#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2whs n SER 2 N 0.00 0.00 0.20 4.52 3.41 -1.26 -3.46 113.62 117.03 2whs n SER 2 Ca 0.00 0.00 0.14 0.00 -0.26 0.00 0.00 58.87 58.75 2whs n SER 2 Cb 0.00 0.00 0.53 0.00 -0.26 0.00 0.00 64.21 64.48 2whs n SER 2 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 2whs h VAL 3 N 0.00 0.00 -3.62 -3.33 2.07 -1.95 -3.42 116.25 106.00 2whs h VAL 3 Ca 0.00 -0.46 -0.68 0.00 0.82 0.00 0.00 66.70 66.38 2whs h VAL 3 Cb 0.00 1.37 -0.25 0.00 -1.52 0.00 0.00 31.29 30.89 2whs h VAL 3 CO 0.00 0.00 -0.58 -0.63 0.02 0.00 0.00 177.57 176.38 2whs s ILE 4 N -3.43 4.28 0.70 4.57 1.01 -1.23 -4.91 121.20 122.20 2whs s ILE 4 Ca 0.04 -0.61 -0.08 0.00 0.00 0.00 0.00 60.65 60.00 2whs s ILE 4 Cb 0.09 -3.22 0.05 0.00 0.01 0.00 0.00 42.46 39.39 2whs s ILE 4 CO 0.51 0.04 1.04 0.00 0.00 0.00 0.00 174.94 176.52 2whs s ALA 5 N 1.55 3.05 0.38 9.38 0.00 -1.26 -4.48 121.76 130.38 2whs s ALA 5 Ca 0.03 -0.75 0.17 0.00 0.00 0.00 0.00 51.96 51.41 2whs s ALA 5 Cb -0.17 -2.73 0.93 0.00 0.00 0.00 0.00 23.12 21.15 2whs s ALA 5 CO 0.04 -1.26 1.91 0.87 0.00 0.00 0.00 175.76 177.32 2whs h LYS 6 N -0.62 0.00 -4.23 0.00 1.57 -1.98 -3.40 116.57 107.91 2whs h LYS 6 Ca -0.45 0.00 -0.52 0.00 -1.87 0.00 0.00 60.65 57.81 2whs h LYS 6 Cb 1.30 0.00 -0.37 0.00 0.08 0.00 0.00 32.23 33.24 2whs h LYS 6 CO 0.62 0.28 -0.80 -1.14 -0.57 0.00 0.00 179.45 177.83 2whs s GLN 7 N -4.24 1.50 0.10 3.15 2.00 -1.26 -3.74 119.66 117.16 2whs s GLN 7 Ca -0.03 -0.25 0.06 0.00 -2.00 0.00 0.00 55.36 53.14 2whs s GLN 7 Cb 0.14 -1.54 -0.03 0.00 0.80 0.00 0.00 33.01 32.38 2whs s GLN 7 CO 0.69 -0.24 -0.14 -1.64 -0.50 0.00 0.00 175.29 173.45 2whs s MET 8 N 1.62 0.93 0.55 1.67 -1.94 -0.93 -5.02 119.30 116.18 2whs s MET 8 Ca 0.03 -1.10 0.05 0.00 -1.71 0.00 0.00 55.69 52.96 2whs s MET 8 Cb -0.13 -0.89 0.04 0.00 2.01 0.00 0.00 34.83 35.86 2whs s MET 8 CO -0.07 0.19 0.36 0.95 -0.01 0.00 0.00 175.02 176.44 2whs s THR 9 N -1.69 1.52 0.06 2.05 -4.23 -0.47 -1.54 115.64 111.34 2whs s THR 9 Ca 0.04 -1.55 -0.23 0.00 -1.18 0.00 0.00 61.69 58.76 2whs s THR 9 Cb -0.07 -2.08 0.06 0.00 1.34 0.00 0.00 72.50 71.74 2whs s THR 9 CO 0.03 0.00 0.54 -0.72 -0.54 0.00 0.00 174.62 173.93 2whs s TYR 10 N -2.80 -0.46 -0.14 3.99 -0.85 0.15 -1.42 117.35 115.82 2whs s TYR 10 Ca 0.29 0.50 0.01 0.00 -0.52 0.00 0.00 57.07 57.36 2whs s TYR 10 Cb -0.02 0.38 -0.00 0.00 0.38 0.00 0.00 41.96 42.70 2whs s TYR 10 CO 0.18 -0.67 -0.18 0.21 -1.52 0.00 0.00 175.55 173.57 2whs s LYS 11 N -2.55 3.17 -0.11 -3.49 2.47 0.25 -0.72 119.74 118.76 2whs s LYS 11 Ca -0.05 -0.78 0.02 0.00 -1.56 0.00 0.00 55.97 53.60 2whs s LYS 11 Cb -0.01 -2.54 -0.01 0.00 -1.46 0.00 0.00 37.83 33.82 2whs s LYS 11 CO -0.02 0.06 -0.18 0.54 0.16 0.00 0.00 175.35 175.91 2whs s VAL 12 N 0.69 2.63 -0.20 4.02 0.11 -0.30 -1.01 120.40 126.33 2whs s VAL 12 Ca -0.08 -0.82 -0.04 0.00 -2.93 0.00 0.00 61.98 58.10 2whs s VAL 12 Cb -0.16 -2.06 -0.02 0.00 -1.53 0.00 0.00 36.38 32.62 2whs s VAL 12 CO 0.02 0.55 -0.02 -0.31 -3.33 0.00 0.00 175.10 172.00 2whs s TYR 13 N 0.22 3.00 -0.02 1.54 1.51 0.33 -1.02 117.35 122.90 2whs s TYR 13 Ca -0.11 -0.62 0.07 0.00 -1.01 0.00 0.00 57.07 55.40 2whs s TYR 13 Cb -0.16 -2.07 -0.02 0.00 -0.11 0.00 0.00 41.96 39.60 2whs s TYR 13 CO 0.06 -0.33 -0.22 1.41 -1.11 0.00 0.00 175.55 175.36 2whs s MET 14 N 1.11 1.85 0.02 -0.62 1.75 0.12 0.19 119.30 123.72 2whs s MET 14 Ca 0.02 -0.79 -0.05 0.00 -1.25 0.00 0.00 55.69 53.63 2whs s MET 14 Cb -0.14 -1.75 -0.01 0.00 2.84 0.00 0.00 34.83 35.76 2whs s MET 14 CO 0.01 0.45 0.08 -1.54 -0.65 0.00 0.00 175.02 173.36 2whs s SER 15 N -0.44 0.15 0.00 1.11 1.04 -0.45 -0.06 113.70 115.05 2whs s SER 15 Ca 0.07 -0.43 0.00 0.00 0.48 0.00 0.00 55.95 56.06 2whs s SER 15 Cb -0.09 0.19 0.00 0.00 0.10 0.00 0.00 66.02 66.22 2whs s SER 15 CO -0.00 -0.42 0.00 0.61 0.98 0.00 0.00 173.24 174.41 2whs n GLY 16 N 1.15 -0.64 2.90 7.32 0.00 -0.57 -2.00 105.19 113.35 2whs n GLY 16 Ca -0.21 -0.72 -0.21 0.00 0.00 0.00 0.00 46.02 44.88 2whs n GLY 16 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2whs s THR 17 N -3.00 0.60 -0.18 2.61 2.01 -0.53 -1.30 115.64 115.84 2whs s THR 17 Ca 0.00 -0.15 0.01 0.00 0.31 0.00 0.00 61.69 61.86 2whs s THR 17 Cb 0.00 -0.62 0.02 0.00 0.01 0.00 0.00 72.50 71.91 2whs s THR 17 CO 0.00 0.24 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.28 2whs s VAL 18 N 0.96 2.05 -1.44 3.82 1.01 -0.28 -0.97 120.40 125.55 2whs s VAL 18 Ca -0.10 -0.93 -0.03 0.00 0.00 0.00 0.00 61.98 60.91 2whs s VAL 18 Cb -0.14 -1.85 0.02 0.00 0.00 0.00 0.00 36.38 34.41 2whs s VAL 18 CO 0.00 0.54 0.53 0.59 0.00 0.00 0.00 175.10 176.76 2whs n ASN 19 N 4.62 -1.05 0.00 3.32 4.13 0.13 -0.80 115.26 125.61 2whs n ASN 19 Ca -0.21 -0.97 0.00 0.00 1.68 0.00 0.00 54.58 55.08 2whs n ASN 19 Cb 0.50 -3.19 0.00 0.00 -1.54 0.00 0.00 39.78 35.55 2whs n ASN 19 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2whs n GLY 20 N -1.85 1.98 3.58 7.41 0.00 -1.26 -5.00 105.19 110.06 2whs n GLY 20 Ca -0.24 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.37 2whs n GLY 20 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2whs s HIS 21 N -3.08 3.20 0.19 1.61 5.04 0.02 -5.05 115.29 117.22 2whs s HIS 21 Ca 0.00 0.40 -0.29 0.00 -1.54 0.00 0.00 55.06 53.63 2whs s HIS 21 Cb 0.00 -2.94 -0.08 0.00 0.04 0.00 0.00 32.58 29.60 2whs s HIS 21 CO 0.00 -0.49 0.91 -0.47 -2.34 0.00 0.00 174.74 172.35 2whs s TYR 22 N 2.49 3.93 0.15 3.88 5.04 -1.26 -1.13 117.35 130.45 2whs s TYR 22 Ca 0.22 1.83 -0.14 0.00 -2.44 0.00 0.00 57.07 56.54 2whs s TYR 22 Cb -0.15 -2.95 0.02 0.00 0.35 0.00 0.00 41.96 39.22 2whs s TYR 22 CO 0.12 0.41 0.39 -0.59 -1.34 0.00 0.00 175.55 174.54 2whs s PHE 23 N -0.89 -0.03 0.03 4.97 -0.12 -0.42 -4.30 117.98 117.22 2whs s PHE 23 Ca 0.41 -0.32 0.04 0.00 -0.05 0.00 0.00 56.93 57.02 2whs s PHE 23 Cb -0.25 0.20 -0.02 0.00 -0.63 0.00 0.00 43.02 42.32 2whs s PHE 23 CO 0.30 -0.74 -0.13 -1.21 -0.05 0.00 0.00 175.22 173.39 2whs s GLU 24 N -3.86 0.88 0.02 1.99 2.02 -0.37 -1.52 118.70 117.86 2whs s GLU 24 Ca 0.07 -0.70 0.05 0.00 0.02 0.00 0.00 54.97 54.42 2whs s GLU 24 Cb 0.02 -0.86 -0.02 0.00 0.10 0.00 0.00 34.13 33.37 2whs s GLU 24 CO -0.07 0.21 -0.15 0.08 0.02 0.00 0.00 175.26 175.35 2whs s VAL 25 N -0.80 1.16 -0.02 2.63 1.01 0.92 -0.77 120.40 124.53 2whs s VAL 25 Ca 0.01 -0.88 0.06 0.00 0.00 0.00 0.00 61.98 61.17 2whs s VAL 25 Cb -0.07 -1.02 -0.01 0.00 0.00 0.00 0.00 36.38 35.27 2whs s VAL 25 CO 0.01 0.13 -0.18 -0.70 0.00 0.00 0.00 175.10 174.35 2whs s GLU 26 N -0.86 1.55 0.04 2.72 2.12 -0.39 0.16 118.70 124.04 2whs s GLU 26 Ca 0.03 -0.66 0.01 0.00 0.36 0.00 0.00 54.97 54.71 2whs s GLU 26 Cb -0.07 -1.48 -0.02 0.00 0.26 0.00 0.00 34.13 32.82 2whs s GLU 26 CO 0.01 0.38 -0.05 0.20 -0.54 0.00 0.00 175.26 175.25 2whs s GLY 27 N -0.38 0.41 -0.18 -1.50 0.00 -0.18 -0.72 107.32 104.77 2whs s GLY 27 Ca 0.06 -0.76 -0.00 0.00 0.00 0.00 0.00 44.72 44.02 2whs s GLY 27 CO -0.00 -0.82 -0.16 0.99 0.00 0.00 0.00 173.10 173.11 2whs s ASP 28 N -1.70 3.49 0.38 1.64 1.01 -0.46 -1.15 116.67 119.87 2whs s ASP 28 Ca -0.10 -0.55 0.05 0.00 0.71 0.00 0.00 52.55 52.65 2whs s ASP 28 Cb -0.08 -1.55 -0.06 0.00 1.01 0.00 0.00 42.92 42.24 2whs s ASP 28 CO -0.01 0.02 0.04 -0.83 0.21 0.00 0.00 175.17 174.60 2whs s GLY 29 N 1.20 2.36 0.06 0.21 0.00 0.10 -0.58 107.32 110.67 2whs s GLY 29 Ca 0.02 -1.99 -0.27 0.00 0.00 0.00 0.00 44.72 42.48 2whs s GLY 29 CO -0.07 -1.97 0.68 -1.59 0.00 0.00 0.00 173.10 170.15 2whs s LYS 30 N -3.80 1.12 0.00 2.90 -2.85 0.10 -0.67 119.74 116.54 2whs s LYS 30 Ca 0.33 -0.18 0.00 0.00 -1.00 0.00 0.00 55.97 55.12 2whs s LYS 30 Cb 0.08 0.52 0.00 0.00 -2.06 0.00 0.00 37.83 36.37 2whs s LYS 30 CO 0.16 -0.44 0.00 0.41 0.10 0.00 0.00 175.35 175.57 2whs n GLY 31 N 0.12 -1.28 2.91 0.59 0.00 -0.59 -0.94 105.19 106.00 2whs n GLY 31 Ca -0.16 -0.96 -0.30 0.00 0.00 0.00 0.00 46.02 44.59 2whs n GLY 31 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2whs s LYS 32 N -1.27 1.73 0.49 1.61 1.02 -0.09 -2.19 119.74 121.05 2whs s LYS 32 Ca 0.00 -2.35 0.20 0.00 0.02 0.00 0.00 55.97 53.85 2whs s LYS 32 Cb 0.00 -3.08 1.24 0.00 -0.52 0.00 0.00 37.83 35.47 2whs s LYS 32 CO 0.00 -1.09 2.00 -1.35 -0.92 0.00 0.00 175.35 173.99 2whs h PRO 33 N 6.77 0.16 -0.01 -1.68 0.11 -1.79 0.14 132.00 135.69 2whs h PRO 33 Ca -0.06 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.04 2whs h PRO 33 Cb 0.92 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.00 2whs h PRO 33 CO 0.62 0.10 -0.15 0.66 -0.21 0.00 0.00 178.00 179.02 2whs n TYR 34 N -4.43 0.00 0.51 0.65 4.01 -1.26 -3.61 117.16 113.03 2whs n TYR 34 Ca 0.09 0.00 0.05 0.00 -0.16 0.00 0.00 57.90 57.88 2whs n TYR 34 Cb 0.49 -0.16 -0.04 0.00 -0.31 0.00 0.00 39.34 39.31 2whs n TYR 34 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 2whs n GLU 35 N -0.84 2.93 -1.10 -0.72 1.02 0.38 -4.71 120.64 117.60 2whs n GLU 35 Ca 0.14 -0.22 -0.04 0.00 -0.02 0.00 0.00 57.16 57.02 2whs n GLU 35 Cb 0.30 -1.05 -0.02 0.00 -0.02 0.00 0.00 31.44 30.65 2whs n GLU 35 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2whs n GLY 36 N 1.15 0.65 3.66 0.62 0.00 -0.65 -4.65 105.19 105.97 2whs n GLY 36 Ca 0.03 -0.60 -0.34 0.00 0.00 0.00 0.00 46.02 45.10 2whs n GLY 36 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2whs s GLU 37 N -1.86 2.89 -0.12 1.61 2.02 -1.22 -1.40 118.70 120.62 2whs s GLU 37 Ca 0.00 -0.47 -0.20 0.00 0.02 0.00 0.00 54.97 54.32 2whs s GLU 37 Cb 0.00 -2.72 0.05 0.00 0.10 0.00 0.00 34.13 31.56 2whs s GLU 37 CO 0.00 0.68 0.50 -1.14 0.02 0.00 0.00 175.26 175.32 2whs s GLN 38 N -0.96 0.71 0.02 1.61 0.74 -0.82 -0.91 119.66 120.04 2whs s GLN 38 Ca 0.14 0.40 0.01 0.00 0.05 0.00 0.00 55.36 55.96 2whs s GLN 38 Cb -0.11 0.34 -0.02 0.00 1.10 0.00 0.00 33.01 34.32 2whs s GLN 38 CO 0.03 -0.15 -0.04 -0.08 -0.55 0.00 0.00 175.29 174.51 2whs s THR 39 N -0.41 0.19 -0.02 -0.34 -1.32 -0.12 -1.29 115.64 112.34 2whs s THR 39 Ca -0.05 -0.74 -0.04 0.00 -1.21 0.00 0.00 61.69 59.64 2whs s THR 39 Cb -0.03 -0.29 0.01 0.00 -1.51 0.00 0.00 72.50 70.67 2whs s THR 39 CO 0.03 -0.35 0.10 0.54 -2.21 0.00 0.00 174.62 172.73 2whs s VAL 40 N -1.11 0.03 -0.13 5.08 0.11 -0.00 -0.72 120.40 123.65 2whs s VAL 40 Ca -0.11 -0.24 -0.01 0.00 -2.93 0.00 0.00 61.98 58.69 2whs s VAL 40 Cb -0.08 -0.22 -0.02 0.00 -1.53 0.00 0.00 36.38 34.53 2whs s VAL 40 CO -0.01 -0.13 -0.09 -0.54 -3.33 0.00 0.00 175.10 171.01 2whs s LYS 41 N -0.40 3.43 0.10 1.54 1.02 0.26 -1.22 119.74 124.47 2whs s LYS 41 Ca -0.05 -0.60 0.10 0.00 0.02 0.00 0.00 55.97 55.44 2whs s LYS 41 Cb -0.03 -2.74 -0.04 0.00 -0.52 0.00 0.00 37.83 34.50 2whs s LYS 41 CO 0.00 0.27 -0.25 -0.51 -0.92 0.00 0.00 175.35 173.94 2whs s LEU 42 N 0.23 2.34 -0.06 3.17 2.01 0.15 -1.36 118.68 125.15 2whs s LEU 42 Ca -0.06 -0.67 0.01 0.00 0.01 0.00 0.00 54.13 53.43 2whs s LEU 42 Cb -0.15 -1.29 0.02 0.00 0.01 0.00 0.00 46.19 44.78 2whs s LEU 42 CO 0.04 0.20 -0.09 -0.89 1.01 0.00 0.00 176.35 176.63 2whs s THR 43 N -1.00 0.89 -0.41 5.49 2.01 0.10 -1.79 115.64 120.94 2whs s THR 43 Ca 0.14 -0.32 -0.29 0.00 0.31 0.00 0.00 61.69 61.54 2whs s THR 43 Cb -0.10 -0.86 0.00 0.00 0.01 0.00 0.00 72.50 71.56 2whs s THR 43 CO 0.05 0.31 1.49 -0.69 -0.69 0.00 0.00 174.62 175.09 2whs s VAL 44 N 0.90 3.81 -0.14 3.82 1.01 -0.33 -1.26 120.40 128.21 2whs s VAL 44 Ca -0.11 0.81 0.20 0.00 0.00 0.00 0.00 61.98 62.88 2whs s VAL 44 Cb -0.15 -4.12 -0.16 0.00 0.00 0.00 0.00 36.38 31.95 2whs s VAL 44 CO 0.01 -0.73 0.70 0.35 0.00 0.00 0.00 175.10 175.43 2whs n THR 45 N 7.13 0.79 -3.82 3.92 -2.24 0.05 -4.79 114.28 115.32 2whs n THR 45 Ca 0.17 -0.63 -0.12 0.00 -2.27 0.00 0.00 64.05 61.20 2whs n THR 45 Cb 0.48 -0.43 -0.11 0.00 -2.10 0.00 0.00 70.33 68.17 2whs n THR 45 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2whs s LYS 46 N -3.12 0.31 -0.11 -0.78 2.20 -1.12 -4.92 119.74 112.19 2whs s LYS 46 Ca -0.04 0.09 0.00 0.00 -0.36 0.00 0.00 55.97 55.66 2whs s LYS 46 Cb 0.10 0.14 0.00 0.00 -1.51 0.00 0.00 37.83 36.56 2whs s LYS 46 CO 0.83 -0.05 0.00 0.41 -0.36 0.00 0.00 175.35 176.18 2whs n GLY 47 N 2.54 0.47 3.96 5.54 0.00 -1.26 -1.24 105.19 115.20 2whs n GLY 47 Ca -0.15 -0.92 -0.22 0.00 0.00 0.00 0.00 46.02 44.73 2whs n GLY 47 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2whs s GLY 48 N -2.87 1.30 0.48 -0.02 0.00 -1.26 -4.03 107.32 100.91 2whs s GLY 48 Ca 0.00 -1.16 -0.23 0.00 0.00 0.00 0.00 44.72 43.33 2whs s GLY 48 CO 0.00 -1.13 1.27 2.56 0.00 0.00 0.00 173.10 175.80 2whs s PRO 49 N -4.12 3.56 0.27 2.90 0.04 -1.26 -5.10 135.00 131.28 2whs s PRO 49 Ca 0.37 2.04 -0.29 0.00 0.04 0.00 0.00 61.00 63.16 2whs s PRO 49 Cb -0.09 -2.42 -0.10 0.00 0.04 0.00 0.00 34.50 31.93 2whs s PRO 49 CO 0.32 -0.79 1.26 -0.51 0.04 0.00 0.00 177.00 177.31 2whs s LEU 50 N -3.09 4.45 -0.01 -3.56 1.43 -1.26 -4.91 118.68 111.73 2whs s LEU 50 Ca 0.65 2.48 0.03 0.00 -1.03 0.00 0.00 54.13 56.26 2whs s LEU 50 Cb -0.35 -3.63 0.12 0.00 0.03 0.00 0.00 46.19 42.35 2whs s LEU 50 CO 0.43 -0.44 0.96 -0.81 0.23 0.00 0.00 176.35 176.72 2whs n PRO 51 N 1.60 1.40 -4.35 1.29 -0.04 -1.26 -4.90 135.00 128.74 2whs n PRO 51 Ca 0.02 -0.46 -0.18 0.00 -0.04 0.00 0.00 63.50 62.84 2whs n PRO 51 Cb 0.43 -1.27 -0.10 0.00 -0.04 0.00 0.00 33.50 32.52 2whs n PRO 51 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 2whs s PHE 52 N -1.66 1.62 0.07 0.54 -0.12 -1.26 -4.65 117.98 112.53 2whs s PHE 52 Ca 0.08 -0.86 -0.32 0.00 -0.05 0.00 0.00 56.93 55.79 2whs s PHE 52 Cb 0.05 -0.93 -0.11 0.00 -0.63 0.00 0.00 43.02 41.40 2whs s PHE 52 CO 0.05 0.05 1.83 0.00 -0.05 0.00 0.00 175.22 177.09 2whs n ALA 53 N -0.44 1.68 -0.31 1.99 0.00 0.62 -4.89 120.51 119.16 2whs n ALA 53 Ca -0.06 0.31 0.19 0.00 0.00 0.00 0.00 53.44 53.89 2whs n ALA 53 Cb 0.63 -2.55 0.46 0.00 0.00 0.00 0.00 19.45 18.00 2whs n ALA 53 CO 0.00 0.00 0.00 2.35 0.00 0.00 0.00 177.50 179.85 2whs h TRP 54 N 8.56 0.75 -0.23 0.00 2.91 -1.95 -2.94 115.95 123.05 2whs h TRP 54 Ca -0.47 0.02 0.07 0.00 1.13 0.00 0.00 58.89 59.64 2whs h TRP 54 Cb 1.24 -0.22 -0.01 0.00 -0.51 0.00 0.00 29.16 29.66 2whs h TRP 54 CO 0.81 0.13 0.17 -0.44 -1.03 0.00 0.00 178.44 178.08 2whs h ASP 55 N 0.50 0.00 0.71 2.65 3.32 -1.95 0.27 116.42 121.92 2whs h ASP 55 Ca 0.56 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.61 2whs h ASP 55 Cb 1.26 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.81 2whs h ASP 55 CO -0.29 0.00 -0.03 0.16 -1.72 0.00 0.00 179.24 177.36 2whs h ILE 56 N 0.00 0.09 0.05 0.35 3.07 -1.92 -2.92 117.51 116.22 2whs h ILE 56 Ca 0.11 -0.43 -0.29 0.00 1.55 0.00 0.00 64.86 65.80 2whs h ILE 56 Cb 0.45 1.39 -0.03 0.00 -0.27 0.00 0.00 36.82 38.36 2whs h ILE 56 CO -0.00 0.02 -1.54 -0.07 -1.05 0.00 0.00 178.15 175.51 2whs h LEU 57 N 0.00 0.17 -0.87 0.16 3.38 -0.67 -3.41 115.31 114.07 2whs h LEU 57 Ca -0.00 -0.27 0.11 0.00 0.09 0.00 0.00 57.88 57.81 2whs h LEU 57 Cb 0.39 -0.05 -0.08 0.00 0.09 0.00 0.00 40.66 41.01 2whs h LEU 57 CO 0.00 1.23 0.50 0.77 0.09 0.00 0.00 178.44 181.04 2whs h SER 58 N 0.03 0.71 0.00 -0.43 4.64 -1.35 -0.30 113.55 116.84 2whs h SER 58 Ca -0.23 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.14 2whs h SER 58 Cb 1.97 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 63.98 2whs h SER 58 CO 0.12 0.38 0.00 -2.65 -0.87 0.00 0.00 176.83 173.81 2whs n PRO 59 N -4.74 0.85 0.00 4.77 -0.02 -1.26 -2.31 135.00 132.29 2whs n PRO 59 Ca 0.15 0.00 0.12 0.00 -2.02 0.00 0.00 63.50 61.75 2whs n PRO 59 Cb 0.32 -1.36 0.09 0.00 -0.02 0.00 0.00 33.50 32.54 2whs n PRO 59 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2whs n GLN 60 N -0.86 2.21 -1.26 -0.52 1.13 -0.12 -4.82 117.38 113.14 2whs n GLN 60 Ca 0.15 -1.86 -0.26 0.00 -1.94 0.00 0.00 57.00 53.09 2whs n GLN 60 Cb 0.07 -1.45 0.14 0.00 0.11 0.00 0.00 30.24 29.11 2whs n GLN 60 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 2whs n LEU 61 N 1.27 6.70 0.00 1.08 4.77 -0.98 -4.95 117.00 124.89 2whs n LEU 61 Ca 0.13 -3.93 0.00 0.00 -0.03 0.00 0.00 56.01 52.19 2whs n LEU 61 Cb 0.58 -0.84 0.00 0.00 -2.33 0.00 0.00 43.42 40.83 2whs n LEU 61 CO 0.15 1.28 0.00 -0.24 -1.33 0.00 0.00 177.39 177.25 2whs n SER 65 N -1.04 0.00 0.23 -1.43 2.88 -1.26 -4.98 113.62 108.01 2whs n SER 65 Ca 0.57 0.00 0.08 0.00 -1.33 0.00 0.00 58.87 58.19 2whs n SER 65 Cb 1.21 0.00 0.54 0.00 -0.75 0.00 0.00 64.21 65.21 2whs n SER 65 CO 0.00 0.00 0.00 0.40 -1.23 0.00 0.00 175.04 174.21 2whs h ILE 66 N 0.00 0.88 0.00 2.46 1.08 -2.00 -2.75 117.51 117.18 2whs h ILE 66 Ca 0.00 -0.87 0.00 0.00 -0.39 0.00 0.00 64.86 63.60 2whs h ILE 66 Cb 0.00 1.51 0.00 0.00 -3.07 0.00 0.00 36.82 35.26 2whs h ILE 66 CO 0.00 0.22 0.00 -2.65 -0.69 0.00 0.00 178.15 175.03 2whs n PRO 67 N -3.86 0.12 -0.60 2.37 -0.02 -1.26 -2.23 135.00 129.52 2whs n PRO 67 Ca -0.02 0.60 -0.10 0.00 -2.02 0.00 0.00 63.50 61.96 2whs n PRO 67 Cb 0.32 -1.88 0.04 0.00 -0.02 0.00 0.00 33.50 31.96 2whs n PRO 67 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 2whs n PHE 68 N -2.14 1.03 -3.88 6.00 3.01 -1.04 -4.72 117.46 115.71 2whs n PHE 68 Ca -0.01 -1.33 -0.35 0.00 1.01 0.00 0.00 57.45 56.77 2whs n PHE 68 Cb 0.05 -0.66 -0.10 0.00 -0.01 0.00 0.00 39.48 38.76 2whs n PHE 68 CO 0.00 0.00 0.00 0.99 1.01 0.00 0.00 176.76 178.76 2whs s THR 69 N -1.34 4.89 -0.33 4.37 2.01 -0.95 -3.82 115.64 120.47 2whs s THR 69 Ca 0.20 0.01 -0.29 0.00 0.31 0.00 0.00 61.69 61.92 2whs s THR 69 Cb 0.16 -3.23 -0.01 0.00 0.01 0.00 0.00 72.50 69.42 2whs s THR 69 CO 0.01 0.42 1.68 -0.75 -0.69 0.00 0.00 174.62 175.29 2whs s LYS 70 N 0.68 3.46 -0.17 4.92 2.20 -0.81 -4.70 119.74 125.32 2whs s LYS 70 Ca 0.05 1.35 -0.07 0.00 -0.36 0.00 0.00 55.97 56.93 2whs s LYS 70 Cb -0.13 -4.13 -0.04 0.00 -1.51 0.00 0.00 37.83 32.02 2whs s LYS 70 CO 0.02 -1.70 0.08 0.71 -0.36 0.00 0.00 175.35 174.10 2whs s TYR 71 N 6.28 3.32 0.75 4.03 1.51 -1.26 -1.05 117.35 130.93 2whs s TYR 71 Ca 0.74 0.20 -0.11 0.00 -1.01 0.00 0.00 57.07 56.89 2whs s TYR 71 Cb -0.21 -2.05 0.04 0.00 -0.11 0.00 0.00 41.96 39.63 2whs s TYR 71 CO 0.33 0.29 1.09 -1.25 -1.11 0.00 0.00 175.55 174.90 2whs s PRO 72 N 0.07 2.38 0.49 -1.71 0.04 -1.26 -4.92 135.00 130.10 2whs s PRO 72 Ca 0.06 1.21 0.22 0.00 0.04 0.00 0.00 61.00 62.54 2whs s PRO 72 Cb -0.12 -1.91 1.28 0.00 0.04 0.00 0.00 34.50 33.79 2whs s PRO 72 CO 0.00 -1.55 1.96 0.93 0.04 0.00 0.00 177.00 178.38 2whs h GLU 73 N -0.88 0.14 -0.01 4.56 5.08 -2.00 -2.58 114.58 118.89 2whs h GLU 73 Ca -0.44 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 2whs h GLU 73 Cb 1.23 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.45 2whs h GLU 73 CO 0.52 0.09 -0.12 -0.40 -1.00 0.00 0.00 179.01 178.10 2whs n ASP 74 N -4.40 0.90 -4.29 1.42 5.75 -1.26 -4.66 116.55 110.01 2whs n ASP 74 Ca 0.12 -0.97 -0.36 0.00 -0.01 0.00 0.00 54.79 53.58 2whs n ASP 74 Cb 0.61 0.02 -0.13 0.00 -1.03 0.00 0.00 41.12 40.59 2whs n ASP 74 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 2whs s ILE 75 N -2.32 3.48 0.22 2.12 1.01 -0.97 -5.03 121.20 119.71 2whs s ILE 75 Ca 0.31 -0.78 -0.32 0.00 0.00 0.00 0.00 60.65 59.86 2whs s ILE 75 Cb 0.20 -2.76 -0.14 0.00 0.01 0.00 0.00 42.46 39.78 2whs s ILE 75 CO 0.44 0.17 1.34 -2.65 0.00 0.00 0.00 174.94 174.24 2whs n PRO 76 N 4.78 1.78 -3.15 2.79 -0.02 -1.26 -4.68 135.00 135.24 2whs n PRO 76 Ca -0.16 0.63 -0.45 0.00 -2.02 0.00 0.00 63.50 61.50 2whs n PRO 76 Cb 0.48 -2.24 -0.03 0.00 -0.02 0.00 0.00 33.50 31.69 2whs n PRO 76 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2whs s ASP 77 N 0.20 6.54 0.24 2.55 -1.08 -1.26 -4.45 116.67 119.42 2whs s ASP 77 Ca 0.69 -2.12 -0.04 0.00 -0.52 0.00 0.00 52.55 50.56 2whs s ASP 77 Cb -0.71 -2.29 0.44 0.00 -1.46 0.00 0.00 42.92 38.90 2whs s ASP 77 CO 0.50 -0.88 1.74 0.22 0.52 0.00 0.00 175.17 177.28 2whs h TYR 78 N 8.52 0.56 -0.00 -5.34 3.20 -1.91 -1.04 116.97 120.97 2whs h TYR 78 Ca -0.00 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.90 2whs h TYR 78 Cb 1.05 -0.13 0.00 0.00 1.54 0.00 0.00 36.73 39.19 2whs h TYR 78 CO 1.01 0.11 -0.00 0.74 -1.64 0.00 0.00 178.16 178.37 2whs h PHE 79 N 0.49 0.01 -0.48 -3.82 0.04 -1.93 -2.91 116.94 108.34 2whs h PHE 79 Ca 0.41 -0.00 -0.00 0.00 2.80 0.00 0.00 57.97 61.17 2whs h PHE 79 Cb 0.58 -0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.70 2whs h PHE 79 CO -0.15 0.61 0.30 0.87 -0.60 0.00 0.00 178.31 179.34 2whs h LYS 80 N -0.60 0.65 -0.69 1.51 1.57 -1.86 -2.58 116.57 114.56 2whs h LYS 80 Ca -0.00 -0.05 0.18 0.00 -1.87 0.00 0.00 60.65 58.91 2whs h LYS 80 Cb 0.61 -0.14 -0.04 0.00 0.08 0.00 0.00 32.23 32.75 2whs h LYS 80 CO 0.00 0.46 0.48 1.96 -0.57 0.00 0.00 179.45 181.78 2whs h GLN 81 N 0.64 0.13 0.00 3.15 4.20 -1.22 -2.59 115.11 119.43 2whs h GLN 81 Ca 0.17 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.88 2whs h GLN 81 Cb -0.03 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 27.72 2whs h GLN 81 CO -0.03 0.09 0.00 0.66 -0.67 0.00 0.00 178.83 178.87 2whs h SER 82 N 0.14 0.00 -4.26 1.46 4.64 -1.25 -3.45 113.55 110.84 2whs h SER 82 Ca 0.34 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 61.17 2whs h SER 82 Cb 1.13 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 63.25 2whs h SER 82 CO -0.05 0.00 0.39 -0.36 -0.87 0.00 0.00 176.83 175.94 2whs s PHE 83 N -3.66 3.52 -1.22 4.77 0.40 -0.98 -0.57 117.98 120.25 2whs s PHE 83 Ca 0.01 1.39 0.30 0.00 -0.60 0.00 0.00 56.93 58.02 2whs s PHE 83 Cb 0.09 -2.76 1.39 0.00 0.51 0.00 0.00 43.02 42.25 2whs s PHE 83 CO 0.45 -0.50 1.99 -0.35 0.70 0.00 0.00 175.22 177.52 2whs n PRO 84 N -2.05 0.22 -0.07 0.24 -0.04 -1.26 -4.81 135.00 127.22 2whs n PRO 84 Ca 0.06 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.44 2whs n PRO 84 Cb 0.54 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.49 2whs n PRO 84 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2whs h GLU 85 N 0.00 0.30 0.00 0.54 3.07 -1.89 -3.38 114.58 113.23 2whs h GLU 85 Ca 0.00 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.84 2whs h GLU 85 Cb 0.39 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 28.23 2whs h GLU 85 CO 0.00 0.20 0.00 0.41 -1.40 0.00 0.00 179.01 178.22 2whs n GLY 86 N -1.18 -1.84 3.63 -3.84 0.00 0.27 -4.73 105.19 97.51 2whs n GLY 86 Ca -0.01 -1.97 -0.09 0.00 0.00 0.00 0.00 46.02 43.95 2whs n GLY 86 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2whs s TYR 87 N 0.00 0.28 0.15 1.61 -0.85 -1.07 -1.34 117.35 116.14 2whs s TYR 87 Ca 0.00 -0.66 0.05 0.00 -0.52 0.00 0.00 57.07 55.94 2whs s TYR 87 Cb 0.00 0.28 -0.04 0.00 0.38 0.00 0.00 41.96 42.57 2whs s TYR 87 CO 0.00 -1.04 -0.11 0.95 -1.52 0.00 0.00 175.55 173.83 2whs s THR 88 N -3.96 1.25 0.09 -3.49 -4.23 0.36 -0.23 115.64 105.44 2whs s THR 88 Ca 0.21 -2.08 -0.08 0.00 -1.18 0.00 0.00 61.69 58.55 2whs s THR 88 Cb -0.02 -1.87 -0.00 0.00 1.34 0.00 0.00 72.50 71.94 2whs s THR 88 CO 0.09 -0.73 0.18 -1.66 -0.54 0.00 0.00 174.62 171.97 2whs s TRP 89 N -3.28 0.20 -0.04 3.99 1.48 -0.89 -0.51 118.94 119.88 2whs s TRP 89 Ca 0.17 -0.63 0.05 0.00 -1.06 0.00 0.00 56.10 54.63 2whs s TRP 89 Cb 0.02 -0.08 -0.01 0.00 -1.16 0.00 0.00 33.47 32.24 2whs s TRP 89 CO 0.01 -0.55 -0.19 -1.21 -4.06 0.00 0.00 176.95 170.96 2whs s GLU 90 N -3.87 1.86 0.01 3.25 0.41 -0.78 -0.07 118.70 119.51 2whs s GLU 90 Ca 0.06 -0.66 0.03 0.00 -0.41 0.00 0.00 54.97 53.99 2whs s GLU 90 Cb 0.05 -1.63 -0.01 0.00 -1.78 0.00 0.00 34.13 30.75 2whs s GLU 90 CO -0.10 0.29 -0.09 0.50 -0.49 0.00 0.00 175.26 175.37 2whs s ARG 91 N -0.07 0.70 -0.12 1.61 3.52 0.15 -1.01 118.95 123.73 2whs s ARG 91 Ca -0.02 -0.47 -0.01 0.00 -0.13 0.00 0.00 55.73 55.10 2whs s ARG 91 Cb -0.11 -0.65 -0.02 0.00 -1.56 0.00 0.00 34.95 32.60 2whs s ARG 91 CO 0.02 0.17 -0.08 -1.12 -0.81 0.00 0.00 175.30 173.48 2whs s SER 92 N -0.64 4.47 -0.24 -2.12 0.01 0.81 -0.49 113.70 115.51 2whs s SER 92 Ca 0.01 -0.16 0.01 0.00 1.31 0.00 0.00 55.95 57.11 2whs s SER 92 Cb -0.05 -1.51 0.04 0.00 0.21 0.00 0.00 66.02 64.71 2whs s SER 92 CO 0.00 0.23 -0.12 -0.04 0.41 0.00 0.00 173.24 173.73 2whs s MET 93 N -0.03 2.56 -0.45 12.44 -1.94 0.66 -0.91 119.30 131.63 2whs s MET 93 Ca -0.01 -1.14 -0.07 0.00 -1.71 0.00 0.00 55.69 52.76 2whs s MET 93 Cb -0.14 -2.85 0.12 0.00 2.01 0.00 0.00 34.83 33.98 2whs s MET 93 CO 0.03 -0.45 0.30 -0.80 -0.01 0.00 0.00 175.02 174.09 2whs s ASN 94 N 1.20 5.55 0.65 3.03 0.01 -0.07 -0.78 114.94 124.53 2whs s ASN 94 Ca -0.03 -1.97 -0.11 0.00 -0.71 0.00 0.00 52.86 50.04 2whs s ASN 94 Cb -0.18 -1.95 -0.02 0.00 0.41 0.00 0.00 41.25 39.52 2whs s ASN 94 CO -0.07 -0.64 1.05 -0.36 -1.51 0.00 0.00 177.10 175.57 2whs s PHE 95 N 1.27 3.49 0.38 2.20 0.08 -0.65 -0.51 117.98 124.25 2whs s PHE 95 Ca 0.07 1.16 0.13 0.00 0.12 0.00 0.00 56.93 58.41 2whs s PHE 95 Cb -0.25 -2.85 0.78 0.00 -0.57 0.00 0.00 43.02 40.13 2whs s PHE 95 CO -0.02 -0.88 1.86 1.05 -0.10 0.00 0.00 175.22 177.13 2whs h GLU 96 N -0.43 0.00 -0.89 0.44 4.11 -1.24 -2.71 114.58 113.85 2whs h GLU 96 Ca -0.44 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 58.96 2whs h GLU 96 Cb 1.22 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.45 2whs h GLU 96 CO 0.63 0.34 0.03 -0.40 0.07 0.00 0.00 179.01 179.67 2whs n ASP 97 N -4.12 2.57 0.00 3.06 5.68 -1.26 -4.90 116.55 117.58 2whs n ASP 97 Ca -0.02 -2.32 0.00 0.00 -0.50 0.00 0.00 54.79 51.95 2whs n ASP 97 Cb 0.38 -0.56 0.00 0.00 -1.14 0.00 0.00 41.12 39.79 2whs n ASP 97 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2whs n GLY 98 N 0.17 2.79 3.69 6.12 0.00 -1.02 -4.81 105.19 112.11 2whs n GLY 98 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 2whs n GLY 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2whs n ALA 99 N -0.53 1.13 -3.27 4.61 0.00 -1.23 -4.85 120.51 116.37 2whs n ALA 99 Ca 0.00 0.24 -0.19 0.00 0.00 0.00 0.00 53.44 53.49 2whs n ALA 99 Cb 0.00 -2.24 -0.16 0.00 0.00 0.00 0.00 19.45 17.05 2whs n ALA 99 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2whs s VAL 100 N -1.23 0.58 -0.09 0.00 1.01 -0.70 -1.63 120.40 118.34 2whs s VAL 100 Ca 0.63 -0.22 0.04 0.00 0.00 0.00 0.00 61.98 62.43 2whs s VAL 100 Cb -0.50 -0.56 -0.01 0.00 0.00 0.00 0.00 36.38 35.31 2whs s VAL 100 CO 0.57 0.21 -0.22 0.00 0.00 0.00 0.00 175.10 175.66 2whs s THR 102 N 0.18 2.69 -0.01 0.00 -4.23 0.15 -0.24 115.64 114.17 2whs s THR 102 Ca -0.12 -0.91 0.02 0.00 -1.18 0.00 0.00 61.69 59.50 2whs s THR 102 Cb -0.16 -2.03 -0.00 0.00 1.34 0.00 0.00 72.50 71.65 2whs s THR 102 CO 0.07 0.56 -0.07 -0.69 -0.54 0.00 0.00 174.62 173.95 2whs s VAL 103 N -0.71 0.57 0.08 2.29 1.01 0.36 -0.41 120.40 123.59 2whs s VAL 103 Ca 0.11 -0.29 0.04 0.00 0.00 0.00 0.00 61.98 61.84 2whs s VAL 103 Cb -0.10 -0.49 -0.03 0.00 0.00 0.00 0.00 36.38 35.75 2whs s VAL 103 CO 0.01 0.17 -0.11 -0.94 0.00 0.00 0.00 175.10 174.22 2whs s SER 104 N -0.05 1.47 0.03 3.32 1.04 0.24 0.30 113.70 120.04 2whs s SER 104 Ca 0.01 -0.73 0.01 0.00 0.48 0.00 0.00 55.95 55.72 2whs s SER 104 Cb -0.04 -0.01 -0.02 0.00 0.10 0.00 0.00 66.02 66.05 2whs s SER 104 CO -0.00 -0.20 -0.05 0.21 0.98 0.00 0.00 173.24 174.18 2whs s ASN 105 N -2.15 0.55 -0.08 7.02 2.47 0.90 -0.70 114.94 122.95 2whs s ASN 105 Ca 0.02 -0.57 0.01 0.00 0.42 0.00 0.00 52.86 52.73 2whs s ASN 105 Cb -0.06 0.08 0.02 0.00 -1.45 0.00 0.00 41.25 39.84 2whs s ASN 105 CO 0.01 -0.29 -0.09 -0.62 -3.72 0.00 0.00 177.10 172.40 2whs s ASP 106 N -1.67 1.81 -0.05 -4.21 -1.08 -0.69 -2.10 116.67 108.68 2whs s ASP 106 Ca -0.11 -0.26 0.06 0.00 -0.52 0.00 0.00 52.55 51.72 2whs s ASP 106 Cb -0.08 -0.76 -0.02 0.00 -1.46 0.00 0.00 42.92 40.60 2whs s ASP 106 CO -0.01 -0.05 -0.22 -0.44 0.52 0.00 0.00 175.17 174.96 2whs s SER 107 N 1.19 3.32 0.05 -0.34 0.01 0.68 -1.14 113.70 117.48 2whs s SER 107 Ca -0.05 -0.42 0.01 0.00 1.31 0.00 0.00 55.95 56.80 2whs s SER 107 Cb -0.14 -0.71 -0.00 0.00 0.21 0.00 0.00 66.02 65.38 2whs s SER 107 CO -0.02 0.29 0.05 -1.54 0.41 0.00 0.00 173.24 172.43 2whs n SER 108 N 2.66 -0.13 -3.88 2.44 3.41 0.63 -2.59 113.62 116.17 2whs n SER 108 Ca -0.17 -1.30 -0.12 0.00 -0.26 0.00 0.00 58.87 57.03 2whs n SER 108 Cb 0.52 0.28 -0.13 0.00 -0.26 0.00 0.00 64.21 64.61 2whs n SER 108 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 175.04 174.37 2whs s ILE 109 N -2.28 0.03 -0.34 -1.33 2.07 -1.26 0.04 121.20 118.12 2whs s ILE 109 Ca 0.05 -0.21 0.01 0.00 -1.41 0.00 0.00 60.65 59.09 2whs s ILE 109 Cb 0.00 -0.14 0.11 0.00 0.13 0.00 0.00 42.46 42.56 2whs s ILE 109 CO 0.04 -0.12 0.10 -1.58 -1.91 0.00 0.00 174.94 171.48 2whs s GLN 110 N -0.34 1.04 6.87 3.50 2.00 0.71 -4.92 119.66 128.53 2whs s GLN 110 Ca -0.04 -1.47 0.00 0.00 -2.00 0.00 0.00 55.36 51.86 2whs s GLN 110 Cb -0.03 -2.43 0.00 0.00 0.80 0.00 0.00 33.01 31.36 2whs s GLN 110 CO -0.00 -1.00 0.00 0.41 -0.50 0.00 0.00 175.29 174.20 2whs n GLY 111 N 4.47 3.51 2.22 2.59 0.00 -1.26 -1.50 105.19 115.21 2whs n GLY 111 Ca 0.01 0.24 -0.25 0.00 0.00 0.00 0.00 46.02 46.02 2whs n GLY 111 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2whs n ASN 112 N 9.14 4.05 -3.73 1.61 5.03 -1.26 -4.86 115.26 125.24 2whs n ASN 112 Ca 0.00 -3.63 -0.24 0.00 0.87 0.00 0.00 54.58 51.59 2whs n ASN 112 Cb 0.00 -0.85 -0.17 0.00 -1.02 0.00 0.00 39.78 37.74 2whs n ASN 112 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2whs s PHE 114 N 2.01 2.93 -0.13 0.00 0.08 -0.51 -0.20 117.98 122.15 2whs s PHE 114 Ca 0.04 1.56 0.00 0.00 0.12 0.00 0.00 56.93 58.65 2whs s PHE 114 Cb -0.13 -3.10 0.02 0.00 -0.57 0.00 0.00 43.02 39.24 2whs s PHE 114 CO -0.06 -1.01 -0.12 0.42 -0.10 0.00 0.00 175.22 174.35 2whs s ILE 115 N -2.00 1.40 -0.13 0.64 1.01 0.11 -0.59 121.20 121.64 2whs s ILE 115 Ca 0.68 -0.53 -0.01 0.00 0.00 0.00 0.00 60.65 60.79 2whs s ILE 115 Cb -0.18 -1.33 -0.02 0.00 0.01 0.00 0.00 42.46 40.94 2whs s ILE 115 CO 0.23 0.43 -0.08 -0.31 0.00 0.00 0.00 174.94 175.21 2whs s TYR 116 N 1.49 2.91 -0.29 3.97 2.02 -0.18 -0.27 117.35 127.00 2whs s TYR 116 Ca 0.03 -0.38 -0.01 0.00 -0.37 0.00 0.00 57.07 56.34 2whs s TYR 116 Cb -0.13 -1.86 0.05 0.00 -0.40 0.00 0.00 41.96 39.62 2whs s TYR 116 CO -0.09 -0.04 -0.03 1.21 -1.57 0.00 0.00 175.55 175.03 2whs s ASN 117 N 0.14 4.74 -0.11 2.29 3.84 -0.29 -0.51 114.94 125.03 2whs s ASN 117 Ca -0.04 -1.28 -0.00 0.00 0.21 0.00 0.00 52.86 51.75 2whs s ASN 117 Cb -0.14 -1.67 -0.02 0.00 -0.55 0.00 0.00 41.25 38.87 2whs s ASN 117 CO 0.04 -0.23 -0.11 -0.69 -2.79 0.00 0.00 177.10 173.32 2whs s VAL 118 N 1.22 3.30 -0.03 -5.21 1.01 0.13 -1.71 120.40 119.11 2whs s VAL 118 Ca -0.06 -0.59 0.05 0.00 0.00 0.00 0.00 61.98 61.38 2whs s VAL 118 Cb -0.20 -2.38 -0.01 0.00 0.00 0.00 0.00 36.38 33.80 2whs s VAL 118 CO -0.02 0.54 -0.19 -0.54 0.00 0.00 0.00 175.10 174.89 2whs s LYS 119 N 0.00 1.73 -0.02 2.72 1.02 0.13 -1.34 119.74 123.98 2whs s LYS 119 Ca -0.03 -0.67 0.01 0.00 0.02 0.00 0.00 55.97 55.31 2whs s LYS 119 Cb -0.14 -1.58 0.01 0.00 -0.52 0.00 0.00 37.83 35.60 2whs s LYS 119 CO 0.04 0.34 -0.05 -1.50 -0.92 0.00 0.00 175.35 173.25 2whs s ILE 120 N -0.22 0.49 -0.17 2.17 2.07 -0.85 -0.60 121.20 124.10 2whs s ILE 120 Ca 0.02 -0.18 0.00 0.00 -1.41 0.00 0.00 60.65 59.08 2whs s ILE 120 Cb -0.10 -0.46 0.04 0.00 0.13 0.00 0.00 42.46 42.07 2whs s ILE 120 CO 0.01 0.17 -0.09 -0.44 -1.91 0.00 0.00 174.94 172.68 2whs s SER 121 N 0.36 2.93 -0.18 4.50 0.01 0.45 -1.46 113.70 120.31 2whs s SER 121 Ca -0.04 -0.67 -0.00 0.00 1.31 0.00 0.00 55.95 56.55 2whs s SER 121 Cb -0.08 -1.07 0.01 0.00 0.21 0.00 0.00 66.02 65.08 2whs s SER 121 CO -0.00 -0.14 -0.16 -0.83 0.41 0.00 0.00 173.24 172.52 2whs s GLY 122 N 1.53 1.45 0.04 3.44 0.00 -0.14 -0.68 107.32 112.96 2whs s GLY 122 Ca 0.01 -1.16 0.06 0.00 0.00 0.00 0.00 44.72 43.63 2whs s GLY 122 CO -0.09 0.22 -0.16 -1.83 0.00 0.00 0.00 173.10 171.25 2whs s GLU 123 N 1.17 1.11 -0.27 2.90 -1.05 -0.42 0.21 118.70 122.35 2whs s GLU 123 Ca 0.02 -0.80 0.00 0.00 -0.15 0.00 0.00 54.97 54.04 2whs s GLU 123 Cb -0.14 -1.15 0.00 0.00 -0.44 0.00 0.00 34.13 32.40 2whs s GLU 123 CO -0.07 0.29 0.00 0.09 0.95 0.00 0.00 175.26 176.52 2whs n ASN 124 N 1.96 -2.05 -4.69 0.83 5.03 -1.26 -1.72 115.26 113.36 2whs n ASN 124 Ca -0.17 0.01 -0.42 0.00 0.87 0.00 0.00 54.58 54.87 2whs n ASN 124 Cb 0.54 -1.14 -0.03 0.00 -1.02 0.00 0.00 39.78 38.13 2whs n ASN 124 CO 0.00 0.00 0.00 -0.36 -1.83 0.00 0.00 177.26 175.07 2whs s PHE 125 N -2.14 3.04 0.19 3.10 0.08 -1.26 -3.58 117.98 117.41 2whs s PHE 125 Ca 0.00 1.00 -0.33 0.00 0.12 0.00 0.00 56.93 57.72 2whs s PHE 125 Cb 0.00 -3.57 -0.14 0.00 -0.57 0.00 0.00 43.02 38.75 2whs s PHE 125 CO 0.00 -1.98 1.51 -2.30 -0.10 0.00 0.00 175.22 172.34 2whs n PRO 126 N 5.08 2.08 -0.00 0.24 -0.02 -1.26 -4.86 135.00 136.25 2whs n PRO 126 Ca 0.12 0.75 0.17 0.00 -2.02 0.00 0.00 63.50 62.51 2whs n PRO 126 Cb 0.45 -2.47 0.63 0.00 -0.02 0.00 0.00 33.50 32.08 2whs n PRO 126 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2whs h PRO 127 N 5.21 0.12 -0.39 0.52 0.11 -1.98 -0.02 132.00 135.57 2whs h PRO 127 Ca -0.45 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2whs h PRO 127 Cb 1.26 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2whs h PRO 127 CO 0.83 0.08 0.00 0.09 -0.21 0.00 0.00 178.00 178.79 2whs n ASN 128 N -4.43 3.29 -4.41 -2.05 3.02 -1.26 -4.42 115.26 105.01 2whs n ASN 128 Ca 0.09 -1.94 -0.29 0.00 -0.03 0.00 0.00 54.58 52.41 2whs n ASN 128 Cb 0.49 -0.25 0.22 0.00 -0.61 0.00 0.00 39.78 39.63 2whs n ASN 128 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 2whs s GLY 129 N -1.28 1.54 0.44 7.41 0.00 -0.02 -4.79 107.32 110.62 2whs s GLY 129 Ca 0.35 -0.43 0.22 0.00 0.00 0.00 0.00 44.72 44.86 2whs s GLY 129 CO 0.27 0.30 1.87 -0.56 0.00 0.00 0.00 173.10 174.98 2whs h PRO 130 N -2.37 0.00 0.13 2.90 0.13 -1.95 -2.10 132.00 128.75 2whs h PRO 130 Ca -0.55 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.57 2whs h PRO 130 Cb 1.33 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.46 2whs h PRO 130 CO 0.51 0.26 -0.06 0.28 -0.23 0.00 0.00 178.00 178.75 2whs h VAL 131 N 0.00 1.04 0.00 1.56 2.07 -1.93 0.38 116.25 119.37 2whs h VAL 131 Ca -0.00 -1.05 0.00 0.00 0.82 0.00 0.00 66.70 66.47 2whs h VAL 131 Cb 0.66 1.66 0.00 0.00 -1.52 0.00 0.00 31.29 32.08 2whs h VAL 131 CO 0.03 0.24 0.00 0.24 0.02 0.00 0.00 177.57 178.10 2whs h MET 132 N -0.70 0.00 -0.03 1.57 2.86 -1.77 0.18 114.93 117.04 2whs h MET 132 Ca -0.02 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 2whs h MET 132 Cb 0.52 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.18 2whs h MET 132 CO 0.03 0.00 -0.01 1.04 1.06 0.00 0.00 176.91 179.03 2whs n GLN 133 N -3.06 2.17 -3.34 1.72 1.13 -0.79 -4.63 117.38 110.57 2whs n GLN 133 Ca 0.01 -1.71 -0.17 0.00 -1.94 0.00 0.00 57.00 53.19 2whs n GLN 133 Cb 0.36 -1.46 0.08 0.00 0.11 0.00 0.00 30.24 29.32 2whs n GLN 133 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2whs n LYS 134 N 1.08 -6.28 -0.29 -1.09 5.02 -0.29 -4.93 118.16 111.38 2whs n LYS 134 Ca 0.15 0.75 0.10 0.00 -2.02 0.00 0.00 58.31 57.28 2whs n LYS 134 Cb 0.55 -5.49 0.26 0.00 -0.02 0.00 0.00 35.03 30.33 2whs n LYS 134 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2whs n LYS 135 N -4.01 2.72 -3.38 1.97 4.76 0.12 -4.98 118.16 115.36 2whs n LYS 135 Ca -0.17 -2.43 -0.31 0.00 -2.87 0.00 0.00 58.31 52.53 2whs n LYS 135 Cb 0.62 -1.47 -0.05 0.00 -1.84 0.00 0.00 35.03 32.29 2whs n LYS 135 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2whs s THR 136 N -1.04 4.96 -0.05 -0.18 -4.23 -1.25 -0.83 115.64 113.02 2whs s THR 136 Ca 0.40 0.34 0.22 0.00 -1.18 0.00 0.00 61.69 61.48 2whs s THR 136 Cb 0.21 -3.65 0.43 0.00 1.34 0.00 0.00 72.50 70.83 2whs s THR 136 CO 0.28 -0.16 1.18 0.00 -0.54 0.00 0.00 174.62 175.38 2whs n GLN 137 N -0.40 0.42 0.00 3.99 6.02 0.11 -4.84 117.38 122.67 2whs n GLN 137 Ca -0.00 -2.34 0.00 0.00 -0.01 0.00 0.00 57.00 54.65 2whs n GLN 137 Cb 0.53 -0.42 0.00 0.00 1.02 0.00 0.00 30.24 31.37 2whs n GLN 137 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2whs n GLY 138 N 0.10 2.89 3.82 1.08 0.00 -1.26 -4.74 105.19 107.08 2whs n GLY 138 Ca 0.09 -1.92 -0.37 0.00 0.00 0.00 0.00 46.02 43.83 2whs n GLY 138 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2whs s TRP 139 N -2.83 3.69 0.61 1.61 0.52 -1.26 -0.25 118.94 121.03 2whs s TRP 139 Ca 0.00 1.33 -0.18 0.00 0.02 0.00 0.00 56.10 57.28 2whs s TRP 139 Cb 0.00 -2.57 -0.03 0.00 -1.15 0.00 0.00 33.47 29.73 2whs s TRP 139 CO 0.00 0.41 1.16 -1.21 0.02 0.00 0.00 176.95 177.33 2whs s GLU 140 N -1.76 2.96 0.73 4.98 0.41 0.25 -4.78 118.70 121.49 2whs s GLU 140 Ca 0.39 1.64 -0.16 0.00 -0.41 0.00 0.00 54.97 56.43 2whs s GLU 140 Cb -0.17 -1.95 -0.05 0.00 -1.78 0.00 0.00 34.13 30.17 2whs s GLU 140 CO 0.21 -1.17 0.40 -2.30 -0.49 0.00 0.00 175.26 171.91 2whs n PRO 141 N -1.83 0.24 -3.89 0.39 -0.02 -1.26 -4.72 135.00 123.91 2whs n PRO 141 Ca 0.12 0.11 -0.10 0.00 -2.02 0.00 0.00 63.50 61.62 2whs n PRO 141 Cb 0.51 -1.71 -0.06 0.00 -0.02 0.00 0.00 33.50 32.21 2whs n PRO 141 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2whs s SER 142 N -1.42 -0.05 -0.22 2.55 1.04 -0.61 -4.91 113.70 110.07 2whs s SER 142 Ca 0.63 -0.74 0.01 0.00 0.48 0.00 0.00 55.95 56.32 2whs s SER 142 Cb -0.35 0.48 0.05 0.00 0.10 0.00 0.00 66.02 66.31 2whs s SER 142 CO 0.60 -0.94 -0.06 -0.89 0.98 0.00 0.00 173.24 172.93 2whs s THR 143 N -3.94 1.47 0.03 2.02 2.01 -1.26 -1.16 115.64 114.82 2whs s THR 143 Ca 0.14 -1.09 -0.21 0.00 0.31 0.00 0.00 61.69 60.84 2whs s THR 143 Cb 0.02 -1.70 -0.06 0.00 0.01 0.00 0.00 72.50 70.77 2whs s THR 143 CO -0.01 -0.03 0.60 -0.70 -0.69 0.00 0.00 174.62 173.80 2whs s GLU 144 N 1.44 4.30 -0.13 4.92 2.12 -0.40 -4.67 118.70 126.28 2whs s GLU 144 Ca -0.04 0.77 -0.03 0.00 0.36 0.00 0.00 54.97 56.03 2whs s GLU 144 Cb -0.18 -3.31 -0.03 0.00 0.26 0.00 0.00 34.13 30.87 2whs s GLU 144 CO -0.07 0.45 -0.04 1.03 -0.54 0.00 0.00 175.26 176.10 2whs s ARG 145 N -0.49 3.42 0.04 4.30 0.52 -0.42 -0.84 118.95 125.47 2whs s ARG 145 Ca 0.31 -0.51 0.06 0.00 -0.52 0.00 0.00 55.73 55.07 2whs s ARG 145 Cb -0.19 -2.84 -0.02 0.00 0.52 0.00 0.00 34.95 32.42 2whs s ARG 145 CO 0.18 0.38 -0.17 -0.51 0.02 0.00 0.00 175.30 175.20 2whs s LEU 146 N -0.03 2.16 0.09 2.53 1.02 -0.37 -1.18 118.68 122.90 2whs s LEU 146 Ca 0.01 -0.48 -0.04 0.00 0.02 0.00 0.00 54.13 53.64 2whs s LEU 146 Cb -0.13 -0.80 -0.02 0.00 0.02 0.00 0.00 46.19 45.26 2whs s LEU 146 CO 0.03 0.10 0.09 0.72 0.02 0.00 0.00 176.35 177.31 2whs s PHE 147 N -0.80 0.47 -0.07 0.29 -0.12 -0.52 -1.78 117.98 115.46 2whs s PHE 147 Ca 0.05 -0.92 -0.16 0.00 -0.05 0.00 0.00 56.93 55.85 2whs s PHE 147 Cb -0.08 -0.27 -0.05 0.00 -0.63 0.00 0.00 43.02 41.99 2whs s PHE 147 CO 0.01 -0.50 0.41 0.00 -0.05 0.00 0.00 175.22 175.09 2whs s ALA 148 N -3.93 3.61 -0.07 1.99 0.00 -1.26 -0.44 121.76 121.65 2whs s ALA 148 Ca 0.11 -0.25 -0.03 0.00 0.00 0.00 0.00 51.96 51.79 2whs s ALA 148 Cb 0.06 -2.47 0.04 0.00 0.00 0.00 0.00 23.12 20.76 2whs s ALA 148 CO -0.07 0.26 0.14 0.50 0.00 0.00 0.00 175.76 176.60 2whs s ARG 149 N -0.28 0.06 -1.47 0.00 3.52 -0.11 -4.94 118.95 115.73 2whs s ARG 149 Ca 0.23 0.42 -0.07 0.00 -0.13 0.00 0.00 55.73 56.18 2whs s ARG 149 Cb -0.16 -0.22 0.01 0.00 -1.56 0.00 0.00 34.95 33.02 2whs s ARG 149 CO 0.11 -0.21 0.17 -0.25 -0.81 0.00 0.00 175.30 174.31 2whs n ASP 150 N 4.58 -0.18 0.00 -2.12 8.00 -1.26 -0.82 116.55 124.75 2whs n ASP 150 Ca -0.19 -1.26 0.00 0.00 0.71 0.00 0.00 54.79 54.05 2whs n ASP 150 Cb 0.51 -1.75 0.00 0.00 -0.02 0.00 0.00 41.12 39.86 2whs n ASP 150 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2whs n GLY 151 N -2.44 1.28 3.76 0.44 0.00 -1.26 -5.00 105.19 101.97 2whs n GLY 151 Ca -0.28 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.51 2whs n GLY 151 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2whs s MET 152 N -0.09 2.49 -0.11 1.61 -1.94 0.00 -4.65 119.30 116.61 2whs s MET 152 Ca 0.00 -1.44 -0.02 0.00 -1.71 0.00 0.00 55.69 52.53 2whs s MET 152 Cb 0.00 -2.27 -0.03 0.00 2.01 0.00 0.00 34.83 34.54 2whs s MET 152 CO 0.00 0.16 -0.04 -0.51 -0.01 0.00 0.00 175.02 174.62 2whs s LEU 153 N -3.86 3.32 -0.18 -0.03 1.02 -0.13 -0.94 118.68 117.88 2whs s LEU 153 Ca 0.37 -0.02 -0.01 0.00 0.02 0.00 0.00 54.13 54.49 2whs s LEU 153 Cb -0.04 -1.76 -0.00 0.00 0.02 0.00 0.00 46.19 44.40 2whs s LEU 153 CO 0.23 0.29 -0.11 -0.63 0.02 0.00 0.00 176.35 176.15 2whs s ILE 154 N -0.36 2.92 0.08 -0.59 -1.09 0.41 -0.00 121.20 122.57 2whs s ILE 154 Ca 0.06 -0.66 0.08 0.00 -2.23 0.00 0.00 60.65 57.89 2whs s ILE 154 Cb -0.12 -2.28 -0.04 0.00 -1.58 0.00 0.00 42.46 38.44 2whs s ILE 154 CO 0.02 0.48 -0.17 -0.83 -1.23 0.00 0.00 174.94 173.22 2whs s GLY 155 N 1.11 1.66 -0.07 6.18 0.00 0.60 -1.44 107.32 115.35 2whs s GLY 155 Ca 0.01 -1.26 -0.03 0.00 0.00 0.00 0.00 44.72 43.43 2whs s GLY 155 CO -0.03 -1.20 0.15 -1.31 0.00 0.00 0.00 173.10 170.71 2whs s ASN 156 N -1.84 0.10 -0.14 1.64 0.01 -0.32 -1.18 114.94 113.20 2whs s ASN 156 Ca 0.17 0.32 -0.07 0.00 -0.71 0.00 0.00 52.86 52.57 2whs s ASN 156 Cb -0.11 0.22 0.06 0.00 0.41 0.00 0.00 41.25 41.83 2whs s ASN 156 CO 0.08 -0.17 0.33 -0.62 -1.51 0.00 0.00 177.10 175.21 2whs s ASP 157 N 1.47 -0.34 -0.40 -1.22 -1.08 -0.89 -1.30 116.67 112.91 2whs s ASP 157 Ca -0.06 0.73 -0.13 0.00 -0.52 0.00 0.00 52.55 52.56 2whs s ASP 157 Cb -0.12 0.65 0.03 0.00 -1.46 0.00 0.00 42.92 42.02 2whs s ASP 157 CO -0.06 -0.19 0.26 -0.31 0.52 0.00 0.00 175.17 175.40 2whs s TYR 158 N 1.49 3.24 0.31 -5.34 2.02 -1.26 -0.34 117.35 117.48 2whs s TYR 158 Ca -0.08 -0.79 0.08 0.00 -0.37 0.00 0.00 57.07 55.90 2whs s TYR 158 Cb -0.10 -2.56 -0.03 0.00 -0.40 0.00 0.00 41.96 38.87 2whs s TYR 158 CO -0.11 -0.63 0.23 -1.64 -1.57 0.00 0.00 175.55 171.83 2whs s MET 159 N 1.62 2.70 -0.11 -0.62 -1.94 -0.12 -4.86 119.30 115.97 2whs s MET 159 Ca 0.04 -1.28 -0.05 0.00 -1.71 0.00 0.00 55.69 52.68 2whs s MET 159 Cb -0.19 -2.44 0.05 0.00 2.01 0.00 0.00 34.83 34.26 2whs s MET 159 CO 0.08 0.18 0.26 0.00 -0.01 0.00 0.00 175.02 175.54 2whs s ALA 160 N -2.28 -0.59 -0.13 3.03 0.00 -1.26 -1.68 121.76 118.85 2whs s ALA 160 Ca 0.38 1.02 -0.20 0.00 0.00 0.00 0.00 51.96 53.17 2whs s ALA 160 Cb -0.06 -0.73 -0.04 0.00 0.00 0.00 0.00 23.12 22.30 2whs s ALA 160 CO 0.25 -0.29 0.55 -0.51 0.00 0.00 0.00 175.76 175.77 2whs s LEU 161 N 1.49 4.24 0.37 0.00 1.43 -0.12 -0.58 118.68 125.51 2whs s LEU 161 Ca -0.07 0.87 -0.27 0.00 -1.03 0.00 0.00 54.13 53.62 2whs s LEU 161 Cb -0.11 -2.80 -0.10 0.00 0.03 0.00 0.00 46.19 43.22 2whs s LEU 161 CO -0.09 -0.09 1.33 -0.54 0.23 0.00 0.00 176.35 177.19 2whs s LYS 162 N 1.03 4.16 0.08 1.70 1.02 0.65 -0.69 119.74 127.69 2whs s LYS 162 Ca 0.28 2.24 0.07 0.00 0.02 0.00 0.00 55.97 58.58 2whs s LYS 162 Cb -0.16 -2.93 -0.04 0.00 -0.52 0.00 0.00 37.83 34.19 2whs s LYS 162 CO 0.12 -0.36 -0.12 -0.51 -0.92 0.00 0.00 175.35 173.55 2whs s LEU 163 N -2.10 2.94 0.18 3.17 1.43 -0.48 0.05 118.68 123.87 2whs s LEU 163 Ca 0.53 -0.39 -0.33 0.00 -1.03 0.00 0.00 54.13 52.91 2whs s LEU 163 Cb -0.40 -1.74 -0.15 0.00 0.03 0.00 0.00 46.19 43.93 2whs s LEU 163 CO 0.53 0.20 1.35 -0.62 0.23 0.00 0.00 176.35 178.04 2whs n GLU 164 N 0.96 1.64 -3.47 1.70 1.02 -0.01 -1.90 120.64 120.59 2whs n GLU 164 Ca -0.14 0.59 -0.21 0.00 -0.02 0.00 0.00 57.16 57.38 2whs n GLU 164 Cb 0.52 -2.22 0.08 0.00 -0.02 0.00 0.00 31.44 29.80 2whs n GLU 164 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2whs n GLY 165 N 2.41 -0.40 0.43 0.62 0.00 -1.26 -4.89 105.19 102.09 2whs n GLY 165 Ca 0.15 0.16 0.05 0.00 0.00 0.00 0.00 46.02 46.37 2whs n GLY 165 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2whs n GLY 166 N -1.73 -2.87 0.00 -0.02 0.00 -0.80 -5.08 105.19 94.69 2whs n GLY 166 Ca -0.05 -1.32 0.00 0.00 0.00 0.00 0.00 46.02 44.65 2whs n GLY 166 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2whs n GLY 167 N -2.64 -0.55 3.09 -0.02 0.00 -1.26 -4.63 105.19 99.18 2whs n GLY 167 Ca -0.03 -1.74 -0.08 0.00 0.00 0.00 0.00 46.02 44.17 2whs n GLY 167 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2whs s HIS 168 N -1.57 0.54 -0.22 1.61 0.09 -1.26 -1.38 115.29 113.09 2whs s HIS 168 Ca 0.00 -0.99 -0.00 0.00 -0.00 0.00 0.00 55.06 54.06 2whs s HIS 168 Cb 0.00 -0.39 0.02 0.00 -0.00 0.00 0.00 32.58 32.22 2whs s HIS 168 CO 0.00 -0.33 -0.11 -0.47 -0.00 0.00 0.00 174.74 173.82 2whs s TYR 169 N -3.62 2.98 0.09 1.40 5.04 0.13 -4.93 117.35 118.43 2whs s TYR 169 Ca 0.05 -1.60 -0.08 0.00 -2.44 0.00 0.00 57.07 53.00 2whs s TYR 169 Cb 0.06 -2.00 -0.06 0.00 0.35 0.00 0.00 41.96 40.31 2whs s TYR 169 CO -0.08 -0.75 0.37 -0.51 -1.34 0.00 0.00 175.55 173.24 2whs s LEU 170 N 1.30 4.33 -0.01 6.97 1.43 -1.26 -0.95 118.68 130.49 2whs s LEU 170 Ca 0.01 0.70 -0.01 0.00 -1.03 0.00 0.00 54.13 53.80 2whs s LEU 170 Cb -0.15 -3.02 -0.00 0.00 0.03 0.00 0.00 46.19 43.04 2whs s LEU 170 CO -0.07 0.15 0.03 0.00 0.23 0.00 0.00 176.35 176.69 2whs s GLU 172 N -0.27 3.81 -0.16 0.00 2.12 0.33 -0.94 118.70 123.59 2whs s GLU 172 Ca -0.03 -0.42 -0.12 0.00 0.36 0.00 0.00 54.97 54.76 2whs s GLU 172 Cb -0.02 -3.25 -0.05 0.00 0.26 0.00 0.00 34.13 31.07 2whs s GLU 172 CO -0.00 0.06 0.25 -0.06 -0.54 0.00 0.00 175.26 174.97 2whs s PHE 173 N 0.94 3.47 -0.08 5.30 0.40 0.54 -0.89 117.98 127.66 2whs s PHE 173 Ca 0.04 0.54 0.02 0.00 -0.60 0.00 0.00 56.93 56.93 2whs s PHE 173 Cb -0.14 -2.27 0.02 0.00 0.51 0.00 0.00 43.02 41.14 2whs s PHE 173 CO 0.03 0.30 -0.12 0.21 0.70 0.00 0.00 175.22 176.34 2whs s LYS 174 N 0.28 1.77 -0.01 0.44 2.47 -0.09 -2.10 119.74 122.50 2whs s LYS 174 Ca 0.15 -0.41 0.05 0.00 -1.56 0.00 0.00 55.97 54.20 2whs s LYS 174 Cb -0.13 -1.54 -0.01 0.00 -1.46 0.00 0.00 37.83 34.69 2whs s LYS 174 CO 0.03 -0.05 -0.16 -1.12 0.16 0.00 0.00 175.35 174.20 2whs s SER 175 N 0.95 1.94 -0.15 1.43 0.01 -0.33 -0.13 113.70 117.42 2whs s SER 175 Ca -0.09 -0.30 0.02 0.00 1.31 0.00 0.00 55.95 56.89 2whs s SER 175 Cb -0.15 -0.23 0.02 0.00 0.21 0.00 0.00 66.02 65.86 2whs s SER 175 CO 0.00 0.20 -0.19 -0.89 0.41 0.00 0.00 173.24 172.77 2whs s THR 176 N -0.36 1.91 -0.13 1.44 2.01 -0.18 -0.29 115.64 120.05 2whs s THR 176 Ca 0.06 -0.87 -0.02 0.00 0.31 0.00 0.00 61.69 61.17 2whs s THR 176 Cb -0.07 -1.72 -0.03 0.00 0.01 0.00 0.00 72.50 70.70 2whs s THR 176 CO -0.00 0.52 -0.06 -0.31 -0.69 0.00 0.00 174.62 174.08 2whs s TYR 177 N 1.06 2.97 -0.23 4.92 2.02 1.00 -1.87 117.35 127.23 2whs s TYR 177 Ca -0.02 -0.25 -0.02 0.00 -0.37 0.00 0.00 57.07 56.41 2whs s TYR 177 Cb -0.14 -1.87 0.07 0.00 -0.40 0.00 0.00 41.96 39.62 2whs s TYR 177 CO -0.06 0.05 0.05 0.21 -1.57 0.00 0.00 175.55 174.23 2whs s LYS 178 N 0.02 0.69 0.58 -0.62 2.20 0.33 -0.96 119.74 121.98 2whs s LYS 178 Ca -0.01 -0.60 -0.18 0.00 -0.36 0.00 0.00 55.97 54.83 2whs s LYS 178 Cb -0.14 -2.06 -0.04 0.00 -1.51 0.00 0.00 37.83 34.09 2whs s LYS 178 CO 0.03 -0.74 1.12 0.00 -0.36 0.00 0.00 175.35 175.41 2whs s ALA 179 N 1.80 2.62 -1.84 3.13 0.00 -1.26 -0.48 121.76 125.72 2whs s ALA 179 Ca 0.02 0.74 0.29 0.00 0.00 0.00 0.00 51.96 53.00 2whs s ALA 179 Cb -0.17 -3.35 1.23 0.00 0.00 0.00 0.00 23.12 20.84 2whs s ALA 179 CO -0.13 -0.93 1.86 1.63 0.00 0.00 0.00 175.76 178.18 2whs n LYS 180 N -1.66 0.90 -3.92 0.00 5.02 -0.45 -4.81 118.16 113.25 2whs n LYS 180 Ca 0.11 -0.35 -0.09 0.00 -2.02 0.00 0.00 58.31 55.96 2whs n LYS 180 Cb 0.51 -1.49 -0.07 0.00 -0.02 0.00 0.00 35.03 33.95 2whs n LYS 180 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 2whs s LYS 181 N -2.34 0.93 0.32 1.97 0.00 -1.26 -5.00 119.74 114.36 2whs s LYS 181 Ca 0.32 -1.07 -0.29 0.00 0.00 0.00 0.00 55.97 54.93 2whs s LYS 181 Cb 0.20 0.34 -0.12 0.00 0.00 0.00 0.00 37.83 38.25 2whs s LYS 181 CO 0.44 -0.31 1.44 -2.30 0.00 0.00 0.00 175.35 174.63 2whs n PRO 182 N -0.10 2.42 -4.30 1.78 -0.02 -1.26 -4.95 135.00 128.57 2whs n PRO 182 Ca -0.12 0.85 -0.16 0.00 -2.02 0.00 0.00 63.50 62.06 2whs n PRO 182 Cb 0.63 -2.54 -0.10 0.00 -0.02 0.00 0.00 33.50 31.46 2whs n PRO 182 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2whs s VAL 183 N -0.66 0.77 -0.04 -1.45 -7.23 -1.26 -5.03 120.40 105.50 2whs s VAL 183 Ca 0.59 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 58.46 2whs s VAL 183 Cb -0.54 -2.37 -0.06 0.00 0.56 0.00 0.00 36.38 33.98 2whs s VAL 183 CO 0.57 -0.27 1.62 -0.13 -0.31 0.00 0.00 175.10 176.58 2whs s ARG 184 N -3.94 4.19 0.02 4.82 0.52 -1.26 -4.98 118.95 118.32 2whs s ARG 184 Ca 0.30 2.17 -0.28 0.00 -0.52 0.00 0.00 55.73 57.40 2whs s ARG 184 Cb 0.07 -3.89 -0.04 0.00 0.52 0.00 0.00 34.95 31.60 2whs s ARG 184 CO 0.09 -0.80 0.88 -1.64 0.02 0.00 0.00 175.30 173.84 2whs s MET 185 N 3.70 4.55 0.83 3.54 -1.94 -1.26 -4.67 119.30 124.05 2whs s MET 185 Ca 0.72 1.24 -0.12 0.00 -1.71 0.00 0.00 55.69 55.82 2whs s MET 185 Cb -0.33 -3.42 0.09 0.00 2.01 0.00 0.00 34.83 33.17 2whs s MET 185 CO 0.29 0.09 1.15 -1.25 -0.01 0.00 0.00 175.02 175.29 2whs s PRO 186 N 0.57 1.79 0.35 2.03 0.04 -1.26 -4.83 135.00 133.68 2whs s PRO 186 Ca 0.45 0.24 -0.04 0.00 0.04 0.00 0.00 61.00 61.69 2whs s PRO 186 Cb -0.21 -1.92 0.08 0.00 0.04 0.00 0.00 34.50 32.49 2whs s PRO 186 CO 0.25 -1.74 0.48 0.41 0.04 0.00 0.00 177.00 176.44 2whs n GLY 187 N -2.84 -0.60 3.59 0.56 0.00 -1.26 -4.60 105.19 100.04 2whs n GLY 187 Ca 0.07 -1.79 -0.62 0.00 0.00 0.00 0.00 46.02 43.69 2whs n GLY 187 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2whs n ARG 188 N -1.97 0.07 -0.86 1.61 0.63 -1.26 -4.79 116.66 110.09 2whs n ARG 188 Ca 0.06 0.02 0.00 0.00 -0.92 0.00 0.00 57.85 57.02 2whs n ARG 188 Cb 0.23 -1.53 0.00 0.00 0.45 0.00 0.00 32.46 31.60 2whs n ARG 188 CO 0.00 0.00 0.00 -2.39 -2.51 0.00 0.00 177.63 172.73 2whs n HIS 189 N 2.45 -0.59 -3.70 -0.14 1.44 -0.73 -4.31 115.22 109.64 2whs n HIS 189 Ca 0.24 0.00 -0.10 0.00 -2.01 0.00 0.00 57.72 55.85 2whs n HIS 189 Cb 0.04 0.00 -0.05 0.00 0.12 0.00 0.00 29.99 30.10 2whs n HIS 189 CO 0.00 0.00 0.00 -1.83 -2.81 0.00 0.00 176.34 171.70 2whs s GLU 190 N -1.16 1.12 -0.06 -1.40 -1.05 -0.60 -1.24 118.70 114.31 2whs s GLU 190 Ca 0.00 -0.80 0.00 0.00 -0.15 0.00 0.00 54.97 54.03 2whs s GLU 190 Cb 0.00 0.46 0.02 0.00 -0.44 0.00 0.00 34.13 34.18 2whs s GLU 190 CO 0.00 -0.44 -0.04 0.42 0.95 0.00 0.00 175.26 176.15 2whs s ILE 191 N -3.84 0.59 -0.17 1.83 1.01 -0.02 -0.70 121.20 119.89 2whs s ILE 191 Ca 0.06 -0.11 -0.05 0.00 0.00 0.00 0.00 60.65 60.54 2whs s ILE 191 Cb 0.02 -0.64 -0.03 0.00 0.01 0.00 0.00 42.46 41.82 2whs s ILE 191 CO -0.09 0.26 0.00 -0.62 0.00 0.00 0.00 174.94 174.49 2whs s ASP 192 N 1.19 5.06 0.02 3.58 3.68 0.12 -1.28 116.67 129.04 2whs s ASP 192 Ca -0.06 -0.08 -0.01 0.00 2.13 0.00 0.00 52.55 54.52 2whs s ASP 192 Cb -0.14 -1.85 -0.02 0.00 -1.45 0.00 0.00 42.92 39.47 2whs s ASP 192 CO -0.02 0.15 -0.00 -0.13 0.13 0.00 0.00 175.17 175.30 2whs s ARG 193 N 0.50 0.38 -0.04 4.34 0.52 -0.31 -0.41 118.95 123.93 2whs s ARG 193 Ca -0.01 -0.66 -0.00 0.00 -0.52 0.00 0.00 55.73 54.54 2whs s ARG 193 Cb -0.14 0.14 0.03 0.00 0.52 0.00 0.00 34.95 35.50 2whs s ARG 193 CO 0.02 -0.07 -0.00 0.21 0.02 0.00 0.00 175.30 175.48 2whs s LYS 194 N -1.81 0.45 -0.12 3.54 2.20 -0.71 -1.58 119.74 121.71 2whs s LYS 194 Ca -0.13 0.07 0.01 0.00 -0.36 0.00 0.00 55.97 55.57 2whs s LYS 194 Cb -0.07 -0.66 0.02 0.00 -1.51 0.00 0.00 37.83 35.60 2whs s LYS 194 CO -0.02 -0.17 -0.15 -1.17 -0.36 0.00 0.00 175.35 173.48 2whs s LEU 195 N 1.29 1.71 -0.02 5.43 2.96 -1.26 -1.48 118.68 127.31 2whs s LEU 195 Ca -0.06 -0.45 0.03 0.00 -0.22 0.00 0.00 54.13 53.43 2whs s LEU 195 Cb -0.13 -1.12 -0.00 0.00 0.50 0.00 0.00 46.19 45.44 2whs s LEU 195 CO -0.02 -0.01 -0.09 -1.81 -1.32 0.00 0.00 176.35 173.11 2whs s ASP 196 N 1.14 1.11 -0.31 3.68 1.01 -0.34 -4.52 116.67 118.44 2whs s ASP 196 Ca -0.03 -0.17 -0.29 0.00 0.71 0.00 0.00 52.55 52.77 2whs s ASP 196 Cb -0.14 -0.23 0.01 0.00 1.01 0.00 0.00 42.92 43.56 2whs s ASP 196 CO -0.04 0.08 1.26 -0.69 0.21 0.00 0.00 175.17 175.98 2whs s VAL 197 N 0.04 4.20 -0.78 -1.27 1.01 -1.26 -0.90 120.40 121.44 2whs s VAL 197 Ca -0.00 1.35 0.23 0.00 0.00 0.00 0.00 61.98 63.56 2whs s VAL 197 Cb -0.06 -4.22 -0.08 0.00 0.00 0.00 0.00 36.38 32.02 2whs s VAL 197 CO 0.00 -0.50 1.15 0.35 0.00 0.00 0.00 175.10 176.10 2whs n THR 198 N 6.19 0.11 -3.63 3.92 -2.24 0.54 -4.95 114.28 114.23 2whs n THR 198 Ca 0.14 -0.14 -0.11 0.00 -2.27 0.00 0.00 64.05 61.67 2whs n THR 198 Cb 0.47 0.29 -0.07 0.00 -2.10 0.00 0.00 70.33 68.92 2whs n THR 198 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2whs s SER 199 N -3.56 -0.53 0.09 3.42 0.15 -1.14 -4.99 113.70 107.15 2whs s SER 199 Ca 0.07 0.97 -0.23 0.00 0.70 0.00 0.00 55.95 57.45 2whs s SER 199 Cb 0.15 0.96 0.06 0.00 -1.71 0.00 0.00 66.02 65.49 2whs s SER 199 CO 0.77 -0.21 0.57 -1.38 1.20 0.00 0.00 173.24 174.19 2whs s HIS 200 N 0.09 -0.49 0.69 3.44 -3.43 -1.26 -0.20 115.29 114.13 2whs s HIS 200 Ca 0.01 0.44 -0.04 0.00 -0.80 0.00 0.00 55.06 54.68 2whs s HIS 200 Cb -0.04 0.44 0.08 0.00 -1.43 0.00 0.00 32.58 31.62 2whs s HIS 200 CO -0.03 -0.74 0.97 0.54 -2.00 0.00 0.00 174.74 173.48 2whs s ASN 201 N -2.29 4.69 0.17 7.38 2.20 -0.52 -4.97 114.94 121.59 2whs s ASN 201 Ca -0.02 0.12 -0.26 0.00 -0.94 0.00 0.00 52.86 51.75 2whs s ASN 201 Cb -0.00 -0.72 0.03 0.00 -2.00 0.00 0.00 41.25 38.55 2whs s ASN 201 CO -0.06 -1.63 1.57 0.03 -2.94 0.00 0.00 177.10 174.07 2whs h ARG 202 N -0.48 -0.22 -0.56 3.55 -0.00 -2.02 -1.89 114.38 112.75 2whs h ARG 202 Ca -0.42 0.02 0.00 0.00 -0.50 0.00 0.00 59.98 59.08 2whs h ARG 202 Cb 1.29 0.05 0.00 0.00 0.00 0.00 0.00 29.97 31.31 2whs h ARG 202 CO 0.51 -0.15 0.00 -0.40 0.00 0.00 0.00 179.97 179.94 2whs n ASP 203 N -5.40 3.11 -2.55 7.04 5.75 -1.26 -4.93 116.55 118.31 2whs n ASP 203 Ca 0.01 -2.16 -0.20 0.00 -0.01 0.00 0.00 54.79 52.43 2whs n ASP 203 Cb 0.35 -0.41 0.02 0.00 -1.03 0.00 0.00 41.12 40.04 2whs n ASP 203 CO 0.00 0.00 0.00 -1.22 -0.11 0.00 0.00 177.20 175.87 2whs n TYR 204 N 0.85 -1.48 0.52 2.11 4.02 -0.71 -4.49 117.16 117.97 2whs n TYR 204 Ca 0.18 0.31 0.12 0.00 -0.01 0.00 0.00 57.90 58.49 2whs n TYR 204 Cb 0.55 -4.03 0.08 0.00 -0.02 0.00 0.00 39.34 35.92 2whs n TYR 204 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 2whs n THR 205 N -4.27 0.27 -3.97 -0.72 -2.24 -1.26 -4.70 114.28 97.39 2whs n THR 205 Ca -0.15 -0.28 -0.28 0.00 -2.27 0.00 0.00 64.05 61.07 2whs n THR 205 Cb 0.63 0.03 -0.17 0.00 -2.10 0.00 0.00 70.33 68.72 2whs n THR 205 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2whs s SER 206 N -4.16 2.39 0.02 3.42 0.01 -1.26 -1.19 113.70 112.93 2whs s SER 206 Ca 0.04 -0.38 0.05 0.00 1.31 0.00 0.00 55.95 56.97 2whs s SER 206 Cb 0.14 -0.99 -0.02 0.00 0.21 0.00 0.00 66.02 65.36 2whs s SER 206 CO 0.77 -0.09 -0.14 -0.69 0.41 0.00 0.00 173.24 173.50 2whs s VAL 207 N 1.59 1.09 -0.06 3.43 1.01 -0.74 -1.44 120.40 125.28 2whs s VAL 207 Ca 0.05 -0.83 0.04 0.00 0.00 0.00 0.00 61.98 61.23 2whs s VAL 207 Cb -0.13 -0.96 -0.02 0.00 0.00 0.00 0.00 36.38 35.28 2whs s VAL 207 CO -0.09 0.11 -0.17 -1.61 0.00 0.00 0.00 175.10 173.34 2whs s GLU 208 N -0.82 2.63 0.09 2.72 2.02 0.72 0.30 118.70 126.36 2whs s GLU 208 Ca 0.03 -0.76 0.07 0.00 0.02 0.00 0.00 54.97 54.33 2whs s GLU 208 Cb -0.07 -2.35 -0.03 0.00 0.10 0.00 0.00 34.13 31.78 2whs s GLU 208 CO 0.01 0.50 -0.18 -0.65 0.02 0.00 0.00 175.26 174.96 2whs s GLN 209 N -0.42 1.00 0.06 1.61 -0.21 -0.36 -0.34 119.66 121.00 2whs s GLN 209 Ca 0.05 -1.10 0.05 0.00 0.02 0.00 0.00 55.36 54.38 2whs s GLN 209 Cb -0.12 -1.13 -0.03 0.00 1.00 0.00 0.00 33.01 32.73 2whs s GLN 209 CO 0.02 0.25 -0.14 0.00 -2.12 0.00 0.00 175.29 173.30 2whs s GLU 211 N -1.52 0.45 -0.08 0.00 2.12 -0.41 -1.20 118.70 118.06 2whs s GLU 211 Ca -0.01 -0.26 0.03 0.00 0.36 0.00 0.00 54.97 55.10 2whs s GLU 211 Cb -0.09 -0.41 -0.01 0.00 0.26 0.00 0.00 34.13 33.88 2whs s GLU 211 CO 0.02 0.11 -0.19 -1.50 -0.54 0.00 0.00 175.26 173.16 2whs s ILE 212 N -0.27 2.56 -0.05 -3.70 1.10 -0.55 -1.95 121.20 118.35 2whs s ILE 212 Ca 0.01 -0.87 0.00 0.00 -0.51 0.00 0.00 60.65 59.28 2whs s ILE 212 Cb -0.03 -2.00 0.03 0.00 0.15 0.00 0.00 42.46 40.61 2whs s ILE 212 CO -0.00 0.56 -0.02 0.00 -2.11 0.00 0.00 174.94 173.37 2whs s ALA 213 N -0.05 0.57 -0.17 1.50 0.00 -0.49 -1.74 121.76 121.39 2whs s ALA 213 Ca -0.05 -0.01 -0.02 0.00 0.00 0.00 0.00 51.96 51.88 2whs s ALA 213 Cb -0.14 -0.49 0.05 0.00 0.00 0.00 0.00 23.12 22.53 2whs s ALA 213 CO 0.04 -0.17 -0.01 0.42 0.00 0.00 0.00 175.76 176.04 2whs s ILE 214 N 1.29 0.77 0.40 0.00 1.01 0.45 -1.91 121.20 123.20 2whs s ILE 214 Ca -0.06 -0.52 -0.23 0.00 0.00 0.00 0.00 60.65 59.84 2whs s ILE 214 Cb -0.13 -1.09 -0.09 0.00 0.01 0.00 0.00 42.46 41.15 2whs s ILE 214 CO -0.02 -0.01 1.01 0.00 0.00 0.00 0.00 174.94 175.92 2whs s ALA 215 N 1.77 3.07 0.13 9.38 0.00 -0.22 -0.70 121.76 135.18 2whs s ALA 215 Ca 0.00 0.60 -0.24 0.00 0.00 0.00 0.00 51.96 52.32 2whs s ALA 215 Cb -0.16 -3.23 0.08 0.00 0.00 0.00 0.00 23.12 19.81 2whs s ALA 215 CO -0.07 -0.09 0.66 -0.98 0.00 0.00 0.00 175.76 175.27 2whs s ARG 216 N -2.64 1.19 0.56 0.00 1.70 0.12 -4.48 118.95 115.40 2whs s ARG 216 Ca 0.58 -0.43 -0.21 0.00 -0.47 0.00 0.00 55.73 55.20 2whs s ARG 216 Cb -0.18 0.55 -0.04 0.00 -0.57 0.00 0.00 34.95 34.70 2whs s ARG 216 CO 0.23 -0.52 1.34 -1.01 -1.08 0.00 0.00 175.30 174.26 2whs s HIS 217 N -3.61 2.26 0.31 5.89 3.76 -1.26 -1.56 115.29 121.08 2whs s HIS 217 Ca 0.02 1.40 -0.00 0.00 -0.15 0.00 0.00 55.06 56.32 2whs s HIS 217 Cb -0.01 -3.76 -0.04 0.00 1.11 0.00 0.00 32.58 29.88 2whs s HIS 217 CO -0.12 -2.86 0.51 -1.12 -0.85 0.00 0.00 174.74 170.30 2whs s SER 218 N -1.06 6.33 0.00 1.40 0.01 -1.26 -4.67 113.70 114.45 2whs s SER 218 Ca 0.73 0.46 0.29 0.00 1.31 0.00 0.00 55.95 58.74 2whs s SER 218 Cb -0.39 -2.03 1.19 0.00 0.21 0.00 0.00 66.02 64.99 2whs s SER 218 CO 0.46 -0.23 1.82 0.00 0.41 0.00 0.00 173.24 175.70