#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xxi h LEU 6 N 0.00 0.16 -0.63 1.34 3.38 -1.96 -1.94 115.31 115.66 1xxi h LEU 6 Ca 0.00 0.12 0.10 0.00 0.09 0.00 0.00 57.88 58.19 1xxi h LEU 6 Cb 0.00 0.12 -0.08 0.00 0.09 0.00 0.00 40.66 40.80 1xxi h LEU 6 CO 0.00 0.05 0.22 0.00 0.09 0.00 0.00 178.44 178.80 1xxi h ALA 7 N 1.54 0.81 -0.08 1.53 0.00 -1.82 0.19 119.26 121.43 1xxi h ALA 7 Ca 0.39 0.10 -0.24 0.00 0.00 0.00 0.00 54.91 55.15 1xxi h ALA 7 Cb 0.60 0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.49 1xxi h ALA 7 CO -0.42 -0.21 -0.90 -0.09 0.00 0.00 0.00 179.25 177.62 1xxi h ARG 8 N 0.39 0.73 -0.30 0.00 9.65 -1.82 -3.11 114.38 119.91 1xxi h ARG 8 Ca 0.32 -0.68 -0.09 0.00 -1.10 0.00 0.00 59.98 58.44 1xxi h ARG 8 Cb 0.43 0.17 -0.02 0.00 -1.39 0.00 0.00 29.97 29.16 1xxi h ARG 8 CO -0.34 1.27 -0.18 -0.22 2.80 0.00 0.00 179.97 183.30 1xxi h LYS 9 N 0.46 0.55 -0.81 0.20 3.64 -0.89 -3.15 116.57 116.57 1xxi h LYS 9 Ca -0.09 -0.19 -0.39 0.00 -1.27 0.00 0.00 60.65 58.72 1xxi h LYS 9 Cb 1.54 -0.04 -0.23 0.00 -0.41 0.00 0.00 32.23 33.09 1xxi h LYS 9 CO 0.18 0.71 0.43 0.91 -2.27 0.00 0.00 179.45 179.40 1xxi n TRP 10 N -4.15 2.51 -2.02 1.91 7.02 0.61 -4.97 117.44 118.34 1xxi n TRP 10 Ca 0.00 -1.67 -0.41 0.00 -1.02 0.00 0.00 57.50 54.40 1xxi n TRP 10 Cb 0.37 -0.80 -0.02 0.00 -2.42 0.00 0.00 31.31 28.44 1xxi n TRP 10 CO 0.00 0.00 0.00 0.50 -2.02 0.00 0.00 177.69 176.17 1xxi s ARG 11 N -3.23 4.27 0.16 -0.99 6.06 -1.18 -4.90 118.95 119.15 1xxi s ARG 11 Ca 0.54 2.28 -0.34 0.00 -2.50 0.00 0.00 55.73 55.71 1xxi s ARG 11 Cb 0.46 -3.13 -0.14 0.00 0.06 0.00 0.00 34.95 32.19 1xxi s ARG 11 CO 0.09 -0.44 1.52 -2.30 -2.50 0.00 0.00 175.30 171.67 1xxi n PRO 12 N 2.70 1.98 -0.00 5.12 -0.02 -1.26 -4.88 135.00 138.64 1xxi n PRO 12 Ca 0.08 0.71 0.06 0.00 -2.02 0.00 0.00 63.50 62.33 1xxi n PRO 12 Cb 0.40 -2.45 -0.07 0.00 -0.02 0.00 0.00 33.50 31.36 1xxi n PRO 12 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 1xxi n GLN 13 N 3.08 2.82 -3.83 -0.52 -0.06 -1.26 -4.90 117.38 112.71 1xxi n GLN 13 Ca 0.16 -0.00 -0.09 0.00 -2.00 0.00 0.00 57.00 55.07 1xxi n GLN 13 Cb 0.28 -1.09 -0.07 0.00 -4.06 0.00 0.00 30.24 25.29 1xxi n GLN 13 CO 0.00 0.00 0.00 0.95 -0.20 0.00 0.00 177.06 177.81 1xxi s THR 14 N -2.19 0.13 0.48 1.69 -4.23 -1.26 -4.92 115.64 105.33 1xxi s THR 14 Ca 0.05 -1.06 0.13 0.00 -1.18 0.00 0.00 61.69 59.63 1xxi s THR 14 Cb 0.09 -1.24 0.26 0.00 1.34 0.00 0.00 72.50 72.95 1xxi s THR 14 CO 0.52 -0.58 2.10 -0.26 -0.54 0.00 0.00 174.62 175.85 1xxi h PHE 15 N 2.83 0.18 0.00 3.99 0.05 -1.95 -0.78 116.94 121.27 1xxi h PHE 15 Ca -0.34 0.00 -0.02 0.00 3.82 0.00 0.00 57.97 61.44 1xxi h PHE 15 Cb 1.20 -0.06 -0.00 0.00 2.00 0.00 0.00 35.95 39.09 1xxi h PHE 15 CO 0.43 0.13 -0.10 0.00 -0.18 0.00 0.00 178.31 178.59 1xxi h ALA 16 N 1.89 1.14 0.00 2.45 0.00 -1.96 -1.93 119.26 120.86 1xxi h ALA 16 Ca 0.05 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1xxi h ALA 16 Cb 0.01 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1xxi h ALA 16 CO -0.01 0.12 -0.14 -0.25 0.00 0.00 0.00 179.25 178.97 1xxi n ASP 17 N -3.41 0.51 -4.72 0.00 8.00 -0.30 -4.85 116.55 111.79 1xxi n ASP 17 Ca -0.01 0.41 -0.42 0.00 0.71 0.00 0.00 54.79 55.48 1xxi n ASP 17 Cb 0.26 -0.47 -0.03 0.00 -0.02 0.00 0.00 41.12 40.87 1xxi n ASP 17 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1xxi s VAL 18 N -3.07 3.92 -0.13 2.53 1.01 -0.73 -4.80 120.40 119.13 1xxi s VAL 18 Ca 0.11 1.42 -0.23 0.00 0.00 0.00 0.00 61.98 63.29 1xxi s VAL 18 Cb 0.15 -3.91 -0.03 0.00 0.00 0.00 0.00 36.38 32.59 1xxi s VAL 18 CO 0.60 0.14 0.68 -0.69 0.00 0.00 0.00 175.10 175.83 1xxi s VAL 19 N 0.81 5.02 -1.69 2.92 1.01 -1.26 -4.70 120.40 122.52 1xxi s VAL 19 Ca 0.57 1.36 -0.10 0.00 0.00 0.00 0.00 61.98 63.81 1xxi s VAL 19 Cb -0.30 -4.01 0.10 0.00 0.00 0.00 0.00 36.38 32.17 1xxi s VAL 19 CO 0.31 0.18 0.27 0.61 0.00 0.00 0.00 175.10 176.46 1xxi n GLY 20 N 3.39 -0.24 2.44 4.51 0.00 -1.26 -4.89 105.19 109.13 1xxi n GLY 20 Ca -0.01 0.13 -0.18 0.00 0.00 0.00 0.00 46.02 45.96 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 -4.37 2.77 -0.27 1.61 1.13 -1.26 -4.85 117.38 112.15 1xxi n GLN 21 Ca -0.14 -4.00 -0.04 0.00 -1.94 0.00 0.00 57.00 50.88 1xxi n GLN 21 Cb 0.60 -1.96 0.02 0.00 0.11 0.00 0.00 30.24 29.00 1xxi n GLN 21 CO 0.00 0.00 0.00 0.93 -1.44 0.00 0.00 177.06 176.55 1xxi h GLU 22 N 2.55 -0.10 -0.47 -1.09 3.07 -1.94 -0.22 114.58 116.37 1xxi h GLU 22 Ca 0.17 0.01 0.11 0.00 -0.50 0.00 0.00 59.36 59.15 1xxi h GLU 22 Cb 1.21 0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 29.12 1xxi h GLU 22 CO 0.65 -0.07 0.33 1.12 -1.40 0.00 0.00 179.01 179.64 1xxi h HIS 23 N -0.11 0.14 0.13 4.33 2.07 -1.99 0.28 115.15 120.00 1xxi h HIS 23 Ca 0.27 0.00 -0.19 0.00 -2.85 0.00 0.00 60.37 57.60 1xxi h HIS 23 Cb 0.57 -0.05 0.02 0.00 2.57 0.00 0.00 27.41 30.52 1xxi h HIS 23 CO -0.72 0.07 -0.87 0.28 -3.07 0.00 0.00 177.93 173.61 1xxi h VAL 24 N 0.13 1.44 -0.40 6.12 2.07 -1.48 -3.17 116.25 120.96 1xxi h VAL 24 Ca 0.22 -2.50 -0.07 0.00 0.82 0.00 0.00 66.70 65.18 1xxi h VAL 24 Cb 0.71 3.12 -0.02 0.00 -1.52 0.00 0.00 31.29 33.58 1xxi h VAL 24 CO -0.03 0.70 -0.04 -0.07 0.02 0.00 0.00 177.57 178.16 1xxi h LEU 25 N -0.41 0.63 -0.58 2.57 3.38 -0.36 -1.29 115.31 119.24 1xxi h LEU 25 Ca -0.16 -0.15 -0.12 0.00 0.09 0.00 0.00 57.88 57.54 1xxi h LEU 25 Cb 1.62 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 42.18 1xxi h LEU 25 CO 0.12 0.73 -0.15 0.74 0.09 0.00 0.00 178.44 179.97 1xxi h THR 26 N 0.62 1.27 -0.15 0.22 2.02 -0.61 -1.38 112.91 114.90 1xxi h THR 26 Ca 0.12 -1.30 -0.17 0.00 0.77 0.00 0.00 66.41 65.83 1xxi h THR 26 Cb 0.44 1.04 0.01 0.00 -1.74 0.00 0.00 68.15 67.90 1xxi h THR 26 CO 0.02 0.45 -0.56 0.00 0.37 0.00 0.00 175.52 175.80 1xxi h ALA 27 N 0.96 0.27 -0.66 6.16 0.00 -1.46 -1.65 119.26 122.88 1xxi h ALA 27 Ca 0.13 -0.52 -0.06 0.00 0.00 0.00 0.00 54.91 54.45 1xxi h ALA 27 Cb 0.71 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.45 1xxi h ALA 27 CO 0.05 0.49 0.16 -0.07 0.00 0.00 0.00 179.25 179.88 1xxi h LEU 28 N 0.30 1.00 -0.39 0.00 3.38 -1.25 -1.51 115.31 116.83 1xxi h LEU 28 Ca -0.03 -0.23 -0.06 0.00 0.09 0.00 0.00 57.88 57.65 1xxi h LEU 28 Cb 1.19 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.67 1xxi h LEU 28 CO 0.12 0.97 0.01 0.00 0.09 0.00 0.00 178.44 179.63 1xxi h ALA 29 N 1.06 0.53 -0.17 1.53 0.00 -1.25 0.06 119.26 121.02 1xxi h ALA 29 Ca 0.21 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 1xxi h ALA 29 Cb 0.36 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1xxi h ALA 29 CO 0.00 0.30 0.11 -0.97 0.00 0.00 0.00 179.25 178.69 1xxi h ASN 30 N 0.52 0.21 -0.13 0.00 -1.24 -1.17 0.13 115.58 113.90 1xxi h ASN 30 Ca 0.11 -0.04 0.00 0.00 0.71 0.00 0.00 56.30 57.08 1xxi h ASN 30 Cb 0.46 -0.05 -0.01 0.00 0.73 0.00 0.00 38.32 39.45 1xxi h ASN 30 CO 0.02 0.19 0.08 1.23 -1.29 0.00 0.00 177.43 177.66 1xxi h GLY 31 N 0.21 0.18 0.96 1.57 0.00 -1.18 -2.03 103.07 102.78 1xxi h GLY 31 Ca 0.06 -0.06 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 1xxi h GLY 31 CO -0.01 0.06 0.01 1.41 0.00 0.00 0.00 176.54 178.01 1xxi h LEU 32 N 0.17 0.03 -1.67 3.11 3.38 -0.79 0.07 115.31 119.61 1xxi h LEU 32 Ca 0.05 -0.04 0.01 0.00 0.09 0.00 0.00 57.88 57.99 1xxi h LEU 32 Cb -0.01 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 1xxi h LEU 32 CO -0.02 0.06 0.24 0.77 0.09 0.00 0.00 178.44 179.58 1xxi h SER 33 N -0.01 0.38 -0.57 -0.43 4.64 -0.63 -2.00 113.55 114.95 1xxi h SER 33 Ca 0.01 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1xxi h SER 33 Cb 0.04 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.04 1xxi h SER 33 CO -0.00 0.28 0.00 0.18 -0.87 0.00 0.00 176.83 176.41 1xxi n LEU 34 N -4.48 3.62 -2.32 5.97 4.77 -0.77 -4.94 117.00 118.84 1xxi n LEU 34 Ca 0.03 -1.82 -0.20 0.00 -0.03 0.00 0.00 56.01 53.99 1xxi n LEU 34 Cb 0.09 -0.46 -0.00 0.00 -2.33 0.00 0.00 43.42 40.71 1xxi n LEU 34 CO 0.35 0.74 -0.22 0.61 -1.33 0.00 0.00 177.39 177.54 1xxi n GLY 35 N 1.22 -0.44 3.27 -0.72 0.00 -0.75 -4.95 105.19 102.82 1xxi n GLY 35 Ca 0.21 -0.04 -0.44 0.00 0.00 0.00 0.00 46.02 45.74 1xxi n GLY 35 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1xxi s ARG 36 N -5.07 3.34 -0.18 1.61 3.52 -0.03 -5.03 118.95 117.11 1xxi s ARG 36 Ca 0.04 -2.50 -0.04 0.00 -0.13 0.00 0.00 55.73 53.09 1xxi s ARG 36 Cb -0.02 -4.24 -0.02 0.00 -1.56 0.00 0.00 34.95 29.11 1xxi s ARG 36 CO 0.05 -1.26 -0.02 0.42 -0.81 0.00 0.00 175.30 173.68 1xxi s ILE 37 N 0.06 3.89 0.55 4.11 -1.09 -1.26 -4.49 121.20 122.98 1xxi s ILE 37 Ca 0.18 -0.34 -0.05 0.00 -2.23 0.00 0.00 60.65 58.21 1xxi s ILE 37 Cb -0.13 -2.74 -0.00 0.00 -1.58 0.00 0.00 42.46 38.02 1xxi s ILE 37 CO -0.07 0.45 0.84 -1.00 -1.23 0.00 0.00 174.94 173.93 1xxi s HIS 38 N 0.77 3.29 -0.54 3.97 3.76 -1.26 -4.99 115.29 120.29 1xxi s HIS 38 Ca -0.01 0.60 0.24 0.00 -0.15 0.00 0.00 55.06 55.74 1xxi s HIS 38 Cb -0.14 -2.60 0.47 0.00 1.11 0.00 0.00 32.58 31.41 1xxi s HIS 38 CO 0.02 -0.66 1.59 1.12 -0.85 0.00 0.00 174.74 175.96 1xxi h HIS 39 N -0.02 0.00 -2.95 1.40 2.07 -1.91 -3.46 115.15 110.28 1xxi h HIS 39 Ca -0.46 0.00 -0.15 0.00 -2.85 0.00 0.00 60.37 56.91 1xxi h HIS 39 Cb 1.25 0.00 -0.26 0.00 2.57 0.00 0.00 27.41 30.97 1xxi h HIS 39 CO 0.49 0.00 -0.36 0.00 -3.07 0.00 0.00 177.93 174.98 1xxi s ALA 40 N -3.18 -0.78 0.01 6.11 0.00 -1.26 -1.39 121.76 121.28 1xxi s ALA 40 Ca 0.07 0.97 0.08 0.00 0.00 0.00 0.00 51.96 53.08 1xxi s ALA 40 Cb 0.08 -0.57 -0.02 0.00 0.00 0.00 0.00 23.12 22.61 1xxi s ALA 40 CO 0.66 -0.17 -0.24 0.71 0.00 0.00 0.00 175.76 176.73 1xxi s TYR 41 N 0.44 2.11 -0.11 0.00 1.51 0.14 -1.55 117.35 119.89 1xxi s TYR 41 Ca -0.02 -0.40 0.02 0.00 -1.01 0.00 0.00 57.07 55.66 1xxi s TYR 41 Cb -0.04 -1.32 0.01 0.00 -0.11 0.00 0.00 41.96 40.51 1xxi s TYR 41 CO -0.02 0.03 -0.18 -1.17 -1.11 0.00 0.00 175.55 173.10 1xxi s LEU 42 N -0.84 1.87 -0.22 -1.29 0.20 0.94 0.41 118.68 119.75 1xxi s LEU 42 Ca 0.09 -0.48 -0.01 0.00 0.69 0.00 0.00 54.13 54.43 1xxi s LEU 42 Cb -0.09 -1.20 0.02 0.00 -0.43 0.00 0.00 46.19 44.48 1xxi s LEU 42 CO 0.00 0.06 -0.11 -0.36 -0.29 0.00 0.00 176.35 175.65 1xxi s PHE 43 N 0.81 2.95 0.32 5.38 0.08 0.11 -0.10 117.98 127.54 1xxi s PHE 43 Ca -0.09 -1.52 0.10 0.00 0.12 0.00 0.00 56.93 55.54 1xxi s PHE 43 Cb -0.16 -2.01 -0.06 0.00 -0.57 0.00 0.00 43.02 40.23 1xxi s PHE 43 CO 0.01 -0.73 -0.10 -1.54 -0.10 0.00 0.00 175.22 172.75 1xxi s SER 44 N 1.33 3.81 0.00 1.36 1.04 -0.29 -1.03 113.70 119.92 1xxi s SER 44 Ca 0.02 -1.08 0.00 0.00 0.48 0.00 0.00 55.95 55.37 1xxi s SER 44 Cb -0.15 -0.39 0.00 0.00 0.10 0.00 0.00 66.02 65.58 1xxi s SER 44 CO -0.07 -0.12 0.00 0.61 0.98 0.00 0.00 173.24 174.63 1xxi n GLY 45 N -0.77 2.70 0.00 7.32 0.00 -1.03 -0.13 105.19 113.28 1xxi n GLY 45 Ca -0.05 -1.53 0.00 0.00 0.00 0.00 0.00 46.02 44.44 1xxi n GLY 45 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1xxi n THR 46 N -1.66 0.00 -2.42 2.61 -2.24 -1.26 -4.03 114.28 105.28 1xxi n THR 46 Ca 0.00 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.37 1xxi n THR 46 Cb 0.00 -1.19 -0.04 0.00 -2.10 0.00 0.00 70.33 67.00 1xxi n THR 46 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1xxi s ARG 47 N -0.67 4.52 -1.55 -0.78 1.81 -1.26 -4.15 118.95 116.86 1xxi s ARG 47 Ca 0.00 1.82 -0.12 0.00 -1.72 0.00 0.00 55.73 55.70 1xxi s ARG 47 Cb 0.00 -3.26 0.09 0.00 -0.45 0.00 0.00 34.95 31.33 1xxi s ARG 47 CO 0.00 -0.06 0.85 0.41 -0.68 0.00 0.00 175.30 175.82 1xxi n GLY 48 N 2.24 -0.43 0.04 -3.53 0.00 -1.26 -4.17 105.19 98.08 1xxi n GLY 48 Ca 0.04 0.17 0.09 0.00 0.00 0.00 0.00 46.02 46.32 1xxi n GLY 48 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1xxi n VAL 49 N -4.54 0.00 0.00 1.61 0.24 -1.26 -1.13 118.33 113.26 1xxi n VAL 49 Ca -0.02 -0.08 0.00 0.00 -2.04 0.00 0.00 64.34 62.20 1xxi n VAL 49 Cb 0.55 1.02 0.00 0.00 -1.47 0.00 0.00 33.84 33.94 1xxi n VAL 49 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1xxi n GLY 50 N 1.43 1.64 0.24 7.63 0.00 -1.26 -4.92 105.19 109.94 1xxi n GLY 50 Ca 0.04 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.91 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 0.24 -0.49 -0.45 1.61 1.57 -1.93 -1.35 116.57 115.76 1xxi h LYS 51 Ca 0.00 0.03 -0.11 0.00 -1.87 0.00 0.00 60.65 58.70 1xxi h LYS 51 Cb 0.00 0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.41 1xxi h LYS 51 CO 0.00 -0.33 -0.17 1.15 -0.57 0.00 0.00 179.45 179.54 1xxi h THR 52 N -0.51 1.27 -0.12 -0.16 2.02 -1.97 -0.79 112.91 112.66 1xxi h THR 52 Ca -0.04 -1.28 0.02 0.00 0.77 0.00 0.00 66.41 65.88 1xxi h THR 52 Cb 0.41 1.10 -0.02 0.00 -1.74 0.00 0.00 68.15 67.90 1xxi h THR 52 CO 0.05 0.44 -0.00 0.28 0.37 0.00 0.00 175.52 176.65 1xxi h SER 53 N 0.76 -0.05 -0.40 4.18 0.02 -1.94 0.79 113.55 116.91 1xxi h SER 53 Ca 0.11 0.03 -0.08 0.00 -0.84 0.00 0.00 61.79 61.01 1xxi h SER 53 Cb 0.69 0.05 -0.01 0.00 0.14 0.00 0.00 62.40 63.26 1xxi h SER 53 CO 0.05 -0.01 -0.06 0.40 -1.14 0.00 0.00 176.83 176.07 1xxi h ILE 54 N 0.04 1.27 -0.70 3.27 2.04 -1.17 -1.42 117.51 120.84 1xxi h ILE 54 Ca 0.05 -1.13 0.04 0.00 1.00 0.00 0.00 64.86 64.82 1xxi h ILE 54 Cb 0.06 1.18 -0.05 0.00 -0.74 0.00 0.00 36.82 37.28 1xxi h ILE 54 CO -0.09 0.38 0.42 0.00 0.00 0.00 0.00 178.15 178.86 1xxi h ALA 55 N 0.86 0.93 -0.67 1.87 0.00 -0.89 -0.29 119.26 121.07 1xxi h ALA 55 Ca 0.11 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 1xxi h ALA 55 Cb 0.58 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 1xxi h ALA 55 CO 0.03 0.16 0.22 -0.09 0.00 0.00 0.00 179.25 179.57 1xxi h ARG 56 N 0.80 1.02 -0.44 0.00 2.43 -0.61 -1.01 114.38 116.57 1xxi h ARG 56 Ca 0.29 -0.20 -0.14 0.00 -0.81 0.00 0.00 59.98 59.12 1xxi h ARG 56 Cb 0.09 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.47 1xxi h ARG 56 CO -0.14 0.87 -0.27 -0.07 -1.51 0.00 0.00 179.97 178.86 1xxi h LEU 57 N 0.99 1.00 -0.45 3.80 3.38 -0.66 -1.08 115.31 122.29 1xxi h LEU 57 Ca 0.22 -0.42 0.01 0.00 0.09 0.00 0.00 57.88 57.78 1xxi h LEU 57 Cb 0.27 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 1xxi h LEU 57 CO -0.01 1.20 0.29 0.25 0.09 0.00 0.00 178.44 180.26 1xxi h LEU 58 N 0.80 0.49 -1.16 1.67 5.85 -0.64 0.78 115.31 123.10 1xxi h LEU 58 Ca 0.09 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 1xxi h LEU 58 Cb 0.85 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.73 1xxi h LEU 58 CO 0.08 0.35 0.44 0.00 -0.34 0.00 0.00 178.44 178.97 1xxi h ALA 59 N 1.17 1.36 -0.37 1.25 0.00 -1.04 -0.04 119.26 121.60 1xxi h ALA 59 Ca 0.17 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 1xxi h ALA 59 Cb -0.05 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.43 1xxi h ALA 59 CO -0.05 0.54 0.01 -0.22 0.00 0.00 0.00 179.25 179.53 1xxi h LYS 60 N 1.03 0.64 -0.06 0.00 3.64 0.16 -2.39 116.57 119.59 1xxi h LYS 60 Ca 0.27 -0.20 -0.06 0.00 -1.27 0.00 0.00 60.65 59.39 1xxi h LYS 60 Cb -0.02 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.72 1xxi h LYS 60 CO -0.05 0.74 -0.25 0.78 -2.27 0.00 0.00 179.45 178.40 1xxi h GLY 61 N 0.47 0.12 1.86 5.01 0.00 0.14 -2.26 103.07 108.39 1xxi h GLY 61 Ca 0.11 -0.08 -0.17 0.00 0.00 0.00 0.00 47.33 47.18 1xxi h GLY 61 CO 0.02 0.08 -0.78 1.41 0.00 0.00 0.00 176.54 177.27 1xxi h LEU 62 N 0.10 0.16 -2.29 3.11 3.38 -0.83 -1.01 115.31 117.94 1xxi h LEU 62 Ca 0.02 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.87 1xxi h LEU 62 Cb 0.51 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.21 1xxi h LEU 62 CO 0.04 0.87 0.00 0.59 0.09 0.00 0.00 178.44 180.03 1xxi n ASN 63 N -3.70 2.51 -4.71 -0.43 3.02 -0.92 -4.65 115.26 106.39 1xxi n ASN 63 Ca -0.02 -1.78 -0.43 0.00 -0.03 0.00 0.00 54.58 52.32 1xxi n ASN 63 Cb 0.74 -0.14 -0.03 0.00 -0.61 0.00 0.00 39.78 39.75 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 5.44 0.00 0.00 0.00 5.08 -1.95 -0.55 114.58 122.60 1xxi h GLU 65 Ca -0.45 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 57.89 1xxi h GLU 65 Cb 1.23 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.48 1xxi h GLU 65 CO 0.85 0.00 -0.11 0.00 -1.00 0.00 0.00 179.01 178.75 1xxi h THR 66 N 0.00 0.72 0.00 1.13 1.03 -1.99 -3.48 112.91 110.32 1xxi h THR 66 Ca 0.01 -0.43 0.00 0.00 -0.01 0.00 0.00 66.41 65.97 1xxi h THR 66 Cb 0.03 1.26 0.00 0.00 -1.07 0.00 0.00 68.15 68.37 1xxi h THR 66 CO -0.00 0.11 0.00 0.61 -0.01 0.00 0.00 175.52 176.23 1xxi n GLY 67 N -0.93 3.11 3.62 2.99 0.00 -0.21 -5.02 105.19 108.74 1xxi n GLY 67 Ca -0.02 -1.85 -0.43 0.00 0.00 0.00 0.00 46.02 43.72 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 -2.03 3.33 0.05 -0.61 1.01 -1.26 -4.35 121.20 117.33 1xxi s ILE 68 Ca 0.00 0.36 -0.06 0.00 0.00 0.00 0.00 60.65 60.95 1xxi s ILE 68 Cb 0.00 -3.36 -0.01 0.00 0.01 0.00 0.00 42.46 39.09 1xxi s ILE 68 CO 0.00 -0.18 0.10 0.28 0.00 0.00 0.00 174.94 175.14 1xxi s THR 69 N 6.34 0.14 -2.32 2.92 -1.32 -0.38 -4.82 115.64 116.20 1xxi s THR 69 Ca 0.85 -1.18 0.28 0.00 -1.21 0.00 0.00 61.69 60.43 1xxi s THR 69 Cb -0.30 -1.02 0.65 0.00 -1.51 0.00 0.00 72.50 70.31 1xxi s THR 69 CO 0.34 -0.65 1.87 0.00 -2.21 0.00 0.00 174.62 173.97 1xxi n ALA 70 N 0.58 2.61 -3.36 11.08 0.00 -1.26 -4.26 120.51 125.90 1xxi n ALA 70 Ca -0.18 -0.37 -0.26 0.00 0.00 0.00 0.00 53.44 52.64 1xxi n ALA 70 Cb 0.59 -1.27 -0.08 0.00 0.00 0.00 0.00 19.45 18.69 1xxi n ALA 70 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1xxi n THR 71 N -0.19 0.31 -1.57 0.00 -2.24 -1.26 -4.67 114.28 104.66 1xxi n THR 71 Ca 0.20 -4.34 -0.46 0.00 -2.27 0.00 0.00 64.05 57.17 1xxi n THR 71 Cb 0.27 -1.97 -0.03 0.00 -2.10 0.00 0.00 70.33 66.50 1xxi n THR 71 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 1xxi n PRO 72 N 1.53 1.15 -0.12 -0.78 -0.02 -1.26 -4.83 135.00 130.68 1xxi n PRO 72 Ca 0.25 0.41 -0.01 0.00 -2.02 0.00 0.00 63.50 62.13 1xxi n PRO 72 Cb 0.47 -1.79 0.24 0.00 -0.02 0.00 0.00 33.50 32.40 1xxi n PRO 72 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1xxi n GLY 74 N -1.06 1.16 0.00 0.00 0.00 -1.26 -4.84 105.19 99.18 1xxi n GLY 74 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 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 -2.00 0.00 -1.58 1.61 0.24 -1.26 -4.53 118.33 110.81 1xxi n VAL 75 Ca 0.00 -0.44 -0.30 0.00 -2.04 0.00 0.00 64.34 61.56 1xxi n VAL 75 Cb 0.00 0.94 0.07 0.00 -1.47 0.00 0.00 33.84 33.39 1xxi n VAL 75 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1xxi h ASP 77 N -0.93 0.83 -0.17 0.00 3.32 -1.99 -0.60 116.42 116.90 1xxi h ASP 77 Ca -0.46 -0.01 0.03 0.00 0.02 0.00 0.00 57.03 56.61 1xxi h ASP 77 Cb 1.25 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 40.58 1xxi h ASP 77 CO 0.59 0.59 0.00 0.78 -1.72 0.00 0.00 179.24 179.48 1xxi h ASN 78 N 0.98 -0.06 -0.47 6.45 4.21 -1.93 -0.03 115.58 124.74 1xxi h ASN 78 Ca 0.29 0.04 0.00 0.00 1.21 0.00 0.00 56.30 57.84 1xxi h ASN 78 Cb -0.04 0.06 -0.02 0.00 -1.12 0.00 0.00 38.32 37.20 1xxi h ASN 78 CO -0.09 -0.01 0.31 0.00 -1.29 0.00 0.00 177.43 176.35 1xxi h ARG 80 N 0.64 0.69 -0.60 0.00 3.08 -0.78 -2.08 114.38 115.33 1xxi h ARG 80 Ca 0.17 -0.14 -0.06 0.00 0.07 0.00 0.00 59.98 60.02 1xxi h ARG 80 Cb -0.06 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 29.86 1xxi h ARG 80 CO -0.04 0.65 0.13 0.93 -1.07 0.00 0.00 179.97 180.58 1xxi h GLU 81 N 0.59 0.97 -0.55 0.04 5.08 -0.87 -0.72 114.58 119.12 1xxi h GLU 81 Ca 0.15 -0.24 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 1xxi h GLU 81 Cb 0.24 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.34 1xxi h GLU 81 CO -0.01 0.90 0.35 0.82 -1.00 0.00 0.00 179.01 180.07 1xxi h ILE 82 N 0.88 1.15 -0.59 3.13 2.04 -1.21 0.16 117.51 123.06 1xxi h ILE 82 Ca 0.19 -0.29 0.06 0.00 1.00 0.00 0.00 64.86 65.81 1xxi h ILE 82 Cb 0.37 0.36 -0.05 0.00 -0.74 0.00 0.00 36.82 36.76 1xxi h ILE 82 CO 0.00 0.15 0.30 -0.08 0.00 0.00 0.00 178.15 178.52 1xxi h GLU 83 N 0.74 0.55 0.00 2.37 4.57 -0.99 -0.62 114.58 121.19 1xxi h GLU 83 Ca 0.20 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.35 1xxi h GLU 83 Cb -0.06 -0.12 0.00 0.00 -0.16 0.00 0.00 28.75 28.40 1xxi h GLU 83 CO -0.04 0.36 0.00 1.04 -1.18 0.00 0.00 179.01 179.19 1xxi n GLN 84 N -4.86 0.23 -1.07 1.92 6.02 -0.31 -4.88 117.38 114.43 1xxi n GLN 84 Ca 0.07 0.35 -0.02 0.00 -0.01 0.00 0.00 57.00 57.38 1xxi n GLN 84 Cb 0.18 -1.85 -0.01 0.00 1.02 0.00 0.00 30.24 29.57 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 0.50 0.57 1.60 1.08 0.00 0.36 -4.92 105.19 104.38 1xxi n GLY 85 Ca 0.03 -0.95 -0.15 0.00 0.00 0.00 0.00 46.02 44.95 1xxi n GLY 85 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1xxi n ARG 86 N -2.92 3.01 -3.47 1.61 3.00 -0.04 -5.00 116.66 112.84 1xxi n ARG 86 Ca -0.02 -3.90 -0.38 0.00 -0.00 0.00 0.00 57.85 53.54 1xxi n ARG 86 Cb 0.08 -2.09 -0.09 0.00 0.00 0.00 0.00 32.46 30.37 1xxi n ARG 86 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.63 177.75 1xxi s PHE 87 N -3.49 3.31 0.59 -0.14 5.36 -1.19 -4.84 117.98 117.58 1xxi s PHE 87 Ca 0.47 0.42 0.28 0.00 -0.96 0.00 0.00 56.93 57.14 1xxi s PHE 87 Cb 0.40 -2.46 1.66 0.00 -0.34 0.00 0.00 43.02 42.28 1xxi s PHE 87 CO 0.01 -0.07 2.12 -0.24 -1.46 0.00 0.00 175.22 175.58 1xxi h VAL 88 N 5.16 0.49 -0.59 3.12 3.04 -1.95 -2.33 116.25 123.20 1xxi h VAL 88 Ca -0.35 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.34 1xxi h VAL 88 Cb 1.17 0.86 0.00 0.00 -2.01 0.00 0.00 31.29 31.30 1xxi h VAL 88 CO 0.67 0.00 0.00 0.47 -1.01 0.00 0.00 177.57 177.70 1xxi n ASP 89 N -3.84 4.49 -3.95 3.17 8.00 -1.26 -4.69 116.55 118.47 1xxi n ASP 89 Ca 0.01 -2.44 -0.30 0.00 0.71 0.00 0.00 54.79 52.76 1xxi n ASP 89 Cb 0.30 -0.54 -0.15 0.00 -0.02 0.00 0.00 41.12 40.71 1xxi n ASP 89 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1xxi s LEU 90 N -1.83 4.28 -0.46 0.64 2.96 -0.88 0.35 118.68 123.74 1xxi s LEU 90 Ca 0.48 -2.45 -0.19 0.00 -0.22 0.00 0.00 54.13 51.74 1xxi s LEU 90 Cb 0.31 -1.54 0.03 0.00 0.50 0.00 0.00 46.19 45.50 1xxi s LEU 90 CO 0.23 -0.32 0.59 -0.63 -1.32 0.00 0.00 176.35 174.89 1xxi s ILE 91 N 0.50 4.91 -0.16 6.68 1.01 0.16 -4.73 121.20 129.57 1xxi s ILE 91 Ca 0.13 -0.19 -0.23 0.00 0.00 0.00 0.00 60.65 60.36 1xxi s ILE 91 Cb -0.22 -4.19 -0.02 0.00 0.01 0.00 0.00 42.46 38.04 1xxi s ILE 91 CO -0.06 -0.62 0.72 -1.61 0.00 0.00 0.00 174.94 173.37 1xxi s GLU 92 N 2.59 4.29 -0.08 2.79 2.02 -1.26 -1.32 118.70 127.73 1xxi s GLU 92 Ca 0.18 0.82 0.05 0.00 0.02 0.00 0.00 54.97 56.04 1xxi s GLU 92 Cb -0.16 -3.55 -0.01 0.00 0.10 0.00 0.00 34.13 30.51 1xxi s GLU 92 CO 0.15 -0.21 -0.23 0.42 0.02 0.00 0.00 175.26 175.42 1xxi s ILE 93 N 1.77 2.23 -0.45 -1.63 1.01 0.10 -4.96 121.20 119.27 1xxi s ILE 93 Ca 0.34 -0.99 -0.02 0.00 0.00 0.00 0.00 60.65 59.99 1xxi s ILE 93 Cb -0.16 -1.84 0.12 0.00 0.01 0.00 0.00 42.46 40.59 1xxi s ILE 93 CO 0.13 0.56 0.24 -0.62 0.00 0.00 0.00 174.94 175.25 1xxi s ASP 94 N 0.03 5.15 0.57 3.58 2.15 -1.26 -0.57 116.67 126.31 1xxi s ASP 94 Ca -0.09 -2.27 0.34 0.00 0.43 0.00 0.00 52.55 50.97 1xxi s ASP 94 Cb -0.15 -1.80 1.64 0.00 -0.30 0.00 0.00 42.92 42.30 1xxi s ASP 94 CO 0.05 -0.47 2.10 0.00 -0.17 0.00 0.00 175.17 176.68 1xxi h ALA 95 N 7.71 1.08 -0.00 3.66 0.00 -1.67 -2.61 119.26 127.42 1xxi h ALA 95 Ca -0.09 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1xxi h ALA 95 Cb 1.02 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.80 1xxi h ALA 95 CO 0.68 0.06 -0.13 0.00 0.00 0.00 0.00 179.25 179.87 1xxi n ALA 96 N -2.15 2.76 -2.69 0.00 0.00 -1.26 -4.59 120.51 112.58 1xxi n ALA 96 Ca -0.01 -0.24 -0.42 0.00 0.00 0.00 0.00 53.44 52.77 1xxi n ALA 96 Cb 0.24 -1.35 -0.03 0.00 0.00 0.00 0.00 19.45 18.31 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 -2.62 7.12 0.45 0.00 0.15 -0.99 -4.93 113.70 112.89 1xxi s SER 97 Ca 0.25 1.37 0.25 0.00 0.70 0.00 0.00 55.95 58.52 1xxi s SER 97 Cb 0.20 -2.50 0.83 0.00 -1.71 0.00 0.00 66.02 62.84 1xxi s SER 97 CO 0.51 -0.36 1.78 0.03 1.20 0.00 0.00 173.24 176.40 1xxi h ARG 98 N 7.09 0.00 0.00 5.44 3.08 -1.90 -3.27 114.38 124.82 1xxi h ARG 98 Ca -0.33 0.00 -0.26 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 0.82 0.17 -1.44 1.15 -1.07 0.00 0.00 179.97 179.61 1xxi h THR 99 N 0.00 1.15 -0.85 2.04 2.02 -1.96 -3.37 112.91 111.94 1xxi h THR 99 Ca -0.00 -2.94 -0.42 0.00 0.77 0.00 0.00 66.41 63.82 1xxi h THR 99 Cb 0.81 2.56 -0.25 0.00 -1.74 0.00 0.00 68.15 69.53 1xxi h THR 99 CO 0.02 0.66 0.48 0.29 0.37 0.00 0.00 175.52 177.33 1xxi n LYS 100 N -3.15 2.37 -0.27 6.66 5.02 -1.23 -4.66 118.16 122.89 1xxi n LYS 100 Ca -0.10 -3.05 -0.02 0.00 -2.02 0.00 0.00 58.31 53.11 1xxi n LYS 100 Cb 1.00 -2.12 0.15 0.00 -0.02 0.00 0.00 35.03 34.05 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 1.21 1.23 0.11 -0.18 -1.51 -1.73 -0.07 116.25 115.32 1xxi h VAL 101 Ca 0.52 -0.57 -0.01 0.00 -1.23 0.00 0.00 66.70 65.41 1xxi h VAL 101 Cb 2.59 0.12 0.00 0.00 -2.13 0.00 0.00 31.29 31.87 1xxi h VAL 101 CO 0.93 0.26 -0.05 -0.08 -1.23 0.00 0.00 177.57 177.40 1xxi h GLU 102 N 1.13 -0.15 -0.95 5.19 4.81 -1.93 -2.38 114.58 120.31 1xxi h GLU 102 Ca 0.29 0.01 0.16 0.00 -0.13 0.00 0.00 59.36 59.69 1xxi h GLU 102 Cb 0.01 0.03 -0.08 0.00 0.63 0.00 0.00 28.75 29.34 1xxi h GLU 102 CO -0.05 0.34 0.60 -0.44 -0.73 0.00 0.00 179.01 178.73 1xxi h ASP 103 N -0.78 0.70 0.05 1.04 3.32 -1.89 0.35 116.42 119.22 1xxi h ASP 103 Ca -0.02 0.06 -0.00 0.00 0.02 0.00 0.00 57.03 57.09 1xxi h ASP 103 Cb 0.56 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.03 1xxi h ASP 103 CO 0.03 0.32 -0.02 0.74 -1.72 0.00 0.00 179.24 178.58 1xxi h THR 104 N 0.72 0.99 -0.13 0.35 2.02 -1.01 -1.17 112.91 114.68 1xxi h THR 104 Ca 0.50 -0.13 -0.00 0.00 0.77 0.00 0.00 66.41 67.54 1xxi h THR 104 Cb 0.80 1.08 -0.01 0.00 -1.74 0.00 0.00 68.15 68.28 1xxi h THR 104 CO -0.26 0.03 0.07 -0.09 0.37 0.00 0.00 175.52 175.64 1xxi h ARG 105 N -0.12 0.19 0.12 6.66 2.43 -0.53 -2.95 114.38 120.17 1xxi h ARG 105 Ca -0.01 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.13 1xxi h ARG 105 Cb 0.11 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.62 1xxi h ARG 105 CO 0.01 0.22 -0.06 -0.44 -1.51 0.00 0.00 179.97 178.19 1xxi h ASP 106 N 0.10 -0.13 -1.01 -3.80 3.32 -0.32 -2.38 116.42 112.21 1xxi h ASP 106 Ca 0.05 -0.15 0.11 0.00 0.02 0.00 0.00 57.03 57.06 1xxi h ASP 106 Cb 0.09 0.03 -0.08 0.00 0.22 0.00 0.00 39.33 39.59 1xxi h ASP 106 CO -0.01 0.07 0.64 -0.07 -1.72 0.00 0.00 179.24 178.15 1xxi h LEU 107 N -0.33 0.96 -0.80 1.55 3.38 -1.28 -0.53 115.31 118.26 1xxi h LEU 107 Ca -0.02 0.04 -0.06 0.00 0.09 0.00 0.00 57.88 57.93 1xxi h LEU 107 Cb 0.27 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 1xxi h LEU 107 CO 0.03 0.53 -0.28 -0.07 0.09 0.00 0.00 178.44 178.74 1xxi h LEU 108 N 1.04 0.00 0.00 1.67 3.38 -1.45 -2.62 115.31 117.33 1xxi h LEU 108 Ca 0.48 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.45 1xxi h LEU 108 Cb 0.42 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.17 1xxi h LEU 108 CO -0.25 0.28 -0.33 0.47 0.09 0.00 0.00 178.44 178.70 1xxi n ASP 109 N -3.35 0.39 -3.15 -0.43 8.00 -0.34 -4.33 116.55 113.33 1xxi n ASP 109 Ca 0.01 0.08 -0.22 0.00 0.71 0.00 0.00 54.79 55.36 1xxi n ASP 109 Cb 0.51 -0.05 -0.04 0.00 -0.02 0.00 0.00 41.12 41.51 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 -1.62 1.92 -4.72 -2.24 3.02 -0.40 -5.08 115.26 106.14 1xxi n ASN 110 Ca 0.06 -3.16 -0.42 0.00 -0.03 0.00 0.00 54.58 51.02 1xxi n ASN 110 Cb 0.36 -0.61 -0.03 0.00 -0.61 0.00 0.00 39.78 38.88 1xxi n ASN 110 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1xxi s VAL 111 N -2.71 2.21 -0.75 2.41 1.01 -1.20 -4.86 120.40 116.51 1xxi s VAL 111 Ca 0.41 0.12 -0.22 0.00 0.00 0.00 0.00 61.98 62.29 1xxi s VAL 111 Cb 0.28 -3.08 0.08 0.00 0.00 0.00 0.00 36.38 33.66 1xxi s VAL 111 CO -0.09 0.01 1.06 -1.10 0.00 0.00 0.00 175.10 174.98 1xxi s GLN 112 N 1.31 3.25 0.45 2.72 -0.21 -1.26 -4.91 119.66 121.01 1xxi s GLN 112 Ca 0.74 -0.98 0.31 0.00 0.02 0.00 0.00 55.36 55.45 1xxi s GLN 112 Cb -0.48 -4.44 1.58 0.00 1.00 0.00 0.00 33.01 30.67 1xxi s GLN 112 CO 0.32 -1.87 1.94 1.88 -2.12 0.00 0.00 175.29 175.44 1xxi h TYR 113 N 9.49 0.00 -3.11 0.91 -1.99 -1.93 -3.41 116.97 116.92 1xxi h TYR 113 Ca -0.16 0.00 -0.64 0.00 2.00 0.00 0.00 58.73 59.93 1xxi h TYR 113 Cb 1.05 0.00 -0.35 0.00 2.00 0.00 0.00 36.73 39.43 1xxi h TYR 113 CO 1.05 0.00 -0.85 0.00 -0.00 0.00 0.00 178.16 178.36 1xxi s ALA 114 N -3.73 2.08 0.61 3.88 0.00 -1.26 -4.64 121.76 118.70 1xxi s ALA 114 Ca -0.02 -1.04 -0.19 0.00 0.00 0.00 0.00 51.96 50.71 1xxi s ALA 114 Cb 0.09 -1.09 -0.02 0.00 0.00 0.00 0.00 23.12 22.10 1xxi s ALA 114 CO 0.33 -0.32 1.30 -2.14 0.00 0.00 0.00 175.76 174.93 1xxi s PRO 115 N 1.32 2.76 -0.07 0.00 0.02 -1.26 -4.94 135.00 132.83 1xxi s PRO 115 Ca 0.03 2.08 0.15 0.00 0.02 0.00 0.00 61.00 63.28 1xxi s PRO 115 Cb -0.13 -1.97 -0.23 0.00 0.02 0.00 0.00 34.50 32.19 1xxi s PRO 115 CO -0.10 -1.44 0.52 0.00 -0.33 0.00 0.00 177.00 175.65 1xxi n ALA 116 N -1.62 1.56 0.08 -1.55 0.00 -1.26 -4.84 120.51 112.87 1xxi n ALA 116 Ca 0.14 -0.89 0.00 0.00 0.00 0.00 0.00 53.44 52.69 1xxi n ALA 116 Cb 0.47 -0.69 0.00 0.00 0.00 0.00 0.00 19.45 19.24 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 -2.94 0.00 -1.79 0.00 3.00 -1.26 -5.11 116.66 108.56 1xxi n ARG 117 Ca -0.20 0.00 -0.29 0.00 -0.00 0.00 0.00 57.85 57.35 1xxi n ARG 117 Cb 1.05 -0.35 0.15 0.00 0.00 0.00 0.00 32.46 33.32 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 -4.33 1.67 0.36 5.14 0.00 -1.26 -4.96 107.32 103.93 1xxi s GLY 118 Ca 0.00 -0.91 0.27 0.00 0.00 0.00 0.00 44.72 44.08 1xxi s GLY 118 CO 0.00 -0.25 1.79 0.07 0.00 0.00 0.00 173.10 174.71 1xxi h ARG 119 N -1.52 0.00 -5.20 2.90 0.11 -1.86 -3.43 114.38 105.38 1xxi h ARG 119 Ca -0.46 0.00 -0.39 0.00 0.10 0.00 0.00 59.98 59.24 1xxi h ARG 119 Cb 1.28 0.00 -0.21 0.00 1.11 0.00 0.00 29.97 32.15 1xxi h ARG 119 CO 0.50 0.00 -0.77 -0.06 0.10 0.00 0.00 179.97 179.74 1xxi s PHE 120 N -3.35 1.11 -0.35 4.08 0.08 -1.26 -4.76 117.98 113.53 1xxi s PHE 120 Ca 0.05 -0.47 -0.13 0.00 0.12 0.00 0.00 56.93 56.51 1xxi s PHE 120 Cb 0.09 -0.63 -0.01 0.00 -0.57 0.00 0.00 43.02 41.90 1xxi s PHE 120 CO 0.52 0.03 0.23 0.21 -0.10 0.00 0.00 175.22 176.11 1xxi s LYS 121 N -1.72 3.37 -0.16 0.44 2.36 0.86 -4.81 119.74 120.08 1xxi s LYS 121 Ca -0.03 -0.73 -0.05 0.00 -2.55 0.00 0.00 55.97 52.61 1xxi s LYS 121 Cb -0.10 -3.79 -0.03 0.00 -1.05 0.00 0.00 37.83 32.86 1xxi s LYS 121 CO 0.02 -0.49 -0.00 0.08 1.55 0.00 0.00 175.35 176.50 1xxi s VAL 122 N 1.69 4.22 -0.16 4.02 1.01 0.15 -1.08 120.40 130.26 1xxi s VAL 122 Ca 0.05 -0.24 -0.02 0.00 0.00 0.00 0.00 61.98 61.77 1xxi s VAL 122 Cb -0.18 -2.86 -0.02 0.00 0.00 0.00 0.00 36.38 33.33 1xxi s VAL 122 CO 0.10 0.50 -0.08 -0.31 0.00 0.00 0.00 175.10 175.30 1xxi s TYR 123 N 0.22 2.91 -0.25 5.22 1.51 -0.11 0.36 117.35 127.21 1xxi s TYR 123 Ca -0.00 -0.62 -0.00 0.00 -1.01 0.00 0.00 57.07 55.44 1xxi s TYR 123 Cb -0.13 -1.94 0.04 0.00 -0.11 0.00 0.00 41.96 39.81 1xxi s TYR 123 CO 0.02 -0.24 -0.08 -1.17 -1.11 0.00 0.00 175.55 172.96 1xxi s LEU 124 N 0.64 3.20 -0.28 -1.29 1.98 -0.44 -0.44 118.68 122.06 1xxi s LEU 124 Ca -0.05 -1.03 -0.05 0.00 -2.89 0.00 0.00 54.13 50.12 1xxi s LEU 124 Cb -0.15 -1.62 0.02 0.00 0.66 0.00 0.00 46.19 45.10 1xxi s LEU 124 CO 0.03 -0.14 0.04 -0.63 -1.89 0.00 0.00 176.35 173.75 1xxi s ILE 125 N 1.25 3.59 0.26 6.68 1.01 -0.42 0.02 121.20 133.59 1xxi s ILE 125 Ca -0.02 -0.84 -0.27 0.00 0.00 0.00 0.00 60.65 59.51 1xxi s ILE 125 Cb -0.17 -2.86 -0.09 0.00 0.01 0.00 0.00 42.46 39.35 1xxi s ILE 125 CO -0.05 0.10 0.91 -1.81 0.00 0.00 0.00 174.94 174.08 1xxi s ASP 126 N 1.43 7.47 -1.29 3.58 -0.00 0.26 -1.37 116.67 126.75 1xxi s ASP 126 Ca 0.01 1.84 -0.23 0.00 -0.00 0.00 0.00 52.55 54.17 1xxi s ASP 126 Cb -0.17 -2.57 0.03 0.00 -0.00 0.00 0.00 42.92 40.20 1xxi s ASP 126 CO 0.00 0.07 0.53 -0.62 -0.00 0.00 0.00 175.17 175.15 1xxi n GLU 127 N 1.09 -0.76 0.30 8.23 -0.58 -0.82 -2.26 120.64 125.84 1xxi n GLU 127 Ca -0.01 0.15 0.19 0.00 -0.42 0.00 0.00 57.16 57.08 1xxi n GLU 127 Cb 0.49 -3.12 1.02 0.00 -0.57 0.00 0.00 31.44 29.25 1xxi n GLU 127 CO 0.00 0.00 0.00 -0.24 -0.48 0.00 0.00 177.13 176.41 1xxi h VAL 128 N -2.30 0.18 0.00 2.62 3.04 -1.37 -1.48 116.25 116.93 1xxi h VAL 128 Ca -0.69 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.00 1xxi h VAL 128 Cb 1.40 0.90 0.00 0.00 -2.01 0.00 0.00 31.29 31.58 1xxi h VAL 128 CO 0.56 0.00 0.00 0.00 -1.01 0.00 0.00 177.57 177.12 1xxi n HIS 129 N -3.31 0.08 0.72 3.17 1.44 -1.26 -2.68 115.22 113.38 1xxi n HIS 129 Ca -0.02 0.03 0.09 0.00 -2.01 0.00 0.00 57.72 55.81 1xxi n HIS 129 Cb 0.19 -0.55 0.25 0.00 0.12 0.00 0.00 29.99 29.99 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 -1.57 2.00 -1.90 -1.40 2.81 -0.56 -4.87 117.12 111.64 1xxi n MET 130 Ca 0.04 -1.55 -0.34 0.00 -1.81 0.00 0.00 57.70 54.05 1xxi n MET 130 Cb 0.21 -1.38 0.03 0.00 -0.71 0.00 0.00 33.22 31.38 1xxi n MET 130 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1xxi s LEU 131 N -1.19 3.49 0.85 4.03 1.43 -1.09 -4.81 118.68 121.38 1xxi s LEU 131 Ca 0.31 2.03 -0.11 0.00 -1.03 0.00 0.00 54.13 55.33 1xxi s LEU 131 Cb 0.17 -4.56 0.10 0.00 0.03 0.00 0.00 46.19 41.93 1xxi s LEU 131 CO 0.23 -1.50 1.09 -0.94 0.23 0.00 0.00 176.35 175.46 1xxi s SER 132 N -2.39 3.86 0.34 2.29 1.04 -1.26 -4.80 113.70 112.78 1xxi s SER 132 Ca 0.68 1.54 0.04 0.00 0.48 0.00 0.00 55.95 58.70 1xxi s SER 132 Cb -0.21 -2.24 0.63 0.00 0.10 0.00 0.00 66.02 64.30 1xxi s SER 132 CO 0.38 -2.40 1.90 -0.09 0.98 0.00 0.00 173.24 174.01 1xxi h ARG 133 N -1.38 0.55 0.23 4.02 2.43 -1.99 -1.02 114.38 117.22 1xxi h ARG 133 Ca -0.48 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 58.60 1xxi h ARG 133 Cb 1.27 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 30.71 1xxi h ARG 133 CO 0.54 0.54 -0.25 1.25 -1.51 0.00 0.00 179.97 180.54 1xxi h HIS 134 N 0.54 -0.67 -0.36 2.20 2.76 -2.00 -2.49 115.15 115.13 1xxi h HIS 134 Ca 0.12 0.01 -0.07 0.00 -2.20 0.00 0.00 60.37 58.23 1xxi h HIS 134 Cb 0.26 0.26 -0.02 0.00 1.55 0.00 0.00 27.41 29.47 1xxi h HIS 134 CO 0.01 -0.37 -0.07 0.77 -1.30 0.00 0.00 177.93 176.97 1xxi h SER 135 N -0.53 0.57 -0.22 3.26 0.02 -1.83 -1.93 113.55 112.89 1xxi h SER 135 Ca -0.00 -0.14 0.05 0.00 -0.84 0.00 0.00 61.79 60.86 1xxi h SER 135 Cb 0.50 -0.15 -0.05 0.00 0.14 0.00 0.00 62.40 62.83 1xxi h SER 135 CO -0.07 0.69 -0.13 -0.26 -1.14 0.00 0.00 176.83 175.93 1xxi h PHE 136 N 0.55 -0.31 -0.25 3.45 0.04 -0.93 0.30 116.94 119.79 1xxi h PHE 136 Ca 0.11 0.03 -0.06 0.00 2.80 0.00 0.00 57.97 60.85 1xxi h PHE 136 Cb 0.46 0.17 -0.01 0.00 2.20 0.00 0.00 35.95 38.77 1xxi h PHE 136 CO 0.02 -0.19 -0.09 -0.91 -0.60 0.00 0.00 178.31 176.53 1xxi h ASN 137 N -0.11 0.38 -0.15 2.17 2.35 -1.16 0.31 115.58 119.37 1xxi h ASN 137 Ca 0.12 -0.08 -0.01 0.00 -0.55 0.00 0.00 56.30 55.79 1xxi h ASN 137 Cb 0.30 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.56 1xxi h ASN 137 CO -0.29 0.51 0.07 0.00 -1.65 0.00 0.00 177.43 176.07 1xxi h ALA 138 N 1.53 0.19 0.05 -0.83 0.00 -0.43 -1.10 119.26 118.67 1xxi h ALA 138 Ca 0.08 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1xxi h ALA 138 Cb 0.40 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1xxi h ALA 138 CO 0.02 -0.23 -0.02 1.25 0.00 0.00 0.00 179.25 180.26 1xxi h LEU 139 N 0.10 -0.06 -0.18 0.00 5.85 0.27 -2.56 115.31 118.73 1xxi h LEU 139 Ca 0.05 -0.08 0.05 0.00 0.84 0.00 0.00 57.88 58.74 1xxi h LEU 139 Cb 0.14 0.01 -0.07 0.00 0.37 0.00 0.00 40.66 41.12 1xxi h LEU 139 CO -0.01 0.05 -0.43 0.25 -0.34 0.00 0.00 178.44 177.96 1xxi h LEU 140 N -0.16 -1.36 -0.91 2.25 6.46 -0.35 0.67 115.31 121.92 1xxi h LEU 140 Ca -0.01 0.18 0.24 0.00 -0.12 0.00 0.00 57.88 58.18 1xxi h LEU 140 Cb 0.13 0.56 -0.13 0.00 -0.73 0.00 0.00 40.66 40.49 1xxi h LEU 140 CO 0.01 -0.42 0.37 0.50 -0.62 0.00 0.00 178.44 178.28 1xxi h LYS 141 N -0.47 0.32 -0.15 1.25 3.64 -1.08 0.40 116.57 120.48 1xxi h LYS 141 Ca 0.08 -0.02 -0.18 0.00 -1.27 0.00 0.00 60.65 59.26 1xxi h LYS 141 Cb 0.62 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 32.37 1xxi h LYS 141 CO -0.43 0.21 -0.65 1.15 -2.27 0.00 0.00 179.45 177.46 1xxi h THR 142 N 0.33 1.33 0.00 1.00 2.02 -0.82 -2.50 112.91 114.27 1xxi h THR 142 Ca 0.58 -1.95 -0.02 0.00 0.77 0.00 0.00 66.41 65.79 1xxi h THR 142 Cb 1.16 1.92 -0.00 0.00 -1.74 0.00 0.00 68.15 69.49 1xxi h THR 142 CO -0.58 0.60 -0.10 -0.07 0.37 0.00 0.00 175.52 175.74 1xxi h LEU 143 N 0.40 0.00 0.06 2.58 3.38 0.16 -2.41 115.31 119.47 1xxi h LEU 143 Ca -0.02 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.70 1xxi h LEU 143 Cb 1.22 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.95 1xxi h LEU 143 CO 0.12 0.10 -1.24 -0.33 0.09 0.00 0.00 178.44 177.18 1xxi h GLU 144 N 0.00 0.13 -2.19 1.13 5.08 -0.22 -3.36 114.58 115.14 1xxi h GLU 144 Ca -0.00 -0.22 -0.58 0.00 -1.00 0.00 0.00 59.36 57.56 1xxi h GLU 144 Cb 0.75 0.08 -0.42 0.00 0.50 0.00 0.00 28.75 29.66 1xxi h GLU 144 CO 0.01 1.04 -0.70 -1.91 -1.00 0.00 0.00 179.01 176.45 1xxi n GLU 145 N -3.39 2.49 -1.50 2.33 2.13 -0.95 -5.07 120.64 116.67 1xxi n GLU 145 Ca -0.07 -4.51 -0.32 0.00 0.66 0.00 0.00 57.16 52.92 1xxi n GLU 145 Cb 0.99 -2.11 -0.18 0.00 0.27 0.00 0.00 31.44 30.41 1xxi n GLU 145 CO 0.00 0.00 0.00 -2.30 -0.41 0.00 0.00 177.13 174.42 1xxi n PRO 146 N 0.48 0.02 -1.74 5.31 -0.02 -0.92 -4.82 135.00 133.30 1xxi n PRO 146 Ca 0.29 -0.01 -0.42 0.00 -2.02 0.00 0.00 63.50 61.35 1xxi n PRO 146 Cb 0.43 -1.32 -0.02 0.00 -0.02 0.00 0.00 33.50 32.57 1xxi n PRO 146 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1xxi n PRO 147 N 7.19 2.76 -2.21 0.52 -0.02 -1.26 -4.95 135.00 137.02 1xxi n PRO 147 Ca 0.66 0.99 -0.30 0.00 -2.02 0.00 0.00 63.50 62.83 1xxi n PRO 147 Cb 0.09 -2.80 -0.00 0.00 -0.02 0.00 0.00 33.50 30.77 1xxi n PRO 147 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1xxi s GLU 148 N 0.11 3.67 0.00 -0.52 2.56 -1.26 -3.23 118.70 120.03 1xxi s GLU 148 Ca 0.68 0.66 0.00 0.00 0.00 0.00 0.00 54.97 56.30 1xxi s GLU 148 Cb -0.49 -2.18 0.00 0.00 2.00 0.00 0.00 34.13 33.46 1xxi s GLU 148 CO 0.42 -0.39 0.00 0.72 -0.56 0.00 0.00 175.26 175.45 1xxi n HIS 149 N -2.30 0.00 -4.60 5.30 8.25 -1.26 -4.84 115.22 115.77 1xxi n HIS 149 Ca 0.05 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.19 1xxi n HIS 149 Cb 0.54 0.00 -0.17 0.00 1.12 0.00 0.00 29.99 31.49 1xxi n HIS 149 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1xxi s VAL 150 N -3.41 1.94 0.02 1.59 1.01 -1.20 0.29 120.40 120.65 1xxi s VAL 150 Ca 0.00 -0.91 0.08 0.00 0.00 0.00 0.00 61.98 61.16 1xxi s VAL 150 Cb 0.00 -1.73 -0.02 0.00 0.00 0.00 0.00 36.38 34.63 1xxi s VAL 150 CO 0.00 0.53 -0.25 -0.54 0.00 0.00 0.00 175.10 174.83 1xxi s LYS 151 N 0.88 1.85 -0.19 2.72 -0.14 -0.24 -4.74 119.74 119.87 1xxi s LYS 151 Ca -0.06 -1.00 -0.02 0.00 -1.36 0.00 0.00 55.97 53.52 1xxi s LYS 151 Cb -0.15 -1.92 -0.00 0.00 -1.68 0.00 0.00 37.83 34.07 1xxi s LYS 151 CO -0.02 0.51 -0.09 -0.06 -0.76 0.00 0.00 175.35 174.92 1xxi s PHE 152 N -0.71 2.89 -0.33 3.18 0.08 -0.48 -0.94 117.98 121.67 1xxi s PHE 152 Ca 0.10 -1.04 -0.01 0.00 0.12 0.00 0.00 56.93 56.11 1xxi s PHE 152 Cb -0.10 -2.02 0.07 0.00 -0.57 0.00 0.00 43.02 40.41 1xxi s PHE 152 CO 0.01 -0.54 0.04 -0.51 -0.10 0.00 0.00 175.22 174.12 1xxi s LEU 153 N 1.23 4.32 0.04 -0.37 1.43 0.42 0.28 118.68 126.03 1xxi s LEU 153 Ca 0.03 -1.62 -0.00 0.00 -1.03 0.00 0.00 54.13 51.50 1xxi s LEU 153 Cb -0.14 -1.71 -0.04 0.00 0.03 0.00 0.00 46.19 44.33 1xxi s LEU 153 CO -0.04 -0.34 0.17 -0.76 0.23 0.00 0.00 176.35 175.61 1xxi s LEU 154 N 1.15 4.23 0.04 1.79 1.43 0.17 -1.30 118.68 126.18 1xxi s LEU 154 Ca 0.00 0.23 0.03 0.00 -1.03 0.00 0.00 54.13 53.37 1xxi s LEU 154 Cb -0.20 -2.72 -0.02 0.00 0.03 0.00 0.00 46.19 43.27 1xxi s LEU 154 CO -0.03 0.21 -0.10 0.00 0.23 0.00 0.00 176.35 176.65 1xxi s ALA 155 N -1.41 0.80 -0.23 4.21 0.00 -0.47 0.08 121.76 124.75 1xxi s ALA 155 Ca 0.31 -0.77 -0.28 0.00 0.00 0.00 0.00 51.96 51.21 1xxi s ALA 155 Cb -0.13 -0.04 0.15 0.00 0.00 0.00 0.00 23.12 23.10 1xxi s ALA 155 CO 0.23 0.08 1.14 -0.08 0.00 0.00 0.00 175.76 177.13 1xxi s THR 156 N -1.13 0.00 -1.47 0.00 -1.32 -0.19 -1.39 115.64 110.14 1xxi s THR 156 Ca -0.05 0.00 0.25 0.00 -1.21 0.00 0.00 61.69 60.68 1xxi s THR 156 Cb -0.09 -1.00 0.07 0.00 -1.51 0.00 0.00 72.50 69.97 1xxi s THR 156 CO 0.01 0.00 1.34 0.35 -2.21 0.00 0.00 174.62 174.11 1xxi n THR 157 N 1.11 0.00 -3.19 5.08 -2.24 -1.26 -2.48 114.28 111.31 1xxi n THR 157 Ca -0.09 -0.09 -0.23 0.00 -2.27 0.00 0.00 64.05 61.37 1xxi n THR 157 Cb 0.58 0.59 -0.07 0.00 -2.10 0.00 0.00 70.33 69.33 1xxi n THR 157 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1xxi n ASP 158 N -0.91 -0.09 -0.09 3.42 4.64 -1.26 -4.65 116.55 117.61 1xxi n ASP 158 Ca 0.09 -2.68 0.19 0.00 -1.38 0.00 0.00 54.79 51.00 1xxi n ASP 158 Cb 0.36 -0.49 0.61 0.00 -1.04 0.00 0.00 41.12 40.56 1xxi n ASP 158 CO 0.00 0.00 0.00 1.55 -0.82 0.00 0.00 177.20 177.93 1xxi h PRO 159 N 4.21 0.18 -0.02 -0.67 0.13 -1.97 -1.46 132.00 132.40 1xxi h PRO 159 Ca 0.08 -0.01 -0.03 0.00 -0.87 0.00 0.00 66.00 65.18 1xxi h PRO 159 Cb 0.89 -0.04 -0.00 0.00 0.13 0.00 0.00 31.00 31.98 1xxi h PRO 159 CO 0.44 0.12 -0.12 1.96 -0.23 0.00 0.00 178.00 180.16 1xxi h GLN 160 N 0.18 0.03 0.00 0.86 4.20 -1.99 -0.67 115.11 117.72 1xxi h GLN 160 Ca 0.32 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.03 1xxi h GLN 160 Cb 1.01 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.79 1xxi h GLN 160 CO -0.06 0.15 0.00 1.63 -0.67 0.00 0.00 178.83 179.89 1xxi n LYS 161 N -4.38 0.18 -3.40 1.46 4.76 -0.55 -4.73 118.16 111.51 1xxi n LYS 161 Ca -0.02 0.16 -0.38 0.00 -2.87 0.00 0.00 58.31 55.20 1xxi n LYS 161 Cb 0.20 -1.50 -0.06 0.00 -1.84 0.00 0.00 35.03 31.83 1xxi n LYS 161 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1xxi s LEU 162 N -2.60 4.46 0.06 -0.35 1.43 -0.26 -4.94 118.68 116.47 1xxi s LEU 162 Ca 0.13 1.03 -0.35 0.00 -1.03 0.00 0.00 54.13 53.91 1xxi s LEU 162 Cb 0.09 -2.70 -0.14 0.00 0.03 0.00 0.00 46.19 43.48 1xxi s LEU 162 CO 0.22 0.25 1.62 -2.65 0.23 0.00 0.00 176.35 176.02 1xxi n PRO 163 N 2.12 1.90 0.29 1.29 -0.02 -1.26 -4.80 135.00 134.53 1xxi n PRO 163 Ca -0.12 0.69 0.20 0.00 -2.02 0.00 0.00 63.50 62.25 1xxi n PRO 163 Cb 0.52 -2.45 1.05 0.00 -0.02 0.00 0.00 33.50 32.60 1xxi n PRO 163 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 1xxi h VAL 164 N 4.12 0.00 -0.01 -1.45 -1.51 -1.94 -0.83 116.25 114.63 1xxi h VAL 164 Ca -0.46 0.00 -0.11 0.00 -1.23 0.00 0.00 66.70 64.89 1xxi h VAL 164 Cb 1.28 0.86 -0.02 0.00 -2.13 0.00 0.00 31.29 31.28 1xxi h VAL 164 CO 0.89 0.00 -0.54 0.71 -1.23 0.00 0.00 177.57 177.40 1xxi h THR 165 N 0.00 1.38 0.01 7.19 1.35 -1.99 -2.07 112.91 118.78 1xxi h THR 165 Ca 0.00 -1.84 -0.16 0.00 -0.55 0.00 0.00 66.41 63.86 1xxi h THR 165 Cb 0.01 1.98 -0.02 0.00 -1.73 0.00 0.00 68.15 68.39 1xxi h THR 165 CO 0.00 0.53 -0.87 0.40 -0.25 0.00 0.00 175.52 175.33 1xxi h ILE 166 N 0.02 1.21 -0.99 6.82 2.04 -1.53 -3.32 117.51 121.75 1xxi h ILE 166 Ca -0.00 -2.25 0.18 0.00 1.00 0.00 0.00 64.86 63.79 1xxi h ILE 166 Cb 0.96 2.63 -0.11 0.00 -0.74 0.00 0.00 36.82 39.57 1xxi h ILE 166 CO 0.07 0.44 0.60 0.25 0.00 0.00 0.00 178.15 179.50 1xxi h LEU 167 N -0.95 0.77 -2.44 1.44 6.46 -1.46 0.22 115.31 119.36 1xxi h LEU 167 Ca -0.23 0.10 -0.00 0.00 -0.12 0.00 0.00 57.88 57.62 1xxi h LEU 167 Cb 1.24 -0.04 -0.00 0.00 -0.73 0.00 0.00 40.66 41.13 1xxi h LEU 167 CO -0.12 0.28 -0.00 -1.28 -0.62 0.00 0.00 178.44 176.69 1xxi h SER 168 N 0.76 0.00 -0.36 1.25 0.87 -1.51 -2.37 113.55 112.19 1xxi h SER 168 Ca 0.57 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 61.13 1xxi h SER 168 Cb 0.87 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.83 1xxi h SER 168 CO -0.38 0.00 0.00 0.54 -0.53 0.00 0.00 176.83 176.46 1xxi n ARG 169 N -3.09 2.19 -4.26 2.24 3.00 0.78 -4.95 116.66 112.58 1xxi n ARG 169 Ca -0.02 -1.81 -0.24 0.00 -0.01 0.00 0.00 57.85 55.78 1xxi n ARG 169 Cb 0.16 -1.45 -0.08 0.00 0.00 0.00 0.00 32.46 31.09 1xxi n ARG 169 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1xxi s LEU 171 N -3.74 4.50 -0.12 0.00 2.96 -0.59 -4.89 118.68 116.79 1xxi s LEU 171 Ca 0.35 -0.27 -0.15 0.00 -0.22 0.00 0.00 54.13 53.84 1xxi s LEU 171 Cb -0.02 -2.41 -0.05 0.00 0.50 0.00 0.00 46.19 44.21 1xxi s LEU 171 CO 0.20 -0.42 0.37 -1.10 -1.32 0.00 0.00 176.35 174.09 1xxi s GLN 172 N 2.13 4.22 -0.10 1.98 -0.21 -1.26 -0.04 119.66 126.37 1xxi s GLN 172 Ca 0.13 0.26 0.02 0.00 0.02 0.00 0.00 55.36 55.79 1xxi s GLN 172 Cb -0.16 -3.40 0.01 0.00 1.00 0.00 0.00 33.01 30.47 1xxi s GLN 172 CO 0.12 0.29 -0.15 -0.06 -2.12 0.00 0.00 175.29 173.37 1xxi s PHE 173 N 0.27 1.92 -0.42 0.91 0.08 0.86 -4.96 117.98 116.65 1xxi s PHE 173 Ca 0.21 -0.89 -0.16 0.00 0.12 0.00 0.00 56.93 56.21 1xxi s PHE 173 Cb -0.14 -1.39 0.02 0.00 -0.57 0.00 0.00 43.02 40.94 1xxi s PHE 173 CO 0.07 -0.46 0.35 -1.01 -0.10 0.00 0.00 175.22 174.07 1xxi s HIS 174 N 0.98 3.22 0.20 0.36 3.76 -1.26 -1.14 115.29 121.40 1xxi s HIS 174 Ca -0.07 -0.54 -0.24 0.00 -0.15 0.00 0.00 55.06 54.06 1xxi s HIS 174 Cb -0.15 -2.71 -0.08 0.00 1.11 0.00 0.00 32.58 30.75 1xxi s HIS 174 CO -0.01 -0.63 0.79 -0.51 -0.85 0.00 0.00 174.74 173.52 1xxi s LEU 175 N 1.82 4.52 0.00 0.89 1.02 0.82 -4.96 118.68 122.80 1xxi s LEU 175 Ca 0.07 1.63 0.00 0.00 0.02 0.00 0.00 54.13 55.86 1xxi s LEU 175 Cb -0.19 -3.44 0.00 0.00 0.02 0.00 0.00 46.19 42.59 1xxi s LEU 175 CO 0.11 0.15 0.00 0.29 0.02 0.00 0.00 176.35 176.92 1xxi n LYS 176 N 1.31 3.60 -4.38 1.70 5.02 -1.26 -4.43 118.16 119.72 1xxi n LYS 176 Ca -0.04 0.00 -0.20 0.00 -2.02 0.00 0.00 58.31 56.05 1xxi n LYS 176 Cb 0.49 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 35.40 1xxi n LYS 176 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1xxi s ALA 177 N -3.14 2.24 -0.11 7.82 0.00 -1.26 -4.72 121.76 122.59 1xxi s ALA 177 Ca 0.00 -1.72 -0.12 0.00 0.00 0.00 0.00 51.96 50.12 1xxi s ALA 177 Cb 0.00 -0.15 -0.05 0.00 0.00 0.00 0.00 23.12 22.93 1xxi s ALA 177 CO 0.00 0.14 0.28 -0.51 0.00 0.00 0.00 175.76 175.67 1xxi s LEU 178 N -3.33 4.34 0.96 0.00 1.43 -1.23 -5.04 118.68 115.82 1xxi s LEU 178 Ca 0.24 0.61 -0.11 0.00 -1.03 0.00 0.00 54.13 53.84 1xxi s LEU 178 Cb -0.02 -2.34 0.17 0.00 0.03 0.00 0.00 46.19 44.03 1xxi s LEU 178 CO 0.09 0.25 1.11 -0.62 0.23 0.00 0.00 176.35 177.41 1xxi s ASP 179 N -0.36 2.58 0.05 2.29 2.15 -1.26 -4.36 116.67 117.76 1xxi s ASP 179 Ca 0.18 1.99 -0.20 0.00 0.43 0.00 0.00 52.55 54.95 1xxi s ASP 179 Cb -0.14 -2.49 -0.10 0.00 -0.30 0.00 0.00 42.92 39.89 1xxi s ASP 179 CO 0.06 -3.28 1.31 0.58 -0.17 0.00 0.00 175.17 173.67 1xxi h VAL 180 N -1.99 0.00 -0.98 1.11 2.07 -1.96 -2.76 116.25 111.74 1xxi h VAL 180 Ca -0.48 0.00 0.22 0.00 0.82 0.00 0.00 66.70 67.27 1xxi h VAL 180 Cb 1.28 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.97 1xxi h VAL 180 CO 0.45 0.00 0.63 -0.08 0.02 0.00 0.00 177.57 178.59 1xxi h GLU 181 N -0.58 0.47 -0.99 1.57 4.81 -1.98 0.34 114.58 118.22 1xxi h GLU 181 Ca -0.04 -0.03 0.15 0.00 -0.13 0.00 0.00 59.36 59.31 1xxi h GLU 181 Cb 0.50 -0.11 -0.09 0.00 0.63 0.00 0.00 28.75 29.68 1xxi h GLU 181 CO -0.02 0.31 0.61 0.37 -0.73 0.00 0.00 179.01 179.55 1xxi h GLN 182 N 0.48 0.86 0.07 1.92 4.15 -1.84 0.23 115.11 120.98 1xxi h GLN 182 Ca 0.54 -0.05 -0.14 0.00 0.77 0.00 0.00 58.65 59.77 1xxi h GLN 182 Cb 1.24 -0.19 0.01 0.00 0.21 0.00 0.00 27.48 28.75 1xxi h GLN 182 CO -0.27 0.57 -0.58 0.82 -1.93 0.00 0.00 178.83 177.44 1xxi h ILE 183 N 0.89 1.53 -0.45 2.39 2.04 -0.25 -3.12 117.51 120.54 1xxi h ILE 183 Ca 0.52 -2.31 0.09 0.00 1.00 0.00 0.00 64.86 64.16 1xxi h ILE 183 Cb 0.64 3.00 -0.10 0.00 -0.74 0.00 0.00 36.82 39.62 1xxi h ILE 183 CO -0.31 0.65 -0.28 -0.09 0.00 0.00 0.00 178.15 178.12 1xxi h ARG 184 N -0.40 -0.18 -0.55 2.37 1.12 -0.62 -0.33 114.38 115.79 1xxi h ARG 184 Ca -0.09 0.01 0.05 0.00 -1.11 0.00 0.00 59.98 58.84 1xxi h ARG 184 Cb 1.38 0.04 -0.03 0.00 -0.01 0.00 0.00 29.97 31.35 1xxi h ARG 184 CO 0.11 -0.12 0.37 1.25 -3.11 0.00 0.00 179.97 178.47 1xxi h HIS 185 N -0.19 0.55 0.01 2.20 2.76 -0.64 -1.60 115.15 118.25 1xxi h HIS 185 Ca 0.20 0.01 -0.17 0.00 -2.20 0.00 0.00 60.37 58.22 1xxi h HIS 185 Cb 0.51 -0.18 0.01 0.00 1.55 0.00 0.00 27.41 29.30 1xxi h HIS 185 CO -0.52 0.30 -0.66 0.37 -1.30 0.00 0.00 177.93 176.12 1xxi h GLN 186 N 0.55 0.42 -0.18 5.26 5.75 -1.23 -2.81 115.11 122.88 1xxi h GLN 186 Ca 0.23 -0.47 0.05 0.00 -0.15 0.00 0.00 58.65 58.31 1xxi h GLN 186 Cb 0.23 0.14 -0.06 0.00 1.07 0.00 0.00 27.48 28.86 1xxi h GLN 186 CO -0.07 1.14 -0.19 -0.07 -2.65 0.00 0.00 178.83 176.99 1xxi h LEU 187 N -0.09 -0.61 -0.11 -2.39 3.38 -0.54 -1.70 115.31 113.25 1xxi h LEU 187 Ca -0.09 0.11 0.02 0.00 0.09 0.00 0.00 57.88 58.02 1xxi h LEU 187 Cb 1.38 0.29 -0.05 0.00 0.09 0.00 0.00 40.66 42.37 1xxi h LEU 187 CO 0.13 -0.24 -0.40 -0.08 0.09 0.00 0.00 178.44 177.94 1xxi h GLU 188 N -0.22 -0.41 -1.28 1.13 4.81 -1.36 0.24 114.58 117.49 1xxi h GLU 188 Ca 0.12 0.03 0.37 0.00 -0.13 0.00 0.00 59.36 59.75 1xxi h GLU 188 Cb 0.39 0.09 -0.08 0.00 0.63 0.00 0.00 28.75 29.79 1xxi h GLU 188 CO -0.31 -0.27 0.89 1.25 -0.73 0.00 0.00 179.01 179.84 1xxi h HIS 189 N -0.42 0.25 0.19 0.92 2.76 -1.17 0.70 115.15 118.38 1xxi h HIS 189 Ca 0.02 0.01 -0.32 0.00 -2.20 0.00 0.00 60.37 57.89 1xxi h HIS 189 Cb 0.50 -0.07 0.03 0.00 1.55 0.00 0.00 27.41 29.42 1xxi h HIS 189 CO -0.55 -0.02 -1.37 0.82 -1.30 0.00 0.00 177.93 175.51 1xxi h ILE 190 N 0.11 1.31 0.00 6.26 2.04 -0.11 -2.64 117.51 124.48 1xxi h ILE 190 Ca 0.67 -2.66 -0.11 0.00 1.00 0.00 0.00 64.86 63.75 1xxi h ILE 190 Cb 2.34 2.91 -0.02 0.00 -0.74 0.00 0.00 36.82 41.31 1xxi h ILE 190 CO -0.15 0.80 -0.54 -0.07 0.00 0.00 0.00 178.15 178.19 1xxi h LEU 191 N 0.18 0.00 0.41 1.44 3.38 0.18 -0.76 115.31 120.14 1xxi h LEU 191 Ca -0.22 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.73 1xxi h LEU 191 Cb 2.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.81 1xxi h LEU 191 CO 0.25 0.54 -0.20 0.78 0.09 0.00 0.00 178.44 179.91 1xxi h ASN 192 N 0.00 -0.46 -0.18 -0.43 2.35 -0.64 -2.51 115.58 113.71 1xxi h ASN 192 Ca -0.01 -0.05 0.05 0.00 -0.55 0.00 0.00 56.30 55.75 1xxi h ASN 192 Cb 1.20 0.12 -0.01 0.00 0.05 0.00 0.00 38.32 39.68 1xxi h ASN 192 CO 0.07 -0.03 0.18 -0.08 -1.65 0.00 0.00 177.43 175.93 1xxi h GLU 193 N -1.10 0.00 -0.01 0.81 4.81 -1.48 -0.15 114.58 117.47 1xxi h GLU 193 Ca -0.06 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 1xxi h GLU 193 Cb 0.48 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.86 1xxi h GLU 193 CO 0.09 0.00 -0.17 0.39 -0.73 0.00 0.00 179.01 178.59 1xxi n GLU 194 N -3.93 0.99 -3.34 1.92 -0.58 -0.29 -4.98 120.64 110.42 1xxi n GLU 194 Ca 0.02 -0.53 -0.11 0.00 -0.42 0.00 0.00 57.16 56.11 1xxi n GLU 194 Cb 0.31 -1.49 0.01 0.00 -0.57 0.00 0.00 31.44 29.70 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 -0.54 -2.57 -4.22 -0.32 8.25 -0.07 -5.03 115.22 110.72 1xxi n HIS 195 Ca 0.14 0.95 -0.18 0.00 -0.26 0.00 0.00 57.72 58.38 1xxi n HIS 195 Cb 0.33 -3.70 -0.15 0.00 1.12 0.00 0.00 29.99 27.59 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 -3.09 0.53 0.12 1.59 1.01 -0.99 -5.07 121.20 115.30 1xxi s ILE 196 Ca 0.10 -0.24 -0.31 0.00 0.00 0.00 0.00 60.65 60.20 1xxi s ILE 196 Cb -0.03 -0.48 -0.09 0.00 0.01 0.00 0.00 42.46 41.87 1xxi s ILE 196 CO 0.80 0.17 1.59 0.00 0.00 0.00 0.00 174.94 177.50 1xxi s ALA 197 N 0.17 3.73 0.01 9.38 0.00 -1.26 -4.73 121.76 129.05 1xxi s ALA 197 Ca -0.02 1.28 -0.07 0.00 0.00 0.00 0.00 51.96 53.16 1xxi s ALA 197 Cb -0.06 -3.65 -0.00 0.00 0.00 0.00 0.00 23.12 19.41 1xxi s ALA 197 CO -0.00 -0.90 0.13 -3.38 0.00 0.00 0.00 175.76 171.61 1xxi s HIS 198 N 1.75 0.06 0.33 0.00 -3.43 -1.26 -0.38 115.29 112.37 1xxi s HIS 198 Ca 0.71 -0.17 0.08 0.00 -0.80 0.00 0.00 55.06 54.88 1xxi s HIS 198 Cb -0.42 -0.06 -0.04 0.00 -1.43 0.00 0.00 32.58 30.63 1xxi s HIS 198 CO 0.31 -0.29 0.11 -1.21 -2.00 0.00 0.00 174.74 171.66 1xxi s GLU 199 N -1.48 2.32 -0.01 -0.38 2.02 -1.10 -5.03 118.70 115.05 1xxi s GLU 199 Ca -0.14 -1.56 -0.23 0.00 0.02 0.00 0.00 54.97 53.05 1xxi s GLU 199 Cb -0.07 -2.14 -0.15 0.00 0.10 0.00 0.00 34.13 31.87 1xxi s GLU 199 CO 0.01 0.14 1.05 -1.35 0.02 0.00 0.00 175.26 175.13 1xxi h PRO 200 N 1.62 -0.46 -0.05 0.39 0.11 -1.93 -3.18 132.00 128.49 1xxi h PRO 200 Ca -0.44 0.03 0.01 0.00 0.11 0.00 0.00 66.00 65.72 1xxi h PRO 200 Cb 1.25 0.11 -0.00 0.00 0.11 0.00 0.00 31.00 32.46 1xxi h PRO 200 CO 0.64 -0.14 0.10 -0.09 -0.21 0.00 0.00 178.00 178.29 1xxi h ARG 201 N -0.91 0.00 0.10 1.05 2.43 -1.96 -1.68 114.38 113.40 1xxi h ARG 201 Ca -0.05 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.12 1xxi h ARG 201 Cb 0.53 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.08 1xxi h ARG 201 CO 0.08 0.00 -0.05 0.00 -1.51 0.00 0.00 179.97 178.49 1xxi h ALA 202 N 1.86 -0.14 0.00 2.80 0.00 -1.90 -1.17 119.26 120.72 1xxi h ALA 202 Ca 0.02 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 1xxi h ALA 202 Cb 0.22 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 1xxi h ALA 202 CO -0.00 -0.36 -0.02 -0.07 0.00 0.00 0.00 179.25 178.80 1xxi h LEU 203 N -0.57 0.00 0.47 0.00 3.38 -1.30 0.27 115.31 117.57 1xxi h LEU 203 Ca -0.01 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 1xxi h LEU 203 Cb 0.46 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.21 1xxi h LEU 203 CO 0.02 0.02 -0.23 1.56 0.09 0.00 0.00 178.44 179.90 1xxi h GLN 204 N 0.00 -0.61 -0.88 1.13 1.08 -1.33 -1.24 115.11 113.26 1xxi h GLN 204 Ca -0.00 0.04 0.16 0.00 -1.45 0.00 0.00 58.65 57.40 1xxi h GLN 204 Cb 0.04 0.14 -0.07 0.00 -0.05 0.00 0.00 27.48 27.54 1xxi h GLN 204 CO 0.00 -0.36 0.57 -0.07 -0.95 0.00 0.00 178.83 178.03 1xxi h LEU 205 N -1.12 0.59 -0.23 1.46 3.38 -0.63 0.32 115.31 119.08 1xxi h LEU 205 Ca -0.07 0.04 -0.15 0.00 0.09 0.00 0.00 57.88 57.80 1xxi h LEU 205 Cb 0.54 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.22 1xxi h LEU 205 CO 0.11 0.28 -0.45 -0.07 0.09 0.00 0.00 178.44 178.40 1xxi h LEU 206 N 0.61 0.79 0.03 1.67 3.38 -0.48 -2.37 115.31 118.93 1xxi h LEU 206 Ca 0.45 -0.55 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 1xxi h LEU 206 Cb 0.83 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.35 1xxi h LEU 206 CO -0.20 1.18 -0.01 0.00 0.09 0.00 0.00 178.44 179.50 1xxi h ALA 207 N 0.62 -0.04 -0.40 1.53 0.00 -0.34 -2.80 119.26 117.84 1xxi h ALA 207 Ca 0.01 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 54.75 1xxi h ALA 207 Cb 1.05 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 1xxi h ALA 207 CO 0.10 -0.33 0.26 0.00 0.00 0.00 0.00 179.25 179.29 1xxi h ARG 208 N -0.42 0.43 -0.54 0.00 3.08 -1.04 -1.64 114.38 114.24 1xxi h ARG 208 Ca -0.00 -0.03 -0.11 0.00 0.07 0.00 0.00 59.98 59.91 1xxi h ARG 208 Cb 0.40 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.33 1xxi h ARG 208 CO 0.01 0.28 -0.09 0.00 -1.07 0.00 0.00 179.97 179.10 1xxi h ALA 209 N 1.77 0.81 -1.74 0.04 0.00 -1.35 -3.36 119.26 115.44 1xxi h ALA 209 Ca 0.16 -0.34 -0.57 0.00 0.00 0.00 0.00 54.91 54.15 1xxi h ALA 209 Cb 0.09 -0.20 -0.08 0.00 0.00 0.00 0.00 17.79 17.60 1xxi h ALA 209 CO -0.04 0.66 0.83 0.00 0.00 0.00 0.00 179.25 180.71 1xxi s ALA 210 N -4.87 3.13 -1.19 0.00 0.00 -0.62 -4.94 121.76 113.27 1xxi s ALA 210 Ca -0.11 -0.71 -0.20 0.00 0.00 0.00 0.00 51.96 50.94 1xxi s ALA 210 Cb 0.13 -3.86 0.05 0.00 0.00 0.00 0.00 23.12 19.44 1xxi s ALA 210 CO 0.86 -2.33 1.65 -1.21 0.00 0.00 0.00 175.76 174.73 1xxi s GLU 211 N 4.39 3.75 0.00 0.00 2.02 -1.26 -4.14 118.70 123.45 1xxi s GLU 211 Ca 0.43 -1.61 0.00 0.00 0.02 0.00 0.00 54.97 53.81 1xxi s GLU 211 Cb -0.08 -5.45 0.00 0.00 0.10 0.00 0.00 34.13 28.70 1xxi s GLU 211 CO 0.28 -2.35 0.00 0.41 0.02 0.00 0.00 175.26 173.62 1xxi n GLY 212 N 5.98 0.67 3.29 -1.39 0.00 -1.26 -4.95 105.19 107.52 1xxi n GLY 212 Ca 0.43 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 46.09 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 -2.53 4.59 0.29 1.61 1.04 -1.25 -3.52 113.70 113.93 1xxi s SER 213 Ca 0.00 -0.65 0.09 0.00 0.48 0.00 0.00 55.95 55.86 1xxi s SER 213 Cb 0.00 -1.76 0.45 0.00 0.10 0.00 0.00 66.02 64.81 1xxi s SER 213 CO 0.00 -0.11 1.68 0.25 0.98 0.00 0.00 173.24 176.04 1xxi h LEU 214 N 8.12 0.13 0.11 2.42 5.85 -1.44 -0.96 115.31 129.53 1xxi h LEU 214 Ca -0.35 -0.06 0.02 0.00 0.84 0.00 0.00 57.88 58.32 1xxi h LEU 214 Cb 1.13 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 42.08 1xxi h LEU 214 CO 0.59 0.60 -0.50 -0.09 -0.34 0.00 0.00 178.44 178.70 1xxi h ARG 215 N 0.09 -0.70 -0.51 1.25 2.43 -1.92 -1.63 114.38 113.40 1xxi h ARG 215 Ca 0.00 0.05 -0.12 0.00 -0.81 0.00 0.00 59.98 59.10 1xxi h ARG 215 Cb 0.91 0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 30.61 1xxi h ARG 215 CO 0.07 -0.47 -0.15 -0.44 -1.51 0.00 0.00 179.97 177.47 1xxi h ASP 216 N -0.73 1.01 -0.83 -3.80 3.32 -1.82 -2.79 116.42 110.78 1xxi h ASP 216 Ca 0.00 -0.37 0.20 0.00 0.02 0.00 0.00 57.03 56.88 1xxi h ASP 216 Cb 0.74 -0.28 -0.15 0.00 0.22 0.00 0.00 39.33 39.87 1xxi h ASP 216 CO -0.29 1.15 0.01 0.00 -1.72 0.00 0.00 179.24 178.39 1xxi h ALA 217 N 0.89 0.89 -0.22 3.45 0.00 -0.65 0.36 119.26 123.99 1xxi h ALA 217 Ca 0.12 0.27 -0.19 0.00 0.00 0.00 0.00 54.91 55.11 1xxi h ALA 217 Cb 0.72 0.47 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1xxi h ALA 217 CO 0.06 -0.45 -0.61 -0.07 0.00 0.00 0.00 179.25 178.17 1xxi h LEU 218 N 0.09 0.85 -1.77 0.00 3.38 -1.20 -1.35 115.31 115.31 1xxi h LEU 218 Ca 0.46 -0.48 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 1xxi h LEU 218 Cb 0.86 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.36 1xxi h LEU 218 CO -0.74 1.26 -0.16 0.77 0.09 0.00 0.00 178.44 179.66 1xxi h SER 219 N 0.56 0.00 0.18 -0.43 4.64 -0.17 0.20 113.55 118.53 1xxi h SER 219 Ca -0.01 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 61.03 1xxi h SER 219 Cb 1.21 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 63.33 1xxi h SER 219 CO 0.13 0.16 -1.22 -0.07 -0.87 0.00 0.00 176.83 174.96 1xxi h LEU 220 N 0.00 0.75 -1.85 5.97 3.38 -0.55 -2.99 115.31 120.02 1xxi h LEU 220 Ca -0.00 -0.90 0.02 0.00 0.09 0.00 0.00 57.88 57.09 1xxi h LEU 220 Cb 0.37 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 1xxi h LEU 220 CO 0.02 1.59 0.13 0.74 0.09 0.00 0.00 178.44 181.01 1xxi h THR 221 N 0.04 1.01 0.00 0.22 2.02 -0.06 -0.69 112.91 115.45 1xxi h THR 221 Ca -0.20 -0.07 -0.12 0.00 0.77 0.00 0.00 66.41 66.79 1xxi h THR 221 Cb 1.94 0.79 -0.02 0.00 -1.74 0.00 0.00 68.15 69.13 1xxi h THR 221 CO 0.23 0.04 -0.58 0.44 0.37 0.00 0.00 175.52 176.02 1xxi h ASP 222 N 0.20 0.00 0.56 4.18 3.32 -0.64 -2.67 116.42 121.37 1xxi h ASP 222 Ca 0.08 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.13 1xxi h ASP 222 Cb 0.08 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.63 1xxi h ASP 222 CO -0.01 0.58 -0.29 0.00 -1.72 0.00 0.00 179.24 177.79 1xxi n GLN 223 N -3.52 0.22 0.01 3.56 1.13 -0.37 -2.90 117.38 115.52 1xxi n GLN 223 Ca -0.00 -0.10 -0.08 0.00 -1.94 0.00 0.00 57.00 54.88 1xxi n GLN 223 Cb 0.66 -1.50 -0.13 0.00 0.11 0.00 0.00 30.24 29.38 1xxi n GLN 223 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1xxi h ALA 224 N 3.19 0.61 0.00 -1.58 0.00 -1.00 -1.96 119.26 118.52 1xxi h ALA 224 Ca 0.00 -1.25 -0.12 0.00 0.00 0.00 0.00 54.91 53.54 1xxi h ALA 224 Cb 0.48 0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 1xxi h ALA 224 CO 0.00 1.45 -0.57 0.82 0.00 0.00 0.00 179.25 180.95 1xxi h ILE 225 N 0.00 1.18 0.08 0.00 2.04 -1.46 -1.96 117.51 117.38 1xxi h ILE 225 Ca -0.17 -2.14 -0.27 0.00 1.00 0.00 0.00 64.86 63.27 1xxi h ILE 225 Cb 1.92 2.24 -0.01 0.00 -0.74 0.00 0.00 36.82 40.22 1xxi h ILE 225 CO 0.10 0.56 -1.44 0.00 0.00 0.00 0.00 178.15 177.37 1xxi h ALA 226 N 1.43 0.25 0.09 1.87 0.00 -1.58 -3.37 119.26 117.95 1xxi h ALA 226 Ca -0.01 -1.16 -0.00 0.00 0.00 0.00 0.00 54.91 53.74 1xxi h ALA 226 Cb 1.19 0.58 0.00 0.00 0.00 0.00 0.00 17.79 19.56 1xxi h ALA 226 CO 0.07 0.86 -0.04 0.66 0.00 0.00 0.00 179.25 180.80 1xxi h SER 227 N -0.45 -0.10 -0.04 0.00 4.64 -1.43 -3.46 113.55 112.71 1xxi h SER 227 Ca -0.33 -0.34 0.00 0.00 -0.47 0.00 0.00 61.79 60.65 1xxi h SER 227 Cb 1.66 0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.77 1xxi h SER 227 CO -0.01 0.30 0.00 0.61 -0.87 0.00 0.00 176.83 176.86 1xxi n GLY 228 N -0.04 0.82 3.88 -0.77 0.00 -0.74 -5.04 105.19 103.30 1xxi n GLY 228 Ca -0.08 -1.56 -0.29 0.00 0.00 0.00 0.00 46.02 44.08 1xxi n GLY 228 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1xxi s ASP 229 N -1.00 4.27 -0.87 1.61 1.01 -1.26 -4.80 116.67 115.63 1xxi s ASP 229 Ca 0.00 0.79 -0.10 0.00 0.71 0.00 0.00 52.55 53.95 1xxi s ASP 229 Cb 0.00 -1.28 -0.08 0.00 1.01 0.00 0.00 42.92 42.57 1xxi s ASP 229 CO 0.00 -2.05 2.05 0.61 0.21 0.00 0.00 175.17 175.98 1xxi n GLY 230 N -3.14 2.97 3.20 0.21 0.00 -1.26 -4.58 105.19 102.59 1xxi n GLY 230 Ca 0.08 -0.96 -0.11 0.00 0.00 0.00 0.00 46.02 45.03 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 3.84 0.33 -1.04 1.61 -0.21 -1.26 -4.51 119.66 118.42 1xxi s GLN 231 Ca 0.44 0.71 -0.18 0.00 0.02 0.00 0.00 55.36 56.34 1xxi s GLN 231 Cb 0.11 -0.05 0.12 0.00 1.00 0.00 0.00 33.01 34.19 1xxi s GLN 231 CO 0.01 -0.16 1.31 0.08 -2.12 0.00 0.00 175.29 174.40 1xxi s VAL 232 N 1.39 4.61 0.11 1.09 1.01 0.49 -4.70 120.40 124.41 1xxi s VAL 232 Ca -0.09 -1.71 0.03 0.00 0.00 0.00 0.00 61.98 60.21 1xxi s VAL 232 Cb -0.09 -4.89 -0.04 0.00 0.00 0.00 0.00 36.38 31.36 1xxi s VAL 232 CO -0.11 -1.65 0.13 -0.94 0.00 0.00 0.00 175.10 172.52 1xxi s SER 233 N 3.73 5.68 0.25 3.32 1.04 -1.26 -2.72 113.70 123.73 1xxi s SER 233 Ca 0.39 -0.01 -0.03 0.00 0.48 0.00 0.00 55.95 56.78 1xxi s SER 233 Cb -0.03 -1.55 0.45 0.00 0.10 0.00 0.00 66.02 64.99 1xxi s SER 233 CO -0.06 0.13 1.80 0.74 0.98 0.00 0.00 173.24 176.83 1xxi h THR 234 N 2.26 0.87 -0.90 2.02 2.02 -1.92 -0.14 112.91 117.11 1xxi h THR 234 Ca -0.47 -0.27 0.08 0.00 0.77 0.00 0.00 66.41 66.53 1xxi h THR 234 Cb 1.18 0.03 -0.07 0.00 -1.74 0.00 0.00 68.15 67.54 1xxi h THR 234 CO 0.66 0.14 0.56 -0.61 0.37 0.00 0.00 175.52 176.64 1xxi h GLN 235 N 0.77 0.94 0.03 6.66 4.15 -1.96 -0.35 115.11 125.36 1xxi h GLN 235 Ca 0.43 -0.06 -0.00 0.00 0.77 0.00 0.00 58.65 59.79 1xxi h GLN 235 Cb 0.45 -0.21 0.00 0.00 0.21 0.00 0.00 27.48 27.93 1xxi h GLN 235 CO -0.28 0.62 -0.02 0.00 -1.93 0.00 0.00 178.83 177.23 1xxi h ALA 236 N 1.45 -0.05 -0.16 3.38 0.00 -1.46 -3.01 119.26 119.41 1xxi h ALA 236 Ca 0.41 -0.33 0.04 0.00 0.00 0.00 0.00 54.91 55.04 1xxi h ALA 236 Cb 0.27 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.03 1xxi h ALA 236 CO -0.21 -0.16 -0.13 0.28 0.00 0.00 0.00 179.25 179.03 1xxi h VAL 237 N -0.78 0.63 0.00 0.00 2.07 -0.75 0.40 116.25 117.82 1xxi h VAL 237 Ca -0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1xxi h VAL 237 Cb 0.68 0.63 0.00 0.00 -1.52 0.00 0.00 31.29 31.08 1xxi h VAL 237 CO 0.01 0.00 0.00 -1.54 0.02 0.00 0.00 177.57 176.06 1xxi n SER 238 N -5.28 0.00 -0.04 0.57 3.41 -0.17 -1.78 113.62 110.32 1xxi n SER 238 Ca -0.02 -1.28 -0.12 0.00 -0.26 0.00 0.00 58.87 57.19 1xxi n SER 238 Cb 0.20 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.01 1xxi n SER 238 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xxi n ALA 239 N -0.66 1.39 -0.04 7.33 0.00 0.14 -0.90 120.51 127.76 1xxi n ALA 239 Ca 0.06 -0.88 -0.15 0.00 0.00 0.00 0.00 53.44 52.47 1xxi n ALA 239 Cb 0.03 -0.63 -0.13 0.00 0.00 0.00 0.00 19.45 18.71 1xxi n ALA 239 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 1xxi h MET 240 N 0.01 0.07 0.01 0.00 2.86 -0.88 -3.41 114.93 113.59 1xxi h MET 240 Ca -0.38 -0.11 -0.03 0.00 -2.06 0.00 0.00 59.70 57.12 1xxi h MET 240 Cb 2.06 0.04 0.00 0.00 0.06 0.00 0.00 31.60 33.77 1xxi h MET 240 CO 0.06 1.05 -0.12 -0.07 1.06 0.00 0.00 176.91 178.89 1xxi h LEU 241 N -0.86 0.09 0.00 1.22 3.38 -1.63 -3.48 115.31 114.02 1xxi h LEU 241 Ca -0.03 -0.89 0.00 0.00 0.09 0.00 0.00 57.88 57.05 1xxi h LEU 241 Cb 1.14 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.86 1xxi h LEU 241 CO 0.03 0.96 0.00 0.61 0.09 0.00 0.00 178.44 180.14 1xxi n GLY 242 N 1.33 0.77 3.82 0.83 0.00 -1.13 -5.08 105.19 105.73 1xxi n GLY 242 Ca -0.10 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.55 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 -0.88 4.67 0.37 2.61 2.01 -0.07 -4.64 115.64 119.70 1xxi s THR 243 Ca 0.00 1.16 0.04 0.00 0.31 0.00 0.00 61.69 63.21 1xxi s THR 243 Cb 0.00 -3.85 0.24 0.00 0.01 0.00 0.00 72.50 68.90 1xxi s THR 243 CO 0.00 0.29 1.99 -0.07 -0.69 0.00 0.00 174.62 176.15 1xxi h LEU 244 N 3.69 0.58 1.25 4.42 3.38 -1.99 -3.43 115.31 123.21 1xxi h LEU 244 Ca -0.48 -0.04 -0.30 0.00 0.09 0.00 0.00 57.88 57.15 1xxi h LEU 244 Cb 1.20 -0.15 -0.08 0.00 0.09 0.00 0.00 40.66 41.72 1xxi h LEU 244 CO 0.65 0.47 -0.31 -0.67 0.09 0.00 0.00 178.44 178.67 1xxi n ASP 245 N -4.41 -4.64 -4.30 -0.43 2.03 -1.26 -4.98 116.55 98.56 1xxi n ASP 245 Ca 0.04 0.21 -0.19 0.00 0.52 0.00 0.00 54.79 55.37 1xxi n ASP 245 Cb 0.10 -3.57 -0.11 0.00 -0.72 0.00 0.00 41.12 36.82 1xxi n ASP 245 CO 0.00 0.00 0.00 -1.81 -1.92 0.00 0.00 177.20 173.47 1xxi s ASP 246 N -2.64 2.39 0.00 1.67 1.01 -1.26 -5.01 116.67 112.83 1xxi s ASP 246 Ca 0.00 -0.89 0.00 0.00 0.71 0.00 0.00 52.55 52.37 1xxi s ASP 246 Cb 0.00 -0.12 0.00 0.00 1.01 0.00 0.00 42.92 43.81 1xxi s ASP 246 CO 0.00 -0.12 0.44 0.47 0.21 0.00 0.00 175.17 176.17 1xxi n ASP 247 N 0.18 0.06 -0.22 0.27 8.00 -1.26 -4.13 116.55 119.45 1xxi n ASP 247 Ca -0.12 -0.94 0.03 0.00 0.71 0.00 0.00 54.79 54.46 1xxi n ASP 247 Cb 0.58 -0.03 0.14 0.00 -0.02 0.00 0.00 41.12 41.79 1xxi n ASP 247 CO 0.00 0.00 0.00 1.56 -0.39 0.00 0.00 177.20 178.37 1xxi h GLN 248 N 0.07 0.31 -0.85 -1.24 4.20 -1.98 -1.47 115.11 114.15 1xxi h GLN 248 Ca 0.00 -0.02 0.03 0.00 0.06 0.00 0.00 58.65 58.72 1xxi h GLN 248 Cb 0.03 -0.07 -0.05 0.00 0.30 0.00 0.00 27.48 27.69 1xxi h GLN 248 CO 0.00 0.20 0.55 0.00 -0.67 0.00 0.00 178.83 178.92 1xxi h ALA 249 N 1.51 1.12 0.06 3.87 0.00 -1.93 -1.72 119.26 122.18 1xxi h ALA 249 Ca 0.36 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.23 1xxi h ALA 249 Cb 0.54 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1xxi h ALA 249 CO -0.41 0.40 -0.03 1.25 0.00 0.00 0.00 179.25 180.46 1xxi h LEU 250 N 1.08 -0.07 -2.04 0.00 5.85 -1.61 -2.69 115.31 115.84 1xxi h LEU 250 Ca 0.34 -0.38 -0.01 0.00 0.84 0.00 0.00 57.88 58.67 1xxi h LEU 250 Cb -0.01 0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.04 1xxi h LEU 250 CO -0.11 0.36 -0.03 0.77 -0.34 0.00 0.00 178.44 179.09 1xxi h SER 251 N -0.51 0.00 -0.44 1.25 4.64 -1.24 0.18 113.55 117.43 1xxi h SER 251 Ca -0.01 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.25 1xxi h SER 251 Cb 0.45 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.52 1xxi h SER 251 CO 0.01 0.03 0.03 -0.07 -0.87 0.00 0.00 176.83 175.97 1xxi h LEU 252 N 0.00 0.74 -0.46 5.97 3.38 -1.27 -0.01 115.31 123.66 1xxi h LEU 252 Ca -0.00 -0.29 -0.05 0.00 0.09 0.00 0.00 57.88 57.63 1xxi h LEU 252 Cb 0.06 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 1xxi h LEU 252 CO 0.00 0.84 0.09 0.58 0.09 0.00 0.00 178.44 180.04 1xxi h VAL 253 N 0.61 1.24 -0.51 1.22 2.07 -0.59 -0.58 116.25 119.71 1xxi h VAL 253 Ca 0.13 -0.87 -0.00 0.00 0.82 0.00 0.00 66.70 66.78 1xxi h VAL 253 Cb 0.44 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 31.12 1xxi h VAL 253 CO 0.02 0.31 0.32 -0.33 0.02 0.00 0.00 177.57 177.90 1xxi h GLU 254 N 0.62 0.68 0.44 1.57 5.08 -0.37 -1.53 114.58 121.07 1xxi h GLU 254 Ca 0.14 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.42 1xxi h GLU 254 Cb 0.36 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.47 1xxi h GLU 254 CO 0.01 0.48 -0.21 0.00 -1.00 0.00 0.00 179.01 178.29 1xxi h ALA 255 N 1.16 -0.60 -0.79 3.43 0.00 -0.82 -2.99 119.26 118.65 1xxi h ALA 255 Ca 0.18 -0.17 0.16 0.00 0.00 0.00 0.00 54.91 55.09 1xxi h ALA 255 Cb -0.03 0.23 -0.15 0.00 0.00 0.00 0.00 17.79 17.84 1xxi h ALA 255 CO -0.04 -0.74 -0.16 1.98 0.00 0.00 0.00 179.25 180.29 1xxi h MET 256 N -0.78 0.01 0.00 0.00 1.85 -1.04 0.23 114.93 115.21 1xxi h MET 256 Ca -0.06 -0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.03 1xxi h MET 256 Cb 0.54 -0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.57 1xxi h MET 256 CO 0.10 0.01 0.00 0.28 -0.40 0.00 0.00 176.91 176.90 1xxi n VAL 257 N -5.49 0.74 0.80 -5.77 0.31 -0.58 -1.86 118.33 106.48 1xxi n VAL 257 Ca 0.12 0.17 0.10 0.00 -0.01 0.00 0.00 64.34 64.72 1xxi n VAL 257 Cb 0.43 -0.89 -0.09 0.00 -0.91 0.00 0.00 33.84 32.38 1xxi n VAL 257 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1xxi n GLU 258 N -1.62 0.13 -2.31 5.55 1.02 0.71 -4.97 120.64 119.15 1xxi n GLU 258 Ca 0.04 -0.03 -0.05 0.00 -0.02 0.00 0.00 57.16 57.10 1xxi n GLU 258 Cb 0.23 -1.51 0.03 0.00 -0.02 0.00 0.00 31.44 30.16 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 -1.65 -0.90 0.91 0.62 0.00 -0.60 -4.98 120.51 113.90 1xxi n ALA 259 Ca 0.03 0.01 0.12 0.00 0.00 0.00 0.00 53.44 53.60 1xxi n ALA 259 Cb 0.38 -1.66 0.23 0.00 0.00 0.00 0.00 19.45 18.40 1xxi n ALA 259 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1xxi n ASN 260 N -1.88 0.53 0.00 0.00 2.85 -1.01 -4.90 115.26 110.85 1xxi n ASN 260 Ca -0.07 -0.18 0.00 0.00 -0.11 0.00 0.00 54.58 54.22 1xxi n ASN 260 Cb 0.55 0.26 0.00 0.00 1.24 0.00 0.00 39.78 41.83 1xxi n ASN 260 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1xxi n GLY 261 N 1.47 0.00 0.34 8.20 0.00 -1.26 -2.05 105.19 111.89 1xxi n GLY 261 Ca 0.05 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.13 1xxi n GLY 261 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1xxi n GLU 262 N 0.00 -0.08 0.08 1.61 4.07 -1.26 0.14 120.64 125.19 1xxi n GLU 262 Ca 0.00 1.47 -0.09 0.00 -0.06 0.00 0.00 57.16 58.48 1xxi n GLU 262 Cb 0.00 -2.20 -0.10 0.00 -0.06 0.00 0.00 31.44 29.08 1xxi n GLU 262 CO 0.00 0.00 0.00 -0.09 -0.06 0.00 0.00 177.13 176.98 1xxi h ARG 263 N 0.00 0.09 0.16 5.31 2.43 -1.83 -0.34 114.38 120.20 1xxi h ARG 263 Ca 0.46 -0.14 -0.01 0.00 -0.81 0.00 0.00 59.98 59.48 1xxi h ARG 263 Cb 0.71 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.31 1xxi h ARG 263 CO -0.97 1.03 -0.08 0.28 -1.51 0.00 0.00 179.97 178.72 1xxi h VAL 264 N 0.03 0.96 -0.01 0.20 2.07 -0.67 0.14 116.25 118.97 1xxi h VAL 264 Ca -0.04 -0.58 -0.02 0.00 0.82 0.00 0.00 66.70 66.88 1xxi h VAL 264 Cb 1.75 1.31 -0.00 0.00 -1.52 0.00 0.00 31.29 32.82 1xxi h VAL 264 CO 0.15 0.13 -0.11 0.24 0.02 0.00 0.00 177.57 178.00 1xxi h MET 265 N -0.50 0.02 0.54 1.57 2.86 0.11 -1.43 114.93 118.10 1xxi h MET 265 Ca -0.02 -0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.59 1xxi h MET 265 Cb 0.39 -0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.05 1xxi h MET 265 CO 0.04 0.12 -0.26 0.00 1.06 0.00 0.00 176.91 177.87 1xxi h ALA 266 N 1.88 -0.72 -0.95 6.32 0.00 -0.72 -2.80 119.26 122.27 1xxi h ALA 266 Ca 0.00 -0.20 0.16 0.00 0.00 0.00 0.00 54.91 54.87 1xxi h ALA 266 Cb 0.20 0.28 -0.10 0.00 0.00 0.00 0.00 17.79 18.17 1xxi h ALA 266 CO 0.01 -0.76 0.56 -0.07 0.00 0.00 0.00 179.25 178.99 1xxi h LEU 267 N -1.01 0.73 -1.43 0.00 3.38 -0.27 0.79 115.31 117.50 1xxi h LEU 267 Ca -0.07 0.08 0.02 0.00 0.09 0.00 0.00 57.88 57.99 1xxi h LEU 267 Cb 0.63 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.30 1xxi h LEU 267 CO 0.12 0.31 0.40 0.40 0.09 0.00 0.00 178.44 179.76 1xxi h ILE 268 N 0.77 1.13 -0.00 1.22 2.04 -1.25 0.27 117.51 121.68 1xxi h ILE 268 Ca 0.52 -0.26 -0.00 0.00 1.00 0.00 0.00 64.86 66.11 1xxi h ILE 268 Cb 0.71 0.29 0.00 0.00 -0.74 0.00 0.00 36.82 37.08 1xxi h ILE 268 CO -0.35 0.14 -0.01 -1.13 0.00 0.00 0.00 178.15 176.80 1xxi h ASN 269 N 0.77 0.02 -0.65 1.72 -1.24 -0.59 -0.70 115.58 114.91 1xxi h ASN 269 Ca 0.23 -0.61 -0.01 0.00 0.71 0.00 0.00 56.30 56.62 1xxi h ASN 269 Cb -0.03 -0.01 -0.03 0.00 0.73 0.00 0.00 38.32 38.98 1xxi h ASN 269 CO -0.05 0.63 0.38 -0.08 -1.29 0.00 0.00 177.43 177.02 1xxi h GLU 270 N -0.59 0.88 -0.14 6.67 4.81 -1.01 0.11 114.58 125.32 1xxi h GLU 270 Ca -0.00 -0.08 0.05 0.00 -0.13 0.00 0.00 59.36 59.19 1xxi h GLU 270 Cb 0.63 -0.18 -0.05 0.00 0.63 0.00 0.00 28.75 29.77 1xxi h GLU 270 CO 0.00 0.64 -0.19 0.00 -0.73 0.00 0.00 179.01 178.73 1xxi h ALA 271 N 1.20 -0.13 -1.00 2.92 0.00 -0.48 -0.30 119.26 121.48 1xxi h ALA 271 Ca 0.23 0.05 0.12 0.00 0.00 0.00 0.00 54.91 55.31 1xxi h ALA 271 Cb -0.01 0.38 -0.08 0.00 0.00 0.00 0.00 17.79 18.07 1xxi h ALA 271 CO -0.04 -0.64 0.63 0.00 0.00 0.00 0.00 179.25 179.19 1xxi h ALA 272 N 0.78 1.54 0.00 0.00 0.00 -0.01 -0.95 119.26 120.62 1xxi h ALA 272 Ca 0.10 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1xxi h ALA 272 Cb 0.39 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 1xxi h ALA 272 CO -0.27 0.21 -0.03 0.00 0.00 0.00 0.00 179.25 179.16 1xxi h ALA 273 N 1.54 1.36 -0.55 0.00 0.00 0.80 -1.25 119.26 121.15 1xxi h ALA 273 Ca 0.49 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.37 1xxi h ALA 273 Cb 0.49 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1xxi h ALA 273 CO -0.26 0.04 0.00 0.54 0.00 0.00 0.00 179.25 179.57 1xxi n ARG 274 N -3.64 3.66 -3.62 0.00 1.74 -0.36 -4.98 116.66 109.46 1xxi n ARG 274 Ca -0.03 -2.57 -0.23 0.00 -0.77 0.00 0.00 57.85 54.25 1xxi n ARG 274 Cb 0.13 -1.91 0.04 0.00 -1.02 0.00 0.00 32.46 29.70 1xxi n ARG 274 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1xxi n GLY 275 N 0.92 -0.64 3.84 -0.13 0.00 -0.47 -4.97 105.19 103.73 1xxi n GLY 275 Ca 0.23 0.30 -0.32 0.00 0.00 0.00 0.00 46.02 46.23 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 -3.57 4.29 -0.63 -0.61 1.01 -1.25 -4.98 121.20 115.47 1xxi s ILE 276 Ca 0.22 0.90 -0.21 0.00 0.00 0.00 0.00 60.65 61.55 1xxi s ILE 276 Cb -0.06 -3.60 0.09 0.00 0.01 0.00 0.00 42.46 38.90 1xxi s ILE 276 CO 0.81 -0.83 0.84 -1.61 0.00 0.00 0.00 174.94 174.16 1xxi s GLU 277 N -4.65 3.08 0.44 2.79 0.41 -1.26 -4.93 118.70 114.58 1xxi s GLU 277 Ca 0.59 -1.08 0.27 0.00 -0.41 0.00 0.00 54.97 54.34 1xxi s GLU 277 Cb -0.13 -4.25 1.33 0.00 -1.78 0.00 0.00 34.13 29.31 1xxi s GLU 277 CO 0.45 -1.68 1.70 -1.49 -0.49 0.00 0.00 175.26 173.75 1xxi h TRP 278 N 9.38 0.49 -0.16 1.61 4.06 -1.93 0.20 115.95 129.59 1xxi h TRP 278 Ca -0.29 0.02 -0.18 0.00 2.06 0.00 0.00 58.89 60.50 1xxi h TRP 278 Cb 1.08 -0.13 -0.00 0.00 -1.00 0.00 0.00 29.16 29.11 1xxi h TRP 278 CO 0.90 -0.07 -0.64 1.49 -3.56 0.00 0.00 178.44 176.56 1xxi h GLU 279 N 0.19 0.58 -0.42 0.49 4.81 -1.93 -2.75 114.58 115.55 1xxi h GLU 279 Ca 0.71 -0.41 -0.02 0.00 -0.13 0.00 0.00 59.36 59.51 1xxi h GLU 279 Cb 2.19 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 31.62 1xxi h GLU 279 CO -0.30 1.03 0.19 0.00 -0.73 0.00 0.00 179.01 179.20 1xxi h ALA 280 N 0.86 1.56 -0.37 2.92 0.00 -1.03 -0.98 119.26 122.22 1xxi h ALA 280 Ca -0.01 -0.10 -0.10 0.00 0.00 0.00 0.00 54.91 54.71 1xxi h ALA 280 Cb 1.22 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 1xxi h ALA 280 CO 0.12 0.36 -0.14 1.25 0.00 0.00 0.00 179.25 180.84 1xxi h LEU 281 N 0.58 0.77 -0.91 0.00 5.85 -1.30 -2.62 115.31 117.68 1xxi h LEU 281 Ca 0.15 -0.39 -0.10 0.00 0.84 0.00 0.00 57.88 58.38 1xxi h LEU 281 Cb 0.08 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.88 1xxi h LEU 281 CO -0.02 0.98 -0.23 -0.07 -0.34 0.00 0.00 178.44 178.77 1xxi h LEU 282 N 0.55 0.54 -0.90 2.25 3.38 -1.09 -2.18 115.31 117.86 1xxi h LEU 282 Ca 0.09 -0.18 -0.07 0.00 0.09 0.00 0.00 57.88 57.81 1xxi h LEU 282 Cb 0.68 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 1xxi h LEU 282 CO 0.05 0.77 0.03 0.58 0.09 0.00 0.00 178.44 179.96 1xxi h VAL 283 N 0.48 1.24 -0.33 1.22 2.07 -1.06 -1.44 116.25 118.44 1xxi h VAL 283 Ca 0.07 -0.98 -0.05 0.00 0.82 0.00 0.00 66.70 66.56 1xxi h VAL 283 Cb 0.66 0.81 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 1xxi h VAL 283 CO 0.05 0.35 0.01 -0.33 0.02 0.00 0.00 177.57 177.67 1xxi h GLU 284 N 0.79 0.57 -1.00 1.57 4.39 -1.16 -0.64 114.58 119.11 1xxi h GLU 284 Ca 0.16 -0.17 0.02 0.00 0.34 0.00 0.00 59.36 59.71 1xxi h GLU 284 Cb 0.43 -0.05 -0.05 0.00 -0.10 0.00 0.00 28.75 28.97 1xxi h GLU 284 CO 0.02 0.69 0.66 0.52 -1.16 0.00 0.00 179.01 179.73 1xxi h MET 285 N 0.37 1.27 -0.51 2.33 2.86 -0.94 0.12 114.93 120.44 1xxi h MET 285 Ca 0.09 -0.08 -0.06 0.00 -2.06 0.00 0.00 59.70 57.60 1xxi h MET 285 Cb 0.42 -0.29 -0.02 0.00 0.06 0.00 0.00 31.60 31.78 1xxi h MET 285 CO 0.01 0.84 0.08 -0.07 1.06 0.00 0.00 176.91 178.83 1xxi h LEU 286 N 1.31 0.81 -0.96 1.22 3.38 -0.93 0.13 115.31 120.27 1xxi h LEU 286 Ca 0.38 -0.26 -0.07 0.00 0.09 0.00 0.00 57.88 58.02 1xxi h LEU 286 Cb -0.08 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.43 1xxi h LEU 286 CO -0.10 0.87 0.02 1.23 0.09 0.00 0.00 178.44 180.55 1xxi h GLY 287 N 0.72 0.83 0.83 0.83 0.00 -0.18 -0.41 103.07 105.69 1xxi h GLY 287 Ca 0.15 -0.54 -0.08 0.00 0.00 0.00 0.00 47.33 46.87 1xxi h GLY 287 CO 0.01 0.50 -0.17 1.41 0.00 0.00 0.00 176.54 178.29 1xxi h LEU 288 N 0.73 0.51 -2.09 3.11 3.38 -0.30 -2.20 115.31 118.44 1xxi h LEU 288 Ca 0.15 -0.46 0.02 0.00 0.09 0.00 0.00 57.88 57.68 1xxi h LEU 288 Cb 0.42 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.02 1xxi h LEU 288 CO 0.02 0.86 0.06 -0.07 0.09 0.00 0.00 178.44 179.40 1xxi h LEU 289 N 0.16 0.00 0.17 1.67 3.38 -0.16 -1.67 115.31 118.86 1xxi h LEU 289 Ca 0.04 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1xxi h LEU 289 Cb 0.71 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.46 1xxi h LEU 289 CO 0.04 0.00 -0.08 -0.74 0.09 0.00 0.00 178.44 177.75 1xxi h HIS 290 N 0.00 -0.21 -0.83 1.13 2.76 -0.83 -2.97 115.15 114.20 1xxi h HIS 290 Ca 0.04 -0.01 0.15 0.00 -2.20 0.00 0.00 60.37 58.35 1xxi h HIS 290 Cb 0.15 0.07 -0.09 0.00 1.55 0.00 0.00 27.41 29.09 1xxi h HIS 290 CO 0.00 0.18 0.41 0.00 -1.30 0.00 0.00 177.93 177.21 1xxi h ARG 291 N -0.93 0.56 -0.18 5.26 3.08 -1.05 -1.06 114.38 120.05 1xxi h ARG 291 Ca -0.02 -0.03 0.05 0.00 0.07 0.00 0.00 59.98 60.04 1xxi h ARG 291 Cb 0.48 -0.13 -0.06 0.00 0.08 0.00 0.00 29.97 30.35 1xxi h ARG 291 CO 0.04 0.37 -0.20 0.82 -1.07 0.00 0.00 179.97 179.93 1xxi h ILE 292 N 0.58 0.48 0.00 2.04 2.04 -1.36 0.59 117.51 121.87 1xxi h ILE 292 Ca 0.45 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 66.31 1xxi h ILE 292 Cb 0.66 0.48 -0.00 0.00 -0.74 0.00 0.00 36.82 37.22 1xxi h ILE 292 CO -0.37 0.00 -0.01 0.00 0.00 0.00 0.00 178.15 177.77 1xxi h ALA 293 N 0.81 1.96 -0.24 1.87 0.00 -1.08 0.90 119.26 123.48 1xxi h ALA 293 Ca 0.12 -0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.83 1xxi h ALA 293 Cb 0.41 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 1xxi h ALA 293 CO -0.32 0.01 -0.58 0.52 0.00 0.00 0.00 179.25 178.88 1xxi h MET 294 N 0.00 0.77 -0.12 0.00 2.86 0.12 -2.90 114.93 115.66 1xxi h MET 294 Ca -0.00 -0.51 -0.07 0.00 -2.06 0.00 0.00 59.70 57.06 1xxi h MET 294 Cb 0.02 0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.73 1xxi h MET 294 CO 0.00 1.13 -0.24 0.28 1.06 0.00 0.00 176.91 179.15 1xxi h VAL 295 N 0.58 1.22 0.00 -2.22 2.07 0.17 -0.37 116.25 117.71 1xxi h VAL 295 Ca 0.00 -1.04 0.00 0.00 0.82 0.00 0.00 66.70 66.48 1xxi h VAL 295 Cb 1.18 1.40 0.00 0.00 -1.52 0.00 0.00 31.29 32.35 1xxi h VAL 295 CO 0.12 0.31 0.00 1.56 0.02 0.00 0.00 177.57 179.59 1xxi h GLN 296 N 0.19 0.00 0.08 1.57 4.20 -0.79 -2.93 115.11 117.43 1xxi h GLN 296 Ca 0.03 0.00 -0.37 0.00 0.06 0.00 0.00 58.65 58.37 1xxi h GLN 296 Cb 0.53 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.27 1xxi h GLN 296 CO 0.04 0.00 -2.15 -0.11 -0.67 0.00 0.00 178.83 175.93 1xxi n LEU 297 N -3.09 2.72 -3.40 1.46 7.94 -0.47 -4.82 117.00 117.35 1xxi n LEU 297 Ca 0.01 0.10 -0.16 0.00 -1.11 0.00 0.00 56.01 54.85 1xxi n LEU 297 Cb 0.36 -1.03 -0.09 0.00 0.53 0.00 0.00 43.42 43.18 1xxi n LEU 297 CO 0.29 0.88 -0.16 -0.94 -1.11 0.00 0.00 177.39 176.35 1xxi s SER 298 N -6.86 1.38 0.00 1.96 1.04 -0.27 -5.05 113.70 105.90 1xxi s SER 298 Ca -0.26 -0.57 0.00 0.00 0.48 0.00 0.00 55.95 55.60 1xxi s SER 298 Cb 0.07 0.61 0.00 0.00 0.10 0.00 0.00 66.02 66.80 1xxi s SER 298 CO 0.72 -0.37 0.42 -0.81 0.98 0.00 0.00 173.24 174.18 1xxi n PRO 299 N 5.32 0.00 0.00 4.02 -0.04 -1.11 -1.53 135.00 141.67 1xxi n PRO 299 Ca -0.02 0.08 0.12 0.00 -0.04 0.00 0.00 63.50 63.65 1xxi n PRO 299 Cb 0.47 -1.58 0.27 0.00 -0.04 0.00 0.00 33.50 32.63 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 -0.92 3.19 0.29 0.55 0.00 -1.26 -4.47 120.51 117.89 1xxi n ALA 300 Ca 0.00 -0.48 0.18 0.00 0.00 0.00 0.00 53.44 53.14 1xxi n ALA 300 Cb 0.08 -1.03 0.97 0.00 0.00 0.00 0.00 19.45 19.47 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 3.78 1.44 -2.24 0.00 0.00 -1.56 -3.41 119.26 117.27 1xxi h ALA 301 Ca 0.00 -0.00 -0.55 0.00 0.00 0.00 0.00 54.91 54.36 1xxi h ALA 301 Cb 0.59 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1xxi h ALA 301 CO 0.00 -0.10 1.08 -0.51 0.00 0.00 0.00 179.25 179.72 1xxi s LEU 302 N -7.10 4.29 0.00 0.00 1.43 -1.26 -4.91 118.68 111.12 1xxi s LEU 302 Ca -0.05 2.17 0.00 0.00 -1.03 0.00 0.00 54.13 55.22 1xxi s LEU 302 Cb 0.14 -3.53 0.00 0.00 0.03 0.00 0.00 46.19 42.83 1xxi s LEU 302 CO 0.49 -0.94 0.00 0.61 0.23 0.00 0.00 176.35 176.74 1xxi n GLY 303 N 4.13 0.83 0.00 -3.19 0.00 -1.26 -4.97 105.19 100.73 1xxi n GLY 303 Ca 0.17 -0.94 0.00 0.00 0.00 0.00 0.00 46.02 45.25 1xxi n GLY 303 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1xxi n ASN 304 N 0.00 0.00 -0.05 1.61 3.02 -1.26 -4.20 115.26 114.38 1xxi n ASN 304 Ca 0.00 0.15 0.15 0.00 -0.03 0.00 0.00 54.58 54.84 1xxi n ASN 304 Cb 0.00 -0.05 0.73 0.00 -0.61 0.00 0.00 39.78 39.85 1xxi n ASN 304 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1xxi n ASP 305 N -0.66 0.18 0.00 6.41 4.64 -1.26 -2.98 116.55 122.88 1xxi n ASP 305 Ca 0.00 -0.44 0.02 0.00 -1.38 0.00 0.00 54.79 52.99 1xxi n ASP 305 Cb 0.00 -0.16 0.12 0.00 -1.04 0.00 0.00 41.12 40.04 1xxi n ASP 305 CO 0.00 0.00 0.00 0.80 -0.82 0.00 0.00 177.20 177.18 1xxi n MET 306 N -1.11 0.63 0.24 -0.67 1.56 -1.26 -2.58 117.12 113.93 1xxi n MET 306 Ca 0.16 0.00 0.10 0.00 -0.27 0.00 0.00 57.70 57.69 1xxi n MET 306 Cb 0.24 -1.10 0.57 0.00 2.15 0.00 0.00 33.22 35.07 1xxi n MET 306 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1xxi h ALA 307 N 2.46 1.16 -0.15 -5.12 0.00 -1.70 -1.70 119.26 114.21 1xxi h ALA 307 Ca 0.00 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.67 1xxi h ALA 307 Cb 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1xxi h ALA 307 CO 0.00 0.25 -0.17 0.00 0.00 0.00 0.00 179.25 179.33 1xxi h ALA 308 N 1.80 1.45 0.01 0.00 0.00 -1.80 -3.08 119.26 117.64 1xxi h ALA 308 Ca -0.00 -0.23 -0.34 0.00 0.00 0.00 0.00 54.91 54.34 1xxi h ALA 308 Cb 0.56 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.21 1xxi h ALA 308 CO 0.03 0.39 -2.06 -0.89 0.00 0.00 0.00 179.25 176.71 1xxi n ILE 309 N -4.24 1.53 0.00 0.00 5.41 -0.88 -4.76 119.36 116.43 1xxi n ILE 309 Ca -0.01 -0.79 0.00 0.00 1.00 0.00 0.00 62.75 62.95 1xxi n ILE 309 Cb 0.30 -0.92 0.00 0.00 -0.71 0.00 0.00 39.64 38.31 1xxi n ILE 309 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 1xxi n GLU 310 N -2.99 0.00 0.07 0.38 4.07 -0.69 0.12 120.64 121.59 1xxi n GLU 310 Ca -0.27 0.00 -0.12 0.00 -0.06 0.00 0.00 57.16 56.71 1xxi n GLU 310 Cb 1.09 0.00 -0.05 0.00 -0.06 0.00 0.00 31.44 32.42 1xxi n GLU 310 CO 0.00 0.00 0.00 1.25 -0.06 0.00 0.00 177.13 178.32 1xxi h LEU 311 N 0.00 -0.74 -0.37 4.31 5.85 -1.85 0.15 115.31 122.66 1xxi h LEU 311 Ca 0.00 0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.80 1xxi h LEU 311 Cb 0.00 0.30 -0.02 0.00 0.37 0.00 0.00 40.66 41.31 1xxi h LEU 311 CO 0.00 -0.33 0.17 0.03 -0.34 0.00 0.00 178.44 177.98 1xxi h ARG 312 N -0.41 0.54 -0.08 1.25 3.08 0.50 0.54 114.38 119.79 1xxi h ARG 312 Ca 0.05 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 60.02 1xxi h ARG 312 Cb 0.48 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.42 1xxi h ARG 312 CO -0.20 0.49 0.04 0.52 -1.07 0.00 0.00 179.97 179.75 1xxi h MET 313 N 0.46 0.09 -0.23 0.04 2.86 -1.18 -2.55 114.93 114.42 1xxi h MET 313 Ca 0.13 -0.01 -0.08 0.00 -2.06 0.00 0.00 59.70 57.69 1xxi h MET 313 Cb 0.13 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.76 1xxi h MET 313 CO -0.02 0.06 -0.18 0.00 1.06 0.00 0.00 176.91 177.83 1xxi h ARG 314 N 0.09 0.40 -0.81 1.72 3.08 -0.55 -1.74 114.38 116.58 1xxi h ARG 314 Ca 0.03 -0.13 0.00 0.00 0.07 0.00 0.00 59.98 59.96 1xxi h ARG 314 Cb 0.01 -0.04 -0.04 0.00 0.08 0.00 0.00 29.97 29.98 1xxi h ARG 314 CO -0.02 0.58 0.51 0.93 -1.07 0.00 0.00 179.97 180.89 1xxi h GLU 315 N 0.37 1.08 -0.33 0.04 4.39 -0.66 -0.48 114.58 118.99 1xxi h GLU 315 Ca 0.06 -0.08 -0.11 0.00 0.34 0.00 0.00 59.36 59.58 1xxi h GLU 315 Cb 0.54 -0.23 -0.01 0.00 -0.10 0.00 0.00 28.75 28.95 1xxi h GLU 315 CO 0.04 0.74 -0.21 -0.07 -1.16 0.00 0.00 179.01 178.34 1xxi h LEU 316 N 1.10 0.75 -0.61 1.33 3.38 -0.98 -1.73 115.31 118.56 1xxi h LEU 316 Ca 0.29 -0.43 0.08 0.00 0.09 0.00 0.00 57.88 57.92 1xxi h LEU 316 Cb -0.08 -0.21 -0.07 0.00 0.09 0.00 0.00 40.66 40.40 1xxi h LEU 316 CO -0.06 1.02 0.26 0.00 0.09 0.00 0.00 178.44 179.75 1xxi h ALA 317 N 0.75 0.79 0.00 1.53 0.00 -0.45 0.89 119.26 122.77 1xxi h ALA 317 Ca 0.07 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1xxi h ALA 317 Cb 0.76 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1xxi h ALA 317 CO 0.06 -0.14 -0.12 0.07 0.00 0.00 0.00 179.25 179.12 1xxi h ARG 318 N 0.46 0.00 0.00 0.00 0.11 -1.03 -3.35 114.38 110.57 1xxi h ARG 318 Ca 0.30 0.00 -0.18 0.00 0.10 0.00 0.00 59.98 60.20 1xxi h ARG 318 Cb 0.33 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.37 1xxi h ARG 318 CO -0.27 0.00 -2.16 0.25 0.10 0.00 0.00 179.97 177.89 1xxi n THR 319 N -2.65 0.68 -4.12 0.08 -2.24 -0.42 -4.94 114.28 100.66 1xxi n THR 319 Ca 0.04 -0.66 -0.35 0.00 -2.27 0.00 0.00 64.05 60.81 1xxi n THR 319 Cb 0.48 -0.23 -0.09 0.00 -2.10 0.00 0.00 70.33 68.39 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 -2.98 4.69 0.21 2.28 1.01 0.17 -5.07 121.20 121.52 1xxi s ILE 320 Ca -0.09 -0.08 -0.32 0.00 0.00 0.00 0.00 60.65 60.16 1xxi s ILE 320 Cb 0.10 -3.06 -0.12 0.00 0.01 0.00 0.00 42.46 39.38 1xxi s ILE 320 CO 0.85 0.53 1.65 -2.65 0.00 0.00 0.00 174.94 175.31 1xxi n PRO 321 N 2.93 2.57 -0.35 2.79 -0.02 -1.26 -4.82 135.00 136.84 1xxi n PRO 321 Ca -0.18 0.92 0.01 0.00 -2.02 0.00 0.00 63.50 62.23 1xxi n PRO 321 Cb 0.53 -2.73 0.17 0.00 -0.02 0.00 0.00 33.50 31.45 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 6.05 1.18 -0.91 0.52 0.13 -1.97 0.25 132.00 137.24 1xxi h PRO 322 Ca -0.44 -0.07 0.18 0.00 -0.87 0.00 0.00 66.00 64.79 1xxi h PRO 322 Cb 1.22 -0.27 -0.11 0.00 0.13 0.00 0.00 31.00 31.98 1xxi h PRO 322 CO 0.90 0.78 0.48 1.15 -0.23 0.00 0.00 178.00 181.08 1xxi h THR 323 N 1.21 0.66 -0.11 1.56 2.02 -2.00 0.11 112.91 116.36 1xxi h THR 323 Ca 0.38 -0.21 -0.19 0.00 0.77 0.00 0.00 66.41 67.17 1xxi h THR 323 Cb 0.01 -0.00 0.01 0.00 -1.74 0.00 0.00 68.15 66.43 1xxi h THR 323 CO -0.12 0.11 -0.67 0.44 0.37 0.00 0.00 175.52 175.65 1xxi h ASP 324 N 0.61 0.77 -0.24 4.18 3.32 -1.46 -2.92 116.42 120.68 1xxi h ASP 324 Ca 0.52 -0.65 0.07 0.00 0.02 0.00 0.00 57.03 56.99 1xxi h ASP 324 Cb 0.83 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 40.14 1xxi h ASP 324 CO -0.41 1.31 0.18 0.40 -1.72 0.00 0.00 179.24 178.99 1xxi h ILE 325 N 0.30 0.88 -0.04 0.35 2.04 0.19 0.28 117.51 121.51 1xxi h ILE 325 Ca -0.05 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.77 1xxi h ILE 325 Cb 1.31 0.88 0.00 0.00 -0.74 0.00 0.00 36.82 38.27 1xxi h ILE 325 CO 0.14 0.00 -0.10 1.56 0.00 0.00 0.00 178.15 179.75 1xxi h GLN 326 N 0.00 0.14 -0.52 2.37 1.08 -1.16 -2.52 115.11 114.51 1xxi h GLN 326 Ca 0.12 -0.10 0.10 0.00 -1.45 0.00 0.00 58.65 57.32 1xxi h GLN 326 Cb 0.46 0.01 -0.10 0.00 -0.05 0.00 0.00 27.48 27.81 1xxi h GLN 326 CO -0.00 0.70 -0.14 1.25 -0.95 0.00 0.00 178.83 179.68 1xxi h LEU 327 N -0.39 -0.52 -0.74 1.46 5.85 -0.33 0.29 115.31 120.93 1xxi h LEU 327 Ca -0.00 0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.88 1xxi h LEU 327 Cb 0.70 0.34 -0.04 0.00 0.37 0.00 0.00 40.66 42.03 1xxi h LEU 327 CO 0.02 -0.18 0.48 1.88 -0.34 0.00 0.00 178.44 180.29 1xxi h TYR 328 N -0.01 0.95 -0.16 1.25 0.05 -1.01 -0.93 116.97 117.10 1xxi h TYR 328 Ca 0.25 0.01 0.00 0.00 0.05 0.00 0.00 58.73 59.05 1xxi h TYR 328 Cb 0.40 -0.32 -0.01 0.00 1.01 0.00 0.00 36.73 37.81 1xxi h TYR 328 CO -0.45 0.61 0.10 -0.92 -1.05 0.00 0.00 178.16 176.45 1xxi h TYR 329 N 1.01 0.20 0.39 4.88 3.20 -0.72 -0.96 116.97 124.96 1xxi h TYR 329 Ca 0.27 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.13 1xxi h TYR 329 Cb -0.09 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.11 1xxi h TYR 329 CO -0.02 0.13 -0.26 0.37 -1.64 0.00 0.00 178.16 176.75 1xxi h GLN 330 N 0.21 -0.60 -0.82 1.82 4.15 -0.71 0.65 115.11 119.81 1xxi h GLN 330 Ca 0.06 0.04 0.11 0.00 0.77 0.00 0.00 58.65 59.63 1xxi h GLN 330 Cb -0.02 0.14 -0.06 0.00 0.21 0.00 0.00 27.48 27.75 1xxi h GLN 330 CO -0.01 -0.40 0.53 1.15 -1.93 0.00 0.00 178.83 178.17 1xxi h THR 331 N -0.63 0.91 0.01 2.39 2.02 -1.00 -0.93 112.91 115.68 1xxi h THR 331 Ca -0.04 -0.24 -0.26 0.00 0.77 0.00 0.00 66.41 66.64 1xxi h THR 331 Cb 0.52 0.15 0.02 0.00 -1.74 0.00 0.00 68.15 67.10 1xxi h THR 331 CO 0.03 0.13 -1.04 -0.07 0.37 0.00 0.00 175.52 174.94 1xxi h LEU 332 N 0.70 0.90 0.26 2.58 3.38 -0.81 -2.60 115.31 119.72 1xxi h LEU 332 Ca 0.39 -0.74 0.01 0.00 0.09 0.00 0.00 57.88 57.62 1xxi h LEU 332 Cb 0.54 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.98 1xxi h LEU 332 CO -0.16 1.53 -0.45 0.25 0.09 0.00 0.00 178.44 179.71 1xxi h LEU 333 N 0.37 -1.28 -0.74 1.67 7.12 0.22 0.52 115.31 123.19 1xxi h LEU 333 Ca -0.13 0.13 0.15 0.00 0.13 0.00 0.00 57.88 58.15 1xxi h LEU 333 Cb 1.69 0.46 -0.14 0.00 -0.53 0.00 0.00 40.66 42.14 1xxi h LEU 333 CO 0.20 -0.55 -0.17 0.40 -0.13 0.00 0.00 178.44 178.19 1xxi h ILE 334 N -0.78 0.27 -1.01 4.05 2.04 -1.29 1.10 117.51 121.90 1xxi h ILE 334 Ca -0.01 -0.00 0.23 0.00 1.00 0.00 0.00 64.86 66.07 1xxi h ILE 334 Cb 0.74 0.26 -0.11 0.00 -0.74 0.00 0.00 36.82 36.98 1xxi h ILE 334 CO -0.17 0.00 0.62 1.23 0.00 0.00 0.00 178.15 179.83 1xxi h GLY 335 N 0.00 1.63 1.46 5.37 0.00 -0.56 0.47 103.07 111.45 1xxi h GLY 335 Ca 0.36 -0.30 -0.09 0.00 0.00 0.00 0.00 47.33 47.30 1xxi h GLY 335 CO -0.75 -0.13 -0.15 -0.09 0.00 0.00 0.00 176.54 175.41 1xxi h ARG 336 N 0.60 0.64 -0.04 4.80 2.43 0.29 -0.12 114.38 122.97 1xxi h ARG 336 Ca 0.60 -0.21 -0.01 0.00 -0.81 0.00 0.00 59.98 59.54 1xxi h ARG 336 Cb 1.16 -0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 30.66 1xxi h ARG 336 CO -0.38 0.77 -0.01 1.57 -1.51 0.00 0.00 179.97 180.40 1xxi h LYS 337 N 0.58 0.08 0.00 0.20 2.10 0.32 -2.94 116.57 116.91 1xxi h LYS 337 Ca 0.10 -0.03 0.00 0.00 -2.00 0.00 0.00 60.65 58.71 1xxi h LYS 337 Cb 0.59 -0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.91 1xxi h LYS 337 CO 0.04 0.44 0.00 0.39 -2.00 0.00 0.00 179.45 178.32 1xxi n GLU 338 N -4.84 0.04 -0.29 0.07 1.02 -0.85 -4.06 120.64 111.73 1xxi n GLU 338 Ca -0.07 0.15 0.11 0.00 -0.02 0.00 0.00 57.16 57.33 1xxi n GLU 338 Cb 0.22 -1.50 0.27 0.00 -0.02 0.00 0.00 31.44 30.41 1xxi n GLU 338 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1xxi h LEU 339 N 0.00 0.11 -0.34 -4.62 5.85 -0.82 0.32 115.31 115.80 1xxi h LEU 339 Ca 0.00 0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.89 1xxi h LEU 339 Cb 0.31 0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.55 1xxi h LEU 339 CO 0.00 -0.08 -0.10 -0.81 -0.34 0.00 0.00 178.44 177.11 1xxi n PRO 340 N -5.15 0.86 0.08 5.25 -0.04 -1.26 -3.34 135.00 131.40 1xxi n PRO 340 Ca 0.20 -0.34 -0.09 0.00 -0.04 0.00 0.00 63.50 63.23 1xxi n PRO 340 Cb 0.63 -1.49 -0.11 0.00 -0.04 0.00 0.00 33.50 32.48 1xxi n PRO 340 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 1xxi h TYR 341 N 0.83 0.15 -3.87 0.54 -1.99 -0.64 -3.46 116.97 108.54 1xxi h TYR 341 Ca 0.00 -0.11 -0.53 0.00 2.00 0.00 0.00 58.73 60.10 1xxi h TYR 341 Cb 0.36 -0.01 0.08 0.00 2.00 0.00 0.00 36.73 39.16 1xxi h TYR 341 CO 0.00 1.06 0.68 0.00 -0.00 0.00 0.00 178.16 179.91 1xxi s ALA 342 N -2.75 3.53 0.57 3.88 0.00 -0.87 -4.91 121.76 121.20 1xxi s ALA 342 Ca -0.01 1.35 0.30 0.00 0.00 0.00 0.00 51.96 53.60 1xxi s ALA 342 Cb 0.09 -3.52 1.46 0.00 0.00 0.00 0.00 23.12 21.15 1xxi s ALA 342 CO 0.84 -0.76 1.87 -1.00 0.00 0.00 0.00 175.76 176.71 1xxi h PRO 343 N 3.38 0.00 -2.63 0.00 0.13 -1.89 -3.40 132.00 127.59 1xxi h PRO 343 Ca -0.49 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.53 1xxi h PRO 343 Cb 1.23 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 32.12 1xxi h PRO 343 CO 0.66 0.00 -0.21 0.34 -0.23 0.00 0.00 178.00 178.56 1xxi s ASP 344 N -5.33 -0.49 0.45 1.44 -1.08 -1.26 -5.06 116.67 105.33 1xxi s ASP 344 Ca -0.04 0.92 0.15 0.00 -0.52 0.00 0.00 52.55 53.05 1xxi s ASP 344 Cb 0.18 0.90 1.07 0.00 -1.46 0.00 0.00 42.92 43.61 1xxi s ASP 344 CO 0.64 -0.17 2.01 0.03 0.52 0.00 0.00 175.17 178.20 1xxi h ARG 345 N 5.87 0.33 -0.12 4.34 3.08 -1.82 -1.50 114.38 124.55 1xxi h ARG 345 Ca -0.29 -0.02 -0.14 0.00 0.07 0.00 0.00 59.98 59.60 1xxi h ARG 345 Cb 1.18 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.16 1xxi h ARG 345 CO 0.24 0.22 -0.46 -0.09 -1.07 0.00 0.00 179.97 178.81 1xxi h ARG 346 N 0.34 0.53 0.00 0.04 2.43 -1.96 -2.39 114.38 113.37 1xxi h ARG 346 Ca 0.23 -0.40 -0.01 0.00 -0.81 0.00 0.00 59.98 58.99 1xxi h ARG 346 Cb 0.48 0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 30.10 1xxi h ARG 346 CO -0.06 1.03 -0.05 1.98 -1.51 0.00 0.00 179.97 181.36 1xxi h MET 347 N 0.14 0.00 -0.13 0.20 4.05 -1.84 0.27 114.93 117.63 1xxi h MET 347 Ca -0.02 0.00 -0.06 0.00 -0.28 0.00 0.00 59.70 59.34 1xxi h MET 347 Cb 1.09 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 31.89 1xxi h MET 347 CO 0.10 0.05 -0.14 0.78 0.23 0.00 0.00 176.91 177.93 1xxi h GLY 348 N 0.89 0.35 1.54 1.39 0.00 -0.98 0.05 103.07 106.31 1xxi h GLY 348 Ca -0.00 -0.36 -0.08 0.00 0.00 0.00 0.00 47.33 46.89 1xxi h GLY 348 CO 0.01 0.33 -0.12 -2.08 0.00 0.00 0.00 176.54 174.67 1xxi h VAL 349 N -0.07 1.24 -0.38 4.60 2.07 -0.51 -2.16 116.25 121.04 1xxi h VAL 349 Ca 0.02 -1.05 -0.16 0.00 0.82 0.00 0.00 66.70 66.33 1xxi h VAL 349 Cb 0.67 1.13 -0.01 0.00 -1.52 0.00 0.00 31.29 31.56 1xxi h VAL 349 CO 0.03 0.35 -0.38 -0.33 0.02 0.00 0.00 177.57 177.26 1xxi h GLU 350 N 0.51 0.92 -0.42 1.57 5.08 -0.50 -2.14 114.58 119.61 1xxi h GLU 350 Ca 0.09 -0.49 0.08 0.00 -1.00 0.00 0.00 59.36 58.04 1xxi h GLU 350 Cb 0.51 0.02 -0.07 0.00 0.50 0.00 0.00 28.75 29.72 1xxi h GLU 350 CO 0.03 1.14 -0.00 0.52 -1.00 0.00 0.00 179.01 179.70 1xxi h MET 351 N 0.73 0.10 0.59 2.33 2.86 -0.55 -1.14 114.93 119.85 1xxi h MET 351 Ca 0.06 -0.01 -0.03 0.00 -2.06 0.00 0.00 59.70 57.66 1xxi h MET 351 Cb 0.97 -0.02 0.01 0.00 0.06 0.00 0.00 31.60 32.61 1xxi h MET 351 CO 0.09 0.07 -0.28 1.15 1.06 0.00 0.00 176.91 179.00 1xxi h THR 352 N 0.11 0.24 -0.63 2.22 2.02 -1.30 -2.41 112.91 113.15 1xxi h THR 352 Ca 0.21 -0.36 -0.01 0.00 0.77 0.00 0.00 66.41 67.01 1xxi h THR 352 Cb 0.29 0.33 -0.03 0.00 -1.74 0.00 0.00 68.15 67.00 1xxi h THR 352 CO -0.34 0.03 0.34 -0.07 0.37 0.00 0.00 175.52 175.85 1xxi h LEU 353 N -1.07 0.78 -1.46 2.58 3.38 -1.34 -0.01 115.31 118.18 1xxi h LEU 353 Ca -0.08 -0.06 -0.06 0.00 0.09 0.00 0.00 57.88 57.77 1xxi h LEU 353 Cb 0.66 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 1xxi h LEU 353 CO 0.13 0.64 -0.28 -0.07 0.09 0.00 0.00 178.44 178.95 1xxi h LEU 354 N 0.88 0.00 -0.64 1.67 3.38 -1.26 -2.29 115.31 117.05 1xxi h LEU 354 Ca 0.22 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.11 1xxi h LEU 354 Cb 0.03 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 1xxi h LEU 354 CO -0.04 0.28 0.09 -0.09 0.09 0.00 0.00 178.44 178.77 1xxi h ARG 355 N 0.00 1.07 0.00 1.13 9.65 -0.51 -1.42 114.38 124.30 1xxi h ARG 355 Ca -0.00 -0.30 -0.03 0.00 -1.10 0.00 0.00 59.98 58.55 1xxi h ARG 355 Cb 0.51 -0.12 -0.00 0.00 -1.39 0.00 0.00 29.97 28.97 1xxi h ARG 355 CO 0.04 1.00 -0.14 0.00 2.80 0.00 0.00 179.97 183.66 1xxi h ALA 356 N 1.03 0.96 -0.03 2.80 0.00 -0.80 -2.29 119.26 120.93 1xxi h ALA 356 Ca 0.19 -0.13 -0.19 0.00 0.00 0.00 0.00 54.91 54.79 1xxi h ALA 356 Cb 0.46 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.24 1xxi h ALA 356 CO 0.02 0.18 -0.71 -0.07 0.00 0.00 0.00 179.25 178.66 1xxi h LEU 357 N 0.00 0.68 0.45 0.00 4.07 -0.90 -3.31 115.31 116.29 1xxi h LEU 357 Ca -0.00 -0.73 -0.02 0.00 0.08 0.00 0.00 57.88 57.21 1xxi h LEU 357 Cb 0.84 -0.20 0.00 0.00 1.08 0.00 0.00 40.66 42.38 1xxi h LEU 357 CO 0.02 1.31 -0.22 0.00 -1.08 0.00 0.00 178.44 178.47 1xxi h ALA 358 N 0.38 -0.60 0.00 1.53 0.00 -1.25 -3.32 119.26 115.99 1xxi h ALA 358 Ca -0.08 -0.14 -0.39 0.00 0.00 0.00 0.00 54.91 54.30 1xxi h ALA 358 Cb 1.39 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 19.41 1xxi h ALA 358 CO 0.14 -0.57 1.95 1.19 0.00 0.00 0.00 179.25 181.96 1xxi n PHE 359 N -5.18 1.19 -3.94 0.00 3.01 -0.87 -4.55 117.46 107.12 1xxi n PHE 359 Ca -0.08 -2.04 -0.35 0.00 1.01 0.00 0.00 57.45 56.00 1xxi n PHE 359 Cb 0.25 -1.82 -0.14 0.00 -0.01 0.00 0.00 39.48 37.76 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 2.25 3.19 -0.04 1.38 2.46 -1.25 -4.83 115.29 118.45 1xxi s HIS 360 Ca 0.55 -1.78 -0.30 0.00 0.47 0.00 0.00 55.06 53.99 1xxi s HIS 360 Cb 0.18 -2.08 -0.06 0.00 -0.13 0.00 0.00 32.58 30.50 1xxi s HIS 360 CO -0.03 -0.78 1.70 -1.25 -2.47 0.00 0.00 174.74 171.91 1xxi s PRO 361 N 1.27 4.17 -0.08 2.88 0.04 -1.26 -1.89 135.00 140.13 1xxi s PRO 361 Ca -0.04 2.24 -0.00 0.00 0.04 0.00 0.00 61.00 63.25 1xxi s PRO 361 Cb -0.19 -4.01 0.00 0.00 0.04 0.00 0.00 34.50 30.34 1xxi s PRO 361 CO -0.02 -0.87 0.07 0.54 0.04 0.00 0.00 177.00 176.75 1xxi n ARG 362 N 7.20 -0.45 -2.61 4.56 1.74 -1.26 -5.09 116.66 120.75 1xxi n ARG 362 Ca 0.18 0.05 -0.06 0.00 -0.77 0.00 0.00 57.85 57.25 1xxi n ARG 362 Cb 0.43 -2.70 -0.02 0.00 -1.02 0.00 0.00 32.46 29.14 1xxi n ARG 362 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 1xxi n MET 363 N -0.95 0.67 -0.60 5.56 2.81 -0.79 -5.01 117.12 118.80 1xxi n MET 363 Ca -0.01 -0.88 -0.24 0.00 -1.81 0.00 0.00 57.70 54.76 1xxi n MET 363 Cb 0.51 0.54 -0.03 0.00 -0.71 0.00 0.00 33.22 33.52 1xxi n MET 363 CO 0.00 0.00 0.00 -0.35 1.51 0.00 0.00 175.97 177.13 1xxi n PRO 364 N -0.22 0.00 -4.51 0.03 -0.04 -1.26 -4.97 135.00 124.04 1xxi n PRO 364 Ca -0.01 0.00 -0.25 0.00 -0.04 0.00 0.00 63.50 63.20 1xxi n PRO 364 Cb 0.16 -0.57 -0.10 0.00 -0.04 0.00 0.00 33.50 32.95 1xxi n PRO 364 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1xxi s LEU 365 N 0.38 2.71 0.48 1.53 1.43 -1.26 -4.88 118.68 119.06 1xxi s LEU 365 Ca 0.36 -1.13 -0.01 0.00 -1.03 0.00 0.00 54.13 52.32 1xxi s LEU 365 Cb -0.51 -1.06 -0.00 0.00 0.03 0.00 0.00 46.19 44.65 1xxi s LEU 365 CO 0.25 -0.12 0.72 -2.16 0.23 0.00 0.00 176.35 175.26 1xxi s PRO 366 N -3.58 3.09 0.29 1.29 0.04 -1.26 -5.14 135.00 129.73 1xxi s PRO 366 Ca 0.32 -0.33 -0.17 0.00 0.04 0.00 0.00 61.00 60.86 1xxi s PRO 366 Cb -0.00 -2.49 0.02 0.00 0.04 0.00 0.00 34.50 32.07 1xxi s PRO 366 CO 0.16 -0.33 0.65 -1.21 0.04 0.00 0.00 177.00 176.31 1xxi s GLU 367 N -4.65 1.81 0.00 4.56 2.02 -1.26 -5.32 118.70 115.86 1xxi s GLU 367 Ca 0.49 -1.19 0.21 0.00 0.02 0.00 0.00 54.97 54.50 1xxi s GLU 367 Cb -0.10 0.57 1.23 0.00 0.10 0.00 0.00 34.13 35.93 1xxi s GLU 367 CO 0.40 -0.81 1.62 -0.35 0.02 0.00 0.00 175.26 176.13