#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xxh n GLN 4 N 0.00 -1.44 -2.40 -3.48 6.02 -1.26 -4.79 117.38 110.03 1xxh n GLN 4 Ca 0.00 1.38 -0.43 0.00 -0.01 0.00 0.00 57.00 57.94 1xxh n GLN 4 Cb 0.00 -1.33 -0.02 0.00 1.02 0.00 0.00 30.24 29.91 1xxh n GLN 4 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 1xxh s VAL 5 N -0.29 4.07 0.40 5.09 -7.23 -1.26 -4.86 120.40 116.32 1xxh s VAL 5 Ca -0.03 1.17 0.31 0.00 -1.81 0.00 0.00 61.98 61.62 1xxh s VAL 5 Cb 0.00 -4.18 0.47 0.00 0.56 0.00 0.00 36.38 33.24 1xxh s VAL 5 CO 0.09 -0.57 1.37 0.18 -0.31 0.00 0.00 175.10 175.85 1xxh n LEU 6 N 7.99 0.16 0.25 1.32 4.77 -1.26 0.16 117.00 130.38 1xxh n LEU 6 Ca 0.15 1.16 0.06 0.00 -0.03 0.00 0.00 56.01 57.36 1xxh n LEU 6 Cb 0.47 -0.57 0.34 0.00 -2.33 0.00 0.00 43.42 41.33 1xxh n LEU 6 CO 0.66 -1.25 0.92 0.00 -1.33 0.00 0.00 177.39 176.39 1xxh h ALA 7 N 1.31 1.46 0.00 -1.18 0.00 -1.89 0.10 119.26 119.06 1xxh h ALA 7 Ca 0.78 0.00 -0.15 0.00 0.00 0.00 0.00 54.91 55.54 1xxh h ALA 7 Cb 2.62 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 20.38 1xxh h ALA 7 CO -0.35 -0.46 -1.56 -2.13 0.00 0.00 0.00 179.25 174.76 1xxh n ARG 8 N -2.32 0.24 0.15 0.00 0.63 0.42 -4.35 116.66 111.44 1xxh n ARG 8 Ca -0.01 0.06 0.12 0.00 -0.92 0.00 0.00 57.85 57.10 1xxh n ARG 8 Cb 0.56 -1.16 0.55 0.00 0.45 0.00 0.00 32.46 32.85 1xxh n ARG 8 CO 0.00 0.00 0.00 1.17 -2.51 0.00 0.00 177.63 176.29 1xxh n LYS 9 N -2.85 0.18 0.00 -0.14 4.81 0.18 -2.33 118.16 118.01 1xxh n LYS 9 Ca -0.18 0.53 0.00 0.00 -0.87 0.00 0.00 58.31 57.79 1xxh n LYS 9 Cb 0.68 -1.93 0.00 0.00 0.02 0.00 0.00 35.03 33.80 1xxh n LYS 9 CO 0.00 0.00 0.00 0.91 1.17 0.00 0.00 177.40 179.48 1xxh n TRP 10 N -2.28 0.00 -1.67 5.64 7.02 -0.15 -5.02 117.44 120.98 1xxh n TRP 10 Ca 0.00 -0.35 -0.51 0.00 -1.02 0.00 0.00 57.50 55.62 1xxh n TRP 10 Cb 0.14 -0.04 -0.06 0.00 -2.42 0.00 0.00 31.31 28.94 1xxh n TRP 10 CO 0.00 0.00 0.00 -2.13 -2.02 0.00 0.00 177.69 173.54 1xxh n ARG 11 N -0.35 1.69 -1.66 -0.99 0.63 -0.98 -4.81 116.66 110.18 1xxh n ARG 11 Ca 0.00 0.61 -0.46 0.00 -0.92 0.00 0.00 57.85 57.09 1xxh n ARG 11 Cb 0.22 -2.36 -0.04 0.00 0.45 0.00 0.00 32.46 30.73 1xxh n ARG 11 CO 0.00 0.00 0.00 -2.30 -2.51 0.00 0.00 177.63 172.82 1xxh n PRO 12 N 4.98 2.02 -0.10 -0.14 -0.02 -1.26 -4.94 135.00 135.54 1xxh n PRO 12 Ca 0.22 0.73 -0.21 0.00 -2.02 0.00 0.00 63.50 62.21 1xxh n PRO 12 Cb 0.23 -2.44 -0.07 0.00 -0.02 0.00 0.00 33.50 31.20 1xxh n PRO 12 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1xxh n GLN 13 N 2.79 0.44 -0.41 -0.52 1.13 -1.26 -4.99 117.38 114.57 1xxh n GLN 13 Ca 0.15 0.19 0.00 0.00 -1.94 0.00 0.00 57.00 55.40 1xxh n GLN 13 Cb 0.29 -1.24 0.00 0.00 0.11 0.00 0.00 30.24 29.40 1xxh n GLN 13 CO 0.00 0.00 0.00 2.41 -1.44 0.00 0.00 177.06 178.03 1xxh n THR 14 N -3.97 0.00 -0.02 5.09 -1.04 -1.26 -4.92 114.28 108.16 1xxh n THR 14 Ca -0.39 0.00 -0.11 0.00 -2.04 0.00 0.00 64.05 61.51 1xxh n THR 14 Cb 0.76 -1.13 -0.14 0.00 -1.82 0.00 0.00 70.33 68.00 1xxh n THR 14 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 1xxh n PHE 15 N -0.53 0.98 -0.22 -1.42 3.01 -1.26 -3.98 117.46 114.04 1xxh n PHE 15 Ca 0.00 0.32 0.06 0.00 1.01 0.00 0.00 57.45 58.84 1xxh n PHE 15 Cb 0.00 -1.17 0.32 0.00 -0.01 0.00 0.00 39.48 38.63 1xxh n PHE 15 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1xxh h ALA 16 N 0.80 1.66 0.00 4.37 0.00 -1.95 -1.89 119.26 122.26 1xxh h ALA 16 Ca -0.33 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.53 1xxh h ALA 16 Cb 2.03 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 19.61 1xxh h ALA 16 CO 0.08 0.21 -0.13 -0.44 0.00 0.00 0.00 179.25 178.97 1xxh h ASP 17 N 0.82 0.00 -3.34 0.00 3.32 -1.96 -3.44 116.42 111.83 1xxh h ASP 17 Ca 0.34 0.00 -0.45 0.00 0.02 0.00 0.00 57.03 56.94 1xxh h ASP 17 Cb 0.27 0.00 0.22 0.00 0.22 0.00 0.00 39.33 40.03 1xxh h ASP 17 CO -0.12 0.13 -0.03 0.52 -1.72 0.00 0.00 179.24 178.02 1xxh n VAL 18 N -3.82 0.00 -5.04 -1.35 0.31 -0.71 -4.84 118.33 102.87 1xxh n VAL 18 Ca -0.02 -0.37 -0.28 0.00 -0.01 0.00 0.00 64.34 63.66 1xxh n VAL 18 Cb 0.23 -0.98 -0.16 0.00 -0.91 0.00 0.00 33.84 32.03 1xxh n VAL 18 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1xxh s VAL 19 N -2.43 1.68 0.00 2.52 1.01 -1.26 -4.87 120.40 117.05 1xxh s VAL 19 Ca 0.68 -0.90 0.00 0.00 0.00 0.00 0.00 61.98 61.76 1xxh s VAL 19 Cb -0.25 -1.41 0.00 0.00 0.00 0.00 0.00 36.38 34.73 1xxh s VAL 19 CO 0.64 0.48 0.00 0.61 0.00 0.00 0.00 175.10 176.83 1xxh n GLY 20 N 2.69 0.00 2.37 4.51 0.00 -1.26 -4.68 105.19 108.82 1xxh n GLY 20 Ca -0.16 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.61 1xxh n GLY 20 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1xxh n GLN 21 N -0.67 2.29 0.01 1.61 6.02 -1.26 -4.71 117.38 120.67 1xxh n GLN 21 Ca 0.00 -2.22 -0.03 0.00 -0.01 0.00 0.00 57.00 54.74 1xxh n GLN 21 Cb 0.00 -2.04 -0.02 0.00 1.02 0.00 0.00 30.24 29.20 1xxh n GLN 21 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 1xxh h GLU 22 N 2.66 -0.13 -0.94 -1.09 5.08 -1.97 -2.66 114.58 115.53 1xxh h GLU 22 Ca 0.38 0.01 0.29 0.00 -1.00 0.00 0.00 59.36 59.04 1xxh h GLU 22 Cb 0.76 0.03 -0.17 0.00 0.50 0.00 0.00 28.75 29.86 1xxh h GLU 22 CO 0.87 -0.09 0.13 0.72 -1.00 0.00 0.00 179.01 179.64 1xxh n HIS 23 N -3.14 0.71 1.47 4.33 8.25 -1.26 0.24 115.22 125.82 1xxh n HIS 23 Ca -0.01 1.13 0.15 0.00 -0.26 0.00 0.00 57.72 58.73 1xxh n HIS 23 Cb 0.08 -1.28 0.77 0.00 1.12 0.00 0.00 29.99 30.69 1xxh n HIS 23 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1xxh n VAL 24 N -5.34 0.00 -0.11 1.59 0.31 -1.11 -2.67 118.33 111.01 1xxh n VAL 24 Ca 0.25 0.00 -0.22 0.00 -0.01 0.00 0.00 64.34 64.36 1xxh n VAL 24 Cb 0.83 -0.50 -0.12 0.00 -0.91 0.00 0.00 33.84 33.14 1xxh n VAL 24 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1xxh n LEU 25 N -1.26 2.50 -0.28 7.52 4.77 0.68 -3.95 117.00 126.98 1xxh n LEU 25 Ca 0.15 0.12 0.05 0.00 -0.03 0.00 0.00 56.01 56.30 1xxh n LEU 25 Cb 0.23 -0.93 0.19 0.00 -2.33 0.00 0.00 43.42 40.58 1xxh n LEU 25 CO 0.23 0.75 1.08 0.74 -1.33 0.00 0.00 177.39 178.86 1xxh h THR 26 N -0.38 0.76 0.00 -5.08 2.02 -0.40 0.59 112.91 110.42 1xxh h THR 26 Ca -0.56 -0.21 -0.02 0.00 0.77 0.00 0.00 66.41 66.39 1xxh h THR 26 Cb 1.78 0.10 -0.00 0.00 -1.74 0.00 0.00 68.15 68.29 1xxh h THR 26 CO -0.17 0.11 -0.09 0.00 0.37 0.00 0.00 175.52 175.75 1xxh h ALA 27 N 1.52 1.63 0.00 6.16 0.00 -1.69 -1.01 119.26 125.87 1xxh h ALA 27 Ca 0.42 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.26 1xxh h ALA 27 Cb 0.56 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1xxh h ALA 27 CO -0.34 0.11 -0.98 1.28 0.00 0.00 0.00 179.25 179.31 1xxh n LEU 28 N -4.10 0.79 0.03 0.00 4.77 0.16 -3.39 117.00 115.26 1xxh n LEU 28 Ca -0.03 0.28 -0.08 0.00 -0.03 0.00 0.00 56.01 56.15 1xxh n LEU 28 Cb 0.17 -0.08 0.08 0.00 -2.33 0.00 0.00 43.42 41.26 1xxh n LEU 28 CO 0.32 -0.15 0.47 0.00 -1.33 0.00 0.00 177.39 176.71 1xxh h ALA 29 N 2.11 0.74 -1.56 -1.18 0.00 0.11 -3.02 119.26 116.46 1xxh h ALA 29 Ca 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1xxh h ALA 29 Cb 0.95 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1xxh h ALA 29 CO 0.00 0.70 0.00 0.09 0.00 0.00 0.00 179.25 180.04 1xxh n ASN 30 N -3.93 0.00 -0.14 0.00 4.13 -0.74 -2.64 115.26 111.94 1xxh n ASN 30 Ca -0.03 0.47 -0.02 0.00 1.68 0.00 0.00 54.58 56.68 1xxh n ASN 30 Cb 0.61 -0.24 -0.01 0.00 -1.54 0.00 0.00 39.78 38.60 1xxh n ASN 30 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1xxh n GLY 31 N 0.86 -0.79 0.23 7.41 0.00 -1.22 0.31 105.19 112.00 1xxh n GLY 31 Ca 0.00 0.39 0.04 0.00 0.00 0.00 0.00 46.02 46.45 1xxh n GLY 31 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1xxh h LEU 32 N 0.00 0.10 0.24 0.99 3.38 -1.66 0.42 115.31 118.77 1xxh h LEU 32 Ca 0.09 -0.02 -0.33 0.00 0.09 0.00 0.00 57.88 57.70 1xxh h LEU 32 Cb 0.17 -0.03 0.04 0.00 0.09 0.00 0.00 40.66 40.93 1xxh h LEU 32 CO -0.33 0.26 -1.45 0.28 0.09 0.00 0.00 178.44 177.29 1xxh h SER 33 N 0.11 0.86 0.02 -0.43 0.02 0.51 -3.29 113.55 111.35 1xxh h SER 33 Ca 0.02 -0.90 0.00 0.00 -0.84 0.00 0.00 61.79 60.07 1xxh h SER 33 Cb 0.31 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 62.57 1xxh h SER 33 CO 0.02 1.70 -0.07 0.18 -1.14 0.00 0.00 176.83 177.52 1xxh n LEU 34 N -3.73 1.83 0.00 5.07 4.77 0.20 -4.94 117.00 120.20 1xxh n LEU 34 Ca -0.16 -0.60 0.00 0.00 -0.03 0.00 0.00 56.01 55.21 1xxh n LEU 34 Cb 1.09 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 42.16 1xxh n LEU 34 CO 0.61 0.31 0.00 0.61 -1.33 0.00 0.00 177.39 177.59 1xxh n GLY 35 N 1.26 2.25 3.23 -0.72 0.00 0.14 -4.88 105.19 106.47 1xxh n GLY 35 Ca 0.16 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.94 1xxh n GLY 35 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xxh n ARG 36 N -2.00 0.00 -2.96 1.61 5.12 -0.70 -4.82 116.66 112.91 1xxh n ARG 36 Ca 0.00 -0.66 -0.43 0.00 -1.93 0.00 0.00 57.85 54.83 1xxh n ARG 36 Cb 0.00 -2.06 -0.05 0.00 -1.16 0.00 0.00 32.46 29.19 1xxh n ARG 36 CO 0.00 0.00 0.00 -1.50 -1.93 0.00 0.00 177.63 174.20 1xxh s ILE 37 N 5.51 4.67 0.82 0.55 2.07 -1.26 -4.75 121.20 128.82 1xxh s ILE 37 Ca 0.37 0.57 -0.12 0.00 -1.41 0.00 0.00 60.65 60.06 1xxh s ILE 37 Cb 0.08 -4.29 0.09 0.00 0.13 0.00 0.00 42.46 38.47 1xxh s ILE 37 CO 0.19 -0.64 1.15 -1.00 -1.91 0.00 0.00 174.94 172.73 1xxh s HIS 38 N 3.25 2.87 -0.54 3.50 3.76 -1.26 -4.98 115.29 121.88 1xxh s HIS 38 Ca 0.30 0.84 0.24 0.00 -0.15 0.00 0.00 55.06 56.30 1xxh s HIS 38 Cb -0.12 -3.39 0.49 0.00 1.11 0.00 0.00 32.58 30.67 1xxh s HIS 38 CO 0.21 -1.87 1.62 1.12 -0.85 0.00 0.00 174.74 174.98 1xxh h HIS 39 N -1.13 0.00 -3.23 1.40 2.07 -1.93 -3.46 115.15 108.87 1xxh h HIS 39 Ca -0.47 0.00 -0.23 0.00 -2.85 0.00 0.00 60.37 56.82 1xxh h HIS 39 Cb 1.32 0.00 -0.31 0.00 2.57 0.00 0.00 27.41 30.99 1xxh h HIS 39 CO 0.34 0.00 -0.57 0.00 -3.07 0.00 0.00 177.93 174.63 1xxh s ALA 40 N -3.18 -0.34 -0.18 6.11 0.00 -1.26 -2.21 121.76 120.70 1xxh s ALA 40 Ca 0.08 0.71 -0.02 0.00 0.00 0.00 0.00 51.96 52.73 1xxh s ALA 40 Cb 0.08 -0.46 -0.00 0.00 0.00 0.00 0.00 23.12 22.74 1xxh s ALA 40 CO 0.65 -0.15 -0.11 0.71 0.00 0.00 0.00 175.76 176.86 1xxh s TYR 41 N 1.03 2.87 -0.11 0.00 1.51 -0.09 -0.62 117.35 121.94 1xxh s TYR 41 Ca -0.08 -1.02 -0.02 0.00 -1.01 0.00 0.00 57.07 54.95 1xxh s TYR 41 Cb -0.10 -1.98 -0.03 0.00 -0.11 0.00 0.00 41.96 39.74 1xxh s TYR 41 CO -0.06 -0.51 -0.04 -1.17 -1.11 0.00 0.00 175.55 172.66 1xxh s LEU 42 N 1.10 3.29 -0.22 -1.29 2.96 -0.77 0.89 118.68 124.65 1xxh s LEU 42 Ca 0.00 -0.03 -0.01 0.00 -0.22 0.00 0.00 54.13 53.87 1xxh s LEU 42 Cb -0.14 -1.76 0.06 0.00 0.50 0.00 0.00 46.19 44.85 1xxh s LEU 42 CO -0.03 0.28 -0.02 -0.36 -1.32 0.00 0.00 176.35 174.91 1xxh s PHE 43 N -0.32 1.81 0.17 5.38 0.08 0.32 -0.26 117.98 125.16 1xxh s PHE 43 Ca 0.05 -1.36 0.03 0.00 0.12 0.00 0.00 56.93 55.77 1xxh s PHE 43 Cb -0.12 -1.34 -0.03 0.00 -0.57 0.00 0.00 43.02 40.95 1xxh s PHE 43 CO 0.02 -0.70 0.28 -1.54 -0.10 0.00 0.00 175.22 173.18 1xxh s SER 44 N 1.59 6.23 0.00 1.36 1.04 -0.74 0.89 113.70 124.08 1xxh s SER 44 Ca -0.04 0.11 0.00 0.00 0.48 0.00 0.00 55.95 56.50 1xxh s SER 44 Cb -0.18 -1.84 0.00 0.00 0.10 0.00 0.00 66.02 64.10 1xxh s SER 44 CO -0.07 0.03 0.00 0.61 0.98 0.00 0.00 173.24 174.79 1xxh n GLY 45 N -0.73 3.65 3.14 7.32 0.00 0.89 -2.19 105.19 117.28 1xxh n GLY 45 Ca -0.08 -0.93 -0.25 0.00 0.00 0.00 0.00 46.02 44.76 1xxh n GLY 45 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1xxh n THR 46 N -1.28 0.00 -3.35 2.61 -1.04 -1.26 -3.92 114.28 106.04 1xxh n THR 46 Ca 0.00 -0.03 -0.37 0.00 -2.04 0.00 0.00 64.05 61.61 1xxh n THR 46 Cb 0.00 -0.80 -0.06 0.00 -1.82 0.00 0.00 70.33 67.65 1xxh n THR 46 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1xxh s ARG 47 N -4.45 4.05 0.00 -2.82 1.04 -1.26 -3.85 118.95 111.66 1xxh s ARG 47 Ca 0.55 0.57 0.00 0.00 -1.04 0.00 0.00 55.73 55.81 1xxh s ARG 47 Cb -0.10 -3.10 0.00 0.00 -2.04 0.00 0.00 34.95 29.70 1xxh s ARG 47 CO 0.47 0.58 0.00 0.41 -0.04 0.00 0.00 175.30 176.72 1xxh n GLY 48 N 1.33 2.88 3.78 3.88 0.00 -1.26 -4.90 105.19 110.90 1xxh n GLY 48 Ca -0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.54 1xxh n GLY 48 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xxh s VAL 49 N -2.58 4.65 0.00 1.61 1.01 -1.25 -4.18 120.40 119.65 1xxh s VAL 49 Ca 0.00 1.46 0.00 0.00 0.00 0.00 0.00 61.98 63.44 1xxh s VAL 49 Cb 0.00 -4.03 0.00 0.00 0.00 0.00 0.00 36.38 32.35 1xxh s VAL 49 CO 0.00 0.48 0.27 0.61 0.00 0.00 0.00 175.10 176.46 1xxh n GLY 50 N 1.94 0.68 0.31 4.51 0.00 -1.26 -4.50 105.19 106.88 1xxh n GLY 50 Ca -0.07 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.83 1xxh n GLY 50 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xxh h LYS 51 N 4.83 -0.76 0.05 1.61 1.57 -1.91 0.46 116.57 122.41 1xxh h LYS 51 Ca 0.00 0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.83 1xxh h LYS 51 Cb 0.00 0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.48 1xxh h LYS 51 CO 0.27 -0.51 -0.03 1.79 -0.57 0.00 0.00 179.45 180.40 1xxh h THR 52 N -0.82 0.96 -0.53 -0.16 1.35 -1.96 -1.12 112.91 110.63 1xxh h THR 52 Ca -0.08 -0.05 0.10 0.00 -0.55 0.00 0.00 66.41 65.83 1xxh h THR 52 Cb 0.61 0.99 -0.08 0.00 -1.73 0.00 0.00 68.15 67.94 1xxh h THR 52 CO 0.13 0.01 0.06 -1.28 -0.25 0.00 0.00 175.52 174.20 1xxh h SER 53 N -0.09 -0.10 1.22 5.36 0.87 -1.89 0.89 113.55 119.81 1xxh h SER 53 Ca -0.01 0.11 0.00 0.00 -1.23 0.00 0.00 61.79 60.66 1xxh h SER 53 Cb 0.07 0.17 0.00 0.00 -0.44 0.00 0.00 62.40 62.21 1xxh h SER 53 CO 0.01 -0.02 0.00 0.40 -0.53 0.00 0.00 176.83 176.69 1xxh h ILE 54 N 0.19 0.00 -0.16 2.23 2.04 -0.05 -2.88 117.51 118.88 1xxh h ILE 54 Ca 0.27 -0.52 -0.18 0.00 1.00 0.00 0.00 64.86 65.43 1xxh h ILE 54 Cb 0.39 1.44 0.01 0.00 -0.74 0.00 0.00 36.82 37.92 1xxh h ILE 54 CO -0.39 0.00 -0.59 0.00 0.00 0.00 0.00 178.15 177.17 1xxh h ALA 55 N 2.18 0.29 -0.75 1.87 0.00 0.20 -3.21 119.26 119.84 1xxh h ALA 55 Ca 0.00 -0.53 -0.05 0.00 0.00 0.00 0.00 54.91 54.32 1xxh h ALA 55 Cb 0.61 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 1xxh h ALA 55 CO 0.00 0.54 0.26 0.00 0.00 0.00 0.00 179.25 180.05 1xxh h ARG 56 N 0.38 1.15 0.00 0.00 3.08 -0.82 -1.80 114.38 116.37 1xxh h ARG 56 Ca -0.03 -0.23 0.00 0.00 0.07 0.00 0.00 59.98 59.79 1xxh h ARG 56 Cb 1.22 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 31.10 1xxh h ARG 56 CO 0.13 0.96 0.00 1.28 -1.07 0.00 0.00 179.97 181.27 1xxh n LEU 57 N -4.26 0.00 -0.12 3.04 4.77 -1.10 -0.44 117.00 118.89 1xxh n LEU 57 Ca 0.06 0.01 -0.24 0.00 -0.03 0.00 0.00 56.01 55.81 1xxh n LEU 57 Cb 0.21 -0.01 -0.08 0.00 -2.33 0.00 0.00 43.42 41.22 1xxh n LEU 57 CO 0.41 -0.01 -1.23 -0.11 -1.33 0.00 0.00 177.39 175.13 1xxh n LEU 58 N -1.01 1.89 0.00 2.23 7.94 -0.69 -3.98 117.00 123.38 1xxh n LEU 58 Ca 0.04 0.33 0.04 0.00 -1.11 0.00 0.00 56.01 55.31 1xxh n LEU 58 Cb 0.02 -0.77 0.17 0.00 0.53 0.00 0.00 43.42 43.37 1xxh n LEU 58 CO 0.03 0.34 0.61 0.00 -1.11 0.00 0.00 177.39 177.27 1xxh n ALA 59 N -4.26 1.39 0.33 1.96 0.00 -0.63 0.60 120.51 119.90 1xxh n ALA 59 Ca -0.43 -0.03 0.11 0.00 0.00 0.00 0.00 53.44 53.09 1xxh n ALA 59 Cb 0.78 -1.13 -0.06 0.00 0.00 0.00 0.00 19.45 19.05 1xxh n ALA 59 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1xxh n LYS 60 N -1.46 0.44 -0.09 0.00 4.81 0.42 -3.62 118.16 118.66 1xxh n LYS 60 Ca 0.02 -0.05 0.07 0.00 -0.87 0.00 0.00 58.31 57.48 1xxh n LYS 60 Cb 0.08 -1.60 0.11 0.00 0.02 0.00 0.00 35.03 33.64 1xxh n LYS 60 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1xxh n GLY 61 N 1.31 1.10 0.31 3.14 0.00 0.20 -3.95 105.19 107.30 1xxh n GLY 61 Ca -0.00 -0.42 -0.21 0.00 0.00 0.00 0.00 46.02 45.39 1xxh n GLY 61 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1xxh n LEU 62 N 0.75 1.59 -0.41 0.99 4.77 0.15 -2.06 117.00 122.79 1xxh n LEU 62 Ca 0.11 0.27 0.14 0.00 -0.03 0.00 0.00 56.01 56.50 1xxh n LEU 62 Cb 0.39 -0.65 0.49 0.00 -2.33 0.00 0.00 43.42 41.33 1xxh n LEU 62 CO 0.09 0.31 0.82 0.59 -1.33 0.00 0.00 177.39 177.87 1xxh n ASN 63 N -4.04 1.35 -4.67 -1.43 3.02 -1.24 -4.49 115.26 103.77 1xxh n ASN 63 Ca -0.38 -1.33 -0.44 0.00 -0.03 0.00 0.00 54.58 52.40 1xxh n ASN 63 Cb 0.74 0.03 -0.02 0.00 -0.61 0.00 0.00 39.78 39.92 1xxh n ASN 63 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1xxh h GLU 65 N 3.43 0.00 0.00 0.00 5.08 -1.92 -1.39 114.58 119.78 1xxh h GLU 65 Ca -0.45 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 1xxh h GLU 65 Cb 1.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.54 1xxh h GLU 65 CO 0.70 0.12 0.00 2.41 -1.00 0.00 0.00 179.01 181.24 1xxh n THR 66 N -3.36 0.07 0.00 1.13 -1.04 -1.26 -4.94 114.28 104.88 1xxh n THR 66 Ca -0.01 0.02 0.00 0.00 -2.04 0.00 0.00 64.05 62.02 1xxh n THR 66 Cb 0.31 -0.80 0.00 0.00 -1.82 0.00 0.00 70.33 68.02 1xxh n THR 66 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1xxh n GLY 67 N -0.15 0.16 3.55 3.41 0.00 -0.52 -4.82 105.19 106.81 1xxh n GLY 67 Ca 0.10 -2.02 -0.35 0.00 0.00 0.00 0.00 46.02 43.74 1xxh n GLY 67 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xxh s ILE 68 N -1.02 3.38 0.35 -0.61 1.01 -1.26 -4.45 121.20 118.60 1xxh s ILE 68 Ca 0.00 0.05 0.09 0.00 0.00 0.00 0.00 60.65 60.79 1xxh s ILE 68 Cb 0.00 -3.97 -0.06 0.00 0.01 0.00 0.00 42.46 38.44 1xxh s ILE 68 CO 0.00 -0.94 -0.01 -0.89 0.00 0.00 0.00 174.94 173.10 1xxh s THR 69 N 9.28 2.50 -0.65 2.92 2.01 -0.87 -4.72 115.64 126.11 1xxh s THR 69 Ca 0.67 -2.02 0.18 0.00 0.31 0.00 0.00 61.69 60.83 1xxh s THR 69 Cb -0.11 -2.77 -0.21 0.00 0.01 0.00 0.00 72.50 69.41 1xxh s THR 69 CO 0.15 -0.19 0.67 0.00 -0.69 0.00 0.00 174.62 174.57 1xxh n ALA 70 N -0.93 3.95 -3.36 7.40 0.00 -1.26 -4.47 120.51 121.84 1xxh n ALA 70 Ca -0.04 -0.49 -0.26 0.00 0.00 0.00 0.00 53.44 52.65 1xxh n ALA 70 Cb 0.63 -0.64 -0.08 0.00 0.00 0.00 0.00 19.45 19.36 1xxh n ALA 70 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1xxh n THR 71 N -1.58 1.77 -0.96 0.00 -1.04 -1.26 -4.63 114.28 106.58 1xxh n THR 71 Ca 0.02 -4.99 -0.33 0.00 -2.04 0.00 0.00 64.05 56.71 1xxh n THR 71 Cb 0.32 -2.04 0.14 0.00 -1.82 0.00 0.00 70.33 66.93 1xxh n THR 71 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 1xxh n PRO 72 N 0.92 -0.05 -3.76 -2.82 -0.02 -1.26 -4.99 135.00 123.03 1xxh n PRO 72 Ca 0.28 0.06 -0.36 0.00 -2.02 0.00 0.00 63.50 61.46 1xxh n PRO 72 Cb 0.44 -2.37 -0.07 0.00 -0.02 0.00 0.00 33.50 31.47 1xxh n PRO 72 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1xxh n GLY 74 N 2.66 -0.70 0.10 0.00 0.00 -1.26 -3.98 105.19 102.00 1xxh n GLY 74 Ca -0.17 -0.12 -0.13 0.00 0.00 0.00 0.00 46.02 45.60 1xxh n GLY 74 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1xxh n VAL 75 N -0.93 1.15 -1.50 1.61 0.24 -1.26 -4.45 118.33 113.19 1xxh n VAL 75 Ca 0.14 -0.50 -0.45 0.00 -2.04 0.00 0.00 64.34 61.50 1xxh n VAL 75 Cb 0.07 -1.08 -0.02 0.00 -1.47 0.00 0.00 33.84 31.34 1xxh n VAL 75 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1xxh h ASP 77 N 1.41 0.06 -0.11 0.00 3.32 -1.95 -0.70 116.42 118.46 1xxh h ASP 77 Ca -0.36 0.01 -0.17 0.00 0.02 0.00 0.00 57.03 56.54 1xxh h ASP 77 Cb 1.39 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.95 1xxh h ASP 77 CO 0.57 0.01 -0.58 0.78 -1.72 0.00 0.00 179.24 178.30 1xxh h ASN 78 N 0.05 0.70 -0.63 6.45 2.35 -1.90 -2.99 115.58 119.61 1xxh h ASN 78 Ca 0.57 -0.64 -0.05 0.00 -0.55 0.00 0.00 56.30 55.62 1xxh h ASN 78 Cb 2.18 -0.21 -0.03 0.00 0.05 0.00 0.00 38.32 40.31 1xxh h ASN 78 CO -0.05 1.23 0.19 0.00 -1.65 0.00 0.00 177.43 177.15 1xxh h ARG 80 N 0.91 -0.06 -0.06 0.00 3.08 -1.55 -2.27 114.38 114.44 1xxh h ARG 80 Ca 0.20 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.20 1xxh h ARG 80 Cb 0.31 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.36 1xxh h ARG 80 CO -0.00 0.10 -0.23 0.93 -1.07 0.00 0.00 179.97 179.70 1xxh h GLU 81 N -0.21 0.09 -0.30 0.04 5.08 -1.55 -2.07 114.58 115.67 1xxh h GLU 81 Ca -0.01 -0.03 -0.12 0.00 -1.00 0.00 0.00 59.36 58.21 1xxh h GLU 81 Cb 0.18 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 1xxh h GLU 81 CO 0.01 0.32 -0.31 0.82 -1.00 0.00 0.00 179.01 178.85 1xxh h ILE 82 N 0.09 1.28 -0.29 3.13 2.04 -1.20 -2.58 117.51 119.98 1xxh h ILE 82 Ca 0.02 -1.43 -0.18 0.00 1.00 0.00 0.00 64.86 64.27 1xxh h ILE 82 Cb 0.45 1.38 -0.09 0.00 -0.74 0.00 0.00 36.82 37.83 1xxh h ILE 82 CO 0.03 0.46 0.23 1.21 0.00 0.00 0.00 178.15 180.08 1xxh n GLU 83 N -4.08 1.44 -0.74 2.37 4.07 -0.78 -3.09 120.64 119.83 1xxh n GLU 83 Ca -0.01 -0.92 -0.01 0.00 -0.06 0.00 0.00 57.16 56.16 1xxh n GLU 83 Cb 0.47 -1.36 -0.01 0.00 -0.06 0.00 0.00 31.44 30.47 1xxh n GLU 83 CO 0.00 0.00 0.00 1.04 -0.06 0.00 0.00 177.13 178.11 1xxh n GLN 84 N 0.46 0.00 -1.45 5.31 6.02 -0.99 -5.02 117.38 121.71 1xxh n GLN 84 Ca 0.18 -0.74 -0.08 0.00 -0.01 0.00 0.00 57.00 56.35 1xxh n GLN 84 Cb 0.68 -0.02 -0.03 0.00 1.02 0.00 0.00 30.24 31.89 1xxh n GLN 84 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1xxh n GLY 85 N 0.07 0.56 2.48 1.08 0.00 -1.18 -4.87 105.19 103.33 1xxh n GLY 85 Ca -0.05 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.68 1xxh n GLY 85 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1xxh s ARG 86 N -3.10 0.76 -0.04 1.61 1.70 -1.11 -5.03 118.95 113.74 1xxh s ARG 86 Ca 0.00 -1.65 0.01 0.00 -0.47 0.00 0.00 55.73 53.62 1xxh s ARG 86 Cb 0.00 -1.49 0.02 0.00 -0.57 0.00 0.00 34.95 32.91 1xxh s ARG 86 CO 0.00 -1.25 -0.05 0.12 -1.08 0.00 0.00 175.30 173.03 1xxh s PHE 87 N 0.67 0.80 0.55 5.89 5.36 -1.26 -4.60 117.98 125.40 1xxh s PHE 87 Ca 0.22 -0.23 0.33 0.00 -0.96 0.00 0.00 56.93 56.29 1xxh s PHE 87 Cb -0.16 -0.68 1.48 0.00 -0.34 0.00 0.00 43.02 43.33 1xxh s PHE 87 CO -0.05 -0.18 1.83 0.28 -1.46 0.00 0.00 175.22 175.64 1xxh h VAL 88 N 6.04 0.43 -0.26 3.12 2.07 -1.98 -0.43 116.25 125.24 1xxh h VAL 88 Ca -0.37 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.15 1xxh h VAL 88 Cb 1.16 0.48 0.00 0.00 -1.52 0.00 0.00 31.29 31.41 1xxh h VAL 88 CO 0.48 0.00 0.00 0.47 0.02 0.00 0.00 177.57 178.54 1xxh n ASP 89 N -4.07 2.65 -4.19 0.57 8.00 -1.26 -4.84 116.55 113.41 1xxh n ASP 89 Ca 0.19 -1.87 -0.41 0.00 0.71 0.00 0.00 54.79 53.42 1xxh n ASP 89 Cb 1.04 -0.17 -0.07 0.00 -0.02 0.00 0.00 41.12 41.90 1xxh n ASP 89 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1xxh s LEU 90 N -0.97 5.78 -0.23 0.64 2.96 -0.17 -0.50 118.68 126.19 1xxh s LEU 90 Ca 0.20 -2.48 -0.17 0.00 -0.22 0.00 0.00 54.13 51.46 1xxh s LEU 90 Cb 0.11 -2.00 -0.03 0.00 0.50 0.00 0.00 46.19 44.77 1xxh s LEU 90 CO 0.15 -0.53 0.47 -0.63 -1.32 0.00 0.00 176.35 174.48 1xxh s ILE 91 N 0.50 5.13 -0.37 6.68 1.01 -0.54 -4.52 121.20 129.08 1xxh s ILE 91 Ca 0.13 0.82 -0.10 0.00 0.00 0.00 0.00 60.65 61.50 1xxh s ILE 91 Cb -0.20 -3.79 0.04 0.00 0.01 0.00 0.00 42.46 38.52 1xxh s ILE 91 CO -0.04 0.16 0.19 -1.61 0.00 0.00 0.00 174.94 173.65 1xxh s GLU 92 N 1.82 2.75 -0.12 2.79 2.02 -1.26 -1.34 118.70 125.35 1xxh s GLU 92 Ca 0.21 -1.16 -0.03 0.00 0.02 0.00 0.00 54.97 54.01 1xxh s GLU 92 Cb -0.15 -3.69 -0.03 0.00 0.10 0.00 0.00 34.13 30.36 1xxh s GLU 92 CO 0.09 -0.73 -0.01 0.42 0.02 0.00 0.00 175.26 175.05 1xxh s ILE 93 N 1.51 4.18 -0.50 -1.63 1.01 0.06 -5.01 121.20 120.80 1xxh s ILE 93 Ca 0.01 -0.28 -0.03 0.00 0.00 0.00 0.00 60.65 60.36 1xxh s ILE 93 Cb -0.20 -2.79 0.13 0.00 0.01 0.00 0.00 42.46 39.61 1xxh s ILE 93 CO 0.05 0.55 0.31 -0.62 0.00 0.00 0.00 174.94 175.23 1xxh s ASP 94 N -0.30 5.23 0.54 3.58 -1.08 -1.26 -1.49 116.67 121.88 1xxh s ASP 94 Ca 0.06 -2.40 0.22 0.00 -0.52 0.00 0.00 52.55 49.91 1xxh s ASP 94 Cb -0.12 -1.84 1.40 0.00 -1.46 0.00 0.00 42.92 40.90 1xxh s ASP 94 CO 0.02 -0.46 2.08 0.00 0.52 0.00 0.00 175.17 177.33 1xxh h ALA 95 N 7.58 2.18 0.00 3.66 0.00 -1.66 0.39 119.26 131.41 1xxh h ALA 95 Ca -0.08 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1xxh h ALA 95 Cb 1.00 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1xxh h ALA 95 CO 0.71 -0.33 0.00 0.00 0.00 0.00 0.00 179.25 179.63 1xxh n ALA 96 N -2.55 2.48 -2.70 0.00 0.00 -1.26 -4.59 120.51 111.90 1xxh n ALA 96 Ca 0.03 -0.16 -0.42 0.00 0.00 0.00 0.00 53.44 52.89 1xxh n ALA 96 Cb 0.35 -1.45 -0.03 0.00 0.00 0.00 0.00 19.45 18.32 1xxh n ALA 96 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1xxh s SER 97 N -2.17 7.28 -0.13 0.00 0.15 0.14 -4.96 113.70 114.00 1xxh s SER 97 Ca 0.37 1.56 -0.23 0.00 0.70 0.00 0.00 55.95 58.34 1xxh s SER 97 Cb 0.19 -2.55 -0.21 0.00 -1.71 0.00 0.00 66.02 61.74 1xxh s SER 97 CO 0.35 -0.32 0.61 0.03 1.20 0.00 0.00 173.24 175.11 1xxh h ARG 98 N 6.93 0.00 0.00 5.44 2.47 -1.87 -3.30 114.38 124.05 1xxh h ARG 98 Ca -0.37 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.33 1xxh h ARG 98 Cb 1.19 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 29.51 1xxh h ARG 98 CO 0.79 0.81 -0.10 1.15 0.56 0.00 0.00 179.97 183.19 1xxh h THR 99 N -1.00 1.02 -0.61 2.04 2.02 -1.97 -2.89 112.91 111.52 1xxh h THR 99 Ca -0.01 -0.33 0.00 0.00 0.77 0.00 0.00 66.41 66.84 1xxh h THR 99 Cb 0.83 1.18 0.00 0.00 -1.74 0.00 0.00 68.15 68.42 1xxh h THR 99 CO -0.01 0.09 0.00 0.29 0.37 0.00 0.00 175.52 176.27 1xxh n LYS 100 N -4.35 2.48 -0.25 6.66 5.02 -1.26 -4.59 118.16 121.87 1xxh n LYS 100 Ca -0.03 -2.29 0.17 0.00 -2.02 0.00 0.00 58.31 54.15 1xxh n LYS 100 Cb 0.17 -1.50 0.48 0.00 -0.02 0.00 0.00 35.03 34.16 1xxh n LYS 100 CO 0.00 0.00 0.00 -0.39 -0.52 0.00 0.00 177.40 176.49 1xxh h VAL 101 N 3.80 0.72 0.00 -0.18 -1.51 -1.58 0.23 116.25 117.72 1xxh h VAL 101 Ca 0.00 -0.16 -0.08 0.00 -1.23 0.00 0.00 66.70 65.23 1xxh h VAL 101 Cb 0.87 0.20 -0.01 0.00 -2.13 0.00 0.00 31.29 30.22 1xxh h VAL 101 CO 0.00 0.09 -0.39 1.05 -1.23 0.00 0.00 177.57 177.09 1xxh h GLU 102 N 0.47 0.00 0.00 5.19 9.09 -1.86 -2.20 114.58 125.27 1xxh h GLU 102 Ca 0.46 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.87 1xxh h GLU 102 Cb 1.05 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.15 1xxh h GLU 102 CO -0.19 0.39 -0.14 -0.44 0.05 0.00 0.00 179.01 178.68 1xxh h ASP 103 N 0.00 0.00 0.11 3.06 3.32 -1.18 -2.52 116.42 119.21 1xxh h ASP 103 Ca -0.00 -0.02 -0.15 0.00 0.02 0.00 0.00 57.03 56.87 1xxh h ASP 103 Cb 1.27 0.00 0.02 0.00 0.22 0.00 0.00 39.33 40.84 1xxh h ASP 103 CO 0.05 0.01 -0.66 0.74 -1.72 0.00 0.00 179.24 177.66 1xxh h THR 104 N 0.00 1.55 -0.07 0.35 2.02 -0.40 -3.15 112.91 113.20 1xxh h THR 104 Ca 0.00 -2.47 -0.03 0.00 0.77 0.00 0.00 66.41 64.68 1xxh h THR 104 Cb 0.86 3.19 -0.00 0.00 -1.74 0.00 0.00 68.15 70.45 1xxh h THR 104 CO 0.00 0.69 -0.09 0.08 0.37 0.00 0.00 175.52 176.58 1xxh h ARG 105 N -0.45 0.19 0.00 6.66 0.11 -1.44 -3.05 114.38 116.39 1xxh h ARG 105 Ca -0.11 -0.10 -0.05 0.00 0.10 0.00 0.00 59.98 59.81 1xxh h ARG 105 Cb 1.51 0.01 -0.01 0.00 1.11 0.00 0.00 29.97 32.59 1xxh h ARG 105 CO 0.12 0.64 -0.23 0.22 0.10 0.00 0.00 179.97 180.82 1xxh h ASP 106 N -0.25 0.00 1.23 0.08 1.82 -1.62 -2.92 116.42 114.75 1xxh h ASP 106 Ca 0.01 0.00 -0.15 0.00 -0.39 0.00 0.00 57.03 56.50 1xxh h ASP 106 Cb 0.61 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 40.60 1xxh h ASP 106 CO 0.02 0.23 -0.80 -0.07 -1.61 0.00 0.00 179.24 177.02 1xxh h LEU 107 N 0.00 0.00 0.00 2.28 3.38 -1.59 -2.61 115.31 116.77 1xxh h LEU 107 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1xxh h LEU 107 Cb 0.43 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.18 1xxh h LEU 107 CO 0.03 0.65 -0.52 -0.07 0.09 0.00 0.00 178.44 178.62 1xxh h LEU 108 N 0.00 0.00 0.00 1.67 3.38 -1.43 -3.27 115.31 115.66 1xxh h LEU 108 Ca -0.04 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1xxh h LEU 108 Cb 1.53 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.28 1xxh h LEU 108 CO 0.08 0.02 -1.38 0.47 0.09 0.00 0.00 178.44 177.72 1xxh n ASP 109 N -2.70 0.47 -3.22 -0.43 8.00 -1.11 -4.41 116.55 113.15 1xxh n ASP 109 Ca 0.02 -0.08 -0.33 0.00 0.71 0.00 0.00 54.79 55.12 1xxh n ASP 109 Cb 0.52 1.18 -0.01 0.00 -0.02 0.00 0.00 41.12 42.78 1xxh n ASP 109 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1xxh n ASN 110 N -2.19 5.70 -4.70 -2.24 3.02 -0.98 -5.04 115.26 108.83 1xxh n ASN 110 Ca -0.01 -3.69 -0.42 0.00 -0.03 0.00 0.00 54.58 50.43 1xxh n ASN 110 Cb 0.50 -0.81 -0.03 0.00 -0.61 0.00 0.00 39.78 38.83 1xxh n ASN 110 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1xxh s VAL 111 N -4.45 4.03 -0.27 2.41 1.01 -1.25 -4.85 120.40 117.03 1xxh s VAL 111 Ca 0.45 1.41 -0.21 0.00 0.00 0.00 0.00 61.98 63.63 1xxh s VAL 111 Cb 0.25 -3.91 -0.01 0.00 0.00 0.00 0.00 36.38 32.71 1xxh s VAL 111 CO -0.14 0.04 0.68 -1.10 0.00 0.00 0.00 175.10 174.57 1xxh s GLN 112 N 1.87 4.05 -0.46 2.72 -0.21 -1.26 -4.97 119.66 121.40 1xxh s GLN 112 Ca 0.59 0.55 -0.03 0.00 0.02 0.00 0.00 55.36 56.49 1xxh s GLN 112 Cb -0.28 -3.68 0.14 0.00 1.00 0.00 0.00 33.01 30.20 1xxh s GLN 112 CO 0.25 -0.50 2.49 0.66 -2.12 0.00 0.00 175.29 176.08 1xxh n TYR 113 N 5.86 1.77 -3.15 0.91 4.02 -1.26 -4.77 117.16 120.54 1xxh n TYR 113 Ca 0.01 -2.04 0.05 0.00 -0.01 0.00 0.00 57.90 55.91 1xxh n TYR 113 Cb 0.49 -1.27 -0.01 0.00 -0.02 0.00 0.00 39.34 38.53 1xxh n TYR 113 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1xxh s ALA 114 N -2.03 -3.01 0.23 -0.72 0.00 -1.26 -5.02 121.76 109.95 1xxh s ALA 114 Ca 0.52 1.56 -0.32 0.00 0.00 0.00 0.00 51.96 53.72 1xxh s ALA 114 Cb 0.36 -2.40 -0.12 0.00 0.00 0.00 0.00 23.12 20.96 1xxh s ALA 114 CO -0.17 -1.46 1.69 -2.30 0.00 0.00 0.00 175.76 173.52 1xxh n PRO 115 N 5.44 2.74 0.08 0.00 -0.02 -1.26 -4.92 135.00 137.05 1xxh n PRO 115 Ca -0.03 0.98 -0.03 0.00 -2.02 0.00 0.00 63.50 62.40 1xxh n PRO 115 Cb 0.53 -2.81 -0.06 0.00 -0.02 0.00 0.00 33.50 31.13 1xxh n PRO 115 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1xxh h ALA 116 N 6.29 0.55 0.00 3.55 0.00 -1.91 -3.42 119.26 124.32 1xxh h ALA 116 Ca -0.44 -0.78 0.00 0.00 0.00 0.00 0.00 54.91 53.69 1xxh h ALA 116 Cb 1.21 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1xxh h ALA 116 CO 0.92 1.00 0.00 0.54 0.00 0.00 0.00 179.25 181.70 1xxh n ARG 117 N -3.22 0.04 -4.56 0.00 1.74 -1.26 -5.09 116.66 104.31 1xxh n ARG 117 Ca -0.02 0.00 -0.27 0.00 -0.77 0.00 0.00 57.85 56.79 1xxh n ARG 117 Cb 0.86 -0.00 -0.11 0.00 -1.02 0.00 0.00 32.46 32.19 1xxh n ARG 117 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1xxh s GLY 118 N 0.00 2.40 0.09 -0.13 0.00 -1.26 -5.05 107.32 103.37 1xxh s GLY 118 Ca 0.00 -2.23 -0.35 0.00 0.00 0.00 0.00 44.72 42.15 1xxh s GLY 118 CO 0.00 -2.06 1.58 3.21 0.00 0.00 0.00 173.10 175.83 1xxh h ARG 119 N 1.81 -0.93 -5.83 2.90 2.47 -1.82 -3.43 114.38 109.57 1xxh h ARG 119 Ca -0.43 0.06 -0.59 0.00 -1.26 0.00 0.00 59.98 57.76 1xxh h ARG 119 Cb 1.24 0.21 -0.07 0.00 -1.65 0.00 0.00 29.97 29.71 1xxh h ARG 119 CO 0.77 -0.62 -0.39 -0.06 0.56 0.00 0.00 179.97 180.24 1xxh s PHE 120 N -5.93 1.98 -0.26 3.04 2.99 -1.26 -4.74 117.98 113.80 1xxh s PHE 120 Ca -0.18 -0.77 -0.03 0.00 0.00 0.00 0.00 56.93 55.95 1xxh s PHE 120 Cb 0.05 -1.90 0.02 0.00 0.00 0.00 0.00 43.02 41.19 1xxh s PHE 120 CO 0.61 -0.18 -0.02 0.21 -0.00 0.00 0.00 175.22 175.84 1xxh s LYS 121 N -4.12 2.85 -0.17 0.44 2.20 -0.04 -4.86 119.74 116.04 1xxh s LYS 121 Ca 0.32 -0.98 -0.17 0.00 -0.36 0.00 0.00 55.97 54.78 1xxh s LYS 121 Cb -0.00 -3.09 -0.04 0.00 -1.51 0.00 0.00 37.83 33.19 1xxh s LYS 121 CO 0.19 -0.43 0.45 0.08 -0.36 0.00 0.00 175.35 175.27 1xxh s VAL 122 N 1.36 5.18 -0.31 4.02 1.01 0.34 -1.86 120.40 130.14 1xxh s VAL 122 Ca 0.00 0.84 -0.02 0.00 0.00 0.00 0.00 61.98 62.80 1xxh s VAL 122 Cb -0.17 -3.78 0.05 0.00 0.00 0.00 0.00 36.38 32.48 1xxh s VAL 122 CO -0.03 0.27 0.02 -0.31 0.00 0.00 0.00 175.10 175.05 1xxh s TYR 123 N 1.08 3.27 -0.36 5.22 1.51 -1.07 -1.47 117.35 125.53 1xxh s TYR 123 Ca 0.22 -1.83 -0.14 0.00 -1.01 0.00 0.00 57.07 54.31 1xxh s TYR 123 Cb -0.15 -2.16 -0.00 0.00 -0.11 0.00 0.00 41.96 39.54 1xxh s TYR 123 CO 0.09 -0.80 0.29 -1.17 -1.11 0.00 0.00 175.55 172.84 1xxh s LEU 124 N 1.27 4.69 -0.24 -1.29 2.96 -0.45 -0.87 118.68 124.75 1xxh s LEU 124 Ca -0.04 -0.54 0.02 0.00 -0.22 0.00 0.00 54.13 53.35 1xxh s LEU 124 Cb -0.20 -2.19 0.05 0.00 0.50 0.00 0.00 46.19 44.35 1xxh s LEU 124 CO -0.01 -0.33 -0.14 -0.63 -1.32 0.00 0.00 176.35 173.93 1xxh s ILE 125 N 1.78 2.16 -0.47 6.68 1.01 0.02 -0.76 121.20 131.61 1xxh s ILE 125 Ca 0.07 -1.40 -0.29 0.00 0.00 0.00 0.00 60.65 59.03 1xxh s ILE 125 Cb -0.18 -2.16 0.03 0.00 0.01 0.00 0.00 42.46 40.16 1xxh s ILE 125 CO 0.11 0.15 1.20 -0.62 0.00 0.00 0.00 174.94 175.78 1xxh s ASP 126 N 1.17 6.56 -0.23 3.58 -1.08 -0.55 -2.01 116.67 124.10 1xxh s ASP 126 Ca -0.04 0.51 -0.03 0.00 -0.52 0.00 0.00 52.55 52.47 1xxh s ASP 126 Cb -0.18 -2.55 0.01 0.00 -1.46 0.00 0.00 42.92 38.75 1xxh s ASP 126 CO -0.07 -1.31 0.06 -0.62 0.52 0.00 0.00 175.17 173.75 1xxh n GLU 127 N 7.94 -3.32 0.11 4.34 1.02 0.33 -2.69 120.64 128.37 1xxh n GLU 127 Ca 0.13 2.67 0.06 0.00 -0.02 0.00 0.00 57.16 59.99 1xxh n GLU 127 Cb 0.49 -4.60 0.01 0.00 -0.02 0.00 0.00 31.44 27.32 1xxh n GLU 127 CO 0.00 0.00 0.00 -0.39 1.18 0.00 0.00 177.13 177.92 1xxh h VAL 128 N 3.49 0.35 0.00 2.62 -1.51 -1.77 -3.26 116.25 116.16 1xxh h VAL 128 Ca -0.14 -1.58 0.00 0.00 -1.23 0.00 0.00 66.70 63.75 1xxh h VAL 128 Cb 0.44 1.96 0.00 0.00 -2.13 0.00 0.00 31.29 31.55 1xxh h VAL 128 CO 0.06 0.20 0.00 0.00 -1.23 0.00 0.00 177.57 176.60 1xxh n HIS 129 N -2.94 0.00 -0.33 5.19 1.44 -1.26 -1.10 115.22 116.23 1xxh n HIS 129 Ca -0.02 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 55.81 1xxh n HIS 129 Cb 0.68 -0.42 0.31 0.00 0.12 0.00 0.00 29.99 30.67 1xxh n HIS 129 CO 0.00 0.00 0.00 -0.12 -2.81 0.00 0.00 176.34 173.41 1xxh n MET 130 N -1.42 2.73 -1.55 -1.40 0.00 -1.23 -4.97 117.12 109.28 1xxh n MET 130 Ca 0.02 -2.61 -0.30 0.00 0.00 0.00 0.00 57.70 54.81 1xxh n MET 130 Cb 0.06 -1.55 0.09 0.00 0.00 0.00 0.00 33.22 31.82 1xxh n MET 130 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 1xxh s LEU 131 N -1.02 2.63 0.44 -0.89 1.43 -0.26 -4.62 118.68 116.39 1xxh s LEU 131 Ca 0.47 1.33 -0.22 0.00 -1.03 0.00 0.00 54.13 54.68 1xxh s LEU 131 Cb 0.25 -3.96 -0.09 0.00 0.03 0.00 0.00 46.19 42.42 1xxh s LEU 131 CO 0.32 -1.94 1.06 -0.94 0.23 0.00 0.00 176.35 175.08 1xxh s SER 132 N -3.89 6.53 0.53 2.29 1.04 -1.26 -4.86 113.70 114.08 1xxh s SER 132 Ca 0.61 2.02 0.25 0.00 0.48 0.00 0.00 55.95 59.31 1xxh s SER 132 Cb -0.14 -2.58 1.40 0.00 0.10 0.00 0.00 66.02 64.80 1xxh s SER 132 CO 0.54 -0.66 2.00 0.03 0.98 0.00 0.00 173.24 176.14 1xxh h ARG 133 N 2.08 0.00 0.00 4.02 2.47 -1.98 0.12 114.38 121.08 1xxh h ARG 133 Ca -0.49 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.23 1xxh h ARG 133 Cb 1.22 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.54 1xxh h ARG 133 CO 0.61 0.00 0.00 1.58 0.56 0.00 0.00 179.97 182.72 1xxh n HIS 134 N -4.35 0.00 0.31 3.04 -0.00 -1.26 -3.62 115.22 109.34 1xxh n HIS 134 Ca 0.09 0.00 0.21 0.00 -0.00 0.00 0.00 57.72 58.02 1xxh n HIS 134 Cb 0.58 -0.43 1.10 0.00 -0.00 0.00 0.00 29.99 31.23 1xxh n HIS 134 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.34 177.00 1xxh h SER 135 N 0.00 0.00 -0.80 0.26 4.64 -1.88 -1.64 113.55 114.12 1xxh h SER 135 Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 1xxh h SER 135 Cb 0.00 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.05 1xxh h SER 135 CO 0.00 0.00 0.42 0.15 -0.87 0.00 0.00 176.83 176.53 1xxh h PHE 136 N 0.00 1.13 0.00 4.77 3.57 -0.87 -1.29 116.94 124.25 1xxh h PHE 136 Ca 0.00 -0.04 -0.11 0.00 3.53 0.00 0.00 57.97 61.36 1xxh h PHE 136 Cb 0.05 -0.36 -0.02 0.00 2.79 0.00 0.00 35.95 38.42 1xxh h PHE 136 CO 0.00 0.80 -0.51 -0.91 -2.23 0.00 0.00 178.31 175.46 1xxh h ASN 137 N 1.14 0.00 -0.90 0.41 2.35 -1.36 -2.85 115.58 114.37 1xxh h ASN 137 Ca 0.28 0.00 0.08 0.00 -0.55 0.00 0.00 56.30 56.12 1xxh h ASN 137 Cb 0.07 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 38.37 1xxh h ASN 137 CO -0.04 0.51 0.58 0.00 -1.65 0.00 0.00 177.43 176.83 1xxh h ALA 138 N 1.49 1.57 0.48 -0.83 0.00 -1.16 -2.37 119.26 118.44 1xxh h ALA 138 Ca -0.01 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1xxh h ALA 138 Cb 1.14 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1xxh h ALA 138 CO 0.07 0.27 -0.23 1.25 0.00 0.00 0.00 179.25 180.60 1xxh h LEU 139 N 0.96 -0.54 -0.48 0.00 5.85 -1.29 -2.84 115.31 116.96 1xxh h LEU 139 Ca 0.41 0.02 0.05 0.00 0.84 0.00 0.00 57.88 59.20 1xxh h LEU 139 Cb 0.31 0.14 -0.06 0.00 0.37 0.00 0.00 40.66 41.42 1xxh h LEU 139 CO -0.17 -0.20 -0.25 -0.11 -0.34 0.00 0.00 178.44 177.37 1xxh n LEU 140 N -4.77 -0.45 0.05 2.25 -0.00 -0.95 0.42 117.00 113.55 1xxh n LEU 140 Ca -0.08 0.84 -0.13 0.00 -0.00 0.00 0.00 56.01 56.65 1xxh n LEU 140 Cb 0.25 -0.13 -0.08 0.00 -0.00 0.00 0.00 43.42 43.46 1xxh n LEU 140 CO 0.19 -0.71 0.77 0.11 -0.00 0.00 0.00 177.39 177.75 1xxh h LYS 141 N 0.00 -0.08 0.00 1.96 1.57 -1.54 -1.11 116.57 117.37 1xxh h LYS 141 Ca 0.10 0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.88 1xxh h LYS 141 Cb 0.22 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.55 1xxh h LYS 141 CO -0.45 0.10 -0.03 1.15 -0.57 0.00 0.00 179.45 179.65 1xxh h THR 142 N -0.25 0.69 0.07 -0.16 2.02 0.13 -1.64 112.91 113.78 1xxh h THR 142 Ca -0.01 -0.10 -0.25 0.00 0.77 0.00 0.00 66.41 66.82 1xxh h THR 142 Cb 0.22 1.06 -0.01 0.00 -1.74 0.00 0.00 68.15 67.68 1xxh h THR 142 CO 0.01 0.02 -1.19 -0.07 0.37 0.00 0.00 175.52 174.67 1xxh h LEU 143 N 0.00 0.25 -0.17 2.58 3.38 0.28 -2.50 115.31 119.12 1xxh h LEU 143 Ca -0.00 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.68 1xxh h LEU 143 Cb 0.06 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 1xxh h LEU 143 CO 0.00 1.22 0.06 -0.08 0.09 0.00 0.00 178.44 179.73 1xxh h GLU 144 N 0.04 0.26 -3.12 1.13 4.57 -0.24 -3.34 114.58 113.89 1xxh h GLU 144 Ca -0.10 -0.05 -0.62 0.00 -1.18 0.00 0.00 59.36 57.40 1xxh h GLU 144 Cb 1.90 -0.04 -0.40 0.00 -0.16 0.00 0.00 28.75 30.05 1xxh h GLU 144 CO 0.17 0.37 -0.70 -2.00 -1.18 0.00 0.00 179.01 175.67 1xxh s GLU 145 N -5.44 1.50 0.03 1.92 2.12 -1.03 -5.11 118.70 112.70 1xxh s GLU 145 Ca -0.14 -2.20 -0.13 0.00 0.36 0.00 0.00 54.97 52.86 1xxh s GLU 145 Cb 0.07 -2.65 -0.06 0.00 0.26 0.00 0.00 34.13 31.75 1xxh s GLU 145 CO 0.71 -1.14 0.42 -1.25 -0.54 0.00 0.00 175.26 173.45 1xxh s PRO 146 N 0.16 3.88 1.23 4.30 0.04 -0.94 -4.67 135.00 138.99 1xxh s PRO 146 Ca 0.17 0.35 -0.16 0.00 0.04 0.00 0.00 61.00 61.40 1xxh s PRO 146 Cb -0.25 -3.14 0.30 0.00 0.04 0.00 0.00 34.50 31.45 1xxh s PRO 146 CO 0.00 0.64 1.01 -1.25 0.04 0.00 0.00 177.00 177.45 1xxh s PRO 147 N -1.38 -1.42 0.05 0.56 0.04 -1.26 -4.96 135.00 126.64 1xxh s PRO 147 Ca 0.27 0.48 -0.09 0.00 0.04 0.00 0.00 61.00 61.70 1xxh s PRO 147 Cb -0.16 -1.53 -0.32 0.00 0.04 0.00 0.00 34.50 32.54 1xxh s PRO 147 CO 0.15 -3.96 1.07 0.93 0.04 0.00 0.00 177.00 175.23 1xxh h GLU 148 N -2.78 0.39 0.01 4.56 5.08 -1.98 -3.36 114.58 116.50 1xxh h GLU 148 Ca -0.55 -0.67 -0.21 0.00 -1.00 0.00 0.00 59.36 56.94 1xxh h GLU 148 Cb 1.33 0.25 -0.03 0.00 0.50 0.00 0.00 28.75 30.81 1xxh h GLU 148 CO 0.44 1.32 -0.99 1.12 -1.00 0.00 0.00 179.01 179.89 1xxh h HIS 149 N 0.11 0.04 -3.27 4.33 2.07 -1.93 -3.45 115.15 113.05 1xxh h HIS 149 Ca -0.19 -0.03 -0.59 0.00 -2.85 0.00 0.00 60.37 56.71 1xxh h HIS 149 Cb 2.06 -0.00 -0.09 0.00 2.57 0.00 0.00 27.41 31.96 1xxh h HIS 149 CO 0.09 1.00 0.49 0.08 -3.07 0.00 0.00 177.93 176.52 1xxh s VAL 150 N -2.76 4.83 0.18 6.12 1.01 -1.26 -0.86 120.40 127.66 1xxh s VAL 150 Ca 0.00 1.60 0.11 0.00 0.00 0.00 0.00 61.98 63.69 1xxh s VAL 150 Cb 0.10 -4.13 -0.04 0.00 0.00 0.00 0.00 36.38 32.31 1xxh s VAL 150 CO 0.82 -0.08 -0.24 -0.54 0.00 0.00 0.00 175.10 175.06 1xxh s LYS 151 N 2.86 1.52 0.09 2.72 -0.14 -0.78 -4.65 119.74 121.38 1xxh s LYS 151 Ca 0.35 -1.49 0.09 0.00 -1.36 0.00 0.00 55.97 53.57 1xxh s LYS 151 Cb -0.15 -1.87 -0.04 0.00 -1.68 0.00 0.00 37.83 34.09 1xxh s LYS 151 CO 0.07 0.41 -0.22 -0.06 -0.76 0.00 0.00 175.35 174.79 1xxh s PHE 152 N -1.58 2.43 -0.28 3.18 0.08 -0.94 -2.61 117.98 118.27 1xxh s PHE 152 Ca 0.20 -0.32 -0.02 0.00 0.12 0.00 0.00 56.93 56.90 1xxh s PHE 152 Cb -0.08 -1.35 0.09 0.00 -0.57 0.00 0.00 43.02 41.11 1xxh s PHE 152 CO 0.09 0.30 0.09 -0.51 -0.10 0.00 0.00 175.22 175.10 1xxh s LEU 153 N -1.82 1.54 0.00 -0.37 1.43 -0.05 -0.91 118.68 118.51 1xxh s LEU 153 Ca 0.15 -1.35 -0.01 0.00 -1.03 0.00 0.00 54.13 51.89 1xxh s LEU 153 Cb -0.10 -0.67 -0.04 0.00 0.03 0.00 0.00 46.19 45.41 1xxh s LEU 153 CO 0.06 -0.40 0.13 -0.76 0.23 0.00 0.00 176.35 175.62 1xxh s LEU 154 N 1.80 4.11 -0.03 1.79 1.43 0.26 -0.80 118.68 127.24 1xxh s LEU 154 Ca 0.07 0.22 0.01 0.00 -1.03 0.00 0.00 54.13 53.40 1xxh s LEU 154 Cb -0.17 -2.46 0.02 0.00 0.03 0.00 0.00 46.19 43.61 1xxh s LEU 154 CO -0.24 0.26 -0.02 0.00 0.23 0.00 0.00 176.35 176.57 1xxh s ALA 155 N -1.28 0.40 0.04 4.21 0.00 -0.85 0.12 121.76 124.40 1xxh s ALA 155 Ca 0.26 0.04 0.02 0.00 0.00 0.00 0.00 51.96 52.28 1xxh s ALA 155 Cb -0.12 -0.28 -0.02 0.00 0.00 0.00 0.00 23.12 22.69 1xxh s ALA 155 CO 0.17 -0.02 -0.08 0.99 0.00 0.00 0.00 175.76 176.83 1xxh s THR 156 N 0.72 0.55 -1.86 0.00 2.01 0.26 0.12 115.64 117.44 1xxh s THR 156 Ca -0.08 -1.01 0.26 0.00 0.31 0.00 0.00 61.69 61.17 1xxh s THR 156 Cb -0.11 -0.60 0.23 0.00 0.01 0.00 0.00 72.50 72.02 1xxh s THR 156 CO -0.01 -0.33 1.48 0.41 -0.69 0.00 0.00 174.62 175.48 1xxh n THR 157 N 1.60 0.00 -3.15 -0.82 -1.04 -1.25 -0.07 114.28 109.54 1xxh n THR 157 Ca -0.22 -0.16 0.05 0.00 -2.04 0.00 0.00 64.05 61.68 1xxh n THR 157 Cb 0.55 0.59 -0.00 0.00 -1.82 0.00 0.00 70.33 69.65 1xxh n THR 157 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1xxh s ASP 158 N -2.47 -0.71 0.22 8.00 2.15 -1.26 -4.75 116.67 117.86 1xxh s ASP 158 Ca 0.24 0.10 0.23 0.00 0.43 0.00 0.00 52.55 53.55 1xxh s ASP 158 Cb 0.19 1.46 0.93 0.00 -0.30 0.00 0.00 42.92 45.19 1xxh s ASP 158 CO 0.52 -0.13 1.71 -2.65 -0.17 0.00 0.00 175.17 174.45 1xxh n PRO 159 N 5.20 0.19 0.38 4.34 -0.02 -1.26 -3.60 135.00 140.23 1xxh n PRO 159 Ca 0.08 0.36 -0.18 0.00 -2.02 0.00 0.00 63.50 61.73 1xxh n PRO 159 Cb 0.57 -1.82 -0.09 0.00 -0.02 0.00 0.00 33.50 32.14 1xxh n PRO 159 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 1xxh h GLN 160 N 0.00 -0.91 -0.23 -0.52 4.20 -1.98 -2.41 115.11 113.25 1xxh h GLN 160 Ca 0.00 0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.77 1xxh h GLN 160 Cb 0.43 0.21 0.00 0.00 0.30 0.00 0.00 27.48 28.42 1xxh h GLN 160 CO 0.00 -0.60 0.00 1.63 -0.67 0.00 0.00 178.83 179.19 1xxh n LYS 161 N -5.49 0.41 -3.87 1.46 5.02 -1.24 -4.54 118.16 109.92 1xxh n LYS 161 Ca -0.14 0.00 -0.36 0.00 -2.02 0.00 0.00 58.31 55.79 1xxh n LYS 161 Cb 0.39 -1.12 -0.12 0.00 -0.02 0.00 0.00 35.03 34.16 1xxh n LYS 161 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1xxh s LEU 162 N -0.44 3.40 0.87 -0.35 1.43 -0.91 -4.85 118.68 117.84 1xxh s LEU 162 Ca 0.00 -0.19 -0.16 0.00 -1.03 0.00 0.00 54.13 52.75 1xxh s LEU 162 Cb 0.00 -1.89 -0.09 0.00 0.03 0.00 0.00 46.19 44.24 1xxh s LEU 162 CO 0.00 0.01 -0.21 -2.65 0.23 0.00 0.00 176.35 173.73 1xxh n PRO 163 N 4.62 -0.02 0.00 1.29 -0.02 -1.26 -4.77 135.00 134.84 1xxh n PRO 163 Ca -0.17 0.01 0.15 0.00 -2.02 0.00 0.00 63.50 61.48 1xxh n PRO 163 Cb 0.52 -1.33 0.74 0.00 -0.02 0.00 0.00 33.50 33.40 1xxh n PRO 163 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1xxh n VAL 164 N -2.58 0.00 0.18 -1.45 0.31 -1.26 -2.87 118.33 110.66 1xxh n VAL 164 Ca 0.03 -0.07 0.06 0.00 -0.01 0.00 0.00 64.34 64.36 1xxh n VAL 164 Cb 0.53 -0.16 0.20 0.00 -0.91 0.00 0.00 33.84 33.50 1xxh n VAL 164 CO 0.00 0.00 0.00 0.71 -1.32 0.00 0.00 176.83 176.22 1xxh h THR 165 N 0.67 0.65 0.00 2.52 1.35 -2.00 -3.12 112.91 112.97 1xxh h THR 165 Ca 0.00 -1.67 -0.27 0.00 -0.55 0.00 0.00 66.41 63.92 1xxh h THR 165 Cb 0.24 2.13 -0.05 0.00 -1.73 0.00 0.00 68.15 68.74 1xxh h THR 165 CO 0.00 0.33 -2.03 -0.38 -0.25 0.00 0.00 175.52 173.19 1xxh n ILE 166 N -3.27 1.04 -0.21 6.82 5.41 -1.17 -4.23 119.36 123.75 1xxh n ILE 166 Ca 0.02 -0.45 -0.02 0.00 1.00 0.00 0.00 62.75 63.29 1xxh n ILE 166 Cb 0.60 -1.03 0.08 0.00 -0.71 0.00 0.00 39.64 38.58 1xxh n ILE 166 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1xxh h LEU 167 N 0.00 0.48 -1.72 1.39 3.38 -1.65 0.56 115.31 117.75 1xxh h LEU 167 Ca -0.41 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.57 1xxh h LEU 167 Cb 1.69 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 42.38 1xxh h LEU 167 CO -0.04 0.32 -0.14 0.77 0.09 0.00 0.00 178.44 179.44 1xxh h SER 168 N 0.62 0.00 -0.35 -0.43 4.64 -1.78 -2.72 113.55 113.52 1xxh h SER 168 Ca 0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.59 1xxh h SER 168 Cb 0.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.26 1xxh h SER 168 CO -0.18 0.14 0.00 0.54 -0.87 0.00 0.00 176.83 176.46 1xxh n ARG 169 N -3.52 2.47 -4.03 4.77 1.74 0.17 -4.92 116.66 113.34 1xxh n ARG 169 Ca -0.01 -1.55 -0.09 0.00 -0.77 0.00 0.00 57.85 55.44 1xxh n ARG 169 Cb 0.29 -1.59 -0.09 0.00 -1.02 0.00 0.00 32.46 30.05 1xxh n ARG 169 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1xxh s LEU 171 N -2.96 6.18 0.73 0.00 2.96 0.21 -4.87 118.68 120.94 1xxh s LEU 171 Ca 0.14 -2.09 -0.15 0.00 -0.22 0.00 0.00 54.13 51.80 1xxh s LEU 171 Cb 0.06 -2.24 0.04 0.00 0.50 0.00 0.00 46.19 44.55 1xxh s LEU 171 CO -0.04 -0.81 1.24 -1.58 -1.32 0.00 0.00 176.35 173.83 1xxh s GLN 172 N 1.33 2.10 -0.28 1.98 0.74 -1.26 -1.84 119.66 122.43 1xxh s GLN 172 Ca 0.12 1.87 0.01 0.00 0.05 0.00 0.00 55.36 57.41 1xxh s GLN 172 Cb -0.19 -1.82 0.16 0.00 1.10 0.00 0.00 33.01 32.26 1xxh s GLN 172 CO -0.02 -1.89 0.46 -0.06 -0.55 0.00 0.00 175.29 173.23 1xxh s PHE 173 N -1.84 -1.17 -0.26 1.67 0.08 0.63 -4.84 117.98 112.26 1xxh s PHE 173 Ca 0.77 0.80 -0.18 0.00 0.12 0.00 0.00 56.93 58.43 1xxh s PHE 173 Cb -0.32 0.08 -0.03 0.00 -0.57 0.00 0.00 43.02 42.18 1xxh s PHE 173 CO 0.45 -0.91 0.54 -1.58 -0.10 0.00 0.00 175.22 173.62 1xxh s HIS 174 N 2.64 3.27 -0.39 0.36 2.46 -1.26 -1.79 115.29 120.57 1xxh s HIS 174 Ca 0.12 0.68 -0.17 0.00 0.47 0.00 0.00 55.06 56.17 1xxh s HIS 174 Cb -0.13 -2.75 0.01 0.00 -0.13 0.00 0.00 32.58 29.58 1xxh s HIS 174 CO -0.24 -0.29 0.43 -0.51 -2.47 0.00 0.00 174.74 171.67 1xxh s LEU 175 N 2.33 4.65 0.37 8.88 1.43 -0.93 -4.94 118.68 130.47 1xxh s LEU 175 Ca 0.22 -0.44 -0.25 0.00 -1.03 0.00 0.00 54.13 52.63 1xxh s LEU 175 Cb -0.16 -2.41 -0.09 0.00 0.03 0.00 0.00 46.19 43.56 1xxh s LEU 175 CO 0.09 -0.50 1.03 -0.54 0.23 0.00 0.00 176.35 176.65 1xxh s LYS 176 N 2.17 4.31 1.17 1.70 1.02 -1.26 -4.58 119.74 124.26 1xxh s LYS 176 Ca 0.13 1.48 -0.14 0.00 0.02 0.00 0.00 55.97 57.47 1xxh s LYS 176 Cb -0.17 -2.65 0.28 0.00 -0.52 0.00 0.00 37.83 34.78 1xxh s LYS 176 CO 0.13 -0.01 1.03 0.00 -0.92 0.00 0.00 175.35 175.58 1xxh s ALA 177 N -1.62 -0.33 -0.15 5.17 0.00 -1.26 -4.99 121.76 118.59 1xxh s ALA 177 Ca 0.55 -0.27 -0.07 0.00 0.00 0.00 0.00 51.96 52.17 1xxh s ALA 177 Cb -0.22 -3.19 -0.04 0.00 0.00 0.00 0.00 23.12 19.68 1xxh s ALA 177 CO 0.27 -3.78 0.10 -0.51 0.00 0.00 0.00 175.76 171.84 1xxh s LEU 178 N -7.16 4.10 1.02 0.00 1.43 -0.92 -5.05 118.68 112.10 1xxh s LEU 178 Ca 0.68 0.29 -0.16 0.00 -1.03 0.00 0.00 54.13 53.91 1xxh s LEU 178 Cb -0.23 -2.01 0.05 0.00 0.03 0.00 0.00 46.19 44.02 1xxh s LEU 178 CO 0.63 0.31 0.15 -0.67 0.23 0.00 0.00 176.35 176.99 1xxh n ASP 179 N 2.67 -2.42 0.11 2.29 2.03 -1.26 -4.14 116.55 115.82 1xxh n ASP 179 Ca -0.18 0.15 -0.13 0.00 0.52 0.00 0.00 54.79 55.14 1xxh n ASP 179 Cb 0.54 -1.07 -0.08 0.00 -0.72 0.00 0.00 41.12 39.78 1xxh n ASP 179 CO 0.00 0.00 0.00 0.58 -1.92 0.00 0.00 177.20 175.86 1xxh h VAL 180 N -1.71 0.88 0.00 5.18 2.07 -1.97 -2.99 116.25 117.70 1xxh h VAL 180 Ca -0.47 -0.64 0.00 0.00 0.82 0.00 0.00 66.70 66.41 1xxh h VAL 180 Cb 1.31 1.24 0.00 0.00 -1.52 0.00 0.00 31.29 32.33 1xxh h VAL 180 CO 0.35 0.14 0.00 -0.62 0.02 0.00 0.00 177.57 177.46 1xxh n GLU 181 N -5.07 0.05 -0.08 1.57 1.02 -1.26 -0.05 120.64 116.81 1xxh n GLU 181 Ca -0.09 0.30 -0.17 0.00 -0.02 0.00 0.00 57.16 57.18 1xxh n GLU 181 Cb 0.23 -1.50 -0.11 0.00 -0.02 0.00 0.00 31.44 30.04 1xxh n GLU 181 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 1xxh h GLN 182 N 0.00 0.00 -0.58 3.49 4.20 -1.87 -2.71 115.11 117.63 1xxh h GLN 182 Ca 0.00 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.65 1xxh h GLN 182 Cb 0.09 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.85 1xxh h GLN 182 CO 0.00 0.91 0.13 0.82 -0.67 0.00 0.00 178.83 180.02 1xxh h ILE 183 N -1.00 1.24 -0.82 2.54 2.04 -1.33 0.16 117.51 120.33 1xxh h ILE 183 Ca -0.16 -0.88 0.08 0.00 1.00 0.00 0.00 64.86 64.90 1xxh h ILE 183 Cb 1.07 0.65 -0.05 0.00 -0.74 0.00 0.00 36.82 37.75 1xxh h ILE 183 CO -0.10 0.33 0.54 -0.09 0.00 0.00 0.00 178.15 178.83 1xxh h ARG 184 N 0.87 0.83 -0.04 2.37 2.43 -0.56 -0.22 114.38 120.07 1xxh h ARG 184 Ca 0.19 -0.05 -0.16 0.00 -0.81 0.00 0.00 59.98 59.14 1xxh h ARG 184 Cb 0.33 -0.19 0.01 0.00 -0.42 0.00 0.00 29.97 29.70 1xxh h ARG 184 CO 0.00 0.55 -0.61 1.25 -1.51 0.00 0.00 179.97 179.66 1xxh h HIS 185 N 0.86 0.69 0.37 2.20 2.76 -0.91 -2.88 115.15 118.24 1xxh h HIS 185 Ca 0.36 -0.35 -0.01 0.00 -2.20 0.00 0.00 60.37 58.17 1xxh h HIS 185 Cb 0.30 -0.09 -0.01 0.00 1.55 0.00 0.00 27.41 29.16 1xxh h HIS 185 CO -0.00 1.15 -0.27 0.37 -1.30 0.00 0.00 177.93 177.88 1xxh h GLN 186 N 0.04 -0.58 -1.35 5.26 5.75 0.28 -1.05 115.11 123.45 1xxh h GLN 186 Ca -0.06 0.04 0.42 0.00 -0.15 0.00 0.00 58.65 58.90 1xxh h GLN 186 Cb 1.29 0.13 -0.11 0.00 1.07 0.00 0.00 27.48 29.86 1xxh h GLN 186 CO 0.12 -0.39 0.90 -0.07 -2.65 0.00 0.00 178.83 176.74 1xxh h LEU 187 N -0.61 0.22 -0.10 -2.39 3.38 -1.18 0.77 115.31 115.40 1xxh h LEU 187 Ca -0.05 0.10 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 1xxh h LEU 187 Cb 0.50 0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.33 1xxh h LEU 187 CO 0.02 -0.11 -0.09 -0.08 0.09 0.00 0.00 178.44 178.27 1xxh h GLU 188 N 0.11 0.23 0.00 1.13 4.81 -1.21 -1.65 114.58 118.00 1xxh h GLU 188 Ca 0.78 -0.12 0.00 0.00 -0.13 0.00 0.00 59.36 59.89 1xxh h GLU 188 Cb 2.56 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.94 1xxh h GLU 188 CO -0.31 0.64 0.00 1.25 -0.73 0.00 0.00 179.01 179.86 1xxh h HIS 189 N -0.17 0.00 0.02 0.92 2.76 0.18 -0.45 115.15 118.40 1xxh h HIS 189 Ca 0.02 0.00 -0.30 0.00 -2.20 0.00 0.00 60.37 57.89 1xxh h HIS 189 Cb 0.60 0.00 -0.05 0.00 1.55 0.00 0.00 27.41 29.51 1xxh h HIS 189 CO 0.09 0.00 -1.73 0.82 -1.30 0.00 0.00 177.93 175.81 1xxh h ILE 190 N 0.00 0.84 0.00 6.26 2.04 -0.69 -3.03 117.51 122.92 1xxh h ILE 190 Ca 0.00 -2.67 -0.16 0.00 1.00 0.00 0.00 64.86 63.03 1xxh h ILE 190 Cb 0.31 2.44 -0.02 0.00 -0.74 0.00 0.00 36.82 38.81 1xxh h ILE 190 CO 0.00 0.54 -0.96 -0.07 0.00 0.00 0.00 178.15 177.66 1xxh h LEU 191 N 0.01 0.00 -0.49 1.44 3.38 -0.95 -2.49 115.31 116.22 1xxh h LEU 191 Ca -0.30 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.52 1xxh h LEU 191 Cb 2.01 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.74 1xxh h LEU 191 CO 0.08 0.64 -0.75 0.78 0.09 0.00 0.00 178.44 179.28 1xxh h ASN 192 N 0.00 0.00 -0.53 -0.43 2.35 -1.23 0.73 115.58 116.48 1xxh h ASN 192 Ca -0.08 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.67 1xxh h ASN 192 Cb 1.56 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.93 1xxh h ASN 192 CO 0.07 0.75 0.00 -0.62 -1.65 0.00 0.00 177.43 175.98 1xxh n GLU 193 N -3.64 2.23 0.00 0.81 1.02 -1.15 -3.24 120.64 116.68 1xxh n GLU 193 Ca -0.01 -1.91 0.00 0.00 -0.02 0.00 0.00 57.16 55.22 1xxh n GLU 193 Cb 0.73 -1.41 0.00 0.00 -0.02 0.00 0.00 31.44 30.74 1xxh n GLU 193 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1xxh n GLU 194 N 1.06 1.02 -3.67 3.49 -0.58 -0.95 -5.01 120.64 115.99 1xxh n GLU 194 Ca 0.18 -0.91 -0.21 0.00 -0.42 0.00 0.00 57.16 55.80 1xxh n GLU 194 Cb 0.45 -0.90 0.04 0.00 -0.57 0.00 0.00 31.44 30.47 1xxh n GLU 194 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 1xxh n HIS 195 N -0.23 -2.03 -4.54 -0.32 8.25 -0.84 -5.01 115.22 110.51 1xxh n HIS 195 Ca 0.00 0.87 -0.34 0.00 -0.26 0.00 0.00 57.72 57.99 1xxh n HIS 195 Cb 0.20 -4.49 -0.12 0.00 1.12 0.00 0.00 29.99 26.69 1xxh n HIS 195 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1xxh s ILE 196 N -3.57 3.71 1.37 1.59 1.01 0.19 -5.04 121.20 120.45 1xxh s ILE 196 Ca 0.08 -0.45 -0.22 0.00 0.00 0.00 0.00 60.65 60.07 1xxh s ILE 196 Cb -0.04 -2.57 0.34 0.00 0.01 0.00 0.00 42.46 40.20 1xxh s ILE 196 CO 0.80 0.54 0.78 0.00 0.00 0.00 0.00 174.94 177.06 1xxh n ALA 197 N 2.98 -4.13 0.00 9.38 0.00 -1.26 -4.63 120.51 122.85 1xxh n ALA 197 Ca -0.18 -1.73 0.00 0.00 0.00 0.00 0.00 53.44 51.53 1xxh n ALA 197 Cb 0.53 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.52 1xxh n ALA 197 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 1xxh n HIS 198 N -5.51 0.00 -2.83 0.00 -0.00 -1.26 -3.95 115.22 101.67 1xxh n HIS 198 Ca 0.11 0.00 -0.42 0.00 -0.00 0.00 0.00 57.72 57.41 1xxh n HIS 198 Cb 0.54 0.00 -0.04 0.00 -0.00 0.00 0.00 29.99 30.50 1xxh n HIS 198 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 1xxh s GLU 199 N 0.00 4.10 0.11 -1.40 2.02 -1.00 -4.98 118.70 117.55 1xxh s GLU 199 Ca 0.00 0.91 -0.22 0.00 0.02 0.00 0.00 54.97 55.68 1xxh s GLU 199 Cb 0.00 -3.69 -0.05 0.00 0.10 0.00 0.00 34.13 30.49 1xxh s GLU 199 CO 0.00 -0.66 1.27 -0.35 0.02 0.00 0.00 175.26 175.54 1xxh n PRO 200 N 6.28 -0.31 -0.37 0.39 -0.04 -1.26 -0.12 135.00 139.58 1xxh n PRO 200 Ca 0.07 1.25 0.34 0.00 -0.04 0.00 0.00 63.50 65.12 1xxh n PRO 200 Cb 0.47 -1.84 0.60 0.00 -0.04 0.00 0.00 33.50 32.69 1xxh n PRO 200 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 1xxh n ARG 201 N -4.64 -0.05 0.17 0.54 1.85 -1.26 0.11 116.66 113.39 1xxh n ARG 201 Ca 0.01 1.27 0.04 0.00 -1.00 0.00 0.00 57.85 58.17 1xxh n ARG 201 Cb 0.18 -2.37 0.27 0.00 -1.05 0.00 0.00 32.46 29.49 1xxh n ARG 201 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1xxh h ALA 202 N 1.75 0.95 -0.03 2.89 0.00 -0.86 -3.05 119.26 120.91 1xxh h ALA 202 Ca 0.83 -0.41 -0.02 0.00 0.00 0.00 0.00 54.91 55.30 1xxh h ALA 202 Cb 2.39 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 20.11 1xxh h ALA 202 CO -0.62 0.56 -0.08 -0.07 0.00 0.00 0.00 179.25 179.05 1xxh h LEU 203 N 0.00 0.11 -1.42 0.00 3.38 0.92 -2.15 115.31 116.14 1xxh h LEU 203 Ca -0.00 -0.61 0.14 0.00 0.09 0.00 0.00 57.88 57.50 1xxh h LEU 203 Cb 1.00 -0.03 -0.06 0.00 0.09 0.00 0.00 40.66 41.66 1xxh h LEU 203 CO 0.06 0.70 0.54 1.56 0.09 0.00 0.00 178.44 181.39 1xxh h GLN 204 N -0.48 0.55 0.76 1.13 4.20 -1.54 0.57 115.11 120.31 1xxh h GLN 204 Ca -0.00 -0.03 -0.04 0.00 0.06 0.00 0.00 58.65 58.64 1xxh h GLN 204 Cb 0.69 -0.12 0.01 0.00 0.30 0.00 0.00 27.48 28.36 1xxh h GLN 204 CO 0.02 0.36 -0.36 -0.07 -0.67 0.00 0.00 178.83 178.11 1xxh h LEU 205 N 0.57 -0.86 -0.97 1.46 3.38 -1.42 -0.51 115.31 116.97 1xxh h LEU 205 Ca 0.41 0.01 0.19 0.00 0.09 0.00 0.00 57.88 58.58 1xxh h LEU 205 Cb 0.77 0.22 -0.11 0.00 0.09 0.00 0.00 40.66 41.63 1xxh h LEU 205 CO -0.16 -0.52 0.56 -0.07 0.09 0.00 0.00 178.44 178.34 1xxh h LEU 206 N -1.19 0.70 0.00 1.67 3.38 -0.56 0.05 115.31 119.35 1xxh h LEU 206 Ca -0.10 0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1xxh h LEU 206 Cb 0.80 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.53 1xxh h LEU 206 CO 0.17 0.23 0.00 0.00 0.09 0.00 0.00 178.44 178.93 1xxh n ALA 207 N -2.36 0.00 -0.34 1.53 0.00 0.19 -2.03 120.51 117.50 1xxh n ALA 207 Ca 0.23 0.00 0.21 0.00 0.00 0.00 0.00 53.44 53.87 1xxh n ALA 207 Cb 0.58 0.09 0.43 0.00 0.00 0.00 0.00 19.45 20.55 1xxh n ALA 207 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 1xxh h ARG 208 N 0.00 0.45 -0.67 0.00 0.11 -1.06 -0.56 114.38 112.66 1xxh h ARG 208 Ca 0.00 -0.03 0.12 0.00 0.10 0.00 0.00 59.98 60.17 1xxh h ARG 208 Cb 0.00 -0.10 -0.12 0.00 1.11 0.00 0.00 29.97 30.85 1xxh h ARG 208 CO 0.00 0.30 -0.32 0.00 0.10 0.00 0.00 179.97 180.05 1xxh h ALA 209 N 1.77 0.06 -2.20 0.08 0.00 -0.78 -3.30 119.26 114.89 1xxh h ALA 209 Ca 0.68 0.20 -0.57 0.00 0.00 0.00 0.00 54.91 55.22 1xxh h ALA 209 Cb 1.44 0.79 -0.05 0.00 0.00 0.00 0.00 17.79 19.96 1xxh h ALA 209 CO -0.51 -0.63 0.65 0.00 0.00 0.00 0.00 179.25 178.75 1xxh s ALA 210 N -6.02 3.51 -0.96 0.00 0.00 -0.22 -4.96 121.76 113.11 1xxh s ALA 210 Ca -0.14 0.30 -0.20 0.00 0.00 0.00 0.00 51.96 51.91 1xxh s ALA 210 Cb 0.17 -3.47 0.10 0.00 0.00 0.00 0.00 23.12 19.92 1xxh s ALA 210 CO 0.70 -0.77 1.25 -1.21 0.00 0.00 0.00 175.76 175.73 1xxh s GLU 211 N 2.45 3.59 -0.18 0.00 2.02 -1.25 -4.14 118.70 121.19 1xxh s GLU 211 Ca 0.47 -1.50 0.00 0.00 0.02 0.00 0.00 54.97 53.96 1xxh s GLU 211 Cb -0.17 -5.07 0.00 0.00 0.10 0.00 0.00 34.13 28.99 1xxh s GLU 211 CO 0.13 -1.94 0.00 0.41 0.02 0.00 0.00 175.26 173.88 1xxh n GLY 212 N 6.02 0.24 3.28 -1.39 0.00 -1.26 -4.88 105.19 107.21 1xxh n GLY 212 Ca 0.27 -0.02 -0.43 0.00 0.00 0.00 0.00 46.02 45.84 1xxh n GLY 212 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xxh s SER 213 N -2.08 6.89 0.23 1.61 1.04 -1.26 -2.17 113.70 117.96 1xxh s SER 213 Ca 0.00 -3.49 -0.08 0.00 0.48 0.00 0.00 55.95 52.86 1xxh s SER 213 Cb 0.00 -2.13 0.40 0.00 0.10 0.00 0.00 66.02 64.39 1xxh s SER 213 CO 0.00 -0.30 1.66 0.25 0.98 0.00 0.00 173.24 175.83 1xxh h LEU 214 N 6.67 -0.21 -0.72 2.42 5.85 -1.92 0.40 115.31 127.81 1xxh h LEU 214 Ca 0.16 0.17 0.10 0.00 0.84 0.00 0.00 57.88 59.14 1xxh h LEU 214 Cb 0.88 0.27 -0.12 0.00 0.37 0.00 0.00 40.66 42.07 1xxh h LEU 214 CO 0.93 -0.11 -0.45 -0.09 -0.34 0.00 0.00 178.44 178.38 1xxh h ARG 215 N 0.16 -0.15 -0.66 1.25 2.43 -1.93 0.53 114.38 116.01 1xxh h ARG 215 Ca 0.38 0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.57 1xxh h ARG 215 Cb 0.65 0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.20 1xxh h ARG 215 CO -0.57 -0.10 0.44 -0.44 -1.51 0.00 0.00 179.97 177.79 1xxh h ASP 216 N -0.15 0.76 -0.84 -3.80 3.32 -1.14 -1.96 116.42 112.61 1xxh h ASP 216 Ca 0.20 -0.02 0.22 0.00 0.02 0.00 0.00 57.03 57.45 1xxh h ASP 216 Cb 0.55 -0.19 -0.04 0.00 0.22 0.00 0.00 39.33 39.86 1xxh h ASP 216 CO -0.78 0.55 0.58 0.00 -1.72 0.00 0.00 179.24 177.88 1xxh h ALA 217 N 1.24 2.55 0.18 3.45 0.00 0.18 0.45 119.26 127.30 1xxh h ALA 217 Ca 0.24 -0.01 -0.33 0.00 0.00 0.00 0.00 54.91 54.81 1xxh h ALA 217 Cb -0.10 0.03 0.01 0.00 0.00 0.00 0.00 17.79 17.73 1xxh h ALA 217 CO -0.05 -0.80 -1.59 -0.07 0.00 0.00 0.00 179.25 176.75 1xxh h LEU 218 N 0.15 0.59 -0.53 0.00 3.38 -0.73 -2.48 115.31 115.69 1xxh h LEU 218 Ca 0.41 -0.77 0.08 0.00 0.09 0.00 0.00 57.88 57.69 1xxh h LEU 218 Cb 1.39 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 41.88 1xxh h LEU 218 CO -0.07 1.63 0.19 0.28 0.09 0.00 0.00 178.44 180.57 1xxh h SER 219 N 0.10 0.19 0.28 -0.43 0.02 0.53 -1.86 113.55 112.38 1xxh h SER 219 Ca -0.28 0.07 -0.01 0.00 -0.84 0.00 0.00 61.79 60.72 1xxh h SER 219 Cb 2.08 0.05 0.00 0.00 0.14 0.00 0.00 62.40 64.68 1xxh h SER 219 CO 0.20 0.13 -0.14 -0.07 -1.14 0.00 0.00 176.83 175.81 1xxh h LEU 220 N 0.37 -0.32 -1.58 5.07 3.38 -1.08 -2.85 115.31 118.30 1xxh h LEU 220 Ca 0.26 -0.21 0.46 0.00 0.09 0.00 0.00 57.88 58.48 1xxh h LEU 220 Cb 0.29 0.08 -0.07 0.00 0.09 0.00 0.00 40.66 41.06 1xxh h LEU 220 CO -0.26 0.14 1.13 0.41 0.09 0.00 0.00 178.44 179.94 1xxh n THR 221 N -5.06 -0.01 0.12 0.22 -1.04 -0.93 0.24 114.28 107.82 1xxh n THR 221 Ca -0.08 1.22 -0.23 0.00 -2.04 0.00 0.00 64.05 62.92 1xxh n THR 221 Cb 0.26 -2.03 -0.14 0.00 -1.82 0.00 0.00 70.33 66.59 1xxh n THR 221 CO 0.00 0.00 0.00 0.44 -0.64 0.00 0.00 175.07 174.87 1xxh h ASP 222 N 0.00 0.82 -0.63 8.00 3.32 -1.11 -2.46 116.42 124.36 1xxh h ASP 222 Ca 0.76 -0.83 -0.09 0.00 0.02 0.00 0.00 57.03 56.89 1xxh h ASP 222 Cb 3.02 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 42.28 1xxh h ASP 222 CO -0.03 1.64 0.04 -0.61 -1.72 0.00 0.00 179.24 178.56 1xxh h GLN 223 N 0.19 1.08 -0.14 3.56 4.15 0.32 -0.54 115.11 123.73 1xxh h GLN 223 Ca -0.22 -0.32 0.01 0.00 0.77 0.00 0.00 58.65 58.89 1xxh h GLN 223 Cb 2.06 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 29.63 1xxh h GLN 223 CO 0.26 1.03 0.05 0.00 -1.93 0.00 0.00 178.83 178.24 1xxh h ALA 224 N 1.01 0.15 0.00 3.38 0.00 -1.29 -0.47 119.26 122.04 1xxh h ALA 224 Ca 0.18 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 1xxh h ALA 224 Cb 0.51 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.30 1xxh h ALA 224 CO 0.02 -0.39 -0.01 0.82 0.00 0.00 0.00 179.25 179.70 1xxh h ILE 225 N 0.13 0.95 -0.08 0.00 2.04 -0.97 0.91 117.51 120.48 1xxh h ILE 225 Ca 0.06 -0.02 -0.15 0.00 1.00 0.00 0.00 64.86 65.74 1xxh h ILE 225 Cb 0.02 1.01 0.01 0.00 -0.74 0.00 0.00 36.82 37.13 1xxh h ILE 225 CO -0.05 0.01 -0.56 0.00 0.00 0.00 0.00 178.15 177.55 1xxh h ALA 226 N 1.99 0.17 0.02 1.87 0.00 0.21 -2.37 119.26 121.15 1xxh h ALA 226 Ca -0.00 -0.53 -0.23 0.00 0.00 0.00 0.00 54.91 54.15 1xxh h ALA 226 Cb 0.01 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1xxh h ALA 226 CO 0.00 0.40 -0.96 0.66 0.00 0.00 0.00 179.25 179.34 1xxh h SER 227 N 0.09 0.46 0.00 0.00 4.64 -0.40 -3.13 113.55 115.21 1xxh h SER 227 Ca -0.05 -0.38 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 1xxh h SER 227 Cb 1.22 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 1xxh h SER 227 CO 0.11 1.19 0.00 0.61 -0.87 0.00 0.00 176.83 177.88 1xxh n GLY 228 N 1.00 -0.68 3.22 -0.77 0.00 0.31 -4.90 105.19 103.37 1xxh n GLY 228 Ca -0.06 -0.12 -0.17 0.00 0.00 0.00 0.00 46.02 45.67 1xxh n GLY 228 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1xxh n ASP 229 N -0.94 -6.79 -2.34 1.61 2.03 -1.15 -3.08 116.55 105.90 1xxh n ASP 229 Ca 0.14 -0.01 -0.20 0.00 0.52 0.00 0.00 54.79 55.25 1xxh n ASP 229 Cb 0.07 -3.81 -0.02 0.00 -0.72 0.00 0.00 41.12 36.64 1xxh n ASP 229 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1xxh n GLY 230 N -0.79 -0.30 3.30 0.27 0.00 -0.91 -4.98 105.19 101.78 1xxh n GLY 230 Ca -0.03 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.85 1xxh n GLY 230 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1xxh s GLN 231 N -4.93 0.70 -0.61 1.61 -0.21 -1.18 -4.46 119.66 110.58 1xxh s GLN 231 Ca 0.00 0.01 -0.10 0.00 0.02 0.00 0.00 55.36 55.29 1xxh s GLN 231 Cb 0.00 0.32 0.16 0.00 1.00 0.00 0.00 33.01 34.49 1xxh s GLN 231 CO 0.00 -0.19 0.50 0.14 -2.12 0.00 0.00 175.29 173.62 1xxh s VAL 232 N -1.05 4.61 -0.00 1.09 -7.23 -1.25 -4.17 120.40 112.39 1xxh s VAL 232 Ca -0.11 -2.19 0.00 0.00 -1.81 0.00 0.00 61.98 57.88 1xxh s VAL 232 Cb -0.04 -3.96 -0.04 0.00 0.56 0.00 0.00 36.38 32.90 1xxh s VAL 232 CO 0.05 -0.88 0.06 -0.94 -0.31 0.00 0.00 175.10 173.08 1xxh s SER 233 N 2.23 5.53 0.30 4.85 1.04 -1.26 -2.38 113.70 124.02 1xxh s SER 233 Ca 0.11 0.10 0.06 0.00 0.48 0.00 0.00 55.95 56.70 1xxh s SER 233 Cb -0.21 -1.55 0.77 0.00 0.10 0.00 0.00 66.02 65.13 1xxh s SER 233 CO -0.03 0.27 1.71 0.74 0.98 0.00 0.00 173.24 176.92 1xxh h THR 234 N 3.28 0.52 -0.77 2.02 2.02 -1.91 0.24 112.91 118.32 1xxh h THR 234 Ca -0.49 -0.17 -0.04 0.00 0.77 0.00 0.00 66.41 66.48 1xxh h THR 234 Cb 1.18 -0.01 -0.03 0.00 -1.74 0.00 0.00 68.15 67.54 1xxh h THR 234 CO 0.61 0.09 0.32 -0.61 0.37 0.00 0.00 175.52 176.30 1xxh h GLN 235 N 0.49 1.13 0.41 6.66 4.15 -1.99 0.25 115.11 126.22 1xxh h GLN 235 Ca 0.59 -0.19 -0.02 0.00 0.77 0.00 0.00 58.65 59.79 1xxh h GLN 235 Cb 1.09 -0.19 0.00 0.00 0.21 0.00 0.00 27.48 28.60 1xxh h GLN 235 CO -0.49 0.91 -0.20 0.00 -1.93 0.00 0.00 178.83 177.12 1xxh h ALA 236 N 1.17 -0.78 -1.83 3.38 0.00 -1.39 -2.92 119.26 116.89 1xxh h ALA 236 Ca 0.26 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1xxh h ALA 236 Cb 0.19 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1xxh h ALA 236 CO -0.02 -0.74 0.00 0.28 0.00 0.00 0.00 179.25 178.77 1xxh n VAL 237 N -4.12 0.00 -0.47 0.00 0.31 -0.28 0.10 118.33 113.87 1xxh n VAL 237 Ca -0.07 1.04 0.39 0.00 -0.01 0.00 0.00 64.34 65.69 1xxh n VAL 237 Cb 0.22 -1.48 0.64 0.00 -0.91 0.00 0.00 33.84 32.30 1xxh n VAL 237 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1xxh n SER 238 N -1.56 0.14 0.00 4.52 3.41 0.07 0.16 113.62 120.36 1xxh n SER 238 Ca 0.00 1.16 0.00 0.00 -0.26 0.00 0.00 58.87 59.77 1xxh n SER 238 Cb 0.00 -0.57 0.00 0.00 -0.26 0.00 0.00 64.21 63.38 1xxh n SER 238 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xxh n ALA 239 N -2.60 -0.21 -0.18 7.33 0.00 0.12 -0.07 120.51 124.90 1xxh n ALA 239 Ca 0.37 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.76 1xxh n ALA 239 Cb 1.50 0.07 -0.05 0.00 0.00 0.00 0.00 19.45 20.97 1xxh n ALA 239 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 1xxh h MET 240 N 0.00 -0.02 -1.10 0.00 2.86 0.23 0.36 114.93 117.26 1xxh h MET 240 Ca 0.00 0.00 0.30 0.00 -2.06 0.00 0.00 59.70 57.94 1xxh h MET 240 Cb 0.00 0.00 -0.08 0.00 0.06 0.00 0.00 31.60 31.58 1xxh h MET 240 CO 0.00 -0.01 0.74 -0.07 1.06 0.00 0.00 176.91 178.62 1xxh h LEU 241 N -0.02 0.29 -2.74 1.22 3.38 -1.43 -3.45 115.31 112.56 1xxh h LEU 241 Ca 0.07 0.06 -0.12 0.00 0.09 0.00 0.00 57.88 57.98 1xxh h LEU 241 Cb 0.20 0.02 0.09 0.00 0.09 0.00 0.00 40.66 41.06 1xxh h LEU 241 CO -0.42 0.04 -0.40 0.61 0.09 0.00 0.00 178.44 178.36 1xxh n GLY 242 N -1.57 -0.08 0.00 0.83 0.00 0.13 -4.74 105.19 99.76 1xxh n GLY 242 Ca 0.26 0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.41 1xxh n GLY 242 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1xxh n THR 243 N -2.30 0.00 -4.48 2.61 -1.04 -0.72 -1.61 114.28 106.74 1xxh n THR 243 Ca -0.03 0.00 -0.34 0.00 -2.04 0.00 0.00 64.05 61.63 1xxh n THR 243 Cb 0.56 0.00 -0.11 0.00 -1.82 0.00 0.00 70.33 68.96 1xxh n THR 243 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1xxh s LEU 244 N 0.00 3.36 -0.53 -4.42 1.43 -1.26 -4.83 118.68 112.43 1xxh s LEU 244 Ca 0.00 0.03 -0.27 0.00 -1.03 0.00 0.00 54.13 52.86 1xxh s LEU 244 Cb 0.00 -1.76 -0.01 0.00 0.03 0.00 0.00 46.19 44.45 1xxh s LEU 244 CO 0.00 0.33 1.74 -0.62 0.23 0.00 0.00 176.35 178.03 1xxh s ASP 245 N -0.63 5.63 0.00 2.29 3.68 -1.26 -4.71 116.67 121.67 1xxh s ASP 245 Ca 0.10 0.56 0.00 0.00 2.13 0.00 0.00 52.55 55.33 1xxh s ASP 245 Cb -0.12 -2.53 0.00 0.00 -1.45 0.00 0.00 42.92 38.82 1xxh s ASP 245 CO 0.02 -2.05 0.00 0.47 0.13 0.00 0.00 175.17 173.74 1xxh n ASP 246 N 11.38 0.00 0.24 -0.34 8.00 -1.26 0.21 116.55 134.79 1xxh n ASP 246 Ca 0.19 0.00 -0.15 0.00 0.71 0.00 0.00 54.79 55.54 1xxh n ASP 246 Cb 0.50 0.00 -0.08 0.00 -0.02 0.00 0.00 41.12 41.52 1xxh n ASP 246 CO 0.00 0.00 0.00 -0.78 -0.39 0.00 0.00 177.20 176.03 1xxh h ASP 247 N 0.00 -0.50 -0.18 -2.24 3.58 -1.98 -2.86 116.42 112.24 1xxh h ASP 247 Ca 0.00 -0.06 -0.02 0.00 0.42 0.00 0.00 57.03 57.37 1xxh h ASP 247 Cb 0.00 0.13 -0.01 0.00 1.72 0.00 0.00 39.33 41.17 1xxh h ASP 247 CO 0.00 -0.25 0.05 0.06 -2.88 0.00 0.00 179.24 176.23 1xxh h GLN 248 N -0.74 0.37 0.45 0.28 3.07 0.22 0.17 115.11 118.94 1xxh h GLN 248 Ca -0.06 -0.05 -0.02 0.00 0.09 0.00 0.00 58.65 58.60 1xxh h GLN 248 Cb 0.53 -0.07 0.00 0.00 0.08 0.00 0.00 27.48 28.02 1xxh h GLN 248 CO 0.10 0.36 -0.22 0.00 0.09 0.00 0.00 178.83 179.16 1xxh h ALA 249 N 1.69 -1.00 -0.95 0.06 0.00 -1.59 -2.72 119.26 114.76 1xxh h ALA 249 Ca 0.09 -0.13 0.24 0.00 0.00 0.00 0.00 54.91 55.10 1xxh h ALA 249 Cb 0.17 0.23 -0.06 0.00 0.00 0.00 0.00 17.79 18.13 1xxh h ALA 249 CO -0.00 -0.95 0.64 1.25 0.00 0.00 0.00 179.25 180.18 1xxh h LEU 250 N -0.70 0.30 0.00 0.00 5.85 -1.31 0.22 115.31 119.68 1xxh h LEU 250 Ca -0.06 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.70 1xxh h LEU 250 Cb 0.47 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.48 1xxh h LEU 250 CO 0.10 0.10 0.00 -1.20 -0.34 0.00 0.00 178.44 177.10 1xxh n SER 251 N -4.46 0.00 -0.09 1.25 7.64 0.59 0.24 113.62 118.79 1xxh n SER 251 Ca 0.21 0.29 -0.11 0.00 1.01 0.00 0.00 58.87 60.27 1xxh n SER 251 Cb 0.83 -0.38 -0.04 0.00 -1.01 0.00 0.00 64.21 63.60 1xxh n SER 251 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1xxh n LEU 252 N -1.38 1.89 -0.28 -3.43 4.32 0.74 -3.65 117.00 115.21 1xxh n LEU 252 Ca 0.04 0.45 0.05 0.00 -0.02 0.00 0.00 56.01 56.53 1xxh n LEU 252 Cb 0.11 -0.82 0.14 0.00 -1.62 0.00 0.00 43.42 41.23 1xxh n LEU 252 CO 0.09 -0.20 0.76 0.58 -1.22 0.00 0.00 177.39 177.40 1xxh h VAL 253 N -1.00 0.24 -0.31 4.08 2.07 -1.22 1.65 116.25 121.76 1xxh h VAL 253 Ca -0.11 -0.01 0.06 0.00 0.82 0.00 0.00 66.70 67.45 1xxh h VAL 253 Cb 0.92 0.20 -0.05 0.00 -1.52 0.00 0.00 31.29 30.84 1xxh h VAL 253 CO -0.07 0.01 -0.02 -0.08 0.02 0.00 0.00 177.57 177.43 1xxh h GLU 254 N 0.04 0.06 0.00 1.57 4.81 -0.40 0.44 114.58 121.11 1xxh h GLU 254 Ca 0.41 -0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.54 1xxh h GLU 254 Cb 0.70 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.05 1xxh h GLU 254 CO -0.77 0.04 -0.47 0.00 -0.73 0.00 0.00 179.01 177.08 1xxh h ALA 255 N 1.28 1.14 -0.10 2.92 0.00 0.09 -1.62 119.26 122.97 1xxh h ALA 255 Ca 0.15 -0.43 -0.02 0.00 0.00 0.00 0.00 54.91 54.60 1xxh h ALA 255 Cb 0.21 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 1xxh h ALA 255 CO -0.27 0.59 -0.03 1.98 0.00 0.00 0.00 179.25 181.52 1xxh h MET 256 N 0.00 0.20 -0.18 0.00 1.85 0.41 -2.89 114.93 114.32 1xxh h MET 256 Ca -0.00 -0.08 0.03 0.00 -0.61 0.00 0.00 59.70 59.03 1xxh h MET 256 Cb 0.87 -0.01 -0.03 0.00 0.43 0.00 0.00 31.60 32.87 1xxh h MET 256 CO 0.06 0.53 0.02 0.28 -0.40 0.00 0.00 176.91 177.40 1xxh h VAL 257 N -0.14 0.90 0.00 -5.77 2.07 -0.10 -1.03 116.25 112.18 1xxh h VAL 257 Ca 0.02 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1xxh h VAL 257 Cb 0.46 0.81 0.00 0.00 -1.52 0.00 0.00 31.29 31.04 1xxh h VAL 257 CO 0.01 0.02 0.06 -0.62 0.02 0.00 0.00 177.57 177.06 1xxh n GLU 258 N -5.11 0.00 -1.05 1.57 1.02 -0.62 -4.79 120.64 111.66 1xxh n GLU 258 Ca -0.03 0.39 -0.02 0.00 -0.02 0.00 0.00 57.16 57.49 1xxh n GLU 258 Cb 0.09 -1.56 -0.01 0.00 -0.02 0.00 0.00 31.44 29.94 1xxh n GLU 258 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1xxh n ALA 259 N -1.39 -0.03 -2.79 0.62 0.00 -0.39 -4.96 120.51 111.57 1xxh n ALA 259 Ca 0.00 0.03 -0.40 0.00 0.00 0.00 0.00 53.44 53.07 1xxh n ALA 259 Cb 0.06 -0.86 -0.11 0.00 0.00 0.00 0.00 19.45 18.53 1xxh n ALA 259 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1xxh s ASN 260 N -2.15 5.70 0.00 0.00 4.22 -1.13 -4.99 114.94 116.58 1xxh s ASN 260 Ca 0.00 -0.68 0.00 0.00 -2.14 0.00 0.00 52.86 50.04 1xxh s ASN 260 Cb 0.00 -2.03 0.00 0.00 1.28 0.00 0.00 41.25 40.50 1xxh s ASN 260 CO 0.00 -0.27 0.24 0.61 -2.04 0.00 0.00 177.10 175.63 1xxh n GLY 261 N 5.01 -2.43 0.00 0.45 0.00 -1.26 -3.13 105.19 103.83 1xxh n GLY 261 Ca -0.13 0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1xxh n GLY 261 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1xxh n GLU 262 N -0.31 0.00 -0.18 1.61 1.02 -1.26 0.43 120.64 121.95 1xxh n GLU 262 Ca 0.00 0.00 -0.01 0.00 -0.02 0.00 0.00 57.16 57.13 1xxh n GLU 262 Cb 0.00 0.00 0.06 0.00 -0.02 0.00 0.00 31.44 31.48 1xxh n GLU 262 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1xxh h ARG 263 N 0.00 0.05 0.00 3.49 2.47 -1.94 0.97 114.38 119.42 1xxh h ARG 263 Ca 0.00 -0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1xxh h ARG 263 Cb 0.00 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 28.31 1xxh h ARG 263 CO 0.00 0.03 0.00 0.28 0.56 0.00 0.00 179.97 180.84 1xxh n VAL 264 N -5.32 0.00 -0.40 2.04 0.31 1.47 -0.78 118.33 115.65 1xxh n VAL 264 Ca 0.06 1.25 0.36 0.00 -0.01 0.00 0.00 64.34 66.01 1xxh n VAL 264 Cb 0.30 -2.08 0.70 0.00 -0.91 0.00 0.00 33.84 31.85 1xxh n VAL 264 CO 0.00 0.00 0.00 0.24 -1.32 0.00 0.00 176.83 175.75 1xxh h MET 265 N 0.00 0.08 0.03 5.55 2.86 -1.34 0.66 114.93 122.78 1xxh h MET 265 Ca 0.00 -0.01 -0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1xxh h MET 265 Cb 0.00 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.64 1xxh h MET 265 CO 0.00 0.06 -0.01 0.00 1.06 0.00 0.00 176.91 178.01 1xxh h ALA 266 N 1.41 -0.04 0.00 6.32 0.00 0.13 -2.87 119.26 124.21 1xxh h ALA 266 Ca 0.67 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 55.36 1xxh h ALA 266 Cb 2.41 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 20.21 1xxh h ALA 266 CO -0.12 -0.36 -0.25 -0.07 0.00 0.00 0.00 179.25 178.46 1xxh h LEU 267 N -0.37 0.00 0.08 0.00 3.38 0.23 -1.54 115.31 117.09 1xxh h LEU 267 Ca -0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 1xxh h LEU 267 Cb 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1xxh h LEU 267 CO 0.01 0.25 -0.04 0.40 0.09 0.00 0.00 178.44 179.15 1xxh h ILE 268 N 0.00 1.04 0.37 1.22 2.04 -0.74 0.15 117.51 121.58 1xxh h ILE 268 Ca -0.00 -0.38 -0.01 0.00 1.00 0.00 0.00 64.86 65.46 1xxh h ILE 268 Cb 0.52 1.29 -0.01 0.00 -0.74 0.00 0.00 36.82 37.88 1xxh h ILE 268 CO 0.03 0.10 -0.27 0.78 0.00 0.00 0.00 178.15 178.78 1xxh h ASN 269 N -0.27 -0.72 -1.00 1.72 2.35 -1.24 1.91 115.58 118.34 1xxh h ASN 269 Ca -0.01 0.05 0.35 0.00 -0.55 0.00 0.00 56.30 56.14 1xxh h ASN 269 Cb 0.23 0.22 -0.11 0.00 0.05 0.00 0.00 38.32 38.71 1xxh h ASN 269 CO 0.02 -0.39 0.62 1.21 -1.65 0.00 0.00 177.43 177.24 1xxh n GLU 270 N -4.02 -0.03 0.01 0.81 2.13 -0.62 0.22 120.64 119.15 1xxh n GLU 270 Ca -0.07 0.97 -0.21 0.00 0.66 0.00 0.00 57.16 58.50 1xxh n GLU 270 Cb 0.27 -1.88 -0.14 0.00 0.27 0.00 0.00 31.44 29.96 1xxh n GLU 270 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1xxh h ALA 271 N 1.26 0.16 0.00 4.31 0.00 0.99 -3.28 119.26 122.71 1xxh h ALA 271 Ca 0.66 -1.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.50 1xxh h ALA 271 Cb 2.07 0.46 -0.00 0.00 0.00 0.00 0.00 17.79 20.32 1xxh h ALA 271 CO -0.40 0.81 -0.02 0.00 0.00 0.00 0.00 179.25 179.65 1xxh h ALA 272 N -0.03 1.24 -0.02 0.00 0.00 1.62 0.12 119.26 122.19 1xxh h ALA 272 Ca -0.30 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.60 1xxh h ALA 272 Cb 1.77 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.56 1xxh h ALA 272 CO 0.07 0.02 0.01 0.00 0.00 0.00 0.00 179.25 179.35 1xxh h ALA 273 N 1.98 0.03 0.00 0.00 0.00 0.15 -2.08 119.26 119.34 1xxh h ALA 273 Ca -0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1xxh h ALA 273 Cb 0.08 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1xxh h ALA 273 CO 0.00 -0.40 0.00 0.54 0.00 0.00 0.00 179.25 179.39 1xxh n ARG 274 N -5.01 0.53 -2.98 0.00 1.74 0.40 -4.87 116.66 106.47 1xxh n ARG 274 Ca -0.07 0.00 -0.05 0.00 -0.77 0.00 0.00 57.85 56.96 1xxh n ARG 274 Cb 0.09 -1.28 0.01 0.00 -1.02 0.00 0.00 32.46 30.25 1xxh n ARG 274 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1xxh n GLY 275 N 0.04 -1.25 3.94 -0.13 0.00 -0.78 -5.01 105.19 102.00 1xxh n GLY 275 Ca 0.07 0.89 -0.27 0.00 0.00 0.00 0.00 46.02 46.71 1xxh n GLY 275 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xxh s ILE 276 N -2.77 2.12 -0.50 -0.61 1.01 -1.23 -4.83 121.20 114.39 1xxh s ILE 276 Ca 0.13 -0.23 -0.09 0.00 0.00 0.00 0.00 60.65 60.46 1xxh s ILE 276 Cb -0.04 -2.89 0.13 0.00 0.01 0.00 0.00 42.46 39.67 1xxh s ILE 276 CO 0.77 0.00 0.37 -1.61 0.00 0.00 0.00 174.94 174.47 1xxh s GLU 277 N -5.48 2.53 0.28 2.79 0.41 -0.63 -5.00 118.70 113.60 1xxh s GLU 277 Ca 0.67 -1.85 -0.08 0.00 -0.41 0.00 0.00 54.97 53.29 1xxh s GLU 277 Cb -0.07 -3.94 0.46 0.00 -1.78 0.00 0.00 34.13 28.80 1xxh s GLU 277 CO 0.48 -1.20 1.56 0.91 -0.49 0.00 0.00 175.26 176.52 1xxh n TRP 278 N 4.77 0.36 -0.13 1.61 7.02 -1.26 0.92 117.44 130.72 1xxh n TRP 278 Ca -0.06 1.22 0.19 0.00 -1.02 0.00 0.00 57.50 57.83 1xxh n TRP 278 Cb 0.41 -1.08 0.58 0.00 -2.42 0.00 0.00 31.31 28.80 1xxh n TRP 278 CO 0.00 0.00 0.00 1.49 -2.02 0.00 0.00 177.69 177.16 1xxh h GLU 279 N 0.00 0.24 0.00 -0.99 4.81 -1.94 0.23 114.58 116.93 1xxh h GLU 279 Ca 0.48 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.69 1xxh h GLU 279 Cb 0.73 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.05 1xxh h GLU 279 CO -1.03 0.16 0.00 0.00 -0.73 0.00 0.00 179.01 177.41 1xxh n ALA 280 N -2.58 2.24 0.76 2.92 0.00 0.26 -0.97 120.51 123.15 1xxh n ALA 280 Ca 0.14 -0.03 0.10 0.00 0.00 0.00 0.00 53.44 53.65 1xxh n ALA 280 Cb 0.62 -1.46 0.46 0.00 0.00 0.00 0.00 19.45 19.07 1xxh n ALA 280 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1xxh n LEU 281 N -2.11 0.00 -0.11 0.00 0.00 0.07 -1.83 117.00 113.02 1xxh n LEU 281 Ca 0.06 0.47 -0.23 0.00 0.00 0.00 0.00 56.01 56.31 1xxh n LEU 281 Cb 0.40 -0.47 -0.08 0.00 0.00 0.00 0.00 43.42 43.26 1xxh n LEU 281 CO 0.29 -0.13 -1.26 0.18 0.00 0.00 0.00 177.39 176.47 1xxh n LEU 282 N -1.47 1.69 -0.33 -1.96 4.77 -0.96 -3.57 117.00 115.17 1xxh n LEU 282 Ca 0.06 0.24 0.19 0.00 -0.03 0.00 0.00 56.01 56.46 1xxh n LEU 282 Cb 0.23 -0.66 0.40 0.00 -2.33 0.00 0.00 43.42 41.06 1xxh n LEU 282 CO 0.19 0.50 1.09 0.58 -1.33 0.00 0.00 177.39 178.42 1xxh h VAL 283 N -0.73 0.39 -0.06 4.08 2.07 -0.99 0.35 116.25 121.37 1xxh h VAL 283 Ca -0.56 -0.13 -0.20 0.00 0.82 0.00 0.00 66.70 66.63 1xxh h VAL 283 Cb 1.51 -0.03 -0.00 0.00 -1.52 0.00 0.00 31.29 31.25 1xxh h VAL 283 CO -0.32 0.07 -0.79 -0.33 0.02 0.00 0.00 177.57 176.22 1xxh h GLU 284 N 0.39 0.42 0.12 1.57 4.39 -1.55 -2.29 114.58 117.63 1xxh h GLU 284 Ca 0.66 -0.37 -0.01 0.00 0.34 0.00 0.00 59.36 59.98 1xxh h GLU 284 Cb 1.37 0.09 0.00 0.00 -0.10 0.00 0.00 28.75 30.11 1xxh h GLU 284 CO -0.57 1.02 -0.06 0.52 -1.16 0.00 0.00 179.01 178.76 1xxh h MET 285 N 0.27 -0.16 -0.45 2.33 2.86 -1.04 -2.81 114.93 115.92 1xxh h MET 285 Ca -0.04 0.01 0.11 0.00 -2.06 0.00 0.00 59.70 57.72 1xxh h MET 285 Cb 1.38 0.04 -0.08 0.00 0.06 0.00 0.00 31.60 33.00 1xxh h MET 285 CO 0.14 -0.11 -0.04 1.28 1.06 0.00 0.00 176.91 179.24 1xxh n LEU 286 N -2.62 -0.10 -0.05 1.22 4.77 -0.40 0.17 117.00 119.99 1xxh n LEU 286 Ca -0.02 0.77 -0.06 0.00 -0.03 0.00 0.00 56.01 56.67 1xxh n LEU 286 Cb 0.07 -0.26 -0.04 0.00 -2.33 0.00 0.00 43.42 40.85 1xxh n LEU 286 CO 0.05 -0.76 0.50 1.23 -1.33 0.00 0.00 177.39 177.08 1xxh h GLY 287 N 0.00 -1.54 0.32 -0.72 0.00 -1.17 -1.61 103.07 98.34 1xxh h GLY 287 Ca 0.25 0.78 0.01 0.00 0.00 0.00 0.00 47.33 48.37 1xxh h GLY 287 CO -0.44 -0.48 -0.45 1.41 0.00 0.00 0.00 176.54 176.58 1xxh h LEU 288 N -0.17 -1.30 -1.00 3.11 3.38 0.20 -2.01 115.31 117.52 1xxh h LEU 288 Ca 0.03 0.13 0.33 0.00 0.09 0.00 0.00 57.88 58.47 1xxh h LEU 288 Cb 0.25 0.47 -0.18 0.00 0.09 0.00 0.00 40.66 41.29 1xxh h LEU 288 CO -0.24 -0.53 0.24 -0.07 0.09 0.00 0.00 178.44 177.93 1xxh h LEU 289 N -0.74 -0.15 0.23 1.67 -0.00 -1.26 0.50 115.31 115.57 1xxh h LEU 289 Ca -0.00 0.27 0.00 0.00 -0.00 0.00 0.00 57.88 58.15 1xxh h LEU 289 Cb 0.73 0.40 -0.03 0.00 -0.00 0.00 0.00 40.66 41.76 1xxh h LEU 289 CO -0.21 -0.39 -0.42 -0.74 -0.00 0.00 0.00 178.44 176.68 1xxh h HIS 290 N 0.01 -1.19 -0.96 1.13 2.76 -0.54 -2.39 115.15 113.97 1xxh h HIS 290 Ca 0.71 0.02 0.13 0.00 -2.20 0.00 0.00 60.37 59.03 1xxh h HIS 290 Cb 1.66 0.49 -0.09 0.00 1.55 0.00 0.00 27.41 31.02 1xxh h HIS 290 CO -0.30 -0.51 0.58 0.00 -1.30 0.00 0.00 177.93 176.40 1xxh h ARG 291 N -0.69 0.85 0.00 5.26 2.47 0.13 -2.50 114.38 119.89 1xxh h ARG 291 Ca -0.02 -0.05 0.00 0.00 -1.26 0.00 0.00 59.98 58.64 1xxh h ARG 291 Cb 0.65 -0.19 0.00 0.00 -1.65 0.00 0.00 29.97 28.78 1xxh h ARG 291 CO -0.16 0.56 0.00 -0.89 0.56 0.00 0.00 179.97 180.04 1xxh n ILE 292 N -4.70 0.00 0.00 2.04 5.41 0.08 -1.99 119.36 120.20 1xxh n ILE 292 Ca 0.19 1.24 0.00 0.00 1.00 0.00 0.00 62.75 65.18 1xxh n ILE 292 Cb 0.40 -2.19 0.00 0.00 -0.71 0.00 0.00 39.64 37.14 1xxh n ILE 292 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1xxh n ALA 293 N -1.31 0.41 0.00 -1.39 0.00 -0.93 0.52 120.51 117.81 1xxh n ALA 293 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.35 1xxh n ALA 293 Cb 0.00 -0.40 -0.14 0.00 0.00 0.00 0.00 19.45 18.91 1xxh n ALA 293 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 1xxh h MET 294 N 0.00 0.02 0.00 0.00 2.86 -0.94 -3.26 114.93 113.61 1xxh h MET 294 Ca 0.00 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 1xxh h MET 294 Cb 0.57 0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.24 1xxh h MET 294 CO 0.00 0.67 -0.21 0.28 1.06 0.00 0.00 176.91 178.71 1xxh h VAL 295 N 0.00 0.00 0.00 -2.22 2.07 0.59 -2.28 116.25 114.41 1xxh h VAL 295 Ca -0.21 -0.53 0.00 0.00 0.82 0.00 0.00 66.70 66.77 1xxh h VAL 295 Cb 1.95 1.40 0.00 0.00 -1.52 0.00 0.00 31.29 33.12 1xxh h VAL 295 CO 0.10 0.00 -0.01 1.56 0.02 0.00 0.00 177.57 179.23 1xxh h GLN 296 N 0.00 0.00 0.02 1.57 4.20 -1.55 -2.83 115.11 116.52 1xxh h GLN 296 Ca 0.00 0.00 -0.34 0.00 0.06 0.00 0.00 58.65 58.37 1xxh h GLN 296 Cb 0.77 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.49 1xxh h GLN 296 CO 0.00 0.00 -2.03 -0.11 -0.67 0.00 0.00 178.83 176.02 1xxh n LEU 297 N -2.64 1.16 -3.29 1.46 7.94 -1.08 -4.85 117.00 115.68 1xxh n LEU 297 Ca 0.05 0.21 -0.06 0.00 -1.11 0.00 0.00 56.01 55.10 1xxh n LEU 297 Cb 0.48 -0.07 -0.06 0.00 0.53 0.00 0.00 43.42 44.29 1xxh n LEU 297 CO 0.32 0.56 -0.01 -0.94 -1.11 0.00 0.00 177.39 176.21 1xxh s SER 298 N -6.13 -0.15 0.51 1.96 1.04 -0.88 -5.00 113.70 105.05 1xxh s SER 298 Ca -0.12 0.28 0.29 0.00 0.48 0.00 0.00 55.95 56.88 1xxh s SER 298 Cb 0.07 1.37 1.60 0.00 0.10 0.00 0.00 66.02 69.17 1xxh s SER 298 CO 0.79 -0.30 1.89 1.55 0.98 0.00 0.00 173.24 178.15 1xxh h PRO 299 N 8.13 0.00 -0.19 4.02 0.13 -1.78 0.64 132.00 142.96 1xxh h PRO 299 Ca -0.18 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.85 1xxh h PRO 299 Cb 1.15 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.27 1xxh h PRO 299 CO 0.27 0.00 -0.33 0.00 -0.23 0.00 0.00 178.00 177.71 1xxh h ALA 300 N 1.71 1.09 0.00 -0.56 0.00 -1.92 -3.36 119.26 116.22 1xxh h ALA 300 Ca 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1xxh h ALA 300 Cb 0.26 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1xxh h ALA 300 CO 0.00 0.57 0.61 0.00 0.00 0.00 0.00 179.25 180.43 1xxh n ALA 301 N -2.48 0.94 -3.72 0.00 0.00 0.22 -4.68 120.51 110.78 1xxh n ALA 301 Ca -0.01 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.21 1xxh n ALA 301 Cb 0.44 -2.19 -0.18 0.00 0.00 0.00 0.00 19.45 17.52 1xxh n ALA 301 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1xxh s LEU 302 N 0.00 0.41 0.00 0.00 0.20 -1.26 -4.49 118.68 113.54 1xxh s LEU 302 Ca 0.00 -0.05 0.00 0.00 0.69 0.00 0.00 54.13 54.77 1xxh s LEU 302 Cb 0.00 -0.31 0.00 0.00 -0.43 0.00 0.00 46.19 45.45 1xxh s LEU 302 CO 0.00 -0.22 0.00 0.61 -0.29 0.00 0.00 176.35 176.45 1xxh n GLY 303 N 5.21 -0.19 0.00 7.98 0.00 -1.26 -4.94 105.19 111.99 1xxh n GLY 303 Ca -0.05 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.90 1xxh n GLY 303 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1xxh n ASN 304 N 0.00 1.16 0.00 1.61 5.03 -1.26 -4.56 115.26 117.24 1xxh n ASN 304 Ca 0.00 -1.34 0.00 0.00 0.87 0.00 0.00 54.58 54.11 1xxh n ASN 304 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 38.76 1xxh n ASN 304 CO 0.00 0.00 0.00 -0.67 -1.83 0.00 0.00 177.26 174.76 1xxh n ASP 305 N -0.17 1.06 -0.08 6.41 2.03 -1.26 -4.47 116.55 120.07 1xxh n ASP 305 Ca 0.00 -0.29 0.26 0.00 0.52 0.00 0.00 54.79 55.27 1xxh n ASP 305 Cb 0.15 0.80 0.69 0.00 -0.72 0.00 0.00 41.12 42.03 1xxh n ASP 305 CO 0.00 0.00 0.00 0.24 -1.92 0.00 0.00 177.20 175.52 1xxh h MET 306 N 0.00 0.00 -0.33 -0.67 2.86 -1.94 -2.95 114.93 111.90 1xxh h MET 306 Ca 0.00 0.00 0.04 0.00 -2.06 0.00 0.00 59.70 57.68 1xxh h MET 306 Cb 0.00 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 31.61 1xxh h MET 306 CO 0.00 0.00 -0.16 0.00 1.06 0.00 0.00 176.91 177.81 1xxh n ALA 307 N -2.44 -0.13 0.28 6.32 0.00 -1.26 0.20 120.51 123.48 1xxh n ALA 307 Ca 0.15 0.30 0.14 0.00 0.00 0.00 0.00 53.44 54.04 1xxh n ALA 307 Cb 0.96 -0.10 0.77 0.00 0.00 0.00 0.00 19.45 21.09 1xxh n ALA 307 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xxh h ALA 308 N 0.31 1.22 0.00 0.00 0.00 -1.89 0.26 119.26 119.15 1xxh h ALA 308 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1xxh h ALA 308 Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1xxh h ALA 308 CO -0.32 -0.22 0.00 0.44 0.00 0.00 0.00 179.25 179.16 1xxh n ILE 309 N -2.68 0.00 -0.14 0.00 -5.35 0.53 -4.86 119.36 106.85 1xxh n ILE 309 Ca -0.02 -0.36 -0.07 0.00 -0.27 0.00 0.00 62.75 62.03 1xxh n ILE 309 Cb 0.28 1.21 -0.01 0.00 -1.74 0.00 0.00 39.64 39.38 1xxh n ILE 309 CO 0.00 0.00 0.00 -0.08 -1.76 0.00 0.00 176.55 174.71 1xxh h GLU 310 N 0.00 -0.22 -1.00 6.28 4.81 0.36 0.13 114.58 124.94 1xxh h GLU 310 Ca 0.00 0.01 0.21 0.00 -0.13 0.00 0.00 59.36 59.45 1xxh h GLU 310 Cb 0.10 0.05 -0.11 0.00 0.63 0.00 0.00 28.75 29.42 1xxh h GLU 310 CO 0.00 -0.14 0.61 1.25 -0.73 0.00 0.00 179.01 179.99 1xxh h LEU 311 N -0.23 0.75 -0.56 1.64 5.85 -1.88 0.60 115.31 121.49 1xxh h LEU 311 Ca 0.19 0.11 -0.11 0.00 0.84 0.00 0.00 57.88 58.90 1xxh h LEU 311 Cb 0.54 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.53 1xxh h LEU 311 CO -0.57 0.22 -0.54 0.03 -0.34 0.00 0.00 178.44 177.24 1xxh h ARG 312 N 0.71 0.00 0.57 1.25 3.08 -1.20 -1.70 114.38 117.09 1xxh h ARG 312 Ca 0.60 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.62 1xxh h ARG 312 Cb 1.00 0.00 0.01 0.00 0.08 0.00 0.00 29.97 31.05 1xxh h ARG 312 CO -0.41 0.54 -0.27 0.52 -1.07 0.00 0.00 179.97 179.28 1xxh h MET 313 N 0.00 -0.74 -0.56 0.04 2.86 0.22 -3.12 114.93 113.63 1xxh h MET 313 Ca -0.01 0.05 0.11 0.00 -2.06 0.00 0.00 59.70 57.80 1xxh h MET 313 Cb 1.18 0.17 -0.10 0.00 0.06 0.00 0.00 31.60 32.90 1xxh h MET 313 CO 0.07 -0.43 -0.11 0.00 1.06 0.00 0.00 176.91 177.50 1xxh h ARG 314 N -1.06 0.02 0.00 1.72 3.08 -1.07 -1.96 114.38 115.11 1xxh h ARG 314 Ca -0.08 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.97 1xxh h ARG 314 Cb 0.65 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.69 1xxh h ARG 314 CO 0.13 0.01 0.00 -1.91 -1.07 0.00 0.00 179.97 177.13 1xxh n GLU 315 N -5.37 0.00 0.00 0.04 4.07 -0.64 -0.39 120.64 118.35 1xxh n GLU 315 Ca 0.06 0.03 0.00 0.00 -0.06 0.00 0.00 57.16 57.20 1xxh n GLU 315 Cb 0.30 -0.56 0.00 0.00 -0.06 0.00 0.00 31.44 31.12 1xxh n GLU 315 CO 0.00 0.00 0.00 1.28 -0.06 0.00 0.00 177.13 178.35 1xxh n LEU 316 N -0.09 0.00 0.01 4.31 4.77 -1.18 -0.21 117.00 124.61 1xxh n LEU 316 Ca 0.00 0.00 -0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1xxh n LEU 316 Cb 0.00 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1xxh n LEU 316 CO 0.00 0.00 0.50 0.00 -1.33 0.00 0.00 177.39 176.56 1xxh h ALA 317 N 0.00 -0.87 -0.20 -1.18 0.00 -0.92 0.24 119.26 116.32 1xxh h ALA 317 Ca 0.00 -0.00 0.06 0.00 0.00 0.00 0.00 54.91 54.96 1xxh h ALA 317 Cb 0.00 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1xxh h ALA 317 CO 0.00 -0.87 0.24 0.07 0.00 0.00 0.00 179.25 178.68 1xxh h ARG 318 N -0.02 0.00 0.00 0.00 0.11 0.23 -3.14 114.38 111.56 1xxh h ARG 318 Ca -0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1xxh h ARG 318 Cb 0.02 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.10 1xxh h ARG 318 CO 0.00 0.00 -1.42 0.25 0.10 0.00 0.00 179.97 178.90 1xxh n THR 319 N -3.74 0.18 -4.47 0.08 -2.24 -0.22 -4.94 114.28 98.93 1xxh n THR 319 Ca 0.02 -0.39 -0.34 0.00 -2.27 0.00 0.00 64.05 61.07 1xxh n THR 319 Cb 0.36 0.07 -0.10 0.00 -2.10 0.00 0.00 70.33 68.56 1xxh n THR 319 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1xxh s ILE 320 N -3.35 3.97 0.10 2.28 1.01 0.80 -5.03 121.20 121.00 1xxh s ILE 320 Ca -0.02 -0.45 -0.31 0.00 0.00 0.00 0.00 60.65 59.88 1xxh s ILE 320 Cb 0.13 -2.67 -0.10 0.00 0.01 0.00 0.00 42.46 39.83 1xxh s ILE 320 CO 0.85 0.55 1.75 -2.84 0.00 0.00 0.00 174.94 175.25 1xxh s PRO 321 N -1.01 4.16 0.24 2.79 0.02 -1.26 -4.85 135.00 135.09 1xxh s PRO 321 Ca 0.14 2.49 -0.06 0.00 0.02 0.00 0.00 61.00 63.59 1xxh s PRO 321 Cb -0.11 -3.58 0.44 0.00 0.02 0.00 0.00 34.50 31.27 1xxh s PRO 321 CO 0.04 -0.79 1.67 -1.00 -0.33 0.00 0.00 177.00 176.59 1xxh h PRO 322 N 8.43 0.22 -0.92 5.54 0.13 -1.97 0.76 132.00 144.19 1xxh h PRO 322 Ca -0.45 -0.01 0.09 0.00 -0.87 0.00 0.00 66.00 64.77 1xxh h PRO 322 Cb 1.21 -0.05 -0.12 0.00 0.13 0.00 0.00 31.00 32.17 1xxh h PRO 322 CO 0.94 0.14 -0.55 1.15 -0.23 0.00 0.00 178.00 179.45 1xxh h THR 323 N 0.22 0.00 -0.14 1.56 2.02 -1.98 0.55 112.91 115.14 1xxh h THR 323 Ca 0.41 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.63 1xxh h THR 323 Cb 0.70 0.00 -0.07 0.00 -1.74 0.00 0.00 68.15 67.05 1xxh h THR 323 CO -0.54 0.00 -0.45 0.44 0.37 0.00 0.00 175.52 175.34 1xxh h ASP 324 N -0.05 -1.43 -0.91 4.18 5.19 0.12 -2.21 116.42 121.31 1xxh h ASP 324 Ca 0.18 0.18 0.11 0.00 -0.62 0.00 0.00 57.03 56.89 1xxh h ASP 324 Cb 0.46 0.58 -0.07 0.00 0.18 0.00 0.00 39.33 40.48 1xxh h ASP 324 CO -0.90 -0.44 0.58 0.40 -3.12 0.00 0.00 179.24 175.76 1xxh h ILE 325 N -0.51 0.92 0.00 0.35 2.04 -0.09 0.49 117.51 120.71 1xxh h ILE 325 Ca 0.07 -0.29 0.00 0.00 1.00 0.00 0.00 64.86 65.64 1xxh h ILE 325 Cb 0.64 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.73 1xxh h ILE 325 CO -0.42 0.15 0.00 0.00 0.00 0.00 0.00 178.15 177.89 1xxh n GLN 326 N -4.55 0.14 -0.07 2.37 1.13 0.08 -1.03 117.38 115.45 1xxh n GLN 326 Ca 0.16 0.62 -0.22 0.00 -1.94 0.00 0.00 57.00 55.62 1xxh n GLN 326 Cb 0.36 -1.95 -0.12 0.00 0.11 0.00 0.00 30.24 28.64 1xxh n GLN 326 CO 0.00 0.00 0.00 1.25 -1.44 0.00 0.00 177.06 176.87 1xxh h LEU 327 N 0.00 0.12 -0.23 1.08 5.85 0.13 -2.94 115.31 119.32 1xxh h LEU 327 Ca 0.00 -0.64 -0.01 0.00 0.84 0.00 0.00 57.88 58.07 1xxh h LEU 327 Cb 0.04 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 1xxh h LEU 327 CO 0.00 1.57 0.12 1.88 -0.34 0.00 0.00 178.44 181.67 1xxh h TYR 328 N -0.72 0.32 -0.08 1.25 0.05 -1.18 1.20 116.97 117.81 1xxh h TYR 328 Ca -0.35 -0.01 0.02 0.00 0.05 0.00 0.00 58.73 58.43 1xxh h TYR 328 Cb 1.49 -0.10 -0.03 0.00 1.01 0.00 0.00 36.73 39.09 1xxh h TYR 328 CO 0.10 0.29 -0.26 -0.92 -1.05 0.00 0.00 178.16 176.32 1xxh h TYR 329 N 0.26 -0.78 -0.11 4.88 3.20 -1.25 0.43 116.97 123.60 1xxh h TYR 329 Ca 0.08 0.03 0.03 0.00 3.14 0.00 0.00 58.73 62.01 1xxh h TYR 329 Cb 0.08 0.35 -0.00 0.00 1.54 0.00 0.00 36.73 38.70 1xxh h TYR 329 CO -0.03 -0.26 0.10 0.37 -1.64 0.00 0.00 178.16 176.69 1xxh h GLN 330 N -0.27 0.00 -0.18 1.82 4.15 -1.27 -0.36 115.11 119.00 1xxh h GLN 330 Ca 0.02 0.00 -0.11 0.00 0.77 0.00 0.00 58.65 59.33 1xxh h GLN 330 Cb 0.32 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.00 1xxh h GLN 330 CO -0.22 0.00 -0.35 1.15 -1.93 0.00 0.00 178.83 177.49 1xxh h THR 331 N 0.00 1.29 0.05 2.39 2.02 0.59 -1.87 112.91 117.38 1xxh h THR 331 Ca 0.05 -1.42 -0.27 0.00 0.77 0.00 0.00 66.41 65.55 1xxh h THR 331 Cb 0.24 1.53 -0.02 0.00 -1.74 0.00 0.00 68.15 68.16 1xxh h THR 331 CO -0.00 0.44 -1.36 -0.07 0.37 0.00 0.00 175.52 174.89 1xxh h LEU 332 N 0.32 0.17 0.00 2.58 3.38 -0.56 -2.96 115.31 118.25 1xxh h LEU 332 Ca 0.04 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.78 1xxh h LEU 332 Cb 0.77 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.46 1xxh h LEU 332 CO 0.06 1.19 0.00 -0.11 0.09 0.00 0.00 178.44 179.67 1xxh n LEU 333 N -3.33 0.00 0.27 1.67 0.00 -0.19 0.37 117.00 115.78 1xxh n LEU 333 Ca -0.10 0.51 0.03 0.00 0.00 0.00 0.00 56.01 56.44 1xxh n LEU 333 Cb 1.01 -0.01 0.14 0.00 0.00 0.00 0.00 43.42 44.56 1xxh n LEU 333 CO 0.48 -0.01 0.92 0.40 0.00 0.00 0.00 177.39 179.19 1xxh h ILE 334 N 0.00 0.00 0.76 1.96 2.04 -1.50 0.49 117.51 121.25 1xxh h ILE 334 Ca 0.00 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.82 1xxh h ILE 334 Cb 0.00 0.11 0.01 0.00 -0.74 0.00 0.00 36.82 36.20 1xxh h ILE 334 CO 0.00 0.00 -0.36 1.23 0.00 0.00 0.00 178.15 179.02 1xxh h GLY 335 N 0.00 -1.06 -0.61 5.37 0.00 0.10 -2.77 103.07 104.10 1xxh h GLY 335 Ca 0.00 0.39 0.12 0.00 0.00 0.00 0.00 47.33 47.84 1xxh h GLY 335 CO 0.00 -0.38 -0.37 -0.09 0.00 0.00 0.00 176.54 175.70 1xxh h ARG 336 N -1.06 -0.11 -0.60 4.80 9.65 0.24 -1.68 114.38 125.62 1xxh h ARG 336 Ca -0.10 0.01 0.05 0.00 -1.10 0.00 0.00 59.98 58.84 1xxh h ARG 336 Cb 0.78 0.03 -0.07 0.00 -1.39 0.00 0.00 29.97 29.31 1xxh h ARG 336 CO 0.17 -0.08 -0.35 1.17 2.80 0.00 0.00 179.97 183.68 1xxh n LYS 337 N -5.44 -0.26 0.22 0.20 4.81 -1.05 -1.58 118.16 115.06 1xxh n LYS 337 Ca 0.06 1.08 0.08 0.00 -0.87 0.00 0.00 58.31 58.66 1xxh n LYS 337 Cb 0.37 -1.60 0.50 0.00 0.02 0.00 0.00 35.03 34.32 1xxh n LYS 337 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 1xxh h GLU 338 N 0.00 0.00 -0.38 1.64 5.08 -1.03 -3.38 114.58 116.52 1xxh h GLU 338 Ca 0.10 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.50 1xxh h GLU 338 Cb 0.25 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.44 1xxh h GLU 338 CO -0.56 0.25 -0.19 -0.11 -1.00 0.00 0.00 179.01 177.40 1xxh n LEU 339 N -3.62 -0.33 0.21 1.33 7.94 -0.61 0.15 117.00 122.06 1xxh n LEU 339 Ca -0.01 0.67 0.18 0.00 -1.11 0.00 0.00 56.01 55.73 1xxh n LEU 339 Cb 0.38 -0.11 0.76 0.00 0.53 0.00 0.00 43.42 44.98 1xxh n LEU 339 CO 0.34 -0.57 1.15 -0.65 -1.11 0.00 0.00 177.39 176.56 1xxh h PRO 340 N 0.00 0.00 -0.01 1.96 0.11 -1.79 0.12 132.00 132.40 1xxh h PRO 340 Ca 0.09 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.20 1xxh h PRO 340 Cb 0.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.30 1xxh h PRO 340 CO -0.36 0.00 -0.44 0.66 -0.21 0.00 0.00 178.00 177.64 1xxh n TYR 341 N -3.30 0.00 -2.55 0.65 4.02 0.39 -4.88 117.16 111.48 1xxh n TYR 341 Ca 0.03 0.00 -0.41 0.00 -0.01 0.00 0.00 57.90 57.51 1xxh n TYR 341 Cb 0.52 0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 39.80 1xxh n TYR 341 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1xxh s ALA 342 N -1.98 3.34 -0.04 -0.72 0.00 0.42 -4.83 121.76 117.94 1xxh s ALA 342 Ca 0.09 0.76 0.00 0.00 0.00 0.00 0.00 51.96 52.81 1xxh s ALA 342 Cb 0.11 -3.35 0.00 0.00 0.00 0.00 0.00 23.12 19.88 1xxh s ALA 342 CO 0.45 -0.20 0.00 -0.35 0.00 0.00 0.00 175.76 175.65 1xxh n PRO 343 N 2.74 0.00 0.00 0.00 -0.04 -1.26 -4.41 135.00 132.03 1xxh n PRO 343 Ca 0.04 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.50 1xxh n PRO 343 Cb 0.47 -1.46 0.00 0.00 -0.04 0.00 0.00 33.50 32.47 1xxh n PRO 343 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1xxh n ASP 344 N 0.97 0.00 0.29 3.54 4.64 -1.26 -4.94 116.55 119.78 1xxh n ASP 344 Ca 0.00 0.00 0.18 0.00 -1.38 0.00 0.00 54.79 53.59 1xxh n ASP 344 Cb 0.00 0.00 0.86 0.00 -1.04 0.00 0.00 41.12 40.94 1xxh n ASP 344 CO 0.00 0.00 0.00 0.03 -0.82 0.00 0.00 177.20 176.41 1xxh h ARG 345 N 0.00 0.00 0.24 -0.67 3.08 -1.85 -1.95 114.38 113.22 1xxh h ARG 345 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 1xxh h ARG 345 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 1xxh h ARG 345 CO 0.00 0.03 -0.11 -0.09 -1.07 0.00 0.00 179.97 178.73 1xxh h ARG 346 N 0.00 -0.31 -0.34 0.04 2.43 -1.94 -2.99 114.38 111.27 1xxh h ARG 346 Ca -0.00 0.02 0.03 0.00 -0.81 0.00 0.00 59.98 59.22 1xxh h ARG 346 Cb 0.32 0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 29.90 1xxh h ARG 346 CO 0.00 -0.21 -0.20 -0.12 -1.51 0.00 0.00 179.97 177.94 1xxh n MET 347 N -4.93 -0.15 -0.35 0.20 1.56 -1.11 0.17 117.12 112.51 1xxh n MET 347 Ca -0.04 1.11 0.13 0.00 -0.27 0.00 0.00 57.70 58.63 1xxh n MET 347 Cb 0.13 -1.65 0.26 0.00 2.15 0.00 0.00 33.22 34.10 1xxh n MET 347 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1xxh n GLY 348 N -1.09 -1.42 0.25 -5.12 0.00 -0.75 0.54 105.19 97.60 1xxh n GLY 348 Ca 0.01 0.99 0.00 0.00 0.00 0.00 0.00 46.02 47.02 1xxh n GLY 348 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1xxh h VAL 349 N 0.00 1.21 0.04 1.61 2.07 0.20 0.13 116.25 121.51 1xxh h VAL 349 Ca 0.57 -0.91 -0.00 0.00 0.82 0.00 0.00 66.70 67.18 1xxh h VAL 349 Cb 1.12 1.18 0.00 0.00 -1.52 0.00 0.00 31.29 32.07 1xxh h VAL 349 CO -0.95 0.29 -0.02 -0.33 0.02 0.00 0.00 177.57 176.58 1xxh h GLU 350 N 0.35 -0.05 -0.93 1.57 5.08 0.19 -3.12 114.58 117.66 1xxh h GLU 350 Ca 0.07 0.00 0.24 0.00 -1.00 0.00 0.00 59.36 58.67 1xxh h GLU 350 Cb 0.44 0.01 -0.17 0.00 0.50 0.00 0.00 28.75 29.53 1xxh h GLU 350 CO 0.03 0.23 -0.01 1.98 -1.00 0.00 0.00 179.01 180.24 1xxh h MET 351 N -1.00 0.04 -0.68 2.33 4.05 0.19 -0.03 114.93 119.82 1xxh h MET 351 Ca -0.01 -0.00 -0.01 0.00 -0.28 0.00 0.00 59.70 59.40 1xxh h MET 351 Cb 0.31 -0.01 -0.03 0.00 -0.80 0.00 0.00 31.60 31.07 1xxh h MET 351 CO 0.01 0.02 0.39 1.15 0.23 0.00 0.00 176.91 178.71 1xxh h THR 352 N 0.04 1.21 -0.04 -0.77 2.02 -0.82 -0.74 112.91 113.80 1xxh h THR 352 Ca 0.54 -0.50 -0.09 0.00 0.77 0.00 0.00 66.41 67.13 1xxh h THR 352 Cb 1.04 0.30 -0.01 0.00 -1.74 0.00 0.00 68.15 67.73 1xxh h THR 352 CO -0.87 0.22 -0.37 -0.07 0.37 0.00 0.00 175.52 174.80 1xxh h LEU 353 N 0.93 0.08 0.73 2.58 3.38 -0.97 -2.15 115.31 119.90 1xxh h LEU 353 Ca 0.24 -0.03 -0.04 0.00 0.09 0.00 0.00 57.88 58.15 1xxh h LEU 353 Cb 0.02 -0.02 0.01 0.00 0.09 0.00 0.00 40.66 40.75 1xxh h LEU 353 CO -0.04 0.45 -0.35 -0.07 0.09 0.00 0.00 178.44 178.52 1xxh h LEU 354 N 0.07 -0.83 -0.97 1.67 3.38 -0.52 0.22 115.31 118.34 1xxh h LEU 354 Ca 0.01 0.02 0.16 0.00 0.09 0.00 0.00 57.88 58.15 1xxh h LEU 354 Cb 0.69 0.22 -0.16 0.00 0.09 0.00 0.00 40.66 41.50 1xxh h LEU 354 CO 0.05 -0.56 -0.37 -0.09 0.09 0.00 0.00 178.44 177.56 1xxh h ARG 355 N -1.04 -0.01 -0.64 1.13 2.43 -0.85 3.56 114.38 118.97 1xxh h ARG 355 Ca -0.10 0.00 0.13 0.00 -0.81 0.00 0.00 59.98 59.20 1xxh h ARG 355 Cb 0.77 0.00 -0.10 0.00 -0.42 0.00 0.00 29.97 30.22 1xxh h ARG 355 CO 0.16 -0.01 0.10 0.00 -1.51 0.00 0.00 179.97 178.72 1xxh h ALA 356 N 1.42 0.74 -0.29 2.80 0.00 -0.86 0.66 119.26 123.74 1xxh h ALA 356 Ca 0.35 0.16 -0.12 0.00 0.00 0.00 0.00 54.91 55.30 1xxh h ALA 356 Cb 0.61 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 1xxh h ALA 356 CO -0.98 -0.34 -0.31 1.25 0.00 0.00 0.00 179.25 178.87 1xxh h LEU 357 N 0.22 0.62 -0.63 0.00 5.85 0.94 0.24 115.31 122.55 1xxh h LEU 357 Ca 0.34 -0.24 -0.15 0.00 0.84 0.00 0.00 57.88 58.67 1xxh h LEU 357 Cb 0.54 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.39 1xxh h LEU 357 CO -0.47 0.90 -0.62 0.00 -0.34 0.00 0.00 178.44 177.91 1xxh h ALA 358 N 1.14 0.83 -0.50 1.25 0.00 0.36 -2.66 119.26 119.67 1xxh h ALA 358 Ca 0.06 -0.55 -0.19 0.00 0.00 0.00 0.00 54.91 54.23 1xxh h ALA 358 Cb 0.79 -0.08 -0.11 0.00 0.00 0.00 0.00 17.79 18.39 1xxh h ALA 358 CO 0.06 0.74 0.12 1.19 0.00 0.00 0.00 179.25 181.36 1xxh n PHE 359 N -3.86 1.61 -1.00 0.00 3.01 0.21 -3.66 117.46 113.76 1xxh n PHE 359 Ca -0.02 -1.38 -0.33 0.00 1.01 0.00 0.00 57.45 56.72 1xxh n PHE 359 Cb 0.63 -0.55 0.12 0.00 -0.01 0.00 0.00 39.48 39.67 1xxh n PHE 359 CO 0.00 0.00 0.00 1.58 1.01 0.00 0.00 176.76 179.35 1xxh n HIS 360 N -0.80 0.38 0.10 1.38 -0.00 0.83 -4.91 115.22 112.20 1xxh n HIS 360 Ca 0.36 0.36 0.10 0.00 0.46 0.00 0.00 57.72 59.00 1xxh n HIS 360 Cb 1.16 -2.00 0.20 0.00 -0.12 0.00 0.00 29.99 29.23 1xxh n HIS 360 CO 0.00 0.00 0.00 -0.35 0.46 0.00 0.00 176.34 176.45 1xxh n PRO 361 N -2.74 2.38 0.00 1.57 -0.04 -1.26 -4.19 135.00 130.72 1xxh n PRO 361 Ca 0.11 -2.17 0.00 0.00 -0.04 0.00 0.00 63.50 61.41 1xxh n PRO 361 Cb 0.51 -1.43 0.00 0.00 -0.04 0.00 0.00 33.50 32.54 1xxh n PRO 361 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1xxh n ARG 362 N 1.20 2.30 -3.00 0.54 5.12 -1.26 -4.92 116.66 116.65 1xxh n ARG 362 Ca 0.17 0.00 -0.13 0.00 -1.93 0.00 0.00 57.85 55.96 1xxh n ARG 362 Cb 0.53 -0.90 -0.03 0.00 -1.16 0.00 0.00 32.46 30.90 1xxh n ARG 362 CO 0.00 0.00 0.00 -1.33 -1.93 0.00 0.00 177.63 174.37 1xxh n MET 363 N -1.47 0.44 -1.73 5.56 2.81 -1.26 -5.15 117.12 116.32 1xxh n MET 363 Ca 0.00 -2.46 -0.29 0.00 -1.81 0.00 0.00 57.70 53.13 1xxh n MET 363 Cb 0.22 -1.53 0.09 0.00 -0.71 0.00 0.00 33.22 31.29 1xxh n MET 363 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 1xxh s PRO 364 N 0.48 2.00 0.15 0.03 0.04 -1.26 -4.69 135.00 131.76 1xxh s PRO 364 Ca 0.31 0.35 -0.31 0.00 0.04 0.00 0.00 61.00 61.40 1xxh s PRO 364 Cb 0.04 -1.93 -0.09 0.00 0.04 0.00 0.00 34.50 32.56 1xxh s PRO 364 CO -0.12 -1.61 1.45 -0.51 0.04 0.00 0.00 177.00 176.25 1xxh s LEU 365 N -5.68 4.38 0.34 -3.56 1.43 -1.01 -4.98 118.68 109.59 1xxh s LEU 365 Ca 0.61 2.47 -0.26 0.00 -1.03 0.00 0.00 54.13 55.92 1xxh s LEU 365 Cb -0.13 -3.59 -0.10 0.00 0.03 0.00 0.00 46.19 42.40 1xxh s LEU 365 CO 0.52 -0.71 0.99 -2.16 0.23 0.00 0.00 176.35 175.22 1xxh s PRO 366 N 0.88 4.48 -0.22 1.29 0.04 -1.26 -4.94 135.00 135.26 1xxh s PRO 366 Ca 0.65 1.44 -0.01 0.00 0.04 0.00 0.00 61.00 63.12 1xxh s PRO 366 Cb -0.40 -2.79 0.07 0.00 0.04 0.00 0.00 34.50 31.42 1xxh s PRO 366 CO 0.32 0.16 0.02 -2.00 0.04 0.00 0.00 177.00 175.54 1xxh s GLU 367 N -2.08 0.95 0.00 4.56 -6.30 -1.26 -5.23 118.70 109.33 1xxh s GLU 367 Ca 0.51 -0.69 0.00 0.00 -2.50 0.00 0.00 54.97 52.29 1xxh s GLU 367 Cb -0.21 -2.24 0.00 0.00 0.00 0.00 0.00 34.13 31.68 1xxh s GLU 367 CO 0.27 -0.68 0.47 -0.35 0.02 0.00 0.00 175.26 174.99