#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xxi s GLN 4 N 0.00 0.15 -0.18 -3.48 -0.21 -1.26 -5.11 119.66 109.56 1xxi s GLN 4 Ca 0.00 0.33 -0.05 0.00 0.02 0.00 0.00 55.36 55.66 1xxi s GLN 4 Cb 0.00 0.15 -0.03 0.00 1.00 0.00 0.00 33.01 34.13 1xxi s GLN 4 CO 0.00 -0.04 -0.01 0.14 -2.12 0.00 0.00 175.29 173.26 1xxi s VAL 5 N 1.85 4.02 0.34 1.09 -7.23 -1.26 -4.98 120.40 114.22 1xxi s VAL 5 Ca -0.03 -0.30 0.25 0.00 -1.81 0.00 0.00 61.98 60.09 1xxi s VAL 5 Cb -0.03 -2.80 0.39 0.00 0.56 0.00 0.00 36.38 34.50 1xxi s VAL 5 CO -0.15 0.45 1.21 0.18 -0.31 0.00 0.00 175.10 176.48 1xxi n LEU 6 N 3.93 0.17 0.30 1.32 4.77 -1.26 0.05 117.00 126.27 1xxi n LEU 6 Ca -0.17 1.08 0.19 0.00 -0.03 0.00 0.00 56.01 57.08 1xxi n LEU 6 Cb 0.52 -0.53 1.01 0.00 -2.33 0.00 0.00 43.42 42.09 1xxi n LEU 6 CO 0.32 -1.17 1.10 0.00 -1.33 0.00 0.00 177.39 176.31 1xxi h ALA 7 N 1.24 1.06 0.00 -1.18 0.00 -1.88 -1.49 119.26 117.01 1xxi h ALA 7 Ca 0.68 0.00 -0.20 0.00 0.00 0.00 0.00 54.91 55.39 1xxi h ALA 7 Cb 2.19 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 19.94 1xxi h ALA 7 CO -0.37 -0.06 -1.77 -2.13 0.00 0.00 0.00 179.25 174.92 1xxi n ARG 8 N -2.85 0.79 0.29 0.00 0.63 0.11 -4.14 116.66 111.48 1xxi n ARG 8 Ca -0.02 0.06 0.18 0.00 -0.92 0.00 0.00 57.85 57.15 1xxi n ARG 8 Cb 0.12 -1.28 0.81 0.00 0.45 0.00 0.00 32.46 32.57 1xxi n ARG 8 CO 0.00 0.00 0.00 -0.22 -2.51 0.00 0.00 177.63 174.90 1xxi h LYS 9 N 0.00 0.00 -0.07 -0.14 3.64 -1.31 -2.85 116.57 115.85 1xxi h LYS 9 Ca -0.30 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.08 1xxi h LYS 9 Cb 1.52 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.34 1xxi h LYS 9 CO -0.03 0.00 0.00 0.91 -2.27 0.00 0.00 179.45 178.06 1xxi n TRP 10 N -3.05 0.14 -1.60 1.91 7.02 -0.59 -4.99 117.44 116.28 1xxi n TRP 10 Ca -0.00 -0.67 -0.44 0.00 -1.02 0.00 0.00 57.50 55.37 1xxi n TRP 10 Cb 0.24 -0.10 -0.03 0.00 -2.42 0.00 0.00 31.31 29.00 1xxi n TRP 10 CO 0.00 0.00 0.00 -2.13 -2.02 0.00 0.00 177.69 173.54 1xxi n ARG 11 N -0.63 2.00 -1.67 -0.99 0.63 -1.08 -4.80 116.66 110.12 1xxi n ARG 11 Ca 0.08 0.58 -0.65 0.00 -0.92 0.00 0.00 57.85 56.93 1xxi n ARG 11 Cb 0.44 -3.16 -0.09 0.00 0.45 0.00 0.00 32.46 30.09 1xxi n ARG 11 CO 0.00 0.00 0.00 -2.30 -2.51 0.00 0.00 177.63 172.82 1xxi n PRO 12 N 8.57 0.00 -0.08 -0.14 -0.02 -1.26 -4.88 135.00 137.19 1xxi n PRO 12 Ca 0.30 0.00 -0.08 0.00 -2.02 0.00 0.00 63.50 61.70 1xxi n PRO 12 Cb 0.43 -1.50 -0.13 0.00 -0.02 0.00 0.00 33.50 32.28 1xxi n PRO 12 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1xxi n GLN 13 N 3.23 1.30 -4.45 -0.52 1.13 -1.26 -4.98 117.38 111.83 1xxi n GLN 13 Ca 0.28 -0.01 -0.23 0.00 -1.94 0.00 0.00 57.00 55.10 1xxi n GLN 13 Cb -0.02 -1.42 -0.10 0.00 0.11 0.00 0.00 30.24 28.81 1xxi n GLN 13 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 1xxi s THR 14 N -2.41 2.24 0.10 5.09 2.01 -1.26 -4.92 115.64 116.49 1xxi s THR 14 Ca -0.08 -2.32 0.33 0.00 0.31 0.00 0.00 61.69 59.93 1xxi s THR 14 Cb 0.05 -2.31 0.36 0.00 0.01 0.00 0.00 72.50 70.60 1xxi s THR 14 CO 0.68 -0.40 2.00 -0.26 -0.69 0.00 0.00 174.62 175.94 1xxi h PHE 15 N 2.29 0.00 0.11 4.92 -1.00 -1.92 -2.44 116.94 118.90 1xxi h PHE 15 Ca -0.40 0.00 -0.27 0.00 2.81 0.00 0.00 57.97 60.11 1xxi h PHE 15 Cb 1.25 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.81 1xxi h PHE 15 CO 0.78 0.00 -1.24 0.00 -1.61 0.00 0.00 178.31 176.23 1xxi h ALA 16 N 2.05 0.15 0.00 2.45 0.00 -1.95 -3.33 119.26 118.64 1xxi h ALA 16 Ca 0.00 -0.92 -0.03 0.00 0.00 0.00 0.00 54.91 53.96 1xxi h ALA 16 Cb 0.27 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 1xxi h ALA 16 CO 0.00 1.03 -0.16 -0.44 0.00 0.00 0.00 179.25 179.68 1xxi h ASP 17 N 0.06 0.00 -4.17 0.00 3.32 -1.84 -3.44 116.42 110.35 1xxi h ASP 17 Ca -0.13 0.00 -0.52 0.00 0.02 0.00 0.00 57.03 56.40 1xxi h ASP 17 Cb 1.95 0.00 0.12 0.00 0.22 0.00 0.00 39.33 41.63 1xxi h ASP 17 CO 0.19 0.16 0.40 -0.69 -1.72 0.00 0.00 179.24 177.58 1xxi s VAL 18 N -4.14 2.76 -0.02 -1.35 1.01 -1.24 -4.90 120.40 112.52 1xxi s VAL 18 Ca -0.02 0.38 -0.01 0.00 0.00 0.00 0.00 61.98 62.33 1xxi s VAL 18 Cb 0.13 -2.96 -0.04 0.00 0.00 0.00 0.00 36.38 33.51 1xxi s VAL 18 CO 0.61 -0.19 0.09 -0.69 0.00 0.00 0.00 175.10 174.92 1xxi s VAL 19 N -2.04 4.82 0.00 2.92 1.01 -1.26 -4.84 120.40 121.01 1xxi s VAL 19 Ca 0.72 -0.33 0.00 0.00 0.00 0.00 0.00 61.98 62.37 1xxi s VAL 19 Cb -0.26 -3.19 0.00 0.00 0.00 0.00 0.00 36.38 32.94 1xxi s VAL 19 CO 0.41 0.39 0.00 0.61 0.00 0.00 0.00 175.10 176.50 1xxi n GLY 20 N 1.29 0.00 2.43 4.51 0.00 -1.26 -4.75 105.19 107.41 1xxi n GLY 20 Ca -0.14 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.52 1xxi n GLY 20 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1xxi n GLN 21 N -0.38 3.95 -0.24 1.61 6.02 -1.26 -4.74 117.38 122.33 1xxi n GLN 21 Ca 0.00 -2.93 -0.13 0.00 -0.01 0.00 0.00 57.00 53.93 1xxi n GLN 21 Cb 0.00 -2.55 -0.10 0.00 1.02 0.00 0.00 30.24 28.62 1xxi n GLN 21 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 1xxi h GLU 22 N 4.32 -0.24 0.00 -1.09 5.08 -1.96 -2.40 114.58 118.30 1xxi h GLU 22 Ca 0.66 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 59.03 1xxi h GLU 22 Cb 0.43 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1xxi h GLU 22 CO 1.37 -0.16 0.00 0.45 -1.00 0.00 0.00 179.01 179.67 1xxi h HIS 23 N -0.25 0.00 0.00 4.33 3.86 -1.99 0.27 115.15 121.38 1xxi h HIS 23 Ca 0.11 0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 59.27 1xxi h HIS 23 Cb 0.53 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.99 1xxi h HIS 23 CO -0.84 0.00 -1.80 0.28 0.86 0.00 0.00 177.93 176.44 1xxi n VAL 24 N -2.40 0.35 0.06 2.45 0.31 -0.93 -3.08 118.33 115.09 1xxi n VAL 24 Ca -0.01 -0.56 -0.21 0.00 -0.01 0.00 0.00 64.34 63.55 1xxi n VAL 24 Cb 0.07 -0.17 -0.15 0.00 -0.91 0.00 0.00 33.84 32.69 1xxi n VAL 24 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1xxi h LEU 25 N 0.00 0.50 -0.44 7.52 3.38 -0.84 -3.00 115.31 122.43 1xxi h LEU 25 Ca -0.07 -0.94 0.04 0.00 0.09 0.00 0.00 57.88 57.00 1xxi h LEU 25 Cb 1.17 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 41.72 1xxi h LEU 25 CO 0.01 1.45 0.22 0.74 0.09 0.00 0.00 178.44 180.94 1xxi h THR 26 N -0.32 0.96 -0.30 0.22 2.02 -0.69 0.75 112.91 115.56 1xxi h THR 26 Ca -0.17 -0.15 0.06 0.00 0.77 0.00 0.00 66.41 66.92 1xxi h THR 26 Cb 1.71 0.49 -0.05 0.00 -1.74 0.00 0.00 68.15 68.55 1xxi h THR 26 CO 0.15 0.08 -0.05 0.00 0.37 0.00 0.00 175.52 176.07 1xxi h ALA 27 N 1.24 0.22 0.00 6.16 0.00 -1.62 -0.26 119.26 124.99 1xxi h ALA 27 Ca 0.19 0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.19 1xxi h ALA 27 Cb 0.10 0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 1xxi h ALA 27 CO -0.14 -0.45 -0.11 -0.07 0.00 0.00 0.00 179.25 178.48 1xxi h LEU 28 N 0.02 0.00 0.04 0.00 3.38 -1.27 -3.08 115.31 114.39 1xxi h LEU 28 Ca 0.15 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.11 1xxi h LEU 28 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 1xxi h LEU 28 CO -0.29 0.11 -0.02 0.00 0.09 0.00 0.00 178.44 178.33 1xxi h ALA 29 N 1.89 -0.05 0.13 1.53 0.00 0.85 -2.17 119.26 121.45 1xxi h ALA 29 Ca -0.00 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 54.73 1xxi h ALA 29 Cb 0.67 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.44 1xxi h ALA 29 CO 0.01 -0.34 -0.44 -0.91 0.00 0.00 0.00 179.25 177.58 1xxi h ASN 30 N -0.42 -1.31 -0.38 0.00 4.21 -1.22 -2.30 115.58 114.16 1xxi h ASN 30 Ca -0.00 0.13 0.08 0.00 1.21 0.00 0.00 56.30 57.72 1xxi h ASN 30 Cb 0.39 0.48 -0.02 0.00 -1.12 0.00 0.00 38.32 38.05 1xxi h ASN 30 CO 0.01 -0.47 0.27 1.23 -1.29 0.00 0.00 177.43 177.17 1xxi h GLY 31 N -0.65 0.19 2.00 2.83 0.00 -1.60 0.35 103.07 106.18 1xxi h GLY 31 Ca -0.01 -0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.26 1xxi h GLY 31 CO -0.22 0.04 0.00 1.04 0.00 0.00 0.00 176.54 177.40 1xxi n LEU 32 N -4.46 0.28 -0.12 3.11 4.77 -0.82 -0.71 117.00 119.06 1xxi n LEU 32 Ca 0.06 0.53 -0.24 0.00 -0.03 0.00 0.00 56.01 56.32 1xxi n LEU 32 Cb 0.35 -0.44 -0.09 0.00 -2.33 0.00 0.00 43.42 40.91 1xxi n LEU 32 CO 0.35 -0.09 -1.13 -1.20 -1.33 0.00 0.00 177.39 173.99 1xxi n SER 33 N -1.77 1.93 0.00 -1.43 7.64 0.21 -4.19 113.62 116.02 1xxi n SER 33 Ca 0.06 0.36 0.12 0.00 1.01 0.00 0.00 58.87 60.43 1xxi n SER 33 Cb 0.36 -0.83 0.58 0.00 -1.01 0.00 0.00 64.21 63.30 1xxi n SER 33 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1xxi n LEU 34 N -4.33 0.00 -1.07 -3.43 4.77 0.97 -4.91 117.00 109.01 1xxi n LEU 34 Ca -0.42 0.44 -0.10 0.00 -0.03 0.00 0.00 56.01 55.89 1xxi n LEU 34 Cb 0.77 -0.44 -0.01 0.00 -2.33 0.00 0.00 43.42 41.41 1xxi n LEU 34 CO 0.09 -0.05 -0.12 0.61 -1.33 0.00 0.00 177.39 176.58 1xxi n GLY 35 N 1.07 0.25 3.08 -0.72 0.00 0.12 -4.94 105.19 104.04 1xxi n GLY 35 Ca 0.08 -0.49 -0.43 0.00 0.00 0.00 0.00 46.02 45.18 1xxi n GLY 35 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xxi n ARG 36 N -2.15 3.60 -3.24 1.61 1.74 -0.27 -4.99 116.66 112.96 1xxi n ARG 36 Ca -0.12 -3.73 -0.40 0.00 -0.77 0.00 0.00 57.85 52.84 1xxi n ARG 36 Cb 0.53 -2.92 -0.07 0.00 -1.02 0.00 0.00 32.46 28.98 1xxi n ARG 36 CO 0.00 0.00 0.00 -1.50 -1.52 0.00 0.00 177.63 174.61 1xxi s ILE 37 N 0.48 5.08 0.22 0.55 2.07 -1.26 -4.72 121.20 123.62 1xxi s ILE 37 Ca 0.40 0.90 -0.19 0.00 -1.41 0.00 0.00 60.65 60.34 1xxi s ILE 37 Cb 0.05 -3.83 -0.08 0.00 0.13 0.00 0.00 42.46 38.73 1xxi s ILE 37 CO 0.01 0.11 0.71 -1.00 -1.91 0.00 0.00 174.94 172.86 1xxi s HIS 38 N 2.10 3.64 -0.33 3.50 3.76 -1.26 -4.96 115.29 121.73 1xxi s HIS 38 Ca 0.22 1.35 0.24 0.00 -0.15 0.00 0.00 55.06 56.72 1xxi s HIS 38 Cb -0.16 -2.59 1.10 0.00 1.11 0.00 0.00 32.58 32.04 1xxi s HIS 38 CO 0.09 0.34 1.73 0.45 -0.85 0.00 0.00 174.74 176.50 1xxi h HIS 39 N 3.41 0.00 -2.84 1.40 -0.00 -1.91 -3.42 115.15 111.79 1xxi h HIS 39 Ca -0.48 0.00 -0.18 0.00 -0.00 0.00 0.00 60.37 59.71 1xxi h HIS 39 Cb 1.19 0.00 -0.30 0.00 -0.00 0.00 0.00 27.41 28.30 1xxi h HIS 39 CO 0.64 0.00 -0.47 0.00 -0.00 0.00 0.00 177.93 178.10 1xxi s ALA 40 N -3.43 -0.68 -0.22 2.45 0.00 -1.26 -0.83 121.76 117.79 1xxi s ALA 40 Ca 0.02 1.09 0.00 0.00 0.00 0.00 0.00 51.96 53.06 1xxi s ALA 40 Cb 0.08 -0.94 0.03 0.00 0.00 0.00 0.00 23.12 22.29 1xxi s ALA 40 CO 0.34 -0.49 -0.13 0.71 0.00 0.00 0.00 175.76 176.19 1xxi s TYR 41 N 2.00 2.97 -0.26 0.00 1.51 -0.47 -0.70 117.35 122.40 1xxi s TYR 41 Ca -0.03 -1.67 -0.10 0.00 -1.01 0.00 0.00 57.07 54.26 1xxi s TYR 41 Cb -0.11 -1.98 -0.04 0.00 -0.11 0.00 0.00 41.96 39.71 1xxi s TYR 41 CO -0.09 -0.77 0.15 -1.17 -1.11 0.00 0.00 175.55 172.55 1xxi s LEU 42 N 1.29 3.88 -0.31 -1.29 2.96 -0.93 -0.19 118.68 124.08 1xxi s LEU 42 Ca 0.01 -0.04 -0.04 0.00 -0.22 0.00 0.00 54.13 53.85 1xxi s LEU 42 Cb -0.15 -2.06 0.04 0.00 0.50 0.00 0.00 46.19 44.52 1xxi s LEU 42 CO -0.08 -0.01 0.03 -0.36 -1.32 0.00 0.00 176.35 174.61 1xxi s PHE 43 N 1.53 3.24 0.31 5.38 0.08 0.24 -0.09 117.98 128.67 1xxi s PHE 43 Ca 0.07 -1.65 0.08 0.00 0.12 0.00 0.00 56.93 55.55 1xxi s PHE 43 Cb -0.15 -2.17 -0.03 0.00 -0.57 0.00 0.00 43.02 40.10 1xxi s PHE 43 CO 0.08 -0.76 0.21 -1.54 -0.10 0.00 0.00 175.22 173.11 1xxi s SER 44 N 1.32 5.13 0.00 1.36 1.04 -0.33 -2.01 113.70 120.21 1xxi s SER 44 Ca -0.03 -0.52 0.00 0.00 0.48 0.00 0.00 55.95 55.87 1xxi s SER 44 Cb -0.19 -0.99 0.00 0.00 0.10 0.00 0.00 66.02 64.93 1xxi s SER 44 CO 0.00 -0.25 0.00 0.61 0.98 0.00 0.00 173.24 174.59 1xxi n GLY 45 N -1.24 3.95 3.30 7.32 0.00 -1.00 -0.87 105.19 116.66 1xxi n GLY 45 Ca -0.04 -1.63 -0.33 0.00 0.00 0.00 0.00 46.02 44.02 1xxi n GLY 45 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1xxi n THR 46 N -1.83 0.00 -2.57 2.61 -1.04 -1.26 -4.24 114.28 105.95 1xxi n THR 46 Ca 0.00 -0.27 -0.33 0.00 -2.04 0.00 0.00 64.05 61.42 1xxi n THR 46 Cb 0.00 -0.59 -0.05 0.00 -1.82 0.00 0.00 70.33 67.87 1xxi n THR 46 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1xxi s ARG 47 N -3.45 4.02 0.00 -2.82 1.04 -1.26 -3.69 118.95 112.79 1xxi s ARG 47 Ca 0.56 1.08 0.00 0.00 -1.04 0.00 0.00 55.73 56.32 1xxi s ARG 47 Cb -0.14 -2.14 0.00 0.00 -2.04 0.00 0.00 34.95 30.63 1xxi s ARG 47 CO 0.67 -0.21 0.00 0.41 -0.04 0.00 0.00 175.30 176.12 1xxi n GLY 48 N -1.03 2.67 3.81 3.88 0.00 -1.26 -4.87 105.19 108.39 1xxi n GLY 48 Ca 0.07 -0.01 -0.34 0.00 0.00 0.00 0.00 46.02 45.75 1xxi n GLY 48 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xxi s VAL 49 N -2.73 4.13 -0.17 1.61 1.01 -1.24 -3.96 120.40 119.05 1xxi s VAL 49 Ca 0.00 1.38 -0.02 0.00 0.00 0.00 0.00 61.98 63.34 1xxi s VAL 49 Cb 0.00 -3.59 -0.07 0.00 0.00 0.00 0.00 36.38 32.72 1xxi s VAL 49 CO 0.00 -0.23 1.59 0.61 0.00 0.00 0.00 175.10 177.06 1xxi n GLY 50 N -0.35 1.94 0.19 4.51 0.00 -1.26 -4.55 105.19 105.66 1xxi n GLY 50 Ca 0.07 -0.44 -0.13 0.00 0.00 0.00 0.00 46.02 45.52 1xxi n GLY 50 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xxi h LYS 51 N 5.60 -0.37 -0.18 1.61 1.57 -1.91 0.14 116.57 123.04 1xxi h LYS 51 Ca 0.14 0.03 -0.05 0.00 -1.87 0.00 0.00 60.65 58.89 1xxi h LYS 51 Cb 0.38 0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.77 1xxi h LYS 51 CO 0.67 -0.06 -0.08 1.79 -0.57 0.00 0.00 179.45 181.20 1xxi h THR 52 N -0.68 1.31 -0.49 -0.16 1.35 -1.96 -2.37 112.91 109.91 1xxi h THR 52 Ca -0.04 -1.12 0.10 0.00 -0.55 0.00 0.00 66.41 64.79 1xxi h THR 52 Cb 0.47 1.67 -0.08 0.00 -1.73 0.00 0.00 68.15 68.48 1xxi h THR 52 CO 0.06 0.34 -0.01 -1.28 -0.25 0.00 0.00 175.52 174.38 1xxi h SER 53 N 0.06 -0.24 1.14 5.36 0.87 -1.88 -0.26 113.55 118.60 1xxi h SER 53 Ca 0.04 0.12 -0.05 0.00 -1.23 0.00 0.00 61.79 60.67 1xxi h SER 53 Cb 0.56 0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 62.73 1xxi h SER 53 CO 0.03 -0.08 -0.25 0.40 -0.53 0.00 0.00 176.83 176.40 1xxi h ILE 54 N 0.10 0.54 -0.11 2.23 2.04 -0.74 -2.93 117.51 118.63 1xxi h ILE 54 Ca 0.25 -1.30 -0.12 0.00 1.00 0.00 0.00 64.86 64.69 1xxi h ILE 54 Cb 0.37 1.91 -0.01 0.00 -0.74 0.00 0.00 36.82 38.34 1xxi h ILE 54 CO -0.42 0.24 -0.46 0.00 0.00 0.00 0.00 178.15 177.51 1xxi h ALA 55 N 1.75 1.01 -0.14 1.87 0.00 -0.53 -3.13 119.26 120.08 1xxi h ALA 55 Ca -0.00 -0.45 -0.03 0.00 0.00 0.00 0.00 54.91 54.43 1xxi h ALA 55 Cb 0.89 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 1xxi h ALA 55 CO 0.03 0.63 -0.03 0.00 0.00 0.00 0.00 179.25 179.89 1xxi h ARG 56 N 0.22 0.27 0.00 0.00 3.08 -1.06 -2.70 114.38 114.20 1xxi h ARG 56 Ca 0.01 -0.10 0.00 0.00 0.07 0.00 0.00 59.98 59.96 1xxi h ARG 56 Cb 0.90 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.94 1xxi h ARG 56 CO 0.07 0.55 0.00 1.28 -1.07 0.00 0.00 179.97 180.80 1xxi n LEU 57 N -4.72 0.00 -0.09 3.04 4.77 -1.19 0.47 117.00 119.29 1xxi n LEU 57 Ca -0.06 0.42 -0.17 0.00 -0.03 0.00 0.00 56.01 56.17 1xxi n LEU 57 Cb 0.25 -0.42 -0.10 0.00 -2.33 0.00 0.00 43.42 40.82 1xxi n LEU 57 CO 0.37 -0.31 -0.33 0.25 -1.33 0.00 0.00 177.39 176.04 1xxi h LEU 58 N 0.00 0.00 -1.44 2.23 5.85 -1.46 -3.28 115.31 117.21 1xxi h LEU 58 Ca 0.00 -0.50 0.00 0.00 0.84 0.00 0.00 57.88 58.22 1xxi h LEU 58 Cb 0.11 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.14 1xxi h LEU 58 CO 0.00 1.28 0.00 0.00 -0.34 0.00 0.00 178.44 179.38 1xxi h ALA 59 N -0.50 1.00 0.00 1.25 0.00 -0.99 -0.24 119.26 119.78 1xxi h ALA 59 Ca -0.23 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1xxi h ALA 59 Cb 1.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1xxi h ALA 59 CO -0.14 0.00 0.00 -0.22 0.00 0.00 0.00 179.25 178.89 1xxi h LYS 60 N 0.00 0.00 -0.00 0.00 3.64 -0.09 -3.02 116.57 117.10 1xxi h LYS 60 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1xxi h LYS 60 Cb 0.30 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.12 1xxi h LYS 60 CO 0.00 0.00 -0.28 0.41 -2.27 0.00 0.00 179.45 177.31 1xxi n GLY 61 N 1.22 -0.03 0.11 5.01 0.00 -0.29 -3.88 105.19 107.34 1xxi n GLY 61 Ca 0.05 -0.26 -0.20 0.00 0.00 0.00 0.00 46.02 45.61 1xxi n GLY 61 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1xxi h LEU 62 N 0.62 0.23 0.00 0.99 3.38 -1.09 0.41 115.31 119.85 1xxi h LEU 62 Ca 0.00 -0.81 0.00 0.00 0.09 0.00 0.00 57.88 57.16 1xxi h LEU 62 Cb 0.27 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.94 1xxi h LEU 62 CO 0.00 1.46 -1.02 0.59 0.09 0.00 0.00 178.44 179.55 1xxi n ASN 63 N -4.18 0.75 -4.55 -0.43 3.02 -1.15 -4.62 115.26 104.11 1xxi n ASN 63 Ca -0.23 -0.64 -0.48 0.00 -0.03 0.00 0.00 54.58 53.20 1xxi n ASN 63 Cb 0.77 0.94 -0.03 0.00 -0.61 0.00 0.00 39.78 40.85 1xxi n ASN 63 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1xxi h GLU 65 N 2.61 0.00 0.00 0.00 5.08 -1.94 -2.33 114.58 118.01 1xxi h GLU 65 Ca -0.40 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.96 1xxi h GLU 65 Cb 1.36 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.61 1xxi h GLU 65 CO 0.65 0.02 0.00 2.41 -1.00 0.00 0.00 179.01 181.10 1xxi n THR 66 N -3.17 0.43 0.00 1.13 -1.04 -1.26 -4.97 114.28 105.40 1xxi n THR 66 Ca -0.01 0.11 0.00 0.00 -2.04 0.00 0.00 64.05 62.11 1xxi n THR 66 Cb 0.23 -0.81 0.00 0.00 -1.82 0.00 0.00 70.33 67.92 1xxi n THR 66 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1xxi n GLY 67 N 0.23 2.02 3.59 3.41 0.00 -0.88 -4.88 105.19 108.68 1xxi n GLY 67 Ca 0.09 -2.08 -0.42 0.00 0.00 0.00 0.00 46.02 43.61 1xxi n GLY 67 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xxi s ILE 68 N -2.00 3.35 0.16 -0.61 1.01 -1.26 -4.51 121.20 117.33 1xxi s ILE 68 Ca 0.00 0.32 0.08 0.00 0.00 0.00 0.00 60.65 61.06 1xxi s ILE 68 Cb 0.00 -3.55 -0.04 0.00 0.01 0.00 0.00 42.46 38.88 1xxi s ILE 68 CO 0.00 -0.40 -0.18 -0.89 0.00 0.00 0.00 174.94 173.47 1xxi s THR 69 N 7.94 1.78 -0.78 2.92 2.01 0.13 -4.77 115.64 124.88 1xxi s THR 69 Ca 0.82 -1.87 0.23 0.00 0.31 0.00 0.00 61.69 61.18 1xxi s THR 69 Cb -0.22 -1.80 -0.15 0.00 0.01 0.00 0.00 72.50 70.34 1xxi s THR 69 CO 0.31 -0.30 1.01 0.00 -0.69 0.00 0.00 174.62 174.95 1xxi n ALA 70 N 0.38 3.88 -3.75 7.40 0.00 -1.26 -4.32 120.51 122.84 1xxi n ALA 70 Ca -0.14 -0.47 -0.28 0.00 0.00 0.00 0.00 53.44 52.55 1xxi n ALA 70 Cb 0.57 -0.91 -0.11 0.00 0.00 0.00 0.00 19.45 19.00 1xxi n ALA 70 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1xxi n THR 71 N -1.73 1.24 -1.80 0.00 -1.04 -1.26 -4.62 114.28 105.07 1xxi n THR 71 Ca 0.03 -4.67 -0.34 0.00 -2.04 0.00 0.00 64.05 57.03 1xxi n THR 71 Cb 0.39 -2.09 0.05 0.00 -1.82 0.00 0.00 70.33 66.86 1xxi n THR 71 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 1xxi s PRO 72 N -1.36 2.76 -0.20 -2.82 0.02 -1.26 -5.00 135.00 127.14 1xxi s PRO 72 Ca 0.28 1.57 -0.18 0.00 0.02 0.00 0.00 61.00 62.68 1xxi s PRO 72 Cb -0.00 -1.93 -0.03 0.00 0.02 0.00 0.00 34.50 32.56 1xxi s PRO 72 CO -0.16 -1.31 0.52 0.00 -0.33 0.00 0.00 177.00 175.72 1xxi n GLY 74 N 3.89 -0.49 0.10 0.00 0.00 -1.26 -3.78 105.19 103.64 1xxi n GLY 74 Ca -0.05 -0.09 -0.12 0.00 0.00 0.00 0.00 46.02 45.76 1xxi n GLY 74 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1xxi n VAL 75 N -0.96 1.27 -1.69 1.61 0.24 -1.26 -4.31 118.33 113.23 1xxi n VAL 75 Ca 0.11 -0.65 -0.44 0.00 -2.04 0.00 0.00 64.34 61.32 1xxi n VAL 75 Cb 0.05 -0.87 -0.02 0.00 -1.47 0.00 0.00 33.84 31.53 1xxi n VAL 75 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1xxi n ASP 77 N 1.72 0.17 -0.08 0.00 8.00 -1.26 0.17 116.55 125.26 1xxi n ASP 77 Ca 0.09 1.26 -0.13 0.00 0.71 0.00 0.00 54.79 56.72 1xxi n ASP 77 Cb 0.34 -0.62 -0.05 0.00 -0.02 0.00 0.00 41.12 40.76 1xxi n ASP 77 CO 0.00 0.00 0.00 0.78 -0.39 0.00 0.00 177.20 177.59 1xxi h ASN 78 N 0.00 0.58 -0.33 -2.24 2.35 -1.92 -2.73 115.58 111.29 1xxi h ASN 78 Ca 0.85 -0.47 -0.01 0.00 -0.55 0.00 0.00 56.30 56.12 1xxi h ASN 78 Cb 2.84 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 41.03 1xxi h ASN 78 CO -0.38 0.93 0.17 0.00 -1.65 0.00 0.00 177.43 176.51 1xxi h ARG 80 N 0.41 0.12 0.00 0.00 3.08 -1.55 -2.68 114.38 113.76 1xxi h ARG 80 Ca 0.12 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 60.12 1xxi h ARG 80 Cb 0.08 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.11 1xxi h ARG 80 CO -0.02 0.25 -0.09 0.93 -1.07 0.00 0.00 179.97 179.96 1xxi h GLU 81 N -0.03 0.00 -0.05 0.04 5.08 -1.44 -2.58 114.58 115.60 1xxi h GLU 81 Ca 0.03 0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 58.19 1xxi h GLU 81 Cb 0.17 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.43 1xxi h GLU 81 CO -0.00 0.09 -0.74 0.82 -1.00 0.00 0.00 179.01 178.18 1xxi h ILE 82 N 0.00 1.34 0.00 3.13 2.04 -1.27 -2.82 117.51 119.93 1xxi h ILE 82 Ca -0.00 -2.04 0.00 0.00 1.00 0.00 0.00 64.86 63.81 1xxi h ILE 82 Cb 0.19 2.32 0.00 0.00 -0.74 0.00 0.00 36.82 38.60 1xxi h ILE 82 CO 0.01 0.62 0.00 1.21 0.00 0.00 0.00 178.15 179.99 1xxi n GLU 83 N -4.07 0.20 -0.40 2.37 4.07 -1.00 -2.30 120.64 119.52 1xxi n GLU 83 Ca -0.09 0.14 0.09 0.00 -0.06 0.00 0.00 57.16 57.23 1xxi n GLU 83 Cb 0.73 -1.50 0.24 0.00 -0.06 0.00 0.00 31.44 30.85 1xxi n GLU 83 CO 0.00 0.00 0.00 1.04 -0.06 0.00 0.00 177.13 178.11 1xxi n GLN 84 N -1.32 2.80 0.00 5.31 6.02 -1.05 -4.97 117.38 124.18 1xxi n GLN 84 Ca 0.07 -2.77 0.00 0.00 -0.01 0.00 0.00 57.00 54.29 1xxi n GLN 84 Cb 0.14 -1.78 0.00 0.00 1.02 0.00 0.00 30.24 29.62 1xxi n GLN 84 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1xxi n GLY 85 N -0.52 1.61 3.44 1.08 0.00 -0.97 -4.93 105.19 104.90 1xxi n GLY 85 Ca 0.20 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.79 1xxi n GLY 85 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xxi s ARG 86 N 0.00 3.13 -0.00 1.61 0.52 -1.07 -4.95 118.95 118.19 1xxi s ARG 86 Ca 0.00 -0.90 -0.00 0.00 -0.52 0.00 0.00 55.73 54.31 1xxi s ARG 86 Cb 0.00 -4.12 0.00 0.00 0.52 0.00 0.00 34.95 31.35 1xxi s ARG 86 CO 0.00 -1.30 0.01 0.12 0.02 0.00 0.00 175.30 174.15 1xxi s PHE 87 N 2.77 -0.01 0.19 -0.53 5.36 -1.25 -4.30 117.98 120.21 1xxi s PHE 87 Ca 0.16 0.02 -0.17 0.00 -0.96 0.00 0.00 56.93 55.98 1xxi s PHE 87 Cb -0.19 0.00 0.16 0.00 -0.34 0.00 0.00 43.02 42.65 1xxi s PHE 87 CO 0.12 -0.01 1.63 0.28 -1.46 0.00 0.00 175.22 175.78 1xxi h VAL 88 N 5.12 0.38 0.00 3.12 2.07 -1.96 -3.02 116.25 121.97 1xxi h VAL 88 Ca -0.24 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.20 1xxi h VAL 88 Cb 1.21 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 31.35 1xxi h VAL 88 CO 0.50 0.00 -1.14 0.44 0.02 0.00 0.00 177.57 177.39 1xxi h ASP 89 N -0.07 0.00 -1.25 0.57 3.32 -1.92 -3.44 116.42 113.64 1xxi h ASP 89 Ca 0.25 0.00 -0.56 0.00 0.02 0.00 0.00 57.03 56.74 1xxi h ASP 89 Cb 0.45 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 39.91 1xxi h ASP 89 CO -0.57 0.28 1.36 -0.22 -1.72 0.00 0.00 179.24 178.38 1xxi s LEU 90 N -5.62 3.42 -0.47 1.55 2.96 -1.14 -3.20 118.68 116.18 1xxi s LEU 90 Ca -0.01 -1.21 -0.23 0.00 -0.22 0.00 0.00 54.13 52.46 1xxi s LEU 90 Cb 0.09 -2.57 0.03 0.00 0.50 0.00 0.00 46.19 44.24 1xxi s LEU 90 CO 0.79 -1.69 0.80 -0.63 -1.32 0.00 0.00 176.35 174.30 1xxi s ILE 91 N 5.66 4.63 -0.46 6.68 1.01 -0.55 -4.52 121.20 133.64 1xxi s ILE 91 Ca 0.47 0.31 -0.17 0.00 0.00 0.00 0.00 60.65 61.27 1xxi s ILE 91 Cb -0.02 -4.36 0.05 0.00 0.01 0.00 0.00 42.46 38.15 1xxi s ILE 91 CO -0.05 -0.80 0.45 -1.61 0.00 0.00 0.00 174.94 172.94 1xxi s GLU 92 N 3.34 3.04 -0.17 2.79 2.02 -1.26 -1.38 118.70 127.08 1xxi s GLU 92 Ca 0.28 -1.06 -0.04 0.00 0.02 0.00 0.00 54.97 54.18 1xxi s GLU 92 Cb -0.13 -4.07 -0.02 0.00 0.10 0.00 0.00 34.13 30.01 1xxi s GLU 92 CO 0.21 -1.01 -0.04 0.42 0.02 0.00 0.00 175.26 174.86 1xxi s ILE 93 N 2.01 3.81 -0.87 -1.63 1.01 0.44 -5.01 121.20 120.96 1xxi s ILE 93 Ca 0.09 -0.38 -0.09 0.00 0.00 0.00 0.00 60.65 60.27 1xxi s ILE 93 Cb -0.21 -2.68 0.22 0.00 0.01 0.00 0.00 42.46 39.81 1xxi s ILE 93 CO 0.10 0.48 0.80 -0.62 0.00 0.00 0.00 174.94 175.69 1xxi s ASP 94 N 0.57 6.51 0.63 3.58 -1.08 -1.26 -1.74 116.67 123.87 1xxi s ASP 94 Ca -0.03 -3.11 0.17 0.00 -0.52 0.00 0.00 52.55 49.07 1xxi s ASP 94 Cb -0.14 -2.10 0.68 0.00 -1.46 0.00 0.00 42.92 39.90 1xxi s ASP 94 CO 0.03 -0.40 1.29 0.00 0.52 0.00 0.00 175.17 176.60 1xxi h ALA 95 N 7.09 2.44 -0.00 3.66 0.00 -1.80 -1.09 119.26 129.56 1xxi h ALA 95 Ca 0.11 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1xxi h ALA 95 Cb 0.95 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1xxi h ALA 95 CO 0.82 -1.29 -0.09 0.00 0.00 0.00 0.00 179.25 178.70 1xxi n ALA 96 N -1.96 2.67 -2.69 0.00 0.00 -1.26 -4.64 120.51 112.63 1xxi n ALA 96 Ca 0.12 -0.21 -0.42 0.00 0.00 0.00 0.00 53.44 52.93 1xxi n ALA 96 Cb 1.18 -1.39 -0.03 0.00 0.00 0.00 0.00 19.45 19.21 1xxi n ALA 96 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1xxi s SER 97 N -2.63 7.13 0.45 0.00 0.15 -0.41 -4.93 113.70 113.47 1xxi s SER 97 Ca 0.25 1.39 0.25 0.00 0.70 0.00 0.00 55.95 58.54 1xxi s SER 97 Cb 0.20 -2.50 0.84 0.00 -1.71 0.00 0.00 66.02 62.84 1xxi s SER 97 CO 0.50 -0.34 1.79 0.03 1.20 0.00 0.00 173.24 176.41 1xxi h ARG 98 N 7.06 0.00 0.00 5.44 3.08 -1.89 -3.27 114.38 124.80 1xxi h ARG 98 Ca -0.34 0.00 -0.25 0.00 0.07 0.00 0.00 59.98 59.46 1xxi h ARG 98 Cb 1.16 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 31.17 1xxi h ARG 98 CO 0.81 0.17 -1.44 1.15 -1.07 0.00 0.00 179.97 179.59 1xxi h THR 99 N 0.00 1.06 -0.87 2.04 2.02 -1.96 -3.37 112.91 111.83 1xxi h THR 99 Ca -0.00 -2.82 -0.46 0.00 0.77 0.00 0.00 66.41 63.89 1xxi h THR 99 Cb 0.80 2.50 -0.27 0.00 -1.74 0.00 0.00 68.15 69.45 1xxi h THR 99 CO 0.02 0.60 0.51 0.29 0.37 0.00 0.00 175.52 177.31 1xxi n LYS 100 N -3.12 2.20 -0.24 6.66 5.02 -1.23 -4.66 118.16 122.78 1xxi n LYS 100 Ca -0.11 -3.07 -0.03 0.00 -2.02 0.00 0.00 58.31 53.08 1xxi n LYS 100 Cb 0.99 -2.11 0.15 0.00 -0.02 0.00 0.00 35.03 34.04 1xxi n LYS 100 CO 0.00 0.00 0.00 -0.39 -0.52 0.00 0.00 177.40 176.49 1xxi h VAL 101 N 1.01 1.23 0.03 -0.18 -1.51 -1.73 -0.48 116.25 114.63 1xxi h VAL 101 Ca 0.55 -0.66 -0.00 0.00 -1.23 0.00 0.00 66.70 65.36 1xxi h VAL 101 Cb 2.51 0.29 0.00 0.00 -2.13 0.00 0.00 31.29 31.96 1xxi h VAL 101 CO 0.99 0.28 -0.02 -0.08 -1.23 0.00 0.00 177.57 177.51 1xxi h GLU 102 N 1.05 -0.04 -0.87 5.19 4.81 -1.93 -2.46 114.58 120.33 1xxi h GLU 102 Ca 0.26 0.00 0.13 0.00 -0.13 0.00 0.00 59.36 59.62 1xxi h GLU 102 Cb 0.11 0.01 -0.07 0.00 0.63 0.00 0.00 28.75 29.43 1xxi h GLU 102 CO -0.03 0.58 0.56 -0.44 -0.73 0.00 0.00 179.01 178.96 1xxi h ASP 103 N -0.73 0.67 0.02 1.04 3.32 -1.88 0.31 116.42 119.17 1xxi h ASP 103 Ca -0.00 0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.08 1xxi h ASP 103 Cb 0.65 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 40.10 1xxi h ASP 103 CO 0.01 0.35 -0.01 0.74 -1.72 0.00 0.00 179.24 178.61 1xxi h THR 104 N 0.72 1.07 -0.12 0.35 2.02 -1.09 -1.44 112.91 114.42 1xxi h THR 104 Ca 0.43 -0.27 -0.00 0.00 0.77 0.00 0.00 66.41 67.34 1xxi h THR 104 Cb 0.64 1.25 -0.01 0.00 -1.74 0.00 0.00 68.15 68.29 1xxi h THR 104 CO -0.19 0.07 0.06 -0.09 0.37 0.00 0.00 175.52 175.74 1xxi h ARG 105 N -0.15 0.16 0.09 6.66 2.43 -0.66 -2.95 114.38 119.97 1xxi h ARG 105 Ca -0.00 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1xxi h ARG 105 Cb 0.14 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.66 1xxi h ARG 105 CO 0.01 0.20 -0.04 -0.44 -1.51 0.00 0.00 179.97 178.18 1xxi h ASP 106 N 0.09 -0.10 -0.96 -3.80 3.32 -0.39 -2.32 116.42 112.25 1xxi h ASP 106 Ca 0.04 -0.15 0.10 0.00 0.02 0.00 0.00 57.03 57.04 1xxi h ASP 106 Cb 0.08 0.03 -0.07 0.00 0.22 0.00 0.00 39.33 39.59 1xxi h ASP 106 CO -0.01 0.09 0.62 -0.07 -1.72 0.00 0.00 179.24 178.15 1xxi h LEU 107 N -0.30 0.90 -0.72 1.55 3.38 -1.33 -0.24 115.31 118.56 1xxi h LEU 107 Ca -0.01 0.03 -0.05 0.00 0.09 0.00 0.00 57.88 57.94 1xxi h LEU 107 Cb 0.25 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1xxi h LEU 107 CO 0.02 0.51 -0.23 -0.07 0.09 0.00 0.00 178.44 178.77 1xxi h LEU 108 N 0.98 0.00 0.00 1.67 3.38 -1.44 -2.61 115.31 117.29 1xxi h LEU 108 Ca 0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.43 1xxi h LEU 108 Cb 0.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.16 1xxi h LEU 108 CO -0.22 0.23 -0.41 0.47 0.09 0.00 0.00 178.44 178.60 1xxi n ASP 109 N -3.27 0.42 -3.13 -0.43 8.00 -0.26 -4.36 116.55 113.51 1xxi n ASP 109 Ca 0.01 -0.05 -0.22 0.00 0.71 0.00 0.00 54.79 55.24 1xxi n ASP 109 Cb 0.50 0.08 -0.04 0.00 -0.02 0.00 0.00 41.12 41.64 1xxi n ASP 109 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1xxi n ASN 110 N -1.57 1.96 -4.74 -2.24 3.02 -0.28 -5.08 115.26 106.34 1xxi n ASN 110 Ca 0.06 -3.19 -0.42 0.00 -0.03 0.00 0.00 54.58 50.99 1xxi n ASN 110 Cb 0.35 -0.61 -0.02 0.00 -0.61 0.00 0.00 39.78 38.89 1xxi n ASN 110 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1xxi n VAL 111 N 0.28 0.91 -3.01 2.41 0.31 -1.19 -4.86 118.33 113.18 1xxi n VAL 111 Ca 0.27 -0.23 -0.44 0.00 -0.01 0.00 0.00 64.34 63.93 1xxi n VAL 111 Cb 0.56 -1.96 -0.04 0.00 -0.91 0.00 0.00 33.84 31.49 1xxi n VAL 111 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 1xxi s GLN 112 N -0.33 3.17 0.45 5.55 -0.21 -1.26 -4.93 119.66 122.10 1xxi s GLN 112 Ca 0.65 -1.27 0.31 0.00 0.02 0.00 0.00 55.36 55.07 1xxi s GLN 112 Cb -0.50 -4.35 1.59 0.00 1.00 0.00 0.00 33.01 30.75 1xxi s GLN 112 CO 0.47 -1.66 1.94 1.88 -2.12 0.00 0.00 175.29 175.80 1xxi h TYR 113 N 9.20 0.00 -3.18 0.91 -1.99 -1.99 -3.41 116.97 116.51 1xxi h TYR 113 Ca -0.21 0.00 -0.62 0.00 2.00 0.00 0.00 58.73 59.90 1xxi h TYR 113 Cb 1.07 0.00 -0.36 0.00 2.00 0.00 0.00 36.73 39.44 1xxi h TYR 113 CO 0.94 0.00 -0.83 0.00 -0.00 0.00 0.00 178.16 178.26 1xxi s ALA 114 N -3.73 1.97 0.61 3.88 0.00 -1.26 -4.46 121.76 118.78 1xxi s ALA 114 Ca -0.02 -1.03 -0.19 0.00 0.00 0.00 0.00 51.96 50.72 1xxi s ALA 114 Cb 0.09 -1.13 -0.02 0.00 0.00 0.00 0.00 23.12 22.06 1xxi s ALA 114 CO 0.34 -0.48 1.29 -2.30 0.00 0.00 0.00 175.76 174.61 1xxi n PRO 115 N 4.72 1.28 -0.03 0.00 -0.02 -1.26 -4.94 135.00 134.75 1xxi n PRO 115 Ca -0.17 0.49 -0.10 0.00 -2.02 0.00 0.00 63.50 61.70 1xxi n PRO 115 Cb 0.49 -2.52 -0.14 0.00 -0.02 0.00 0.00 33.50 31.31 1xxi n PRO 115 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1xxi n ALA 116 N -1.63 1.45 0.06 3.55 0.00 -1.26 -4.86 120.51 117.82 1xxi n ALA 116 Ca 0.14 -0.85 0.00 0.00 0.00 0.00 0.00 53.44 52.73 1xxi n ALA 116 Cb 0.47 -0.72 0.00 0.00 0.00 0.00 0.00 19.45 19.20 1xxi n ALA 116 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1xxi n ARG 117 N -3.03 0.00 -1.04 0.00 3.00 -1.26 -5.11 116.66 109.21 1xxi n ARG 117 Ca -0.21 0.00 -0.29 0.00 -0.00 0.00 0.00 57.85 57.34 1xxi n ARG 117 Cb 1.07 -0.16 0.17 0.00 0.00 0.00 0.00 32.46 33.54 1xxi n ARG 117 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 1xxi s GLY 118 N -4.14 1.60 0.15 5.14 0.00 -1.26 -4.98 107.32 103.82 1xxi s GLY 118 Ca 0.00 -0.06 -0.09 0.00 0.00 0.00 0.00 44.72 44.57 1xxi s GLY 118 CO 0.00 0.48 1.43 3.21 0.00 0.00 0.00 173.10 178.21 1xxi h ARG 119 N -1.81 0.75 -6.49 2.90 3.08 -1.82 -3.43 114.38 107.55 1xxi h ARG 119 Ca -0.52 -0.50 -0.64 0.00 0.07 0.00 0.00 59.98 58.40 1xxi h ARG 119 Cb 1.30 0.07 -0.15 0.00 0.08 0.00 0.00 29.97 31.26 1xxi h ARG 119 CO 0.53 1.12 -0.74 -0.06 -1.07 0.00 0.00 179.97 179.75 1xxi s PHE 120 N -4.01 2.58 -0.99 3.04 0.08 -1.26 -4.72 117.98 112.70 1xxi s PHE 120 Ca -0.09 -0.24 -0.05 0.00 0.12 0.00 0.00 56.93 56.66 1xxi s PHE 120 Cb 0.10 -1.28 0.25 0.00 -0.57 0.00 0.00 43.02 41.52 1xxi s PHE 120 CO 0.88 0.50 0.92 0.21 -0.10 0.00 0.00 175.22 177.63 1xxi s LYS 121 N -2.73 3.69 0.32 0.44 2.20 -0.55 -4.85 119.74 118.26 1xxi s LYS 121 Ca 0.24 -3.22 -0.29 0.00 -0.36 0.00 0.00 55.97 52.34 1xxi s LYS 121 Cb -0.09 -4.24 -0.10 0.00 -1.51 0.00 0.00 37.83 31.89 1xxi s LYS 121 CO 0.14 -1.25 1.30 0.08 -0.36 0.00 0.00 175.35 175.26 1xxi s VAL 122 N -1.25 2.77 -0.56 4.02 1.01 -1.19 -3.50 120.40 121.70 1xxi s VAL 122 Ca 0.28 0.76 0.04 0.00 0.00 0.00 0.00 61.98 63.07 1xxi s VAL 122 Cb -0.09 -3.49 0.15 0.00 0.00 0.00 0.00 36.38 32.96 1xxi s VAL 122 CO -0.10 0.18 0.35 -0.31 0.00 0.00 0.00 175.10 175.22 1xxi s TYR 123 N -1.02 2.82 -0.31 5.22 1.51 -1.01 -1.49 117.35 123.07 1xxi s TYR 123 Ca 0.50 -2.97 -0.29 0.00 -1.01 0.00 0.00 57.07 53.29 1xxi s TYR 123 Cb -0.39 -2.36 -0.00 0.00 -0.11 0.00 0.00 41.96 39.10 1xxi s TYR 123 CO 0.51 -0.69 1.36 -1.17 -1.11 0.00 0.00 175.55 174.45 1xxi s LEU 124 N -0.54 3.82 -0.20 -1.29 2.96 -0.48 -2.62 118.68 120.34 1xxi s LEU 124 Ca 0.22 1.18 0.01 0.00 -0.22 0.00 0.00 54.13 55.32 1xxi s LEU 124 Cb -0.14 -3.54 0.03 0.00 0.50 0.00 0.00 46.19 43.04 1xxi s LEU 124 CO -0.08 -1.17 -0.15 -0.63 -1.32 0.00 0.00 176.35 173.00 1xxi s ILE 125 N 4.67 1.91 -0.19 6.68 1.01 -0.87 -0.42 121.20 133.98 1xxi s ILE 125 Ca 0.59 -1.06 -0.22 0.00 0.00 0.00 0.00 60.65 59.96 1xxi s ILE 125 Cb -0.17 -1.86 -0.02 0.00 0.01 0.00 0.00 42.46 40.42 1xxi s ILE 125 CO 0.26 0.32 0.68 -0.62 0.00 0.00 0.00 174.94 175.57 1xxi s ASP 126 N 1.30 6.75 -0.46 3.58 -1.08 -0.71 -1.50 116.67 124.55 1xxi s ASP 126 Ca 0.01 0.91 -0.19 0.00 -0.52 0.00 0.00 52.55 52.75 1xxi s ASP 126 Cb -0.15 -2.37 0.03 0.00 -1.46 0.00 0.00 42.92 38.96 1xxi s ASP 126 CO -0.10 -0.31 0.62 -0.62 0.52 0.00 0.00 175.17 175.28 1xxi n GLU 127 N 5.12 -2.23 0.13 4.34 1.02 -0.10 -3.45 120.64 125.46 1xxi n GLU 127 Ca 0.00 1.94 0.13 0.00 -0.02 0.00 0.00 57.16 59.21 1xxi n GLU 127 Cb 0.49 -4.94 0.43 0.00 -0.02 0.00 0.00 31.44 27.40 1xxi n GLU 127 CO 0.00 0.00 0.00 -0.39 1.18 0.00 0.00 177.13 177.92 1xxi h VAL 128 N 1.90 0.00 0.00 2.62 -1.51 -1.71 -3.17 116.25 114.38 1xxi h VAL 128 Ca -0.12 -0.45 0.00 0.00 -1.23 0.00 0.00 66.70 64.90 1xxi h VAL 128 Cb 1.09 1.37 0.00 0.00 -2.13 0.00 0.00 31.29 31.61 1xxi h VAL 128 CO 0.21 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 176.55 1xxi n HIS 129 N -2.36 0.00 -0.85 5.19 1.44 -1.26 -1.91 115.22 115.47 1xxi n HIS 129 Ca 0.04 0.00 0.08 0.00 -2.01 0.00 0.00 57.72 55.83 1xxi n HIS 129 Cb 0.37 0.00 0.15 0.00 0.12 0.00 0.00 29.99 30.63 1xxi n HIS 129 CO 0.00 0.00 0.00 -1.33 -2.81 0.00 0.00 176.34 172.20 1xxi n MET 130 N -0.94 2.01 -2.66 -1.40 2.00 -1.20 -4.94 117.12 109.98 1xxi n MET 130 Ca 0.13 -2.47 -0.38 0.00 0.00 0.00 0.00 57.70 54.99 1xxi n MET 130 Cb 0.06 -1.50 -0.05 0.00 0.00 0.00 0.00 33.22 31.73 1xxi n MET 130 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 1xxi s LEU 131 N -2.50 4.42 0.36 4.03 1.43 -0.80 -4.72 118.68 120.90 1xxi s LEU 131 Ca 0.30 1.99 -0.28 0.00 -1.03 0.00 0.00 54.13 55.11 1xxi s LEU 131 Cb 0.25 -3.86 -0.11 0.00 0.03 0.00 0.00 46.19 42.49 1xxi s LEU 131 CO 0.05 -0.11 1.46 -1.54 0.23 0.00 0.00 176.35 176.44 1xxi n SER 132 N 0.80 3.58 0.10 2.29 3.41 -1.26 -4.72 113.62 117.82 1xxi n SER 132 Ca 0.01 1.21 0.19 0.00 -0.26 0.00 0.00 58.87 60.03 1xxi n SER 132 Cb 0.48 -1.59 0.65 0.00 -0.26 0.00 0.00 64.21 63.50 1xxi n SER 132 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 1xxi h ARG 133 N 3.09 0.00 0.02 4.33 3.08 -1.98 0.59 114.38 123.51 1xxi h ARG 133 Ca -0.49 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 59.56 1xxi h ARG 133 Cb 1.25 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.30 1xxi h ARG 133 CO 0.66 0.00 -0.01 0.45 -1.07 0.00 0.00 179.97 180.00 1xxi h HIS 134 N 0.00 -0.02 -0.00 3.04 3.86 -2.02 -3.23 115.15 116.77 1xxi h HIS 134 Ca 0.19 -0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.40 1xxi h HIS 134 Cb 1.40 0.01 0.00 0.00 1.06 0.00 0.00 27.41 29.88 1xxi h HIS 134 CO 0.00 0.65 -0.11 -1.13 0.86 0.00 0.00 177.93 178.20 1xxi n SER 135 N -4.77 0.25 0.03 2.45 3.41 -0.53 -3.59 113.62 110.88 1xxi n SER 135 Ca -0.09 -0.14 -0.20 0.00 -0.26 0.00 0.00 58.87 58.19 1xxi n SER 135 Cb 0.34 -0.19 -0.11 0.00 -0.26 0.00 0.00 64.21 63.99 1xxi n SER 135 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 1xxi h PHE 136 N 0.21 0.92 -0.11 7.33 3.57 -0.98 -3.15 116.94 124.73 1xxi h PHE 136 Ca 0.00 -0.51 -0.07 0.00 3.53 0.00 0.00 57.97 60.92 1xxi h PHE 136 Cb 0.40 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.03 1xxi h PHE 136 CO 0.00 1.34 -0.27 -0.91 -2.23 0.00 0.00 178.31 176.24 1xxi h ASN 137 N 0.24 0.20 -0.57 0.41 2.35 -1.61 -2.31 115.58 114.29 1xxi h ASN 137 Ca -0.12 -0.06 -0.04 0.00 -0.55 0.00 0.00 56.30 55.53 1xxi h ASN 137 Cb 1.60 -0.05 -0.03 0.00 0.05 0.00 0.00 38.32 39.89 1xxi h ASN 137 CO 0.18 0.47 0.22 0.00 -1.65 0.00 0.00 177.43 176.66 1xxi h ALA 138 N 1.55 1.25 -0.40 -0.83 0.00 -1.65 -0.42 119.26 118.75 1xxi h ALA 138 Ca 0.03 -0.17 -0.16 0.00 0.00 0.00 0.00 54.91 54.61 1xxi h ALA 138 Cb 0.57 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1xxi h ALA 138 CO 0.04 0.54 -0.37 1.25 0.00 0.00 0.00 179.25 180.72 1xxi h LEU 139 N 0.88 1.01 0.54 0.00 5.85 -1.42 -2.05 115.31 120.13 1xxi h LEU 139 Ca 0.20 -0.46 -0.02 0.00 0.84 0.00 0.00 57.88 58.45 1xxi h LEU 139 Cb 0.20 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.94 1xxi h LEU 139 CO -0.02 1.26 -0.38 -0.07 -0.34 0.00 0.00 178.44 178.89 1xxi h LEU 140 N 0.78 -0.98 -1.96 2.25 3.38 -0.88 0.21 115.31 118.11 1xxi h LEU 140 Ca 0.07 0.07 0.09 0.00 0.09 0.00 0.00 57.88 58.19 1xxi h LEU 140 Cb 0.96 0.30 -0.02 0.00 0.09 0.00 0.00 40.66 42.00 1xxi h LEU 140 CO 0.09 -0.57 0.25 0.11 0.09 0.00 0.00 178.44 178.41 1xxi h LYS 141 N -0.90 0.05 0.00 1.13 1.57 -1.08 -0.52 116.57 116.82 1xxi h LYS 141 Ca -0.06 -0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.60 1xxi h LYS 141 Cb 0.75 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 33.03 1xxi h LYS 141 CO 0.03 0.03 -0.82 1.15 -0.57 0.00 0.00 179.45 179.28 1xxi h THR 142 N 0.05 0.66 0.11 -0.16 2.02 -0.93 -3.34 112.91 111.32 1xxi h THR 142 Ca 0.16 -2.02 -0.28 0.00 0.77 0.00 0.00 66.41 65.04 1xxi h THR 142 Cb 0.59 2.22 0.02 0.00 -1.74 0.00 0.00 68.15 69.24 1xxi h THR 142 CO -0.01 0.37 -1.20 -0.07 0.37 0.00 0.00 175.52 174.98 1xxi h LEU 143 N 0.00 0.71 -0.77 2.58 3.38 0.62 -2.38 115.31 119.45 1xxi h LEU 143 Ca -0.06 -0.66 0.04 0.00 0.09 0.00 0.00 57.88 57.29 1xxi h LEU 143 Cb 1.41 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 41.89 1xxi h LEU 143 CO 0.05 1.49 0.48 -0.08 0.09 0.00 0.00 178.44 180.46 1xxi h GLU 144 N 0.21 0.88 -2.49 1.13 4.57 -1.49 -3.35 114.58 114.04 1xxi h GLU 144 Ca -0.16 -0.05 -0.57 0.00 -1.18 0.00 0.00 59.36 57.40 1xxi h GLU 144 Cb 1.88 -0.20 -0.38 0.00 -0.16 0.00 0.00 28.75 29.89 1xxi h GLU 144 CO 0.22 0.58 -0.86 -1.21 -1.18 0.00 0.00 179.01 176.56 1xxi s GLU 145 N -6.10 0.61 0.02 1.92 2.02 -1.24 -5.13 118.70 110.80 1xxi s GLU 145 Ca -0.13 -1.44 -0.08 0.00 0.02 0.00 0.00 54.97 53.35 1xxi s GLU 145 Cb 0.17 -1.27 -0.05 0.00 0.10 0.00 0.00 34.13 33.07 1xxi s GLU 145 CO 0.78 -1.24 0.30 -1.25 0.02 0.00 0.00 175.26 173.86 1xxi s PRO 146 N 0.91 3.63 0.87 0.39 0.04 -0.90 -4.73 135.00 135.21 1xxi s PRO 146 Ca 0.21 -0.00 -0.11 0.00 0.04 0.00 0.00 61.00 61.14 1xxi s PRO 146 Cb -0.18 -3.07 0.12 0.00 0.04 0.00 0.00 34.50 31.41 1xxi s PRO 146 CO -0.03 0.63 1.10 -1.25 0.04 0.00 0.00 177.00 177.49 1xxi s PRO 147 N -1.74 1.42 0.46 0.56 0.04 -1.26 -4.94 135.00 129.54 1xxi s PRO 147 Ca 0.28 1.09 0.22 0.00 0.04 0.00 0.00 61.00 62.63 1xxi s PRO 147 Cb -0.13 -1.81 1.13 0.00 0.04 0.00 0.00 34.50 33.73 1xxi s PRO 147 CO 0.16 -2.21 1.95 0.93 0.04 0.00 0.00 177.00 177.88 1xxi h GLU 148 N -1.54 0.00 0.00 4.56 5.08 -1.99 -3.09 114.58 117.60 1xxi h GLU 148 Ca -0.47 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 57.66 1xxi h GLU 148 Cb 1.26 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.48 1xxi h GLU 148 CO 0.51 0.21 -1.26 1.12 -1.00 0.00 0.00 179.01 178.59 1xxi h HIS 149 N 0.00 0.00 -3.25 4.33 2.07 -1.89 -3.47 115.15 112.94 1xxi h HIS 149 Ca -0.00 0.00 -0.57 0.00 -2.85 0.00 0.00 60.37 56.94 1xxi h HIS 149 Cb 0.50 0.00 -0.05 0.00 2.57 0.00 0.00 27.41 30.43 1xxi h HIS 149 CO 0.00 0.96 -0.04 0.08 -3.07 0.00 0.00 177.93 175.86 1xxi s VAL 150 N -2.69 4.81 0.02 6.12 1.01 -1.17 -1.49 120.40 127.01 1xxi s VAL 150 Ca -0.01 1.20 0.00 0.00 0.00 0.00 0.00 61.98 63.17 1xxi s VAL 150 Cb 0.09 -3.90 -0.02 0.00 0.00 0.00 0.00 36.38 32.56 1xxi s VAL 150 CO 0.82 0.51 -0.03 -0.54 0.00 0.00 0.00 175.10 175.86 1xxi s LYS 151 N -0.81 0.28 0.06 2.72 -0.14 -1.23 -4.68 119.74 115.95 1xxi s LYS 151 Ca 0.29 -0.54 0.06 0.00 -1.36 0.00 0.00 55.97 54.42 1xxi s LYS 151 Cb -0.19 0.08 -0.04 0.00 -1.68 0.00 0.00 37.83 36.01 1xxi s LYS 151 CO 0.18 -0.04 -0.12 -0.06 -0.76 0.00 0.00 175.35 174.55 1xxi s PHE 152 N -1.28 2.72 -0.46 3.18 0.08 -0.01 -2.42 117.98 119.80 1xxi s PHE 152 Ca -0.14 -0.16 0.03 0.00 0.12 0.00 0.00 56.93 56.78 1xxi s PHE 152 Cb -0.09 -1.48 0.15 0.00 -0.57 0.00 0.00 43.02 41.03 1xxi s PHE 152 CO -0.01 0.37 0.30 -0.51 -0.10 0.00 0.00 175.22 175.27 1xxi s LEU 153 N -1.81 2.45 0.20 -0.37 1.43 -1.08 -1.37 118.68 118.13 1xxi s LEU 153 Ca 0.18 -2.88 -0.25 0.00 -1.03 0.00 0.00 54.13 50.16 1xxi s LEU 153 Cb -0.11 -0.88 -0.08 0.00 0.03 0.00 0.00 46.19 45.15 1xxi s LEU 153 CO 0.10 -0.22 0.80 -0.76 0.23 0.00 0.00 176.35 176.50 1xxi s LEU 154 N 0.08 4.52 0.16 1.79 1.43 0.73 -2.06 118.68 125.34 1xxi s LEU 154 Ca 0.23 1.64 0.08 0.00 -1.03 0.00 0.00 54.13 55.05 1xxi s LEU 154 Cb -0.13 -3.46 -0.04 0.00 0.03 0.00 0.00 46.19 42.58 1xxi s LEU 154 CO -0.08 0.14 -0.16 0.00 0.23 0.00 0.00 176.35 176.48 1xxi s ALA 155 N -1.28 1.87 -0.09 4.21 0.00 -0.56 0.79 121.76 126.70 1xxi s ALA 155 Ca 0.39 -1.49 -0.30 0.00 0.00 0.00 0.00 51.96 50.56 1xxi s ALA 155 Cb -0.21 -0.13 0.10 0.00 0.00 0.00 0.00 23.12 22.88 1xxi s ALA 155 CO 0.25 0.15 0.85 0.99 0.00 0.00 0.00 175.76 178.01 1xxi s THR 156 N -2.34 0.00 -0.08 0.00 2.01 -0.85 -0.93 115.64 113.45 1xxi s THR 156 Ca 0.16 0.00 0.21 0.00 0.31 0.00 0.00 61.69 62.37 1xxi s THR 156 Cb -0.04 -1.00 -0.29 0.00 0.01 0.00 0.00 72.50 71.18 1xxi s THR 156 CO 0.06 0.00 0.44 0.41 -0.69 0.00 0.00 174.62 174.84 1xxi n THR 157 N 0.68 0.38 -3.49 -0.82 -1.04 -1.26 -2.37 114.28 106.36 1xxi n THR 157 Ca -0.14 -0.59 -0.28 0.00 -2.04 0.00 0.00 64.05 61.01 1xxi n THR 157 Cb 0.58 -0.15 -0.13 0.00 -1.82 0.00 0.00 70.33 68.81 1xxi n THR 157 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1xxi s ASP 158 N -4.82 3.10 0.62 8.00 2.15 -1.26 -4.62 116.67 119.84 1xxi s ASP 158 Ca -0.08 -1.60 0.39 0.00 0.43 0.00 0.00 52.55 51.69 1xxi s ASP 158 Cb 0.12 -0.27 2.03 0.00 -0.30 0.00 0.00 42.92 44.50 1xxi s ASP 158 CO 0.88 -0.38 2.24 -0.65 -0.17 0.00 0.00 175.17 177.09 1xxi h PRO 159 N 7.82 0.00 0.00 4.34 0.11 -1.97 -2.94 132.00 139.36 1xxi h PRO 159 Ca -0.09 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.94 1xxi h PRO 159 Cb 1.00 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.10 1xxi h PRO 159 CO 0.36 0.01 -0.41 1.96 -0.21 0.00 0.00 178.00 179.71 1xxi h GLN 160 N 0.00 0.00 0.00 1.05 4.20 -2.01 -2.98 115.11 115.37 1xxi h GLN 160 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1xxi h GLN 160 Cb 0.16 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.94 1xxi h GLN 160 CO 0.00 0.41 0.00 1.63 -0.67 0.00 0.00 178.83 180.20 1xxi n LYS 161 N -3.41 0.93 -3.88 1.46 5.02 -1.11 -4.67 118.16 112.50 1xxi n LYS 161 Ca 0.01 0.00 -0.36 0.00 -2.02 0.00 0.00 58.31 55.94 1xxi n LYS 161 Cb 0.58 -1.21 -0.11 0.00 -0.02 0.00 0.00 35.03 34.27 1xxi n LYS 161 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1xxi s LEU 162 N -1.41 3.66 0.38 -0.35 1.43 -1.13 -4.84 118.68 116.41 1xxi s LEU 162 Ca 0.19 -0.06 -0.27 0.00 -1.03 0.00 0.00 54.13 52.95 1xxi s LEU 162 Cb 0.08 -1.96 -0.11 0.00 0.03 0.00 0.00 46.19 44.24 1xxi s LEU 162 CO 0.14 0.06 1.36 -0.81 0.23 0.00 0.00 176.35 177.33 1xxi n PRO 163 N 4.29 2.27 0.15 1.29 -0.04 -1.26 -4.78 135.00 136.91 1xxi n PRO 163 Ca -0.16 0.80 0.19 0.00 -0.04 0.00 0.00 63.50 64.29 1xxi n PRO 163 Cb 0.52 -2.47 0.77 0.00 -0.04 0.00 0.00 33.50 32.28 1xxi n PRO 163 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1xxi h VAL 164 N 2.55 0.33 0.00 0.52 2.07 -1.96 0.14 116.25 119.90 1xxi h VAL 164 Ca -0.48 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.01 1xxi h VAL 164 Cb 1.27 0.68 -0.00 0.00 -1.52 0.00 0.00 31.29 31.72 1xxi h VAL 164 CO 0.62 0.00 -0.11 0.71 0.02 0.00 0.00 177.57 178.81 1xxi h THR 165 N 0.00 0.64 0.00 2.57 1.35 -2.00 -2.50 112.91 112.97 1xxi h THR 165 Ca 0.15 -0.46 -0.34 0.00 -0.55 0.00 0.00 66.41 65.20 1xxi h THR 165 Cb 0.91 1.29 -0.05 0.00 -1.73 0.00 0.00 68.15 68.57 1xxi h THR 165 CO -0.00 0.11 -1.88 -0.38 -0.25 0.00 0.00 175.52 173.12 1xxi n ILE 166 N -3.78 1.54 -0.25 6.82 5.41 0.45 -4.27 119.36 125.28 1xxi n ILE 166 Ca -0.02 -0.21 0.06 0.00 1.00 0.00 0.00 62.75 63.57 1xxi n ILE 166 Cb 0.21 -1.95 0.18 0.00 -0.71 0.00 0.00 39.64 37.37 1xxi n ILE 166 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1xxi h LEU 167 N -0.96 -0.09 -1.93 1.39 3.38 -1.48 0.33 115.31 115.96 1xxi h LEU 167 Ca -0.52 0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.62 1xxi h LEU 167 Cb 1.47 0.24 0.00 0.00 0.09 0.00 0.00 40.66 42.46 1xxi h LEU 167 CO -0.30 -0.09 0.00 0.77 0.09 0.00 0.00 178.44 178.91 1xxi h SER 168 N 0.21 0.00 0.01 -0.43 4.64 -1.67 -2.64 113.55 113.67 1xxi h SER 168 Ca 0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.74 1xxi h SER 168 Cb 0.73 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.82 1xxi h SER 168 CO -0.56 0.00 -0.06 0.54 -0.87 0.00 0.00 176.83 175.88 1xxi n ARG 169 N -2.80 1.76 -4.38 4.77 1.74 0.12 -4.94 116.66 112.93 1xxi n ARG 169 Ca -0.01 -1.23 -0.22 0.00 -0.77 0.00 0.00 57.85 55.62 1xxi n ARG 169 Cb 0.15 -1.47 -0.11 0.00 -1.02 0.00 0.00 32.46 30.01 1xxi n ARG 169 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1xxi s LEU 171 N -3.01 4.87 0.40 0.00 2.96 0.13 -4.85 118.68 119.18 1xxi s LEU 171 Ca 0.21 -1.38 -0.24 0.00 -0.22 0.00 0.00 54.13 52.49 1xxi s LEU 171 Cb -0.05 -2.38 -0.09 0.00 0.50 0.00 0.00 46.19 44.18 1xxi s LEU 171 CO 0.09 -1.25 1.10 -1.10 -1.32 0.00 0.00 176.35 173.87 1xxi s GLN 172 N 3.29 4.10 -0.09 1.98 -0.21 -1.26 -2.20 119.66 125.28 1xxi s GLN 172 Ca 0.21 1.64 -0.03 0.00 0.02 0.00 0.00 55.36 57.20 1xxi s GLN 172 Cb -0.16 -2.59 0.05 0.00 1.00 0.00 0.00 33.01 31.31 1xxi s GLN 172 CO 0.04 -0.23 0.15 -0.06 -2.12 0.00 0.00 175.29 173.08 1xxi s PHE 173 N -1.56 -0.15 -0.35 0.91 0.08 0.87 -4.92 117.98 112.87 1xxi s PHE 173 Ca 0.58 0.53 -0.17 0.00 0.12 0.00 0.00 56.93 57.99 1xxi s PHE 173 Cb -0.26 -0.30 -0.00 0.00 -0.57 0.00 0.00 43.02 41.89 1xxi s PHE 173 CO 0.32 -0.28 0.46 -1.58 -0.10 0.00 0.00 175.22 174.03 1xxi s HIS 174 N 2.28 3.19 -0.56 0.36 2.46 -1.26 -1.19 115.29 120.57 1xxi s HIS 174 Ca 0.03 0.08 -0.20 0.00 0.47 0.00 0.00 55.06 55.44 1xxi s HIS 174 Cb -0.12 -2.84 0.07 0.00 -0.13 0.00 0.00 32.58 29.56 1xxi s HIS 174 CO -0.06 -0.51 0.73 -0.51 -2.47 0.00 0.00 174.74 171.92 1xxi s LEU 175 N 2.25 4.91 0.66 8.88 1.43 -0.05 -4.97 118.68 131.79 1xxi s LEU 175 Ca 0.16 -1.01 -0.15 0.00 -1.03 0.00 0.00 54.13 52.10 1xxi s LEU 175 Cb -0.16 -2.45 -0.00 0.00 0.03 0.00 0.00 46.19 43.61 1xxi s LEU 175 CO 0.13 -1.07 1.11 -0.54 0.23 0.00 0.00 176.35 176.21 1xxi s LYS 176 N 2.99 2.80 1.05 1.70 1.02 -1.26 -4.52 119.74 123.52 1xxi s LYS 176 Ca 0.17 1.40 -0.15 0.00 0.02 0.00 0.00 55.97 57.41 1xxi s LYS 176 Cb -0.20 -1.95 0.21 0.00 -0.52 0.00 0.00 37.83 35.38 1xxi s LYS 176 CO 0.11 -1.26 1.12 0.00 -0.92 0.00 0.00 175.35 174.41 1xxi s ALA 177 N -2.32 1.07 0.03 5.17 0.00 -1.26 -4.98 121.76 119.46 1xxi s ALA 177 Ca 0.67 -0.66 0.00 0.00 0.00 0.00 0.00 51.96 51.98 1xxi s ALA 177 Cb -0.21 -3.00 -0.04 0.00 0.00 0.00 0.00 23.12 19.88 1xxi s ALA 177 CO 0.41 -2.97 0.12 -0.51 0.00 0.00 0.00 175.76 172.82 1xxi s LEU 178 N -6.50 4.04 0.69 0.00 1.43 -1.25 -5.07 118.68 112.03 1xxi s LEU 178 Ca 0.68 0.16 -0.11 0.00 -1.03 0.00 0.00 54.13 53.82 1xxi s LEU 178 Cb -0.14 -2.53 0.01 0.00 0.03 0.00 0.00 46.19 43.56 1xxi s LEU 178 CO 0.56 0.22 1.07 -0.62 0.23 0.00 0.00 176.35 177.80 1xxi s ASP 179 N -2.12 5.28 0.04 2.29 2.15 -1.26 -4.24 116.67 118.80 1xxi s ASP 179 Ca 0.28 1.69 -0.23 0.00 0.43 0.00 0.00 52.55 54.71 1xxi s ASP 179 Cb -0.12 -2.51 -0.13 0.00 -0.30 0.00 0.00 42.92 39.86 1xxi s ASP 179 CO 0.20 -1.51 1.35 0.58 -0.17 0.00 0.00 175.17 175.62 1xxi h VAL 180 N -0.62 0.00 0.00 1.11 2.07 -1.98 -2.39 116.25 114.44 1xxi h VAL 180 Ca -0.44 -0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.08 1xxi h VAL 180 Cb 1.22 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.99 1xxi h VAL 180 CO 0.56 0.00 0.00 -0.62 0.02 0.00 0.00 177.57 177.53 1xxi n GLU 181 N -4.27 0.62 -0.03 1.57 1.02 -1.26 -0.45 120.64 117.85 1xxi n GLU 181 Ca -0.10 0.00 0.02 0.00 -0.02 0.00 0.00 57.16 57.05 1xxi n GLU 181 Cb 0.33 -1.17 -0.11 0.00 -0.02 0.00 0.00 31.44 30.47 1xxi n GLU 181 CO 0.00 0.00 0.00 0.94 1.18 0.00 0.00 177.13 179.25 1xxi n GLN 182 N -0.13 0.98 -0.02 3.49 7.27 -1.02 -3.52 117.38 124.42 1xxi n GLN 182 Ca 0.00 -0.08 -0.18 0.00 0.07 0.00 0.00 57.00 56.80 1xxi n GLN 182 Cb 0.08 -1.34 -0.14 0.00 2.41 0.00 0.00 30.24 31.25 1xxi n GLN 182 CO 0.00 0.00 0.00 -0.89 0.07 0.00 0.00 177.06 176.24 1xxi n ILE 183 N -2.20 1.70 0.31 1.69 5.41 0.10 -3.37 119.36 122.99 1xxi n ILE 183 Ca -0.10 -0.67 -0.17 0.00 1.00 0.00 0.00 62.75 62.81 1xxi n ILE 183 Cb 0.60 -1.53 -0.08 0.00 -0.71 0.00 0.00 39.64 37.91 1xxi n ILE 183 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 176.55 176.46 1xxi h ARG 184 N 0.05 -0.77 -0.82 0.38 1.12 -0.96 0.28 114.38 113.65 1xxi h ARG 184 Ca -0.43 0.05 0.18 0.00 -1.11 0.00 0.00 59.98 58.67 1xxi h ARG 184 Cb 2.02 0.18 -0.05 0.00 -0.01 0.00 0.00 29.97 32.10 1xxi h ARG 184 CO 0.06 -0.52 0.55 1.25 -3.11 0.00 0.00 179.97 178.20 1xxi h HIS 185 N -0.80 0.44 -0.02 2.20 2.76 -1.74 0.92 115.15 118.92 1xxi h HIS 185 Ca -0.07 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.11 1xxi h HIS 185 Cb 0.65 -0.14 0.00 0.00 1.55 0.00 0.00 27.41 29.47 1xxi h HIS 185 CO -0.08 0.14 -0.04 0.37 -1.30 0.00 0.00 177.93 177.02 1xxi h GLN 186 N 0.35 0.05 -0.68 5.26 5.75 -1.34 -2.66 115.11 121.85 1xxi h GLN 186 Ca 0.41 -0.04 0.01 0.00 -0.15 0.00 0.00 58.65 58.89 1xxi h GLN 186 Cb 1.08 0.01 -0.03 0.00 1.07 0.00 0.00 27.48 29.60 1xxi h GLN 186 CO -0.13 0.65 0.45 -0.07 -2.65 0.00 0.00 178.83 177.08 1xxi h LEU 187 N -0.53 0.77 -0.28 -2.39 3.38 0.17 -0.10 115.31 116.34 1xxi h LEU 187 Ca -0.00 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 1xxi h LEU 187 Cb 0.65 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 1xxi h LEU 187 CO 0.01 0.56 -0.01 -0.08 0.09 0.00 0.00 178.44 179.00 1xxi h GLU 188 N 0.91 0.50 0.16 1.13 4.81 -0.96 -0.64 114.58 120.49 1xxi h GLU 188 Ca 0.25 -0.17 -0.00 0.00 -0.13 0.00 0.00 59.36 59.32 1xxi h GLU 188 Cb -0.08 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.25 1xxi h GLU 188 CO -0.06 0.67 -0.10 1.25 -0.73 0.00 0.00 179.01 180.03 1xxi h HIS 189 N 0.27 -0.27 -0.55 0.92 2.76 -1.04 0.20 115.15 117.45 1xxi h HIS 189 Ca 0.08 -0.00 0.02 0.00 -2.20 0.00 0.00 60.37 58.26 1xxi h HIS 189 Cb 0.45 0.10 -0.03 0.00 1.55 0.00 0.00 27.41 29.47 1xxi h HIS 189 CO 0.04 -0.16 0.35 0.82 -1.30 0.00 0.00 177.93 177.67 1xxi h ILE 190 N -0.26 1.10 -0.15 6.26 2.04 -0.97 0.11 117.51 125.65 1xxi h ILE 190 Ca -0.01 -0.24 -0.07 0.00 1.00 0.00 0.00 64.86 65.54 1xxi h ILE 190 Cb 0.22 0.34 -0.01 0.00 -0.74 0.00 0.00 36.82 36.63 1xxi h ILE 190 CO 0.01 0.13 -0.22 -0.07 0.00 0.00 0.00 178.15 178.00 1xxi h LEU 191 N 0.70 0.25 -0.89 1.44 3.38 -0.83 -2.13 115.31 117.23 1xxi h LEU 191 Ca 0.21 -0.07 -0.12 0.00 0.09 0.00 0.00 57.88 58.00 1xxi h LEU 191 Cb -0.03 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 1xxi h LEU 191 CO -0.07 0.48 -0.46 0.78 0.09 0.00 0.00 178.44 179.25 1xxi h ASN 192 N 0.23 0.22 1.18 -0.43 2.35 0.64 -2.00 115.58 117.78 1xxi h ASN 192 Ca 0.04 -0.10 0.00 0.00 -0.55 0.00 0.00 56.30 55.69 1xxi h ASN 192 Cb 0.52 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 38.83 1xxi h ASN 192 CO 0.04 0.66 -0.23 -0.62 -1.65 0.00 0.00 177.43 175.62 1xxi n GLU 193 N -3.98 0.23 0.00 0.81 1.02 -0.10 -3.30 120.64 115.33 1xxi n GLU 193 Ca -0.02 0.14 0.11 0.00 -0.02 0.00 0.00 57.16 57.38 1xxi n GLU 193 Cb 0.51 -1.72 0.07 0.00 -0.02 0.00 0.00 31.44 30.28 1xxi n GLU 193 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1xxi n GLU 194 N -2.10 1.30 -3.38 3.49 -0.58 -0.85 -4.98 120.64 113.54 1xxi n GLU 194 Ca 0.05 -1.04 -0.17 0.00 -0.42 0.00 0.00 57.16 55.58 1xxi n GLU 194 Cb 0.42 -1.48 0.09 0.00 -0.57 0.00 0.00 31.44 29.90 1xxi n GLU 194 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 1xxi n HIS 195 N 0.06 -2.15 -5.04 -0.32 8.25 -0.88 -5.01 115.22 110.12 1xxi n HIS 195 Ca 0.10 0.90 -0.32 0.00 -0.26 0.00 0.00 57.72 58.14 1xxi n HIS 195 Cb 0.47 -4.94 -0.16 0.00 1.12 0.00 0.00 29.99 26.47 1xxi n HIS 195 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1xxi s ILE 196 N -3.34 2.43 0.96 1.59 1.01 -0.81 -5.07 121.20 117.98 1xxi s ILE 196 Ca 0.05 -0.89 -0.11 0.00 0.00 0.00 0.00 60.65 59.71 1xxi s ILE 196 Cb -0.02 -1.97 0.17 0.00 0.01 0.00 0.00 42.46 40.65 1xxi s ILE 196 CO 0.70 0.55 1.11 0.00 0.00 0.00 0.00 174.94 177.29 1xxi s ALA 197 N 0.35 1.11 -0.21 9.38 0.00 -1.26 -4.62 121.76 126.51 1xxi s ALA 197 Ca -0.16 0.35 -0.35 0.00 0.00 0.00 0.00 51.96 51.80 1xxi s ALA 197 Cb -0.17 -3.37 0.15 0.00 0.00 0.00 0.00 23.12 19.73 1xxi s ALA 197 CO 0.08 -2.88 1.25 -3.38 0.00 0.00 0.00 175.76 170.82 1xxi s HIS 198 N -2.65 -0.11 -0.14 0.00 -3.43 -1.26 -2.68 115.29 105.01 1xxi s HIS 198 Ca 0.66 0.08 0.00 0.00 -0.80 0.00 0.00 55.06 55.00 1xxi s HIS 198 Cb -0.22 0.51 -0.01 0.00 -1.43 0.00 0.00 32.58 31.43 1xxi s HIS 198 CO 0.59 -0.16 -0.14 -1.21 -2.00 0.00 0.00 174.74 171.82 1xxi s GLU 199 N -2.20 3.31 0.58 -0.38 2.02 -1.11 -5.01 118.70 115.90 1xxi s GLU 199 Ca 0.09 -0.72 0.29 0.00 0.02 0.00 0.00 54.97 54.65 1xxi s GLU 199 Cb -0.01 -2.63 1.50 0.00 0.10 0.00 0.00 34.13 33.09 1xxi s GLU 199 CO -0.04 0.13 1.94 -1.00 0.02 0.00 0.00 175.26 176.30 1xxi h PRO 200 N 6.97 0.00 0.00 0.39 0.13 -1.99 0.03 132.00 137.54 1xxi h PRO 200 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1xxi h PRO 200 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1xxi h PRO 200 CO 0.56 0.00 -0.12 -2.13 -0.23 0.00 0.00 178.00 176.08 1xxi n ARG 201 N -3.80 0.18 0.14 0.86 0.63 -1.26 -2.65 116.66 110.76 1xxi n ARG 201 Ca 0.08 0.13 -0.25 0.00 -0.92 0.00 0.00 57.85 56.89 1xxi n ARG 201 Cb 0.62 -1.69 -0.16 0.00 0.45 0.00 0.00 32.46 31.69 1xxi n ARG 201 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1xxi h ALA 202 N 2.68 -0.14 -0.47 5.13 0.00 -1.33 -3.17 119.26 121.96 1xxi h ALA 202 Ca 0.00 -0.88 -0.12 0.00 0.00 0.00 0.00 54.91 53.91 1xxi h ALA 202 Cb 0.66 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 1xxi h ALA 202 CO 0.00 0.72 -0.20 -0.07 0.00 0.00 0.00 179.25 179.70 1xxi h LEU 203 N 0.15 0.96 -0.61 0.00 3.38 -1.42 -1.89 115.31 115.87 1xxi h LEU 203 Ca -0.26 -0.35 0.00 0.00 0.09 0.00 0.00 57.88 57.36 1xxi h LEU 203 Cb 2.17 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 42.63 1xxi h LEU 203 CO 0.27 1.12 0.39 -0.61 0.09 0.00 0.00 178.44 179.71 1xxi h GLN 204 N 0.82 0.82 -0.85 1.13 5.75 -1.61 0.55 115.11 121.72 1xxi h GLN 204 Ca 0.11 -0.06 -0.01 0.00 -0.15 0.00 0.00 58.65 58.54 1xxi h GLN 204 Cb 0.75 -0.18 -0.04 0.00 1.07 0.00 0.00 27.48 29.08 1xxi h GLN 204 CO 0.06 0.56 0.50 -0.07 -2.65 0.00 0.00 178.83 177.24 1xxi h LEU 205 N 0.83 1.03 -0.55 -2.39 3.38 -1.47 0.11 115.31 116.26 1xxi h LEU 205 Ca 0.22 -0.07 -0.16 0.00 0.09 0.00 0.00 57.88 57.97 1xxi h LEU 205 Cb -0.06 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.41 1xxi h LEU 205 CO -0.05 0.80 -0.69 -0.07 0.09 0.00 0.00 178.44 178.53 1xxi h LEU 206 N 1.18 0.23 -0.93 1.67 3.38 -0.66 0.22 115.31 120.39 1xxi h LEU 206 Ca 0.31 -0.15 -0.10 0.00 0.09 0.00 0.00 57.88 58.03 1xxi h LEU 206 Cb -0.03 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 1xxi h LEU 206 CO -0.06 0.84 -0.48 0.00 0.09 0.00 0.00 178.44 178.84 1xxi h ALA 207 N 1.15 1.05 0.16 1.53 0.00 0.97 -3.02 119.26 121.11 1xxi h ALA 207 Ca -0.02 -0.44 -0.34 0.00 0.00 0.00 0.00 54.91 54.12 1xxi h ALA 207 Cb 1.23 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1xxi h ALA 207 CO 0.10 0.60 -1.72 0.00 0.00 0.00 0.00 179.25 178.24 1xxi h ARG 208 N 0.00 0.34 -0.82 0.00 3.08 -0.65 -3.38 114.38 112.94 1xxi h ARG 208 Ca -0.00 -0.57 0.09 0.00 0.07 0.00 0.00 59.98 59.56 1xxi h ARG 208 Cb 0.94 0.21 -0.11 0.00 0.08 0.00 0.00 29.97 31.09 1xxi h ARG 208 CO 0.06 1.28 -0.55 0.00 -1.07 0.00 0.00 179.97 179.69 1xxi h ALA 209 N 0.06 -0.52 -2.65 0.04 0.00 -0.46 -3.33 119.26 112.40 1xxi h ALA 209 Ca -0.35 0.10 -0.53 0.00 0.00 0.00 0.00 54.91 54.13 1xxi h ALA 209 Cb 2.00 1.25 -0.03 0.00 0.00 0.00 0.00 17.79 21.01 1xxi h ALA 209 CO 0.13 -0.95 0.24 0.00 0.00 0.00 0.00 179.25 178.68 1xxi s ALA 210 N -5.60 3.34 -0.66 0.00 0.00 -1.15 -4.99 121.76 112.69 1xxi s ALA 210 Ca -0.13 0.42 -0.15 0.00 0.00 0.00 0.00 51.96 52.09 1xxi s ALA 210 Cb 0.11 -3.10 0.17 0.00 0.00 0.00 0.00 23.12 20.30 1xxi s ALA 210 CO 0.63 0.08 0.62 -2.00 0.00 0.00 0.00 175.76 175.08 1xxi s GLU 211 N -0.26 3.25 -1.86 0.00 2.12 -1.25 -4.50 118.70 116.19 1xxi s GLU 211 Ca 0.41 -2.01 0.00 0.00 0.36 0.00 0.00 54.97 53.73 1xxi s GLU 211 Cb -0.22 -4.36 0.00 0.00 0.26 0.00 0.00 34.13 29.81 1xxi s GLU 211 CO 0.26 -1.32 0.00 0.41 -0.54 0.00 0.00 175.26 174.07 1xxi n GLY 212 N 4.73 0.73 2.91 -1.50 0.00 -1.26 -4.91 105.19 105.90 1xxi n GLY 212 Ca -0.02 -0.08 -0.29 0.00 0.00 0.00 0.00 46.02 45.63 1xxi n GLY 212 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xxi s SER 213 N -2.46 4.39 0.48 1.61 1.04 -1.26 -3.81 113.70 113.68 1xxi s SER 213 Ca 0.00 -3.25 0.21 0.00 0.48 0.00 0.00 55.95 53.39 1xxi s SER 213 Cb 0.00 -1.58 1.23 0.00 0.10 0.00 0.00 66.02 65.77 1xxi s SER 213 CO 0.00 -0.19 1.94 0.25 0.98 0.00 0.00 173.24 176.22 1xxi h LEU 214 N 6.16 0.20 0.45 2.42 5.85 -1.93 0.98 115.31 129.44 1xxi h LEU 214 Ca -0.00 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.72 1xxi h LEU 214 Cb 0.85 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.83 1xxi h LEU 214 CO 0.68 0.10 -0.46 0.03 -0.34 0.00 0.00 178.44 178.45 1xxi h ARG 215 N 0.21 -0.87 -0.62 1.25 3.08 -1.94 -2.18 114.38 113.31 1xxi h ARG 215 Ca 0.34 0.06 0.11 0.00 0.07 0.00 0.00 59.98 60.56 1xxi h ARG 215 Cb 1.04 0.20 -0.04 0.00 0.08 0.00 0.00 29.97 31.25 1xxi h ARG 215 CO -0.07 -0.58 0.42 -0.44 -1.07 0.00 0.00 179.97 178.23 1xxi h ASP 216 N -0.91 0.34 -0.28 7.04 3.32 -1.40 -1.19 116.42 123.36 1xxi h ASP 216 Ca -0.06 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.00 1xxi h ASP 216 Cb 0.79 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.26 1xxi h ASP 216 CO -0.06 0.20 0.16 0.00 -1.72 0.00 0.00 179.24 177.82 1xxi h ALA 217 N 1.69 0.35 0.29 3.45 0.00 -0.33 0.34 119.26 125.05 1xxi h ALA 217 Ca 0.29 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 1xxi h ALA 217 Cb 0.64 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1xxi h ALA 217 CO -0.08 -0.14 -0.14 -0.07 0.00 0.00 0.00 179.25 178.82 1xxi h LEU 218 N 0.35 -0.33 -0.88 0.00 3.38 -0.76 0.39 115.31 117.46 1xxi h LEU 218 Ca 0.10 -0.11 0.19 0.00 0.09 0.00 0.00 57.88 58.15 1xxi h LEU 218 Cb 0.02 0.08 -0.11 0.00 0.09 0.00 0.00 40.66 40.75 1xxi h LEU 218 CO -0.02 -0.08 0.42 0.28 0.09 0.00 0.00 178.44 179.14 1xxi h SER 219 N -0.57 0.44 -0.24 -0.43 0.02 -1.05 0.72 113.55 112.44 1xxi h SER 219 Ca -0.04 0.13 -0.10 0.00 -0.84 0.00 0.00 61.79 60.94 1xxi h SER 219 Cb 0.42 0.07 -0.02 0.00 0.14 0.00 0.00 62.40 63.01 1xxi h SER 219 CO 0.06 0.10 -0.17 -0.07 -1.14 0.00 0.00 176.83 175.61 1xxi h LEU 220 N 0.51 0.68 -0.84 5.07 3.38 0.24 -2.52 115.31 121.83 1xxi h LEU 220 Ca 0.52 -0.22 -0.04 0.00 0.09 0.00 0.00 57.88 58.24 1xxi h LEU 220 Cb 0.90 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.46 1xxi h LEU 220 CO -0.46 0.86 -0.19 0.74 0.09 0.00 0.00 178.44 179.49 1xxi h THR 221 N 0.61 0.40 0.02 0.22 2.02 0.46 -2.74 112.91 113.91 1xxi h THR 221 Ca 0.10 -1.14 -0.21 0.00 0.77 0.00 0.00 66.41 65.92 1xxi h THR 221 Cb 0.64 1.85 -0.01 0.00 -1.74 0.00 0.00 68.15 68.89 1xxi h THR 221 CO 0.04 0.18 -0.95 0.44 0.37 0.00 0.00 175.52 175.61 1xxi h ASP 222 N 0.00 0.28 0.03 4.18 3.32 -0.09 -2.55 116.42 121.59 1xxi h ASP 222 Ca -0.00 -0.25 -0.00 0.00 0.02 0.00 0.00 57.03 56.80 1xxi h ASP 222 Cb 0.84 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.30 1xxi h ASP 222 CO 0.02 1.08 -0.01 1.56 -1.72 0.00 0.00 179.24 180.17 1xxi h GLN 223 N 0.10 -0.04 -0.83 3.56 4.20 -1.44 -1.15 115.11 119.52 1xxi h GLN 223 Ca -0.06 0.00 0.17 0.00 0.06 0.00 0.00 58.65 58.82 1xxi h GLN 223 Cb 1.61 0.01 -0.06 0.00 0.30 0.00 0.00 27.48 29.34 1xxi h GLN 223 CO 0.15 0.22 0.55 0.00 -0.67 0.00 0.00 178.83 179.07 1xxi h ALA 224 N 0.67 2.09 0.11 3.87 0.00 -1.48 -0.00 119.26 124.52 1xxi h ALA 224 Ca -0.00 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1xxi h ALA 224 Cb 0.27 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1xxi h ALA 224 CO 0.01 -0.33 -0.05 0.82 0.00 0.00 0.00 179.25 179.70 1xxi h ILE 225 N 0.46 1.07 -0.80 0.00 2.04 -1.22 -1.96 117.51 117.12 1xxi h ILE 225 Ca 0.42 -1.26 0.13 0.00 1.00 0.00 0.00 64.86 65.14 1xxi h ILE 225 Cb 0.93 1.81 -0.06 0.00 -0.74 0.00 0.00 36.82 38.76 1xxi h ILE 225 CO -0.15 0.28 0.52 0.00 0.00 0.00 0.00 178.15 178.80 1xxi h ALA 226 N -0.08 1.91 -0.00 1.87 0.00 0.09 -1.96 119.26 121.09 1xxi h ALA 226 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1xxi h ALA 226 Cb 0.57 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1xxi h ALA 226 CO 0.02 -0.10 -0.55 -1.13 0.00 0.00 0.00 179.25 177.49 1xxi n SER 227 N -4.51 0.65 -0.65 0.00 3.41 -0.14 -3.79 113.62 108.58 1xxi n SER 227 Ca 0.15 -0.44 0.06 0.00 -0.26 0.00 0.00 58.87 58.37 1xxi n SER 227 Cb 0.43 0.35 0.17 0.00 -0.26 0.00 0.00 64.21 64.90 1xxi n SER 227 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xxi n GLY 228 N 1.48 3.14 3.70 5.00 0.00 -0.74 -4.91 105.19 112.86 1xxi n GLY 228 Ca 0.06 -0.53 -0.23 0.00 0.00 0.00 0.00 46.02 45.32 1xxi n GLY 228 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1xxi n ASP 229 N 0.15 -5.20 0.00 1.61 2.03 -0.80 -2.57 116.55 111.78 1xxi n ASP 229 Ca 0.13 -0.82 0.00 0.00 0.52 0.00 0.00 54.79 54.62 1xxi n ASP 229 Cb 0.53 -2.05 0.00 0.00 -0.72 0.00 0.00 41.12 38.88 1xxi n ASP 229 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1xxi n GLY 230 N -1.56 2.36 3.24 0.27 0.00 -1.16 -5.03 105.19 103.31 1xxi n GLY 230 Ca -0.27 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.46 1xxi n GLY 230 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1xxi s GLN 231 N -0.42 2.07 -1.18 1.61 -0.21 -1.06 -4.31 119.66 116.16 1xxi s GLN 231 Ca 0.00 -0.80 -0.11 0.00 0.02 0.00 0.00 55.36 54.47 1xxi s GLN 231 Cb 0.00 -1.87 0.22 0.00 1.00 0.00 0.00 33.01 32.36 1xxi s GLN 231 CO 0.00 0.40 1.39 0.28 -2.12 0.00 0.00 175.29 175.24 1xxi n VAL 232 N 2.79 4.45 -3.88 1.09 0.31 -1.09 -4.30 118.33 117.70 1xxi n VAL 232 Ca -0.17 -5.00 -0.32 0.00 -0.01 0.00 0.00 64.34 58.84 1xxi n VAL 232 Cb 0.52 -2.46 -0.05 0.00 -0.91 0.00 0.00 33.84 30.94 1xxi n VAL 232 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1xxi s SER 233 N 1.77 6.38 0.37 4.52 1.04 -1.26 -2.76 113.70 123.76 1xxi s SER 233 Ca 0.38 0.35 0.12 0.00 0.48 0.00 0.00 55.95 57.28 1xxi s SER 233 Cb -0.03 -2.00 0.92 0.00 0.10 0.00 0.00 66.02 65.01 1xxi s SER 233 CO -0.02 0.22 1.83 0.74 0.98 0.00 0.00 173.24 176.99 1xxi h THR 234 N 2.52 0.72 0.00 2.02 2.02 -1.93 0.56 112.91 118.83 1xxi h THR 234 Ca -0.47 -0.20 0.00 0.00 0.77 0.00 0.00 66.41 66.51 1xxi h THR 234 Cb 1.18 0.09 0.00 0.00 -1.74 0.00 0.00 68.15 67.67 1xxi h THR 234 CO 0.72 0.11 0.00 0.00 0.37 0.00 0.00 175.52 176.71 1xxi n GLN 235 N -4.60 0.12 -0.09 6.66 6.02 -1.26 0.00 117.38 124.23 1xxi n GLN 235 Ca 0.20 0.14 -0.12 0.00 -0.01 0.00 0.00 57.00 57.22 1xxi n GLN 235 Cb 0.61 -1.50 -0.11 0.00 1.02 0.00 0.00 30.24 30.26 1xxi n GLN 235 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1xxi n ALA 236 N -1.41 1.58 0.08 -1.58 0.00 0.18 -4.43 120.51 114.93 1xxi n ALA 236 Ca 0.07 -0.95 -0.06 0.00 0.00 0.00 0.00 53.44 52.49 1xxi n ALA 236 Cb 0.20 -0.02 -0.04 0.00 0.00 0.00 0.00 19.45 19.59 1xxi n ALA 236 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1xxi h VAL 237 N 0.00 0.19 -0.50 0.00 2.07 -0.87 -3.17 116.25 113.97 1xxi h VAL 237 Ca -0.45 -0.86 0.14 0.00 0.82 0.00 0.00 66.70 66.35 1xxi h VAL 237 Cb 1.82 0.32 -0.02 0.00 -1.52 0.00 0.00 31.29 31.90 1xxi h VAL 237 CO -0.03 0.05 0.77 0.77 0.02 0.00 0.00 177.57 179.15 1xxi h SER 238 N -1.05 0.00 0.55 0.57 4.64 -0.65 0.53 113.55 118.13 1xxi h SER 238 Ca -0.03 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 61.00 1xxi h SER 238 Cb 0.32 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.37 1xxi h SER 238 CO 0.05 0.00 -1.59 0.00 -0.87 0.00 0.00 176.83 174.42 1xxi h ALA 239 N 0.92 0.63 0.29 5.18 0.00 -1.74 0.14 119.26 124.68 1xxi h ALA 239 Ca 0.24 -1.34 -0.01 0.00 0.00 0.00 0.00 54.91 53.80 1xxi h ALA 239 Cb 1.78 0.38 0.00 0.00 0.00 0.00 0.00 17.79 19.95 1xxi h ALA 239 CO -0.00 1.47 -0.14 0.52 0.00 0.00 0.00 179.25 181.10 1xxi h MET 240 N 0.01 -0.37 0.00 0.00 2.86 0.10 -1.55 114.93 115.98 1xxi h MET 240 Ca -0.25 0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.42 1xxi h MET 240 Cb 1.97 0.08 0.00 0.00 0.06 0.00 0.00 31.60 33.72 1xxi h MET 240 CO 0.10 -0.14 0.00 1.28 1.06 0.00 0.00 176.91 179.21 1xxi n LEU 241 N -5.19 0.58 0.00 1.22 4.77 -1.09 -4.84 117.00 112.44 1xxi n LEU 241 Ca -0.10 0.64 0.00 0.00 -0.03 0.00 0.00 56.01 56.53 1xxi n LEU 241 Cb 0.22 -0.57 0.00 0.00 -2.33 0.00 0.00 43.42 40.74 1xxi n LEU 241 CO 0.34 -0.52 0.00 0.61 -1.33 0.00 0.00 177.39 176.48 1xxi n GLY 242 N -0.02 0.40 3.73 -0.72 0.00 -0.59 -4.45 105.19 103.55 1xxi n GLY 242 Ca 0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.65 1xxi n GLY 242 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xxi s THR 243 N -1.93 5.06 0.48 2.61 2.01 0.45 -3.24 115.64 121.07 1xxi s THR 243 Ca 0.00 1.23 -0.24 0.00 0.31 0.00 0.00 61.69 62.98 1xxi s THR 243 Cb 0.00 -3.94 -0.07 0.00 0.01 0.00 0.00 72.50 68.50 1xxi s THR 243 CO 0.00 0.32 1.38 0.18 -0.69 0.00 0.00 174.62 175.81 1xxi n LEU 244 N 3.47 5.08 -4.77 4.42 4.77 -1.26 -4.35 117.00 124.36 1xxi n LEU 244 Ca -0.05 1.07 -0.40 0.00 -0.03 0.00 0.00 56.01 56.60 1xxi n LEU 244 Cb 0.51 -1.58 0.01 0.00 -2.33 0.00 0.00 43.42 40.03 1xxi n LEU 244 CO 0.45 -0.38 1.04 -1.81 -1.33 0.00 0.00 177.39 175.37 1xxi s ASP 245 N -0.62 6.11 0.00 -1.43 1.11 -1.26 -4.72 116.67 115.85 1xxi s ASP 245 Ca 0.65 2.86 0.00 0.00 0.18 0.00 0.00 52.55 56.23 1xxi s ASP 245 Cb -0.45 -2.65 0.00 0.00 1.07 0.00 0.00 42.92 40.89 1xxi s ASP 245 CO 0.55 -1.01 0.47 0.47 1.18 0.00 0.00 175.17 176.83 1xxi n ASP 246 N 0.04 0.00 -0.09 0.27 8.00 -1.26 -0.47 116.55 123.04 1xxi n ASP 246 Ca 0.04 0.04 -0.19 0.00 0.71 0.00 0.00 54.79 55.39 1xxi n ASP 246 Cb 0.42 -0.04 -0.13 0.00 -0.02 0.00 0.00 41.12 41.35 1xxi n ASP 246 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1xxi n ASP 247 N -0.97 1.97 -0.05 -2.24 2.03 -1.26 -2.26 116.55 113.77 1xxi n ASP 247 Ca 0.00 -0.03 -0.10 0.00 0.52 0.00 0.00 54.79 55.18 1xxi n ASP 247 Cb 0.01 -0.51 -0.04 0.00 -0.72 0.00 0.00 41.12 39.86 1xxi n ASP 247 CO 0.00 0.00 0.00 1.56 -1.92 0.00 0.00 177.20 176.84 1xxi h GLN 248 N 0.02 0.29 -0.42 -0.67 4.20 -1.12 -0.67 115.11 116.75 1xxi h GLN 248 Ca -0.53 -0.03 -0.11 0.00 0.06 0.00 0.00 58.65 58.04 1xxi h GLN 248 Cb 1.95 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 29.66 1xxi h GLN 248 CO -0.03 0.26 -0.18 0.00 -0.67 0.00 0.00 178.83 178.20 1xxi h ALA 249 N 1.02 0.59 -0.27 3.87 0.00 -1.50 -2.87 119.26 120.09 1xxi h ALA 249 Ca 0.08 -0.37 -0.05 0.00 0.00 0.00 0.00 54.91 54.57 1xxi h ALA 249 Cb 0.05 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1xxi h ALA 249 CO -0.01 0.54 -0.03 1.25 0.00 0.00 0.00 179.25 180.99 1xxi h LEU 250 N 0.69 0.39 -0.50 0.00 5.85 -1.17 -2.59 115.31 117.97 1xxi h LEU 250 Ca 0.10 -0.07 -0.17 0.00 0.84 0.00 0.00 57.88 58.58 1xxi h LEU 250 Cb 0.74 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.66 1xxi h LEU 250 CO 0.06 0.47 -0.60 0.28 -0.34 0.00 0.00 178.44 178.31 1xxi h SER 251 N 0.40 0.55 -0.28 1.25 0.02 -0.96 -2.26 113.55 112.27 1xxi h SER 251 Ca 0.09 -0.31 0.03 0.00 -0.84 0.00 0.00 61.79 60.76 1xxi h SER 251 Cb 0.31 -0.16 -0.03 0.00 0.14 0.00 0.00 62.40 62.66 1xxi h SER 251 CO 0.01 1.02 0.09 -0.07 -1.14 0.00 0.00 176.83 176.74 1xxi h LEU 252 N 0.36 0.09 -1.18 5.07 3.38 -1.26 1.28 115.31 123.05 1xxi h LEU 252 Ca -0.00 0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.01 1xxi h LEU 252 Cb 1.15 0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.88 1xxi h LEU 252 CO 0.11 0.09 0.56 0.58 0.09 0.00 0.00 178.44 179.86 1xxi h VAL 253 N 0.21 1.20 -0.16 1.22 2.07 -1.37 0.03 116.25 119.45 1xxi h VAL 253 Ca 0.13 -0.38 -0.22 0.00 0.82 0.00 0.00 66.70 67.04 1xxi h VAL 253 Cb 0.10 -0.02 0.01 0.00 -1.52 0.00 0.00 31.29 29.86 1xxi h VAL 253 CO -0.14 0.20 -0.77 -0.33 0.02 0.00 0.00 177.57 176.55 1xxi h GLU 254 N 1.12 0.80 -0.02 1.57 5.08 -0.50 -1.93 114.58 120.71 1xxi h GLU 254 Ca 0.31 -0.65 0.03 0.00 -1.00 0.00 0.00 59.36 58.05 1xxi h GLU 254 Cb -0.10 0.14 -0.04 0.00 0.50 0.00 0.00 28.75 29.25 1xxi h GLU 254 CO -0.07 1.26 -0.21 0.00 -1.00 0.00 0.00 179.01 178.99 1xxi h ALA 255 N 0.55 -0.25 -0.63 3.43 0.00 0.25 -0.72 119.26 121.89 1xxi h ALA 255 Ca -0.05 0.01 0.09 0.00 0.00 0.00 0.00 54.91 54.95 1xxi h ALA 255 Cb 1.41 0.37 -0.07 0.00 0.00 0.00 0.00 17.79 19.50 1xxi h ALA 255 CO 0.16 -0.70 0.27 1.98 0.00 0.00 0.00 179.25 180.96 1xxi h MET 256 N -0.32 0.46 0.00 0.00 -1.53 -0.95 -0.90 114.93 111.69 1xxi h MET 256 Ca 0.06 -0.03 -0.09 0.00 -3.44 0.00 0.00 59.70 56.21 1xxi h MET 256 Cb 0.41 -0.10 -0.01 0.00 -0.55 0.00 0.00 31.60 31.34 1xxi h MET 256 CO -0.20 0.31 -0.42 0.28 0.14 0.00 0.00 176.91 177.01 1xxi h VAL 257 N 0.48 0.99 0.00 -5.77 2.07 -0.70 -1.97 116.25 111.34 1xxi h VAL 257 Ca 0.31 -1.64 0.00 0.00 0.82 0.00 0.00 66.70 66.19 1xxi h VAL 257 Cb 0.35 1.97 0.00 0.00 -1.52 0.00 0.00 31.29 32.09 1xxi h VAL 257 CO -0.28 0.41 -0.21 -0.62 0.02 0.00 0.00 177.57 176.90 1xxi n GLU 258 N -3.59 0.10 -2.60 1.57 1.02 -0.34 -4.95 120.64 111.87 1xxi n GLU 258 Ca -0.00 0.06 -0.16 0.00 -0.02 0.00 0.00 57.16 57.03 1xxi n GLU 258 Cb 0.53 -1.60 0.01 0.00 -0.02 0.00 0.00 31.44 30.37 1xxi n GLU 258 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1xxi n ALA 259 N -1.61 -0.62 -2.53 0.62 0.00 -0.43 -4.98 120.51 110.97 1xxi n ALA 259 Ca 0.06 0.18 -0.43 0.00 0.00 0.00 0.00 53.44 53.25 1xxi n ALA 259 Cb 0.37 -2.51 -0.10 0.00 0.00 0.00 0.00 19.45 17.21 1xxi n ALA 259 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1xxi s ASN 260 N -2.56 6.04 0.10 0.00 4.22 -1.16 -4.97 114.94 116.60 1xxi s ASN 260 Ca 0.13 -0.92 -0.20 0.00 -2.14 0.00 0.00 52.86 49.73 1xxi s ASN 260 Cb -0.06 -2.13 -0.09 0.00 1.28 0.00 0.00 41.25 40.25 1xxi s ASN 260 CO 0.16 -0.44 1.65 1.23 -2.04 0.00 0.00 177.10 177.66 1xxi h GLY 261 N 8.59 0.31 0.17 0.45 0.00 -1.93 -3.17 103.07 107.50 1xxi h GLY 261 Ca -0.27 -0.17 0.08 0.00 0.00 0.00 0.00 47.33 46.97 1xxi h GLY 261 CO 0.72 0.16 -0.15 -2.09 0.00 0.00 0.00 176.54 175.18 1xxi h GLU 262 N 0.18 -0.08 -0.83 4.80 4.81 -1.99 -0.91 114.58 120.56 1xxi h GLU 262 Ca 0.07 0.01 0.12 0.00 -0.13 0.00 0.00 59.36 59.43 1xxi h GLU 262 Cb 0.15 0.02 -0.08 0.00 0.63 0.00 0.00 28.75 29.47 1xxi h GLU 262 CO -0.01 -0.05 0.44 -0.09 -0.73 0.00 0.00 179.01 178.57 1xxi h ARG 263 N -0.08 0.66 0.67 1.92 2.43 -1.99 0.14 114.38 118.13 1xxi h ARG 263 Ca 0.18 -0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 59.28 1xxi h ARG 263 Cb 0.35 -0.15 0.01 0.00 -0.42 0.00 0.00 29.97 29.76 1xxi h ARG 263 CO -0.41 0.43 -0.32 0.28 -1.51 0.00 0.00 179.97 178.44 1xxi h VAL 264 N 0.68 0.32 -0.30 0.20 2.07 -1.17 0.08 116.25 118.13 1xxi h VAL 264 Ca 0.43 -0.08 0.02 0.00 0.82 0.00 0.00 66.70 67.89 1xxi h VAL 264 Cb 0.52 0.34 -0.02 0.00 -1.52 0.00 0.00 31.29 30.62 1xxi h VAL 264 CO -0.31 0.01 0.20 0.24 0.02 0.00 0.00 177.57 177.72 1xxi h MET 265 N -0.96 0.31 -0.49 1.57 2.86 -0.76 -0.07 114.93 117.39 1xxi h MET 265 Ca -0.09 -0.02 -0.07 0.00 -2.06 0.00 0.00 59.70 57.46 1xxi h MET 265 Cb 0.71 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 32.28 1xxi h MET 265 CO 0.15 0.20 0.02 0.00 1.06 0.00 0.00 176.91 178.35 1xxi h ALA 266 N 1.83 0.65 -0.29 6.32 0.00 -0.29 0.59 119.26 128.07 1xxi h ALA 266 Ca 0.12 -0.27 -0.10 0.00 0.00 0.00 0.00 54.91 54.66 1xxi h ALA 266 Cb 0.08 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1xxi h ALA 266 CO -0.03 0.43 -0.26 -0.07 0.00 0.00 0.00 179.25 179.33 1xxi h LEU 267 N 0.70 0.57 -0.67 0.00 3.38 0.43 0.99 115.31 120.71 1xxi h LEU 267 Ca 0.14 -0.20 -0.12 0.00 0.09 0.00 0.00 57.88 57.79 1xxi h LEU 267 Cb 0.48 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1xxi h LEU 267 CO 0.02 0.82 -0.27 0.40 0.09 0.00 0.00 178.44 179.50 1xxi h ILE 268 N 0.50 1.28 0.07 1.22 2.04 -0.75 0.71 117.51 122.57 1xxi h ILE 268 Ca 0.07 -1.39 -0.00 0.00 1.00 0.00 0.00 64.86 64.54 1xxi h ILE 268 Cb 0.71 1.29 0.00 0.00 -0.74 0.00 0.00 36.82 38.08 1xxi h ILE 268 CO 0.05 0.46 -0.03 -1.13 0.00 0.00 0.00 178.15 177.50 1xxi h ASN 269 N 0.64 -0.08 -0.17 1.72 -0.73 -0.59 -1.15 115.58 115.22 1xxi h ASN 269 Ca 0.08 -0.46 0.05 0.00 1.87 0.00 0.00 56.30 57.84 1xxi h ASN 269 Cb 0.78 0.02 -0.01 0.00 0.27 0.00 0.00 38.32 39.38 1xxi h ASN 269 CO 0.06 0.45 0.14 -0.08 -0.37 0.00 0.00 177.43 177.63 1xxi h GLU 270 N -0.64 0.00 0.15 6.67 4.81 -0.74 0.63 114.58 125.46 1xxi h GLU 270 Ca -0.01 0.00 -0.30 0.00 -0.13 0.00 0.00 59.36 58.92 1xxi h GLU 270 Cb 0.53 0.00 0.03 0.00 0.63 0.00 0.00 28.75 29.94 1xxi h GLU 270 CO 0.02 0.00 -1.29 0.00 -0.73 0.00 0.00 179.01 177.01 1xxi h ALA 271 N 1.87 0.00 -0.38 2.92 0.00 -0.76 -3.17 119.26 119.76 1xxi h ALA 271 Ca 0.08 -0.81 0.02 0.00 0.00 0.00 0.00 54.91 54.20 1xxi h ALA 271 Cb 0.37 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1xxi h ALA 271 CO -0.00 0.75 0.25 0.00 0.00 0.00 0.00 179.25 180.25 1xxi h ALA 272 N 0.35 1.80 -0.79 0.00 0.00 0.41 -1.81 119.26 119.22 1xxi h ALA 272 Ca -0.19 -0.02 0.07 0.00 0.00 0.00 0.00 54.91 54.77 1xxi h ALA 272 Cb 1.97 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 19.58 1xxi h ALA 272 CO 0.24 0.16 0.52 0.00 0.00 0.00 0.00 179.25 180.17 1xxi h ALA 273 N 1.78 1.65 -0.46 0.00 0.00 -1.35 -0.11 119.26 120.78 1xxi h ALA 273 Ca 0.15 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 1xxi h ALA 273 Cb 0.04 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.58 1xxi h ALA 273 CO -0.03 0.22 0.08 2.89 0.00 0.00 0.00 179.25 182.40 1xxi n ARG 274 N -4.49 3.43 -3.36 0.00 1.85 -0.68 -4.97 116.66 108.44 1xxi n ARG 274 Ca 0.12 -2.20 -0.12 0.00 -1.00 0.00 0.00 57.85 54.64 1xxi n ARG 274 Cb 0.23 -2.01 0.01 0.00 -1.05 0.00 0.00 32.46 29.65 1xxi n ARG 274 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1xxi n GLY 275 N 0.25 -1.22 3.68 2.89 0.00 -0.05 -4.95 105.19 105.78 1xxi n GLY 275 Ca 0.24 0.51 -0.30 0.00 0.00 0.00 0.00 46.02 46.47 1xxi n GLY 275 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xxi s ILE 276 N -3.08 1.67 -0.40 -0.61 1.01 -1.25 -4.64 121.20 113.89 1xxi s ILE 276 Ca 0.09 0.00 0.03 0.00 0.00 0.00 0.00 60.65 60.78 1xxi s ILE 276 Cb -0.03 -2.63 0.11 0.00 0.01 0.00 0.00 42.46 39.92 1xxi s ILE 276 CO 0.81 0.00 0.13 -1.61 0.00 0.00 0.00 174.94 174.27 1xxi s GLU 277 N -5.60 1.68 0.48 2.79 0.41 -1.20 -4.95 118.70 112.31 1xxi s GLU 277 Ca 0.73 -2.11 0.33 0.00 -0.41 0.00 0.00 54.97 53.51 1xxi s GLU 277 Cb -0.07 -3.28 1.46 0.00 -1.78 0.00 0.00 34.13 30.46 1xxi s GLU 277 CO 0.55 -1.00 1.69 -1.49 -0.49 0.00 0.00 175.26 174.52 1xxi h TRP 278 N 7.30 0.31 -0.33 1.61 4.06 -1.94 0.50 115.95 127.47 1xxi h TRP 278 Ca -0.06 0.01 -0.01 0.00 2.06 0.00 0.00 58.89 60.90 1xxi h TRP 278 Cb 0.98 -0.08 -0.01 0.00 -1.00 0.00 0.00 29.16 29.05 1xxi h TRP 278 CO 0.49 -0.06 0.16 1.49 -3.56 0.00 0.00 178.44 176.96 1xxi h GLU 279 N 0.11 0.47 -0.98 0.49 4.57 -1.94 -2.92 114.58 114.37 1xxi h GLU 279 Ca 0.73 -0.07 0.07 0.00 -1.18 0.00 0.00 59.36 58.92 1xxi h GLU 279 Cb 2.52 -0.08 -0.07 0.00 -0.16 0.00 0.00 28.75 30.96 1xxi h GLU 279 CO -0.21 0.43 0.63 0.00 -1.18 0.00 0.00 179.01 178.68 1xxi h ALA 280 N 1.02 1.45 0.00 2.92 0.00 -0.38 -1.36 119.26 122.91 1xxi h ALA 280 Ca 0.11 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1xxi h ALA 280 Cb 0.11 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 1xxi h ALA 280 CO -0.01 0.39 -0.03 1.25 0.00 0.00 0.00 179.25 180.84 1xxi h LEU 281 N 1.12 0.00 0.10 0.00 6.46 -1.35 -0.78 115.31 120.84 1xxi h LEU 281 Ca 0.43 0.00 -0.13 0.00 -0.12 0.00 0.00 57.88 58.07 1xxi h LEU 281 Cb 0.23 0.00 0.01 0.00 -0.73 0.00 0.00 40.66 40.17 1xxi h LEU 281 CO -0.18 0.03 -0.56 -0.07 -0.62 0.00 0.00 178.44 177.04 1xxi h LEU 282 N 0.00 0.33 0.27 2.25 3.38 -1.28 -3.25 115.31 117.01 1xxi h LEU 282 Ca -0.00 -0.96 0.00 0.00 0.09 0.00 0.00 57.88 57.01 1xxi h LEU 282 Cb 0.07 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 1xxi h LEU 282 CO 0.00 1.27 -0.28 0.58 0.09 0.00 0.00 178.44 180.10 1xxi h VAL 283 N -0.56 0.40 -0.27 1.22 2.07 -1.01 -0.10 116.25 118.00 1xxi h VAL 283 Ca -0.10 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.45 1xxi h VAL 283 Cb 1.44 0.40 -0.01 0.00 -1.52 0.00 0.00 31.29 31.60 1xxi h VAL 283 CO 0.11 0.00 0.18 -0.33 0.02 0.00 0.00 177.57 177.55 1xxi h GLU 284 N -0.59 0.24 -0.14 1.57 4.39 -1.34 -0.43 114.58 118.28 1xxi h GLU 284 Ca -0.01 -0.01 -0.20 0.00 0.34 0.00 0.00 59.36 59.48 1xxi h GLU 284 Cb 0.54 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.14 1xxi h GLU 284 CO -0.07 0.16 -0.71 0.52 -1.16 0.00 0.00 179.01 177.76 1xxi h MET 285 N 0.25 0.62 0.46 2.33 2.86 -1.46 -0.70 114.93 119.29 1xxi h MET 285 Ca 0.11 -0.48 -0.02 0.00 -2.06 0.00 0.00 59.70 57.25 1xxi h MET 285 Cb 0.14 0.09 0.00 0.00 0.06 0.00 0.00 31.60 31.90 1xxi h MET 285 CO -0.02 1.10 -0.22 -0.07 1.06 0.00 0.00 176.91 178.75 1xxi h LEU 286 N 0.44 -0.53 -1.07 1.22 3.38 0.42 -0.98 115.31 118.19 1xxi h LEU 286 Ca -0.03 -0.03 0.06 0.00 0.09 0.00 0.00 57.88 57.97 1xxi h LEU 286 Cb 1.30 0.14 -0.06 0.00 0.09 0.00 0.00 40.66 42.13 1xxi h LEU 286 CO 0.14 -0.30 0.63 1.23 0.09 0.00 0.00 178.44 180.22 1xxi h GLY 287 N -0.73 1.44 1.02 0.83 0.00 -1.14 0.36 103.07 104.85 1xxi h GLY 287 Ca -0.06 -0.45 -0.02 0.00 0.00 0.00 0.00 47.33 46.79 1xxi h GLY 287 CO 0.10 0.33 0.41 1.41 0.00 0.00 0.00 176.54 178.80 1xxi h LEU 288 N 1.13 1.00 -1.11 3.11 3.38 -0.97 0.18 115.31 122.03 1xxi h LEU 288 Ca 0.41 -0.11 -0.08 0.00 0.09 0.00 0.00 57.88 58.20 1xxi h LEU 288 Cb 0.16 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 1xxi h LEU 288 CO -0.16 0.82 -0.18 -0.07 0.09 0.00 0.00 178.44 178.95 1xxi h LEU 289 N 1.10 0.41 0.17 1.67 3.38 0.45 -2.37 115.31 120.12 1xxi h LEU 289 Ca 0.27 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 1xxi h LEU 289 Cb 0.06 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.70 1xxi h LEU 289 CO -0.04 0.61 -0.08 -0.74 0.09 0.00 0.00 178.44 178.27 1xxi h HIS 290 N 0.38 -0.21 -0.56 1.13 2.76 0.86 -2.34 115.15 117.17 1xxi h HIS 290 Ca 0.07 -0.01 0.03 0.00 -2.20 0.00 0.00 60.37 58.27 1xxi h HIS 290 Cb 0.53 0.07 -0.03 0.00 1.55 0.00 0.00 27.41 29.53 1xxi h HIS 290 CO 0.01 0.02 0.37 0.00 -1.30 0.00 0.00 177.93 177.04 1xxi h ARG 291 N -0.43 0.63 -0.15 5.26 3.08 -0.33 -0.77 114.38 121.67 1xxi h ARG 291 Ca -0.02 -0.04 -0.07 0.00 0.07 0.00 0.00 59.98 59.92 1xxi h ARG 291 Cb 0.33 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.23 1xxi h ARG 291 CO 0.04 0.42 -0.24 0.82 -1.07 0.00 0.00 179.97 179.94 1xxi h ILE 292 N 0.65 1.23 -0.41 2.04 2.04 -1.29 -2.01 117.51 119.75 1xxi h ILE 292 Ca 0.23 -1.09 -0.13 0.00 1.00 0.00 0.00 64.86 64.87 1xxi h ILE 292 Cb 0.10 1.39 -0.01 0.00 -0.74 0.00 0.00 36.82 37.56 1xxi h ILE 292 CO -0.06 0.33 -0.24 0.00 0.00 0.00 0.00 178.15 178.19 1xxi h ALA 293 N 1.52 0.58 -0.00 1.87 0.00 -0.60 -2.85 119.26 119.78 1xxi h ALA 293 Ca 0.04 -0.39 -0.00 0.00 0.00 0.00 0.00 54.91 54.56 1xxi h ALA 293 Cb 0.56 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 1xxi h ALA 293 CO 0.04 0.58 0.00 0.52 0.00 0.00 0.00 179.25 180.39 1xxi h MET 294 N 0.71 0.00 -0.02 0.00 2.86 -1.17 -2.92 114.93 114.38 1xxi h MET 294 Ca 0.09 -0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.73 1xxi h MET 294 Cb 0.81 -0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.47 1xxi h MET 294 CO 0.07 0.14 0.08 0.28 1.06 0.00 0.00 176.91 178.54 1xxi h VAL 295 N -0.14 0.14 0.00 -2.22 2.07 -1.36 0.40 116.25 115.15 1xxi h VAL 295 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1xxi h VAL 295 Cb 0.14 0.92 0.00 0.00 -1.52 0.00 0.00 31.29 30.83 1xxi h VAL 295 CO -0.00 0.00 -0.14 0.00 0.02 0.00 0.00 177.57 177.45 1xxi n GLN 296 N -3.26 0.02 -0.09 1.57 6.02 -1.08 -3.00 117.38 117.55 1xxi n GLN 296 Ca -0.02 0.01 -0.11 0.00 -0.01 0.00 0.00 57.00 56.87 1xxi n GLN 296 Cb 0.16 -1.52 -0.04 0.00 1.02 0.00 0.00 30.24 29.87 1xxi n GLN 296 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.06 175.94 1xxi n LEU 297 N -1.54 1.89 -3.90 1.08 7.94 0.12 -4.87 117.00 117.71 1xxi n LEU 297 Ca 0.06 0.45 -0.30 0.00 -1.11 0.00 0.00 56.01 55.11 1xxi n LEU 297 Cb 0.34 -0.81 -0.15 0.00 0.53 0.00 0.00 43.42 43.33 1xxi n LEU 297 CO 0.29 -0.22 -0.34 -0.94 -1.11 0.00 0.00 177.39 175.07 1xxi s SER 298 N -6.08 4.36 0.00 1.96 1.04 0.04 -4.99 113.70 110.03 1xxi s SER 298 Ca -0.25 -1.82 0.00 0.00 0.48 0.00 0.00 55.95 54.36 1xxi s SER 298 Cb 0.05 -1.27 0.00 0.00 0.10 0.00 0.00 66.02 64.89 1xxi s SER 298 CO 0.37 -0.37 0.70 -0.81 0.98 0.00 0.00 173.24 174.11 1xxi n PRO 299 N 4.54 0.00 0.00 4.02 -0.04 -1.16 0.62 135.00 142.98 1xxi n PRO 299 Ca -0.01 0.23 0.14 0.00 -0.04 0.00 0.00 63.50 63.82 1xxi n PRO 299 Cb 0.42 -1.71 0.48 0.00 -0.04 0.00 0.00 33.50 32.65 1xxi n PRO 299 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1xxi n ALA 300 N -1.20 2.85 -0.26 0.55 0.00 -1.26 -4.50 120.51 116.68 1xxi n ALA 300 Ca 0.00 -0.39 0.12 0.00 0.00 0.00 0.00 53.44 53.17 1xxi n ALA 300 Cb 0.21 -1.18 0.38 0.00 0.00 0.00 0.00 19.45 18.85 1xxi n ALA 300 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xxi h ALA 301 N 3.91 1.84 -2.30 0.00 0.00 -0.13 -3.45 119.26 119.12 1xxi h ALA 301 Ca 0.00 0.01 -0.58 0.00 0.00 0.00 0.00 54.91 54.34 1xxi h ALA 301 Cb 0.47 -0.12 0.11 0.00 0.00 0.00 0.00 17.79 18.24 1xxi h ALA 301 CO 0.00 -0.07 0.35 1.28 0.00 0.00 0.00 179.25 180.81 1xxi n LEU 302 N -4.56 2.83 -4.81 0.00 4.77 -1.26 -4.97 117.00 109.00 1xxi n LEU 302 Ca 0.17 1.20 -0.29 0.00 -0.03 0.00 0.00 56.01 57.06 1xxi n LEU 302 Cb 0.46 -1.40 0.13 0.00 -2.33 0.00 0.00 43.42 40.28 1xxi n LEU 302 CO 0.30 -0.86 0.73 -0.83 -1.33 0.00 0.00 177.39 175.40 1xxi s GLY 303 N -0.41 1.59 0.05 -0.72 0.00 -1.26 -4.99 107.32 101.58 1xxi s GLY 303 Ca 0.57 -0.59 -0.21 0.00 0.00 0.00 0.00 44.72 44.49 1xxi s GLY 303 CO 0.61 -0.02 1.46 -0.57 0.00 0.00 0.00 173.10 174.58 1xxi h ASN 304 N -1.46 0.25 0.59 1.64 -0.73 -1.99 -3.04 115.58 110.83 1xxi h ASN 304 Ca -0.49 -0.33 0.00 0.00 1.87 0.00 0.00 56.30 57.34 1xxi h ASN 304 Cb 1.33 -0.07 0.00 0.00 0.27 0.00 0.00 38.32 39.85 1xxi h ASN 304 CO 0.61 0.52 0.00 -0.67 -0.37 0.00 0.00 177.43 177.52 1xxi n ASP 305 N -4.75 0.00 0.19 1.15 -0.08 -1.26 -2.91 116.55 108.89 1xxi n ASP 305 Ca -0.06 0.11 0.14 0.00 -1.51 0.00 0.00 54.79 53.47 1xxi n ASP 305 Cb 0.23 -0.35 0.68 0.00 2.34 0.00 0.00 41.12 44.02 1xxi n ASP 305 CO 0.00 0.00 0.00 0.24 0.12 0.00 0.00 177.20 177.56 1xxi h MET 306 N 0.00 0.00 -1.26 -0.67 2.86 -1.92 -3.19 114.93 110.76 1xxi h MET 306 Ca 0.00 0.00 0.37 0.00 -2.06 0.00 0.00 59.70 58.01 1xxi h MET 306 Cb 0.30 0.00 -0.08 0.00 0.06 0.00 0.00 31.60 31.87 1xxi h MET 306 CO 0.00 0.00 0.86 0.00 1.06 0.00 0.00 176.91 178.83 1xxi h ALA 307 N 2.06 2.86 -0.86 6.32 0.00 -1.69 0.50 119.26 128.45 1xxi h ALA 307 Ca 0.00 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1xxi h ALA 307 Cb 0.12 0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 1xxi h ALA 307 CO 0.00 -1.30 0.47 0.00 0.00 0.00 0.00 179.25 178.41 1xxi h ALA 308 N 1.47 1.20 -0.29 0.00 0.00 -1.87 -2.73 119.26 117.04 1xxi h ALA 308 Ca 0.67 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.45 1xxi h ALA 308 Cb 2.28 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 19.72 1xxi h ALA 308 CO -0.19 0.64 0.00 0.44 0.00 0.00 0.00 179.25 180.15 1xxi n ILE 309 N -4.33 0.48 -0.34 0.00 -5.35 0.78 -4.61 119.36 105.98 1xxi n ILE 309 Ca 0.09 -0.74 0.13 0.00 -0.27 0.00 0.00 62.75 61.96 1xxi n ILE 309 Cb 0.10 0.96 0.34 0.00 -1.74 0.00 0.00 39.64 39.30 1xxi n ILE 309 CO 0.00 0.00 0.00 -0.08 -1.76 0.00 0.00 176.55 174.71 1xxi h GLU 310 N 3.52 0.73 -0.45 6.28 4.81 0.15 0.15 114.58 129.76 1xxi h GLU 310 Ca 0.00 -0.04 -0.12 0.00 -0.13 0.00 0.00 59.36 59.06 1xxi h GLU 310 Cb 0.83 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 30.03 1xxi h GLU 310 CO 0.00 0.48 -0.20 1.25 -0.73 0.00 0.00 179.01 179.81 1xxi h LEU 311 N 0.75 0.96 -0.10 1.64 5.85 -1.81 -1.55 115.31 121.05 1xxi h LEU 311 Ca 0.56 -0.40 -0.12 0.00 0.84 0.00 0.00 57.88 58.76 1xxi h LEU 311 Cb 0.88 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 41.65 1xxi h LEU 311 CO -0.34 1.15 -0.39 0.03 -0.34 0.00 0.00 178.44 178.54 1xxi h ARG 312 N 0.78 0.44 -0.61 1.25 3.08 -1.53 -2.12 114.38 115.67 1xxi h ARG 312 Ca 0.10 -0.34 0.07 0.00 0.07 0.00 0.00 59.98 59.89 1xxi h ARG 312 Cb 0.77 0.07 -0.06 0.00 0.08 0.00 0.00 29.97 30.83 1xxi h ARG 312 CO 0.06 0.97 0.29 0.52 -1.07 0.00 0.00 179.97 180.74 1xxi h MET 313 N 0.00 0.50 -0.19 0.04 2.86 -0.80 -1.45 114.93 115.89 1xxi h MET 313 Ca -0.02 -0.03 -0.07 0.00 -2.06 0.00 0.00 59.70 57.52 1xxi h MET 313 Cb 1.03 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 32.56 1xxi h MET 313 CO 0.08 0.33 -0.19 0.00 1.06 0.00 0.00 176.91 178.19 1xxi h ARG 314 N 0.52 0.33 0.25 1.72 3.08 -1.27 -2.44 114.38 116.57 1xxi h ARG 314 Ca 0.29 -0.10 -0.01 0.00 0.07 0.00 0.00 59.98 60.23 1xxi h ARG 314 Cb 0.28 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.29 1xxi h ARG 314 CO -0.24 0.52 -0.12 1.49 -1.07 0.00 0.00 179.97 180.55 1xxi h GLU 315 N 0.30 -0.33 -0.32 0.04 4.57 -0.57 -2.95 114.58 115.33 1xxi h GLU 315 Ca 0.05 0.02 0.07 0.00 -1.18 0.00 0.00 59.36 58.33 1xxi h GLU 315 Cb 0.52 0.07 -0.08 0.00 -0.16 0.00 0.00 28.75 29.11 1xxi h GLU 315 CO 0.03 -0.02 -0.22 -0.07 -1.18 0.00 0.00 179.01 177.55 1xxi h LEU 316 N -0.64 -0.73 -0.99 1.64 3.38 -1.39 -1.79 115.31 114.78 1xxi h LEU 316 Ca -0.03 0.15 0.24 0.00 0.09 0.00 0.00 57.88 58.32 1xxi h LEU 316 Cb 0.46 0.36 -0.19 0.00 0.09 0.00 0.00 40.66 41.38 1xxi h LEU 316 CO 0.06 -0.25 -0.11 0.00 0.09 0.00 0.00 178.44 178.22 1xxi h ALA 317 N 0.97 0.92 0.00 1.53 0.00 -1.31 0.41 119.26 121.78 1xxi h ALA 317 Ca 0.17 0.36 -0.07 0.00 0.00 0.00 0.00 54.91 55.37 1xxi h ALA 317 Cb 0.44 0.68 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 1xxi h ALA 317 CO -0.43 -0.48 -0.90 0.07 0.00 0.00 0.00 179.25 177.51 1xxi h ARG 318 N 0.00 0.00 0.00 0.00 0.11 -1.26 -3.37 114.38 109.86 1xxi h ARG 318 Ca 0.54 0.00 -0.22 0.00 0.10 0.00 0.00 59.98 60.39 1xxi h ARG 318 Cb 0.98 0.00 -0.04 0.00 1.11 0.00 0.00 29.97 32.02 1xxi h ARG 318 CO -0.97 0.17 -1.60 0.25 0.10 0.00 0.00 179.97 177.91 1xxi n THR 319 N -2.89 1.33 -3.73 0.08 -2.24 0.72 -4.86 114.28 102.69 1xxi n THR 319 Ca -0.02 -0.74 -0.37 0.00 -2.27 0.00 0.00 64.05 60.65 1xxi n THR 319 Cb 0.67 -0.82 -0.11 0.00 -2.10 0.00 0.00 70.33 67.97 1xxi n THR 319 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1xxi s ILE 320 N -2.79 4.86 0.19 2.28 1.01 0.11 -5.07 121.20 121.80 1xxi s ILE 320 Ca -0.04 0.01 -0.33 0.00 0.00 0.00 0.00 60.65 60.29 1xxi s ILE 320 Cb 0.08 -3.28 -0.13 0.00 0.01 0.00 0.00 42.46 39.14 1xxi s ILE 320 CO 0.82 0.33 1.59 -2.65 0.00 0.00 0.00 174.94 175.02 1xxi n PRO 321 N 4.68 2.28 0.03 2.79 -0.02 -1.26 -4.81 135.00 138.69 1xxi n PRO 321 Ca -0.15 0.82 0.20 0.00 -2.02 0.00 0.00 63.50 62.35 1xxi n PRO 321 Cb 0.52 -2.59 0.71 0.00 -0.02 0.00 0.00 33.50 32.11 1xxi n PRO 321 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 1xxi h PRO 322 N 5.82 0.00 0.33 0.52 0.13 -1.97 0.26 132.00 137.09 1xxi h PRO 322 Ca -0.45 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.67 1xxi h PRO 322 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1xxi h PRO 322 CO 0.88 0.00 -0.16 1.15 -0.23 0.00 0.00 178.00 179.64 1xxi h THR 323 N 0.00 0.67 -0.44 1.56 2.02 -2.00 -0.06 112.91 114.67 1xxi h THR 323 Ca 0.23 -0.01 0.03 0.00 0.77 0.00 0.00 66.41 67.43 1xxi h THR 323 Cb 0.96 0.68 -0.04 0.00 -1.74 0.00 0.00 68.15 68.01 1xxi h THR 323 CO -0.00 0.00 0.23 0.44 0.37 0.00 0.00 175.52 176.56 1xxi h ASP 324 N -0.45 0.35 -0.00 4.18 5.19 -1.36 -1.21 116.42 123.12 1xxi h ASP 324 Ca -0.05 0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.38 1xxi h ASP 324 Cb 0.35 -0.05 -0.00 0.00 0.18 0.00 0.00 39.33 39.81 1xxi h ASP 324 CO 0.08 0.25 0.00 0.40 -3.12 0.00 0.00 179.24 176.84 1xxi h ILE 325 N 0.46 0.78 -0.15 0.35 2.04 -0.89 -0.51 117.51 119.60 1xxi h ILE 325 Ca 0.19 0.00 -0.18 0.00 1.00 0.00 0.00 64.86 65.87 1xxi h ILE 325 Cb 0.08 1.00 -0.00 0.00 -0.74 0.00 0.00 36.82 37.15 1xxi h ILE 325 CO -0.12 0.00 -0.65 1.56 0.00 0.00 0.00 178.15 178.94 1xxi h GLN 326 N 0.00 0.56 0.09 2.37 1.08 0.22 -2.47 115.11 116.95 1xxi h GLN 326 Ca 0.00 -0.40 -0.00 0.00 -1.45 0.00 0.00 58.65 56.79 1xxi h GLN 326 Cb 0.00 0.07 0.00 0.00 -0.05 0.00 0.00 27.48 27.50 1xxi h GLN 326 CO -0.00 1.02 -0.04 1.25 -0.95 0.00 0.00 178.83 180.11 1xxi h LEU 327 N 0.40 -0.10 -0.91 1.46 5.85 -0.70 -1.37 115.31 119.94 1xxi h LEU 327 Ca -0.01 -0.19 0.08 0.00 0.84 0.00 0.00 57.88 58.59 1xxi h LEU 327 Cb 1.22 0.03 -0.07 0.00 0.37 0.00 0.00 40.66 42.21 1xxi h LEU 327 CO 0.12 0.14 0.56 1.88 -0.34 0.00 0.00 178.44 180.80 1xxi h TYR 328 N -0.34 1.03 -0.39 1.25 0.05 -1.36 0.16 116.97 117.37 1xxi h TYR 328 Ca -0.01 0.03 -0.08 0.00 0.05 0.00 0.00 58.73 58.72 1xxi h TYR 328 Cb 0.29 -0.33 -0.02 0.00 1.01 0.00 0.00 36.73 37.68 1xxi h TYR 328 CO -0.00 0.49 -0.08 -0.92 -1.05 0.00 0.00 178.16 176.60 1xxi h TYR 329 N 0.99 0.70 -0.04 4.88 3.20 -1.28 -1.92 116.97 123.49 1xxi h TYR 329 Ca 0.41 -0.11 -0.03 0.00 3.14 0.00 0.00 58.73 62.15 1xxi h TYR 329 Cb 0.26 -0.19 0.00 0.00 1.54 0.00 0.00 36.73 38.34 1xxi h TYR 329 CO -0.03 0.71 -0.08 0.37 -1.64 0.00 0.00 178.16 177.49 1xxi h GLN 330 N 0.61 0.13 -0.24 1.82 4.15 0.28 -1.77 115.11 120.09 1xxi h GLN 330 Ca 0.11 -0.08 0.06 0.00 0.77 0.00 0.00 58.65 59.51 1xxi h GLN 330 Cb 0.49 0.01 -0.07 0.00 0.21 0.00 0.00 27.48 28.13 1xxi h GLN 330 CO 0.03 0.67 -0.21 1.15 -1.93 0.00 0.00 178.83 178.53 1xxi h THR 331 N -0.39 0.44 0.00 2.39 2.02 -0.76 0.13 112.91 116.74 1xxi h THR 331 Ca 0.00 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.13 1xxi h THR 331 Cb 0.66 0.44 -0.01 0.00 -1.74 0.00 0.00 68.15 67.51 1xxi h THR 331 CO 0.02 0.00 -0.27 -0.07 0.37 0.00 0.00 175.52 175.57 1xxi h LEU 332 N -0.22 0.00 0.08 2.58 3.38 -1.37 -1.19 115.31 118.58 1xxi h LEU 332 Ca 0.14 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 1xxi h LEU 332 Cb 0.42 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.17 1xxi h LEU 332 CO -0.36 0.27 -0.04 0.25 0.09 0.00 0.00 178.44 178.64 1xxi h LEU 333 N 0.00 -0.09 -1.14 1.67 5.85 -0.21 -2.71 115.31 118.68 1xxi h LEU 333 Ca -0.00 -0.47 0.26 0.00 0.84 0.00 0.00 57.88 58.50 1xxi h LEU 333 Cb 0.52 0.02 -0.11 0.00 0.37 0.00 0.00 40.66 41.46 1xxi h LEU 333 CO 0.03 0.58 0.63 0.40 -0.34 0.00 0.00 178.44 179.74 1xxi h ILE 334 N -0.92 0.53 0.00 4.05 2.04 -0.77 1.55 117.51 123.99 1xxi h ILE 334 Ca -0.01 -0.17 -0.02 0.00 1.00 0.00 0.00 64.86 65.65 1xxi h ILE 334 Cb 0.56 -0.03 -0.00 0.00 -0.74 0.00 0.00 36.82 36.61 1xxi h ILE 334 CO 0.02 0.09 -0.11 1.23 0.00 0.00 0.00 178.15 179.38 1xxi h GLY 335 N 0.51 0.00 1.90 5.37 0.00 -1.17 0.34 103.07 110.01 1xxi h GLY 335 Ca 0.63 0.00 -0.23 0.00 0.00 0.00 0.00 47.33 47.73 1xxi h GLY 335 CO -0.41 0.00 -1.07 -0.09 0.00 0.00 0.00 176.54 174.97 1xxi h ARG 336 N 0.00 0.06 -0.31 4.80 2.43 0.25 -2.28 114.38 119.33 1xxi h ARG 336 Ca -0.00 -0.11 -0.01 0.00 -0.81 0.00 0.00 59.98 59.05 1xxi h ARG 336 Cb 0.32 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.90 1xxi h ARG 336 CO 0.01 1.05 0.16 0.87 -1.51 0.00 0.00 179.97 180.55 1xxi h LYS 337 N 0.02 0.44 -0.00 0.20 1.57 0.37 -3.19 116.57 115.96 1xxi h LYS 337 Ca -0.04 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 58.68 1xxi h LYS 337 Cb 1.82 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 34.05 1xxi h LYS 337 CO 0.15 0.39 0.00 0.93 -0.57 0.00 0.00 179.45 180.35 1xxi h GLU 338 N 0.37 0.00 0.00 3.15 5.08 -1.35 -3.38 114.58 118.45 1xxi h GLU 338 Ca 0.11 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1xxi h GLU 338 Cb 0.09 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.34 1xxi h GLU 338 CO -0.02 0.08 0.00 -0.11 -1.00 0.00 0.00 179.01 177.96 1xxi n LEU 339 N -5.05 0.00 0.17 1.33 7.94 -0.86 0.12 117.00 120.64 1xxi n LEU 339 Ca -0.07 0.00 0.13 0.00 -1.11 0.00 0.00 56.01 54.96 1xxi n LEU 339 Cb 0.06 0.00 0.44 0.00 0.53 0.00 0.00 43.42 44.45 1xxi n LEU 339 CO 0.33 0.00 0.88 -0.65 -1.11 0.00 0.00 177.39 176.85 1xxi h PRO 340 N 0.00 0.00 0.00 1.96 0.11 -1.81 -3.05 132.00 129.21 1xxi h PRO 340 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1xxi h PRO 340 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 1xxi h PRO 340 CO 0.00 0.00 -1.20 0.66 -0.21 0.00 0.00 178.00 177.25 1xxi n TYR 341 N -2.57 0.24 -1.78 0.65 4.02 0.32 -4.91 117.16 113.13 1xxi n TYR 341 Ca 0.03 0.07 -0.37 0.00 -0.01 0.00 0.00 57.90 57.63 1xxi n TYR 341 Cb 0.37 -0.44 0.06 0.00 -0.02 0.00 0.00 39.34 39.31 1xxi n TYR 341 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1xxi s ALA 342 N -3.25 2.40 0.58 -0.72 0.00 -1.10 -4.86 121.76 114.82 1xxi s ALA 342 Ca 0.02 1.17 0.27 0.00 0.00 0.00 0.00 51.96 53.42 1xxi s ALA 342 Cb 0.14 -3.54 1.63 0.00 0.00 0.00 0.00 23.12 21.35 1xxi s ALA 342 CO 0.83 -1.53 2.13 -1.00 0.00 0.00 0.00 175.76 176.18 1xxi h PRO 343 N 0.58 0.00 -2.25 0.00 0.13 -1.90 -3.42 132.00 125.14 1xxi h PRO 343 Ca -0.51 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.57 1xxi h PRO 343 Cb 1.33 0.00 -0.23 0.00 0.13 0.00 0.00 31.00 32.23 1xxi h PRO 343 CO 0.53 0.00 -0.05 0.34 -0.23 0.00 0.00 178.00 178.59 1xxi s ASP 344 N -6.03 -0.72 0.19 1.44 -1.08 -1.26 -5.05 116.67 104.16 1xxi s ASP 344 Ca -0.05 1.26 -0.14 0.00 -0.52 0.00 0.00 52.55 53.11 1xxi s ASP 344 Cb 0.16 1.20 0.19 0.00 -1.46 0.00 0.00 42.92 43.01 1xxi s ASP 344 CO 0.58 -0.22 1.67 0.03 0.52 0.00 0.00 175.17 177.74 1xxi h ARG 345 N 6.20 0.06 0.00 4.34 3.08 -1.83 0.21 114.38 126.43 1xxi h ARG 345 Ca -0.31 -0.00 -0.00 0.00 0.07 0.00 0.00 59.98 59.74 1xxi h ARG 345 Cb 1.19 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 31.23 1xxi h ARG 345 CO 0.17 0.04 -0.02 -0.09 -1.07 0.00 0.00 179.97 179.00 1xxi h ARG 346 N 0.06 0.00 0.06 0.04 2.43 -1.97 -1.73 114.38 113.28 1xxi h ARG 346 Ca 0.26 0.00 -0.19 0.00 -0.81 0.00 0.00 59.98 59.24 1xxi h ARG 346 Cb 0.39 0.00 0.02 0.00 -0.42 0.00 0.00 29.97 29.96 1xxi h ARG 346 CO -0.47 0.02 -0.77 1.98 -1.51 0.00 0.00 179.97 179.21 1xxi h MET 347 N 0.00 0.41 -0.80 0.20 4.05 -1.31 -2.78 114.93 114.71 1xxi h MET 347 Ca -0.00 -0.53 0.16 0.00 -0.28 0.00 0.00 59.70 59.05 1xxi h MET 347 Cb 0.03 0.17 -0.10 0.00 -0.80 0.00 0.00 31.60 30.90 1xxi h MET 347 CO 0.00 1.19 0.33 0.78 0.23 0.00 0.00 176.91 179.45 1xxi h GLY 348 N -0.13 1.26 1.71 1.39 0.00 0.18 0.24 103.07 107.73 1xxi h GLY 348 Ca -0.11 -0.16 -0.07 0.00 0.00 0.00 0.00 47.33 46.98 1xxi h GLY 348 CO 0.15 -0.13 -0.20 -2.08 0.00 0.00 0.00 176.54 174.28 1xxi h VAL 349 N 0.45 1.23 -0.09 4.60 2.07 -1.43 0.95 116.25 124.03 1xxi h VAL 349 Ca 0.45 -1.06 -0.23 0.00 0.82 0.00 0.00 66.70 66.68 1xxi h VAL 349 Cb 0.73 1.30 0.01 0.00 -1.52 0.00 0.00 31.29 31.81 1xxi h VAL 349 CO -0.43 0.33 -0.87 -0.33 0.02 0.00 0.00 177.57 176.29 1xxi h GLU 350 N 0.32 0.72 -0.35 1.57 5.08 -0.82 -2.97 114.58 118.13 1xxi h GLU 350 Ca 0.06 -0.65 -0.17 0.00 -1.00 0.00 0.00 59.36 57.59 1xxi h GLU 350 Cb 0.53 0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.93 1xxi h GLU 350 CO 0.04 1.25 -0.45 1.98 -1.00 0.00 0.00 179.01 180.82 1xxi h MET 351 N 0.46 0.92 -0.61 2.33 4.05 -0.66 0.13 114.93 121.56 1xxi h MET 351 Ca -0.08 -0.53 0.04 0.00 -0.28 0.00 0.00 59.70 58.86 1xxi h MET 351 Cb 1.50 0.04 -0.03 0.00 -0.80 0.00 0.00 31.60 32.30 1xxi h MET 351 CO 0.17 1.18 0.40 1.15 0.23 0.00 0.00 176.91 180.04 1xxi h THR 352 N 0.74 1.05 0.10 -0.77 2.02 -0.85 -1.74 112.91 113.46 1xxi h THR 352 Ca 0.04 -0.23 -0.18 0.00 0.77 0.00 0.00 66.41 66.82 1xxi h THR 352 Cb 1.05 0.32 0.02 0.00 -1.74 0.00 0.00 68.15 67.80 1xxi h THR 352 CO 0.11 0.12 -0.75 -0.07 0.37 0.00 0.00 175.52 175.30 1xxi h LEU 353 N 0.67 0.48 -1.84 2.58 3.38 -1.29 -2.95 115.31 116.35 1xxi h LEU 353 Ca 0.25 -0.90 0.00 0.00 0.09 0.00 0.00 57.88 57.32 1xxi h LEU 353 Cb 0.15 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1xxi h LEU 353 CO -0.07 1.34 0.00 -0.07 0.09 0.00 0.00 178.44 179.73 1xxi h LEU 354 N -0.31 0.00 0.00 1.67 3.38 -0.41 -0.12 115.31 119.53 1xxi h LEU 354 Ca -0.12 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.82 1xxi h LEU 354 Cb 1.55 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.29 1xxi h LEU 354 CO 0.14 0.00 -0.17 -0.09 0.09 0.00 0.00 178.44 178.41 1xxi h ARG 355 N 0.00 0.00 -0.90 1.13 2.43 -1.32 -1.99 114.38 113.73 1xxi h ARG 355 Ca 0.00 0.00 0.19 0.00 -0.81 0.00 0.00 59.98 59.36 1xxi h ARG 355 Cb 0.02 0.00 -0.07 0.00 -0.42 0.00 0.00 29.97 29.50 1xxi h ARG 355 CO 0.00 0.91 0.59 0.00 -1.51 0.00 0.00 179.97 179.96 1xxi h ALA 356 N -0.15 2.07 -0.24 2.80 0.00 -0.91 0.28 119.26 123.12 1xxi h ALA 356 Ca -0.05 0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.74 1xxi h ALA 356 Cb 0.96 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1xxi h ALA 356 CO -0.03 -0.36 -0.42 -0.07 0.00 0.00 0.00 179.25 178.38 1xxi h LEU 357 N 0.50 0.78 -0.86 0.00 4.07 -1.18 -1.25 115.31 117.37 1xxi h LEU 357 Ca 0.47 -0.53 -0.09 0.00 0.08 0.00 0.00 57.88 57.81 1xxi h LEU 357 Cb 1.04 -0.22 -0.01 0.00 1.08 0.00 0.00 40.66 42.55 1xxi h LEU 357 CO -0.20 1.16 -0.44 0.00 -1.08 0.00 0.00 178.44 177.88 1xxi h ALA 358 N 0.64 0.98 -0.42 1.53 0.00 -0.25 -2.99 119.26 118.75 1xxi h ALA 358 Ca 0.01 -0.40 -0.10 0.00 0.00 0.00 0.00 54.91 54.42 1xxi h ALA 358 Cb 1.02 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.67 1xxi h ALA 358 CO 0.09 0.55 0.06 1.19 0.00 0.00 0.00 179.25 181.15 1xxi n PHE 359 N -3.59 1.41 -1.87 0.00 3.01 0.79 -4.15 117.46 113.07 1xxi n PHE 359 Ca -0.00 -1.14 -0.42 0.00 1.01 0.00 0.00 57.45 56.90 1xxi n PHE 359 Cb 0.54 -0.46 -0.03 0.00 -0.01 0.00 0.00 39.48 39.52 1xxi n PHE 359 CO 0.00 0.00 0.00 -1.58 1.01 0.00 0.00 176.76 176.19 1xxi s HIS 360 N -2.98 2.95 0.24 1.38 2.46 -0.48 -4.94 115.29 113.93 1xxi s HIS 360 Ca 0.47 0.67 -0.01 0.00 0.47 0.00 0.00 55.06 56.66 1xxi s HIS 360 Cb 0.39 -3.99 0.29 0.00 -0.13 0.00 0.00 32.58 29.14 1xxi s HIS 360 CO 0.08 -3.52 1.67 -1.00 -2.47 0.00 0.00 174.74 169.50 1xxi h PRO 361 N 6.00 0.64 0.00 2.88 0.13 -1.93 -3.34 132.00 136.39 1xxi h PRO 361 Ca -0.44 -0.25 -0.10 0.00 -0.87 0.00 0.00 66.00 64.34 1xxi h PRO 361 Cb 1.21 -0.03 -0.02 0.00 0.13 0.00 0.00 31.00 32.29 1xxi h PRO 361 CO 0.87 0.82 -1.44 0.54 -0.23 0.00 0.00 178.00 178.56 1xxi n ARG 362 N -4.12 0.63 -3.64 0.86 5.12 -1.26 -4.94 116.66 109.31 1xxi n ARG 362 Ca -0.00 0.10 -0.08 0.00 -1.93 0.00 0.00 57.85 55.94 1xxi n ARG 362 Cb 0.42 -1.75 -0.07 0.00 -1.16 0.00 0.00 32.46 29.90 1xxi n ARG 362 CO 0.00 0.00 0.00 -1.64 -1.93 0.00 0.00 177.63 174.06 1xxi s MET 363 N -3.14 0.55 0.33 5.56 -1.94 -1.25 -5.20 119.30 114.21 1xxi s MET 363 Ca -0.03 0.75 0.04 0.00 -1.71 0.00 0.00 55.69 54.73 1xxi s MET 363 Cb 0.10 0.21 -0.03 0.00 2.01 0.00 0.00 34.83 37.11 1xxi s MET 363 CO 0.82 -0.08 0.17 -1.25 -0.01 0.00 0.00 175.02 174.67 1xxi s PRO 364 N 0.71 1.67 0.09 2.03 0.04 -1.26 -4.28 135.00 134.00 1xxi s PRO 364 Ca -0.02 -1.97 -0.31 0.00 0.04 0.00 0.00 61.00 58.74 1xxi s PRO 364 Cb -0.05 -0.13 -0.09 0.00 0.04 0.00 0.00 34.50 34.27 1xxi s PRO 364 CO -0.09 -0.48 1.67 -0.51 0.04 0.00 0.00 177.00 177.63 1xxi s LEU 365 N -3.41 4.37 0.64 -3.56 1.43 -1.22 -5.00 118.68 111.92 1xxi s LEU 365 Ca 0.34 2.54 -0.04 0.00 -1.03 0.00 0.00 54.13 55.94 1xxi s LEU 365 Cb 0.04 -3.57 0.04 0.00 0.03 0.00 0.00 46.19 42.74 1xxi s LEU 365 CO 0.18 -0.90 0.92 -2.16 0.23 0.00 0.00 176.35 174.63 1xxi s PRO 366 N 2.46 2.45 0.06 1.29 0.04 -1.26 -4.98 135.00 135.06 1xxi s PRO 366 Ca 0.74 -0.33 -0.27 0.00 0.04 0.00 0.00 61.00 61.18 1xxi s PRO 366 Cb -0.41 -2.28 0.07 0.00 0.04 0.00 0.00 34.50 31.92 1xxi s PRO 366 CO 0.33 -0.97 0.65 -1.21 0.04 0.00 0.00 177.00 175.83 1xxi s GLU 367 N -5.06 1.16 0.00 4.56 2.02 -1.26 -5.25 118.70 114.87 1xxi s GLU 367 Ca 0.58 -0.15 0.21 0.00 0.02 0.00 0.00 54.97 55.63 1xxi s GLU 367 Cb -0.11 0.54 0.16 0.00 0.10 0.00 0.00 34.13 34.83 1xxi s GLU 367 CO 0.43 -0.45 1.16 -0.35 0.02 0.00 0.00 175.26 176.07