#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xdi s THR 3 N 0.00 5.03 -0.45 2.52 -1.32 -0.49 -4.94 115.64 115.98 1xdi s THR 3 Ca 0.00 1.38 -0.22 0.00 -1.21 0.00 0.00 61.69 61.63 1xdi s THR 3 Cb 0.00 -4.02 0.03 0.00 -1.51 0.00 0.00 72.50 67.00 1xdi s THR 3 CO 0.00 0.19 0.75 -0.13 -2.21 0.00 0.00 174.62 173.22 1xdi s ARG 4 N 1.24 3.36 -0.25 7.08 0.52 -1.26 -1.75 118.95 127.89 1xdi s ARG 4 Ca 0.35 -0.20 -0.10 0.00 -0.52 0.00 0.00 55.73 55.26 1xdi s ARG 4 Cb -0.17 -3.95 -0.05 0.00 0.52 0.00 0.00 34.95 31.31 1xdi s ARG 4 CO 0.15 -1.10 0.15 0.42 0.02 0.00 0.00 175.30 174.93 1xdi s ILE 5 N 3.17 5.16 -0.14 1.52 1.01 -0.33 -1.02 121.20 130.57 1xdi s ILE 5 Ca 0.28 0.11 0.02 0.00 0.00 0.00 0.00 60.65 61.06 1xdi s ILE 5 Cb -0.13 -3.41 0.01 0.00 0.01 0.00 0.00 42.46 38.94 1xdi s ILE 5 CO 0.21 0.33 -0.20 -0.69 0.00 0.00 0.00 174.94 174.59 1xdi s VAL 6 N 1.25 1.95 -0.22 2.92 1.01 -0.94 -0.27 120.40 126.09 1xdi s VAL 6 Ca 0.07 -0.90 -0.05 0.00 0.00 0.00 0.00 61.98 61.10 1xdi s VAL 6 Cb -0.14 -1.74 -0.02 0.00 0.00 0.00 0.00 36.38 34.48 1xdi s VAL 6 CO 0.06 0.53 0.00 -0.63 0.00 0.00 0.00 175.10 175.06 1xdi s ILE 7 N 0.99 3.85 -0.32 2.22 1.01 -0.44 -1.56 121.20 126.97 1xdi s ILE 7 Ca -0.03 -0.34 -0.18 0.00 0.00 0.00 0.00 60.65 60.10 1xdi s ILE 7 Cb -0.15 -2.76 -0.01 0.00 0.01 0.00 0.00 42.46 39.55 1xdi s ILE 7 CO -0.05 0.41 0.49 -0.76 0.00 0.00 0.00 174.94 175.03 1xdi s LEU 8 N 1.28 4.22 0.00 2.97 1.43 -0.69 -0.82 118.68 127.07 1xdi s LEU 8 Ca 0.04 0.16 0.00 0.00 -1.03 0.00 0.00 54.13 53.30 1xdi s LEU 8 Cb -0.15 -2.58 0.00 0.00 0.03 0.00 0.00 46.19 43.49 1xdi s LEU 8 CO 0.01 -0.39 0.00 0.61 0.23 0.00 0.00 176.35 176.81 1xdi n GLY 9 N 4.67 2.01 1.29 -3.19 0.00 0.83 0.16 105.19 110.96 1xdi n GLY 9 Ca -0.05 -1.45 -0.08 0.00 0.00 0.00 0.00 46.02 44.44 1xdi n GLY 9 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xdi n GLY 10 N 2.45 5.44 0.00 -0.02 0.00 -1.26 -4.14 105.19 107.66 1xdi n GLY 10 Ca 0.00 -1.70 0.00 0.00 0.00 0.00 0.00 46.02 44.32 1xdi n GLY 10 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xdi n GLY 11 N -1.00 0.68 0.32 -0.02 0.00 -1.26 -0.49 105.19 103.41 1xdi n GLY 11 Ca 0.33 -1.91 0.02 0.00 0.00 0.00 0.00 46.02 44.46 1xdi n GLY 11 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1xdi h PRO 12 N 0.00 -0.02 -0.16 1.61 0.11 -1.91 0.20 132.00 131.82 1xdi h PRO 12 Ca 0.00 0.00 0.04 0.00 0.11 0.00 0.00 66.00 66.15 1xdi h PRO 12 Cb 0.00 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 31.05 1xdi h PRO 12 CO 0.00 -0.01 -0.49 0.00 -0.21 0.00 0.00 178.00 177.29 1xdi h ALA 13 N 1.69 -0.73 0.03 -0.75 0.00 -1.85 -2.68 119.26 114.97 1xdi h ALA 13 Ca 0.37 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.26 1xdi h ALA 13 Cb 0.60 0.92 0.00 0.00 0.00 0.00 0.00 17.79 19.31 1xdi h ALA 13 CO -0.85 -1.01 -0.02 0.78 0.00 0.00 0.00 179.25 178.16 1xdi h GLY 14 N -0.52 -0.05 1.83 0.00 0.00 -1.09 -3.13 103.07 100.12 1xdi h GLY 14 Ca 0.06 0.02 0.00 0.00 0.00 0.00 0.00 47.33 47.41 1xdi h GLY 14 CO -0.44 -0.02 0.00 1.58 0.00 0.00 0.00 176.54 177.66 1xdi n TYR 15 N -4.82 0.00 -0.71 5.60 0.18 0.47 -1.40 117.16 116.47 1xdi n TYR 15 Ca -0.09 0.00 0.06 0.00 1.88 0.00 0.00 57.90 59.75 1xdi n TYR 15 Cb 0.30 -0.42 0.08 0.00 -0.38 0.00 0.00 39.34 38.92 1xdi n TYR 15 CO 0.00 0.00 0.00 -1.91 -2.08 0.00 0.00 176.86 172.87 1xdi n GLU 16 N -1.42 1.83 -0.08 -3.48 2.13 -1.01 -2.64 120.64 115.97 1xdi n GLU 16 Ca 0.05 -2.07 -0.10 0.00 0.66 0.00 0.00 57.16 55.70 1xdi n GLU 16 Cb 0.14 -1.25 -0.09 0.00 0.27 0.00 0.00 31.44 30.50 1xdi n GLU 16 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1xdi n ALA 17 N -1.01 1.64 -0.08 4.31 0.00 -0.75 -3.98 120.51 120.65 1xdi n ALA 17 Ca 0.09 -0.82 -0.13 0.00 0.00 0.00 0.00 53.44 52.58 1xdi n ALA 17 Cb 0.50 0.03 -0.05 0.00 0.00 0.00 0.00 19.45 19.93 1xdi n ALA 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xdi h ALA 18 N 0.31 0.36 -0.24 0.00 0.00 -1.32 -0.85 119.26 117.52 1xdi h ALA 18 Ca -0.38 -0.39 0.05 0.00 0.00 0.00 0.00 54.91 54.19 1xdi h ALA 18 Cb 1.72 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 19.38 1xdi h ALA 18 CO -0.02 0.36 -0.07 1.25 0.00 0.00 0.00 179.25 180.76 1xdi h LEU 19 N 0.32 -0.26 -0.82 0.00 5.85 -1.70 0.11 115.31 118.81 1xdi h LEU 19 Ca 0.04 0.08 -0.06 0.00 0.84 0.00 0.00 57.88 58.77 1xdi h LEU 19 Cb 0.83 0.16 -0.03 0.00 0.37 0.00 0.00 40.66 42.00 1xdi h LEU 19 CO 0.07 -0.10 0.18 0.58 -0.34 0.00 0.00 178.44 178.83 1xdi h VAL 20 N -0.02 1.25 0.77 1.05 2.07 -1.67 -1.06 116.25 118.64 1xdi h VAL 20 Ca 0.12 -0.91 -0.04 0.00 0.82 0.00 0.00 66.70 66.69 1xdi h VAL 20 Cb 0.20 0.54 0.01 0.00 -1.52 0.00 0.00 31.29 30.51 1xdi h VAL 20 CO -0.26 0.35 -0.37 0.00 0.02 0.00 0.00 177.57 177.32 1xdi h ALA 21 N 1.18 -1.28 0.00 1.67 0.00 -0.06 -2.57 119.26 118.20 1xdi h ALA 21 Ca 0.22 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 1xdi h ALA 21 Cb 0.33 0.40 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1xdi h ALA 21 CO -0.00 -1.20 -0.23 0.00 0.00 0.00 0.00 179.25 177.82 1xdi h ALA 22 N -1.53 1.36 0.17 0.00 0.00 -0.86 -2.55 119.26 115.85 1xdi h ALA 22 Ca -0.11 -0.21 -0.32 0.00 0.00 0.00 0.00 54.91 54.28 1xdi h ALA 22 Cb 0.79 -0.04 0.03 0.00 0.00 0.00 0.00 17.79 18.57 1xdi h ALA 22 CO 0.17 0.29 -1.34 1.15 0.00 0.00 0.00 179.25 179.52 1xdi h THR 23 N 0.00 1.28 0.00 0.00 2.02 -1.19 -3.06 112.91 111.96 1xdi h THR 23 Ca -0.00 -2.55 0.00 0.00 0.77 0.00 0.00 66.41 64.62 1xdi h THR 23 Cb 0.49 2.83 0.00 0.00 -1.74 0.00 0.00 68.15 69.73 1xdi h THR 23 CO 0.03 0.77 -0.66 -1.20 0.37 0.00 0.00 175.52 174.83 1xdi n SER 24 N -3.76 0.60 -2.70 4.18 7.64 -0.97 -4.46 113.62 114.15 1xdi n SER 24 Ca -0.15 -0.29 -0.07 0.00 1.01 0.00 0.00 58.87 59.37 1xdi n SER 24 Cb 1.03 0.42 0.03 0.00 -1.01 0.00 0.00 64.21 64.69 1xdi n SER 24 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1xdi n HIS 25 N -1.65 1.21 -0.32 1.43 8.25 -0.96 -4.97 115.22 118.20 1xdi n HIS 25 Ca 0.04 -2.64 0.22 0.00 -0.26 0.00 0.00 57.72 55.08 1xdi n HIS 25 Cb 0.36 -0.34 0.43 0.00 1.12 0.00 0.00 29.99 31.56 1xdi n HIS 25 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1xdi h PRO 26 N 2.90 0.16 -0.02 -0.41 0.11 -1.75 -2.56 132.00 130.44 1xdi h PRO 26 Ca -0.10 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.00 1xdi h PRO 26 Cb 1.20 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1xdi h PRO 26 CO 0.43 0.11 -0.35 0.39 -0.21 0.00 0.00 178.00 178.36 1xdi n GLU 27 N -5.21 1.44 0.00 1.05 1.02 -1.26 -4.27 120.64 113.40 1xdi n GLU 27 Ca 0.29 -1.17 0.06 0.00 -0.02 0.00 0.00 57.16 56.33 1xdi n GLU 27 Cb 0.94 -1.48 -0.00 0.00 -0.02 0.00 0.00 31.44 30.88 1xdi n GLU 27 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1xdi n THR 28 N 0.24 0.00 -4.37 2.62 -2.24 -0.99 -5.00 114.28 104.54 1xdi n THR 28 Ca 0.11 -0.36 -0.19 0.00 -2.27 0.00 0.00 64.05 61.33 1xdi n THR 28 Cb 0.49 1.15 -0.10 0.00 -2.10 0.00 0.00 70.33 69.76 1xdi n THR 28 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1xdi s THR 29 N -1.64 1.65 -0.27 4.28 -4.23 -1.08 -1.40 115.64 112.95 1xdi s THR 29 Ca 0.10 -2.16 -0.02 0.00 -1.18 0.00 0.00 61.69 58.43 1xdi s THR 29 Cb 0.10 -2.22 0.09 0.00 1.34 0.00 0.00 72.50 71.81 1xdi s THR 29 CO 0.33 -0.47 0.08 -1.58 -0.54 0.00 0.00 174.62 172.45 1xdi s GLN 30 N -3.69 0.59 -0.24 3.99 0.74 -0.72 -4.93 119.66 115.40 1xdi s GLN 30 Ca 0.25 -0.74 -0.14 0.00 0.05 0.00 0.00 55.36 54.78 1xdi s GLN 30 Cb 0.01 -1.86 -0.04 0.00 1.10 0.00 0.00 33.01 32.22 1xdi s GLN 30 CO 0.09 -0.88 0.33 0.08 -0.55 0.00 0.00 175.29 174.36 1xdi s VAL 31 N 1.80 5.23 -0.13 1.34 1.01 -1.26 -1.19 120.40 127.19 1xdi s VAL 31 Ca 0.06 0.53 0.01 0.00 0.00 0.00 0.00 61.98 62.58 1xdi s VAL 31 Cb -0.17 -3.66 -0.01 0.00 0.00 0.00 0.00 36.38 32.54 1xdi s VAL 31 CO -0.22 0.24 -0.17 -0.89 0.00 0.00 0.00 175.10 174.06 1xdi s THR 32 N 1.55 2.63 -0.24 3.92 2.01 0.62 -1.58 115.64 124.55 1xdi s THR 32 Ca 0.15 -0.80 -0.04 0.00 0.31 0.00 0.00 61.69 61.31 1xdi s THR 32 Cb -0.15 -2.08 0.00 0.00 0.01 0.00 0.00 72.50 70.28 1xdi s THR 32 CO 0.08 0.53 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.82 1xdi s VAL 33 N 0.53 3.34 -0.39 3.82 1.01 -0.46 -1.32 120.40 126.94 1xdi s VAL 33 Ca -0.11 -0.66 -0.08 0.00 0.00 0.00 0.00 61.98 61.13 1xdi s VAL 33 Cb -0.16 -2.60 0.06 0.00 0.00 0.00 0.00 36.38 33.68 1xdi s VAL 33 CO 0.04 0.31 0.20 -0.63 0.00 0.00 0.00 175.10 175.02 1xdi s ILE 34 N 1.44 4.06 -0.01 2.22 1.01 -0.00 -0.56 121.20 129.36 1xdi s ILE 34 Ca 0.04 -1.30 0.04 0.00 0.00 0.00 0.00 60.65 59.44 1xdi s ILE 34 Cb -0.15 -3.42 -0.01 0.00 0.01 0.00 0.00 42.46 38.88 1xdi s ILE 34 CO -0.03 -0.38 -0.14 -0.62 0.00 0.00 0.00 174.94 173.77 1xdi s ASP 35 N 1.81 1.64 -0.14 3.58 2.15 -1.03 -0.12 116.67 124.56 1xdi s ASP 35 Ca 0.02 -0.27 0.07 0.00 0.43 0.00 0.00 52.55 52.80 1xdi s ASP 35 Cb -0.21 -0.18 -0.23 0.00 -0.30 0.00 0.00 42.92 42.00 1xdi s ASP 35 CO 0.02 0.16 0.30 0.00 -0.17 0.00 0.00 175.17 175.49 1xdi n ASP 37 N -3.13 0.70 0.00 0.00 8.00 -1.26 -4.56 116.55 116.30 1xdi n ASP 37 Ca -0.29 -0.50 0.00 0.00 0.71 0.00 0.00 54.79 54.71 1xdi n ASP 37 Cb 1.07 0.67 0.00 0.00 -0.02 0.00 0.00 41.12 42.84 1xdi n ASP 37 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1xdi n GLY 38 N 1.46 3.70 3.73 0.44 0.00 -1.26 -4.97 105.19 108.30 1xdi n GLY 38 Ca 0.04 -1.30 -0.65 0.00 0.00 0.00 0.00 46.02 44.10 1xdi n GLY 38 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1xdi n ILE 39 N 0.30 0.07 0.00 -0.61 2.08 -1.26 -1.55 119.36 118.39 1xdi n ILE 39 Ca 0.00 -0.01 0.00 0.00 0.56 0.00 0.00 62.75 63.30 1xdi n ILE 39 Cb 0.00 -0.64 0.00 0.00 -0.75 0.00 0.00 39.64 38.25 1xdi n ILE 39 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1xdi n GLY 40 N 3.93 1.98 7.00 7.39 0.00 0.36 -4.50 105.19 121.35 1xdi n GLY 40 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.31 1xdi n GLY 40 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xdi n GLY 41 N 0.00 -0.13 0.29 -0.02 0.00 -0.59 -2.19 105.19 102.55 1xdi n GLY 41 Ca 0.00 -0.68 0.06 0.00 0.00 0.00 0.00 46.02 45.40 1xdi n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xdi h ALA 42 N -0.61 1.86 -0.77 4.61 0.00 -1.94 0.24 119.26 122.66 1xdi h ALA 42 Ca 0.00 -0.02 0.10 0.00 0.00 0.00 0.00 54.91 55.00 1xdi h ALA 42 Cb 0.00 -0.09 -0.08 0.00 0.00 0.00 0.00 17.79 17.63 1xdi h ALA 42 CO 0.00 0.12 0.40 0.00 0.00 0.00 0.00 179.25 179.76 1xdi h ALA 43 N 1.85 1.09 0.12 0.00 0.00 -1.96 0.41 119.26 120.77 1xdi h ALA 43 Ca 0.09 0.05 -0.36 0.00 0.00 0.00 0.00 54.91 54.70 1xdi h ALA 43 Cb 0.02 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1xdi h ALA 43 CO -0.02 -0.02 -1.99 0.28 0.00 0.00 0.00 179.25 177.50 1xdi n VAL 44 N -4.83 1.77 0.23 0.00 0.31 -0.89 0.45 118.33 115.37 1xdi n VAL 44 Ca 0.13 -0.64 0.12 0.00 -0.01 0.00 0.00 64.34 63.94 1xdi n VAL 44 Cb 0.30 -1.74 0.04 0.00 -0.91 0.00 0.00 33.84 31.53 1xdi n VAL 44 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1xdi h LEU 45 N 0.04 0.00 0.00 7.52 3.38 -0.96 -3.39 115.31 121.90 1xdi h LEU 45 Ca -0.43 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.47 1xdi h LEU 45 Cb 2.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.76 1xdi h LEU 45 CO 0.08 0.03 -0.13 0.47 0.09 0.00 0.00 178.44 178.98 1xdi n ASP 46 N -2.52 0.49 0.00 -0.43 8.00 0.86 -4.90 116.55 118.05 1xdi n ASP 46 Ca 0.01 0.22 0.00 0.00 0.71 0.00 0.00 54.79 55.73 1xdi n ASP 46 Cb 0.52 -0.04 0.00 0.00 -0.02 0.00 0.00 41.12 41.58 1xdi n ASP 46 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1xdi n ASP 47 N -3.35 0.00 0.00 -2.24 8.00 0.11 -4.67 116.55 114.39 1xdi n ASP 47 Ca 0.00 0.04 0.00 0.00 0.71 0.00 0.00 54.79 55.54 1xdi n ASP 47 Cb 0.07 -0.13 0.00 0.00 -0.02 0.00 0.00 41.12 41.03 1xdi n ASP 47 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1xdi h VAL 49 N 0.00 0.11 0.63 0.00 2.07 -0.22 -2.54 116.25 116.30 1xdi h VAL 49 Ca 0.00 -0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.49 1xdi h VAL 49 Cb 0.00 0.11 0.01 0.00 -1.52 0.00 0.00 31.29 29.88 1xdi h VAL 49 CO 0.00 0.00 -0.30 -0.65 0.02 0.00 0.00 177.57 176.64 1xdi h PRO 50 N 0.00 -0.81 -0.72 1.57 0.11 -1.75 -0.87 132.00 129.53 1xdi h PRO 50 Ca 0.44 0.06 0.14 0.00 0.11 0.00 0.00 66.00 66.74 1xdi h PRO 50 Cb 0.68 0.18 -0.10 0.00 0.11 0.00 0.00 31.00 31.88 1xdi h PRO 50 CO -0.91 -0.53 0.24 0.66 -0.21 0.00 0.00 178.00 177.25 1xdi h SER 51 N -0.87 0.17 -0.21 -2.05 4.64 -1.19 0.59 113.55 114.63 1xdi h SER 51 Ca -0.09 0.12 -0.04 0.00 -0.47 0.00 0.00 61.79 61.31 1xdi h SER 51 Cb 0.66 0.12 -0.02 0.00 -0.31 0.00 0.00 62.40 62.85 1xdi h SER 51 CO 0.14 0.05 0.02 0.11 -0.87 0.00 0.00 176.83 176.28 1xdi h LYS 52 N 0.37 0.47 0.37 4.77 6.56 -1.39 0.36 116.57 128.07 1xdi h LYS 52 Ca 0.40 -0.09 -0.02 0.00 -1.06 0.00 0.00 60.65 59.88 1xdi h LYS 52 Cb 0.62 -0.07 0.00 0.00 -0.57 0.00 0.00 32.23 32.21 1xdi h LYS 52 CO -0.43 0.48 -0.18 1.15 -2.06 0.00 0.00 179.45 178.41 1xdi h THR 53 N 0.45 0.50 -0.71 -0.16 2.02 0.76 -0.85 112.91 114.93 1xdi h THR 53 Ca 0.10 -0.63 0.15 0.00 0.77 0.00 0.00 66.41 66.81 1xdi h THR 53 Cb 0.27 0.75 -0.13 0.00 -1.74 0.00 0.00 68.15 67.30 1xdi h THR 53 CO 0.01 0.10 -0.10 0.15 0.37 0.00 0.00 175.52 176.04 1xdi h PHE 54 N -0.92 -0.24 -0.12 3.16 3.57 0.43 0.53 116.94 123.35 1xdi h PHE 54 Ca -0.05 0.06 -0.06 0.00 3.53 0.00 0.00 57.97 61.44 1xdi h PHE 54 Cb 0.54 0.22 -0.01 0.00 2.79 0.00 0.00 35.95 39.49 1xdi h PHE 54 CO 0.03 -0.28 -0.22 0.82 -2.23 0.00 0.00 178.31 176.44 1xdi h ILE 55 N 0.04 1.21 -0.19 1.41 2.04 -0.24 -2.11 117.51 119.67 1xdi h ILE 55 Ca 0.36 -0.98 -0.14 0.00 1.00 0.00 0.00 64.86 65.10 1xdi h ILE 55 Cb 0.59 1.37 -0.01 0.00 -0.74 0.00 0.00 36.82 38.03 1xdi h ILE 55 CO -0.69 0.30 -0.48 0.00 0.00 0.00 0.00 178.15 177.28 1xdi h ALA 56 N 1.60 0.81 -0.29 1.87 0.00 0.58 -1.76 119.26 122.06 1xdi h ALA 56 Ca 0.03 -0.47 -0.09 0.00 0.00 0.00 0.00 54.91 54.38 1xdi h ALA 56 Cb 0.49 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1xdi h ALA 56 CO 0.03 0.66 -0.17 0.77 0.00 0.00 0.00 179.25 180.55 1xdi h SER 57 N 0.40 0.65 -0.97 0.00 0.02 -1.03 -2.82 113.55 109.81 1xdi h SER 57 Ca 0.02 -0.42 0.11 0.00 -0.84 0.00 0.00 61.79 60.66 1xdi h SER 57 Cb 0.99 -0.18 -0.08 0.00 0.14 0.00 0.00 62.40 63.27 1xdi h SER 57 CO 0.09 0.94 0.60 0.74 -1.14 0.00 0.00 176.83 178.06 1xdi h THR 58 N 0.38 0.94 -0.68 -2.27 2.02 -1.22 -2.43 112.91 109.65 1xdi h THR 58 Ca 0.06 -0.34 0.14 0.00 0.77 0.00 0.00 66.41 67.05 1xdi h THR 58 Cb 0.70 -0.13 -0.12 0.00 -1.74 0.00 0.00 68.15 66.86 1xdi h THR 58 CO 0.05 0.18 -0.05 1.23 0.37 0.00 0.00 175.52 177.30 1xdi h GLY 59 N 0.99 0.66 -0.57 2.16 0.00 -1.05 -1.26 103.07 103.99 1xdi h GLY 59 Ca 0.47 0.13 0.14 0.00 0.00 0.00 0.00 47.33 48.07 1xdi h GLY 59 CO -0.25 -0.25 -0.27 1.41 0.00 0.00 0.00 176.54 177.18 1xdi h LEU 60 N 0.07 -0.98 -0.67 3.11 3.38 -1.49 0.13 115.31 118.87 1xdi h LEU 60 Ca 0.35 0.24 0.10 0.00 0.09 0.00 0.00 57.88 58.66 1xdi h LEU 60 Cb 0.58 0.56 -0.07 0.00 0.09 0.00 0.00 40.66 41.81 1xdi h LEU 60 CO -0.62 -0.28 0.29 -0.09 0.09 0.00 0.00 178.44 177.83 1xdi h ARG 61 N -0.06 0.48 0.00 1.13 2.43 -1.37 -0.71 114.38 116.28 1xdi h ARG 61 Ca 0.32 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.46 1xdi h ARG 61 Cb 0.57 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.01 1xdi h ARG 61 CO -0.79 0.32 0.00 2.41 -1.51 0.00 0.00 179.97 180.40 1xdi n THR 62 N -4.94 0.00 0.00 0.20 -1.04 0.42 -3.35 114.28 105.57 1xdi n THR 62 Ca 0.10 1.47 0.00 0.00 -2.04 0.00 0.00 64.05 63.59 1xdi n THR 62 Cb 0.29 -2.05 0.00 0.00 -1.82 0.00 0.00 70.33 66.75 1xdi n THR 62 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1xdi n GLU 63 N -2.74 0.00 0.00 -2.82 1.02 -0.86 -3.99 120.64 111.25 1xdi n GLU 63 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1xdi n GLU 63 Cb 0.00 -0.40 0.00 0.00 -0.02 0.00 0.00 31.44 31.02 1xdi n GLU 63 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 1xdi n LEU 64 N 0.00 0.00 -0.68 -4.62 7.94 -0.33 0.15 117.00 119.46 1xdi n LEU 64 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 1xdi n LEU 64 Cb 0.00 0.00 0.00 0.00 0.53 0.00 0.00 43.42 43.95 1xdi n LEU 64 CO 0.00 0.00 0.09 0.54 -1.11 0.00 0.00 177.39 176.91 1xdi n ARG 65 N 0.00 0.26 -0.11 1.96 1.74 -1.21 0.11 116.66 119.41 1xdi n ARG 65 Ca 0.00 0.00 0.04 0.00 -0.77 0.00 0.00 57.85 57.12 1xdi n ARG 65 Cb 0.00 -1.22 0.09 0.00 -1.02 0.00 0.00 32.46 30.32 1xdi n ARG 65 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 1xdi n ARG 66 N 0.55 2.75 -0.30 5.56 3.00 0.38 -4.67 116.66 123.94 1xdi n ARG 66 Ca 0.00 -1.94 -0.04 0.00 -0.00 0.00 0.00 57.85 55.87 1xdi n ARG 66 Cb 0.09 -1.23 0.08 0.00 0.00 0.00 0.00 32.46 31.39 1xdi n ARG 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1xdi h ALA 67 N 0.87 1.04 -0.53 5.13 0.00 -0.49 -3.15 119.26 122.13 1xdi h ALA 67 Ca 0.00 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.85 1xdi h ALA 67 Cb 0.73 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 1xdi h ALA 67 CO 0.02 0.47 0.34 -1.35 0.00 0.00 0.00 179.25 178.74 1xdi h PRO 68 N 1.12 0.67 -0.32 0.00 0.11 -1.16 0.16 132.00 132.59 1xdi h PRO 68 Ca 0.30 -0.04 0.09 0.00 0.11 0.00 0.00 66.00 66.46 1xdi h PRO 68 Cb -0.09 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 30.85 1xdi h PRO 68 CO -0.06 0.44 0.25 0.45 -0.21 0.00 0.00 178.00 178.87 1xdi h HIS 69 N 0.69 0.00 -0.02 0.65 3.86 -1.83 0.19 115.15 118.70 1xdi h HIS 69 Ca 0.20 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.41 1xdi h HIS 69 Cb -0.05 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.42 1xdi h HIS 69 CO -0.05 0.00 -0.09 1.28 0.86 0.00 0.00 177.93 179.94 1xdi n LEU 70 N -4.25 1.88 0.00 2.43 4.77 -0.51 -4.94 117.00 116.39 1xdi n LEU 70 Ca 0.05 -0.62 0.00 0.00 -0.03 0.00 0.00 56.01 55.40 1xdi n LEU 70 Cb 0.42 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.49 1xdi n LEU 70 CO 0.34 0.32 0.00 0.61 -1.33 0.00 0.00 177.39 177.33 1xdi n GLY 71 N 1.27 0.80 3.51 -0.72 0.00 0.06 -5.09 105.19 105.02 1xdi n GLY 71 Ca 0.16 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.84 1xdi n GLY 71 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1xdi s PHE 72 N -2.00 2.86 0.00 1.61 0.40 0.46 -4.97 117.98 116.33 1xdi s PHE 72 Ca 0.00 -0.17 0.00 0.00 -0.60 0.00 0.00 56.93 56.16 1xdi s PHE 72 Cb 0.00 -1.73 0.00 0.00 0.51 0.00 0.00 43.02 41.80 1xdi s PHE 72 CO 0.00 0.16 0.00 0.72 0.70 0.00 0.00 175.22 176.80 1xdi n HIS 73 N 2.59 -0.51 0.00 0.36 8.25 -1.26 -0.65 115.22 123.99 1xdi n HIS 73 Ca -0.18 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.28 1xdi n HIS 73 Cb 0.53 0.14 0.00 0.00 1.12 0.00 0.00 29.99 31.77 1xdi n HIS 73 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1xdi n LYS 80 N 0.00 0.00 -4.14 -0.41 5.02 -1.26 -4.88 118.16 112.49 1xdi n LYS 80 Ca 0.00 0.00 -0.34 0.00 -2.02 0.00 0.00 58.31 55.95 1xdi n LYS 80 Cb 0.00 0.00 -0.14 0.00 -0.02 0.00 0.00 35.03 34.87 1xdi n LYS 80 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1xdi s ILE 81 N 0.00 3.37 -1.03 -0.18 1.01 -1.26 -5.06 121.20 118.04 1xdi s ILE 81 Ca 0.00 -0.51 -0.05 0.00 0.00 0.00 0.00 60.65 60.08 1xdi s ILE 81 Cb 0.00 -2.50 0.27 0.00 0.01 0.00 0.00 42.46 40.24 1xdi s ILE 81 CO 0.00 0.45 1.07 -0.24 0.00 0.00 0.00 174.94 176.23 1xdi n SER 82 N 4.38 5.24 -0.32 3.58 2.88 -1.26 -4.94 113.62 123.18 1xdi n SER 82 Ca -0.18 -3.15 0.19 0.00 -1.33 0.00 0.00 58.87 54.40 1xdi n SER 82 Cb 0.51 -1.24 0.38 0.00 -0.75 0.00 0.00 64.21 63.12 1xdi n SER 82 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 1xdi h LEU 83 N 6.14 -0.08 -1.19 2.46 7.12 -1.96 -0.33 115.31 127.47 1xdi h LEU 83 Ca 0.18 0.25 0.03 0.00 0.13 0.00 0.00 57.88 58.47 1xdi h LEU 83 Cb 0.80 0.35 -0.05 0.00 -0.53 0.00 0.00 40.66 41.23 1xdi h LEU 83 CO 1.02 -0.31 0.56 -0.65 -0.13 0.00 0.00 178.44 178.93 1xdi h PRO 84 N 0.08 1.03 0.00 5.25 0.11 -1.84 -0.53 132.00 136.10 1xdi h PRO 84 Ca 0.66 -0.06 -0.12 0.00 0.11 0.00 0.00 66.00 66.59 1xdi h PRO 84 Cb 1.50 -0.23 -0.02 0.00 0.11 0.00 0.00 31.00 32.36 1xdi h PRO 84 CO -0.79 0.68 -0.55 -0.56 -0.21 0.00 0.00 178.00 176.57 1xdi h GLN 85 N 1.06 0.00 0.23 1.05 3.07 -1.49 -0.35 115.11 118.68 1xdi h GLN 85 Ca 0.34 0.00 -0.01 0.00 0.09 0.00 0.00 58.65 59.06 1xdi h GLN 85 Cb 0.02 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.58 1xdi h GLN 85 CO -0.10 0.55 -0.11 0.82 0.09 0.00 0.00 178.83 180.08 1xdi h ILE 86 N 0.00 0.83 -0.64 1.86 2.04 -1.10 -1.11 117.51 119.39 1xdi h ILE 86 Ca -0.01 -0.32 0.08 0.00 1.00 0.00 0.00 64.86 65.62 1xdi h ILE 86 Cb 1.16 1.02 -0.07 0.00 -0.74 0.00 0.00 36.82 38.19 1xdi h ILE 86 CO 0.07 0.07 0.30 0.45 0.00 0.00 0.00 178.15 179.04 1xdi h HIS 87 N -0.47 0.53 -0.11 1.37 3.86 -1.08 0.17 115.15 119.42 1xdi h HIS 87 Ca -0.03 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1xdi h HIS 87 Cb 0.35 -0.14 -0.01 0.00 1.06 0.00 0.00 27.41 28.67 1xdi h HIS 87 CO -0.02 0.20 0.07 0.00 0.86 0.00 0.00 177.93 179.04 1xdi h ALA 88 N 1.39 1.94 0.00 2.45 0.00 -0.82 0.42 119.26 124.65 1xdi h ALA 88 Ca 0.31 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 55.04 1xdi h ALA 88 Cb 0.31 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1xdi h ALA 88 CO -0.25 0.05 -0.80 -0.09 0.00 0.00 0.00 179.25 178.16 1xdi h ARG 89 N 0.13 0.00 -0.21 0.00 2.43 0.32 -0.66 114.38 116.39 1xdi h ARG 89 Ca 0.04 0.00 -0.08 0.00 -0.81 0.00 0.00 59.98 59.13 1xdi h ARG 89 Cb 0.00 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.55 1xdi h ARG 89 CO -0.01 0.80 -0.17 0.28 -1.51 0.00 0.00 179.97 179.35 1xdi h VAL 90 N 0.00 1.32 0.04 0.20 2.07 0.24 -1.89 116.25 118.23 1xdi h VAL 90 Ca -0.01 -1.31 -0.00 0.00 0.82 0.00 0.00 66.70 66.20 1xdi h VAL 90 Cb 1.56 1.71 0.00 0.00 -1.52 0.00 0.00 31.29 33.04 1xdi h VAL 90 CO 0.10 0.40 -0.02 0.11 0.02 0.00 0.00 177.57 178.19 1xdi h LYS 91 N 0.18 -0.05 -0.62 1.57 1.79 -0.88 -2.90 116.57 115.66 1xdi h LYS 91 Ca 0.04 0.00 0.12 0.00 -2.18 0.00 0.00 60.65 58.63 1xdi h LYS 91 Cb 0.71 0.01 -0.12 0.00 -1.58 0.00 0.00 32.23 31.25 1xdi h LYS 91 CO 0.05 0.53 -0.25 1.15 -1.08 0.00 0.00 179.45 179.85 1xdi h THR 92 N -0.67 0.25 -0.60 -0.16 2.02 -1.16 -0.96 112.91 111.64 1xdi h THR 92 Ca -0.01 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.16 1xdi h THR 92 Cb 0.60 0.25 -0.03 0.00 -1.74 0.00 0.00 68.15 67.24 1xdi h THR 92 CO 0.01 0.00 0.31 0.25 0.37 0.00 0.00 175.52 176.46 1xdi h LEU 93 N -0.09 0.76 -0.37 2.58 6.46 -1.43 -2.62 115.31 120.60 1xdi h LEU 93 Ca 0.28 -0.11 0.07 0.00 -0.12 0.00 0.00 57.88 58.00 1xdi h LEU 93 Cb 0.52 -0.20 -0.07 0.00 -0.73 0.00 0.00 40.66 40.19 1xdi h LEU 93 CO -0.68 0.66 -0.06 0.00 -0.62 0.00 0.00 178.44 177.74 1xdi h ALA 94 N 1.14 0.28 -0.80 1.25 0.00 -1.06 -1.66 119.26 118.41 1xdi h ALA 94 Ca 0.21 0.13 0.09 0.00 0.00 0.00 0.00 54.91 55.34 1xdi h ALA 94 Cb 0.08 0.25 -0.05 0.00 0.00 0.00 0.00 17.79 18.07 1xdi h ALA 94 CO -0.03 -0.44 0.52 0.00 0.00 0.00 0.00 179.25 179.30 1xdi h ALA 95 N 1.36 1.75 -0.02 0.00 0.00 -0.93 -1.89 119.26 119.53 1xdi h ALA 95 Ca 0.18 -0.01 -0.23 0.00 0.00 0.00 0.00 54.91 54.85 1xdi h ALA 95 Cb 0.27 -0.17 0.01 0.00 0.00 0.00 0.00 17.79 17.89 1xdi h ALA 95 CO -0.36 0.09 -0.94 0.00 0.00 0.00 0.00 179.25 178.04 1xdi h ALA 96 N 1.60 0.31 -0.50 0.00 0.00 -0.97 -0.54 119.26 119.16 1xdi h ALA 96 Ca 0.37 -0.69 -0.05 0.00 0.00 0.00 0.00 54.91 54.54 1xdi h ALA 96 Cb 0.44 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1xdi h ALA 96 CO -0.14 0.77 0.12 0.37 0.00 0.00 0.00 179.25 180.36 1xdi h GLN 97 N 0.30 0.76 -0.09 0.00 5.75 -0.85 0.68 115.11 121.67 1xdi h GLN 97 Ca -0.09 -0.15 -0.23 0.00 -0.15 0.00 0.00 58.65 58.03 1xdi h GLN 97 Cb 1.58 -0.12 0.01 0.00 1.07 0.00 0.00 27.48 30.03 1xdi h GLN 97 CO 0.17 0.69 -0.84 1.03 -2.65 0.00 0.00 178.83 177.23 1xdi h SER 98 N 0.73 0.89 -0.30 -0.69 0.87 -1.27 -2.99 113.55 110.80 1xdi h SER 98 Ca 0.16 -0.67 -0.10 0.00 -1.23 0.00 0.00 61.79 59.95 1xdi h SER 98 Cb 0.28 -0.27 -0.02 0.00 -0.44 0.00 0.00 62.40 61.96 1xdi h SER 98 CO -0.00 1.43 -0.16 0.00 -0.53 0.00 0.00 176.83 177.58 1xdi h ALA 99 N 0.48 0.97 -0.34 6.23 0.00 -0.50 -1.83 119.26 124.26 1xdi h ALA 99 Ca -0.08 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.50 1xdi h ALA 99 Cb 1.48 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 19.09 1xdi h ALA 99 CO 0.17 0.60 0.21 -0.44 0.00 0.00 0.00 179.25 179.80 1xdi h ASP 100 N 0.67 0.41 -0.58 0.00 5.19 -0.90 -1.79 116.42 119.41 1xdi h ASP 100 Ca 0.11 -0.04 -0.10 0.00 -0.62 0.00 0.00 57.03 56.37 1xdi h ASP 100 Cb 0.64 -0.10 -0.02 0.00 0.18 0.00 0.00 39.33 40.02 1xdi h ASP 100 CO 0.04 0.33 -0.02 0.40 -3.12 0.00 0.00 179.24 176.88 1xdi h ILE 101 N 0.45 1.27 -0.37 0.35 2.04 -1.39 -2.12 117.51 117.73 1xdi h ILE 101 Ca 0.12 -1.16 -0.01 0.00 1.00 0.00 0.00 64.86 64.81 1xdi h ILE 101 Cb -0.01 0.85 -0.02 0.00 -0.74 0.00 0.00 36.82 36.91 1xdi h ILE 101 CO -0.02 0.42 0.21 0.74 0.00 0.00 0.00 178.15 179.49 1xdi h THR 102 N 0.93 1.14 -0.79 -0.27 2.02 -1.20 -1.14 112.91 113.60 1xdi h THR 102 Ca 0.16 -0.36 0.00 0.00 0.77 0.00 0.00 66.41 66.98 1xdi h THR 102 Cb 0.57 0.70 -0.04 0.00 -1.74 0.00 0.00 68.15 67.65 1xdi h THR 102 CO 0.03 0.15 0.50 0.00 0.37 0.00 0.00 175.52 176.57 1xdi h ALA 103 N 1.07 1.39 -0.12 6.16 0.00 -1.13 0.93 119.26 127.55 1xdi h ALA 103 Ca 0.13 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1xdi h ALA 103 Cb 0.05 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 1xdi h ALA 103 CO -0.02 0.54 -0.01 0.37 0.00 0.00 0.00 179.25 180.13 1xdi h GLN 104 N 1.08 0.23 -0.06 0.00 4.15 -0.95 -0.60 115.11 118.95 1xdi h GLN 104 Ca 0.29 -0.08 0.03 0.00 0.77 0.00 0.00 58.65 59.66 1xdi h GLN 104 Cb -0.08 -0.02 -0.03 0.00 0.21 0.00 0.00 27.48 27.56 1xdi h GLN 104 CO -0.06 0.49 -0.10 -0.07 -1.93 0.00 0.00 178.83 177.16 1xdi h LEU 105 N -0.06 -0.29 -1.04 -2.39 3.38 -0.73 -1.21 115.31 112.97 1xdi h LEU 105 Ca 0.03 0.05 0.04 0.00 0.09 0.00 0.00 57.88 58.10 1xdi h LEU 105 Cb 0.39 0.14 -0.06 0.00 0.09 0.00 0.00 40.66 41.22 1xdi h LEU 105 CO 0.01 -0.14 0.64 -0.07 0.09 0.00 0.00 178.44 178.98 1xdi h LEU 106 N -0.14 1.06 0.00 1.67 4.07 -0.71 0.40 115.31 121.66 1xdi h LEU 106 Ca 0.06 -0.01 0.00 0.00 0.08 0.00 0.00 57.88 58.01 1xdi h LEU 106 Cb 0.22 -0.24 0.00 0.00 1.08 0.00 0.00 40.66 41.72 1xdi h LEU 106 CO -0.14 0.72 -0.32 -1.54 -1.08 0.00 0.00 178.44 176.08 1xdi n SER 107 N -4.44 0.64 -0.42 -0.43 3.41 -0.24 -2.48 113.62 109.66 1xdi n SER 107 Ca 0.13 0.29 0.13 0.00 -0.26 0.00 0.00 58.87 59.16 1xdi n SER 107 Cb 0.11 -0.24 0.54 0.00 -0.26 0.00 0.00 64.21 64.35 1xdi n SER 107 CO 0.00 0.00 0.00 0.80 -0.16 0.00 0.00 175.04 175.68 1xdi n MET 108 N -2.03 1.58 -0.74 4.33 0.00 -0.47 -4.90 117.12 114.89 1xdi n MET 108 Ca 0.05 -0.84 0.00 0.00 0.00 0.00 0.00 57.70 56.90 1xdi n MET 108 Cb 0.41 -1.45 0.00 0.00 0.00 0.00 0.00 33.22 32.18 1xdi n MET 108 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1xdi n GLY 109 N 1.13 0.55 3.74 -5.12 0.00 -0.98 -4.90 105.19 99.61 1xdi n GLY 109 Ca 0.19 -0.75 -0.40 0.00 0.00 0.00 0.00 46.02 45.06 1xdi n GLY 109 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xdi s VAL 110 N -2.00 4.70 -0.67 1.61 1.01 0.04 -4.76 120.40 120.34 1xdi s VAL 110 Ca 0.00 1.72 -0.24 0.00 0.00 0.00 0.00 61.98 63.46 1xdi s VAL 110 Cb 0.00 -4.16 0.06 0.00 0.00 0.00 0.00 36.38 32.28 1xdi s VAL 110 CO 0.00 0.35 1.04 -1.10 0.00 0.00 0.00 175.10 175.39 1xdi s GLN 111 N 0.01 3.15 -0.10 2.72 -1.52 -0.62 -4.25 119.66 119.06 1xdi s GLN 111 Ca 0.40 -0.62 -0.22 0.00 -1.95 0.00 0.00 55.36 52.97 1xdi s GLN 111 Cb -0.21 -4.20 -0.04 0.00 -0.22 0.00 0.00 33.01 28.35 1xdi s GLN 111 CO 0.24 -1.86 0.63 0.08 -0.25 0.00 0.00 175.29 174.13 1xdi s VAL 112 N 4.47 5.09 -0.27 1.09 1.01 -1.26 -1.35 120.40 129.17 1xdi s VAL 112 Ca 0.26 1.28 0.02 0.00 0.00 0.00 0.00 61.98 63.54 1xdi s VAL 112 Cb -0.14 -3.97 0.07 0.00 0.00 0.00 0.00 36.38 32.34 1xdi s VAL 112 CO 0.12 0.26 -0.03 -0.63 0.00 0.00 0.00 175.10 174.82 1xdi s ILE 113 N 0.87 1.80 -0.24 2.22 1.01 0.27 -4.95 121.20 122.18 1xdi s ILE 113 Ca 0.33 -1.59 -0.29 0.00 0.00 0.00 0.00 60.65 59.11 1xdi s ILE 113 Cb -0.17 -2.10 -0.03 0.00 0.01 0.00 0.00 42.46 40.17 1xdi s ILE 113 CO 0.15 -0.24 1.69 0.00 0.00 0.00 0.00 174.94 176.54 1xdi s ALA 114 N 1.23 3.16 0.00 9.38 0.00 -1.26 -2.48 121.76 131.80 1xdi s ALA 114 Ca -0.02 0.45 0.00 0.00 0.00 0.00 0.00 51.96 52.39 1xdi s ALA 114 Cb -0.19 -3.90 0.00 0.00 0.00 0.00 0.00 23.12 19.03 1xdi s ALA 114 CO -0.08 -2.14 0.00 0.41 0.00 0.00 0.00 175.76 173.96 1xdi n GLY 115 N 4.89 -1.93 3.49 0.00 0.00 0.09 -4.61 105.19 107.12 1xdi n GLY 115 Ca 0.20 -1.15 -0.34 0.00 0.00 0.00 0.00 46.02 44.73 1xdi n GLY 115 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1xdi s ARG 116 N -1.78 3.59 0.16 1.61 3.52 -0.04 -1.61 118.95 124.40 1xdi s ARG 116 Ca 0.00 -0.53 0.06 0.00 -0.13 0.00 0.00 55.73 55.12 1xdi s ARG 116 Cb 0.00 -2.87 -0.04 0.00 -1.56 0.00 0.00 34.95 30.48 1xdi s ARG 116 CO 0.00 0.27 0.08 0.20 -0.81 0.00 0.00 175.30 175.05 1xdi s GLY 117 N 0.27 1.73 0.01 8.12 0.00 -1.26 0.11 107.32 116.30 1xdi s GLY 117 Ca -0.04 -1.26 -0.18 0.00 0.00 0.00 0.00 44.72 43.24 1xdi s GLY 117 CO 0.03 -1.27 0.39 1.85 0.00 0.00 0.00 173.10 174.10 1xdi s GLU 118 N -3.01 0.81 0.03 2.90 2.12 0.58 -4.86 118.70 117.28 1xdi s GLU 118 Ca 0.30 -0.22 -0.30 0.00 0.36 0.00 0.00 54.97 55.10 1xdi s GLU 118 Cb -0.10 0.36 -0.04 0.00 0.26 0.00 0.00 34.13 34.61 1xdi s GLU 118 CO 0.22 -0.25 1.09 -0.51 -0.54 0.00 0.00 175.26 175.26 1xdi s LEU 119 N -1.60 4.37 -0.11 2.70 1.43 0.08 0.84 118.68 126.38 1xdi s LEU 119 Ca -0.10 1.83 0.14 0.00 -1.03 0.00 0.00 54.13 54.98 1xdi s LEU 119 Cb -0.03 -3.57 0.31 0.00 0.03 0.00 0.00 46.19 42.92 1xdi s LEU 119 CO 0.02 -0.36 1.15 2.30 0.23 0.00 0.00 176.35 179.69 1xdi n ILE 120 N 3.91 1.38 -1.52 -0.59 -5.35 0.40 -4.46 119.36 113.13 1xdi n ILE 120 Ca 0.07 -2.01 -0.53 0.00 -0.27 0.00 0.00 62.75 60.01 1xdi n ILE 120 Cb 0.49 0.08 -0.06 0.00 -1.74 0.00 0.00 39.64 38.41 1xdi n ILE 120 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 1xdi n ASP 121 N -0.79 0.51 0.06 7.28 9.92 -1.25 -4.92 116.55 127.36 1xdi n ASP 121 Ca 0.13 1.14 -0.13 0.00 -0.53 0.00 0.00 54.79 55.40 1xdi n ASP 121 Cb 0.75 -1.06 -0.08 0.00 -0.64 0.00 0.00 41.12 40.09 1xdi n ASP 121 CO 0.00 0.00 0.00 -1.28 0.13 0.00 0.00 177.20 176.05 1xdi h SER 122 N 3.12 -1.29 -4.92 -2.24 0.87 -1.95 -3.45 113.55 103.68 1xdi h SER 122 Ca -0.45 0.14 -0.45 0.00 -1.23 0.00 0.00 61.79 59.81 1xdi h SER 122 Cb 1.39 0.48 -0.06 0.00 -0.44 0.00 0.00 62.40 63.78 1xdi h SER 122 CO 0.68 -0.43 -0.26 0.35 -0.53 0.00 0.00 176.83 176.64 1xdi n THR 123 N -4.84 0.00 1.00 2.23 -2.24 -1.26 -5.08 114.28 104.09 1xdi n THR 123 Ca -0.06 -1.65 0.10 0.00 -2.27 0.00 0.00 64.05 60.17 1xdi n THR 123 Cb 0.32 0.04 -0.09 0.00 -2.10 0.00 0.00 70.33 68.51 1xdi n THR 123 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 1xdi n PRO 124 N -1.24 0.20 -2.16 -0.78 -0.02 -1.25 -4.69 135.00 125.07 1xdi n PRO 124 Ca -0.07 -0.17 -0.36 0.00 -2.02 0.00 0.00 63.50 60.89 1xdi n PRO 124 Cb 0.46 -1.50 0.02 0.00 -0.02 0.00 0.00 33.50 32.47 1xdi n PRO 124 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1xdi n GLY 125 N 1.49 5.71 3.79 -1.23 0.00 -1.26 -4.60 105.19 109.08 1xdi n GLY 125 Ca 0.05 -2.58 -0.25 0.00 0.00 0.00 0.00 46.02 43.24 1xdi n GLY 125 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xdi s LEU 126 N -3.91 3.74 -0.02 0.99 1.43 -1.26 -5.04 118.68 114.61 1xdi s LEU 126 Ca 0.50 -0.22 -0.06 0.00 -1.03 0.00 0.00 54.13 53.32 1xdi s LEU 126 Cb 0.41 -2.32 -0.03 0.00 0.03 0.00 0.00 46.19 44.27 1xdi s LEU 126 CO -0.33 0.03 0.44 0.00 0.23 0.00 0.00 176.35 176.72 1xdi h ALA 127 N 2.08 -0.41 -2.55 4.21 0.00 -1.95 -3.44 119.26 117.19 1xdi h ALA 127 Ca -0.48 -0.05 -0.52 0.00 0.00 0.00 0.00 54.91 53.86 1xdi h ALA 127 Cb 1.22 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.07 1xdi h ALA 127 CO 0.62 -0.39 0.37 0.50 0.00 0.00 0.00 179.25 180.34 1xdi s ARG 128 N -2.35 4.68 0.50 0.00 3.52 -1.26 -4.74 118.95 119.30 1xdi s ARG 128 Ca -0.03 1.46 0.08 0.00 -0.13 0.00 0.00 55.73 57.11 1xdi s ARG 128 Cb 0.00 -3.38 0.04 0.00 -1.56 0.00 0.00 34.95 30.05 1xdi s ARG 128 CO 0.10 0.18 0.61 -1.01 -0.81 0.00 0.00 175.30 174.37 1xdi s HIS 129 N 0.11 2.07 -0.04 5.12 3.76 0.12 -4.88 115.29 121.55 1xdi s HIS 129 Ca 0.48 -0.60 0.00 0.00 -0.15 0.00 0.00 55.06 54.78 1xdi s HIS 129 Cb -0.23 -2.22 0.03 0.00 1.11 0.00 0.00 32.58 31.27 1xdi s HIS 129 CO 0.30 -0.68 -0.00 0.50 -0.85 0.00 0.00 174.74 174.00 1xdi s ARG 130 N -4.44 0.45 0.10 1.40 3.52 -1.26 0.11 118.95 118.83 1xdi s ARG 130 Ca 0.54 0.07 0.10 0.00 -0.13 0.00 0.00 55.73 56.31 1xdi s ARG 130 Cb -0.06 -0.66 -0.04 0.00 -1.56 0.00 0.00 34.95 32.64 1xdi s ARG 130 CO 0.33 -0.17 -0.26 0.42 -0.81 0.00 0.00 175.30 174.81 1xdi s ILE 131 N 1.27 2.17 -0.09 4.11 1.01 0.90 -0.45 121.20 130.11 1xdi s ILE 131 Ca -0.06 -1.61 0.04 0.00 0.00 0.00 0.00 60.65 59.02 1xdi s ILE 131 Cb -0.13 -1.90 -0.01 0.00 0.01 0.00 0.00 42.46 40.43 1xdi s ILE 131 CO -0.02 0.17 -0.23 -0.75 0.00 0.00 0.00 174.94 174.11 1xdi s LYS 132 N -1.76 2.90 -0.16 2.79 2.20 0.25 0.81 119.74 126.77 1xdi s LYS 132 Ca 0.13 -0.86 -0.04 0.00 -0.36 0.00 0.00 55.97 54.83 1xdi s LYS 132 Cb -0.10 -2.29 -0.03 0.00 -1.51 0.00 0.00 37.83 33.90 1xdi s LYS 132 CO 0.05 0.26 -0.03 0.00 -0.36 0.00 0.00 175.35 175.27 1xdi s ALA 133 N 0.14 3.06 -0.18 3.13 0.00 -0.14 -0.30 121.76 127.46 1xdi s ALA 133 Ca -0.12 -0.81 -0.02 0.00 0.00 0.00 0.00 51.96 51.01 1xdi s ALA 133 Cb -0.16 -1.59 -0.01 0.00 0.00 0.00 0.00 23.12 21.36 1xdi s ALA 133 CO 0.07 0.22 -0.09 0.99 0.00 0.00 0.00 175.76 176.95 1xdi s THR 134 N 0.32 3.10 0.86 0.00 2.01 0.30 -2.36 115.64 119.86 1xdi s THR 134 Ca -0.03 -0.61 -0.12 0.00 0.31 0.00 0.00 61.69 61.24 1xdi s THR 134 Cb -0.14 -2.36 0.11 0.00 0.01 0.00 0.00 72.50 70.12 1xdi s THR 134 CO 0.03 0.48 1.16 0.00 -0.69 0.00 0.00 174.62 175.59 1xdi s ALA 135 N 1.02 2.21 -0.54 7.40 0.00 -0.74 -0.86 121.76 130.25 1xdi s ALA 135 Ca -0.01 -0.58 0.26 0.00 0.00 0.00 0.00 51.96 51.63 1xdi s ALA 135 Cb -0.15 -3.00 0.87 0.00 0.00 0.00 0.00 23.12 20.85 1xdi s ALA 135 CO -0.01 -1.98 1.76 0.00 0.00 0.00 0.00 175.76 175.52 1xdi h ALA 136 N -1.28 1.00 0.00 0.00 0.00 -1.90 -2.45 119.26 114.63 1xdi h ALA 136 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1xdi h ALA 136 Cb 1.33 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.12 1xdi h ALA 136 CO 0.64 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 179.64 1xdi n ASP 137 N -2.41 0.00 0.00 0.00 8.00 -1.26 -4.86 116.55 116.01 1xdi n ASP 137 Ca 0.04 -0.70 0.00 0.00 0.71 0.00 0.00 54.79 54.84 1xdi n ASP 137 Cb 0.36 -0.08 0.00 0.00 -0.02 0.00 0.00 41.12 41.38 1xdi n ASP 137 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1xdi n GLY 138 N 0.91 3.05 3.36 0.44 0.00 -0.92 -5.01 105.19 107.01 1xdi n GLY 138 Ca 0.20 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 1xdi n GLY 138 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1xdi n SER 139 N 0.16 -2.12 -3.70 1.61 3.41 -1.26 -4.63 113.62 107.09 1xdi n SER 139 Ca 0.00 0.08 -0.13 0.00 -0.26 0.00 0.00 58.87 58.56 1xdi n SER 139 Cb 0.00 -1.10 -0.09 0.00 -0.26 0.00 0.00 64.21 62.76 1xdi n SER 139 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1xdi s THR 140 N -2.33 -0.00 0.15 6.66 -4.23 -1.26 -1.79 115.64 112.84 1xdi s THR 140 Ca 0.58 0.01 0.09 0.00 -1.18 0.00 0.00 61.69 61.19 1xdi s THR 140 Cb -0.17 -0.70 -0.04 0.00 1.34 0.00 0.00 72.50 72.93 1xdi s THR 140 CO 0.66 0.00 -0.21 -0.94 -0.54 0.00 0.00 174.62 173.60 1xdi s SER 141 N 0.46 2.84 0.07 3.99 1.04 -1.00 -4.98 113.70 116.12 1xdi s SER 141 Ca -0.02 -0.80 0.06 0.00 0.48 0.00 0.00 55.95 55.68 1xdi s SER 141 Cb -0.04 -0.18 -0.04 0.00 0.10 0.00 0.00 66.02 65.87 1xdi s SER 141 CO -0.02 0.04 -0.12 -1.61 0.98 0.00 0.00 173.24 172.51 1xdi s GLU 142 N -2.42 2.17 -0.01 4.02 2.02 -1.26 -0.97 118.70 122.24 1xdi s GLU 142 Ca 0.14 -0.96 0.00 0.00 0.02 0.00 0.00 54.97 54.17 1xdi s GLU 142 Cb -0.08 -2.30 0.02 0.00 0.10 0.00 0.00 34.13 31.87 1xdi s GLU 142 CO 0.06 0.53 0.01 -1.01 0.02 0.00 0.00 175.26 174.88 1xdi s HIS 143 N -1.08 0.12 0.31 1.61 3.76 0.24 -4.98 115.29 115.27 1xdi s HIS 143 Ca 0.18 0.04 -0.23 0.00 -0.15 0.00 0.00 55.06 54.91 1xdi s HIS 143 Cb -0.11 -0.20 -0.09 0.00 1.11 0.00 0.00 32.58 33.29 1xdi s HIS 143 CO 0.10 -0.06 0.86 -1.21 -0.85 0.00 0.00 174.74 173.58 1xdi s GLU 144 N 0.60 4.39 -0.13 1.40 0.41 -1.26 -0.07 118.70 124.04 1xdi s GLU 144 Ca -0.05 1.11 -0.04 0.00 -0.41 0.00 0.00 54.97 55.58 1xdi s GLU 144 Cb -0.08 -2.72 0.06 0.00 -1.78 0.00 0.00 34.13 29.61 1xdi s GLU 144 CO -0.01 0.27 0.13 0.00 -0.49 0.00 0.00 175.26 175.16 1xdi s ALA 145 N -1.69 0.06 0.03 5.21 0.00 0.12 -4.83 121.76 120.66 1xdi s ALA 145 Ca 0.50 0.17 -0.20 0.00 0.00 0.00 0.00 51.96 52.43 1xdi s ALA 145 Cb -0.16 -0.96 -0.17 0.00 0.00 0.00 0.00 23.12 21.83 1xdi s ALA 145 CO 0.21 -0.88 1.26 -0.44 0.00 0.00 0.00 175.76 175.91 1xdi h ASP 146 N 8.38 0.46 -3.87 0.00 3.32 -1.36 0.34 116.42 123.69 1xdi h ASP 146 Ca -0.14 -0.58 -0.69 0.00 0.02 0.00 0.00 57.03 55.64 1xdi h ASP 146 Cb 1.14 -0.13 -0.31 0.00 0.22 0.00 0.00 39.33 40.25 1xdi h ASP 146 CO 0.22 0.96 -0.87 -0.69 -1.72 0.00 0.00 179.24 177.14 1xdi s VAL 147 N -3.91 2.21 -0.04 -1.35 1.01 -0.99 -4.69 120.40 112.64 1xdi s VAL 147 Ca -0.14 -1.00 0.05 0.00 0.00 0.00 0.00 61.98 60.89 1xdi s VAL 147 Cb 0.05 -1.82 -0.01 0.00 0.00 0.00 0.00 36.38 34.60 1xdi s VAL 147 CO 0.78 0.57 -0.20 -0.69 0.00 0.00 0.00 175.10 175.56 1xdi s VAL 148 N -0.10 1.66 -0.30 2.92 1.01 0.36 -2.22 120.40 123.72 1xdi s VAL 148 Ca -0.05 -0.85 0.03 0.00 0.00 0.00 0.00 61.98 61.10 1xdi s VAL 148 Cb -0.14 -1.41 0.08 0.00 0.00 0.00 0.00 36.38 34.92 1xdi s VAL 148 CO 0.04 0.47 0.00 -0.22 0.00 0.00 0.00 175.10 175.39 1xdi s LEU 149 N -0.12 3.85 -0.50 3.92 2.96 -0.60 0.03 118.68 128.23 1xdi s LEU 149 Ca -0.02 -1.78 -0.29 0.00 -0.22 0.00 0.00 54.13 51.83 1xdi s LEU 149 Cb -0.12 -1.46 0.03 0.00 0.50 0.00 0.00 46.19 45.14 1xdi s LEU 149 CO 0.02 -0.32 1.20 -0.69 -1.32 0.00 0.00 176.35 175.24 1xdi s VAL 150 N 1.10 4.10 -0.45 1.68 1.01 0.49 -1.70 120.40 126.62 1xdi s VAL 150 Ca 0.04 1.08 0.09 0.00 0.00 0.00 0.00 61.98 63.19 1xdi s VAL 150 Cb -0.19 -4.58 0.34 0.00 0.00 0.00 0.00 36.38 31.95 1xdi s VAL 150 CO -0.09 -1.07 0.79 0.00 0.00 0.00 0.00 175.10 174.73 1xdi n ALA 151 N 8.22 2.99 1.41 5.51 0.00 0.12 -2.24 120.51 136.53 1xdi n ALA 151 Ca 0.12 -3.88 0.14 0.00 0.00 0.00 0.00 53.44 49.81 1xdi n ALA 151 Cb 0.49 -0.86 0.47 0.00 0.00 0.00 0.00 19.45 19.55 1xdi n ALA 151 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1xdi n THR 152 N 0.20 0.00 -4.92 0.00 -2.24 -1.24 -4.08 114.28 101.99 1xdi n THR 152 Ca 0.27 -0.23 0.00 0.00 -2.27 0.00 0.00 64.05 61.82 1xdi n THR 152 Cb 0.55 0.51 0.00 0.00 -2.10 0.00 0.00 70.33 69.29 1xdi n THR 152 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xdi n GLY 153 N 1.23 0.24 3.57 3.38 0.00 -1.26 -4.54 105.19 107.81 1xdi n GLY 153 Ca 0.17 -0.89 -0.26 0.00 0.00 0.00 0.00 46.02 45.05 1xdi n GLY 153 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xdi s ALA 154 N -1.98 2.95 0.05 4.61 0.00 -1.26 0.15 121.76 126.27 1xdi s ALA 154 Ca 0.00 -1.94 0.03 0.00 0.00 0.00 0.00 51.96 50.05 1xdi s ALA 154 Cb 0.00 0.38 -0.02 0.00 0.00 0.00 0.00 23.12 23.47 1xdi s ALA 154 CO 0.00 -0.19 -0.09 -1.12 0.00 0.00 0.00 175.76 174.36 1xdi s SER 155 N -3.64 0.97 0.18 0.00 0.01 0.10 -4.85 113.70 106.47 1xdi s SER 155 Ca 0.32 -0.55 -0.32 0.00 1.31 0.00 0.00 55.95 56.70 1xdi s SER 155 Cb 0.08 0.02 -0.16 0.00 0.21 0.00 0.00 66.02 66.18 1xdi s SER 155 CO 0.15 -0.18 1.13 -2.65 0.41 0.00 0.00 173.24 172.10 1xdi n PRO 156 N 1.47 1.11 -2.54 12.44 -0.02 -1.26 0.11 135.00 146.31 1xdi n PRO 156 Ca -0.22 0.39 -0.37 0.00 -2.02 0.00 0.00 63.50 61.28 1xdi n PRO 156 Cb 0.55 -1.87 -0.04 0.00 -0.02 0.00 0.00 33.50 32.12 1xdi n PRO 156 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1xdi s ARG 157 N -0.47 4.31 -0.08 -0.52 3.52 0.30 -4.60 118.95 121.40 1xdi s ARG 157 Ca 0.72 1.57 0.02 0.00 -0.13 0.00 0.00 55.73 57.92 1xdi s ARG 157 Cb -0.85 -2.72 0.01 0.00 -1.56 0.00 0.00 34.95 29.83 1xdi s ARG 157 CO 0.53 -0.02 -0.16 0.42 -0.81 0.00 0.00 175.30 175.26 1xdi s ILE 158 N -1.53 1.44 -0.24 4.11 1.01 -1.26 -4.84 121.20 119.89 1xdi s ILE 158 Ca 0.54 -0.64 -0.23 0.00 0.00 0.00 0.00 60.65 60.32 1xdi s ILE 158 Cb -0.24 -1.30 -0.01 0.00 0.01 0.00 0.00 42.46 40.92 1xdi s ILE 158 CO 0.31 0.42 0.75 -0.22 0.00 0.00 0.00 174.94 176.20 1xdi s LEU 159 N 0.68 4.08 0.45 2.97 2.96 -1.26 -4.93 118.68 123.62 1xdi s LEU 159 Ca -0.13 0.91 0.31 0.00 -0.22 0.00 0.00 54.13 55.00 1xdi s LEU 159 Cb -0.16 -3.06 1.59 0.00 0.50 0.00 0.00 46.19 45.06 1xdi s LEU 159 CO 0.04 -0.45 1.93 1.55 -1.32 0.00 0.00 176.35 178.10 1xdi h PRO 160 N 7.74 0.00 -0.63 0.98 0.13 -1.99 -1.06 132.00 137.17 1xdi h PRO 160 Ca -0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 1xdi h PRO 160 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 1xdi h PRO 160 CO 0.83 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.47 1xdi n SER 161 N -2.60 2.81 -2.72 1.44 3.41 -1.26 -4.06 113.62 110.64 1xdi n SER 161 Ca -0.01 -2.28 -0.07 0.00 -0.26 0.00 0.00 58.87 56.24 1xdi n SER 161 Cb 0.09 -0.46 0.09 0.00 -0.26 0.00 0.00 64.21 63.67 1xdi n SER 161 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xdi n ALA 162 N 0.41 -1.51 -2.31 7.33 0.00 -0.41 -0.64 120.51 123.38 1xdi n ALA 162 Ca 0.13 -1.19 -0.42 0.00 0.00 0.00 0.00 53.44 51.96 1xdi n ALA 162 Cb 0.56 -1.68 -0.03 0.00 0.00 0.00 0.00 19.45 18.31 1xdi n ALA 162 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1xdi s GLN 163 N 0.31 4.34 0.61 0.00 -1.52 -1.18 -4.43 119.66 117.79 1xdi s GLN 163 Ca 0.24 1.88 -0.18 0.00 -1.95 0.00 0.00 55.36 55.35 1xdi s GLN 163 Cb 0.27 -3.45 -0.05 0.00 -0.22 0.00 0.00 33.01 29.57 1xdi s GLN 163 CO -0.12 -0.44 0.93 -2.30 -0.25 0.00 0.00 175.29 173.12 1xdi n PRO 164 N 4.68 0.84 0.00 2.91 -0.02 -1.26 -4.84 135.00 137.30 1xdi n PRO 164 Ca 0.11 0.33 0.00 0.00 -2.02 0.00 0.00 63.50 61.92 1xdi n PRO 164 Cb 0.45 -2.14 0.00 0.00 -0.02 0.00 0.00 33.50 31.78 1xdi n PRO 164 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1xdi n ASP 165 N -0.78 0.34 0.00 2.55 5.75 0.18 -4.96 116.55 119.63 1xdi n ASP 165 Ca 0.14 -1.11 0.00 0.00 -0.01 0.00 0.00 54.79 53.81 1xdi n ASP 165 Cb 0.48 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.57 1xdi n ASP 165 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1xdi n GLY 166 N -0.06 2.47 0.14 6.12 0.00 -1.08 -4.74 105.19 108.04 1xdi n GLY 166 Ca 0.00 -0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 1xdi n GLY 166 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1xdi n GLU 167 N 0.00 0.56 -0.01 1.61 1.02 -1.26 -4.89 120.64 117.68 1xdi n GLU 167 Ca 0.00 0.24 -0.01 0.00 -0.02 0.00 0.00 57.16 57.37 1xdi n GLU 167 Cb 0.00 -1.46 -0.01 0.00 -0.02 0.00 0.00 31.44 29.95 1xdi n GLU 167 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1xdi n ARG 168 N -4.30 2.09 -3.40 3.49 1.74 -1.26 -4.91 116.66 110.11 1xdi n ARG 168 Ca -0.42 0.01 -0.43 0.00 -0.77 0.00 0.00 57.85 56.24 1xdi n ARG 168 Cb 0.77 -1.05 -0.09 0.00 -1.02 0.00 0.00 32.46 31.07 1xdi n ARG 168 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1xdi s ILE 169 N -2.05 5.19 0.04 0.55 -1.09 -1.26 0.28 121.20 122.86 1xdi s ILE 169 Ca -0.02 -0.46 0.09 0.00 -2.23 0.00 0.00 60.65 58.03 1xdi s ILE 169 Cb 0.01 -3.95 -0.03 0.00 -1.58 0.00 0.00 42.46 36.91 1xdi s ILE 169 CO 0.07 -0.32 -0.25 -0.76 -1.23 0.00 0.00 174.94 172.44 1xdi s LEU 170 N 1.89 2.15 0.43 2.97 1.43 0.32 0.51 118.68 128.37 1xdi s LEU 170 Ca 0.08 -0.56 0.03 0.00 -1.03 0.00 0.00 54.13 52.65 1xdi s LEU 170 Cb -0.18 -1.24 0.00 0.00 0.03 0.00 0.00 46.19 44.81 1xdi s LEU 170 CO 0.12 0.25 0.61 0.42 0.23 0.00 0.00 176.35 177.98 1xdi s THR 171 N -0.78 3.68 0.50 5.49 -4.23 -1.26 0.77 115.64 119.82 1xdi s THR 171 Ca 0.11 -0.75 0.21 0.00 -1.18 0.00 0.00 61.69 60.09 1xdi s THR 171 Cb -0.10 -3.32 0.27 0.00 1.34 0.00 0.00 72.50 70.70 1xdi s THR 171 CO 0.02 -0.18 2.12 4.11 -0.54 0.00 0.00 174.62 180.15 1xdi h TRP 172 N 0.53 0.00 -0.22 3.99 0.09 -1.96 -2.22 115.95 116.16 1xdi h TRP 172 Ca -0.45 0.00 -0.03 0.00 0.09 0.00 0.00 58.89 58.50 1xdi h TRP 172 Cb 1.26 0.00 -0.01 0.00 0.08 0.00 0.00 29.16 30.49 1xdi h TRP 172 CO 0.42 0.07 0.01 0.00 0.09 0.00 0.00 178.44 179.03 1xdi h ARG 173 N 0.00 0.32 0.00 0.12 3.08 -1.94 -3.07 114.38 112.90 1xdi h ARG 173 Ca -0.00 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.00 1xdi h ARG 173 Cb 0.14 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.14 1xdi h ARG 173 CO 0.01 0.35 -0.12 1.96 -1.07 0.00 0.00 179.97 181.10 1xdi h GLN 174 N 0.32 0.00 -1.20 0.04 4.20 -1.78 -3.39 115.11 113.30 1xdi h GLN 174 Ca 0.07 0.00 0.34 0.00 0.06 0.00 0.00 58.65 59.13 1xdi h GLN 174 Cb 0.21 0.00 -0.09 0.00 0.30 0.00 0.00 27.48 27.90 1xdi h GLN 174 CO 0.00 0.00 0.81 -0.07 -0.67 0.00 0.00 178.83 178.90 1xdi h LEU 175 N 0.00 0.24 -0.63 1.46 3.38 -1.55 -1.93 115.31 116.29 1xdi h LEU 175 Ca 0.00 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1xdi h LEU 175 Cb 0.82 0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.60 1xdi h LEU 175 CO 0.00 -0.00 0.00 -1.22 0.09 0.00 0.00 178.44 177.31 1xdi n TYR 176 N -4.47 0.22 1.02 1.13 4.01 -1.26 -3.01 117.16 114.80 1xdi n TYR 176 Ca 0.29 -0.11 0.11 0.00 -0.16 0.00 0.00 57.90 58.03 1xdi n TYR 176 Cb 1.17 -0.01 0.07 0.00 -0.31 0.00 0.00 39.34 40.27 1xdi n TYR 176 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 1xdi n ASP 177 N -0.03 0.91 -4.79 7.72 8.00 -0.73 -4.87 116.55 122.76 1xdi n ASP 177 Ca 0.05 -0.76 -0.35 0.00 0.71 0.00 0.00 54.79 54.44 1xdi n ASP 177 Cb 0.15 0.60 -0.06 0.00 -0.02 0.00 0.00 41.12 41.79 1xdi n ASP 177 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1xdi s LEU 178 N -2.91 4.13 -0.01 0.64 1.43 -1.16 -4.98 118.68 115.83 1xdi s LEU 178 Ca 0.11 1.85 0.16 0.00 -1.03 0.00 0.00 54.13 55.22 1xdi s LEU 178 Cb 0.17 -4.26 0.46 0.00 0.03 0.00 0.00 46.19 42.59 1xdi s LEU 178 CO 0.75 -0.32 1.38 0.47 0.23 0.00 0.00 176.35 178.86 1xdi n ASP 179 N -0.08 3.40 -3.58 2.29 8.00 -1.26 -4.72 116.55 120.60 1xdi n ASP 179 Ca 0.05 -2.03 -0.16 0.00 0.71 0.00 0.00 54.79 53.36 1xdi n ASP 179 Cb 0.51 -0.35 -0.07 0.00 -0.02 0.00 0.00 41.12 41.20 1xdi n ASP 179 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1xdi s ALA 180 N -1.05 -1.64 0.32 2.24 0.00 -1.26 -4.58 121.76 115.80 1xdi s ALA 180 Ca 0.35 1.41 -0.29 0.00 0.00 0.00 0.00 51.96 53.42 1xdi s ALA 180 Cb 0.18 -0.35 -0.11 0.00 0.00 0.00 0.00 23.12 22.85 1xdi s ALA 180 CO 0.23 -0.34 1.49 -0.51 0.00 0.00 0.00 175.76 176.63 1xdi s LEU 181 N -0.71 4.35 0.68 0.00 1.43 -1.26 -4.95 118.68 118.23 1xdi s LEU 181 Ca -0.08 2.90 -0.17 0.00 -1.03 0.00 0.00 54.13 55.76 1xdi s LEU 181 Cb -0.02 -3.65 0.01 0.00 0.03 0.00 0.00 46.19 42.56 1xdi s LEU 181 CO 0.07 -0.81 1.24 -2.84 0.23 0.00 0.00 176.35 174.24 1xdi s PRO 182 N -1.24 2.40 0.02 1.29 0.02 -1.26 -4.93 135.00 131.30 1xdi s PRO 182 Ca 0.57 1.89 -0.18 0.00 0.02 0.00 0.00 61.00 63.29 1xdi s PRO 182 Cb -0.45 -1.85 -0.24 0.00 0.02 0.00 0.00 34.50 31.98 1xdi s PRO 182 CO 0.53 -1.67 1.11 -0.44 -0.33 0.00 0.00 177.00 176.21 1xdi h ASP 183 N 0.19 0.62 -2.46 2.53 5.19 -1.94 -3.44 116.42 117.12 1xdi h ASP 183 Ca -0.49 -0.77 -0.39 0.00 -0.62 0.00 0.00 57.03 54.76 1xdi h ASP 183 Cb 1.31 -0.19 -0.36 0.00 0.18 0.00 0.00 39.33 40.27 1xdi h ASP 183 CO 0.52 1.31 -0.68 -2.28 -3.12 0.00 0.00 179.24 174.99 1xdi s HIS 184 N -3.19 -0.17 -0.19 4.55 2.46 -1.26 -4.30 115.29 113.19 1xdi s HIS 184 Ca -0.12 -0.27 -0.23 0.00 0.47 0.00 0.00 55.06 54.90 1xdi s HIS 184 Cb 0.04 -0.57 -0.02 0.00 -0.13 0.00 0.00 32.58 31.91 1xdi s HIS 184 CO 0.85 -0.80 0.75 -1.17 -2.47 0.00 0.00 174.74 171.90 1xdi s LEU 185 N 2.27 4.14 -0.21 8.88 2.96 -0.30 -0.28 118.68 136.15 1xdi s LEU 185 Ca 0.08 1.01 -0.06 0.00 -0.22 0.00 0.00 54.13 54.94 1xdi s LEU 185 Cb -0.15 -3.08 -0.03 0.00 0.50 0.00 0.00 46.19 43.43 1xdi s LEU 185 CO -0.28 -0.37 0.02 -0.63 -1.32 0.00 0.00 176.35 173.78 1xdi s ILE 186 N 2.18 4.12 -0.26 6.68 1.01 -0.50 -0.89 121.20 133.53 1xdi s ILE 186 Ca 0.34 -0.25 -0.05 0.00 0.00 0.00 0.00 60.65 60.68 1xdi s ILE 186 Cb -0.16 -2.88 0.00 0.00 0.01 0.00 0.00 42.46 39.44 1xdi s ILE 186 CO 0.11 0.41 0.02 -0.69 0.00 0.00 0.00 174.94 174.78 1xdi s VAL 187 N 1.11 3.64 -0.30 2.92 1.01 -0.76 -0.79 120.40 127.24 1xdi s VAL 187 Ca 0.03 -0.65 -0.14 0.00 0.00 0.00 0.00 61.98 61.22 1xdi s VAL 187 Cb -0.14 -2.80 -0.03 0.00 0.00 0.00 0.00 36.38 33.40 1xdi s VAL 187 CO 0.02 0.22 0.33 -0.69 0.00 0.00 0.00 175.10 174.98 1xdi s VAL 188 N 1.47 5.20 0.00 2.92 1.01 -0.52 -1.72 120.40 128.76 1xdi s VAL 188 Ca 0.03 0.31 0.00 0.00 0.00 0.00 0.00 61.98 62.32 1xdi s VAL 188 Cb -0.16 -3.71 0.00 0.00 0.00 0.00 0.00 36.38 32.51 1xdi s VAL 188 CO -0.00 0.09 0.00 0.61 0.00 0.00 0.00 175.10 175.80 1xdi n GLY 189 N 4.85 1.97 3.73 4.51 0.00 -0.45 -0.73 105.19 119.08 1xdi n GLY 189 Ca -0.10 -0.96 -0.40 0.00 0.00 0.00 0.00 46.02 44.57 1xdi n GLY 189 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xdi s SER 190 N 0.00 7.18 -0.09 1.61 1.04 -1.26 -4.57 113.70 117.60 1xdi s SER 190 Ca 0.00 1.41 -0.31 0.00 0.48 0.00 0.00 55.95 57.53 1xdi s SER 190 Cb 0.00 -2.47 0.11 0.00 0.10 0.00 0.00 66.02 63.76 1xdi s SER 190 CO 0.00 -0.07 1.38 -0.83 0.98 0.00 0.00 173.24 174.71 1xdi s GLY 191 N 0.37 -0.26 0.20 7.32 0.00 -1.17 -4.80 107.32 108.99 1xdi s GLY 191 Ca 0.41 0.28 -0.09 0.00 0.00 0.00 0.00 44.72 45.32 1xdi s GLY 191 CO 0.22 5.97 1.75 -2.08 0.00 0.00 0.00 173.10 178.97 1xdi h VAL 192 N 2.00 1.25 0.00 1.40 2.07 -1.89 0.53 116.25 121.62 1xdi h VAL 192 Ca -0.22 -0.83 0.00 0.00 0.82 0.00 0.00 66.70 66.48 1xdi h VAL 192 Cb 1.17 0.42 0.00 0.00 -1.52 0.00 0.00 31.29 31.37 1xdi h VAL 192 CO 0.29 0.33 -0.12 0.00 0.02 0.00 0.00 177.57 178.09 1xdi h THR 193 N 1.06 0.00 0.17 2.57 1.03 -1.95 -1.23 112.91 114.56 1xdi h THR 193 Ca 0.24 -0.68 -0.33 0.00 -0.01 0.00 0.00 66.41 65.63 1xdi h THR 193 Cb 0.24 1.61 0.01 0.00 -1.07 0.00 0.00 68.15 68.94 1xdi h THR 193 CO -0.02 0.00 -1.62 1.23 -0.01 0.00 0.00 175.52 175.11 1xdi h GLY 194 N 4.32 0.42 0.77 2.99 0.00 -1.72 -3.27 103.07 106.59 1xdi h GLY 194 Ca 0.00 -1.08 0.05 0.00 0.00 0.00 0.00 47.33 46.30 1xdi h GLY 194 CO 0.00 0.95 0.41 0.00 0.00 0.00 0.00 176.54 177.89 1xdi h ALA 195 N 0.27 0.91 -0.55 3.60 0.00 0.23 -0.74 119.26 122.98 1xdi h ALA 195 Ca -0.29 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.60 1xdi h ALA 195 Cb 2.08 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 19.67 1xdi h ALA 195 CO 0.19 0.13 0.25 0.93 0.00 0.00 0.00 179.25 180.75 1xdi h GLU 196 N 0.77 0.80 -0.16 0.00 5.08 -1.34 -2.25 114.58 117.49 1xdi h GLU 196 Ca 0.29 -0.13 -0.20 0.00 -1.00 0.00 0.00 59.36 58.33 1xdi h GLU 196 Cb 0.11 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.22 1xdi h GLU 196 CO -0.15 0.67 -0.69 0.74 -1.00 0.00 0.00 179.01 178.58 1xdi h PHE 197 N 0.75 0.86 -0.35 4.33 0.04 -1.51 0.45 116.94 121.51 1xdi h PHE 197 Ca 0.19 -0.36 0.03 0.00 2.80 0.00 0.00 57.97 60.64 1xdi h PHE 197 Cb 0.14 -0.14 -0.03 0.00 2.20 0.00 0.00 35.95 38.12 1xdi h PHE 197 CO 0.00 1.15 0.14 0.28 -0.60 0.00 0.00 178.31 179.28 1xdi h VAL 198 N 0.47 0.94 0.08 -0.55 2.07 -1.09 0.20 116.25 118.37 1xdi h VAL 198 Ca -0.03 -0.10 -0.00 0.00 0.82 0.00 0.00 66.70 67.39 1xdi h VAL 198 Cb 1.29 0.60 0.00 0.00 -1.52 0.00 0.00 31.29 31.66 1xdi h VAL 198 CO 0.13 0.06 -0.04 -0.78 0.02 0.00 0.00 177.57 176.96 1xdi h ASP 199 N 0.31 -0.10 -0.03 0.57 1.82 -1.17 -0.79 116.42 117.03 1xdi h ASP 199 Ca 0.15 -0.03 0.03 0.00 -0.39 0.00 0.00 57.03 56.79 1xdi h ASP 199 Cb 0.10 0.02 -0.03 0.00 0.68 0.00 0.00 39.33 40.10 1xdi h ASP 199 CO -0.14 -0.03 -0.15 0.00 -1.61 0.00 0.00 179.24 177.31 1xdi h ALA 200 N 0.76 -0.15 -0.41 -0.78 0.00 -0.34 -2.39 119.26 115.95 1xdi h ALA 200 Ca -0.01 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 1xdi h ALA 200 Cb 0.12 0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1xdi h ALA 200 CO 0.02 -0.63 0.06 1.88 0.00 0.00 0.00 179.25 180.58 1xdi h TYR 201 N -0.23 0.63 -0.03 0.00 0.05 -0.54 -2.05 116.97 114.79 1xdi h TYR 201 Ca 0.06 -0.05 -0.03 0.00 0.05 0.00 0.00 58.73 58.76 1xdi h TYR 201 Cb 0.32 -0.19 -0.01 0.00 1.01 0.00 0.00 36.73 37.86 1xdi h TYR 201 CO -0.22 0.57 -0.13 1.15 -1.05 0.00 0.00 178.16 178.47 1xdi h THR 202 N 0.60 1.11 0.00 -2.88 2.02 -0.92 0.09 112.91 112.93 1xdi h THR 202 Ca 0.13 -0.53 -0.17 0.00 0.77 0.00 0.00 66.41 66.61 1xdi h THR 202 Cb 0.28 1.25 -0.02 0.00 -1.74 0.00 0.00 68.15 67.91 1xdi h THR 202 CO 0.00 0.16 -0.83 -0.33 0.37 0.00 0.00 175.52 174.88 1xdi h GLU 203 N 0.04 0.00 0.00 6.66 4.39 -0.87 -2.46 114.58 122.34 1xdi h GLU 203 Ca 0.01 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.71 1xdi h GLU 203 Cb 0.27 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.92 1xdi h GLU 203 CO 0.02 0.83 0.00 1.28 -1.16 0.00 0.00 179.01 179.98 1xdi n LEU 204 N -3.41 0.00 0.00 1.33 4.77 -0.72 -4.72 117.00 114.25 1xdi n LEU 204 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1xdi n LEU 204 Cb 0.84 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.93 1xdi n LEU 204 CO 0.45 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.12 1xdi n GLY 205 N 0.55 0.70 3.77 -0.72 0.00 -0.92 -5.06 105.19 103.51 1xdi n GLY 205 Ca 0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 1xdi n GLY 205 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xdi s VAL 206 N -2.36 4.44 0.25 1.61 1.01 -0.06 -4.98 120.40 120.31 1xdi s VAL 206 Ca 0.00 1.69 -0.30 0.00 0.00 0.00 0.00 61.98 63.37 1xdi s VAL 206 Cb 0.00 -4.13 -0.09 0.00 0.00 0.00 0.00 36.38 32.16 1xdi s VAL 206 CO 0.00 0.49 1.08 -2.84 0.00 0.00 0.00 175.10 173.84 1xdi s PRO 207 N -0.93 4.65 -0.01 2.72 0.02 -1.26 -3.99 135.00 136.20 1xdi s PRO 207 Ca 0.36 1.75 0.02 0.00 0.02 0.00 0.00 61.00 63.16 1xdi s PRO 207 Cb -0.23 -3.22 -0.00 0.00 0.02 0.00 0.00 34.50 31.07 1xdi s PRO 207 CO 0.26 0.20 -0.08 0.08 -0.33 0.00 0.00 177.00 177.13 1xdi s VAL 208 N -0.90 0.64 -0.16 3.83 1.01 -1.26 -1.15 120.40 122.41 1xdi s VAL 208 Ca 0.45 -0.32 0.00 0.00 0.00 0.00 0.00 61.98 62.12 1xdi s VAL 208 Cb -0.31 -0.56 0.03 0.00 0.00 0.00 0.00 36.38 35.55 1xdi s VAL 208 CO 0.38 0.19 -0.09 -0.89 0.00 0.00 0.00 175.10 174.70 1xdi s THR 209 N -0.01 1.32 -0.10 3.92 2.01 -0.06 -1.53 115.64 121.18 1xdi s THR 209 Ca 0.00 -0.63 -0.09 0.00 0.31 0.00 0.00 61.69 61.28 1xdi s THR 209 Cb -0.05 -1.37 -0.04 0.00 0.01 0.00 0.00 72.50 71.04 1xdi s THR 209 CO -0.00 0.27 0.19 -0.69 -0.69 0.00 0.00 174.62 173.70 1xdi s VAL 210 N 1.56 5.41 -0.64 3.82 1.01 0.17 -1.83 120.40 129.90 1xdi s VAL 210 Ca 0.02 0.34 -0.02 0.00 0.00 0.00 0.00 61.98 62.32 1xdi s VAL 210 Cb -0.14 -3.47 0.16 0.00 0.00 0.00 0.00 36.38 32.93 1xdi s VAL 210 CO -0.09 0.60 0.46 -0.69 0.00 0.00 0.00 175.10 175.38 1xdi s VAL 211 N -0.96 3.65 0.08 2.92 1.01 -0.70 -0.27 120.40 126.12 1xdi s VAL 211 Ca 0.16 -3.13 -0.20 0.00 0.00 0.00 0.00 61.98 58.81 1xdi s VAL 211 Cb -0.13 -3.38 -0.07 0.00 0.00 0.00 0.00 36.38 32.81 1xdi s VAL 211 CO 0.06 -0.89 0.60 0.00 0.00 0.00 0.00 175.10 174.87 1xdi s ALA 212 N -0.26 3.55 0.04 5.51 0.00 -0.91 -1.34 121.76 128.36 1xdi s ALA 212 Ca 0.18 0.08 0.10 0.00 0.00 0.00 0.00 51.96 52.33 1xdi s ALA 212 Cb -0.19 -2.70 -0.08 0.00 0.00 0.00 0.00 23.12 20.15 1xdi s ALA 212 CO -0.04 0.35 1.36 0.77 0.00 0.00 0.00 175.76 178.20 1xdi h SER 213 N 4.67 0.00 -3.67 0.00 0.02 -1.86 0.13 113.55 112.84 1xdi h SER 213 Ca -0.49 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.46 1xdi h SER 213 Cb 1.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.75 1xdi h SER 213 CO 0.65 0.81 0.00 0.00 -1.14 0.00 0.00 176.83 177.15 1xdi n GLN 214 N -3.33 1.33 0.15 3.45 3.00 -1.26 -3.87 117.38 116.84 1xdi n GLN 214 Ca 0.01 0.00 0.02 0.00 -0.01 0.00 0.00 57.00 57.02 1xdi n GLN 214 Cb 0.85 0.00 0.38 0.00 0.00 0.00 0.00 30.24 31.47 1xdi n GLN 214 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.06 176.62 1xdi h ASP 215 N 0.00 0.14 -3.21 1.08 5.19 -1.96 -2.69 116.42 114.96 1xdi h ASP 215 Ca 0.00 -0.04 -0.45 0.00 -0.62 0.00 0.00 57.03 55.92 1xdi h ASP 215 Cb 0.00 -0.04 -0.14 0.00 0.18 0.00 0.00 39.33 39.33 1xdi h ASP 215 CO 0.00 0.38 -0.72 -1.00 -3.12 0.00 0.00 179.24 174.78 1xdi s HIS 216 N -4.51 1.73 0.12 4.55 3.76 -1.26 -4.91 115.29 114.76 1xdi s HIS 216 Ca -0.04 -0.62 -0.18 0.00 -0.15 0.00 0.00 55.06 54.06 1xdi s HIS 216 Cb 0.15 -0.85 -0.05 0.00 1.11 0.00 0.00 32.58 32.94 1xdi s HIS 216 CO 0.73 0.32 1.69 0.28 -0.85 0.00 0.00 174.74 176.90 1xdi h VAL 217 N 2.51 1.15 -3.43 -0.90 2.07 -1.97 -3.33 116.25 112.35 1xdi h VAL 217 Ca -0.38 -0.44 -0.66 0.00 0.82 0.00 0.00 66.70 66.03 1xdi h VAL 217 Cb 1.22 0.92 -0.39 0.00 -1.52 0.00 0.00 31.29 31.53 1xdi h VAL 217 CO 0.63 0.16 -0.50 -0.22 0.02 0.00 0.00 177.57 177.66 1xdi s LEU 218 N -9.90 4.75 0.42 2.57 0.20 -1.26 -3.01 118.68 112.43 1xdi s LEU 218 Ca -0.13 -3.04 -0.24 0.00 0.69 0.00 0.00 54.13 51.41 1xdi s LEU 218 Cb 0.09 -1.73 -0.08 0.00 -0.43 0.00 0.00 46.19 44.03 1xdi s LEU 218 CO 0.72 -0.27 1.17 -2.16 -0.29 0.00 0.00 176.35 175.52 1xdi s PRO 219 N -0.32 3.96 -0.12 0.98 0.04 -1.25 -4.93 135.00 133.36 1xdi s PRO 219 Ca 0.18 1.82 -0.12 0.00 0.04 0.00 0.00 61.00 62.92 1xdi s PRO 219 Cb -0.22 -2.59 0.03 0.00 0.04 0.00 0.00 34.50 31.76 1xdi s PRO 219 CO -0.03 -0.39 0.34 -0.47 0.04 0.00 0.00 177.00 176.50 1xdi s TYR 220 N -1.46 -0.36 0.14 0.56 5.04 -1.26 -4.87 117.35 115.15 1xdi s TYR 220 Ca 0.59 0.85 -0.26 0.00 -2.44 0.00 0.00 57.07 55.81 1xdi s TYR 220 Cb -0.30 0.13 -0.01 0.00 0.35 0.00 0.00 41.96 42.12 1xdi s TYR 220 CO 0.37 -0.21 1.60 1.49 -1.34 0.00 0.00 175.55 177.47 1xdi h GLU 221 N 5.38 -0.37 -6.04 4.97 4.81 -2.03 -3.40 114.58 117.90 1xdi h GLU 221 Ca -0.27 0.03 -0.58 0.00 -0.13 0.00 0.00 59.36 58.41 1xdi h GLU 221 Cb 1.18 0.08 -0.06 0.00 0.63 0.00 0.00 28.75 30.59 1xdi h GLU 221 CO 0.30 -0.25 0.74 0.34 -0.73 0.00 0.00 179.01 179.41 1xdi s ASP 222 N -4.94 7.06 0.11 1.04 -1.08 -1.26 -4.81 116.67 112.79 1xdi s ASP 222 Ca -0.15 1.33 -0.29 0.00 -0.52 0.00 0.00 52.55 52.92 1xdi s ASP 222 Cb 0.11 -2.52 -0.10 0.00 -1.46 0.00 0.00 42.92 38.95 1xdi s ASP 222 CO 0.66 -0.64 1.62 0.00 0.52 0.00 0.00 175.17 177.33 1xdi h ALA 223 N 7.48 -0.58 -0.98 3.66 0.00 -2.01 -2.24 119.26 124.59 1xdi h ALA 223 Ca -0.20 -0.07 0.18 0.00 0.00 0.00 0.00 54.91 54.83 1xdi h ALA 223 Cb 1.07 0.49 -0.09 0.00 0.00 0.00 0.00 17.79 19.26 1xdi h ALA 223 CO 0.96 -0.88 0.61 -0.44 0.00 0.00 0.00 179.25 179.51 1xdi h ASP 224 N -0.58 0.72 -0.01 0.00 3.32 -1.96 -1.59 116.42 116.33 1xdi h ASP 224 Ca 0.01 0.08 -0.00 0.00 0.02 0.00 0.00 57.03 57.14 1xdi h ASP 224 Cb 0.58 -0.06 -0.00 0.00 0.22 0.00 0.00 39.33 40.07 1xdi h ASP 224 CO -0.14 0.28 -0.00 0.00 -1.72 0.00 0.00 179.24 177.66 1xdi h ALA 225 N 1.62 0.01 -0.76 3.45 0.00 -1.89 -2.80 119.26 118.90 1xdi h ALA 225 Ca 0.54 -0.17 0.16 0.00 0.00 0.00 0.00 54.91 55.44 1xdi h ALA 225 Cb 0.90 -0.00 -0.14 0.00 0.00 0.00 0.00 17.79 18.55 1xdi h ALA 225 CO -0.32 -0.31 -0.14 0.00 0.00 0.00 0.00 179.25 178.48 1xdi h ALA 226 N 0.66 0.58 -0.19 0.00 0.00 -0.76 0.61 119.26 120.15 1xdi h ALA 226 Ca 0.00 0.28 -0.00 0.00 0.00 0.00 0.00 54.91 55.19 1xdi h ALA 226 Cb 0.35 0.54 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 1xdi h ALA 226 CO 0.00 -0.42 0.12 1.25 0.00 0.00 0.00 179.25 180.20 1xdi h LEU 227 N 0.02 0.23 -0.82 0.00 6.46 -1.30 0.26 115.31 120.16 1xdi h LEU 227 Ca 0.38 -0.04 0.17 0.00 -0.12 0.00 0.00 57.88 58.27 1xdi h LEU 227 Cb 0.61 -0.06 -0.11 0.00 -0.73 0.00 0.00 40.66 40.38 1xdi h LEU 227 CO -0.75 0.20 0.35 0.58 -0.62 0.00 0.00 178.44 178.19 1xdi h VAL 228 N 0.24 0.60 0.17 1.05 2.07 -0.62 0.98 116.25 120.74 1xdi h VAL 228 Ca 0.07 -0.16 -0.31 0.00 0.82 0.00 0.00 66.70 67.12 1xdi h VAL 228 Cb 0.01 0.11 0.03 0.00 -1.52 0.00 0.00 31.29 29.91 1xdi h VAL 228 CO -0.01 0.08 -1.33 -0.07 0.02 0.00 0.00 177.57 176.26 1xdi h LEU 229 N 0.45 0.85 0.09 2.57 3.38 -0.65 -2.67 115.31 119.34 1xdi h LEU 229 Ca 0.47 -0.83 0.02 0.00 0.09 0.00 0.00 57.88 57.63 1xdi h LEU 229 Cb 0.78 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 41.22 1xdi h LEU 229 CO -0.45 1.64 -0.28 -0.08 0.09 0.00 0.00 178.44 179.36 1xdi h GLU 230 N 0.23 -0.47 -0.96 1.13 4.81 0.26 0.88 114.58 120.45 1xdi h GLU 230 Ca -0.21 0.03 0.13 0.00 -0.13 0.00 0.00 59.36 59.18 1xdi h GLU 230 Cb 2.01 0.11 -0.08 0.00 0.63 0.00 0.00 28.75 31.41 1xdi h GLU 230 CO 0.25 -0.31 0.61 0.93 -0.73 0.00 0.00 179.01 179.76 1xdi h GLU 231 N -0.48 0.86 0.40 1.92 4.39 -0.92 -1.69 114.58 119.07 1xdi h GLU 231 Ca 0.04 -0.05 -0.02 0.00 0.34 0.00 0.00 59.36 59.67 1xdi h GLU 231 Cb 0.52 -0.19 0.00 0.00 -0.10 0.00 0.00 28.75 28.98 1xdi h GLU 231 CO -0.18 0.57 -0.19 1.03 -1.16 0.00 0.00 179.01 179.07 1xdi h SER 232 N 0.89 -0.46 -0.94 1.42 0.87 -0.90 -1.29 113.55 113.14 1xdi h SER 232 Ca 0.48 -0.10 0.07 0.00 -1.23 0.00 0.00 61.79 61.01 1xdi h SER 232 Cb 0.57 0.12 -0.07 0.00 -0.44 0.00 0.00 62.40 62.58 1xdi h SER 232 CO -0.25 -0.14 0.59 -0.26 -0.53 0.00 0.00 176.83 176.24 1xdi h PHE 233 N -0.80 1.09 -0.45 2.24 0.04 -0.67 -1.92 116.94 116.48 1xdi h PHE 233 Ca -0.06 0.03 -0.02 0.00 2.80 0.00 0.00 57.97 60.73 1xdi h PHE 233 Cb 0.54 -0.35 -0.02 0.00 2.20 0.00 0.00 35.95 38.31 1xdi h PHE 233 CO 0.01 0.54 0.22 0.00 -0.60 0.00 0.00 178.31 178.48 1xdi h ALA 234 N 1.44 0.58 0.30 2.45 0.00 -1.24 0.04 119.26 122.83 1xdi h ALA 234 Ca 0.41 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.20 1xdi h ALA 234 Cb 0.21 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1xdi h ALA 234 CO -0.19 0.14 -0.14 0.93 0.00 0.00 0.00 179.25 179.98 1xdi h GLU 235 N 0.58 -0.39 0.00 0.00 5.08 -0.82 -1.55 114.58 117.48 1xdi h GLU 235 Ca 0.15 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 1xdi h GLU 235 Cb 0.11 0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.45 1xdi h GLU 235 CO -0.02 -0.13 0.00 0.54 -1.00 0.00 0.00 179.01 178.40 1xdi n ARG 236 N -5.18 0.16 -1.28 2.33 1.74 -0.76 -4.80 116.66 108.88 1xdi n ARG 236 Ca -0.10 0.00 -0.07 0.00 -0.77 0.00 0.00 57.85 56.91 1xdi n ARG 236 Cb 0.24 -1.05 -0.03 0.00 -1.02 0.00 0.00 32.46 30.60 1xdi n ARG 236 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1xdi n GLY 237 N -0.37 0.84 3.75 -0.13 0.00 -0.58 -5.01 105.19 103.69 1xdi n GLY 237 Ca 0.00 -0.73 -0.41 0.00 0.00 0.00 0.00 46.02 44.88 1xdi n GLY 237 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xdi s VAL 238 N -2.26 2.78 -0.15 1.61 1.01 -0.07 -4.79 120.40 118.53 1xdi s VAL 238 Ca 0.00 0.68 -0.10 0.00 0.00 0.00 0.00 61.98 62.55 1xdi s VAL 238 Cb 0.00 -3.43 -0.05 0.00 0.00 0.00 0.00 36.38 32.90 1xdi s VAL 238 CO 0.00 0.12 0.19 -0.13 0.00 0.00 0.00 175.10 175.28 1xdi s ARG 239 N -0.61 3.96 0.00 2.72 0.52 -0.58 -4.63 118.95 120.32 1xdi s ARG 239 Ca 0.57 -0.07 -0.01 0.00 -0.52 0.00 0.00 55.73 55.70 1xdi s ARG 239 Cb -0.40 -3.34 -0.00 0.00 0.52 0.00 0.00 34.95 31.73 1xdi s ARG 239 CO 0.44 0.46 0.01 -0.48 0.02 0.00 0.00 175.30 175.76 1xdi s LEU 240 N -0.15 2.00 -0.38 2.53 2.34 -1.26 0.43 118.68 124.19 1xdi s LEU 240 Ca 0.13 -0.14 -0.12 0.00 0.06 0.00 0.00 54.13 54.07 1xdi s LEU 240 Cb -0.12 0.12 0.03 0.00 -0.56 0.00 0.00 46.19 45.65 1xdi s LEU 240 CO 0.02 -0.12 0.22 -0.36 -1.06 0.00 0.00 176.35 175.06 1xdi s PHE 241 N -0.53 3.25 0.59 3.48 0.08 0.62 -4.93 117.98 120.54 1xdi s PHE 241 Ca -0.06 -0.91 -0.16 0.00 0.12 0.00 0.00 56.93 55.93 1xdi s PHE 241 Cb -0.04 -2.47 -0.04 0.00 -0.57 0.00 0.00 43.02 39.91 1xdi s PHE 241 CO -0.00 -0.64 1.05 0.15 -0.10 0.00 0.00 175.22 175.68 1xdi s LYS 242 N 1.57 3.34 -1.40 0.44 1.02 -1.26 -2.14 119.74 121.31 1xdi s LYS 242 Ca 0.02 1.19 -0.02 0.00 0.02 0.00 0.00 55.97 57.19 1xdi s LYS 242 Cb -0.19 -2.04 0.00 0.00 -0.52 0.00 0.00 37.83 35.08 1xdi s LYS 242 CO 0.07 -0.79 0.40 0.09 -0.92 0.00 0.00 175.35 174.20 1xdi n ASN 243 N -2.03 -0.50 -4.07 2.83 3.02 -0.44 -4.90 115.26 109.17 1xdi n ASN 243 Ca 0.09 -1.04 -0.14 0.00 -0.03 0.00 0.00 54.58 53.46 1xdi n ASN 243 Cb 0.53 -2.93 -0.12 0.00 -0.61 0.00 0.00 39.78 36.66 1xdi n ASN 243 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1xdi s ALA 244 N -3.97 0.64 0.08 5.41 0.00 0.33 -4.95 121.76 119.31 1xdi s ALA 244 Ca 0.03 -0.76 0.10 0.00 0.00 0.00 0.00 51.96 51.33 1xdi s ALA 244 Cb -0.01 0.01 -0.03 0.00 0.00 0.00 0.00 23.12 23.09 1xdi s ALA 244 CO 0.90 0.01 -0.26 1.03 0.00 0.00 0.00 175.76 177.45 1xdi s ARG 245 N -1.49 1.55 -0.35 0.00 0.52 -1.26 -3.41 118.95 114.50 1xdi s ARG 245 Ca -0.08 -1.19 -0.27 0.00 -0.52 0.00 0.00 55.73 53.67 1xdi s ARG 245 Cb -0.09 -1.85 0.02 0.00 0.52 0.00 0.00 34.95 33.54 1xdi s ARG 245 CO 0.01 0.46 1.01 0.00 0.02 0.00 0.00 175.30 176.79 1xdi s ALA 246 N -0.93 3.43 0.37 2.13 0.00 -1.26 -1.56 121.76 123.93 1xdi s ALA 246 Ca 0.12 -0.27 0.17 0.00 0.00 0.00 0.00 51.96 51.98 1xdi s ALA 246 Cb -0.10 -3.62 0.94 0.00 0.00 0.00 0.00 23.12 20.34 1xdi s ALA 246 CO 0.04 -1.60 1.90 0.00 0.00 0.00 0.00 175.76 176.10 1xdi h ALA 247 N 8.36 1.37 -1.38 0.00 0.00 -0.32 -3.45 119.26 123.85 1xdi h ALA 247 Ca -0.22 -0.25 0.31 0.00 0.00 0.00 0.00 54.91 54.75 1xdi h ALA 247 Cb 1.07 -0.04 -0.15 0.00 0.00 0.00 0.00 17.79 18.66 1xdi h ALA 247 CO 1.02 0.35 0.85 -1.54 0.00 0.00 0.00 179.25 179.93 1xdi s SER 248 N -6.70 -0.07 -0.25 0.00 1.04 -0.60 -4.84 113.70 102.28 1xdi s SER 248 Ca -0.03 -0.06 -0.03 0.00 0.48 0.00 0.00 55.95 56.31 1xdi s SER 248 Cb 0.14 0.13 0.08 0.00 0.10 0.00 0.00 66.02 66.47 1xdi s SER 248 CO 0.68 -0.22 0.09 -0.69 0.98 0.00 0.00 173.24 174.08 1xdi s VAL 249 N -2.35 0.39 0.33 5.02 1.01 0.19 -1.74 120.40 123.24 1xdi s VAL 249 Ca 0.12 -0.81 0.01 0.00 0.00 0.00 0.00 61.98 61.30 1xdi s VAL 249 Cb 0.03 -1.15 -0.03 0.00 0.00 0.00 0.00 36.38 35.22 1xdi s VAL 249 CO -0.04 -0.50 0.52 -0.89 0.00 0.00 0.00 175.10 174.18 1xdi s THR 250 N 1.89 5.13 -0.27 3.92 2.01 -0.65 -4.48 115.64 123.19 1xdi s THR 250 Ca 0.05 -0.53 -0.11 0.00 0.31 0.00 0.00 61.69 61.42 1xdi s THR 250 Cb -0.17 -3.86 -0.05 0.00 0.01 0.00 0.00 72.50 68.44 1xdi s THR 250 CO -0.21 -0.51 0.17 -0.60 -0.69 0.00 0.00 174.62 172.78 1xdi s ARG 251 N -4.23 3.92 0.00 4.92 3.52 -1.26 -0.47 118.95 125.35 1xdi s ARG 251 Ca 0.39 -0.34 0.00 0.00 -0.13 0.00 0.00 55.73 55.65 1xdi s ARG 251 Cb -0.10 -3.61 0.00 0.00 -1.56 0.00 0.00 34.95 29.68 1xdi s ARG 251 CO 0.35 -0.16 0.00 0.25 -0.81 0.00 0.00 175.30 174.92 1xdi n THR 252 N 4.99 0.00 0.00 4.11 -2.24 -1.14 -4.87 114.28 115.14 1xdi n THR 252 Ca -0.14 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 1xdi n THR 252 Cb 0.52 -1.07 0.00 0.00 -2.10 0.00 0.00 70.33 67.68 1xdi n THR 252 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xdi n GLY 253 N 5.00 -1.65 0.08 3.38 0.00 -1.26 -3.95 105.19 106.79 1xdi n GLY 253 Ca 0.00 0.35 0.05 0.00 0.00 0.00 0.00 46.02 46.43 1xdi n GLY 253 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xdi n ALA 254 N -1.94 3.33 -2.71 4.61 0.00 -1.26 -5.00 120.51 117.53 1xdi n ALA 254 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.08 1xdi n ALA 254 Cb 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 19.45 19.04 1xdi n ALA 254 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xdi n GLY 255 N 1.19 2.14 3.23 0.00 0.00 -1.25 -4.90 105.19 105.59 1xdi n GLY 255 Ca 0.03 -0.33 -0.13 0.00 0.00 0.00 0.00 46.02 45.59 1xdi n GLY 255 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xdi s VAL 256 N 4.06 -0.00 -0.37 1.61 1.01 0.32 -2.87 120.40 124.15 1xdi s VAL 256 Ca 0.00 0.01 -0.09 0.00 0.00 0.00 0.00 61.98 61.90 1xdi s VAL 256 Cb 0.00 -0.49 0.04 0.00 0.00 0.00 0.00 36.38 35.93 1xdi s VAL 256 CO 0.00 0.01 0.18 -0.22 0.00 0.00 0.00 175.10 175.07 1xdi s LEU 257 N 0.31 4.67 -0.16 3.92 2.96 0.38 -1.99 118.68 128.77 1xdi s LEU 257 Ca -0.01 -1.15 -0.17 0.00 -0.22 0.00 0.00 54.13 52.58 1xdi s LEU 257 Cb -0.03 -1.96 -0.04 0.00 0.50 0.00 0.00 46.19 44.66 1xdi s LEU 257 CO -0.01 -0.40 0.42 -0.69 -1.32 0.00 0.00 176.35 174.36 1xdi s VAL 258 N 1.47 5.21 -0.12 1.68 1.01 -0.67 -1.63 120.40 127.35 1xdi s VAL 258 Ca 0.01 0.80 0.03 0.00 0.00 0.00 0.00 61.98 62.82 1xdi s VAL 258 Cb -0.20 -3.76 0.01 0.00 0.00 0.00 0.00 36.38 32.43 1xdi s VAL 258 CO 0.04 0.30 -0.23 -0.89 0.00 0.00 0.00 175.10 174.32 1xdi s THR 259 N 0.92 2.04 0.18 3.92 2.01 -0.71 -1.68 115.64 122.32 1xdi s THR 259 Ca 0.22 -0.99 0.08 0.00 0.31 0.00 0.00 61.69 61.30 1xdi s THR 259 Cb -0.15 -1.79 -0.04 0.00 0.01 0.00 0.00 72.50 70.53 1xdi s THR 259 CO 0.08 0.55 -0.01 0.00 -0.69 0.00 0.00 174.62 174.55 1xdi s MET 260 N 0.60 2.37 0.32 4.92 0.23 -1.12 0.39 119.30 127.00 1xdi s MET 260 Ca -0.13 -1.14 0.00 0.00 -1.03 0.00 0.00 55.69 53.40 1xdi s MET 260 Cb -0.17 -2.33 0.00 0.00 -1.53 0.00 0.00 34.83 30.80 1xdi s MET 260 CO 0.03 0.45 0.72 0.25 -2.03 0.00 0.00 175.02 174.44 1xdi n THR 261 N -0.14 0.00 1.06 3.16 -2.24 -0.60 0.10 114.28 115.62 1xdi n THR 261 Ca -0.10 0.72 0.12 0.00 -2.27 0.00 0.00 64.05 62.52 1xdi n THR 261 Cb 0.55 -1.67 0.16 0.00 -2.10 0.00 0.00 70.33 67.27 1xdi n THR 261 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1xdi n ASP 262 N -1.70 0.96 0.00 3.42 5.68 -1.26 -4.98 116.55 118.67 1xdi n ASP 262 Ca 0.00 -0.76 0.00 0.00 -0.50 0.00 0.00 54.79 53.53 1xdi n ASP 262 Cb 0.72 0.43 0.00 0.00 -1.14 0.00 0.00 41.12 41.13 1xdi n ASP 262 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1xdi n GLY 263 N 1.45 2.78 3.62 6.12 0.00 0.28 -5.08 105.19 114.37 1xdi n GLY 263 Ca 0.07 -0.08 -0.30 0.00 0.00 0.00 0.00 46.02 45.71 1xdi n GLY 263 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xdi s ARG 264 N 0.00 0.43 0.10 1.61 0.52 -1.26 -4.75 118.95 115.60 1xdi s ARG 264 Ca 0.00 1.15 0.01 0.00 -0.52 0.00 0.00 55.73 56.36 1xdi s ARG 264 Cb 0.00 -1.69 -0.04 0.00 0.52 0.00 0.00 34.95 33.74 1xdi s ARG 264 CO 0.00 -2.91 -0.03 0.95 0.02 0.00 0.00 175.30 173.33 1xdi s THR 265 N -2.65 0.50 0.16 0.02 -4.23 -1.26 -2.80 115.64 105.38 1xdi s THR 265 Ca 0.66 -1.90 0.03 0.00 -1.18 0.00 0.00 61.69 59.30 1xdi s THR 265 Cb -0.22 -1.74 -0.05 0.00 1.34 0.00 0.00 72.50 71.83 1xdi s THR 265 CO 0.60 -0.81 -0.05 -0.69 -0.54 0.00 0.00 174.62 173.13 1xdi s VAL 266 N -3.75 0.93 -0.06 2.29 1.01 -0.68 -5.00 120.40 115.13 1xdi s VAL 266 Ca 0.13 -2.01 0.01 0.00 0.00 0.00 0.00 61.98 60.11 1xdi s VAL 266 Cb 0.06 -1.96 0.02 0.00 0.00 0.00 0.00 36.38 34.50 1xdi s VAL 266 CO -0.04 -0.64 -0.07 -1.61 0.00 0.00 0.00 175.10 172.74 1xdi s GLU 267 N -3.82 1.16 0.15 2.72 2.02 -1.26 -1.66 118.70 118.00 1xdi s GLU 267 Ca 0.19 -0.19 0.02 0.00 0.02 0.00 0.00 54.97 55.01 1xdi s GLU 267 Cb 0.04 -1.14 -0.01 0.00 0.10 0.00 0.00 34.13 33.13 1xdi s GLU 267 CO 0.02 -0.11 0.07 0.41 0.02 0.00 0.00 175.26 175.67 1xdi n GLY 268 N 4.25 3.74 0.13 -1.39 0.00 -0.84 -4.96 105.19 106.11 1xdi n GLY 268 Ca -0.20 -1.94 -0.20 0.00 0.00 0.00 0.00 46.02 43.68 1xdi n GLY 268 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1xdi h SER 269 N 0.65 0.56 -4.96 1.61 4.64 -0.95 0.93 113.55 116.03 1xdi h SER 269 Ca -0.11 -0.71 -0.17 0.00 -0.47 0.00 0.00 61.79 60.33 1xdi h SER 269 Cb 0.46 -0.18 -0.16 0.00 -0.31 0.00 0.00 62.40 62.21 1xdi h SER 269 CO 0.18 1.58 -0.69 -1.00 -0.87 0.00 0.00 176.83 176.03 1xdi s HIS 270 N -2.61 0.64 -0.12 4.77 3.76 -1.22 -3.91 115.29 116.60 1xdi s HIS 270 Ca -0.10 -0.94 0.01 0.00 -0.15 0.00 0.00 55.06 53.89 1xdi s HIS 270 Cb 0.06 -0.42 0.02 0.00 1.11 0.00 0.00 32.58 33.34 1xdi s HIS 270 CO 0.88 -0.26 -0.14 0.00 -0.85 0.00 0.00 174.74 174.36 1xdi s ALA 271 N -3.47 1.71 -0.41 -1.40 0.00 0.14 -1.41 121.76 116.93 1xdi s ALA 271 Ca 0.06 -0.76 -0.16 0.00 0.00 0.00 0.00 51.96 51.10 1xdi s ALA 271 Cb 0.05 -0.89 0.02 0.00 0.00 0.00 0.00 23.12 22.29 1xdi s ALA 271 CO -0.07 -0.17 0.35 -1.17 0.00 0.00 0.00 175.76 174.71 1xdi s LEU 272 N 1.15 4.94 -0.28 0.00 0.20 0.03 0.12 118.68 124.83 1xdi s LEU 272 Ca -0.03 -0.74 -0.29 0.00 0.69 0.00 0.00 54.13 53.76 1xdi s LEU 272 Cb -0.14 -2.26 0.01 0.00 -0.43 0.00 0.00 46.19 43.37 1xdi s LEU 272 CO -0.04 -0.48 1.18 -0.04 -0.29 0.00 0.00 176.35 176.68 1xdi s MET 273 N 1.88 4.05 -0.54 1.98 -1.94 0.23 -1.43 119.30 123.53 1xdi s MET 273 Ca 0.08 1.24 0.04 0.00 -1.71 0.00 0.00 55.69 55.35 1xdi s MET 273 Cb -0.18 -3.79 0.38 0.00 2.01 0.00 0.00 34.83 33.25 1xdi s MET 273 CO 0.12 -0.94 1.13 2.41 -0.01 0.00 0.00 175.02 177.73 1xdi n THR 274 N 5.89 2.87 -0.11 2.05 -1.04 0.09 -4.09 114.28 119.93 1xdi n THR 274 Ca 0.13 -5.20 0.00 0.00 -2.04 0.00 0.00 64.05 56.94 1xdi n THR 274 Cb 0.46 -1.33 0.00 0.00 -1.82 0.00 0.00 70.33 67.64 1xdi n THR 274 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 1xdi n ILE 275 N -0.38 0.00 -1.14 12.58 5.41 -1.26 -4.42 119.36 130.16 1xdi n ILE 275 Ca 0.37 0.00 0.00 0.00 1.00 0.00 0.00 62.75 64.12 1xdi n ILE 275 Cb 0.51 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.44 1xdi n ILE 275 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1xdi n GLY 276 N 5.00 2.34 3.32 7.39 0.00 -1.26 -4.91 105.19 117.07 1xdi n GLY 276 Ca 0.00 -1.89 -0.18 0.00 0.00 0.00 0.00 46.02 43.95 1xdi n GLY 276 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xdi s SER 277 N -0.73 1.39 -0.02 1.61 0.01 -1.26 -0.54 113.70 114.16 1xdi s SER 277 Ca 0.00 -1.52 0.06 0.00 1.31 0.00 0.00 55.95 55.80 1xdi s SER 277 Cb 0.00 0.34 -0.01 0.00 0.21 0.00 0.00 66.02 66.56 1xdi s SER 277 CO 0.00 -0.86 -0.19 -0.69 0.41 0.00 0.00 173.24 171.92 1xdi s VAL 278 N -3.67 1.51 0.33 3.43 1.01 0.30 -4.67 120.40 118.64 1xdi s VAL 278 Ca 0.36 -0.80 -0.29 0.00 0.00 0.00 0.00 61.98 61.25 1xdi s VAL 278 Cb 0.06 -1.27 -0.10 0.00 0.00 0.00 0.00 36.38 35.06 1xdi s VAL 278 CO 0.16 0.43 1.35 -2.16 0.00 0.00 0.00 175.10 174.88 1xdi s PRO 279 N -0.32 4.31 -1.34 2.72 0.04 -1.26 0.01 135.00 139.15 1xdi s PRO 279 Ca 0.04 2.28 -0.11 0.00 0.04 0.00 0.00 61.00 63.25 1xdi s PRO 279 Cb -0.09 -3.06 0.12 0.00 0.04 0.00 0.00 34.50 31.52 1xdi s PRO 279 CO 0.00 -0.26 1.99 0.09 0.04 0.00 0.00 177.00 178.86 1xdi n ASN 280 N 0.84 4.65 -0.37 6.66 5.03 0.12 -4.63 115.26 127.56 1xdi n ASN 280 Ca 0.01 -3.00 0.08 0.00 0.87 0.00 0.00 54.58 52.53 1xdi n ASN 280 Cb 0.41 -1.55 0.17 0.00 -1.02 0.00 0.00 39.78 37.79 1xdi n ASN 280 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.26 175.78 1xdi n THR 281 N 4.09 1.98 -4.21 3.41 -2.24 -1.26 -4.72 114.28 111.32 1xdi n THR 281 Ca 0.44 -2.69 -0.26 0.00 -2.27 0.00 0.00 64.05 59.27 1xdi n THR 281 Cb 0.38 -0.20 -0.08 0.00 -2.10 0.00 0.00 70.33 68.33 1xdi n THR 281 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1xdi s SER 282 N -3.01 4.75 -1.24 3.42 1.04 -1.26 -4.61 113.70 112.79 1xdi s SER 282 Ca 0.34 -0.41 -0.06 0.00 0.48 0.00 0.00 55.95 56.30 1xdi s SER 282 Cb 0.32 -1.00 0.01 0.00 0.10 0.00 0.00 66.02 65.45 1xdi s SER 282 CO -0.02 0.08 0.76 0.61 0.98 0.00 0.00 173.24 175.65 1xdi n GLY 283 N -0.17 -0.33 0.13 7.32 0.00 -1.26 -4.89 105.19 105.98 1xdi n GLY 283 Ca -0.09 0.05 0.05 0.00 0.00 0.00 0.00 46.02 46.03 1xdi n GLY 283 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1xdi n LEU 284 N -3.89 0.88 -0.57 0.99 4.77 -1.26 -4.85 117.00 113.08 1xdi n LEU 284 Ca -0.05 -0.63 -0.05 0.00 -0.03 0.00 0.00 56.01 55.24 1xdi n LEU 284 Cb 0.58 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.66 1xdi n LEU 284 CO 0.47 0.19 -0.06 0.61 -1.33 0.00 0.00 177.39 177.27 1xdi n GLY 285 N 1.08 0.31 0.08 -0.72 0.00 -1.26 -0.74 105.19 103.94 1xdi n GLY 285 Ca 0.03 -0.70 0.08 0.00 0.00 0.00 0.00 46.02 45.43 1xdi n GLY 285 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1xdi n LEU 286 N -0.74 0.33 0.01 0.99 4.77 -1.26 -1.45 117.00 119.66 1xdi n LEU 286 Ca -0.06 0.61 -0.14 0.00 -0.03 0.00 0.00 56.01 56.39 1xdi n LEU 286 Cb 0.45 -0.60 -0.03 0.00 -2.33 0.00 0.00 43.42 40.92 1xdi n LEU 286 CO 0.08 -0.55 0.30 -0.33 -1.33 0.00 0.00 177.39 175.56 1xdi h GLU 287 N 0.00 0.62 0.00 3.23 3.07 -1.91 -2.42 114.58 117.17 1xdi h GLU 287 Ca 0.00 -0.51 0.00 0.00 -0.50 0.00 0.00 59.36 58.35 1xdi h GLU 287 Cb 0.18 0.11 0.00 0.00 -0.84 0.00 0.00 28.75 28.20 1xdi h GLU 287 CO 0.00 1.13 0.00 0.54 -1.40 0.00 0.00 179.01 179.28 1xdi n ARG 288 N -3.89 0.00 0.00 2.33 1.74 -0.53 -2.47 116.66 113.85 1xdi n ARG 288 Ca -0.06 0.35 0.00 0.00 -0.77 0.00 0.00 57.85 57.37 1xdi n ARG 288 Cb 0.73 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.67 1xdi n ARG 288 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1xdi n VAL 289 N -1.49 0.81 0.00 1.55 0.31 -1.15 -3.93 118.33 114.43 1xdi n VAL 289 Ca 0.02 -0.85 0.00 0.00 -0.01 0.00 0.00 64.34 63.50 1xdi n VAL 289 Cb 0.09 0.60 0.00 0.00 -0.91 0.00 0.00 33.84 33.63 1xdi n VAL 289 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1xdi n GLY 290 N -0.41 1.33 3.80 2.92 0.00 -1.03 -4.81 105.19 106.99 1xdi n GLY 290 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1xdi n GLY 290 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xdi s ILE 291 N -2.33 3.96 -0.12 -0.61 1.01 -0.92 -5.01 121.20 117.18 1xdi s ILE 291 Ca 0.00 1.23 -0.02 0.00 0.00 0.00 0.00 60.65 61.87 1xdi s ILE 291 Cb 0.00 -3.50 0.04 0.00 0.01 0.00 0.00 42.46 39.01 1xdi s ILE 291 CO 0.00 -0.25 0.01 -1.10 0.00 0.00 0.00 174.94 173.59 1xdi s GLN 292 N -3.19 0.71 -0.02 2.79 -1.52 -1.26 -4.28 119.66 112.89 1xdi s GLN 292 Ca 0.65 -0.10 -0.39 0.00 -1.95 0.00 0.00 55.36 53.57 1xdi s GLN 292 Cb -0.14 -1.41 -0.18 0.00 -0.22 0.00 0.00 33.01 31.05 1xdi s GLN 292 CO 0.18 -0.41 1.28 1.28 -0.25 0.00 0.00 175.29 177.37 1xdi n LEU 293 N 5.10 1.00 0.00 2.90 4.77 -1.26 -4.91 117.00 124.60 1xdi n LEU 293 Ca -0.08 1.14 -0.25 0.00 -0.03 0.00 0.00 56.01 56.78 1xdi n LEU 293 Cb 0.49 -1.05 0.18 0.00 -2.33 0.00 0.00 43.42 40.70 1xdi n LEU 293 CO 0.12 -1.33 0.74 0.61 -1.33 0.00 0.00 177.39 176.20 1xdi n GLY 294 N 2.35 -1.52 3.55 -0.72 0.00 0.14 -4.72 105.19 104.26 1xdi n GLY 294 Ca 0.21 -1.69 -0.62 0.00 0.00 0.00 0.00 46.02 43.91 1xdi n GLY 294 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xdi n ARG 295 N -3.46 0.26 -0.18 1.61 1.74 -1.26 -0.12 116.66 115.25 1xdi n ARG 295 Ca 0.14 0.09 0.00 0.00 -0.77 0.00 0.00 57.85 57.31 1xdi n ARG 295 Cb 0.50 -1.67 0.00 0.00 -1.02 0.00 0.00 32.46 30.27 1xdi n ARG 295 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1xdi n GLY 296 N 5.43 0.90 2.42 -0.13 0.00 -1.26 -4.06 105.19 108.49 1xdi n GLY 296 Ca 0.39 -0.11 -0.19 0.00 0.00 0.00 0.00 46.02 46.10 1xdi n GLY 296 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1xdi n ASN 297 N 0.21 -5.50 -4.88 1.61 3.02 0.83 -4.68 115.26 105.86 1xdi n ASN 297 Ca 0.00 0.10 -0.32 0.00 -0.03 0.00 0.00 54.58 54.33 1xdi n ASN 297 Cb 0.00 -4.64 -0.05 0.00 -0.61 0.00 0.00 39.78 34.48 1xdi n ASN 297 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1xdi s TYR 298 N -2.91 3.48 -1.28 3.10 2.02 -0.83 -4.61 117.35 116.31 1xdi s TYR 298 Ca 0.00 0.78 -0.15 0.00 -0.37 0.00 0.00 57.07 57.34 1xdi s TYR 298 Cb 0.00 -2.18 0.12 0.00 -0.40 0.00 0.00 41.96 39.50 1xdi s TYR 298 CO 0.00 0.37 1.69 -0.11 -1.57 0.00 0.00 175.55 175.93 1xdi n LEU 299 N 0.16 5.48 -4.62 -1.29 0.00 -0.72 0.24 117.00 116.25 1xdi n LEU 299 Ca -0.02 -4.25 -0.62 0.00 0.00 0.00 0.00 56.01 51.12 1xdi n LEU 299 Cb 0.52 -1.65 -0.09 0.00 0.00 0.00 0.00 43.42 42.20 1xdi n LEU 299 CO 0.46 0.64 0.86 0.35 0.00 0.00 0.00 177.39 179.70 1xdi n THR 300 N 5.16 0.01 -4.52 1.96 -2.24 -1.26 -4.53 114.28 108.86 1xdi n THR 300 Ca 0.43 -0.00 -0.24 0.00 -2.27 0.00 0.00 64.05 61.97 1xdi n THR 300 Cb 0.43 -0.31 -0.10 0.00 -2.10 0.00 0.00 70.33 68.25 1xdi n THR 300 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1xdi s VAL 301 N 1.42 1.21 0.12 2.28 0.11 -1.26 -4.60 120.40 119.69 1xdi s VAL 301 Ca 0.97 -2.00 -0.02 0.00 -2.93 0.00 0.00 61.98 58.00 1xdi s VAL 301 Cb -1.34 -2.69 0.03 0.00 -1.53 0.00 0.00 36.38 30.85 1xdi s VAL 301 CO 0.67 0.00 0.13 0.47 -3.33 0.00 0.00 175.10 173.04 1xdi n ASP 302 N -0.89 -0.64 -0.00 3.54 8.00 -0.66 -4.90 116.55 121.00 1xdi n ASP 302 Ca -0.05 -0.78 0.09 0.00 0.71 0.00 0.00 54.79 54.77 1xdi n ASP 302 Cb 0.66 -0.11 -0.11 0.00 -0.02 0.00 0.00 41.12 41.54 1xdi n ASP 302 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 1xdi n ARG 303 N -1.63 0.52 -0.24 -1.24 0.63 -1.26 -3.56 116.66 109.88 1xdi n ARG 303 Ca 0.02 -0.01 0.08 0.00 -0.92 0.00 0.00 57.85 57.03 1xdi n ARG 303 Cb 0.06 -1.43 0.18 0.00 0.45 0.00 0.00 32.46 31.73 1xdi n ARG 303 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 1xdi n VAL 304 N -1.48 1.94 -1.31 5.15 0.31 -1.26 -2.90 118.33 118.78 1xdi n VAL 304 Ca 0.03 -1.92 -0.11 0.00 -0.01 0.00 0.00 64.34 62.33 1xdi n VAL 304 Cb 0.31 -0.14 -0.05 0.00 -0.91 0.00 0.00 33.84 33.05 1xdi n VAL 304 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 1xdi n SER 305 N -0.83 -4.97 -4.79 4.52 7.64 -1.23 -4.42 113.62 109.54 1xdi n SER 305 Ca 0.17 0.27 -0.32 0.00 1.01 0.00 0.00 58.87 60.00 1xdi n SER 305 Cb 0.71 -3.42 -0.06 0.00 -1.01 0.00 0.00 64.21 60.43 1xdi n SER 305 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1xdi s ARG 306 N -2.75 3.01 0.94 1.43 1.70 -1.26 -1.41 118.95 120.61 1xdi s ARG 306 Ca 0.00 -0.58 -0.14 0.00 -0.47 0.00 0.00 55.73 54.54 1xdi s ARG 306 Cb 0.00 -2.81 0.20 0.00 -0.57 0.00 0.00 34.95 31.77 1xdi s ARG 306 CO 0.00 0.61 1.29 0.95 -1.08 0.00 0.00 175.30 177.07 1xdi s THR 307 N -1.31 2.01 -0.73 4.99 -4.23 0.69 -1.66 115.64 115.40 1xdi s THR 307 Ca 0.27 -0.08 0.23 0.00 -1.18 0.00 0.00 61.69 60.93 1xdi s THR 307 Cb -0.12 -2.93 0.23 0.00 1.34 0.00 0.00 72.50 71.01 1xdi s THR 307 CO 0.19 0.00 1.70 0.18 -0.54 0.00 0.00 174.62 176.15 1xdi n LEU 308 N -3.68 0.46 -4.76 4.79 4.32 -1.26 -4.66 117.00 112.21 1xdi n LEU 308 Ca 0.16 0.59 -0.36 0.00 -0.02 0.00 0.00 56.01 56.37 1xdi n LEU 308 Cb 0.59 -0.49 -0.07 0.00 -1.62 0.00 0.00 43.42 41.83 1xdi n LEU 308 CO 0.45 -0.33 -0.11 0.00 -1.22 0.00 0.00 177.39 176.18 1xdi s ALA 309 N -3.15 3.69 0.75 -1.18 0.00 -1.26 -5.02 121.76 115.58 1xdi s ALA 309 Ca 0.08 -0.58 -0.14 0.00 0.00 0.00 0.00 51.96 51.32 1xdi s ALA 309 Cb 0.11 -2.22 0.05 0.00 0.00 0.00 0.00 23.12 21.07 1xdi s ALA 309 CO 0.43 0.23 1.16 0.95 0.00 0.00 0.00 175.76 178.53 1xdi s THR 310 N 0.09 2.62 0.00 0.00 -4.23 -1.26 -1.60 115.64 111.26 1xdi s THR 310 Ca 0.13 0.27 0.00 0.00 -1.18 0.00 0.00 61.69 60.91 1xdi s THR 310 Cb -0.12 -2.73 0.00 0.00 1.34 0.00 0.00 72.50 70.99 1xdi s THR 310 CO 0.02 -0.20 0.00 0.61 -0.54 0.00 0.00 174.62 174.51 1xdi n GLY 311 N -0.06 1.02 3.43 3.99 0.00 -1.26 -4.93 105.19 107.38 1xdi n GLY 311 Ca 0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.75 1xdi n GLY 311 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xdi s ILE 312 N -1.07 4.61 0.20 -0.61 1.01 -0.63 -0.49 121.20 124.22 1xdi s ILE 312 Ca 0.00 -0.47 0.08 0.00 0.00 0.00 0.00 60.65 60.25 1xdi s ILE 312 Cb 0.00 -3.38 -0.04 0.00 0.01 0.00 0.00 42.46 39.05 1xdi s ILE 312 CO 0.00 0.02 0.00 -0.31 0.00 0.00 0.00 174.94 174.66 1xdi s TYR 313 N 1.61 2.81 0.14 3.97 1.51 0.10 -0.22 117.35 127.27 1xdi s TYR 313 Ca 0.04 -0.16 -0.01 0.00 -1.01 0.00 0.00 57.07 55.94 1xdi s TYR 313 Cb -0.17 -1.34 -0.04 0.00 -0.11 0.00 0.00 41.96 40.30 1xdi s TYR 313 CO 0.06 0.54 0.05 0.00 -1.11 0.00 0.00 175.55 175.09 1xdi s ALA 314 N -1.86 0.95 -0.14 3.71 0.00 -0.50 0.18 121.76 124.11 1xdi s ALA 314 Ca 0.28 -1.50 -0.31 0.00 0.00 0.00 0.00 51.96 50.43 1xdi s ALA 314 Cb -0.09 0.83 0.13 0.00 0.00 0.00 0.00 23.12 23.99 1xdi s ALA 314 CO 0.19 -0.46 1.07 0.00 0.00 0.00 0.00 175.76 176.56 1xdi s ALA 315 N -3.99 -1.97 0.00 0.00 0.00 -0.95 -4.65 121.76 110.21 1xdi s ALA 315 Ca 0.24 1.45 0.00 0.00 0.00 0.00 0.00 51.96 53.66 1xdi s ALA 315 Cb 0.07 -0.26 0.00 0.00 0.00 0.00 0.00 23.12 22.94 1xdi s ALA 315 CO 0.02 -0.51 0.00 0.41 0.00 0.00 0.00 175.76 175.68 1xdi n GLY 316 N 0.14 -1.75 0.31 0.00 0.00 -1.26 -4.38 105.19 98.26 1xdi n GLY 316 Ca -0.05 -1.95 0.16 0.00 0.00 0.00 0.00 46.02 44.17 1xdi n GLY 316 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1xdi h ASP 317 N 0.00 0.00 0.13 1.61 3.32 -1.88 -1.97 116.42 117.64 1xdi h ASP 317 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1xdi h ASP 317 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1xdi h ASP 317 CO 0.00 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.52 1xdi n THR 319 N -1.11 0.37 -1.01 0.00 -2.24 -0.74 -1.76 114.28 107.79 1xdi n THR 319 Ca 0.12 -0.49 -0.00 0.00 -2.27 0.00 0.00 64.05 61.40 1xdi n THR 319 Cb 0.09 -0.12 -0.00 0.00 -2.10 0.00 0.00 70.33 68.20 1xdi n THR 319 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xdi n GLY 320 N 1.69 0.45 0.00 3.38 0.00 -1.02 -4.46 105.19 105.23 1xdi n GLY 320 Ca -0.11 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.31 1xdi n GLY 320 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1xdi n LEU 321 N -0.03 0.26 -3.73 0.99 0.00 -1.26 -4.91 117.00 108.32 1xdi n LEU 321 Ca -0.00 0.70 -0.12 0.00 0.00 0.00 0.00 56.01 56.58 1xdi n LEU 321 Cb 0.02 -0.32 -0.13 0.00 0.00 0.00 0.00 43.42 42.98 1xdi n LEU 321 CO 0.00 -0.32 -0.12 -0.76 0.00 0.00 0.00 177.39 176.19 1xdi s LEU 322 N -2.93 0.38 -1.44 -1.96 1.43 -1.26 -5.08 118.68 107.82 1xdi s LEU 322 Ca 0.00 0.53 -0.12 0.00 -1.03 0.00 0.00 54.13 53.51 1xdi s LEU 322 Cb 0.00 0.74 0.05 0.00 0.03 0.00 0.00 46.19 47.01 1xdi s LEU 322 CO 0.00 -0.17 2.26 -0.81 0.23 0.00 0.00 176.35 177.86 1xdi n PRO 323 N 4.27 3.18 -4.19 1.29 -0.04 -1.26 -4.63 135.00 133.62 1xdi n PRO 323 Ca -0.25 -2.77 -0.19 0.00 -0.04 0.00 0.00 63.50 60.26 1xdi n PRO 323 Cb 0.53 -3.13 -0.12 0.00 -0.04 0.00 0.00 33.50 30.74 1xdi n PRO 323 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1xdi s LEU 324 N 1.30 2.28 0.13 1.53 1.43 -1.26 -5.04 118.68 119.05 1xdi s LEU 324 Ca 0.49 -0.62 -0.10 0.00 -1.03 0.00 0.00 54.13 52.86 1xdi s LEU 324 Cb 0.14 -0.56 -0.07 0.00 0.03 0.00 0.00 46.19 45.73 1xdi s LEU 324 CO -0.07 -0.06 1.39 0.00 0.23 0.00 0.00 176.35 177.84 1xdi h ALA 325 N 4.28 0.46 -0.93 4.21 0.00 -1.99 -2.47 119.26 122.81 1xdi h ALA 325 Ca -0.41 -0.54 0.06 0.00 0.00 0.00 0.00 54.91 54.01 1xdi h ALA 325 Cb 1.19 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.86 1xdi h ALA 325 CO 0.40 0.69 0.60 0.66 0.00 0.00 0.00 179.25 181.60 1xdi h SER 326 N 0.58 0.95 0.09 0.00 4.64 -1.96 0.14 113.55 117.98 1xdi h SER 326 Ca -0.01 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.17 1xdi h SER 326 Cb 1.23 -0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 63.11 1xdi h SER 326 CO 0.13 0.62 -0.50 0.58 -0.87 0.00 0.00 176.83 176.79 1xdi h VAL 327 N 1.08 1.32 -0.75 0.95 2.07 -1.84 -2.81 116.25 116.27 1xdi h VAL 327 Ca 0.39 -1.73 -0.06 0.00 0.82 0.00 0.00 66.70 66.12 1xdi h VAL 327 Cb 0.16 1.73 -0.03 0.00 -1.52 0.00 0.00 31.29 31.63 1xdi h VAL 327 CO -0.14 0.53 0.23 0.00 0.02 0.00 0.00 177.57 178.21 1xdi h ALA 328 N 1.09 0.98 -0.44 1.67 0.00 -0.47 -1.57 119.26 120.53 1xdi h ALA 328 Ca 0.02 -0.23 -0.08 0.00 0.00 0.00 0.00 54.91 54.61 1xdi h ALA 328 Cb 1.01 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 1xdi h ALA 328 CO 0.09 0.67 -0.05 0.00 0.00 0.00 0.00 179.25 179.96 1xdi h ALA 329 N 1.12 0.59 0.00 0.00 0.00 -0.78 -1.83 119.26 118.37 1xdi h ALA 329 Ca 0.24 -0.30 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 1xdi h ALA 329 Cb 0.32 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1xdi h ALA 329 CO -0.01 0.43 -0.25 1.98 0.00 0.00 0.00 179.25 181.41 1xdi h MET 330 N 0.64 0.00 -0.12 0.00 -1.53 -1.33 0.22 114.93 112.81 1xdi h MET 330 Ca 0.12 0.00 -0.20 0.00 -3.44 0.00 0.00 59.70 56.18 1xdi h MET 330 Cb 0.56 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 31.62 1xdi h MET 330 CO 0.03 0.25 -0.72 1.96 0.14 0.00 0.00 176.91 178.57 1xdi h GLN 331 N 0.00 0.58 -0.17 0.39 4.20 -0.67 -0.03 115.11 119.41 1xdi h GLN 331 Ca -0.00 -0.46 -0.22 0.00 0.06 0.00 0.00 58.65 58.03 1xdi h GLN 331 Cb 0.67 0.09 0.01 0.00 0.30 0.00 0.00 27.48 28.55 1xdi h GLN 331 CO 0.03 1.08 -0.74 0.78 -0.67 0.00 0.00 178.83 179.31 1xdi h GLY 332 N 0.97 0.88 0.79 3.46 0.00 -0.88 -2.01 103.07 106.29 1xdi h GLY 332 Ca -0.03 -1.21 0.00 0.00 0.00 0.00 0.00 47.33 46.09 1xdi h GLY 332 CO 0.14 1.08 -0.17 -0.09 0.00 0.00 0.00 176.54 177.50 1xdi h ARG 333 N 0.56 -0.35 0.00 4.80 2.43 -0.90 -1.43 114.38 119.49 1xdi h ARG 333 Ca -0.04 0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.12 1xdi h ARG 333 Cb 1.37 0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 30.99 1xdi h ARG 333 CO 0.15 -0.23 -0.15 0.82 -1.51 0.00 0.00 179.97 179.05 1xdi h ILE 334 N -0.36 0.78 0.00 1.20 2.04 -1.01 -0.61 117.51 119.56 1xdi h ILE 334 Ca 0.00 -0.61 -0.07 0.00 1.00 0.00 0.00 64.86 65.19 1xdi h ILE 334 Cb 0.34 1.36 -0.01 0.00 -0.74 0.00 0.00 36.82 37.77 1xdi h ILE 334 CO -0.05 0.15 -0.33 0.00 0.00 0.00 0.00 178.15 177.93 1xdi h ALA 335 N 1.85 0.84 0.18 1.87 0.00 -0.80 -1.49 119.26 121.70 1xdi h ALA 335 Ca -0.00 -0.30 -0.31 0.00 0.00 0.00 0.00 54.91 54.30 1xdi h ALA 335 Cb 0.35 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.10 1xdi h ALA 335 CO 0.02 0.41 -1.47 0.52 0.00 0.00 0.00 179.25 178.73 1xdi h MET 336 N 0.00 0.38 -0.80 0.00 2.86 -0.21 -2.73 114.93 114.42 1xdi h MET 336 Ca -0.00 -0.64 -0.04 0.00 -2.06 0.00 0.00 59.70 56.95 1xdi h MET 336 Cb 1.10 0.24 -0.04 0.00 0.06 0.00 0.00 31.60 32.97 1xdi h MET 336 CO 0.04 1.29 0.35 1.88 1.06 0.00 0.00 176.91 181.53 1xdi h TYR 337 N 0.10 1.20 -0.22 -0.22 0.05 -1.00 -0.38 116.97 116.50 1xdi h TYR 337 Ca -0.23 -0.08 -0.13 0.00 0.05 0.00 0.00 58.73 58.34 1xdi h TYR 337 Cb 2.07 -0.36 -0.00 0.00 1.01 0.00 0.00 36.73 39.45 1xdi h TYR 337 CO 0.09 0.89 -0.38 1.25 -1.05 0.00 0.00 178.16 178.97 1xdi h HIS 338 N 1.16 0.81 0.00 4.88 2.76 -1.36 -2.12 115.15 121.28 1xdi h HIS 338 Ca 0.27 -0.28 -0.05 0.00 -2.20 0.00 0.00 60.37 58.11 1xdi h HIS 338 Cb 0.18 -0.15 -0.01 0.00 1.55 0.00 0.00 27.41 28.98 1xdi h HIS 338 CO 0.02 1.04 -0.26 0.00 -1.30 0.00 0.00 177.93 177.43 1xdi h ALA 339 N 0.63 1.09 -0.86 5.26 0.00 -1.25 -3.23 119.26 120.90 1xdi h ALA 339 Ca 0.02 -0.23 -0.50 0.00 0.00 0.00 0.00 54.91 54.20 1xdi h ALA 339 Cb 0.97 -0.04 -0.27 0.00 0.00 0.00 0.00 17.79 18.44 1xdi h ALA 339 CO 0.09 0.32 0.49 1.28 0.00 0.00 0.00 179.25 181.42 1xdi n LEU 340 N -3.53 6.39 -3.65 0.00 4.77 -0.17 -4.94 117.00 115.86 1xdi n LEU 340 Ca -0.01 -3.88 -0.28 0.00 -0.03 0.00 0.00 56.01 51.81 1xdi n LEU 340 Cb 0.41 -0.81 -0.00 0.00 -2.33 0.00 0.00 43.42 40.69 1xdi n LEU 340 CO 0.34 1.26 -0.00 0.61 -1.33 0.00 0.00 177.39 178.27 1xdi n GLY 341 N -1.06 -0.48 2.16 -0.72 0.00 -1.22 -4.98 105.19 98.89 1xdi n GLY 341 Ca 0.55 0.12 -0.12 0.00 0.00 0.00 0.00 46.02 46.57 1xdi n GLY 341 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1xdi n GLU 342 N -4.08 0.83 -2.16 1.61 1.02 -0.80 -5.06 120.64 112.00 1xdi n GLU 342 Ca 0.02 -1.77 -0.41 0.00 -0.02 0.00 0.00 57.16 54.97 1xdi n GLU 342 Cb 0.53 -0.06 -0.02 0.00 -0.02 0.00 0.00 31.44 31.86 1xdi n GLU 342 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1xdi s GLY 343 N -3.37 2.86 -0.05 0.62 0.00 -1.26 -4.79 107.32 101.33 1xdi s GLY 343 Ca 0.30 1.21 0.02 0.00 0.00 0.00 0.00 44.72 46.25 1xdi s GLY 343 CO 0.19 1.93 -0.11 0.14 0.00 0.00 0.00 173.10 175.25 1xdi s VAL 344 N -0.85 1.00 -0.29 1.40 1.01 -1.26 -4.83 120.40 116.57 1xdi s VAL 344 Ca 0.51 -0.43 0.02 0.00 0.00 0.00 0.00 61.98 62.07 1xdi s VAL 344 Cb -0.39 -0.91 0.09 0.00 0.00 0.00 0.00 36.38 35.17 1xdi s VAL 344 CO 0.49 0.32 0.02 -0.44 0.00 0.00 0.00 175.10 175.48 1xdi s SER 345 N 0.50 4.27 0.44 3.32 0.01 -1.26 -5.12 113.70 115.85 1xdi s SER 345 Ca -0.10 -1.67 -0.21 0.00 1.31 0.00 0.00 55.95 55.28 1xdi s SER 345 Cb -0.13 -1.29 -0.13 0.00 0.21 0.00 0.00 66.02 64.68 1xdi s SER 345 CO 0.02 -0.33 0.39 -2.65 0.41 0.00 0.00 173.24 171.08 1xdi n PRO 346 N 4.55 0.39 -2.25 12.44 -0.02 -1.26 -4.88 135.00 143.96 1xdi n PRO 346 Ca -0.04 0.14 -0.41 0.00 -2.02 0.00 0.00 63.50 61.18 1xdi n PRO 346 Cb 0.43 -1.37 -0.03 0.00 -0.02 0.00 0.00 33.50 32.50 1xdi n PRO 346 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1xdi s ILE 347 N -1.58 3.12 -0.24 4.25 1.09 -1.14 -5.01 121.20 121.69 1xdi s ILE 347 Ca 0.63 1.03 -0.06 0.00 -1.10 0.00 0.00 60.65 61.15 1xdi s ILE 347 Cb -0.59 -3.66 -0.02 0.00 -1.06 0.00 0.00 42.46 37.14 1xdi s ILE 347 CO 0.59 0.21 0.02 -0.13 -0.10 0.00 0.00 174.94 175.52 1xdi s ARG 348 N -0.97 3.48 0.44 2.79 0.52 -1.26 -4.99 118.95 118.96 1xdi s ARG 348 Ca 0.51 -0.58 0.17 0.00 -0.52 0.00 0.00 55.73 55.31 1xdi s ARG 348 Cb -0.36 -3.18 1.09 0.00 0.52 0.00 0.00 34.95 33.02 1xdi s ARG 348 CO 0.44 -0.21 1.94 -0.07 0.02 0.00 0.00 175.30 177.41 1xdi h LEU 349 N 8.18 0.34 -1.32 2.53 -0.00 -1.99 -1.86 115.31 121.19 1xdi h LEU 349 Ca -0.39 0.02 0.00 0.00 -0.00 0.00 0.00 57.88 57.50 1xdi h LEU 349 Cb 1.16 -0.05 0.00 0.00 -0.00 0.00 0.00 40.66 41.77 1xdi h LEU 349 CO 0.59 0.18 0.00 0.54 -0.00 0.00 0.00 178.44 179.75 1xdi n ARG 350 N -4.46 1.49 -0.00 1.13 5.12 -1.26 -2.58 116.66 116.10 1xdi n ARG 350 Ca 0.13 -0.40 0.03 0.00 -1.93 0.00 0.00 57.85 55.69 1xdi n ARG 350 Cb 0.52 -1.59 -0.05 0.00 -1.16 0.00 0.00 32.46 30.18 1xdi n ARG 350 CO 0.00 0.00 0.00 0.25 -1.93 0.00 0.00 177.63 175.95 1xdi n THR 351 N 0.08 0.00 -1.67 0.55 -2.24 -0.70 -2.56 114.28 107.74 1xdi n THR 351 Ca 0.04 -0.16 -0.45 0.00 -2.27 0.00 0.00 64.05 61.21 1xdi n THR 351 Cb 0.37 0.39 -0.03 0.00 -2.10 0.00 0.00 70.33 68.96 1xdi n THR 351 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1xdi n VAL 352 N -1.69 0.89 -4.27 2.28 0.31 -1.07 -4.80 118.33 109.99 1xdi n VAL 352 Ca -0.01 -0.22 -0.34 0.00 -0.01 0.00 0.00 64.34 63.76 1xdi n VAL 352 Cb 0.16 -1.50 -0.11 0.00 -0.91 0.00 0.00 33.84 31.49 1xdi n VAL 352 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1xdi s ALA 353 N 0.01 3.20 -0.01 3.52 0.00 -1.26 -4.34 121.76 122.88 1xdi s ALA 353 Ca 0.69 -0.79 0.00 0.00 0.00 0.00 0.00 51.96 51.86 1xdi s ALA 353 Cb -0.64 -1.65 0.01 0.00 0.00 0.00 0.00 23.12 20.83 1xdi s ALA 353 CO 0.49 0.30 -0.01 0.00 0.00 0.00 0.00 175.76 176.54 1xdi s ALA 354 N 0.06 0.14 0.11 0.00 0.00 -0.71 -4.98 121.76 116.38 1xdi s ALA 354 Ca 0.02 0.03 0.08 0.00 0.00 0.00 0.00 51.96 52.10 1xdi s ALA 354 Cb -0.13 -0.11 -0.04 0.00 0.00 0.00 0.00 23.12 22.85 1xdi s ALA 354 CO 0.02 -0.01 -0.20 0.95 0.00 0.00 0.00 175.76 176.52 1xdi s THR 355 N 0.30 1.73 -0.22 0.00 -4.23 -1.26 -1.74 115.64 110.23 1xdi s THR 355 Ca -0.03 -1.61 -0.09 0.00 -1.18 0.00 0.00 61.69 58.78 1xdi s THR 355 Cb -0.04 -1.61 -0.04 0.00 1.34 0.00 0.00 72.50 72.14 1xdi s THR 355 CO -0.01 -0.11 0.10 -0.69 -0.54 0.00 0.00 174.62 173.37 1xdi s VAL 356 N -1.33 4.94 -1.36 2.29 1.01 0.61 -4.97 120.40 121.59 1xdi s VAL 356 Ca 0.08 0.03 -0.08 0.00 0.00 0.00 0.00 61.98 62.01 1xdi s VAL 356 Cb -0.09 -3.27 0.10 0.00 0.00 0.00 0.00 36.38 33.12 1xdi s VAL 356 CO 0.05 0.40 2.25 0.49 0.00 0.00 0.00 175.10 178.28 1xdi n PHE 357 N 4.05 2.79 -2.78 5.22 3.72 -1.26 -2.76 117.46 126.44 1xdi n PHE 357 Ca -0.16 -2.86 -0.02 0.00 -0.05 0.00 0.00 57.45 54.36 1xdi n PHE 357 Cb 0.52 -2.04 0.01 0.00 -0.94 0.00 0.00 39.48 37.03 1xdi n PHE 357 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 1xdi n THR 358 N 2.92 0.00 -3.87 4.37 -2.24 -1.26 -4.83 114.28 109.37 1xdi n THR 358 Ca 0.55 -0.19 -0.30 0.00 -2.27 0.00 0.00 64.05 61.84 1xdi n THR 358 Cb 0.30 -1.07 -0.16 0.00 -2.10 0.00 0.00 70.33 67.31 1xdi n THR 358 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1xdi s ARG 359 N -2.39 1.25 0.91 -0.78 0.52 -1.26 -2.99 118.95 114.21 1xdi s ARG 359 Ca 0.07 -0.89 -0.13 0.00 -0.52 0.00 0.00 55.73 54.25 1xdi s ARG 359 Cb -0.00 -2.42 0.14 0.00 0.52 0.00 0.00 34.95 33.18 1xdi s ARG 359 CO 0.04 -0.67 1.16 -1.25 0.02 0.00 0.00 175.30 174.60 1xdi s PRO 360 N 1.52 1.10 0.55 3.54 0.04 -1.26 -5.03 135.00 135.46 1xdi s PRO 360 Ca -0.02 0.19 -0.15 0.00 0.04 0.00 0.00 61.00 61.06 1xdi s PRO 360 Cb -0.18 -1.84 -0.06 0.00 0.04 0.00 0.00 34.50 32.45 1xdi s PRO 360 CO -0.09 -2.20 1.01 -1.21 0.04 0.00 0.00 177.00 174.55 1xdi s GLU 361 N -5.38 3.73 -0.07 4.56 2.02 -0.70 -4.89 118.70 117.98 1xdi s GLU 361 Ca 0.65 0.98 -0.00 0.00 0.02 0.00 0.00 54.97 56.61 1xdi s GLU 361 Cb -0.13 -2.10 0.03 0.00 0.10 0.00 0.00 34.13 32.02 1xdi s GLU 361 CO 0.53 -0.46 -0.02 0.42 0.02 0.00 0.00 175.26 175.75 1xdi s ILE 362 N -2.68 0.47 0.05 -1.63 1.01 -1.11 -1.89 121.20 115.42 1xdi s ILE 362 Ca 0.59 0.01 0.05 0.00 0.00 0.00 0.00 60.65 61.31 1xdi s ILE 362 Cb -0.11 -0.57 -0.02 0.00 0.01 0.00 0.00 42.46 41.76 1xdi s ILE 362 CO 0.37 0.25 -0.15 0.00 0.00 0.00 0.00 174.94 175.41 1xdi s ALA 363 N 1.60 1.27 0.14 9.38 0.00 0.60 -0.28 121.76 134.46 1xdi s ALA 363 Ca -0.00 -0.91 -0.06 0.00 0.00 0.00 0.00 51.96 50.99 1xdi s ALA 363 Cb -0.13 -0.18 -0.02 0.00 0.00 0.00 0.00 23.12 22.79 1xdi s ALA 363 CO -0.04 0.24 0.19 0.00 0.00 0.00 0.00 175.76 176.15 1xdi s ALA 364 N -0.95 0.23 -0.20 0.00 0.00 -0.71 0.28 121.76 120.42 1xdi s ALA 364 Ca 0.02 -1.03 -0.26 0.00 0.00 0.00 0.00 51.96 50.69 1xdi s ALA 364 Cb -0.08 0.78 0.07 0.00 0.00 0.00 0.00 23.12 23.88 1xdi s ALA 364 CO 0.02 -0.57 0.68 0.08 0.00 0.00 0.00 175.76 175.97 1xdi s VAL 365 N -3.97 0.00 0.00 0.00 1.01 -0.31 -1.75 120.40 115.38 1xdi s VAL 365 Ca 0.17 -0.01 0.00 0.00 0.00 0.00 0.00 61.98 62.14 1xdi s VAL 365 Cb 0.05 -0.97 0.00 0.00 0.00 0.00 0.00 36.38 35.46 1xdi s VAL 365 CO -0.02 -0.00 0.00 0.61 0.00 0.00 0.00 175.10 175.69 1xdi n GLY 366 N 2.20 -1.21 3.64 4.51 0.00 -1.06 -0.84 105.19 112.44 1xdi n GLY 366 Ca -0.15 -1.24 -0.48 0.00 0.00 0.00 0.00 46.02 44.15 1xdi n GLY 366 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1xdi n VAL 367 N -0.09 0.25 -1.82 1.61 0.31 -0.74 -4.87 118.33 112.97 1xdi n VAL 367 Ca 0.00 -0.06 -0.32 0.00 -0.01 0.00 0.00 64.34 63.95 1xdi n VAL 367 Cb 0.00 -1.28 0.03 0.00 -0.91 0.00 0.00 33.84 31.68 1xdi n VAL 367 CO 0.00 0.00 0.00 -2.84 -1.32 0.00 0.00 176.83 172.67 1xdi s PRO 368 N 0.45 3.07 0.44 5.55 0.02 -1.26 -4.70 135.00 138.56 1xdi s PRO 368 Ca 0.78 1.16 0.12 0.00 0.02 0.00 0.00 61.00 63.08 1xdi s PRO 368 Cb -0.76 -2.00 0.96 0.00 0.02 0.00 0.00 34.50 32.72 1xdi s PRO 368 CO 0.43 -1.01 2.00 0.37 -0.33 0.00 0.00 177.00 178.47 1xdi h GLN 369 N -0.04 0.14 -0.49 5.54 4.15 -1.92 -2.80 115.11 119.70 1xdi h GLN 369 Ca -0.46 -0.02 0.04 0.00 0.77 0.00 0.00 58.65 58.98 1xdi h GLN 369 Cb 1.22 -0.02 -0.06 0.00 0.21 0.00 0.00 27.48 28.83 1xdi h GLN 369 CO 0.56 0.23 -0.29 0.43 -1.93 0.00 0.00 178.83 177.84 1xdi n SER 370 N -4.36 -0.52 -0.04 -0.69 7.64 -1.26 -1.48 113.62 112.91 1xdi n SER 370 Ca -0.01 1.35 -0.08 0.00 1.01 0.00 0.00 58.87 61.14 1xdi n SER 370 Cb 0.20 -0.35 -0.02 0.00 -1.01 0.00 0.00 64.21 63.03 1xdi n SER 370 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 1xdi h VAL 371 N 0.00 0.67 -0.60 0.44 2.07 -1.88 -2.46 116.25 114.50 1xdi h VAL 371 Ca 0.08 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.70 1xdi h VAL 371 Cb 0.20 0.67 -0.08 0.00 -1.52 0.00 0.00 31.29 30.56 1xdi h VAL 371 CO -0.46 0.00 0.17 0.40 0.02 0.00 0.00 177.57 177.71 1xdi h ILE 372 N -0.08 0.70 0.00 4.57 2.04 -1.27 0.13 117.51 123.60 1xdi h ILE 372 Ca 0.12 -0.11 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1xdi h ILE 372 Cb 0.25 0.35 0.00 0.00 -0.74 0.00 0.00 36.82 36.68 1xdi h ILE 372 CO -0.27 0.06 0.00 0.44 0.00 0.00 0.00 178.15 178.38 1xdi h ASP 373 N 0.33 0.00 0.61 1.72 3.32 -0.81 -1.08 116.42 120.50 1xdi h ASP 373 Ca 0.31 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.36 1xdi h ASP 373 Cb 0.43 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.98 1xdi h ASP 373 CO -0.35 0.00 -0.55 0.00 -1.72 0.00 0.00 179.24 176.62 1xdi n ALA 374 N -1.82 3.33 0.00 3.45 0.00 0.43 -4.94 120.51 120.96 1xdi n ALA 374 Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.13 1xdi n ALA 374 Cb 0.16 -1.14 0.00 0.00 0.00 0.00 0.00 19.45 18.48 1xdi n ALA 374 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xdi n GLY 375 N 1.45 1.04 0.32 0.00 0.00 -0.41 -4.94 105.19 102.65 1xdi n GLY 375 Ca 0.05 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.04 1xdi n GLY 375 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1xdi h SER 376 N 0.00 0.88 -3.52 1.61 0.02 -1.75 -3.41 113.55 107.37 1xdi h SER 376 Ca 0.00 -0.13 -0.67 0.00 -0.84 0.00 0.00 61.79 60.15 1xdi h SER 376 Cb 0.00 -0.23 -0.27 0.00 0.14 0.00 0.00 62.40 62.04 1xdi h SER 376 CO 0.00 0.80 -0.79 -0.69 -1.14 0.00 0.00 176.83 175.01 1xdi s VAL 377 N -5.40 2.85 -0.85 2.27 1.01 -1.25 -5.03 120.40 114.00 1xdi s VAL 377 Ca -0.11 -0.75 -0.22 0.00 0.00 0.00 0.00 61.98 60.91 1xdi s VAL 377 Cb 0.16 -2.16 0.08 0.00 0.00 0.00 0.00 36.38 34.46 1xdi s VAL 377 CO 0.81 0.55 1.17 0.00 0.00 0.00 0.00 175.10 177.63 1xdi s ALA 378 N 0.09 3.07 0.10 5.51 0.00 -1.26 -4.54 121.76 124.72 1xdi s ALA 378 Ca -0.07 -2.22 -0.01 0.00 0.00 0.00 0.00 51.96 49.65 1xdi s ALA 378 Cb -0.15 -4.13 -0.04 0.00 0.00 0.00 0.00 23.12 18.80 1xdi s ALA 378 CO 0.05 -3.11 0.03 0.00 0.00 0.00 0.00 175.76 172.73 1xdi s ALA 379 N 3.97 0.66 -0.04 0.00 0.00 -1.26 -2.24 121.76 122.84 1xdi s ALA 379 Ca 0.33 -1.32 -0.02 0.00 0.00 0.00 0.00 51.96 50.95 1xdi s ALA 379 Cb -0.07 0.61 -0.04 0.00 0.00 0.00 0.00 23.12 23.62 1xdi s ALA 379 CO -0.01 -0.45 0.10 0.50 0.00 0.00 0.00 175.76 175.90 1xdi s ARG 380 N -3.99 3.19 0.07 0.00 3.52 0.13 -4.84 118.95 117.04 1xdi s ARG 380 Ca 0.16 -0.38 0.02 0.00 -0.13 0.00 0.00 55.73 55.40 1xdi s ARG 380 Cb 0.07 -2.95 -0.03 0.00 -1.56 0.00 0.00 34.95 30.48 1xdi s ARG 380 CO -0.04 0.68 -0.07 0.95 -0.81 0.00 0.00 175.30 176.02 1xdi s THR 381 N -1.15 0.61 -0.05 4.11 -4.23 -1.26 -0.42 115.64 113.26 1xdi s THR 381 Ca 0.21 -1.53 -0.12 0.00 -1.18 0.00 0.00 61.69 59.06 1xdi s THR 381 Cb -0.12 -1.18 0.02 0.00 1.34 0.00 0.00 72.50 72.57 1xdi s THR 381 CO 0.12 -0.65 0.29 -0.51 -0.54 0.00 0.00 174.62 173.33 1xdi s ILE 382 N -2.58 0.04 -0.20 2.99 2.07 -1.05 -5.02 121.20 117.45 1xdi s ILE 382 Ca 0.02 -0.34 0.00 0.00 -1.41 0.00 0.00 60.65 58.92 1xdi s ILE 382 Cb -0.02 -0.53 0.05 0.00 0.13 0.00 0.00 42.46 42.09 1xdi s ILE 382 CO -0.02 -0.19 -0.07 -0.32 -1.91 0.00 0.00 174.94 172.43 1xdi s MET 383 N -0.84 1.71 -0.34 3.50 -2.45 -1.26 -2.67 119.30 116.95 1xdi s MET 383 Ca -0.09 -0.80 -0.08 0.00 -1.25 0.00 0.00 55.69 53.47 1xdi s MET 383 Cb -0.05 -2.36 0.03 0.00 1.25 0.00 0.00 34.83 33.70 1xdi s MET 383 CO 0.03 -0.49 0.14 -1.17 1.05 0.00 0.00 175.02 174.58 1xdi s LEU 384 N 1.47 4.36 0.78 4.11 2.96 0.10 -4.95 118.68 127.51 1xdi s LEU 384 Ca -0.02 -0.96 -0.15 0.00 -0.22 0.00 0.00 54.13 52.78 1xdi s LEU 384 Cb -0.17 -1.94 0.01 0.00 0.50 0.00 0.00 46.19 44.60 1xdi s LEU 384 CO -0.07 -0.31 0.75 -2.65 -1.32 0.00 0.00 176.35 172.74 1xdi n PRO 385 N 4.90 0.22 0.01 0.98 -0.02 -1.26 -0.66 135.00 139.17 1xdi n PRO 385 Ca -0.13 0.13 0.11 0.00 -2.02 0.00 0.00 63.50 61.59 1xdi n PRO 385 Cb 0.46 -2.05 0.00 0.00 -0.02 0.00 0.00 33.50 31.89 1xdi n PRO 385 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1xdi n LEU 386 N -1.42 0.72 0.27 2.45 4.77 0.17 -4.46 117.00 119.50 1xdi n LEU 386 Ca 0.11 -0.22 0.18 0.00 -0.03 0.00 0.00 56.01 56.05 1xdi n LEU 386 Cb 0.50 -0.09 0.83 0.00 -2.33 0.00 0.00 43.42 42.34 1xdi n LEU 386 CO 0.50 0.15 1.03 0.08 -1.33 0.00 0.00 177.39 177.81 1xdi h ARG 387 N 0.00 0.00 0.00 3.23 0.11 -1.80 0.94 114.38 116.86 1xdi h ARG 387 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1xdi h ARG 387 Cb 0.59 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.67 1xdi h ARG 387 CO 0.00 0.00 -0.11 0.25 0.10 0.00 0.00 179.97 180.21 1xdi n THR 388 N -2.91 0.06 -2.48 0.08 -2.24 -1.26 -4.55 114.28 100.98 1xdi n THR 388 Ca -0.01 -0.03 -0.42 0.00 -2.27 0.00 0.00 64.05 61.32 1xdi n THR 388 Cb 0.20 -0.35 -0.03 0.00 -2.10 0.00 0.00 70.33 68.05 1xdi n THR 388 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1xdi s ASN 389 N -3.17 7.08 0.22 3.42 3.84 0.32 -4.96 114.94 121.70 1xdi s ASN 389 Ca 0.13 1.80 -0.07 0.00 0.21 0.00 0.00 52.86 54.93 1xdi s ASN 389 Cb 0.18 -2.56 0.31 0.00 -0.55 0.00 0.00 41.25 38.63 1xdi s ASN 389 CO 0.57 -0.55 1.81 0.00 -2.79 0.00 0.00 177.10 176.14 1xdi h ALA 390 N 7.35 1.01 0.01 1.71 0.00 -1.86 -1.97 119.26 125.50 1xdi h ALA 390 Ca -0.35 0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.61 1xdi h ALA 390 Cb 1.17 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.80 1xdi h ALA 390 CO 0.87 0.06 -0.18 -0.09 0.00 0.00 0.00 179.25 179.91 1xdi h ARG 391 N 0.72 -0.29 -0.73 0.00 9.65 -1.87 -0.78 114.38 121.09 1xdi h ARG 391 Ca 0.34 0.02 0.13 0.00 -1.10 0.00 0.00 59.98 59.37 1xdi h ARG 391 Cb 0.26 0.07 -0.09 0.00 -1.39 0.00 0.00 29.97 28.82 1xdi h ARG 391 CO -0.21 -0.19 0.31 0.00 2.80 0.00 0.00 179.97 182.67 1xdi h ALA 392 N 0.61 1.02 -0.91 2.80 0.00 -1.68 0.50 119.26 121.61 1xdi h ALA 392 Ca 0.05 0.10 0.09 0.00 0.00 0.00 0.00 54.91 55.16 1xdi h ALA 392 Cb 0.37 0.06 -0.07 0.00 0.00 0.00 0.00 17.79 18.15 1xdi h ALA 392 CO -0.17 -0.17 0.59 -0.22 0.00 0.00 0.00 179.25 179.28 1xdi h LYS 393 N 0.48 0.91 -0.29 0.00 3.64 -0.52 -0.43 116.57 120.35 1xdi h LYS 393 Ca 0.39 -0.05 -0.05 0.00 -1.27 0.00 0.00 60.65 59.67 1xdi h LYS 393 Cb 0.55 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 32.16 1xdi h LYS 393 CO -0.37 0.60 0.00 0.52 -2.27 0.00 0.00 179.45 177.94 1xdi h MET 394 N 0.93 0.51 -0.88 1.90 2.86 0.41 -2.75 114.93 117.92 1xdi h MET 394 Ca 0.42 -0.16 -0.00 0.00 -2.06 0.00 0.00 59.70 57.90 1xdi h MET 394 Cb 0.37 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 31.98 1xdi h MET 394 CO -0.18 0.65 0.01 0.43 1.06 0.00 0.00 176.91 178.88 1xdi n SER 395 N -4.59 2.45 -4.19 1.22 7.64 -0.45 -4.91 113.62 110.79 1xdi n SER 395 Ca -0.03 -2.29 -0.38 0.00 1.01 0.00 0.00 58.87 57.19 1xdi n SER 395 Cb 0.25 -0.56 -0.04 0.00 -1.01 0.00 0.00 64.21 62.85 1xdi n SER 395 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1xdi n GLU 396 N 0.18 -0.75 -3.75 1.43 1.02 -0.30 -4.93 120.64 113.55 1xdi n GLU 396 Ca 0.09 0.10 -0.36 0.00 -0.02 0.00 0.00 57.16 56.97 1xdi n GLU 396 Cb 0.55 -3.16 -0.09 0.00 -0.02 0.00 0.00 31.44 28.71 1xdi n GLU 396 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 1xdi s MET 397 N -7.36 4.07 0.00 3.49 -1.94 -0.80 -4.98 119.30 111.79 1xdi s MET 397 Ca 0.23 -0.28 0.00 0.00 -1.71 0.00 0.00 55.69 53.93 1xdi s MET 397 Cb -0.12 -3.44 0.00 0.00 2.01 0.00 0.00 34.83 33.28 1xdi s MET 397 CO 0.98 0.16 0.11 0.54 -0.01 0.00 0.00 175.02 176.80 1xdi n ARG 398 N 3.94 5.10 0.00 2.03 1.74 -1.26 -4.54 116.66 123.67 1xdi n ARG 398 Ca -0.16 -0.11 0.00 0.00 -0.77 0.00 0.00 57.85 56.82 1xdi n ARG 398 Cb 0.52 -0.59 0.00 0.00 -1.02 0.00 0.00 32.46 31.37 1xdi n ARG 398 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1xdi n HIS 399 N -0.76 0.00 -1.53 -1.55 8.25 -1.26 -4.80 115.22 113.57 1xdi n HIS 399 Ca 0.00 -0.20 -0.30 0.00 -0.26 0.00 0.00 57.72 56.96 1xdi n HIS 399 Cb 0.00 -0.02 0.10 0.00 1.12 0.00 0.00 29.99 31.19 1xdi n HIS 399 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1xdi s GLY 400 N -0.41 1.62 0.05 -1.41 0.00 -1.26 -4.92 107.32 100.99 1xdi s GLY 400 Ca 0.00 -0.25 -0.28 0.00 0.00 0.00 0.00 44.72 44.19 1xdi s GLY 400 CO 0.00 0.20 0.96 -0.11 0.00 0.00 0.00 173.10 174.15 1xdi s PHE 401 N -3.17 -0.22 -0.09 1.90 -0.12 -0.53 -0.65 117.98 115.10 1xdi s PHE 401 Ca 0.61 0.02 0.02 0.00 -0.05 0.00 0.00 56.93 57.54 1xdi s PHE 401 Cb -0.15 0.58 0.01 0.00 -0.63 0.00 0.00 43.02 42.84 1xdi s PHE 401 CO 0.54 -0.63 -0.16 0.08 -0.05 0.00 0.00 175.22 175.01 1xdi s VAL 402 N -3.11 1.49 -0.17 -2.49 1.01 0.17 -2.05 120.40 115.26 1xdi s VAL 402 Ca 0.09 -0.66 -0.01 0.00 0.00 0.00 0.00 61.98 61.39 1xdi s VAL 402 Cb -0.01 -1.34 -0.01 0.00 0.00 0.00 0.00 36.38 35.03 1xdi s VAL 402 CO -0.04 0.44 -0.11 -0.54 0.00 0.00 0.00 175.10 174.85 1xdi s LYS 403 N 0.75 3.33 -0.04 2.72 1.02 0.45 0.00 119.74 127.97 1xdi s LYS 403 Ca -0.12 -0.68 0.05 0.00 0.02 0.00 0.00 55.97 55.24 1xdi s LYS 403 Cb -0.16 -2.76 -0.01 0.00 -0.52 0.00 0.00 37.83 34.39 1xdi s LYS 403 CO 0.02 0.02 -0.20 0.42 -0.92 0.00 0.00 175.35 174.69 1xdi s ILE 404 N 0.87 1.65 -0.04 2.17 1.01 -1.09 -0.13 121.20 125.63 1xdi s ILE 404 Ca -0.03 -0.86 0.06 0.00 0.00 0.00 0.00 60.65 59.82 1xdi s ILE 404 Cb -0.15 -1.39 -0.02 0.00 0.01 0.00 0.00 42.46 40.91 1xdi s ILE 404 CO 0.00 0.47 -0.21 -0.36 0.00 0.00 0.00 174.94 174.84 1xdi s PHE 405 N -0.18 2.49 0.02 3.97 0.08 -0.32 -2.53 117.98 121.51 1xdi s PHE 405 Ca 0.00 -0.36 -0.07 0.00 0.12 0.00 0.00 56.93 56.63 1xdi s PHE 405 Cb -0.11 -1.57 -0.00 0.00 -0.57 0.00 0.00 43.02 40.77 1xdi s PHE 405 CO 0.02 0.03 0.13 0.00 -0.10 0.00 0.00 175.22 175.30 1xdi n ARG 407 N 1.13 1.46 0.21 0.00 3.00 -0.22 0.22 116.66 122.46 1xdi n ARG 407 Ca -0.21 0.51 -0.15 0.00 -0.00 0.00 0.00 57.85 58.00 1xdi n ARG 407 Cb 0.57 -1.95 -0.07 0.00 0.00 0.00 0.00 32.46 31.01 1xdi n ARG 407 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1xdi h ARG 408 N 2.43 -0.69 0.00 -0.14 2.47 -1.77 -2.30 114.38 114.38 1xdi h ARG 408 Ca -0.41 0.05 0.00 0.00 -1.26 0.00 0.00 59.98 58.36 1xdi h ARG 408 Cb 1.33 0.16 0.00 0.00 -1.65 0.00 0.00 29.97 29.81 1xdi h ARG 408 CO 0.63 -0.46 -0.06 0.66 0.56 0.00 0.00 179.97 181.30 1xdi h SER 409 N -0.71 0.00 0.47 7.04 4.64 -1.91 -3.40 113.55 119.68 1xdi h SER 409 Ca -0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 1xdi h SER 409 Cb 0.66 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.75 1xdi h SER 409 CO -0.09 0.23 0.00 0.71 -0.87 0.00 0.00 176.83 176.81 1xdi h THR 410 N -0.39 0.00 -0.01 2.95 1.35 -1.97 -3.47 112.91 111.38 1xdi h THR 410 Ca 0.00 -0.22 -0.00 0.00 -0.55 0.00 0.00 66.41 65.64 1xdi h THR 410 Cb 0.06 1.12 -0.00 0.00 -1.73 0.00 0.00 68.15 67.60 1xdi h THR 410 CO 0.00 0.00 -0.00 0.61 -0.25 0.00 0.00 175.52 175.88 1xdi n GLY 411 N -0.56 0.30 3.71 5.82 0.00 -0.86 -4.86 105.19 108.74 1xdi n GLY 411 Ca -0.01 -0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 1xdi n GLY 411 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xdi s VAL 412 N -1.58 3.23 0.16 1.61 1.01 -1.26 -0.86 120.40 122.70 1xdi s VAL 412 Ca 0.00 0.86 -0.32 0.00 0.00 0.00 0.00 61.98 62.53 1xdi s VAL 412 Cb 0.00 -3.55 -0.11 0.00 0.00 0.00 0.00 36.38 32.72 1xdi s VAL 412 CO 0.00 0.06 1.68 -0.69 0.00 0.00 0.00 175.10 176.15 1xdi s VAL 413 N 1.25 2.44 0.00 2.92 1.01 0.11 -1.05 120.40 127.08 1xdi s VAL 413 Ca 0.66 0.22 0.00 0.00 0.00 0.00 0.00 61.98 62.86 1xdi s VAL 413 Cb -0.38 -3.14 0.00 0.00 0.00 0.00 0.00 36.38 32.86 1xdi s VAL 413 CO 0.30 0.01 0.15 2.30 0.00 0.00 0.00 175.10 177.86 1xdi n ILE 414 N 4.21 0.00 -3.68 2.22 -5.35 -0.14 -4.15 119.36 112.47 1xdi n ILE 414 Ca 0.16 -0.37 -0.01 0.00 -0.27 0.00 0.00 62.75 62.25 1xdi n ILE 414 Cb 0.37 1.10 -0.01 0.00 -1.74 0.00 0.00 39.64 39.37 1xdi n ILE 414 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1xdi s GLY 415 N -0.45 -0.32 -0.17 3.28 0.00 -1.17 -1.80 107.32 106.70 1xdi s GLY 415 Ca 0.00 0.45 -0.30 0.00 0.00 0.00 0.00 44.72 44.86 1xdi s GLY 415 CO 0.00 0.08 1.08 -0.32 0.00 0.00 0.00 173.10 173.94 1xdi s GLY 416 N -2.93 -0.22 0.00 0.20 0.00 -0.02 -1.17 107.32 103.18 1xdi s GLY 416 Ca 0.13 2.02 0.00 0.00 0.00 0.00 0.00 44.72 46.87 1xdi s GLY 416 CO -0.01 0.91 -0.01 0.14 0.00 0.00 0.00 173.10 174.13 1xdi s VAL 417 N -1.47 0.05 -0.05 1.40 1.01 0.81 -1.16 120.40 120.99 1xdi s VAL 417 Ca 0.02 -0.09 -0.01 0.00 0.00 0.00 0.00 61.98 61.90 1xdi s VAL 417 Cb -0.01 -0.06 0.03 0.00 0.00 0.00 0.00 36.38 36.34 1xdi s VAL 417 CO -0.02 -0.02 0.03 -0.69 0.00 0.00 0.00 175.10 174.39 1xdi s VAL 418 N -0.12 0.09 -0.33 2.92 1.01 0.14 -0.41 120.40 123.71 1xdi s VAL 418 Ca -0.01 0.26 0.00 0.00 0.00 0.00 0.00 61.98 62.23 1xdi s VAL 418 Cb -0.01 -0.28 0.08 0.00 0.00 0.00 0.00 36.38 36.17 1xdi s VAL 418 CO -0.00 0.19 0.04 -0.69 0.00 0.00 0.00 175.10 174.63 1xdi s VAL 419 N 1.81 2.72 0.26 2.92 1.01 -0.87 -0.29 120.40 127.95 1xdi s VAL 419 Ca 0.01 -1.83 -0.21 0.00 0.00 0.00 0.00 61.98 59.96 1xdi s VAL 419 Cb -0.12 -2.74 0.05 0.00 0.00 0.00 0.00 36.38 33.56 1xdi s VAL 419 CO -0.03 -0.35 0.87 0.00 0.00 0.00 0.00 175.10 175.59 1xdi s ALA 420 N 1.11 -1.27 0.41 5.51 0.00 -0.79 -1.45 121.76 125.28 1xdi s ALA 420 Ca 0.01 -0.34 0.10 0.00 0.00 0.00 0.00 51.96 51.74 1xdi s ALA 420 Cb -0.20 0.73 0.92 0.00 0.00 0.00 0.00 23.12 24.57 1xdi s ALA 420 CO -0.04 -1.03 1.99 -1.35 0.00 0.00 0.00 175.76 175.33 1xdi h PRO 421 N 2.00 0.51 -1.27 0.00 0.11 -1.94 -1.78 132.00 129.63 1xdi h PRO 421 Ca -0.26 -0.03 -0.59 0.00 0.11 0.00 0.00 66.00 65.23 1xdi h PRO 421 Cb 1.24 -0.11 -0.41 0.00 0.11 0.00 0.00 31.00 31.82 1xdi h PRO 421 CO 0.32 0.34 -0.64 0.44 -0.21 0.00 0.00 178.00 178.24 1xdi n ILE 422 N -4.48 2.51 -0.05 4.15 -5.35 -1.26 -4.47 119.36 110.41 1xdi n ILE 422 Ca 0.08 -4.62 0.01 0.00 -0.27 0.00 0.00 62.75 57.95 1xdi n ILE 422 Cb 0.26 -1.22 0.31 0.00 -1.74 0.00 0.00 39.64 37.25 1xdi n ILE 422 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1xdi h ALA 423 N 2.45 1.47 -0.15 -1.28 0.00 -1.78 -1.77 119.26 118.19 1xdi h ALA 423 Ca 0.34 -0.12 0.04 0.00 0.00 0.00 0.00 54.91 55.17 1xdi h ALA 423 Cb 1.09 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 1xdi h ALA 423 CO 0.86 0.41 0.24 0.66 0.00 0.00 0.00 179.25 181.43 1xdi h SER 424 N 0.64 0.00 0.00 0.00 4.64 -1.87 -0.01 113.55 116.95 1xdi h SER 424 Ca 0.16 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.19 1xdi h SER 424 Cb 0.13 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.18 1xdi h SER 424 CO -0.02 0.00 -1.63 -0.62 -0.87 0.00 0.00 176.83 173.69 1xdi n GLU 425 N -3.47 0.56 0.27 4.77 -0.58 -0.70 -4.40 120.64 117.08 1xdi n GLU 425 Ca 0.01 0.46 0.18 0.00 -0.42 0.00 0.00 57.16 57.39 1xdi n GLU 425 Cb 0.35 -1.65 0.91 0.00 -0.57 0.00 0.00 31.44 30.48 1xdi n GLU 425 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 1xdi h LEU 426 N -1.00 0.00 -1.10 -4.62 3.38 -1.04 -2.48 115.31 108.45 1xdi h LEU 426 Ca -0.43 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.44 1xdi h LEU 426 Cb 1.35 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.08 1xdi h LEU 426 CO -0.26 0.00 -0.41 -0.29 0.09 0.00 0.00 178.44 177.57 1xdi h ILE 427 N 0.00 1.30 -0.48 1.22 6.09 -1.22 -3.32 117.51 121.10 1xdi h ILE 427 Ca 0.00 -1.46 0.06 0.00 -1.37 0.00 0.00 64.86 62.10 1xdi h ILE 427 Cb 0.11 1.74 -0.09 0.00 0.47 0.00 0.00 36.82 39.05 1xdi h ILE 427 CO 0.00 0.42 -0.52 0.25 -3.07 0.00 0.00 178.15 175.23 1xdi h LEU 428 N 0.06 -1.75 -0.69 2.19 5.85 -1.69 -0.24 115.31 119.04 1xdi h LEU 428 Ca 0.00 0.25 0.15 0.00 0.84 0.00 0.00 57.88 59.12 1xdi h LEU 428 Cb 0.76 0.74 -0.12 0.00 0.37 0.00 0.00 40.66 42.41 1xdi h LEU 428 CO 0.06 -0.37 0.00 -0.65 -0.34 0.00 0.00 178.44 177.13 1xdi h PRO 429 N -0.33 0.11 0.00 5.25 0.11 -1.79 0.60 132.00 135.95 1xdi h PRO 429 Ca 0.11 -0.01 0.02 0.00 0.11 0.00 0.00 66.00 66.23 1xdi h PRO 429 Cb 0.58 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 31.64 1xdi h PRO 429 CO -0.64 0.07 -0.10 0.82 -0.21 0.00 0.00 178.00 177.95 1xdi h ILE 430 N 0.11 0.76 -0.41 4.15 2.04 -1.26 -0.87 117.51 122.04 1xdi h ILE 430 Ca 0.37 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.31 1xdi h ILE 430 Cb 0.62 0.76 -0.08 0.00 -0.74 0.00 0.00 36.82 37.38 1xdi h ILE 430 CO -0.60 0.00 -0.16 0.00 0.00 0.00 0.00 178.15 177.39 1xdi h ALA 431 N 0.81 0.17 -0.47 1.87 0.00 -0.24 0.61 119.26 122.00 1xdi h ALA 431 Ca 0.04 0.15 0.09 0.00 0.00 0.00 0.00 54.91 55.19 1xdi h ALA 431 Cb 0.21 0.42 -0.10 0.00 0.00 0.00 0.00 17.79 18.32 1xdi h ALA 431 CO -0.10 -0.52 -0.22 0.28 0.00 0.00 0.00 179.25 178.69 1xdi h VAL 432 N -0.08 0.35 -0.38 0.00 2.07 -0.35 0.51 116.25 118.36 1xdi h VAL 432 Ca 0.20 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.77 1xdi h VAL 432 Cb 0.39 0.35 -0.05 0.00 -1.52 0.00 0.00 31.29 30.46 1xdi h VAL 432 CO -0.46 0.00 0.09 0.00 0.02 0.00 0.00 177.57 177.22 1xdi h ALA 433 N 1.17 0.42 0.76 1.67 0.00 0.71 0.15 119.26 124.15 1xdi h ALA 433 Ca 0.22 0.07 -0.04 0.00 0.00 0.00 0.00 54.91 55.16 1xdi h ALA 433 Cb 0.47 0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.34 1xdi h ALA 433 CO -0.55 -0.31 -0.37 0.28 0.00 0.00 0.00 179.25 178.31 1xdi h VAL 434 N 0.23 0.11 -0.01 0.00 2.07 0.25 0.32 116.25 119.22 1xdi h VAL 434 Ca 0.18 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.51 1xdi h VAL 434 Cb 0.19 0.14 -0.00 0.00 -1.52 0.00 0.00 31.29 30.10 1xdi h VAL 434 CO -0.22 0.01 0.25 -0.61 0.02 0.00 0.00 177.57 177.02 1xdi h GLN 435 N -1.20 0.00 0.00 1.57 5.75 -0.02 -2.71 115.11 118.50 1xdi h GLN 435 Ca -0.10 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.40 1xdi h GLN 435 Cb 0.80 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.35 1xdi h GLN 435 CO 0.17 0.00 -0.03 0.09 -2.65 0.00 0.00 178.83 176.42 1xdi n ASN 436 N -2.96 2.05 -3.92 -0.69 3.02 0.53 -4.99 115.26 108.31 1xdi n ASN 436 Ca -0.02 -2.62 -0.28 0.00 -0.03 0.00 0.00 54.58 51.63 1xdi n ASN 436 Cb 0.31 -0.27 -0.01 0.00 -0.61 0.00 0.00 39.78 39.20 1xdi n ASN 436 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1xdi n ARG 437 N -1.02 -2.65 -2.76 3.52 1.74 -0.01 -4.93 116.66 110.55 1xdi n ARG 437 Ca 0.09 0.39 -0.32 0.00 -0.77 0.00 0.00 57.85 57.25 1xdi n ARG 437 Cb 0.51 -4.31 -0.04 0.00 -1.02 0.00 0.00 32.46 27.60 1xdi n ARG 437 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1xdi s ILE 438 N -3.86 4.64 0.01 0.55 1.01 -0.52 -4.83 121.20 118.20 1xdi s ILE 438 Ca 0.12 0.98 -0.02 0.00 0.00 0.00 0.00 60.65 61.73 1xdi s ILE 438 Cb -0.05 -3.69 -0.04 0.00 0.01 0.00 0.00 42.46 38.69 1xdi s ILE 438 CO 0.89 -0.49 0.19 0.28 0.00 0.00 0.00 174.94 175.81 1xdi s THR 439 N -2.35 5.42 0.39 2.92 -1.32 -1.26 -0.71 115.64 118.72 1xdi s THR 439 Ca 0.56 -0.22 0.14 0.00 -1.21 0.00 0.00 61.69 60.96 1xdi s THR 439 Cb -0.10 -3.56 0.36 0.00 -1.51 0.00 0.00 72.50 67.69 1xdi s THR 439 CO 0.26 0.28 1.85 -0.37 -2.21 0.00 0.00 174.62 174.43 1xdi h VAL 440 N 2.64 0.71 -0.00 5.08 -1.51 -1.33 1.52 116.25 123.36 1xdi h VAL 440 Ca -0.48 -0.18 -0.00 0.00 -1.23 0.00 0.00 66.70 64.81 1xdi h VAL 440 Cb 1.18 0.15 -0.00 0.00 -2.13 0.00 0.00 31.29 30.49 1xdi h VAL 440 CO 0.71 0.09 0.00 0.78 -1.23 0.00 0.00 177.57 177.92 1xdi h ASN 441 N 0.51 0.00 -0.26 4.19 4.21 -1.85 0.11 115.58 122.50 1xdi h ASN 441 Ca 0.48 -0.08 -0.01 0.00 1.21 0.00 0.00 56.30 57.91 1xdi h ASN 441 Cb 1.04 -0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 38.23 1xdi h ASN 441 CO -0.21 0.08 0.14 -0.33 -1.29 0.00 0.00 177.43 175.82 1xdi h GLU 442 N -0.08 0.39 0.07 0.81 5.08 0.03 -2.44 114.58 118.44 1xdi h GLU 442 Ca 0.00 -0.03 -0.29 0.00 -1.00 0.00 0.00 59.36 58.04 1xdi h GLU 442 Cb 0.08 -0.08 0.03 0.00 0.50 0.00 0.00 28.75 29.27 1xdi h GLU 442 CO -0.00 0.30 -1.16 1.25 -1.00 0.00 0.00 179.01 178.40 1xdi h LEU 443 N 0.39 0.89 -2.90 1.33 5.85 0.22 -3.29 115.31 117.81 1xdi h LEU 443 Ca 0.10 -0.77 0.00 0.00 0.84 0.00 0.00 57.88 58.05 1xdi h LEU 443 Cb 0.03 -0.28 -0.00 0.00 0.37 0.00 0.00 40.66 40.79 1xdi h LEU 443 CO -0.02 1.58 0.00 0.00 -0.34 0.00 0.00 178.44 179.66 1xdi h ALA 444 N 0.35 1.09 -0.00 1.25 0.00 -0.32 -1.37 119.26 120.26 1xdi h ALA 444 Ca -0.16 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1xdi h ALA 444 Cb 1.82 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.61 1xdi h ALA 444 CO 0.22 -0.01 -0.29 1.04 0.00 0.00 0.00 179.25 180.22 1xdi n GLN 445 N -3.20 0.53 -2.54 0.00 6.02 -1.12 -4.83 117.38 112.25 1xdi n GLN 445 Ca -0.03 -0.28 -0.42 0.00 -0.01 0.00 0.00 57.00 56.25 1xdi n GLN 445 Cb 0.08 -1.49 -0.03 0.00 1.02 0.00 0.00 30.24 29.82 1xdi n GLN 445 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 1xdi s THR 446 N -2.66 4.43 -1.27 5.09 2.01 -0.52 -4.93 115.64 117.79 1xdi s THR 446 Ca 0.21 1.74 -0.19 0.00 0.31 0.00 0.00 61.69 63.76 1xdi s THR 446 Cb 0.19 -4.12 0.02 0.00 0.01 0.00 0.00 72.50 68.60 1xdi s THR 446 CO 0.56 0.01 1.83 0.18 -0.69 0.00 0.00 174.62 176.52 1xdi n LEU 447 N 5.02 4.60 -4.55 4.42 4.77 -1.26 -4.97 117.00 125.03 1xdi n LEU 447 Ca 0.10 -3.72 -0.29 0.00 -0.03 0.00 0.00 56.01 52.07 1xdi n LEU 447 Cb 0.47 -1.72 0.23 0.00 -2.33 0.00 0.00 43.42 40.07 1xdi n LEU 447 CO 0.54 -0.28 0.56 0.00 -1.33 0.00 0.00 177.39 176.88 1xdi s ALA 448 N 5.86 0.05 0.38 -1.18 0.00 -1.26 -4.98 121.76 120.63 1xdi s ALA 448 Ca 0.57 -0.10 -0.22 0.00 0.00 0.00 0.00 51.96 52.21 1xdi s ALA 448 Cb 0.04 -3.24 -0.10 0.00 0.00 0.00 0.00 23.12 19.81 1xdi s ALA 448 CO 0.08 -3.50 0.93 0.08 0.00 0.00 0.00 175.76 173.35 1xdi s VAL 449 N -2.59 4.35 -0.06 0.00 1.01 -1.26 -4.99 120.40 116.87 1xdi s VAL 449 Ca 0.67 1.56 0.05 0.00 0.00 0.00 0.00 61.98 64.26 1xdi s VAL 449 Cb -0.23 -3.74 -0.00 0.00 0.00 0.00 0.00 36.38 32.40 1xdi s VAL 449 CO 0.62 -0.15 -0.20 -0.47 0.00 0.00 0.00 175.10 174.91 1xdi s TYR 450 N -1.97 2.00 -0.09 5.22 6.14 -1.26 -3.50 117.35 123.90 1xdi s TYR 450 Ca 0.57 -0.63 -0.10 0.00 0.64 0.00 0.00 57.07 57.55 1xdi s TYR 450 Cb -0.12 -1.34 -0.05 0.00 0.42 0.00 0.00 41.96 40.87 1xdi s TYR 450 CO 0.17 -0.22 0.24 -1.25 0.64 0.00 0.00 175.55 175.13 1xdi s PRO 451 N 0.08 3.69 0.18 4.97 0.04 -1.26 -5.20 135.00 137.50 1xdi s PRO 451 Ca -0.07 0.06 -0.18 0.00 0.04 0.00 0.00 61.00 60.86 1xdi s PRO 451 Cb -0.13 -3.23 0.03 0.00 0.04 0.00 0.00 34.50 31.21 1xdi s PRO 451 CO 0.04 0.69 0.51 -1.54 0.04 0.00 0.00 177.00 176.74 1xdi s SER 452 N -0.89 -0.28 0.36 6.66 1.04 -1.23 -4.79 113.70 114.57 1xdi s SER 452 Ca 0.18 -0.41 0.20 0.00 0.48 0.00 0.00 55.95 56.39 1xdi s SER 452 Cb -0.14 0.56 0.42 0.00 0.10 0.00 0.00 66.02 66.97 1xdi s SER 452 CO 0.07 -1.01 1.61 -0.07 0.98 0.00 0.00 173.24 174.82 1xdi h LEU 453 N 2.21 0.00 -0.34 2.42 3.38 -1.95 -2.89 115.31 118.14 1xdi h LEU 453 Ca -0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.67 1xdi h LEU 453 Cb 1.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.02 1xdi h LEU 453 CO 0.39 0.32 0.00 -1.54 0.09 0.00 0.00 178.44 177.70 1xdi n SER 454 N -3.26 0.25 0.22 -0.43 3.41 -1.26 -1.57 113.62 110.98 1xdi n SER 454 Ca 0.02 0.57 0.10 0.00 -0.26 0.00 0.00 58.87 59.30 1xdi n SER 454 Cb 0.59 -0.62 0.40 0.00 -0.26 0.00 0.00 64.21 64.32 1xdi n SER 454 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1xdi h GLY 455 N 1.84 0.00 1.72 5.00 0.00 -1.73 -2.55 103.07 107.36 1xdi h GLY 455 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.19 1xdi h GLY 455 CO 0.00 0.00 -0.55 1.76 0.00 0.00 0.00 176.54 177.75 1xdi h SER 456 N 0.00 0.32 -0.60 0.19 0.02 -1.47 -2.29 113.55 109.73 1xdi h SER 456 Ca -0.00 -0.17 -0.08 0.00 -0.84 0.00 0.00 61.79 60.70 1xdi h SER 456 Cb 0.83 -0.09 -0.02 0.00 0.14 0.00 0.00 62.40 63.25 1xdi h SER 456 CO 0.03 0.81 0.08 0.40 -1.14 0.00 0.00 176.83 177.00 1xdi h ILE 457 N 0.22 1.26 0.00 3.27 2.04 -1.52 0.48 117.51 123.27 1xdi h ILE 457 Ca 0.00 -1.03 -0.07 0.00 1.00 0.00 0.00 64.86 64.77 1xdi h ILE 457 Cb 1.03 0.76 -0.01 0.00 -0.74 0.00 0.00 36.82 37.86 1xdi h ILE 457 CO 0.09 0.38 -0.32 0.71 0.00 0.00 0.00 178.15 179.00 1xdi h THR 458 N 0.91 0.72 -0.03 -0.27 1.35 -1.41 -2.27 112.91 111.91 1xdi h THR 458 Ca 0.18 -1.44 -0.09 0.00 -0.55 0.00 0.00 66.41 64.51 1xdi h THR 458 Cb 0.45 1.93 0.01 0.00 -1.73 0.00 0.00 68.15 68.81 1xdi h THR 458 CO 0.02 0.32 -0.33 -0.33 -0.25 0.00 0.00 175.52 174.94 1xdi h GLU 459 N 0.00 0.28 -0.41 4.72 4.39 -0.95 0.46 114.58 123.08 1xdi h GLU 459 Ca -0.00 -0.26 0.05 0.00 0.34 0.00 0.00 59.36 59.49 1xdi h GLU 459 Cb 0.91 0.06 -0.08 0.00 -0.10 0.00 0.00 28.75 29.54 1xdi h GLU 459 CO 0.04 0.94 -0.56 0.00 -1.16 0.00 0.00 179.01 178.27 1xdi h ALA 460 N 0.35 -0.78 -0.52 3.43 0.00 0.18 0.49 119.26 122.41 1xdi h ALA 460 Ca -0.03 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 1xdi h ALA 460 Cb 1.03 1.12 -0.02 0.00 0.00 0.00 0.00 17.79 19.92 1xdi h ALA 460 CO 0.07 -1.05 0.06 0.00 0.00 0.00 0.00 179.25 178.32 1xdi h ALA 461 N -0.03 1.12 -0.90 0.00 0.00 -1.44 -2.48 119.26 115.52 1xdi h ALA 461 Ca 0.07 -0.25 0.17 0.00 0.00 0.00 0.00 54.91 54.91 1xdi h ALA 461 Cb 0.60 -0.21 -0.10 0.00 0.00 0.00 0.00 17.79 18.08 1xdi h ALA 461 CO -0.60 0.57 0.48 -0.09 0.00 0.00 0.00 179.25 179.62 1xdi h ARG 462 N 0.80 0.61 0.00 0.00 2.43 0.22 0.19 114.38 118.62 1xdi h ARG 462 Ca 0.16 -0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 59.25 1xdi h ARG 462 Cb 0.40 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.80 1xdi h ARG 462 CO 0.01 0.40 -0.22 0.00 -1.51 0.00 0.00 179.97 178.66 1xdi h ARG 463 N 0.63 0.00 0.00 0.20 3.08 -0.41 -2.52 114.38 115.36 1xdi h ARG 463 Ca 0.51 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.56 1xdi h ARG 463 Cb 0.80 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.85 1xdi h ARG 463 CO -0.40 0.22 0.00 -0.07 -1.07 0.00 0.00 179.97 178.65 1xdi h LEU 464 N 0.00 0.00 -9.44 3.04 3.38 -0.39 -3.46 115.31 108.44 1xdi h LEU 464 Ca -0.00 0.00 -0.62 0.00 0.09 0.00 0.00 57.88 57.35 1xdi h LEU 464 Cb 0.80 0.00 0.09 0.00 0.09 0.00 0.00 40.66 41.64 1xdi h LEU 464 CO 0.03 0.00 0.34 0.23 0.09 0.00 0.00 178.44 179.13 1xdi n MET 465 N -2.39 1.46 0.00 1.13 2.81 -0.95 -5.02 117.12 114.16 1xdi n MET 465 Ca 0.03 0.52 0.00 0.00 -1.81 0.00 0.00 57.70 56.44 1xdi n MET 465 Cb 0.34 -2.04 0.00 0.00 -0.71 0.00 0.00 33.22 30.81 1xdi n MET 465 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48