#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hxl s VAL 3 N 0.00 3.38 0.49 0.00 1.01 -1.26 -4.91 120.40 119.11 2hxl s VAL 3 Ca 0.00 0.42 0.35 0.00 0.00 0.00 0.00 61.98 62.75 2hxl s VAL 3 Cb 0.00 -3.40 0.55 0.00 0.00 0.00 0.00 36.38 33.54 2hxl s VAL 3 CO 0.00 -0.18 1.68 1.55 0.00 0.00 0.00 175.10 178.15 2hxl h PRO 4 N 11.96 0.08 -0.05 2.72 0.13 -2.08 -3.09 132.00 141.68 2hxl h PRO 4 Ca -0.39 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 2hxl h PRO 4 Cb 1.19 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2hxl h PRO 4 CO 0.98 0.05 0.00 1.19 -0.23 0.00 0.00 178.00 180.00 2hxl n PHE 5 N -4.37 0.11 0.27 1.56 0.99 -1.26 -4.76 117.46 110.00 2hxl n PHE 5 Ca 0.35 -0.70 0.12 0.00 -0.00 0.00 0.00 57.45 57.21 2hxl n PHE 5 Cb 1.46 -0.10 0.74 0.00 -1.00 0.00 0.00 39.48 40.57 2hxl n PHE 5 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.76 177.04 2hxl h VAL 6 N 0.32 0.69 -0.00 -4.37 2.07 -1.96 -2.94 116.25 110.06 2hxl h VAL 6 Ca 0.00 -0.35 0.00 0.00 0.82 0.00 0.00 66.70 67.17 2hxl h VAL 6 Cb 0.76 1.21 0.00 0.00 -1.52 0.00 0.00 31.29 31.74 2hxl h VAL 6 CO 0.02 0.08 -0.04 -0.62 0.02 0.00 0.00 177.57 177.03 2hxl n GLU 7 N -3.90 0.90 -3.31 1.57 -0.58 -1.26 -4.82 120.64 109.23 2hxl n GLU 7 Ca -0.02 -0.22 -0.38 0.00 -0.42 0.00 0.00 57.16 56.12 2hxl n GLU 7 Cb 0.18 -1.50 -0.06 0.00 -0.57 0.00 0.00 31.44 29.49 2hxl n GLU 7 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 2hxl s ASP 8 N -2.25 6.66 0.03 1.62 1.01 -1.11 -5.05 116.67 117.58 2hxl s ASP 8 Ca 0.37 0.79 0.09 0.00 0.71 0.00 0.00 52.55 54.51 2hxl s ASP 8 Cb 0.21 -2.28 -0.03 0.00 1.01 0.00 0.00 42.92 41.83 2hxl s ASP 8 CO 0.41 -0.02 -0.26 0.26 0.21 0.00 0.00 175.17 175.78 2hxl s TRP 9 N 0.74 2.30 -0.09 4.23 0.51 -1.26 -1.23 118.94 124.14 2hxl s TRP 9 Ca 0.26 -0.42 0.00 0.00 -2.12 0.00 0.00 56.10 53.82 2hxl s TRP 9 Cb -0.15 -1.41 -0.03 0.00 -0.81 0.00 0.00 33.47 31.07 2hxl s TRP 9 CO 0.10 0.08 -0.07 -0.51 -0.51 0.00 0.00 176.95 176.04 2hxl s ASP 10 N -1.06 4.60 -0.64 2.95 -0.00 -0.53 -4.91 116.67 117.08 2hxl s ASP 10 Ca 0.11 -0.07 -0.22 0.00 -0.00 0.00 0.00 52.55 52.37 2hxl s ASP 10 Cb -0.10 -1.30 0.08 0.00 -0.00 0.00 0.00 42.92 41.60 2hxl s ASP 10 CO 0.01 0.31 0.90 -0.76 -0.00 0.00 0.00 175.17 175.64 2hxl s LEU 11 N -0.52 4.60 -0.06 1.23 1.02 -1.26 -0.96 118.68 122.73 2hxl s LEU 11 Ca 0.08 -1.06 -0.26 0.00 0.02 0.00 0.00 54.13 52.90 2hxl s LEU 11 Cb -0.12 -2.41 -0.23 0.00 0.02 0.00 0.00 46.19 43.46 2hxl s LEU 11 CO 0.02 -1.36 1.05 0.58 0.02 0.00 0.00 176.35 176.67 2hxl h VAL 12 N 5.96 1.55 -3.21 -1.59 2.07 -1.53 -3.49 116.25 116.01 2hxl h VAL 12 Ca -0.29 -1.76 -0.03 0.00 0.82 0.00 0.00 66.70 65.44 2hxl h VAL 12 Cb 1.07 2.69 -0.03 0.00 -1.52 0.00 0.00 31.29 33.50 2hxl h VAL 12 CO 1.16 0.47 0.16 0.00 0.02 0.00 0.00 177.57 179.38 2hxl s GLN 13 N -3.31 1.99 -0.29 1.57 -2.07 -1.25 -5.00 119.66 111.29 2hxl s GLN 13 Ca -0.17 -1.32 -0.13 0.00 -1.82 0.00 0.00 55.36 51.92 2hxl s GLN 13 Cb 0.00 0.58 -0.04 0.00 -1.09 0.00 0.00 33.01 32.47 2hxl s GLN 13 CO 0.71 -0.90 0.26 0.99 -1.32 0.00 0.00 175.29 175.03 2hxl s THR 14 N -3.07 5.26 0.07 3.63 2.01 -1.26 -0.88 115.64 121.40 2hxl s THR 14 Ca 0.17 0.21 -0.02 0.00 0.31 0.00 0.00 61.69 62.36 2hxl s THR 14 Cb -0.04 -3.63 -0.27 0.00 0.01 0.00 0.00 72.50 68.57 2hxl s THR 14 CO 0.11 0.16 1.12 -0.07 -0.69 0.00 0.00 174.62 175.25 2hxl h LEU 15 N 8.48 0.35 0.00 4.42 3.38 -1.29 -3.48 115.31 127.17 2hxl h LEU 15 Ca -0.33 -0.38 0.00 0.00 0.09 0.00 0.00 57.88 57.25 2hxl h LEU 15 Cb 1.17 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.81 2hxl h LEU 15 CO 0.60 1.30 0.00 0.61 0.09 0.00 0.00 178.44 181.04 2hxl n GLY 16 N 1.52 1.40 3.92 0.83 0.00 -1.08 -5.01 105.19 106.77 2hxl n GLY 16 Ca -0.08 0.15 -0.25 0.00 0.00 0.00 0.00 46.02 45.83 2hxl n GLY 16 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2hxl s GLU 17 N -0.67 3.33 0.36 1.61 2.02 -1.26 -1.14 118.70 122.94 2hxl s GLU 17 Ca 0.00 -0.67 -0.02 0.00 0.02 0.00 0.00 54.97 54.30 2hxl s GLU 17 Cb 0.00 -2.89 0.01 0.00 0.10 0.00 0.00 34.13 31.35 2hxl s GLU 17 CO 0.00 0.50 0.50 0.20 0.02 0.00 0.00 175.26 176.48 2hxl s GLY 18 N -3.30 1.58 0.08 -1.39 0.00 -0.46 -4.97 107.32 98.85 2hxl s GLY 18 Ca 0.34 -1.57 -0.29 0.00 0.00 0.00 0.00 44.72 43.20 2hxl s GLY 18 CO 0.28 -1.01 1.66 0.00 0.00 0.00 0.00 173.10 174.03 2hxl h ALA 19 N 2.06 -0.59 0.00 3.20 0.00 -2.02 -3.07 119.26 118.84 2hxl h ALA 19 Ca -0.28 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.48 2hxl h ALA 19 Cb 1.24 0.24 -0.00 0.00 0.00 0.00 0.00 17.79 19.26 2hxl h ALA 19 CO 0.38 -0.83 -0.11 0.10 0.00 0.00 0.00 179.25 178.79 2hxl h TYR 20 N -0.59 0.00 0.00 0.00 -0.00 -1.97 -3.49 116.97 110.92 2hxl h TYR 20 Ca -0.06 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.67 2hxl h TYR 20 Cb 0.46 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.19 2hxl h TYR 20 CO -0.05 0.11 0.00 0.41 -0.00 0.00 0.00 178.16 178.63 2hxl n GLY 21 N -0.19 -0.48 3.51 0.10 0.00 -1.16 -2.93 105.19 104.03 2hxl n GLY 21 Ca -0.00 0.26 -0.15 0.00 0.00 0.00 0.00 46.02 46.13 2hxl n GLY 21 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2hxl s GLU 22 N 0.00 1.00 -0.13 1.61 -1.05 -0.92 -1.36 118.70 117.85 2hxl s GLU 22 Ca 0.00 0.06 0.00 0.00 -0.15 0.00 0.00 54.97 54.88 2hxl s GLU 22 Cb 0.00 0.47 -0.01 0.00 -0.44 0.00 0.00 34.13 34.14 2hxl s GLU 22 CO 0.00 -0.35 -0.14 0.08 0.95 0.00 0.00 175.26 175.80 2hxl s VAL 23 N -1.80 2.95 0.20 1.83 1.01 -0.30 -0.60 120.40 123.70 2hxl s VAL 23 Ca -0.06 -0.70 0.09 0.00 0.00 0.00 0.00 61.98 61.31 2hxl s VAL 23 Cb -0.00 -2.23 -0.05 0.00 0.00 0.00 0.00 36.38 34.10 2hxl s VAL 23 CO 0.03 0.53 -0.18 -1.10 0.00 0.00 0.00 175.10 174.38 2hxl s GLN 24 N 0.35 1.39 -0.10 2.72 -0.21 -0.62 -0.80 119.66 122.39 2hxl s GLN 24 Ca -0.12 -1.55 -0.24 0.00 0.02 0.00 0.00 55.36 53.47 2hxl s GLN 24 Cb -0.16 -1.39 -0.03 0.00 1.00 0.00 0.00 33.01 32.43 2hxl s GLN 24 CO 0.06 0.26 0.75 -1.17 -2.12 0.00 0.00 175.29 173.07 2hxl s LEU 25 N -3.05 4.27 -0.06 2.90 2.96 -0.06 -0.76 118.68 124.88 2hxl s LEU 25 Ca 0.21 1.19 0.06 0.00 -0.22 0.00 0.00 54.13 55.37 2hxl s LEU 25 Cb -0.04 -3.14 -0.01 0.00 0.50 0.00 0.00 46.19 43.50 2hxl s LEU 25 CO 0.09 -0.21 -0.24 0.00 -1.32 0.00 0.00 176.35 174.66 2hxl s ALA 26 N 1.26 2.21 -0.10 5.97 0.00 -0.06 -1.18 121.76 129.85 2hxl s ALA 26 Ca 0.38 -1.04 0.04 0.00 0.00 0.00 0.00 51.96 51.34 2hxl s ALA 26 Cb -0.17 -0.71 0.00 0.00 0.00 0.00 0.00 23.12 22.24 2hxl s ALA 26 CO 0.17 0.42 -0.23 0.08 0.00 0.00 0.00 175.76 176.19 2hxl s VAL 27 N -0.18 2.02 0.23 0.00 1.01 -0.14 -1.27 120.40 122.08 2hxl s VAL 27 Ca -0.03 -1.00 -0.31 0.00 0.00 0.00 0.00 61.98 60.65 2hxl s VAL 27 Cb -0.14 -1.75 -0.11 0.00 0.00 0.00 0.00 36.38 34.39 2hxl s VAL 27 CO 0.04 0.55 1.55 0.21 0.00 0.00 0.00 175.10 177.44 2hxl s ASN 28 N 0.35 6.53 0.27 3.32 3.84 0.11 -1.45 114.94 127.91 2hxl s ASN 28 Ca -0.19 2.74 -0.04 0.00 0.21 0.00 0.00 52.86 55.58 2hxl s ASN 28 Cb -0.18 -2.61 0.33 0.00 -0.55 0.00 0.00 41.25 38.24 2hxl s ASN 28 CO 0.09 -0.82 1.94 -0.09 -2.79 0.00 0.00 177.10 175.43 2hxl h ARG 29 N 5.69 1.23 0.00 0.43 2.43 -1.44 -0.73 114.38 121.98 2hxl h ARG 29 Ca -0.45 -0.08 -0.13 0.00 -0.81 0.00 0.00 59.98 58.51 2hxl h ARG 29 Cb 1.21 -0.27 -0.02 0.00 -0.42 0.00 0.00 29.97 30.47 2hxl h ARG 29 CO 0.84 0.82 -0.98 0.28 -1.51 0.00 0.00 179.97 179.42 2hxl n VAL 30 N -4.39 1.48 0.15 0.20 0.31 -1.26 -4.61 118.33 110.20 2hxl n VAL 30 Ca 0.11 0.07 0.09 0.00 -0.01 0.00 0.00 64.34 64.60 2hxl n VAL 30 Cb 0.02 -2.20 0.06 0.00 -0.91 0.00 0.00 33.84 30.81 2hxl n VAL 30 CO 0.00 0.00 0.00 0.71 -1.32 0.00 0.00 176.83 176.22 2hxl h THR 31 N -1.00 0.17 -0.52 2.52 1.35 -1.94 -3.48 112.91 110.01 2hxl h THR 31 Ca -0.20 -1.27 -0.21 0.00 -0.55 0.00 0.00 66.41 64.19 2hxl h THR 31 Cb 0.95 1.87 -0.08 0.00 -1.73 0.00 0.00 68.15 69.17 2hxl h THR 31 CO -0.12 0.10 -0.19 -0.62 -0.25 0.00 0.00 175.52 174.44 2hxl n GLU 32 N -2.94 -0.71 -2.30 4.72 1.02 -0.28 -4.96 120.64 115.21 2hxl n GLU 32 Ca 0.01 0.84 -0.41 0.00 -0.02 0.00 0.00 57.16 57.58 2hxl n GLU 32 Cb 0.60 -4.77 -0.03 0.00 -0.02 0.00 0.00 31.44 27.21 2hxl n GLU 32 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 2hxl s GLU 33 N -2.92 4.49 -0.06 3.49 2.12 -1.26 -4.56 118.70 120.00 2hxl s GLU 33 Ca 0.00 2.00 -0.03 0.00 0.36 0.00 0.00 54.97 57.30 2hxl s GLU 33 Cb 0.00 -3.14 -0.04 0.00 0.26 0.00 0.00 34.13 31.21 2hxl s GLU 33 CO 0.00 -0.01 0.09 0.00 -0.54 0.00 0.00 175.26 174.80 2hxl s ALA 34 N -0.97 3.64 0.00 6.30 0.00 -1.26 -0.71 121.76 128.75 2hxl s ALA 34 Ca 0.48 -0.78 -0.13 0.00 0.00 0.00 0.00 51.96 51.53 2hxl s ALA 34 Cb -0.36 -1.70 0.02 0.00 0.00 0.00 0.00 23.12 21.08 2hxl s ALA 34 CO 0.46 0.65 0.26 0.14 0.00 0.00 0.00 175.76 177.27 2hxl s VAL 35 N -1.09 0.07 -0.05 0.00 -7.23 -0.40 -4.38 120.40 107.33 2hxl s VAL 35 Ca 0.19 -0.59 -0.14 0.00 -1.81 0.00 0.00 61.98 59.63 2hxl s VAL 35 Cb -0.12 -0.65 -0.05 0.00 0.56 0.00 0.00 36.38 36.12 2hxl s VAL 35 CO 0.09 -0.33 0.35 0.00 -0.31 0.00 0.00 175.10 174.91 2hxl s ALA 36 N -1.64 3.70 -0.26 1.32 0.00 -0.12 -0.88 121.76 123.88 2hxl s ALA 36 Ca -0.12 -0.32 0.01 0.00 0.00 0.00 0.00 51.96 51.53 2hxl s ALA 36 Cb -0.05 -2.34 0.05 0.00 0.00 0.00 0.00 23.12 20.78 2hxl s ALA 36 CO 0.02 0.42 -0.08 0.08 0.00 0.00 0.00 175.76 176.19 2hxl s VAL 37 N -0.75 2.48 -0.34 0.00 1.01 0.06 -0.55 120.40 122.31 2hxl s VAL 37 Ca 0.21 -1.39 -0.24 0.00 0.00 0.00 0.00 61.98 60.57 2hxl s VAL 37 Cb -0.15 -2.37 0.01 0.00 0.00 0.00 0.00 36.38 33.86 2hxl s VAL 37 CO 0.10 0.06 0.81 -0.75 0.00 0.00 0.00 175.10 175.32 2hxl s LYS 38 N 1.20 3.86 -0.41 2.72 2.20 -0.23 -1.59 119.74 127.48 2hxl s LYS 38 Ca -0.05 0.47 -0.10 0.00 -0.36 0.00 0.00 55.97 55.93 2hxl s LYS 38 Cb -0.19 -3.77 0.06 0.00 -1.51 0.00 0.00 37.83 32.43 2hxl s LYS 38 CO -0.05 -0.79 0.25 0.42 -0.36 0.00 0.00 175.35 174.83 2hxl s ILE 39 N 3.09 4.40 -0.21 5.43 1.01 0.23 -1.30 121.20 133.84 2hxl s ILE 39 Ca 0.33 -1.22 -0.04 0.00 0.00 0.00 0.00 60.65 59.71 2hxl s ILE 39 Cb -0.13 -3.62 -0.02 0.00 0.01 0.00 0.00 42.46 38.70 2hxl s ILE 39 CO 0.15 -0.44 -0.02 0.68 0.00 0.00 0.00 174.94 175.31 2hxl s VAL 40 N 1.48 3.65 -0.82 2.92 -7.23 -0.96 -2.16 120.40 117.27 2hxl s VAL 40 Ca 0.03 -0.41 -0.25 0.00 -1.81 0.00 0.00 61.98 59.53 2hxl s VAL 40 Cb -0.22 -2.66 0.02 0.00 0.56 0.00 0.00 36.38 34.08 2hxl s VAL 40 CO 0.04 0.42 1.49 -0.62 -0.31 0.00 0.00 175.10 176.12 2hxl s ASP 41 N 1.26 6.02 0.41 4.85 -1.08 -1.15 -2.39 116.67 124.58 2hxl s ASP 41 Ca 0.03 -0.65 0.16 0.00 -0.52 0.00 0.00 52.55 51.58 2hxl s ASP 41 Cb -0.14 -2.56 1.04 0.00 -1.46 0.00 0.00 42.92 39.80 2hxl s ASP 41 CO -0.00 -1.92 1.85 0.24 0.52 0.00 0.00 175.17 175.86 2hxl h MET 42 N 10.86 0.44 -0.82 4.34 2.86 -1.88 -2.46 114.93 128.27 2hxl h MET 42 Ca -0.10 -0.03 0.17 0.00 -2.06 0.00 0.00 59.70 57.68 2hxl h MET 42 Cb 1.05 -0.10 -0.10 0.00 0.06 0.00 0.00 31.60 32.51 2hxl h MET 42 CO 1.31 0.29 0.35 -0.22 1.06 0.00 0.00 176.91 179.70 2hxl h LYS 43 N 0.45 0.45 -0.24 1.72 1.63 -1.90 -2.20 116.57 116.48 2hxl h LYS 43 Ca 0.47 -0.03 -0.17 0.00 -0.85 0.00 0.00 60.65 60.07 2hxl h LYS 43 Cb 1.10 -0.10 -0.00 0.00 -0.60 0.00 0.00 32.23 32.63 2hxl h LYS 43 CO -0.19 0.30 -0.53 0.00 -3.45 0.00 0.00 179.45 175.58 2hxl h ARG 44 N 0.47 0.69 -1.92 1.90 3.08 -1.83 -3.50 114.38 113.27 2hxl h ARG 44 Ca 0.47 -0.43 -0.10 0.00 0.07 0.00 0.00 59.98 59.99 2hxl h ARG 44 Cb 0.75 0.04 -0.28 0.00 0.08 0.00 0.00 29.97 30.57 2hxl h ARG 44 CO -0.43 1.05 -0.42 0.00 -1.07 0.00 0.00 179.97 179.09 2hxl h PRO 49 N 8.15 -0.08 0.21 0.00 0.11 -1.96 -2.50 132.00 135.93 2hxl h PRO 49 Ca -0.19 0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.91 2hxl h PRO 49 Cb 1.14 0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2hxl h PRO 49 CO 0.23 -0.05 -0.10 1.49 -0.21 0.00 0.00 178.00 179.36 2hxl h GLU 50 N -0.08 -0.27 0.73 1.05 4.81 -2.00 -2.83 114.58 115.99 2hxl h GLU 50 Ca 0.19 0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.41 2hxl h GLU 50 Cb 0.38 0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.81 2hxl h GLU 50 CO -0.45 -0.04 -0.49 -0.97 -0.73 0.00 0.00 179.01 176.34 2hxl h ASN 51 N -0.47 -1.25 -0.18 1.04 -1.24 -1.93 -2.92 115.58 108.63 2hxl h ASN 51 Ca -0.03 0.08 -0.00 0.00 0.71 0.00 0.00 56.30 57.05 2hxl h ASN 51 Cb 0.36 0.37 -0.01 0.00 0.73 0.00 0.00 38.32 39.77 2hxl h ASN 51 CO 0.05 -0.73 0.10 -0.29 -1.29 0.00 0.00 177.43 175.28 2hxl h ILE 52 N -1.15 1.06 -0.72 2.57 6.09 -1.58 -2.13 117.51 121.65 2hxl h ILE 52 Ca -0.10 -0.17 -0.07 0.00 -1.37 0.00 0.00 64.86 63.16 2hxl h ILE 52 Cb 0.93 0.81 -0.03 0.00 0.47 0.00 0.00 36.82 39.00 2hxl h ILE 52 CO 0.07 0.07 0.20 0.50 -3.07 0.00 0.00 178.15 175.92 2hxl h LYS 53 N 0.27 1.15 -0.28 2.19 1.63 -1.43 -2.41 116.57 117.68 2hxl h LYS 53 Ca 0.07 -0.26 -0.18 0.00 -0.85 0.00 0.00 60.65 59.42 2hxl h LYS 53 Cb 0.01 -0.16 -0.00 0.00 -0.60 0.00 0.00 32.23 31.48 2hxl h LYS 53 CO -0.01 0.99 -0.54 -0.22 -3.45 0.00 0.00 179.45 176.22 2hxl h LYS 54 N 1.09 0.85 -0.94 1.90 3.64 -1.25 -2.79 116.57 119.07 2hxl h LYS 54 Ca 0.23 -0.53 0.05 0.00 -1.27 0.00 0.00 60.65 59.12 2hxl h LYS 54 Cb 0.35 0.06 -0.06 0.00 -0.41 0.00 0.00 32.23 32.17 2hxl h LYS 54 CO -0.00 1.17 0.60 1.49 -2.27 0.00 0.00 179.45 180.44 2hxl h GLU 55 N 0.65 1.11 -0.30 1.90 4.81 -1.18 -0.85 114.58 120.72 2hxl h GLU 55 Ca 0.02 -0.07 -0.09 0.00 -0.13 0.00 0.00 59.36 59.09 2hxl h GLU 55 Cb 1.14 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 30.27 2hxl h GLU 55 CO 0.12 0.73 -0.16 0.82 -0.73 0.00 0.00 179.01 179.79 2hxl h ILE 56 N 1.14 1.29 -0.39 2.32 2.04 -1.42 -1.81 117.51 120.68 2hxl h ILE 56 Ca 0.39 -1.27 0.03 0.00 1.00 0.00 0.00 64.86 65.01 2hxl h ILE 56 Cb 0.07 1.46 -0.04 0.00 -0.74 0.00 0.00 36.82 37.58 2hxl h ILE 56 CO -0.14 0.41 0.19 0.00 0.00 0.00 0.00 178.15 178.60 2hxl h ILE 58 N 0.38 1.25 -0.76 0.00 2.04 -1.16 -3.04 117.51 116.22 2hxl h ILE 58 Ca 0.17 -0.98 0.01 0.00 1.00 0.00 0.00 64.86 65.06 2hxl h ILE 58 Cb 0.09 0.98 -0.04 0.00 -0.74 0.00 0.00 36.82 37.12 2hxl h ILE 58 CO -0.13 0.34 0.50 0.78 0.00 0.00 0.00 178.15 179.64 2hxl h ASN 59 N 0.65 0.88 0.12 1.72 2.35 -0.99 -2.56 115.58 117.74 2hxl h ASN 59 Ca 0.14 -0.02 -0.01 0.00 -0.55 0.00 0.00 56.30 55.85 2hxl h ASN 59 Cb 0.44 -0.22 -0.00 0.00 0.05 0.00 0.00 38.32 38.59 2hxl h ASN 59 CO 0.02 0.64 -0.04 0.50 -1.65 0.00 0.00 177.43 176.89 2hxl h LYS 60 N 1.03 0.00 -0.57 0.81 3.64 -1.10 -2.33 116.57 118.06 2hxl h LYS 60 Ca 0.28 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.66 2hxl h LYS 60 Cb -0.12 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.70 2hxl h LYS 60 CO -0.06 0.04 0.00 0.00 -2.27 0.00 0.00 179.45 177.16 2hxl n MET 61 N -3.76 2.61 -3.92 1.90 0.00 -0.97 -4.96 117.12 108.02 2hxl n MET 61 Ca -0.03 -2.46 -0.36 0.00 0.00 0.00 0.00 57.70 54.85 2hxl n MET 61 Cb 0.13 -1.54 -0.07 0.00 0.00 0.00 0.00 33.22 31.73 2hxl n MET 61 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 2hxl s LEU 62 N -1.24 4.19 -0.34 3.17 1.43 -0.88 -5.06 118.68 119.95 2hxl s LEU 62 Ca 0.44 0.34 0.07 0.00 -1.03 0.00 0.00 54.13 53.94 2hxl s LEU 62 Cb 0.24 -2.03 0.19 0.00 0.03 0.00 0.00 46.19 44.62 2hxl s LEU 62 CO 0.33 0.33 0.59 0.21 0.23 0.00 0.00 176.35 178.04 2hxl s ASN 63 N -0.56 -1.41 -0.14 2.29 2.47 -1.26 -4.72 114.94 111.61 2hxl s ASN 63 Ca 0.12 -0.30 -0.25 0.00 0.42 0.00 0.00 52.86 52.86 2hxl s ASN 63 Cb -0.12 1.92 0.06 0.00 -1.45 0.00 0.00 41.25 41.66 2hxl s ASN 63 CO 0.02 -0.25 0.61 -2.28 -3.72 0.00 0.00 177.10 171.48 2hxl s HIS 64 N 2.37 -0.62 0.59 0.43 2.46 -1.26 -5.05 115.29 114.21 2hxl s HIS 64 Ca 0.13 1.30 0.43 0.00 0.47 0.00 0.00 55.06 57.39 2hxl s HIS 64 Cb -0.08 0.29 2.33 0.00 -0.13 0.00 0.00 32.58 34.99 2hxl s HIS 64 CO -0.18 -0.45 2.31 1.05 -2.47 0.00 0.00 174.74 175.01 2hxl h GLU 65 N 4.16 0.00 -0.39 2.88 9.09 -1.99 -1.98 114.58 126.34 2hxl h GLU 65 Ca -0.28 0.00 -0.15 0.00 0.05 0.00 0.00 59.36 58.98 2hxl h GLU 65 Cb 1.16 0.00 -0.09 0.00 -1.65 0.00 0.00 28.75 28.17 2hxl h GLU 65 CO 0.25 0.00 0.03 0.09 0.05 0.00 0.00 179.01 179.43 2hxl n ASN 66 N -3.01 3.22 -3.86 3.06 4.13 -1.26 -4.82 115.26 112.73 2hxl n ASN 66 Ca -0.03 -3.46 -0.20 0.00 1.68 0.00 0.00 54.58 52.58 2hxl n ASN 66 Cb 0.07 -0.63 -0.16 0.00 -1.54 0.00 0.00 39.78 37.52 2hxl n ASN 66 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2hxl s VAL 67 N -3.09 0.44 -0.12 2.41 1.01 -0.75 -0.85 120.40 119.46 2hxl s VAL 67 Ca 0.45 -0.04 -0.36 0.00 0.00 0.00 0.00 61.98 62.03 2hxl s VAL 67 Cb 0.39 -0.50 -0.13 0.00 0.00 0.00 0.00 36.38 36.14 2hxl s VAL 67 CO 0.05 0.21 1.80 0.52 0.00 0.00 0.00 175.10 177.68 2hxl n VAL 68 N 4.24 0.44 -2.02 2.92 0.31 -0.52 -4.56 118.33 119.13 2hxl n VAL 68 Ca -0.22 -0.08 -0.38 0.00 -0.01 0.00 0.00 64.34 63.65 2hxl n VAL 68 Cb 0.51 -1.63 0.01 0.00 -0.91 0.00 0.00 33.84 31.82 2hxl n VAL 68 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 2hxl s LYS 69 N 3.56 3.50 -0.19 5.55 2.20 -1.26 -4.82 119.74 128.28 2hxl s LYS 69 Ca 0.93 2.02 -0.03 0.00 -0.36 0.00 0.00 55.97 58.53 2hxl s LYS 69 Cb -0.81 -2.37 -0.02 0.00 -1.51 0.00 0.00 37.83 33.12 2hxl s LYS 69 CO 0.55 -0.84 -0.05 0.12 -0.36 0.00 0.00 175.35 174.77 2hxl s PHE 70 N -1.41 2.96 -0.11 4.03 5.36 -1.26 -1.17 117.98 126.38 2hxl s PHE 70 Ca 0.67 -0.65 0.19 0.00 -0.96 0.00 0.00 56.93 56.18 2hxl s PHE 70 Cb -0.35 -2.03 -0.29 0.00 -0.34 0.00 0.00 43.02 40.02 2hxl s PHE 70 CO 0.42 -0.32 0.27 0.66 -1.46 0.00 0.00 175.22 174.79 2hxl n TYR 71 N 4.20 0.00 -1.72 10.12 4.01 0.04 -5.01 117.16 128.80 2hxl n TYR 71 Ca -0.18 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.56 2hxl n TYR 71 Cb 0.52 -0.72 0.00 0.00 -0.31 0.00 0.00 39.34 38.83 2hxl n TYR 71 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2hxl n GLY 72 N 1.55 -0.92 3.37 2.72 0.00 -1.21 -4.99 105.19 105.70 2hxl n GLY 72 Ca -0.18 -1.49 -0.10 0.00 0.00 0.00 0.00 46.02 44.25 2hxl n GLY 72 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2hxl s HIS 73 N -2.31 -0.15 -0.03 1.61 -3.43 -1.26 -1.32 115.29 108.40 2hxl s HIS 73 Ca 0.00 -0.17 0.02 0.00 -0.80 0.00 0.00 55.06 54.11 2hxl s HIS 73 Cb 0.00 0.28 0.01 0.00 -1.43 0.00 0.00 32.58 31.43 2hxl s HIS 73 CO 0.00 -0.75 -0.07 1.03 -2.00 0.00 0.00 174.74 172.95 2hxl s ARG 74 N -3.83 0.79 0.00 -0.38 0.52 -0.88 -4.99 118.95 110.19 2hxl s ARG 74 Ca 0.05 -0.21 0.00 0.00 -0.52 0.00 0.00 55.73 55.05 2hxl s ARG 74 Cb 0.01 -0.77 0.00 0.00 0.52 0.00 0.00 34.95 34.72 2hxl s ARG 74 CO -0.09 0.05 0.47 0.54 0.02 0.00 0.00 175.30 176.29 2hxl n ARG 75 N 3.46 0.00 -3.39 3.54 5.12 -1.26 -2.64 116.66 121.49 2hxl n ARG 75 Ca -0.20 0.44 -0.33 0.00 -1.93 0.00 0.00 57.85 55.83 2hxl n ARG 75 Cb 0.54 -1.19 0.03 0.00 -1.16 0.00 0.00 32.46 30.69 2hxl n ARG 75 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 2hxl n GLU 76 N -1.81 -2.02 0.00 5.56 1.02 -1.26 -3.97 120.64 118.16 2hxl n GLU 76 Ca 0.00 1.55 0.00 0.00 -0.02 0.00 0.00 57.16 58.69 2hxl n GLU 76 Cb 0.00 -2.76 0.00 0.00 -0.02 0.00 0.00 31.44 28.66 2hxl n GLU 76 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2hxl n GLY 77 N -0.23 2.56 1.89 0.62 0.00 -1.26 -3.27 105.19 105.50 2hxl n GLY 77 Ca -0.05 -0.29 -0.22 0.00 0.00 0.00 0.00 46.02 45.47 2hxl n GLY 77 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2hxl n ASN 78 N 6.61 4.98 -3.64 1.61 4.05 -1.26 -4.93 115.26 122.68 2hxl n ASN 78 Ca 0.00 -3.77 -0.21 0.00 0.45 0.00 0.00 54.58 51.05 2hxl n ASN 78 Cb 0.00 -0.67 -0.17 0.00 1.23 0.00 0.00 39.78 40.17 2hxl n ASN 78 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 2hxl s ILE 79 N -4.17 -0.14 0.09 -1.44 1.01 -1.20 -3.16 121.20 112.18 2hxl s ILE 79 Ca 0.54 0.19 -0.24 0.00 0.00 0.00 0.00 60.65 61.14 2hxl s ILE 79 Cb 0.45 -0.35 -0.07 0.00 0.01 0.00 0.00 42.46 42.50 2hxl s ILE 79 CO 0.02 -0.00 0.73 -1.10 0.00 0.00 0.00 174.94 174.58 2hxl s GLN 80 N 2.19 4.46 -0.26 2.79 -1.52 -1.01 -4.46 119.66 121.86 2hxl s GLN 80 Ca 0.04 1.02 0.02 0.00 -1.95 0.00 0.00 55.36 54.50 2hxl s GLN 80 Cb -0.14 -3.30 0.06 0.00 -0.22 0.00 0.00 33.01 29.41 2hxl s GLN 80 CO -0.06 0.45 -0.08 0.71 -0.25 0.00 0.00 175.29 176.06 2hxl s TYR 81 N -0.63 3.06 -0.32 0.91 2.02 -1.08 -2.27 117.35 119.04 2hxl s TYR 81 Ca 0.35 -2.22 -0.12 0.00 -0.37 0.00 0.00 57.07 54.72 2hxl s TYR 81 Cb -0.21 -1.90 -0.02 0.00 -0.40 0.00 0.00 41.96 39.43 2hxl s TYR 81 CO 0.23 -0.86 0.21 -0.51 -1.57 0.00 0.00 175.55 173.05 2hxl s LEU 82 N 1.17 4.31 -0.39 -1.29 1.02 -0.42 -2.06 118.68 121.02 2hxl s LEU 82 Ca -0.07 -0.34 -0.22 0.00 0.02 0.00 0.00 54.13 53.52 2hxl s LEU 82 Cb -0.20 -2.11 0.01 0.00 0.02 0.00 0.00 46.19 43.92 2hxl s LEU 82 CO -0.06 -0.18 0.71 -0.36 0.02 0.00 0.00 176.35 176.48 2hxl s PHE 83 N 1.71 3.09 0.32 0.29 0.40 -0.44 -1.07 117.98 122.29 2hxl s PHE 83 Ca 0.06 0.30 0.06 0.00 -0.60 0.00 0.00 56.93 56.75 2hxl s PHE 83 Cb -0.17 -3.35 -0.06 0.00 0.51 0.00 0.00 43.02 39.95 2hxl s PHE 83 CO 0.10 -0.77 -0.03 -0.51 0.70 0.00 0.00 175.22 174.71 2hxl s LEU 84 N 2.95 2.52 0.23 -0.37 1.43 0.29 -0.78 118.68 124.95 2hxl s LEU 84 Ca 0.27 -1.27 -0.31 0.00 -1.03 0.00 0.00 54.13 51.80 2hxl s LEU 84 Cb -0.14 -0.68 -0.11 0.00 0.03 0.00 0.00 46.19 45.29 2hxl s LEU 84 CO 0.18 -0.40 1.59 -0.70 0.23 0.00 0.00 176.35 177.24 2hxl s GLU 85 N -3.74 4.17 -0.18 1.70 2.12 -0.32 -0.95 118.70 121.51 2hxl s GLU 85 Ca 0.33 2.48 -0.21 0.00 0.36 0.00 0.00 54.97 57.92 2hxl s GLU 85 Cb 0.06 -3.08 -0.03 0.00 0.26 0.00 0.00 34.13 31.34 2hxl s GLU 85 CO 0.15 -0.61 0.62 -0.47 -0.54 0.00 0.00 175.26 174.40 2hxl s TYR 86 N 0.54 3.41 -0.51 5.30 5.04 -1.26 -4.41 117.35 125.46 2hxl s TYR 86 Ca 0.67 0.95 -0.08 0.00 -2.44 0.00 0.00 57.07 56.17 2hxl s TYR 86 Cb -0.46 -2.77 0.13 0.00 0.35 0.00 0.00 41.96 39.21 2hxl s TYR 86 CO 0.39 -0.11 0.36 0.00 -1.34 0.00 0.00 175.55 174.86 2hxl h SER 88 N 8.16 0.37 0.65 0.00 0.87 -1.82 -2.51 113.55 119.26 2hxl h SER 88 Ca -0.15 0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.48 2hxl h SER 88 Cb 1.05 0.01 0.00 0.00 -0.44 0.00 0.00 62.40 63.03 2hxl h SER 88 CO 0.81 0.06 0.00 0.61 -0.53 0.00 0.00 176.83 177.78 2hxl n GLY 89 N -1.52 -1.16 6.74 5.77 0.00 0.82 -4.93 105.19 110.91 2hxl n GLY 89 Ca 0.26 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.20 2hxl n GLY 89 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hxl n GLY 90 N 0.56 -1.55 3.83 -0.02 0.00 -0.95 -4.70 105.19 102.37 2hxl n GLY 90 Ca 0.06 -1.34 -0.35 0.00 0.00 0.00 0.00 46.02 44.39 2hxl n GLY 90 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2hxl s GLU 91 N 0.00 4.17 0.41 1.61 2.02 -1.26 -0.64 118.70 125.01 2hxl s GLU 91 Ca 0.00 0.82 0.08 0.00 0.02 0.00 0.00 54.97 55.89 2hxl s GLU 91 Cb 0.00 -2.67 0.86 0.00 0.10 0.00 0.00 34.13 32.42 2hxl s GLU 91 CO 0.00 0.28 2.03 1.25 0.02 0.00 0.00 175.26 178.85 2hxl h LEU 92 N 2.89 0.41 -0.87 1.80 5.85 -0.46 -2.23 115.31 122.70 2hxl h LEU 92 Ca -0.48 -0.02 0.22 0.00 0.84 0.00 0.00 57.88 58.44 2hxl h LEU 92 Cb 1.19 -0.10 -0.13 0.00 0.37 0.00 0.00 40.66 41.98 2hxl h LEU 92 CO 0.65 0.34 0.31 0.15 -0.34 0.00 0.00 178.44 179.55 2hxl h PHE 93 N 0.47 0.50 0.00 1.25 3.04 -1.70 0.14 116.94 120.64 2hxl h PHE 93 Ca 0.12 0.04 0.00 0.00 3.98 0.00 0.00 57.97 62.12 2hxl h PHE 93 Cb 0.03 -0.08 0.00 0.00 2.56 0.00 0.00 35.95 38.45 2hxl h PHE 93 CO 0.00 -0.11 0.00 -0.25 -2.02 0.00 0.00 178.31 175.93 2hxl n ASP 94 N -5.12 0.02 -0.49 0.41 10.43 -0.84 -2.50 116.55 118.45 2hxl n ASP 94 Ca 0.21 0.50 0.13 0.00 2.57 0.00 0.00 54.79 58.20 2hxl n ASP 94 Cb 0.64 -0.51 0.30 0.00 1.84 0.00 0.00 41.12 43.40 2hxl n ASP 94 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 2hxl n ARG 95 N -1.52 1.43 -3.34 -1.24 5.12 0.49 -4.81 116.66 112.80 2hxl n ARG 95 Ca 0.05 -0.99 -0.43 0.00 -1.93 0.00 0.00 57.85 54.54 2hxl n ARG 95 Cb 0.23 -1.48 -0.09 0.00 -1.16 0.00 0.00 32.46 29.96 2hxl n ARG 95 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 2hxl s ILE 96 N -2.25 5.12 0.01 0.55 1.01 -1.04 -4.72 121.20 119.88 2hxl s ILE 96 Ca 0.28 -0.50 -0.30 0.00 0.00 0.00 0.00 60.65 60.13 2hxl s ILE 96 Cb 0.20 -4.05 -0.06 0.00 0.01 0.00 0.00 42.46 38.56 2hxl s ILE 96 CO 0.43 -0.45 1.41 -1.61 0.00 0.00 0.00 174.94 174.72 2hxl s GLU 97 N 2.03 4.28 0.05 2.79 8.01 -0.31 -4.85 118.70 130.71 2hxl s GLU 97 Ca 0.10 1.99 -0.36 0.00 0.01 0.00 0.00 54.97 56.71 2hxl s GLU 97 Cb -0.18 -3.55 -0.15 0.00 -4.31 0.00 0.00 34.13 25.94 2hxl s GLU 97 CO 0.12 -0.57 1.53 -2.30 0.01 0.00 0.00 175.26 174.05 2hxl n PRO 98 N 5.26 1.62 -0.88 0.39 -0.02 -1.26 -0.99 135.00 139.12 2hxl n PRO 98 Ca 0.13 0.59 0.00 0.00 -2.02 0.00 0.00 63.50 62.20 2hxl n PRO 98 Cb 0.43 -2.30 0.00 0.00 -0.02 0.00 0.00 33.50 31.61 2hxl n PRO 98 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2hxl n ASP 99 N 3.60 -3.44 0.01 2.55 2.03 0.86 -4.71 116.55 117.46 2hxl n ASP 99 Ca 0.19 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.50 2hxl n ASP 99 Cb 0.23 -2.37 0.00 0.00 -0.72 0.00 0.00 41.12 38.26 2hxl n ASP 99 CO 0.00 0.00 0.00 -0.38 -1.92 0.00 0.00 177.20 174.90 2hxl n ILE 100 N -2.19 0.16 0.00 5.18 2.08 -0.30 -4.71 119.36 119.58 2hxl n ILE 100 Ca 0.00 0.05 0.00 0.00 0.56 0.00 0.00 62.75 63.36 2hxl n ILE 100 Cb 0.24 -1.38 0.00 0.00 -0.75 0.00 0.00 39.64 37.75 2hxl n ILE 100 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2hxl n GLY 101 N 2.86 0.82 3.78 7.39 0.00 -0.16 -3.97 105.19 115.91 2hxl n GLY 101 Ca 0.00 -1.35 -0.08 0.00 0.00 0.00 0.00 46.02 44.59 2hxl n GLY 101 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2hxl s MET 102 N 0.00 1.69 0.24 1.61 0.23 -0.08 -1.16 119.30 121.84 2hxl s MET 102 Ca 0.00 -0.90 -0.31 0.00 -1.03 0.00 0.00 55.69 53.44 2hxl s MET 102 Cb 0.00 0.60 -0.13 0.00 -1.53 0.00 0.00 34.83 33.78 2hxl s MET 102 CO 0.00 -0.77 1.55 -2.30 -2.03 0.00 0.00 175.02 171.47 2hxl n PRO 103 N -0.44 2.41 -0.33 3.16 -0.02 -1.26 -4.79 135.00 133.73 2hxl n PRO 103 Ca -0.06 0.86 0.15 0.00 -2.02 0.00 0.00 63.50 62.43 2hxl n PRO 103 Cb 0.60 -2.61 0.35 0.00 -0.02 0.00 0.00 33.50 31.82 2hxl n PRO 103 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2hxl h GLU 104 N 5.03 0.52 -0.55 -0.52 4.81 -1.97 -0.46 114.58 121.45 2hxl h GLU 104 Ca -0.45 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 58.71 2hxl h GLU 104 Cb 1.24 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 30.48 2hxl h GLU 104 CO 0.82 0.35 0.19 -1.35 -0.73 0.00 0.00 179.01 178.28 2hxl h PRO 105 N 0.54 0.81 -0.44 0.92 0.11 -1.90 -0.06 132.00 131.98 2hxl h PRO 105 Ca 0.60 -0.14 -0.14 0.00 0.11 0.00 0.00 66.00 66.43 2hxl h PRO 105 Cb 1.11 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.07 2hxl h PRO 105 CO -0.48 0.69 -0.28 -0.44 -0.21 0.00 0.00 178.00 177.28 2hxl h ASP 106 N 0.79 0.99 -0.34 -2.05 3.32 -1.47 -1.94 116.42 115.72 2hxl h ASP 106 Ca 0.18 -0.40 -0.09 0.00 0.02 0.00 0.00 57.03 56.74 2hxl h ASP 106 Cb 0.20 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 2hxl h ASP 106 CO -0.01 1.20 -0.08 0.00 -1.72 0.00 0.00 179.24 178.62 2hxl h ALA 107 N 0.86 1.04 -0.35 3.45 0.00 -0.94 -0.74 119.26 122.58 2hxl h ALA 107 Ca 0.09 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.66 2hxl h ALA 107 Cb 0.86 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 2hxl h ALA 107 CO 0.08 0.59 0.05 0.37 0.00 0.00 0.00 179.25 180.33 2hxl h GLN 108 N 0.70 0.59 -0.40 0.00 4.15 -0.86 -0.26 115.11 119.03 2hxl h GLN 108 Ca 0.12 -0.16 -0.01 0.00 0.77 0.00 0.00 58.65 59.37 2hxl h GLN 108 Cb 0.55 -0.07 -0.02 0.00 0.21 0.00 0.00 27.48 28.15 2hxl h GLN 108 CO 0.03 0.67 0.22 -0.09 -1.93 0.00 0.00 178.83 177.73 2hxl h ARG 109 N 0.42 0.57 -0.60 1.69 2.43 -1.15 0.11 114.38 117.86 2hxl h ARG 109 Ca 0.11 -0.07 -0.05 0.00 -0.81 0.00 0.00 59.98 59.16 2hxl h ARG 109 Cb 0.37 -0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 29.79 2hxl h ARG 109 CO 0.01 0.47 0.17 0.74 -1.51 0.00 0.00 179.97 179.85 2hxl h PHE 110 N 0.52 0.94 -0.52 2.20 0.04 -1.03 -2.30 116.94 116.79 2hxl h PHE 110 Ca 0.14 -0.08 -0.10 0.00 2.80 0.00 0.00 57.97 60.73 2hxl h PHE 110 Cb 0.07 -0.28 -0.02 0.00 2.20 0.00 0.00 35.95 37.93 2hxl h PHE 110 CO -0.02 0.76 -0.06 0.35 -0.60 0.00 0.00 178.31 178.74 2hxl h PHE 111 N 0.88 1.05 -0.41 -0.55 3.57 -0.62 -0.41 116.94 120.44 2hxl h PHE 111 Ca 0.20 -0.20 0.04 0.00 3.53 0.00 0.00 57.97 61.53 2hxl h PHE 111 Cb 0.27 -0.27 -0.04 0.00 2.79 0.00 0.00 35.95 38.71 2hxl h PHE 111 CO 0.02 0.98 0.18 0.45 -2.23 0.00 0.00 178.31 177.71 2hxl h HIS 112 N 0.81 0.32 -0.63 0.41 3.86 -0.72 0.28 115.15 119.48 2hxl h HIS 112 Ca 0.14 0.02 -0.08 0.00 -1.16 0.00 0.00 60.37 59.29 2hxl h HIS 112 Cb 0.60 -0.08 -0.03 0.00 1.06 0.00 0.00 27.41 28.96 2hxl h HIS 112 CO 0.04 0.15 0.09 1.96 0.86 0.00 0.00 177.93 181.03 2hxl h GLN 113 N 0.37 1.05 -0.37 2.45 4.20 -1.23 -0.88 115.11 120.69 2hxl h GLN 113 Ca 0.18 -0.28 -0.01 0.00 0.06 0.00 0.00 58.65 58.60 2hxl h GLN 113 Cb 0.13 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 27.77 2hxl h GLN 113 CO -0.16 0.97 0.18 1.25 -0.67 0.00 0.00 178.83 180.40 2hxl h LEU 114 N 0.98 0.48 -1.05 1.46 5.85 -0.65 -1.65 115.31 120.73 2hxl h LEU 114 Ca 0.19 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.79 2hxl h LEU 114 Cb 0.44 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.30 2hxl h LEU 114 CO 0.01 0.47 0.58 0.24 -0.34 0.00 0.00 178.44 179.41 2hxl h MET 115 N 0.46 1.22 -0.12 1.25 2.86 -0.64 -0.78 114.93 119.19 2hxl h MET 115 Ca 0.13 -0.09 0.01 0.00 -2.06 0.00 0.00 59.70 57.68 2hxl h MET 115 Cb 0.12 -0.27 -0.01 0.00 0.06 0.00 0.00 31.60 31.50 2hxl h MET 115 CO -0.02 0.83 0.05 0.00 1.06 0.00 0.00 176.91 178.84 2hxl h ALA 116 N 1.39 0.13 -0.37 6.32 0.00 -0.68 0.87 119.26 126.91 2hxl h ALA 116 Ca 0.33 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.24 2hxl h ALA 116 Cb -0.10 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2hxl h ALA 116 CO -0.07 -0.40 0.19 0.78 0.00 0.00 0.00 179.25 179.75 2hxl h GLY 117 N 0.11 0.57 1.05 0.00 0.00 -0.90 -1.78 103.07 102.12 2hxl h GLY 117 Ca 0.05 -0.27 -0.07 0.00 0.00 0.00 0.00 47.33 47.04 2hxl h GLY 117 CO -0.04 0.26 0.15 -2.08 0.00 0.00 0.00 176.54 174.83 2hxl h VAL 118 N 0.47 1.26 -0.84 4.60 2.07 -0.98 -1.01 116.25 121.81 2hxl h VAL 118 Ca 0.13 -0.97 0.01 0.00 0.82 0.00 0.00 66.70 66.68 2hxl h VAL 118 Cb 0.09 0.59 -0.04 0.00 -1.52 0.00 0.00 31.29 30.41 2hxl h VAL 118 CO -0.02 0.37 0.55 0.58 0.02 0.00 0.00 177.57 179.08 2hxl h VAL 119 N 1.02 1.22 0.37 2.57 2.07 -0.67 0.35 116.25 123.17 2hxl h VAL 119 Ca 0.21 -0.40 -0.02 0.00 0.82 0.00 0.00 66.70 67.31 2hxl h VAL 119 Cb 0.38 -0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.14 2hxl h VAL 119 CO 0.00 0.21 -0.18 0.22 0.02 0.00 0.00 177.57 177.85 2hxl h TYR 120 N 1.14 -0.46 -0.04 1.57 3.20 -0.89 -0.32 116.97 121.17 2hxl h TYR 120 Ca 0.31 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.20 2hxl h TYR 120 Cb -0.13 0.15 -0.03 0.00 1.54 0.00 0.00 36.73 38.26 2hxl h TYR 120 CO -0.01 -0.27 -0.14 -0.07 -1.64 0.00 0.00 178.16 176.03 2hxl h LEU 121 N -0.51 -0.42 -1.61 2.82 3.38 -0.90 -1.85 115.31 116.21 2hxl h LEU 121 Ca -0.05 0.07 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 2hxl h LEU 121 Cb 0.39 0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.31 2hxl h LEU 121 CO 0.08 -0.19 0.21 0.45 0.09 0.00 0.00 178.44 179.08 2hxl h HIS 122 N -0.22 0.45 0.00 1.13 3.86 -0.89 -0.62 115.15 118.87 2hxl h HIS 122 Ca 0.06 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.22 2hxl h HIS 122 Cb 0.30 -0.15 -0.01 0.00 1.06 0.00 0.00 27.41 28.61 2hxl h HIS 122 CO -0.22 0.30 -0.26 0.78 0.86 0.00 0.00 177.93 179.39 2hxl h GLY 123 N 0.52 0.00 -2.48 2.45 0.00 -0.24 -1.96 103.07 101.36 2hxl h GLY 123 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.46 2hxl h GLY 123 CO -0.02 0.00 0.00 4.51 0.00 0.00 0.00 176.54 181.03 2hxl n ILE 124 N -4.03 1.05 -1.02 2.60 3.06 -0.71 -4.94 119.36 115.37 2hxl n ILE 124 Ca -0.02 -0.91 -0.01 0.00 -2.50 0.00 0.00 62.75 59.32 2hxl n ILE 124 Cb 0.33 0.35 -0.00 0.00 0.54 0.00 0.00 39.64 40.85 2hxl n ILE 124 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 2hxl n GLY 125 N 1.41 0.45 3.49 4.50 0.00 -0.73 -4.93 105.19 109.38 2hxl n GLY 125 Ca 0.22 -0.83 -0.33 0.00 0.00 0.00 0.00 46.02 45.08 2hxl n GLY 125 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2hxl s ILE 126 N -2.02 3.11 -0.08 -0.61 -5.25 -0.32 -0.22 121.20 115.82 2hxl s ILE 126 Ca 0.00 -0.71 0.03 0.00 -0.99 0.00 0.00 60.65 58.98 2hxl s ILE 126 Cb 0.00 -2.23 -0.02 0.00 2.95 0.00 0.00 42.46 43.17 2hxl s ILE 126 CO 0.00 0.59 -0.16 0.28 -1.79 0.00 0.00 174.94 173.85 2hxl s THR 127 N -0.74 2.81 0.03 8.37 -1.32 -0.22 -3.31 115.64 121.26 2hxl s THR 127 Ca 0.12 -0.79 -0.19 0.00 -1.21 0.00 0.00 61.69 59.62 2hxl s THR 127 Cb -0.11 -2.11 -0.18 0.00 -1.51 0.00 0.00 72.50 68.59 2hxl s THR 127 CO 0.01 0.56 1.23 -0.74 -2.21 0.00 0.00 174.62 173.47 2hxl h HIS 128 N 5.96 0.58 0.00 9.09 2.76 -1.91 -1.70 115.15 129.94 2hxl h HIS 128 Ca -0.36 -0.25 0.00 0.00 -2.20 0.00 0.00 60.37 57.56 2hxl h HIS 128 Cb 1.18 -0.09 0.00 0.00 1.55 0.00 0.00 27.41 30.04 2hxl h HIS 128 CO 0.48 1.00 0.00 0.54 -1.30 0.00 0.00 177.93 178.65 2hxl n ARG 129 N -4.34 -0.15 -2.71 5.26 1.74 -1.26 -2.93 116.66 112.27 2hxl n ARG 129 Ca -0.08 0.04 -0.05 0.00 -0.77 0.00 0.00 57.85 56.99 2hxl n ARG 129 Cb 0.54 -3.57 0.08 0.00 -1.02 0.00 0.00 32.46 28.49 2hxl n ARG 129 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2hxl n ASP 130 N -0.08 -0.02 -4.68 0.55 4.64 -1.26 -3.44 116.55 112.26 2hxl n ASP 130 Ca 0.00 -2.38 -0.42 0.00 -1.38 0.00 0.00 54.79 50.61 2hxl n ASP 130 Cb 0.04 0.15 -0.03 0.00 -1.04 0.00 0.00 41.12 40.24 2hxl n ASP 130 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 2hxl s ILE 131 N -1.72 3.82 0.07 5.18 1.01 -1.26 -4.84 121.20 123.46 2hxl s ILE 131 Ca 0.22 1.17 -0.26 0.00 0.00 0.00 0.00 60.65 61.78 2hxl s ILE 131 Cb 0.41 -3.75 0.09 0.00 0.01 0.00 0.00 42.46 39.21 2hxl s ILE 131 CO -0.05 -0.02 0.79 -1.59 0.00 0.00 0.00 174.94 174.07 2hxl s LYS 132 N 2.58 1.03 0.48 2.79 -2.85 -1.26 -4.80 119.74 117.71 2hxl s LYS 132 Ca 0.63 -0.40 0.27 0.00 -1.00 0.00 0.00 55.97 55.47 2hxl s LYS 132 Cb -0.30 0.46 1.33 0.00 -2.06 0.00 0.00 37.83 37.27 2hxl s LYS 132 CO 0.25 -0.45 1.83 -1.35 0.10 0.00 0.00 175.35 175.73 2hxl h PRO 133 N 2.00 0.17 0.00 1.78 0.11 -1.93 0.17 132.00 134.29 2hxl h PRO 133 Ca -0.26 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.80 2hxl h PRO 133 Cb 1.27 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 2hxl h PRO 133 CO 0.33 0.11 -0.18 0.93 -0.21 0.00 0.00 178.00 178.98 2hxl h GLU 134 N 0.17 0.00 -0.53 1.05 3.07 -1.95 -2.53 114.58 113.85 2hxl h GLU 134 Ca 0.51 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.37 2hxl h GLU 134 Cb 1.71 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.62 2hxl h GLU 134 CO -0.11 0.18 0.00 0.09 -1.40 0.00 0.00 179.01 177.76 2hxl n ASN 135 N -3.49 3.52 -4.24 1.42 3.02 0.04 -4.83 115.26 110.70 2hxl n ASN 135 Ca -0.01 -1.97 -0.36 0.00 -0.03 0.00 0.00 54.58 52.20 2hxl n ASN 135 Cb 0.34 -0.35 -0.13 0.00 -0.61 0.00 0.00 39.78 39.03 2hxl n ASN 135 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2hxl s LEU 136 N -1.10 4.05 0.30 3.41 1.43 -1.11 -0.66 118.68 124.99 2hxl s LEU 136 Ca 0.39 -1.14 0.06 0.00 -1.03 0.00 0.00 54.13 52.41 2hxl s LEU 136 Cb 0.21 -1.80 -0.02 0.00 0.03 0.00 0.00 46.19 44.61 2hxl s LEU 136 CO 0.28 -0.28 0.40 -0.76 0.23 0.00 0.00 176.35 176.22 2hxl s LEU 137 N 1.35 4.06 -0.04 1.79 1.43 -0.17 -0.26 118.68 126.84 2hxl s LEU 137 Ca -0.03 -0.12 0.05 0.00 -1.03 0.00 0.00 54.13 53.00 2hxl s LEU 137 Cb -0.19 -2.73 -0.01 0.00 0.03 0.00 0.00 46.19 43.29 2hxl s LEU 137 CO 0.01 -0.28 -0.21 -0.76 0.23 0.00 0.00 176.35 175.35 2hxl s LEU 138 N -4.07 2.00 0.00 1.79 1.43 0.19 -0.57 118.68 119.45 2hxl s LEU 138 Ca 0.40 -0.40 0.00 0.00 -1.03 0.00 0.00 54.13 53.10 2hxl s LEU 138 Cb -0.09 -1.12 0.00 0.00 0.03 0.00 0.00 46.19 45.01 2hxl s LEU 138 CO 0.30 0.21 0.00 -0.90 0.23 0.00 0.00 176.35 176.19 2hxl n ASP 139 N 2.91 0.00 -0.10 2.29 3.85 -0.79 -0.13 116.55 124.57 2hxl n ASP 139 Ca -0.17 -0.97 0.15 0.00 -0.71 0.00 0.00 54.79 53.10 2hxl n ASP 139 Cb 0.53 0.00 0.54 0.00 -1.35 0.00 0.00 41.12 40.84 2hxl n ASP 139 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 177.20 177.24 2hxl h GLU 140 N 0.00 0.31 -0.66 0.11 9.09 -1.91 -1.34 114.58 120.18 2hxl h GLU 140 Ca 0.00 -0.02 -0.14 0.00 0.05 0.00 0.00 59.36 59.25 2hxl h GLU 140 Cb 0.00 -0.07 -0.08 0.00 -1.65 0.00 0.00 28.75 26.94 2hxl h GLU 140 CO 0.00 0.21 0.17 0.54 0.05 0.00 0.00 179.01 179.98 2hxl n ARG 141 N -4.45 3.96 -2.22 1.06 1.74 -1.26 -4.93 116.66 110.56 2hxl n ARG 141 Ca 0.12 -3.11 -0.17 0.00 -0.77 0.00 0.00 57.85 53.92 2hxl n ARG 141 Cb 0.49 -2.20 -0.02 0.00 -1.02 0.00 0.00 32.46 29.72 2hxl n ARG 141 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2hxl n ASP 142 N 0.01 -5.04 -4.71 0.55 8.00 -0.51 -4.99 116.55 109.86 2hxl n ASP 142 Ca 0.36 0.04 -0.41 0.00 0.71 0.00 0.00 54.79 55.49 2hxl n ASP 142 Cb 1.30 -4.12 -0.04 0.00 -0.02 0.00 0.00 41.12 38.24 2hxl n ASP 142 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 2hxl s ASN 143 N -2.30 7.11 0.28 -2.24 0.02 -1.26 -4.77 114.94 111.79 2hxl s ASN 143 Ca 0.00 1.34 -0.29 0.00 -1.02 0.00 0.00 52.86 52.90 2hxl s ASN 143 Cb 0.00 -2.47 -0.09 0.00 0.02 0.00 0.00 41.25 38.71 2hxl s ASN 143 CO 0.00 -0.18 1.01 -0.22 0.02 0.00 0.00 177.10 177.73 2hxl s LEU 144 N 0.96 4.52 -0.02 0.60 0.20 -1.26 -1.89 118.68 121.79 2hxl s LEU 144 Ca 0.42 2.07 -0.00 0.00 0.69 0.00 0.00 54.13 57.31 2hxl s LEU 144 Cb -0.19 -3.73 0.03 0.00 -0.43 0.00 0.00 46.19 41.88 2hxl s LEU 144 CO 0.21 -0.05 0.03 -0.54 -0.29 0.00 0.00 176.35 175.71 2hxl s LYS 145 N -1.53 -0.01 0.04 1.98 1.02 0.27 -4.43 119.74 117.08 2hxl s LYS 145 Ca 0.45 0.19 -0.30 0.00 0.02 0.00 0.00 55.97 56.33 2hxl s LYS 145 Cb -0.27 -0.28 -0.05 0.00 -0.52 0.00 0.00 37.83 36.71 2hxl s LYS 145 CO 0.34 -0.17 1.13 0.42 -0.92 0.00 0.00 175.35 176.14 2hxl s ILE 146 N 1.12 4.31 0.25 2.17 1.01 -0.02 -1.00 121.20 129.04 2hxl s ILE 146 Ca -0.08 1.66 0.03 0.00 0.00 0.00 0.00 60.65 62.26 2hxl s ILE 146 Cb -0.13 -4.06 -0.05 0.00 0.01 0.00 0.00 42.46 38.22 2hxl s ILE 146 CO -0.03 0.13 0.02 -0.94 0.00 0.00 0.00 174.94 174.12 2hxl s SER 147 N 1.04 1.89 -0.14 3.58 1.04 0.16 -1.44 113.70 119.84 2hxl s SER 147 Ca 0.56 -1.26 -0.02 0.00 0.48 0.00 0.00 55.95 55.72 2hxl s SER 147 Cb -0.27 0.00 0.01 0.00 0.10 0.00 0.00 66.02 65.86 2hxl s SER 147 CO 0.29 -0.54 0.03 -0.67 0.98 0.00 0.00 173.24 173.33 2hxl n ASP 148 N -0.48 -3.96 -1.93 7.02 4.64 -1.26 -4.82 116.55 115.77 2hxl n ASP 148 Ca -0.04 0.69 -0.18 0.00 -1.38 0.00 0.00 54.79 53.87 2hxl n ASP 148 Cb 0.65 -3.11 0.18 0.00 -1.04 0.00 0.00 41.12 37.80 2hxl n ASP 148 CO 0.00 0.00 0.00 0.49 -0.82 0.00 0.00 177.20 176.87 2hxl n PHE 149 N 0.47 2.50 0.21 -0.67 3.01 -1.26 -4.54 117.46 117.19 2hxl n PHE 149 Ca -0.05 -1.79 0.08 0.00 1.01 0.00 0.00 57.45 56.69 2hxl n PHE 149 Cb 0.08 -0.82 0.43 0.00 -0.01 0.00 0.00 39.48 39.16 2hxl n PHE 149 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 2hxl h GLY 150 N 1.01 0.00 -1.17 1.37 0.00 -1.91 -3.04 103.07 99.32 2hxl h GLY 150 Ca 0.52 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.85 2hxl h GLY 150 CO 0.91 0.00 -0.01 1.04 0.00 0.00 0.00 176.54 178.47 2hxl n LEU 151 N -3.49 2.21 -4.78 3.11 4.77 -1.26 -4.82 117.00 112.74 2hxl n LEU 151 Ca -0.00 -0.99 -0.31 0.00 -0.03 0.00 0.00 56.01 54.67 2hxl n LEU 151 Cb 0.44 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.61 2hxl n LEU 151 CO 0.35 0.40 0.71 0.00 -1.33 0.00 0.00 177.39 177.51 2hxl s ALA 152 N -1.26 2.36 0.20 -1.18 0.00 -1.15 -4.66 121.76 116.06 2hxl s ALA 152 Ca 0.17 0.27 -0.19 0.00 0.00 0.00 0.00 51.96 52.21 2hxl s ALA 152 Cb 0.12 -3.26 0.04 0.00 0.00 0.00 0.00 23.12 20.02 2hxl s ALA 152 CO 0.19 -1.61 0.56 -0.08 0.00 0.00 0.00 175.76 174.83 2hxl s THR 153 N -2.86 0.02 -0.21 0.00 -1.32 -0.64 -4.96 115.64 105.68 2hxl s THR 153 Ca 0.61 -0.62 -0.21 0.00 -1.21 0.00 0.00 61.69 60.26 2hxl s THR 153 Cb -0.17 -1.48 -0.02 0.00 -1.51 0.00 0.00 72.50 69.32 2hxl s THR 153 CO 0.54 -0.08 0.65 -0.69 -2.21 0.00 0.00 174.62 172.83 2hxl s VAL 154 N -3.85 5.00 -0.71 5.08 1.01 -1.26 -1.05 120.40 124.61 2hxl s VAL 154 Ca 0.07 1.23 0.12 0.00 0.00 0.00 0.00 61.98 63.41 2hxl s VAL 154 Cb -0.02 -3.97 -0.10 0.00 0.00 0.00 0.00 36.38 32.30 2hxl s VAL 154 CO -0.04 0.08 0.57 2.22 0.00 0.00 0.00 175.10 177.93 2hxl n PHE 155 N 5.20 0.00 -3.78 5.22 -1.74 0.70 -4.91 117.46 118.14 2hxl n PHE 155 Ca -0.00 0.00 -0.19 0.00 -0.56 0.00 0.00 57.45 56.70 2hxl n PHE 155 Cb 0.49 0.00 -0.17 0.00 1.52 0.00 0.00 39.48 41.32 2hxl n PHE 155 CO 0.00 0.00 0.00 0.50 -0.56 0.00 0.00 176.76 176.70 2hxl s ARG 156 N -2.04 0.18 -0.01 3.97 3.52 -1.15 -0.35 118.95 123.08 2hxl s ARG 156 Ca 0.06 0.21 -0.00 0.00 -0.13 0.00 0.00 55.73 55.87 2hxl s ARG 156 Cb 0.09 -0.56 0.02 0.00 -1.56 0.00 0.00 34.95 32.95 2hxl s ARG 156 CO 0.46 -0.24 0.02 -0.47 -0.81 0.00 0.00 175.30 174.26 2hxl s TYR 157 N 1.63 0.02 -1.48 5.12 5.04 -0.87 -4.60 117.35 122.22 2hxl s TYR 157 Ca -0.01 0.09 -0.12 0.00 -2.44 0.00 0.00 57.07 54.59 2hxl s TYR 157 Cb -0.13 -0.16 0.06 0.00 0.35 0.00 0.00 41.96 42.09 2hxl s TYR 157 CO -0.03 -0.06 0.98 0.09 -1.34 0.00 0.00 175.55 175.19 2hxl n ASN 158 N 3.81 -5.27 -1.85 4.32 5.03 -1.26 -1.23 115.26 118.81 2hxl n ASN 158 Ca -0.23 -0.66 -0.21 0.00 0.87 0.00 0.00 54.58 54.36 2hxl n ASN 158 Cb 0.53 -4.20 -0.06 0.00 -1.02 0.00 0.00 39.78 35.04 2hxl n ASN 158 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 2hxl n ASN 159 N -2.82 -5.55 -4.16 6.41 5.15 -1.26 -4.98 115.26 108.06 2hxl n ASN 159 Ca 0.02 0.34 -0.33 0.00 -0.60 0.00 0.00 54.58 54.02 2hxl n ASN 159 Cb 0.54 -4.81 -0.16 0.00 -0.53 0.00 0.00 39.78 34.82 2hxl n ASN 159 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 2hxl s ARG 160 N -4.16 3.01 0.20 1.20 6.06 -0.36 -5.11 118.95 119.78 2hxl s ARG 160 Ca 0.00 -0.85 -0.30 0.00 -2.50 0.00 0.00 55.73 52.08 2hxl s ARG 160 Cb 0.00 -2.45 -0.08 0.00 0.06 0.00 0.00 34.95 32.48 2hxl s ARG 160 CO 0.00 -0.05 0.95 -2.00 -2.50 0.00 0.00 175.30 171.70 2hxl s GLU 161 N 0.90 4.80 -0.20 5.12 2.12 -1.26 -2.04 118.70 128.14 2hxl s GLU 161 Ca -0.05 1.48 -0.04 0.00 0.36 0.00 0.00 54.97 56.72 2hxl s GLU 161 Cb -0.15 -3.31 -0.02 0.00 0.26 0.00 0.00 34.13 30.91 2hxl s GLU 161 CO -0.04 0.41 -0.03 0.50 -0.54 0.00 0.00 175.26 175.57 2hxl s ARG 162 N -0.77 3.51 0.37 4.30 3.52 0.53 -4.99 118.95 125.41 2hxl s ARG 162 Ca 0.43 -0.57 -0.26 0.00 -0.13 0.00 0.00 55.73 55.20 2hxl s ARG 162 Cb -0.25 -3.00 -0.09 0.00 -1.56 0.00 0.00 34.95 30.05 2hxl s ARG 162 CO 0.31 -0.03 1.09 -0.51 -0.81 0.00 0.00 175.30 175.35 2hxl s LEU 163 N 1.07 4.26 0.36 -0.88 1.43 -1.26 -4.74 118.68 118.91 2hxl s LEU 163 Ca 0.01 2.17 0.01 0.00 -1.03 0.00 0.00 54.13 55.29 2hxl s LEU 163 Cb -0.15 -4.00 -0.03 0.00 0.03 0.00 0.00 46.19 42.05 2hxl s LEU 163 CO 0.01 -0.44 0.55 -0.76 0.23 0.00 0.00 176.35 175.93 2hxl s LEU 164 N -2.29 3.98 0.00 1.79 1.43 -0.01 -4.85 118.68 118.73 2hxl s LEU 164 Ca 0.54 0.38 0.00 0.00 -1.03 0.00 0.00 54.13 54.02 2hxl s LEU 164 Cb -0.27 -3.25 0.00 0.00 0.03 0.00 0.00 46.19 42.71 2hxl s LEU 164 CO 0.34 -0.35 0.00 -0.46 0.23 0.00 0.00 176.35 176.11 2hxl n ASN 165 N -1.80 0.00 -4.75 2.29 6.94 -1.26 -1.37 115.26 115.31 2hxl n ASN 165 Ca -0.04 0.00 -0.41 0.00 -0.02 0.00 0.00 54.58 54.12 2hxl n ASN 165 Cb 0.56 0.00 -0.04 0.00 -2.36 0.00 0.00 39.78 37.94 2hxl n ASN 165 CO 0.00 0.00 0.00 -0.75 -1.03 0.00 0.00 177.26 175.48 2hxl s LYS 166 N 0.00 4.60 -0.60 -3.83 2.20 -1.26 -4.92 119.74 115.93 2hxl s LYS 166 Ca 0.00 1.83 -0.28 0.00 -0.36 0.00 0.00 55.97 57.17 2hxl s LYS 166 Cb 0.00 -3.20 0.03 0.00 -1.51 0.00 0.00 37.83 33.15 2hxl s LYS 166 CO 0.00 0.13 1.17 -1.64 -0.36 0.00 0.00 175.35 174.65 2hxl s MET 167 N -1.16 3.45 0.08 4.03 -1.94 -1.26 -5.00 119.30 117.51 2hxl s MET 167 Ca 0.47 0.13 0.04 0.00 -1.71 0.00 0.00 55.69 54.61 2hxl s MET 167 Cb -0.32 -4.04 -0.03 0.00 2.01 0.00 0.00 34.83 32.44 2hxl s MET 167 CO 0.40 -1.72 -0.10 0.00 -0.01 0.00 0.00 175.02 173.60 2hxl n GLY 169 N 0.81 0.55 2.86 0.00 0.00 -1.22 -4.92 105.19 103.27 2hxl n GLY 169 Ca -0.18 -2.28 -0.25 0.00 0.00 0.00 0.00 46.02 43.31 2hxl n GLY 169 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2hxl s THR 170 N -0.07 0.79 0.15 2.61 2.01 -1.26 -5.03 115.64 114.84 2hxl s THR 170 Ca 0.00 -0.15 -0.13 0.00 0.31 0.00 0.00 61.69 61.72 2hxl s THR 170 Cb 0.00 -0.85 0.14 0.00 0.01 0.00 0.00 72.50 71.80 2hxl s THR 170 CO 0.00 0.33 1.06 0.18 -0.69 0.00 0.00 174.62 175.49 2hxl n LEU 171 N 4.94 -0.48 0.32 4.42 4.32 -1.26 -0.47 117.00 128.79 2hxl n LEU 171 Ca -0.11 1.19 0.20 0.00 -0.02 0.00 0.00 56.01 57.27 2hxl n LEU 171 Cb 0.50 -0.26 1.05 0.00 -1.62 0.00 0.00 43.42 43.10 2hxl n LEU 171 CO 0.15 -1.06 1.13 -0.65 -1.22 0.00 0.00 177.39 175.74 2hxl h PRO 172 N 0.00 0.00 -0.00 3.23 0.11 -1.75 -2.83 132.00 130.76 2hxl h PRO 172 Ca 0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.33 2hxl h PRO 172 Cb 0.39 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.50 2hxl h PRO 172 CO -0.67 0.01 -0.73 0.66 -0.21 0.00 0.00 178.00 177.06 2hxl n TYR 173 N -3.30 0.00 -2.74 0.65 4.01 0.38 -4.85 117.16 111.31 2hxl n TYR 173 Ca -0.02 0.00 -0.36 0.00 -0.16 0.00 0.00 57.90 57.36 2hxl n TYR 173 Cb 0.12 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.08 2hxl n TYR 173 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 2hxl s VAL 174 N -2.51 4.16 0.46 -0.72 0.11 -0.80 -3.71 120.40 117.39 2hxl s VAL 174 Ca 0.07 1.61 -0.22 0.00 -2.93 0.00 0.00 61.98 60.51 2hxl s VAL 174 Cb 0.13 -3.81 -0.08 0.00 -1.53 0.00 0.00 36.38 31.09 2hxl s VAL 174 CO 0.65 -0.04 1.08 0.00 -3.33 0.00 0.00 175.10 173.47 2hxl s ALA 175 N -1.81 2.95 0.51 1.54 0.00 -1.26 -4.56 121.76 119.12 2hxl s ALA 175 Ca 0.56 0.74 0.17 0.00 0.00 0.00 0.00 51.96 53.42 2hxl s ALA 175 Cb -0.16 -3.30 1.24 0.00 0.00 0.00 0.00 23.12 20.90 2hxl s ALA 175 CO 0.21 -0.41 2.09 -1.00 0.00 0.00 0.00 175.76 176.66 2hxl h PRO 176 N 1.94 0.08 0.00 0.00 0.13 -1.87 -2.48 132.00 129.80 2hxl h PRO 176 Ca -0.49 -0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.58 2hxl h PRO 176 Cb 1.23 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 2hxl h PRO 176 CO 0.60 0.05 -0.27 1.05 -0.23 0.00 0.00 178.00 179.21 2hxl h GLU 177 N 0.08 0.00 -0.41 0.86 9.09 -1.91 -2.02 114.58 120.27 2hxl h GLU 177 Ca 0.09 0.00 -0.00 0.00 0.05 0.00 0.00 59.36 59.50 2hxl h GLU 177 Cb 0.27 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.35 2hxl h GLU 177 CO -0.01 0.27 0.25 1.25 0.05 0.00 0.00 179.01 180.82 2hxl h LEU 178 N 0.00 0.48 0.00 3.06 7.12 -1.73 0.11 115.31 124.34 2hxl h LEU 178 Ca -0.00 -0.02 0.00 0.00 0.13 0.00 0.00 57.88 57.99 2hxl h LEU 178 Cb 0.50 -0.12 0.00 0.00 -0.53 0.00 0.00 40.66 40.51 2hxl h LEU 178 CO 0.03 0.37 -0.93 0.18 -0.13 0.00 0.00 178.44 177.97 2hxl n LEU 179 N -4.45 0.64 -0.06 2.25 4.77 -0.82 -4.49 117.00 114.84 2hxl n LEU 179 Ca 0.03 0.09 -0.04 0.00 -0.03 0.00 0.00 56.01 56.06 2hxl n LEU 179 Cb 0.08 -0.12 -0.11 0.00 -2.33 0.00 0.00 43.42 40.94 2hxl n LEU 179 CO 0.36 -0.01 -0.90 0.29 -1.33 0.00 0.00 177.39 175.80 2hxl n LYS 180 N -2.09 1.45 -4.43 3.23 5.02 -0.83 -5.04 118.16 115.47 2hxl n LYS 180 Ca 0.02 -0.03 -0.25 0.00 -2.02 0.00 0.00 58.31 56.02 2hxl n LYS 180 Cb 0.45 -1.36 -0.10 0.00 -0.02 0.00 0.00 35.03 34.00 2hxl n LYS 180 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2hxl s ARG 181 N -2.49 1.69 0.05 1.97 1.81 0.32 -5.05 118.95 117.25 2hxl s ARG 181 Ca -0.07 -1.63 -0.17 0.00 -1.72 0.00 0.00 55.73 52.15 2hxl s ARG 181 Cb 0.05 -1.85 -0.19 0.00 -0.45 0.00 0.00 34.95 32.51 2hxl s ARG 181 CO 0.59 0.36 1.22 -0.09 -0.68 0.00 0.00 175.30 176.69 2hxl h ARG 182 N 2.62 0.59 -6.33 3.54 2.43 -1.92 -3.44 114.38 111.86 2hxl h ARG 182 Ca -0.43 -0.52 -0.59 0.00 -0.81 0.00 0.00 59.98 57.63 2hxl h ARG 182 Cb 1.24 0.12 -0.21 0.00 -0.42 0.00 0.00 29.97 30.70 2hxl h ARG 182 CO 0.55 1.15 -0.83 -1.21 -1.51 0.00 0.00 179.97 178.12 2hxl s GLU 183 N -3.55 1.25 0.04 0.20 2.02 -1.26 -4.34 118.70 113.05 2hxl s GLU 183 Ca -0.12 -1.28 -0.27 0.00 0.02 0.00 0.00 54.97 53.32 2hxl s GLU 183 Cb 0.06 -1.53 0.08 0.00 0.10 0.00 0.00 34.13 32.83 2hxl s GLU 183 CO 0.86 0.35 0.68 -0.59 0.02 0.00 0.00 175.26 176.57 2hxl s PHE 184 N -1.34 -0.57 0.37 1.61 -0.12 -0.47 -4.96 117.98 112.49 2hxl s PHE 184 Ca 0.11 0.69 -0.26 0.00 -0.05 0.00 0.00 56.93 57.42 2hxl s PHE 184 Cb -0.09 0.49 -0.09 0.00 -0.63 0.00 0.00 43.02 42.70 2hxl s PHE 184 CO 0.06 -0.70 1.15 -1.01 -0.05 0.00 0.00 175.22 174.67 2hxl s HIS 185 N -2.43 3.20 -0.02 3.49 3.76 -1.26 -0.83 115.29 121.20 2hxl s HIS 185 Ca -0.04 1.58 -0.25 0.00 -0.15 0.00 0.00 55.06 56.21 2hxl s HIS 185 Cb -0.01 -3.36 -0.18 0.00 1.11 0.00 0.00 32.58 30.14 2hxl s HIS 185 CO -0.02 -1.11 1.19 0.00 -0.85 0.00 0.00 174.74 173.95 2hxl h ALA 186 N 2.92 -0.15 -0.46 -1.40 0.00 -1.95 -3.36 119.26 114.85 2hxl h ALA 186 Ca -0.48 -0.22 0.09 0.00 0.00 0.00 0.00 54.91 54.30 2hxl h ALA 186 Cb 1.23 0.06 -0.08 0.00 0.00 0.00 0.00 17.79 18.99 2hxl h ALA 186 CO 0.64 -0.35 -0.06 0.93 0.00 0.00 0.00 179.25 180.40 2hxl h GLU 187 N -0.62 0.04 -0.04 0.00 5.08 -1.98 -1.82 114.58 115.25 2hxl h GLU 187 Ca -0.02 -0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.35 2hxl h GLU 187 Cb 0.49 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.73 2hxl h GLU 187 CO 0.02 0.03 0.03 -1.35 -1.00 0.00 0.00 179.01 176.74 2hxl h PRO 188 N 0.05 0.00 -0.39 2.33 0.11 -1.91 -1.80 132.00 130.39 2hxl h PRO 188 Ca 0.23 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.28 2hxl h PRO 188 Cb 0.34 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.44 2hxl h PRO 188 CO -0.44 0.00 0.03 0.28 -0.21 0.00 0.00 178.00 177.66 2hxl h VAL 189 N 0.00 1.25 -0.12 3.15 2.07 -1.48 -1.40 116.25 119.72 2hxl h VAL 189 Ca 0.02 -0.94 -0.09 0.00 0.82 0.00 0.00 66.70 66.51 2hxl h VAL 189 Cb 0.07 1.11 -0.01 0.00 -1.52 0.00 0.00 31.29 30.94 2hxl h VAL 189 CO -0.00 0.32 -0.33 0.44 0.02 0.00 0.00 177.57 178.01 2hxl h ASP 190 N 0.49 0.24 -0.42 0.57 3.32 -1.31 -2.49 116.42 116.82 2hxl h ASP 190 Ca 0.11 -0.09 -0.03 0.00 0.02 0.00 0.00 57.03 57.05 2hxl h ASP 190 Cb 0.42 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 39.89 2hxl h ASP 190 CO 0.01 0.57 0.14 0.58 -1.72 0.00 0.00 179.24 178.82 2hxl h VAL 191 N 0.21 1.21 -0.13 -1.35 2.07 -0.96 -2.12 116.25 115.18 2hxl h VAL 191 Ca 0.03 -0.69 0.02 0.00 0.82 0.00 0.00 66.70 66.87 2hxl h VAL 191 Cb 0.70 0.88 -0.02 0.00 -1.52 0.00 0.00 31.29 31.33 2hxl h VAL 191 CO 0.05 0.25 0.02 -0.25 0.02 0.00 0.00 177.57 177.66 2hxl h TRP 192 N 0.53 0.03 -0.31 1.57 2.91 -1.09 -1.23 115.95 118.37 2hxl h TRP 192 Ca 0.14 0.01 -0.00 0.00 1.13 0.00 0.00 58.89 60.16 2hxl h TRP 192 Cb 0.24 0.01 -0.02 0.00 -0.51 0.00 0.00 29.16 28.88 2hxl h TRP 192 CO 0.01 0.01 0.18 0.66 -1.03 0.00 0.00 178.44 178.27 2hxl h SER 193 N 0.07 0.36 0.01 2.65 4.64 -1.34 -0.13 113.55 119.82 2hxl h SER 193 Ca 0.06 -0.02 -0.10 0.00 -0.47 0.00 0.00 61.79 61.26 2hxl h SER 193 Cb 0.06 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 62.04 2hxl h SER 193 CO -0.08 0.29 -0.30 0.00 -0.87 0.00 0.00 176.83 175.86 2hxl h GLY 195 N 1.06 1.14 1.53 0.00 0.00 0.10 -0.95 103.07 105.95 2hxl h GLY 195 Ca 0.05 -0.75 -0.12 0.00 0.00 0.00 0.00 47.33 46.50 2hxl h GLY 195 CO 0.06 0.70 -0.37 1.19 0.00 0.00 0.00 176.54 178.11 2hxl h ILE 196 N 0.98 1.30 -0.76 2.60 6.09 -0.91 -1.59 117.51 125.21 2hxl h ILE 196 Ca 0.20 -1.51 -0.05 0.00 -1.37 0.00 0.00 64.86 62.13 2hxl h ILE 196 Cb 0.42 1.52 -0.03 0.00 0.47 0.00 0.00 36.82 39.20 2hxl h ILE 196 CO 0.01 0.48 0.28 0.58 -3.07 0.00 0.00 178.15 176.43 2hxl h VAL 197 N 0.44 1.26 -0.60 2.19 2.07 -0.98 -1.37 116.25 119.26 2hxl h VAL 197 Ca 0.04 -0.84 -0.01 0.00 0.82 0.00 0.00 66.70 66.72 2hxl h VAL 197 Cb 0.85 0.39 -0.03 0.00 -1.52 0.00 0.00 31.29 30.98 2hxl h VAL 197 CO 0.07 0.34 0.34 0.25 0.02 0.00 0.00 177.57 178.59 2hxl h LEU 198 N 1.10 0.75 -0.55 2.57 6.46 -0.82 -0.56 115.31 124.26 2hxl h LEU 198 Ca 0.25 -0.09 0.02 0.00 -0.12 0.00 0.00 57.88 57.94 2hxl h LEU 198 Cb 0.24 -0.19 -0.03 0.00 -0.73 0.00 0.00 40.66 39.95 2hxl h LEU 198 CO -0.02 0.62 0.35 0.74 -0.62 0.00 0.00 178.44 179.51 2hxl h THR 199 N 0.82 1.09 -0.47 1.05 2.02 -0.98 -1.43 112.91 115.00 2hxl h THR 199 Ca 0.21 -0.24 -0.02 0.00 0.77 0.00 0.00 66.41 67.14 2hxl h THR 199 Cb 0.03 0.33 -0.02 0.00 -1.74 0.00 0.00 68.15 66.75 2hxl h THR 199 CO -0.04 0.13 0.23 0.00 0.37 0.00 0.00 175.52 176.21 2hxl h ALA 200 N 1.23 0.61 -0.53 6.16 0.00 -0.83 0.35 119.26 126.26 2hxl h ALA 200 Ca 0.22 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 2hxl h ALA 200 Cb -0.02 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 2hxl h ALA 200 CO -0.08 0.17 0.21 0.52 0.00 0.00 0.00 179.25 180.08 2hxl h MET 201 N 0.62 0.75 0.00 0.00 2.07 -0.75 0.14 114.93 117.76 2hxl h MET 201 Ca 0.16 -0.11 0.00 0.00 -2.07 0.00 0.00 59.70 57.68 2hxl h MET 201 Cb 0.12 -0.14 0.00 0.00 -1.87 0.00 0.00 31.60 29.71 2hxl h MET 201 CO -0.02 0.62 -0.82 1.28 1.07 0.00 0.00 176.91 179.04 2hxl n LEU 202 N -4.35 0.68 0.00 1.22 4.77 -0.57 -0.90 117.00 117.85 2hxl n LEU 202 Ca 0.04 0.15 0.00 0.00 -0.03 0.00 0.00 56.01 56.18 2hxl n LEU 202 Cb 0.15 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 2hxl n LEU 202 CO 0.38 -0.04 -0.06 0.00 -1.33 0.00 0.00 177.39 176.35 2hxl n ALA 203 N -1.87 1.38 -1.74 -1.18 0.00 0.08 -4.63 120.51 112.55 2hxl n ALA 203 Ca 0.02 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.33 2hxl n ALA 203 Cb 0.45 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.87 2hxl n ALA 203 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2hxl n GLY 204 N 0.86 0.76 3.42 0.00 0.00 0.49 -2.96 105.19 107.77 2hxl n GLY 204 Ca 0.00 -0.38 -0.14 0.00 0.00 0.00 0.00 46.02 45.50 2hxl n GLY 204 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2hxl s GLU 205 N -3.75 1.11 -0.06 1.61 -1.05 -1.26 -0.09 118.70 115.21 2hxl s GLU 205 Ca 0.00 -0.22 -0.15 0.00 -0.15 0.00 0.00 54.97 54.45 2hxl s GLU 205 Cb 0.00 0.51 -0.05 0.00 -0.44 0.00 0.00 34.13 34.15 2hxl s GLU 205 CO 0.00 -0.42 0.40 -0.51 0.95 0.00 0.00 175.26 175.68 2hxl s LEU 206 N -2.07 4.39 0.43 1.83 1.02 -1.26 -4.07 118.68 118.95 2hxl s LEU 206 Ca -0.04 0.84 0.12 0.00 0.02 0.00 0.00 54.13 55.07 2hxl s LEU 206 Cb -0.01 -2.57 0.95 0.00 0.02 0.00 0.00 46.19 44.58 2hxl s LEU 206 CO -0.03 0.21 1.99 1.55 0.02 0.00 0.00 176.35 180.09 2hxl h PRO 207 N 5.53 0.13 -3.06 1.29 0.13 -1.94 -3.46 132.00 130.63 2hxl h PRO 207 Ca -0.47 -0.02 -0.02 0.00 -0.87 0.00 0.00 66.00 64.61 2hxl h PRO 207 Cb 1.20 -0.02 -0.12 0.00 0.13 0.00 0.00 31.00 32.19 2hxl h PRO 207 CO 0.67 0.24 0.17 1.67 -0.23 0.00 0.00 178.00 180.52 2hxl s TRP 208 N -4.81 -0.48 0.30 1.56 -2.14 -1.26 -4.67 118.94 107.44 2hxl s TRP 208 Ca -0.05 0.26 0.07 0.00 2.66 0.00 0.00 56.10 59.04 2hxl s TRP 208 Cb 0.16 0.52 0.48 0.00 -3.10 0.00 0.00 33.47 31.53 2hxl s TRP 208 CO 0.71 -0.84 1.71 -0.44 -2.66 0.00 0.00 176.95 175.44 2hxl h ASP 209 N 2.05 0.21 -4.32 -2.66 3.32 -1.93 -3.41 116.42 109.68 2hxl h ASP 209 Ca -0.34 -0.09 0.06 0.00 0.02 0.00 0.00 57.03 56.68 2hxl h ASP 209 Cb 1.30 -0.06 -0.22 0.00 0.22 0.00 0.00 39.33 40.58 2hxl h ASP 209 CO 0.39 0.61 0.48 0.00 -1.72 0.00 0.00 179.24 178.99 2hxl s GLN 210 N -4.14 0.70 -1.46 3.56 -2.07 -1.26 -2.66 119.66 112.33 2hxl s GLN 210 Ca -0.04 0.13 -0.13 0.00 -1.82 0.00 0.00 55.36 53.49 2hxl s GLN 210 Cb 0.13 0.33 0.04 0.00 -1.09 0.00 0.00 33.01 32.42 2hxl s GLN 210 CO 0.77 -0.23 2.25 -0.35 -1.32 0.00 0.00 175.29 176.41 2hxl n PRO 211 N 0.68 2.94 -4.20 9.60 -0.04 -1.26 -4.74 135.00 137.99 2hxl n PRO 211 Ca -0.12 -2.63 -0.16 0.00 -0.04 0.00 0.00 63.50 60.54 2hxl n PRO 211 Cb 0.58 -3.24 -0.11 0.00 -0.04 0.00 0.00 33.50 30.69 2hxl n PRO 211 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2hxl s SER 212 N 3.00 1.71 0.53 3.54 1.04 -1.26 -4.53 113.70 117.73 2hxl s SER 212 Ca 0.48 -0.78 0.23 0.00 0.48 0.00 0.00 55.95 56.36 2hxl s SER 212 Cb 0.14 -0.03 1.38 0.00 0.10 0.00 0.00 66.02 67.61 2hxl s SER 212 CO -0.08 -0.18 2.05 0.44 0.98 0.00 0.00 173.24 176.44 2hxl h ASP 213 N 3.67 0.00 0.12 7.02 3.45 -1.96 -1.48 116.42 127.25 2hxl h ASP 213 Ca -0.39 0.00 -0.02 0.00 0.43 0.00 0.00 57.03 57.05 2hxl h ASP 213 Cb 1.19 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 39.96 2hxl h ASP 213 CO 0.50 0.00 -0.11 0.77 -1.57 0.00 0.00 179.24 178.83 2hxl h SER 214 N 0.00 0.00 -3.24 6.45 4.64 -1.95 -3.41 113.55 116.03 2hxl h SER 214 Ca 0.16 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.91 2hxl h SER 214 Cb 0.66 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.69 2hxl h SER 214 CO -0.00 0.11 0.85 0.00 -0.87 0.00 0.00 176.83 176.92 2hxl h GLN 216 N 8.08 0.70 -0.85 0.00 5.75 -1.86 -1.31 115.11 125.63 2hxl h GLN 216 Ca -0.21 -0.04 0.09 0.00 -0.15 0.00 0.00 58.65 58.34 2hxl h GLN 216 Cb 1.06 -0.16 -0.07 0.00 1.07 0.00 0.00 27.48 29.39 2hxl h GLN 216 CO 1.02 0.46 0.50 0.93 -2.65 0.00 0.00 178.83 179.09 2hxl h GLU 217 N 0.72 0.83 -0.26 1.69 3.07 -1.91 -1.13 114.58 117.58 2hxl h GLU 217 Ca 0.38 -0.05 -0.08 0.00 -0.50 0.00 0.00 59.36 59.12 2hxl h GLU 217 Cb 0.38 -0.19 -0.01 0.00 -0.84 0.00 0.00 28.75 28.10 2hxl h GLU 217 CO -0.26 0.55 -0.13 -0.92 -1.40 0.00 0.00 179.01 176.85 2hxl h TYR 218 N 0.85 0.64 -0.58 4.33 3.20 -1.53 -2.80 116.97 121.07 2hxl h TYR 218 Ca 0.40 -0.16 -0.03 0.00 3.14 0.00 0.00 58.73 62.08 2hxl h TYR 218 Cb 0.33 -0.15 -0.03 0.00 1.54 0.00 0.00 36.73 38.42 2hxl h TYR 218 CO -0.05 0.81 0.22 0.66 -1.64 0.00 0.00 178.16 178.16 2hxl h SER 219 N 0.29 0.77 -0.81 -2.11 4.64 -1.00 -2.31 113.55 113.02 2hxl h SER 219 Ca 0.06 -0.10 -0.01 0.00 -0.47 0.00 0.00 61.79 61.27 2hxl h SER 219 Cb 0.64 -0.20 -0.04 0.00 -0.31 0.00 0.00 62.40 62.50 2hxl h SER 219 CO 0.04 0.70 0.47 0.44 -0.87 0.00 0.00 176.83 177.61 2hxl h ASP 220 N 0.83 1.00 -0.57 4.97 3.45 -1.16 -1.45 116.42 123.49 2hxl h ASP 220 Ca 0.20 -0.08 -0.03 0.00 0.43 0.00 0.00 57.03 57.54 2hxl h ASP 220 Cb 0.18 -0.25 -0.03 0.00 -0.56 0.00 0.00 39.33 38.67 2hxl h ASP 220 CO -0.02 0.79 0.22 -0.25 -1.57 0.00 0.00 179.24 178.41 2hxl h TRP 221 N 1.12 0.88 -0.37 4.55 2.91 -1.20 -1.70 115.95 122.14 2hxl h TRP 221 Ca 0.29 -0.07 -0.02 0.00 1.13 0.00 0.00 58.89 60.22 2hxl h TRP 221 Cb -0.01 -0.26 -0.02 0.00 -0.51 0.00 0.00 29.16 28.36 2hxl h TRP 221 CO -0.00 0.71 0.15 0.87 -1.03 0.00 0.00 178.44 179.14 2hxl h LYS 222 N 0.79 0.52 -0.44 2.65 1.79 -0.98 -0.99 116.57 119.90 2hxl h LYS 222 Ca 0.19 -0.06 0.00 0.00 -2.18 0.00 0.00 60.65 58.60 2hxl h LYS 222 Cb 0.21 -0.10 0.00 0.00 -1.58 0.00 0.00 32.23 30.76 2hxl h LYS 222 CO -0.01 0.43 0.00 0.39 -1.08 0.00 0.00 179.45 179.17 2hxl n GLU 223 N -4.40 1.89 -3.30 3.15 1.02 -0.58 -4.93 120.64 113.50 2hxl n GLU 223 Ca 0.02 -1.08 -0.24 0.00 -0.02 0.00 0.00 57.16 55.84 2hxl n GLU 223 Cb 0.14 -1.38 0.05 0.00 -0.02 0.00 0.00 31.44 30.22 2hxl n GLU 223 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2hxl n LYS 224 N 0.31 -5.79 -2.07 3.49 5.02 -0.38 -4.92 118.16 113.83 2hxl n LYS 224 Ca 0.10 0.83 -0.41 0.00 -2.02 0.00 0.00 58.31 56.80 2hxl n LYS 224 Cb 0.34 -5.74 -0.00 0.00 -0.02 0.00 0.00 35.03 29.61 2hxl n LYS 224 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2hxl n LYS 225 N -4.37 3.95 0.00 1.97 5.02 -0.69 -4.75 118.16 119.30 2hxl n LYS 225 Ca -0.06 -3.32 0.04 0.00 -2.02 0.00 0.00 58.31 52.95 2hxl n LYS 225 Cb 0.59 -2.83 0.22 0.00 -0.02 0.00 0.00 35.03 32.99 2hxl n LYS 225 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2hxl n THR 226 N 2.85 0.00 1.49 -0.18 -2.24 -1.26 -2.59 114.28 112.35 2hxl n THR 226 Ca 0.53 0.00 0.14 0.00 -2.27 0.00 0.00 64.05 62.45 2hxl n THR 226 Cb 0.31 -0.37 0.52 0.00 -2.10 0.00 0.00 70.33 68.69 2hxl n THR 226 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2hxl n TYR 227 N -0.68 0.01 -3.27 4.78 0.18 -1.26 -2.41 117.16 114.50 2hxl n TYR 227 Ca 0.06 -0.01 -0.31 0.00 1.88 0.00 0.00 57.90 59.52 2hxl n TYR 227 Cb 0.03 0.00 -0.04 0.00 -0.38 0.00 0.00 39.34 38.94 2hxl n TYR 227 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 2hxl s LEU 228 N -1.98 4.07 0.00 -3.48 1.43 -1.07 -4.67 118.68 112.98 2hxl s LEU 228 Ca 0.38 0.93 0.00 0.00 -1.03 0.00 0.00 54.13 54.40 2hxl s LEU 228 Cb 0.21 -3.73 0.00 0.00 0.03 0.00 0.00 46.19 42.70 2hxl s LEU 228 CO 0.33 -0.18 0.00 -3.20 0.23 0.00 0.00 176.35 173.54 2hxl n ASN 229 N -0.59 0.00 0.05 2.29 5.15 -1.26 -2.10 115.26 118.80 2hxl n ASN 229 Ca 0.00 0.00 -0.13 0.00 -0.60 0.00 0.00 54.58 53.86 2hxl n ASN 229 Cb 0.53 0.00 -0.09 0.00 -0.53 0.00 0.00 39.78 39.69 2hxl n ASN 229 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 2hxl h PRO 230 N 0.00 -0.16 -0.42 1.20 0.13 -1.94 -3.34 132.00 127.47 2hxl h PRO 230 Ca 0.00 0.01 -0.02 0.00 -0.87 0.00 0.00 66.00 65.12 2hxl h PRO 230 Cb 0.00 0.04 -0.02 0.00 0.13 0.00 0.00 31.00 31.14 2hxl h PRO 230 CO 0.00 0.26 0.15 -1.49 -0.23 0.00 0.00 178.00 176.69 2hxl h TRP 231 N -0.63 0.59 0.00 1.56 4.06 -1.67 -2.93 115.95 116.93 2hxl h TRP 231 Ca -0.02 -0.02 0.00 0.00 2.06 0.00 0.00 58.89 60.91 2hxl h TRP 231 Cb 0.49 -0.19 0.00 0.00 -1.00 0.00 0.00 29.16 28.46 2hxl h TRP 231 CO 0.07 0.48 0.00 1.57 -3.56 0.00 0.00 178.44 177.00 2hxl h LYS 232 N 0.59 0.00 -0.25 0.49 2.10 -1.12 -2.38 116.57 116.00 2hxl h LYS 232 Ca 0.14 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.79 2hxl h LYS 232 Cb 0.14 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.47 2hxl h LYS 232 CO -0.01 0.00 0.00 1.63 -2.00 0.00 0.00 179.45 179.07 2hxl n LYS 233 N -2.91 2.08 -0.05 0.07 5.02 -1.11 -4.68 118.16 116.58 2hxl n LYS 233 Ca -0.02 -1.63 -0.22 0.00 -2.02 0.00 0.00 58.31 54.42 2hxl n LYS 233 Cb 0.13 -1.45 -0.13 0.00 -0.02 0.00 0.00 35.03 33.57 2hxl n LYS 233 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 2hxl n ILE 234 N 0.86 1.66 0.00 -0.18 5.41 -0.90 -4.85 119.36 121.36 2hxl n ILE 234 Ca 0.17 -0.37 0.00 0.00 1.00 0.00 0.00 62.75 63.55 2hxl n ILE 234 Cb 0.46 -1.86 0.00 0.00 -0.71 0.00 0.00 39.64 37.53 2hxl n ILE 234 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 2hxl n ASP 235 N -3.91 0.00 -0.34 4.38 -0.08 -1.26 -4.79 116.55 110.55 2hxl n ASP 235 Ca -0.34 0.00 0.15 0.00 -1.51 0.00 0.00 54.79 53.09 2hxl n ASP 235 Cb 0.88 0.00 0.35 0.00 2.34 0.00 0.00 41.12 44.69 2hxl n ASP 235 CO 0.00 0.00 0.00 0.77 0.12 0.00 0.00 177.20 178.09 2hxl h SER 236 N 0.00 0.64 0.71 1.67 4.64 -1.97 -1.38 113.55 117.86 2hxl h SER 236 Ca 0.00 0.13 -0.03 0.00 -0.47 0.00 0.00 61.79 61.41 2hxl h SER 236 Cb 0.00 0.03 0.01 0.00 -0.31 0.00 0.00 62.40 62.12 2hxl h SER 236 CO 0.00 0.14 -0.34 0.00 -0.87 0.00 0.00 176.83 175.76 2hxl h ALA 237 N 1.70 -1.16 0.00 5.18 0.00 -2.00 -0.24 119.26 122.73 2hxl h ALA 237 Ca 0.60 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 55.26 2hxl h ALA 237 Cb 1.08 0.37 -0.01 0.00 0.00 0.00 0.00 17.79 19.23 2hxl h ALA 237 CO -0.45 -1.09 -0.20 -1.00 0.00 0.00 0.00 179.25 176.50 2hxl h PRO 238 N -1.02 0.00 -0.52 0.00 0.13 -1.85 -2.36 132.00 126.37 2hxl h PRO 238 Ca -0.10 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.98 2hxl h PRO 238 Cb 0.73 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.83 2hxl h PRO 238 CO 0.16 0.20 0.12 1.25 -0.23 0.00 0.00 178.00 179.50 2hxl h LEU 239 N 0.00 0.75 -1.13 1.56 6.46 -1.12 -1.19 115.31 120.63 2hxl h LEU 239 Ca -0.00 -0.13 -0.06 0.00 -0.12 0.00 0.00 57.88 57.57 2hxl h LEU 239 Cb 0.39 -0.19 -0.02 0.00 -0.73 0.00 0.00 40.66 40.11 2hxl h LEU 239 CO 0.03 0.74 -0.04 0.00 -0.62 0.00 0.00 178.44 178.55 2hxl h ALA 240 N 1.36 1.29 -0.25 1.25 0.00 -0.49 -0.30 119.26 122.11 2hxl h ALA 240 Ca 0.17 -0.23 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 2hxl h ALA 240 Cb 0.29 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2hxl h ALA 240 CO -0.00 0.48 -0.06 1.25 0.00 0.00 0.00 179.25 180.91 2hxl h LEU 241 N 0.53 0.50 -1.36 0.00 5.85 -1.25 -2.98 115.31 116.59 2hxl h LEU 241 Ca 0.11 -0.37 0.02 0.00 0.84 0.00 0.00 57.88 58.48 2hxl h LEU 241 Cb 0.40 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 41.26 2hxl h LEU 241 CO 0.02 0.75 0.44 -0.07 -0.34 0.00 0.00 178.44 179.24 2hxl h LEU 242 N 0.24 0.73 -2.15 2.25 4.07 -0.81 -0.16 115.31 119.48 2hxl h LEU 242 Ca 0.06 -0.01 -0.01 0.00 0.08 0.00 0.00 57.88 58.00 2hxl h LEU 242 Cb 0.53 -0.18 -0.00 0.00 1.08 0.00 0.00 40.66 42.09 2hxl h LEU 242 CO 0.03 0.52 -0.07 0.45 -1.08 0.00 0.00 178.44 178.29 2hxl h HIS 243 N 0.86 0.00 0.01 1.13 3.86 -0.91 -0.30 115.15 119.79 2hxl h HIS 243 Ca 0.25 0.00 -0.29 0.00 -1.16 0.00 0.00 60.37 59.18 2hxl h HIS 243 Cb -0.03 0.00 -0.05 0.00 1.06 0.00 0.00 27.41 28.40 2hxl h HIS 243 CO -0.00 0.07 -1.66 0.87 0.86 0.00 0.00 177.93 178.06 2hxl h LYS 244 N 0.00 0.01 0.02 2.45 1.57 -0.97 -3.40 116.57 116.25 2hxl h LYS 244 Ca -0.00 -0.02 -0.06 0.00 -1.87 0.00 0.00 60.65 58.70 2hxl h LYS 244 Cb 0.18 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.50 2hxl h LYS 244 CO 0.01 0.56 -0.28 0.82 -0.57 0.00 0.00 179.45 179.98 2hxl h ILE 245 N 0.00 1.63 -0.49 1.86 2.04 -1.03 -2.32 117.51 119.20 2hxl h ILE 245 Ca -0.27 -2.34 -0.67 0.00 1.00 0.00 0.00 64.86 62.57 2hxl h ILE 245 Cb 2.00 3.20 -0.04 0.00 -0.74 0.00 0.00 36.82 41.24 2hxl h ILE 245 CO 0.08 0.58 3.01 0.18 0.00 0.00 0.00 178.15 182.01 2hxl n LEU 246 N -4.52 8.28 -4.63 1.44 4.77 -0.15 -4.70 117.00 117.49 2hxl n LEU 246 Ca -0.14 -4.52 -0.35 0.00 -0.03 0.00 0.00 56.01 50.97 2hxl n LEU 246 Cb 0.55 -1.47 -0.10 0.00 -2.33 0.00 0.00 43.42 40.08 2hxl n LEU 246 CO 0.33 2.05 -0.23 -0.69 -1.33 0.00 0.00 177.39 177.52 2hxl s VAL 247 N 0.67 4.92 0.28 4.08 1.01 -1.26 -4.93 120.40 125.17 2hxl s VAL 247 Ca 0.63 0.02 -0.03 0.00 0.00 0.00 0.00 61.98 62.60 2hxl s VAL 247 Cb 0.19 -3.24 0.24 0.00 0.00 0.00 0.00 36.38 33.57 2hxl s VAL 247 CO -0.08 0.43 1.92 1.05 0.00 0.00 0.00 175.10 178.42 2hxl h GLU 248 N 6.98 1.11 -6.66 2.72 4.11 -1.97 -3.39 114.58 117.48 2hxl h GLU 248 Ca -0.38 -0.10 -0.56 0.00 0.07 0.00 0.00 59.36 58.39 2hxl h GLU 248 Cb 1.17 -0.23 -0.07 0.00 0.50 0.00 0.00 28.75 30.12 2hxl h GLU 248 CO 0.69 0.78 0.97 1.21 0.07 0.00 0.00 179.01 182.73 2hxl s ASN 249 N -6.31 6.54 0.60 3.06 3.84 -1.26 -4.60 114.94 116.81 2hxl s ASN 249 Ca -0.12 0.49 0.31 0.00 0.21 0.00 0.00 52.86 53.76 2hxl s ASN 249 Cb 0.17 -2.55 1.82 0.00 -0.55 0.00 0.00 41.25 40.15 2hxl s ASN 249 CO 0.80 -1.33 2.20 1.55 -2.79 0.00 0.00 177.10 177.53 2hxl h PRO 250 N 9.62 0.00 0.00 0.43 0.13 -1.96 -0.82 132.00 139.40 2hxl h PRO 250 Ca -0.24 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.81 2hxl h PRO 250 Cb 1.07 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.19 2hxl h PRO 250 CO 1.13 0.00 -0.38 0.77 -0.23 0.00 0.00 178.00 179.28 2hxl h SER 251 N 0.00 0.00 0.27 1.44 0.02 -1.94 -3.18 113.55 110.16 2hxl h SER 251 Ca 0.03 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 2hxl h SER 251 Cb 0.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.75 2hxl h SER 251 CO -0.00 0.38 -1.11 0.00 -1.14 0.00 0.00 176.83 174.96 2hxl n ALA 252 N -2.24 3.69 -1.76 3.77 0.00 -0.40 -4.96 120.51 118.60 2hxl n ALA 252 Ca 0.01 -0.47 -0.39 0.00 0.00 0.00 0.00 53.44 52.59 2hxl n ALA 252 Cb 0.59 -0.90 0.02 0.00 0.00 0.00 0.00 19.45 19.15 2hxl n ALA 252 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2hxl s ARG 253 N -3.18 3.60 0.49 0.00 3.52 -0.69 -4.95 118.95 117.74 2hxl s ARG 253 Ca 0.04 2.22 -0.23 0.00 -0.13 0.00 0.00 55.73 57.63 2hxl s ARG 253 Cb 0.15 -2.53 -0.07 0.00 -1.56 0.00 0.00 34.95 30.94 2hxl s ARG 253 CO 0.83 -0.82 1.37 -1.50 -0.81 0.00 0.00 175.30 174.36 2hxl s ILE 254 N -1.29 2.17 0.46 4.11 2.07 -0.87 -5.02 121.20 122.83 2hxl s ILE 254 Ca 0.63 0.14 0.04 0.00 -1.41 0.00 0.00 60.65 60.06 2hxl s ILE 254 Cb -0.40 -3.08 0.01 0.00 0.13 0.00 0.00 42.46 39.13 2hxl s ILE 254 CO 0.49 0.01 0.64 0.42 -1.91 0.00 0.00 174.94 174.60 2hxl s THR 255 N -1.27 3.18 0.13 4.00 -4.23 -1.26 -4.91 115.64 111.27 2hxl s THR 255 Ca 0.66 -0.80 -0.17 0.00 -1.18 0.00 0.00 61.69 60.20 2hxl s THR 255 Cb -0.41 -3.13 -0.01 0.00 1.34 0.00 0.00 72.50 70.29 2hxl s THR 255 CO 0.50 -0.07 1.72 0.40 -0.54 0.00 0.00 174.62 176.63 2hxl h ILE 256 N 0.43 1.16 -0.87 2.99 2.04 -1.97 -1.24 117.51 120.06 2hxl h ILE 256 Ca -0.42 -0.45 0.19 0.00 1.00 0.00 0.00 64.86 65.18 2hxl h ILE 256 Cb 1.28 0.78 -0.06 0.00 -0.74 0.00 0.00 36.82 38.07 2hxl h ILE 256 CO 0.50 0.17 0.58 -0.65 0.00 0.00 0.00 178.15 178.75 2hxl h PRO 257 N 0.47 0.38 0.00 2.37 0.11 -2.00 0.26 132.00 133.58 2hxl h PRO 257 Ca 0.13 -0.02 -0.17 0.00 0.11 0.00 0.00 66.00 66.05 2hxl h PRO 257 Cb 0.10 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 31.10 2hxl h PRO 257 CO -0.02 0.25 -0.80 -0.44 -0.21 0.00 0.00 178.00 176.78 2hxl h ASP 258 N 0.39 0.00 -0.60 -2.05 3.45 -1.83 -3.18 116.42 112.60 2hxl h ASP 258 Ca 0.44 0.00 -0.06 0.00 0.43 0.00 0.00 57.03 57.85 2hxl h ASP 258 Cb 1.12 0.00 -0.03 0.00 -0.56 0.00 0.00 39.33 39.86 2hxl h ASP 258 CO -0.16 0.78 0.17 0.40 -1.57 0.00 0.00 179.24 178.86 2hxl h ILE 259 N 0.00 1.24 0.00 0.35 2.04 0.20 -1.59 117.51 119.75 2hxl h ILE 259 Ca -0.02 -0.87 0.00 0.00 1.00 0.00 0.00 64.86 64.97 2hxl h ILE 259 Cb 1.61 0.58 0.00 0.00 -0.74 0.00 0.00 36.82 38.27 2hxl h ILE 259 CO 0.10 0.33 0.00 0.50 0.00 0.00 0.00 178.15 179.08 2hxl h LYS 260 N 0.94 0.00 -0.01 2.37 3.64 -1.25 -1.61 116.57 120.65 2hxl h LYS 260 Ca 0.20 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.58 2hxl h LYS 260 Cb 0.31 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.13 2hxl h LYS 260 CO -0.00 0.00 -0.70 1.63 -2.27 0.00 0.00 179.45 178.11 2hxl n LYS 261 N -2.81 0.78 -1.80 1.90 5.02 -0.63 -4.78 118.16 115.83 2hxl n LYS 261 Ca -0.02 -0.52 -0.39 0.00 -2.02 0.00 0.00 58.31 55.36 2hxl n LYS 261 Cb 0.11 -1.46 0.03 0.00 -0.02 0.00 0.00 35.03 33.69 2hxl n LYS 261 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2hxl s ASP 262 N -2.66 5.65 0.13 4.39 -1.08 -0.61 -4.90 116.67 117.60 2hxl s ASP 262 Ca 0.13 2.85 -0.22 0.00 -0.52 0.00 0.00 52.55 54.79 2hxl s ASP 262 Cb 0.17 -2.65 -0.02 0.00 -1.46 0.00 0.00 42.92 38.96 2hxl s ASP 262 CO 0.69 -1.32 1.67 -0.09 0.52 0.00 0.00 175.17 176.64 2hxl h ARG 263 N 1.99 -0.17 -0.71 4.34 2.43 -1.93 -2.39 114.38 117.94 2hxl h ARG 263 Ca -0.51 0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 58.60 2hxl h ARG 263 Cb 1.28 0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 30.84 2hxl h ARG 263 CO 0.60 -0.11 0.17 2.35 -1.51 0.00 0.00 179.97 181.46 2hxl h TRP 264 N -0.18 1.19 -0.66 2.20 7.01 -1.92 -1.91 115.95 121.67 2hxl h TRP 264 Ca 0.10 -0.14 0.10 0.00 2.11 0.00 0.00 58.89 61.06 2hxl h TRP 264 Cb 0.32 -0.33 -0.04 0.00 -2.10 0.00 0.00 29.16 27.00 2hxl h TRP 264 CO -0.27 0.96 0.44 -0.92 -2.79 0.00 0.00 178.44 175.86 2hxl h TYR 265 N 1.07 0.52 -0.60 2.65 5.03 -1.77 -1.65 116.97 122.22 2hxl h TYR 265 Ca 0.22 0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.55 2hxl h TYR 265 Cb 0.37 -0.17 0.00 0.00 1.55 0.00 0.00 36.73 38.49 2hxl h TYR 265 CO 0.03 0.24 0.00 0.09 -1.32 0.00 0.00 178.16 177.20 2hxl n ASN 266 N -4.48 4.12 -4.69 -2.11 3.02 -0.93 -4.97 115.26 105.23 2hxl n ASN 266 Ca 0.11 -2.26 -0.42 0.00 -0.03 0.00 0.00 54.58 51.98 2hxl n ASN 266 Cb 0.38 -0.49 -0.03 0.00 -0.61 0.00 0.00 39.78 39.03 2hxl n ASN 266 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 2hxl s LYS 267 N -1.49 4.42 0.10 3.52 2.20 -0.62 -4.99 119.74 122.87 2hxl s LYS 267 Ca 0.45 1.27 -0.31 0.00 -0.36 0.00 0.00 55.97 57.02 2hxl s LYS 267 Cb 0.27 -3.53 -0.09 0.00 -1.51 0.00 0.00 37.83 32.97 2hxl s LYS 267 CO 0.25 -0.25 1.61 -2.14 -0.36 0.00 0.00 175.35 174.46 2hxl s PRO 268 N 1.79 4.21 0.01 4.03 0.02 -1.26 -4.78 135.00 139.02 2hxl s PRO 268 Ca 0.46 2.32 0.00 0.00 0.02 0.00 0.00 61.00 63.79 2hxl s PRO 268 Cb -0.18 -3.45 0.00 0.00 0.02 0.00 0.00 34.50 30.88 2hxl s PRO 268 CO 0.18 -0.68 0.00 1.28 -0.33 0.00 0.00 177.00 177.45 2hxl n LEU 269 N 5.05 -0.01 -4.77 -5.54 4.77 -1.26 -5.14 117.00 110.10 2hxl n LEU 269 Ca 0.15 0.01 -0.30 0.00 -0.03 0.00 0.00 56.01 55.84 2hxl n LEU 269 Cb 0.40 0.03 0.11 0.00 -2.33 0.00 0.00 43.42 41.63 2hxl n LEU 269 CO 0.62 -0.51 0.70 -0.54 -1.33 0.00 0.00 177.39 176.33 2hxl s LYS 270 N -2.00 1.72 -0.00 3.23 -0.14 -1.26 -4.90 119.74 116.39 2hxl s LYS 270 Ca 0.00 0.67 0.03 0.00 -1.36 0.00 0.00 55.97 55.30 2hxl s LYS 270 Cb 0.00 -1.87 -0.01 0.00 -1.68 0.00 0.00 37.83 34.27 2hxl s LYS 270 CO 0.00 -1.88 -0.08 0.15 -0.76 0.00 0.00 175.35 172.78 2hxl s LYS 271 N -5.09 0.67 1.45 1.68 -0.14 -1.26 -5.15 119.74 111.89 2hxl s LYS 271 Ca 0.62 -0.32 -0.23 0.00 -1.36 0.00 0.00 55.97 54.67 2hxl s LYS 271 Cb -0.16 -0.64 0.37 0.00 -1.68 0.00 0.00 37.83 35.73 2hxl s LYS 271 CO 0.55 0.17 0.89 0.41 -0.76 0.00 0.00 175.35 176.61 2hxl n GLY 272 N 2.80 -3.72 3.71 -3.33 0.00 -1.26 -4.93 105.19 98.47 2hxl n GLY 272 Ca -0.14 -1.64 -0.42 0.00 0.00 0.00 0.00 46.02 43.82 2hxl n GLY 272 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hxl s ALA 273 N -2.15 3.41 -0.08 4.61 0.00 -1.26 -4.95 121.76 121.35 2hxl s ALA 273 Ca 0.68 0.88 -0.34 0.00 0.00 0.00 0.00 51.96 53.17 2hxl s ALA 273 Cb -0.14 -3.45 -0.12 0.00 0.00 0.00 0.00 23.12 19.41 2hxl s ALA 273 CO 0.58 -0.45 1.87 1.63 0.00 0.00 0.00 175.76 179.38 2hxl n LYS 274 N 3.86 2.15 -3.07 0.00 5.02 -1.26 -3.62 118.16 121.25 2hxl n LYS 274 Ca 0.09 0.79 -0.18 0.00 -2.02 0.00 0.00 58.31 56.99 2hxl n LYS 274 Cb 0.46 -2.63 0.02 0.00 -0.02 0.00 0.00 35.03 32.86 2hxl n LYS 274 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2hxl n ARG 275 N 6.48 -2.23 0.00 1.97 5.12 -1.26 -5.34 116.66 121.40 2hxl n ARG 275 Ca 0.22 1.89 0.02 0.00 -1.93 0.00 0.00 57.85 58.06 2hxl n ARG 275 Cb 0.29 -4.50 0.12 0.00 -1.16 0.00 0.00 32.46 27.21 2hxl n ARG 275 CO 0.00 0.00 0.00 -0.35 -1.93 0.00 0.00 177.63 175.35