.00 0.00 175.29 175.37 1w9s s VAL 93 N -0.44 2.04 0.62 1.09 1.01 0.38 -4.83 120.40 120.27 1w9s s VAL 93 Ca 0.31 -1.05 -0.02 0.00 0.00 0.00 0.00 61.98 61.22 1w9s s VAL 93 Cb -0.19 -1.91 0.05 0.00 0.00 0.00 0.00 36.38 34.33 1w9s s VAL 93 CO 0.18 0.42 0.88 -2.16 0.00 0.00 0.00 175.10 174.42 1w9s s PRO 94 N 1.27 2.37 0.27 2.72 0.04 -1.26 -0.89 135.00 139.52 1w9s s PRO 94 Ca 0.02 -0.59 -0.31 0.00 0.04 0.00 0.00 61.00 60.16 1w9s s PRO 94 Cb -0.14 -2.36 -0.12 0.00 0.04 0.00 0.00 34.50 31.92 1w9s s PRO 94 CO -0.11 -0.95 1.52 -1.71 0.04 0.00 0.00 177.00 175.79 1w9s n ASN 95 N -2.59 3.40 -0.22 6.66 5.15 -1.23 -4.47 115.26 121.97 1w9s n ASN 95 Ca 0.08 1.14 0.03 0.00 -0.60 0.00 0.00 54.58 55.23 1w9s n ASN 95 Cb 0.60 -1.52 0.02 0.00 -0.53 0.00 0.00 39.78 38.35 1w9s n ASN 95 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1w9s n THR 96 N 2.10 0.00 -0.10 -0.44 -2.24 -0.33 -4.93 114.28 108.34 1w9s n THR 96 Ca 0.10 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.38 1w9s n THR 96 Cb 0.34 1.11 0.00 0.00 -2.10 0.00 0.00 70.33 69.69 1w9s n THR 96 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1w9s n GLY 97 N 0.32 0.64 0.00 3.38 0.00 -1.12 -4.79 105.19 103.62 1w9s n GLY 97 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1w9s n GLY 97 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1w9s n GLY 98 N -2.02 2.04 0.17 -0.02 0.00 -1.09 -4.90 105.19 99.37 1w9s n GLY 98 Ca 0.00 -0.94 0.14 0.00 0.00 0.00 0.00 46.02 45.22 1w9s n GLY 98 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 1w9s h TRP 99 N 0.00 0.00 0.00 1.61 -0.00 -1.91 -2.59 115.95 113.06 1w9s h TRP 99 Ca 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 58.89 58.82 1w9s h TRP 99 Cb 0.00 0.00 -0.16 0.00 -0.00 0.00 0.00 29.16 29.00 1w9s h TRP 99 CO 0.00 0.00 -0.70 1.04 -0.00 0.00 0.00 178.44 178.78 1w9s n GLN 100 N -2.52 0.90 -3.31 0.49 1.13 -1.26 -4.68 117.38 108.12 1w9s n GLN 100 Ca 0.02 -2.69 -0.46 0.00 -1.94 0.00 0.00 57.00 51.93 1w9s n GLN 100 Cb 0.28 -0.94 -0.05 0.00 0.11 0.00 0.00 30.24 29.64 1w9s n GLN 100 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 1w9s s GLN 101 N -1.84 3.01 0.04 -1.09 -1.52 -0.99 -4.79 119.66 112.48 1w9s s GLN 101 Ca 0.35 -1.74 -0.15 0.00 -1.95 0.00 0.00 55.36 51.88 1w9s s GLN 101 Cb 0.36 -4.30 -0.06 0.00 -0.22 0.00 0.00 33.01 28.79 1w9s s GLN 101 CO -0.10 -1.33 0.45 -1.58 -0.25 0.00 0.00 175.29 172.47 1w9s s TRP 102 N 1.55 3.70 0.06 0.91 0.52 -1.26 -4.33 118.94 120.09 1w9s s TRP 102 Ca 0.04 1.01 -0.07 0.00 0.02 0.00 0.00 56.10 57.10 1w9s s TRP 102 Cb -0.29 -2.31 -0.01 0.00 -1.15 0.00 0.00 33.47 29.71 1w9s s TRP 102 CO 0.03 0.59 0.13 -1.14 0.02 0.00 0.00 176.95 176.58 1w9s s GLN 103 N -1.31 0.70 -0.19 4.98 0.74 -0.33 -4.98 119.66 119.26 1w9s s GLN 103 Ca 0.28 -0.87 -0.05 0.00 0.05 0.00 0.00 55.36 54.77 1w9s s GLN 103 Cb -0.16 0.28 -0.03 0.00 1.10 0.00 0.00 33.01 34.19 1w9s s GLN 103 CO 0.16 -0.19 0.00 0.99 -0.55 0.00 0.00 175.29 175.70 1w9s s THR 104 N -3.22 4.08 0.27 -0.34 2.01 -1.26 -0.52 115.64 116.66 1w9s s THR 104 Ca 0.00 -0.28 0.11 0.00 0.31 0.00 0.00 61.69 61.83 1w9s s THR 104 Cb 0.02 -2.83 -0.05 0.00 0.01 0.00 0.00 72.50 69.65 1w9s s THR 104 CO -0.07 0.44 -0.10 0.68 -0.69 0.00 0.00 174.62 174.88 1w9s s VAL 105 N 0.78 3.00 0.05 3.82 -7.23 -0.35 -4.95 120.40 115.53 1w9s s VAL 105 Ca 0.01 -2.13 0.00 0.00 -1.81 0.00 0.00 61.98 58.05 1w9s s VAL 105 Cb -0.14 -2.59 -0.03 0.00 0.56 0.00 0.00 36.38 34.18 1w9s s VAL 105 CO 0.02 -0.38 -0.04 0.42 -0.31 0.00 0.00 175.10 174.81 1w9s s THR 106 N -2.39 0.32 0.03 5.32 -4.23 -1.26 -0.63 115.64 112.81 1w9s s THR 106 Ca 0.31 -1.49 -0.12 0.00 -1.18 0.00 0.00 61.69 59.20 1w9s s THR 106 Cb -0.06 -1.09 0.01 0.00 1.34 0.00 0.00 72.50 72.71 1w9s s THR 106 CO 0.18 -0.76 0.26 -0.83 -0.54 0.00 0.00 174.62 172.93 1w9s s GLY 107 N -2.37 -0.07 0.40 3.99 0.00 -0.55 -4.66 107.32 104.06 1w9s s GLY 107 Ca -0.01 -0.06 -0.25 0.00 0.00 0.00 0.00 44.72 44.41 1w9s s GLY 107 CO -0.05 -0.26 1.12 -1.31 0.00 0.00 0.00 173.10 172.60 1w9s s ASN 108 N -1.96 6.63 0.18 1.64 0.01 -1.26 -0.88 114.94 119.30 1w9s s ASN 108 Ca -0.06 2.22 0.02 0.00 -0.71 0.00 0.00 52.86 54.33 1w9s s ASN 108 Cb -0.02 -2.60 -0.05 0.00 0.41 0.00 0.00 41.25 38.99 1w9s s ASN 108 CO -0.02 -0.59 0.01 0.68 -1.51 0.00 0.00 177.10 175.66 1w9s s VAL 109 N -1.49 0.67 -0.25 1.60 -7.23 -0.72 -3.41 120.40 109.57 1w9s s VAL 109 Ca 0.57 -1.98 -0.01 0.00 -1.81 0.00 0.00 61.98 58.75 1w9s s VAL 109 Cb -0.27 -2.14 0.08 0.00 0.56 0.00 0.00 36.38 34.60 1w9s s VAL 109 CO 0.34 -0.46 0.04 -1.10 -0.31 0.00 0.00 175.10 173.61 1w9s s GLN 110 N -3.92 0.91 -0.11 4.82 -0.21 -0.12 -4.06 119.66 116.96 1w9s s GLN 110 Ca 0.24 -0.83 -0.00 0.00 0.02 0.00 0.00 55.36 54.80 1w9s s GLN 110 Cb 0.06 -2.20 0.02 0.00 1.00 0.00 0.00 33.01 31.89 1w9s s GLN 110 CO 0.04 -0.77 -0.09 0.42 -2.12 0.00 0.00 175.29 172.78 1w9s s ILE 111 N 1.64 1.07 0.56 1.08 1.01 -1.00 -4.84 121.20 120.73 1w9s s ILE 111 Ca 0.02 -0.33 -0.09 0.00 0.00 0.00 0.00 60.65 60.25 1w9s s ILE 111 Cb -0.18 -1.07 -0.04 0.00 0.01 0.00 0.00 42.46 41.18 1w9s s ILE 111 CO -0.14 0.37 0.94 -1.10 0.00 0.00 0.00 174.94 175.01 1w9s s GLN 112 N 1.57 3.59 0.41 2.79 -0.21 -1.26 -1.00 119.66 125.55 1w9s s GLN 112 Ca 0.03 0.55 -0.26 0.00 0.02 0.00 0.00 55.36 55.70 1w9s s GLN 112 Cb -0.13 -2.19 -0.10 0.00 1.00 0.00 0.00 33.01 31.58 1w9s s GLN 112 CO -0.07 -0.42 1.27 -2.30 -2.12 0.00 0.00 175.29 171.65 1w9s n PRO 113 N -2.52 1.96 -3.79 2.91 -0.02 -1.26 -4.86 135.00 127.42 1w9s n PRO 113 Ca 0.04 0.70 0.00 0.00 -2.02 0.00 0.00 63.50 62.22 1w9s n PRO 113 Cb 0.54 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.65 1w9s n PRO 113 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1w9s n GLY 114 N 0.80 -2.42 3.41 -1.23 0.00 -0.70 -4.99 105.19 100.07 1w9s n GLY 114 Ca 0.06 -1.34 -0.33 0.00 0.00 0.00 0.00 46.02 44.41 1w9s n GLY 114 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1w9s s THR 115 N -2.17 3.35 0.07 2.61 2.01 -1.26 -0.63 115.64 119.63 1w9s s THR 115 Ca 0.00 -0.55 0.01 0.00 0.31 0.00 0.00 61.69 61.46 1w9s s THR 115 Cb 0.00 -2.43 -0.04 0.00 0.01 0.00 0.00 72.50 70.04 1w9s s THR 115 CO 0.00 0.51 -0.06 -0.31 -0.69 0.00 0.00 174.62 174.07 1w9s s TYR 116 N 0.36 0.76 -0.39 4.92 1.51 -0.07 -4.91 117.35 119.54 1w9s s TYR 116 Ca -0.08 -0.82 -0.22 0.00 -1.01 0.00 0.00 57.07 54.93 1w9s s TYR 116 Cb -0.15 -0.46 0.01 0.00 -0.11 0.00 0.00 41.96 41.25 1w9s s TYR 116 CO 0.05 -0.17 0.73 -0.51 -1.11 0.00 0.00 175.55 174.54 1w9s s ASP 117 N -2.61 6.47 -0.16 2.29 1.01 -1.26 -0.77 116.67 121.64 1w9s s ASP 117 Ca 0.05 0.13 -0.14 0.00 0.71 0.00 0.00 52.55 53.30 1w9s s ASP 117 Cb 0.01 -2.37 -0.05 0.00 1.01 0.00 0.00 42.92 41.53 1w9s s ASP 117 CO -0.04 -0.74 0.29 -0.69 0.21 0.00 0.00 175.17 174.19 1w9s s VAL 118 N 3.02 5.31 -0.10 -1.27 1.01 0.01 -1.05 120.40 127.32 1w9s s VAL 118 Ca 0.28 0.54 0.02 0.00 0.00 0.00 0.00 61.98 62.82 1w9s s VAL 118 Cb -0.13 -3.63 -0.02 0.00 0.00 0.00 0.00 36.38 32.60 1w9s s VAL 118 CO 0.18 0.40 -0.14 -0.31 0.00 0.00 0.00 175.10 175.22 1w9s s TYR 119 N 0.40 2.75 -0.28 5.22 2.02 0.64 -0.74 117.35 127.35 1w9s s TYR 119 Ca 0.16 -0.47 -0.09 0.00 -0.37 0.00 0.00 57.07 56.30 1w9s s TYR 119 Cb -0.13 -1.75 -0.03 0.00 -0.40 0.00 0.00 41.96 39.65 1w9s s TYR 119 CO 0.04 -0.06 0.14 -0.51 -1.57 0.00 0.00 175.55 173.58 1w9s s LEU 120 N -0.09 3.86 -0.17 -1.29 1.43 -0.47 -1.51 118.68 120.44 1w9s s LEU 120 Ca -0.02 -0.23 -0.02 0.00 -1.03 0.00 0.00 54.13 52.82 1w9s s LEU 120 Cb -0.14 -2.02 -0.01 0.00 0.03 0.00 0.00 46.19 44.05 1w9s s LEU 120 CO 0.04 -0.09 -0.08 -0.69 0.23 0.00 0.00 176.35 175.75 1w9s s VAL 121 N 1.67 3.32 -0.11 -1.59 1.01 -0.35 -1.36 120.40 122.98 1w9s s VAL 121 Ca 0.06 -0.55 -0.12 0.00 0.00 0.00 0.00 61.98 61.38 1w9s s VAL 121 Cb -0.16 -2.45 -0.05 0.00 0.00 0.00 0.00 36.38 33.72 1w9s s VAL 121 CO 0.07 0.48 0.27 -0.36 0.00 0.00 0.00 175.10 175.56 1w9s s PHE 122 N 0.76 3.56 0.01 5.22 0.08 -0.15 -0.42 117.98 127.04 1w9s s PHE 122 Ca -0.03 0.66 0.00 0.00 0.12 0.00 0.00 56.93 57.67 1w9s s PHE 122 Cb -0.15 -2.22 -0.01 0.00 -0.57 0.00 0.00 43.02 40.08 1w9s s PHE 122 CO 0.02 0.46 -0.01 0.15 -0.10 0.00 0.00 175.22 175.74 1w9s s LYS 123 N -0.28 0.12 0.00 0.44 -0.14 -0.43 0.22 119.74 119.67 1w9s s LYS 123 Ca 0.17 -0.19 0.00 0.00 -1.36 0.00 0.00 55.97 54.59 1w9s s LYS 123 Cb -0.13 -0.00 0.00 0.00 -1.68 0.00 0.00 37.83 36.01 1w9s s LYS 123 CO 0.06 -0.01 0.00 0.41 -0.76 0.00 0.00 175.35 175.05 1w9s n GLY 124 N 2.64 -0.53 3.77 -3.33 0.00 -1.26 -0.61 105.19 105.87 1w9s n GLY 124 Ca -0.16 -0.87 -0.40 0.00 0.00 0.00 0.00 46.02 44.59 1w9s n GLY 124 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1w9s s SER 125 N -4.00 6.10 0.00 1.61 0.15 -1.26 -4.70 113.70 111.60 1w9s s SER 125 Ca 0.00 2.98 0.24 0.00 0.70 0.00 0.00 55.95 59.87 1w9s s SER 125 Cb 0.00 -2.66 1.15 0.00 -1.71 0.00 0.00 66.02 62.80 1w9s s SER 125 CO 0.00 -1.03 1.79 -0.81 1.20 0.00 0.00 173.24 174.39 1w9s n PRO 126 N 0.11 0.23 0.00 5.44 -0.04 -1.26 -4.11 135.00 135.37 1w9s n PRO 126 Ca 0.03 0.07 0.13 0.00 -0.04 0.00 0.00 63.50 63.69 1w9s n PRO 126 Cb 0.41 -1.50 0.35 0.00 -0.04 0.00 0.00 33.50 32.71 1w9s n PRO 126 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1w9s n GLU 127 N -1.36 0.53 -3.71 0.54 -0.58 -1.26 -4.87 120.64 109.93 1w9s n GLU 127 Ca 0.10 -0.30 -0.10 0.00 -0.42 0.00 0.00 57.16 56.43 1w9s n GLU 127 Cb 0.22 -1.49 -0.06 0.00 -0.57 0.00 0.00 31.44 29.54 1w9s n GLU 127 CO 0.00 0.00 0.00 1.52 -0.48 0.00 0.00 177.13 178.17 1w9s s TYR 128 N -2.68 -0.11 0.48 -0.32 -0.85 -1.26 -5.14 117.35 107.47 1w9s s TYR 128 Ca 0.20 -0.18 -0.22 0.00 -0.52 0.00 0.00 57.07 56.36 1w9s s TYR 128 Cb 0.19 0.15 -0.07 0.00 0.38 0.00 0.00 41.96 42.60 1w9s s TYR 128 CO 0.58 -0.62 1.11 -0.51 -1.52 0.00 0.00 175.55 174.59 1w9s s ASP 129 N -2.61 6.17 -0.23 -0.18 1.11 -1.26 -4.74 116.67 114.94 1w9s s ASP 129 Ca 0.01 2.15 0.00 0.00 0.18 0.00 0.00 52.55 54.90 1w9s s ASP 129 Cb 0.02 -2.59 -0.19 0.00 1.07 0.00 0.00 42.92 41.23 1w9s s ASP 129 CO -0.09 -0.90 -0.09 0.18 1.18 0.00 0.00 175.17 175.44 1w9s n LEU 130 N -0.74 2.83 -3.61 1.23 4.77 0.73 -4.71 117.00 117.51 1w9s n LEU 130 Ca 0.09 -0.06 -0.00 0.00 -0.03 0.00 0.00 56.01 56.00 1w9s n LEU 130 Cb 0.50 -0.92 -0.01 0.00 -2.33 0.00 0.00 43.42 40.66 1w9s n LEU 130 CO 0.44 0.91 1.09 0.00 -1.33 0.00 0.00 177.39 178.50 1w9s s MET 131 N -2.53 0.25 0.14 3.23 0.23 -1.26 -3.77 119.30 115.60 1w9s s MET 131 Ca -0.32 -0.12 0.10 0.00 -1.03 0.00 0.00 55.69 54.32 1w9s s MET 131 Cb 0.08 0.10 -0.04 0.00 -1.53 0.00 0.00 34.83 33.44 1w9s s MET 131 CO 0.64 -0.11 -0.19 -0.80 -2.03 0.00 0.00 175.02 172.53 1w9s s ASN 132 N -2.59 3.81 -0.04 -1.18 0.01 0.71 -4.09 114.94 111.56 1w9s s ASN 132 Ca 0.12 -0.64 0.01 0.00 -0.71 0.00 0.00 52.86 51.64 1w9s s ASN 132 Cb 0.03 -0.49 0.02 0.00 0.41 0.00 0.00 41.25 41.22 1w9s s ASN 132 CO -0.04 0.15 -0.03 -0.69 -1.51 0.00 0.00 177.10 174.98 1w9s s VAL 133 N -1.33 0.42 -0.21 1.60 1.01 -0.65 -1.61 120.40 119.62 1w9s s VAL 133 Ca 0.19 -0.03 -0.19 0.00 0.00 0.00 0.00 61.98 61.95 1w9s s VAL 133 Cb -0.10 -0.48 -0.16 0.00 0.00 0.00 0.00 36.38 35.65 1w9s s VAL 133 CO 0.11 0.21 0.07 -3.20 0.00 0.00 0.00 175.10 172.28 1w9s n ASN 134 N 4.23 1.87 -3.75 3.32 2.85 -0.28 -1.42 115.26 122.07 1w9s n ASN 134 Ca -0.23 0.44 -0.07 0.00 -0.11 0.00 0.00 54.58 54.61 1w9s n ASN 134 Cb 0.51 -0.93 -0.02 0.00 1.24 0.00 0.00 39.78 40.58 1w9s n ASN 134 CO 0.00 0.00 0.00 -1.66 -2.11 0.00 0.00 177.26 173.49 1w9s s TRP 135 N -2.38 -0.12 0.11 1.20 1.48 -1.26 -0.95 118.94 117.04 1w9s s TRP 135 Ca -0.28 -0.36 -0.09 0.00 -1.06 0.00 0.00 56.10 54.30 1w9s s TRP 135 Cb 0.07 0.69 0.00 0.00 -1.16 0.00 0.00 33.47 33.07 1w9s s TRP 135 CO 0.52 -1.27 0.24 -0.59 -4.06 0.00 0.00 176.95 171.80 1w9s s PHE 136 N -3.73 0.19 -0.15 1.66 -0.71 -0.39 -1.20 117.98 113.65 1w9s s PHE 136 Ca 0.12 -0.59 -0.19 0.00 -1.04 0.00 0.00 56.93 55.23 1w9s s PHE 136 Cb -0.06 -0.02 0.05 0.00 -1.21 0.00 0.00 43.02 41.78 1w9s s PHE 136 CO 0.08 -0.61 0.51 0.54 -1.34 0.00 0.00 175.22 174.40 1w9s s VAL 137 N -3.89 0.01 0.35 -2.49 0.11 -0.01 -0.49 120.40 114.00 1w9s s VAL 137 Ca 0.08 -0.07 0.02 0.00 -2.93 0.00 0.00 61.98 59.08 1w9s s VAL 137 Cb 0.04 -0.75 -0.02 0.00 -1.53 0.00 0.00 36.38 34.12 1w9s s VAL 137 CO -0.08 -0.04 0.54 -0.36 -3.33 0.00 0.00 175.10 171.83 1w9s s PHE 138 N -0.16 3.39 0.05 1.54 0.40 0.89 -0.39 117.98 123.71 1w9s s PHE 138 Ca -0.03 0.21 0.05 0.00 -0.60 0.00 0.00 56.93 56.55 1w9s s PHE 138 Cb -0.03 -1.95 -0.02 0.00 0.51 0.00 0.00 43.02 41.52 1w9s s PHE 138 CO 0.02 0.05 -0.13 1.03 0.70 0.00 0.00 175.22 176.89 1w9s s ARG 139 N -4.30 0.85 0.00 0.44 1.81 -0.36 -4.50 118.95 112.89 1w9s s ARG 139 Ca 0.41 -0.80 0.15 0.00 -1.72 0.00 0.00 55.73 53.78 1w9s s ARG 139 Cb -0.10 -0.84 0.12 0.00 -0.45 0.00 0.00 34.95 33.69 1w9s s ARG 139 CO 0.35 0.20 0.99 0.00 -0.68 0.00 0.00 175.30 176.16