#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qmo s HIS 0 N 0.00 1.76 -0.30 1.61 4.02 -1.24 -5.00 115.29 116.15 2qmo s HIS 0 Ca 0.00 -1.39 -0.19 0.00 1.02 0.00 0.00 55.06 54.50 2qmo s HIS 0 Cb 0.00 -1.03 0.18 0.00 -1.02 0.00 0.00 32.58 30.71 2qmo s HIS 0 CO 0.00 -0.45 1.26 -1.17 1.02 0.00 0.00 174.74 175.40 2qmo s LEU 2 N -3.54 -0.06 0.27 0.89 2.96 -0.20 -1.41 118.68 117.59 2qmo s LEU 2 Ca 0.28 0.06 -0.29 0.00 -0.22 0.00 0.00 54.13 53.96 2qmo s LEU 2 Cb 0.02 1.06 -0.09 0.00 0.50 0.00 0.00 46.19 47.68 2qmo s LEU 2 CO 0.18 -0.01 0.97 0.12 -1.32 0.00 0.00 176.35 176.29 2qmo s PHE 3 N 2.55 3.81 -0.13 5.38 5.36 0.51 -0.89 117.98 134.57 2qmo s PHE 3 Ca -0.05 1.84 0.02 0.00 -0.96 0.00 0.00 56.93 57.77 2qmo s PHE 3 Cb -0.05 -3.03 0.01 0.00 -0.34 0.00 0.00 43.02 39.62 2qmo s PHE 3 CO -0.11 0.17 -0.18 0.42 -1.46 0.00 0.00 175.22 174.05 2qmo s ILE 4 N -1.30 1.80 0.44 3.12 1.01 0.28 -0.05 121.20 126.49 2qmo s ILE 4 Ca 0.45 -0.81 0.03 0.00 0.00 0.00 0.00 60.65 60.32 2qmo s ILE 4 Cb -0.25 -1.62 -0.02 0.00 0.01 0.00 0.00 42.46 40.58 2qmo s ILE 4 CO 0.31 0.50 0.10 -0.44 0.00 0.00 0.00 174.94 175.42 2qmo s SER 5 N 1.02 3.15 0.06 3.58 0.01 -0.58 -0.95 113.70 119.99 2qmo s SER 5 Ca -0.04 -1.69 0.01 0.00 1.31 0.00 0.00 55.95 55.54 2qmo s SER 5 Cb -0.15 0.55 -0.03 0.00 0.21 0.00 0.00 66.02 66.60 2qmo s SER 5 CO -0.04 -0.94 -0.06 0.00 0.41 0.00 0.00 173.24 172.61 2qmo s ALA 6 N -3.12 0.67 0.24 1.44 0.00 -1.26 -0.10 121.76 119.64 2qmo s ALA 6 Ca 0.19 -1.01 -0.03 0.00 0.00 0.00 0.00 51.96 51.10 2qmo s ALA 6 Cb 0.02 0.12 0.28 0.00 0.00 0.00 0.00 23.12 23.54 2qmo s ALA 6 CO 0.12 -0.15 1.71 1.79 0.00 0.00 0.00 175.76 179.23 2qmo h THR 7 N 3.80 1.25 -3.31 0.00 1.35 -1.27 -3.41 112.91 111.32 2qmo h THR 7 Ca -0.35 -1.11 -0.00 0.00 -0.55 0.00 0.00 66.41 64.40 2qmo h THR 7 Cb 1.18 0.97 -0.08 0.00 -1.73 0.00 0.00 68.15 68.49 2qmo h THR 7 CO 0.52 0.38 0.05 0.20 -0.25 0.00 0.00 175.52 176.43 2qmo s ASN 8 N -6.67 -0.21 0.30 5.36 -0.87 -1.26 -4.99 114.94 106.59 2qmo s ASN 8 Ca -0.09 -0.65 0.25 0.00 -1.57 0.00 0.00 52.86 50.79 2qmo s ASN 8 Cb 0.14 0.63 1.03 0.00 -0.02 0.00 0.00 41.25 43.03 2qmo s ASN 8 CO 0.82 -1.17 1.75 0.74 -2.57 0.00 0.00 177.10 176.67 2qmo h THR 9 N 2.15 0.00 -0.42 1.60 2.02 -1.90 -2.51 112.91 113.85 2qmo h THR 9 Ca -0.25 -0.28 0.00 0.00 0.77 0.00 0.00 66.41 66.65 2qmo h THR 9 Cb 1.26 1.06 0.00 0.00 -1.74 0.00 0.00 68.15 68.73 2qmo h THR 9 CO 0.32 0.00 0.00 -0.46 0.37 0.00 0.00 175.52 175.75 2qmo n ASN 10 N -2.37 4.30 0.10 4.18 6.94 -1.26 -4.58 115.26 122.57 2qmo n ASN 10 Ca 0.02 -2.62 0.03 0.00 -0.02 0.00 0.00 54.58 51.99 2qmo n ASN 10 Cb 0.25 -0.62 -0.01 0.00 -2.36 0.00 0.00 39.78 37.04 2qmo n ASN 10 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2qmo h ALA 11 N 3.48 0.66 -0.71 -2.53 0.00 -1.79 -3.44 119.26 114.93 2qmo h ALA 11 Ca 0.00 -0.52 -0.03 0.00 0.00 0.00 0.00 54.91 54.36 2qmo h ALA 11 Cb 1.51 0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.38 2qmo h ALA 11 CO 0.33 0.61 -0.05 0.41 0.00 0.00 0.00 179.25 180.55 2qmo n GLY 12 N 1.28 0.51 0.36 0.00 0.00 -1.26 -4.51 105.19 101.56 2qmo n GLY 12 Ca -0.03 -0.73 0.07 0.00 0.00 0.00 0.00 46.02 45.33 2qmo n GLY 12 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2qmo h LYS 13 N -0.09 0.75 -0.57 1.61 2.10 -1.91 -2.79 116.57 115.67 2qmo h LYS 13 Ca -0.04 -0.05 -0.04 0.00 -2.00 0.00 0.00 60.65 58.52 2qmo h LYS 13 Cb 1.03 -0.17 -0.02 0.00 -0.90 0.00 0.00 32.23 32.17 2qmo h LYS 13 CO 0.05 0.50 0.19 1.15 -2.00 0.00 0.00 179.45 179.34 2qmo h THR 14 N 0.78 1.23 -0.29 0.07 2.02 -1.99 0.13 112.91 114.86 2qmo h THR 14 Ca 0.34 -0.77 -0.06 0.00 0.77 0.00 0.00 66.41 66.69 2qmo h THR 14 Cb 0.32 0.67 -0.02 0.00 -1.74 0.00 0.00 68.15 67.38 2qmo h THR 14 CO -0.12 0.29 -0.09 0.00 0.37 0.00 0.00 175.52 175.97 2qmo h THR 15 N 0.79 1.22 -0.18 3.16 1.03 -1.94 -0.98 112.91 116.01 2qmo h THR 15 Ca 0.18 -0.93 -0.06 0.00 -0.01 0.00 0.00 66.41 65.59 2qmo h THR 15 Cb 0.26 1.09 -0.00 0.00 -1.07 0.00 0.00 68.15 68.42 2qmo h THR 15 CO -0.01 0.31 -0.14 0.00 -0.01 0.00 0.00 175.52 175.66 2qmo h ALA 17 N 0.65 0.97 -0.53 0.00 0.00 -0.56 0.10 119.26 119.89 2qmo h ALA 17 Ca 0.03 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 2qmo h ALA 17 Cb 0.66 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 2qmo h ALA 17 CO 0.04 -0.00 0.01 0.00 0.00 0.00 0.00 179.25 179.29 2qmo h ARG 18 N 0.65 0.93 -0.59 0.00 3.08 -1.13 -0.83 114.38 116.49 2qmo h ARG 18 Ca 0.34 -0.29 -0.04 0.00 0.07 0.00 0.00 59.98 60.06 2qmo h ARG 18 Cb 0.31 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.25 2qmo h ARG 18 CO -0.24 0.94 0.22 -0.07 -1.07 0.00 0.00 179.97 179.75 2qmo h LEU 19 N 0.80 0.83 -0.38 3.04 3.38 -0.76 -0.00 115.31 122.22 2qmo h LEU 19 Ca 0.15 -0.18 -0.07 0.00 0.09 0.00 0.00 57.88 57.87 2qmo h LEU 19 Cb 0.52 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 2qmo h LEU 19 CO 0.03 0.79 -0.03 0.25 0.09 0.00 0.00 178.44 179.57 2qmo h LEU 20 N 0.82 0.68 -0.99 1.67 5.85 -0.58 -1.15 115.31 121.62 2qmo h LEU 20 Ca 0.19 -0.33 -0.07 0.00 0.84 0.00 0.00 57.88 58.52 2qmo h LEU 20 Cb 0.23 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.06 2qmo h LEU 20 CO -0.01 0.84 0.00 0.00 -0.34 0.00 0.00 178.44 178.93 2qmo h ALA 21 N 0.86 1.16 -0.52 1.25 0.00 -1.04 0.26 119.26 121.22 2qmo h ALA 21 Ca 0.10 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 2qmo h ALA 21 Cb 0.51 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 2qmo h ALA 21 CO 0.02 0.54 0.31 0.37 0.00 0.00 0.00 179.25 180.50 2qmo h GLN 22 N 0.69 0.71 -0.21 0.00 4.15 -0.80 0.50 115.11 120.15 2qmo h GLN 22 Ca 0.14 -0.07 -0.02 0.00 0.77 0.00 0.00 58.65 59.47 2qmo h GLN 22 Cb 0.42 -0.15 -0.01 0.00 0.21 0.00 0.00 27.48 27.95 2qmo h GLN 22 CO 0.02 0.52 0.05 -0.92 -1.93 0.00 0.00 178.83 176.57 2qmo h TYR 23 N 0.70 0.36 0.02 3.99 3.20 -0.76 -0.80 116.97 123.68 2qmo h TYR 23 Ca 0.19 -0.04 0.01 0.00 3.14 0.00 0.00 58.73 62.02 2qmo h TYR 23 Cb -0.01 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.15 2qmo h TYR 23 CO -0.03 0.45 -0.06 0.00 -1.64 0.00 0.00 178.16 176.89 2qmo h ASN 25 N -0.11 0.59 0.51 0.00 2.35 -0.66 0.48 115.58 118.74 2qmo h ASN 25 Ca 0.02 0.07 -0.05 0.00 -0.55 0.00 0.00 56.30 55.79 2qmo h ASN 25 Cb 0.13 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.46 2qmo h ASN 25 CO -0.04 0.29 -0.24 0.00 -1.65 0.00 0.00 177.43 175.79 2qmo h ALA 26 N 1.52 1.24 -0.20 -0.83 0.00 -0.62 -1.61 119.26 118.77 2qmo h ALA 26 Ca 0.44 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 55.13 2qmo h ALA 26 Cb 0.54 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2qmo h ALA 26 CO -0.32 0.30 0.00 0.00 0.00 0.00 0.00 179.25 179.24 2qmo n GLY 28 N 1.05 0.46 3.41 0.00 0.00 -0.60 -5.02 105.19 104.49 2qmo n GLY 28 Ca 0.14 -0.36 -0.44 0.00 0.00 0.00 0.00 46.02 45.35 2qmo n GLY 28 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qmo s VAL 29 N -2.00 5.05 -0.32 1.61 1.01 0.06 -4.99 120.40 120.82 2qmo s VAL 29 Ca 0.00 -0.81 -0.29 0.00 0.00 0.00 0.00 61.98 60.89 2qmo s VAL 29 Cb 0.00 -4.23 0.00 0.00 0.00 0.00 0.00 36.38 32.15 2qmo s VAL 29 CO 0.00 -0.72 1.35 -0.75 0.00 0.00 0.00 175.10 174.98 2qmo s LYS 30 N 2.15 3.83 -0.06 2.72 2.20 -1.26 -2.65 119.74 126.67 2qmo s LYS 30 Ca 0.09 1.21 0.03 0.00 -0.36 0.00 0.00 55.97 56.94 2qmo s LYS 30 Cb -0.22 -3.92 0.01 0.00 -1.51 0.00 0.00 37.83 32.19 2qmo s LYS 30 CO 0.09 -1.23 -0.13 0.99 -0.36 0.00 0.00 175.35 174.71 2qmo s THR 31 N 4.65 1.20 0.08 3.43 2.01 -1.26 -0.17 115.64 125.58 2qmo s THR 31 Ca 0.58 -0.53 0.05 0.00 0.31 0.00 0.00 61.69 62.11 2qmo s THR 31 Cb -0.17 -1.08 -0.04 0.00 0.01 0.00 0.00 72.50 71.23 2qmo s THR 31 CO 0.26 0.37 -0.04 -0.51 -0.69 0.00 0.00 174.62 174.01 2qmo s ILE 32 N 0.53 3.80 -0.21 1.82 2.07 -0.70 -4.93 121.20 123.58 2qmo s ILE 32 Ca -0.13 -1.03 -0.04 0.00 -1.41 0.00 0.00 60.65 58.04 2qmo s ILE 32 Cb -0.15 -2.78 -0.02 0.00 0.13 0.00 0.00 42.46 39.64 2qmo s ILE 32 CO 0.04 0.15 -0.02 -0.76 -1.91 0.00 0.00 174.94 172.44 2qmo s LEU 33 N -2.17 3.07 0.07 8.50 1.43 -1.26 -0.82 118.68 127.50 2qmo s LEU 33 Ca 0.23 -0.30 0.10 0.00 -1.03 0.00 0.00 54.13 53.13 2qmo s LEU 33 Cb -0.11 -1.78 -0.03 0.00 0.03 0.00 0.00 46.19 44.29 2qmo s LEU 33 CO 0.16 0.02 -0.26 -0.76 0.23 0.00 0.00 176.35 175.74 2qmo s LEU 34 N 1.23 2.23 -0.52 1.79 1.43 0.46 -4.77 118.68 120.54 2qmo s LEU 34 Ca 0.03 -0.63 0.05 0.00 -1.03 0.00 0.00 54.13 52.55 2qmo s LEU 34 Cb -0.14 -1.28 0.19 0.00 0.03 0.00 0.00 46.19 44.99 2qmo s LEU 34 CO -0.00 0.24 0.46 1.17 0.23 0.00 0.00 176.35 178.45 2qmo n LYS 35 N 1.51 1.01 0.13 1.70 3.00 -0.42 -0.81 118.16 124.28 2qmo n LYS 35 Ca -0.17 -3.72 0.03 0.00 -0.00 0.00 0.00 58.31 54.45 2qmo n LYS 35 Cb 0.52 -1.83 0.42 0.00 0.00 0.00 0.00 35.03 34.14 2qmo n LYS 35 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.40 176.40 2qmo h PRO 36 N 5.11 0.22 -4.62 1.64 0.13 -1.71 -3.37 132.00 129.40 2qmo h PRO 36 Ca 0.19 -0.04 -0.55 0.00 -0.87 0.00 0.00 66.00 64.73 2qmo h PRO 36 Cb 0.83 -0.03 -0.34 0.00 0.13 0.00 0.00 31.00 31.59 2qmo h PRO 36 CO 0.54 0.33 -0.82 0.42 -0.23 0.00 0.00 178.00 178.23 2qmo s ILE 37 N -4.81 1.29 -0.01 -3.56 1.01 -1.26 -1.01 121.20 112.86 2qmo s ILE 37 Ca -0.05 -0.54 0.00 0.00 0.00 0.00 0.00 60.65 60.06 2qmo s ILE 37 Cb 0.16 -1.19 0.01 0.00 0.01 0.00 0.00 42.46 41.45 2qmo s ILE 37 CO 0.72 0.40 0.01 -0.70 0.00 0.00 0.00 174.94 175.37 2qmo s GLU 38 N 0.87 0.01 0.39 2.79 2.12 -0.08 -4.51 118.70 120.29 2qmo s GLU 38 Ca -0.10 0.07 0.08 0.00 0.36 0.00 0.00 54.97 55.37 2qmo s GLU 38 Cb -0.15 -0.12 -0.04 0.00 0.26 0.00 0.00 34.13 34.08 2qmo s GLU 38 CO 0.01 -0.06 0.23 0.95 -0.54 0.00 0.00 175.26 175.84 2qmo s THR 39 N 0.42 2.64 -0.86 -1.70 -4.23 -1.26 -1.35 115.64 109.29 2qmo s THR 39 Ca -0.04 -1.59 0.00 0.00 -1.18 0.00 0.00 61.69 58.88 2qmo s THR 39 Cb -0.05 -3.00 0.00 0.00 1.34 0.00 0.00 72.50 70.79 2qmo s THR 39 CO -0.01 -0.06 0.00 0.61 -0.54 0.00 0.00 174.62 174.62 2qmo n GLY 40 N -1.30 0.19 3.67 3.99 0.00 -0.09 -4.87 105.19 106.78 2qmo n GLY 40 Ca -0.00 -0.50 -0.23 0.00 0.00 0.00 0.00 46.02 45.28 2qmo n GLY 40 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2qmo s VAL 41 N -2.46 3.61 -0.37 1.61 -7.23 -0.25 -4.96 120.40 110.35 2qmo s VAL 41 Ca 0.00 -1.80 0.04 0.00 -1.81 0.00 0.00 61.98 58.41 2qmo s VAL 41 Cb 0.00 -2.92 0.16 0.00 0.56 0.00 0.00 36.38 34.18 2qmo s VAL 41 CO 0.00 -0.35 0.41 0.21 -0.31 0.00 0.00 175.10 175.07 2qmo s ASN 42 N -3.63 0.75 0.46 4.85 3.84 -1.26 -3.71 114.94 116.25 2qmo s ASN 42 Ca 0.31 -1.41 0.29 0.00 0.21 0.00 0.00 52.86 52.26 2qmo s ASN 42 Cb -0.07 0.78 0.95 0.00 -0.55 0.00 0.00 41.25 42.36 2qmo s ASN 42 CO 0.20 -0.25 1.82 0.44 -2.79 0.00 0.00 177.10 176.52 2qmo h ASP 43 N 7.11 0.00 0.43 -4.21 3.32 -1.99 -1.38 116.42 119.70 2qmo h ASP 43 Ca 0.04 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.04 2qmo h ASP 43 Cb 1.08 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.62 2qmo h ASP 43 CO 0.19 0.00 -0.26 0.00 -1.72 0.00 0.00 179.24 177.45 2qmo h ALA 44 N 2.06 1.33 0.00 3.45 0.00 -2.06 -3.38 119.26 120.65 2qmo h ALA 44 Ca 0.00 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 2qmo h ALA 44 Cb 0.68 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 2qmo h ALA 44 CO 0.00 0.32 -1.12 -0.89 0.00 0.00 0.00 179.25 177.57 2qmo n ILE 45 N -3.87 0.06 -3.73 0.00 2.08 -0.86 -5.00 119.36 108.04 2qmo n ILE 45 Ca -0.02 -0.07 -0.24 0.00 0.56 0.00 0.00 62.75 62.98 2qmo n ILE 45 Cb 0.34 -0.12 -0.17 0.00 -0.75 0.00 0.00 39.64 38.94 2qmo n ILE 45 CO 0.00 0.00 0.00 0.21 0.56 0.00 0.00 176.55 177.32 2qmo s ASN 46 N -2.66 2.03 -0.55 4.38 3.84 -0.57 -5.02 114.94 116.39 2qmo s ASN 46 Ca -0.01 -0.36 0.01 0.00 0.21 0.00 0.00 52.86 52.71 2qmo s ASN 46 Cb 0.01 -0.42 0.46 0.00 -0.55 0.00 0.00 41.25 40.75 2qmo s ASN 46 CO 0.09 -0.26 1.79 1.41 -2.79 0.00 0.00 177.10 177.34 2qmo n HIS 47 N 5.16 3.04 -0.93 0.43 8.25 -1.26 -4.43 115.22 125.47 2qmo n HIS 47 Ca -0.07 -2.74 0.05 0.00 -0.26 0.00 0.00 57.72 54.70 2qmo n HIS 47 Cb 0.49 -1.11 0.07 0.00 1.12 0.00 0.00 29.99 30.56 2qmo n HIS 47 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2qmo n SER 48 N -0.88 1.68 -4.56 0.41 7.64 -1.26 -4.68 113.62 111.97 2qmo n SER 48 Ca 0.57 -2.45 -0.28 0.00 1.01 0.00 0.00 58.87 57.72 2qmo n SER 48 Cb 0.79 -0.24 0.23 0.00 -1.01 0.00 0.00 64.21 63.97 2qmo n SER 48 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2qmo s SER 49 N -1.83 1.55 0.19 6.43 1.04 -1.26 -4.73 113.70 115.08 2qmo s SER 49 Ca 0.16 1.42 -0.13 0.00 0.48 0.00 0.00 55.95 57.88 2qmo s SER 49 Cb 0.14 -2.15 0.12 0.00 0.10 0.00 0.00 66.02 64.23 2qmo s SER 49 CO 0.01 -3.83 1.83 0.44 0.98 0.00 0.00 173.24 172.67 2qmo h ASP 50 N -2.37 0.57 -0.30 7.02 3.32 -1.97 -1.80 116.42 120.89 2qmo h ASP 50 Ca -0.59 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 56.42 2qmo h ASP 50 Cb 1.33 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 40.74 2qmo h ASP 50 CO 0.53 0.40 0.08 0.00 -1.72 0.00 0.00 179.24 178.52 2qmo h ALA 51 N 1.25 1.42 -0.57 3.45 0.00 -1.91 -0.09 119.26 122.80 2qmo h ALA 51 Ca 0.23 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 2qmo h ALA 51 Cb 0.01 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 2qmo h ALA 51 CO -0.10 0.42 0.11 0.45 0.00 0.00 0.00 179.25 180.13 2qmo h HIS 52 N 0.55 0.99 -0.39 0.00 3.86 -1.67 0.12 115.15 118.61 2qmo h HIS 52 Ca 0.13 -0.13 -0.04 0.00 -1.16 0.00 0.00 60.37 59.17 2qmo h HIS 52 Cb 0.24 -0.27 -0.02 0.00 1.06 0.00 0.00 27.41 28.42 2qmo h HIS 52 CO 0.01 0.86 0.11 -0.07 0.86 0.00 0.00 177.93 179.70 2qmo h LEU 53 N 0.84 0.59 -0.30 2.43 3.38 -0.89 -1.43 115.31 119.93 2qmo h LEU 53 Ca 0.18 -0.22 0.05 0.00 0.09 0.00 0.00 57.88 57.97 2qmo h LEU 53 Cb 0.39 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.95 2qmo h LEU 53 CO 0.01 0.65 0.04 -0.26 0.09 0.00 0.00 178.44 178.97 2qmo h PHE 54 N 0.49 0.06 -0.66 1.13 -1.00 -0.90 -2.36 116.94 113.71 2qmo h PHE 54 Ca 0.13 0.02 0.07 0.00 2.81 0.00 0.00 57.97 61.00 2qmo h PHE 54 Cb 0.29 0.02 -0.06 0.00 3.61 0.00 0.00 35.95 39.80 2qmo h PHE 54 CO 0.01 -0.01 0.34 1.25 -1.61 0.00 0.00 178.31 178.30 2qmo h LEU 55 N 0.14 0.47 -0.34 1.54 5.85 -0.45 0.27 115.31 122.78 2qmo h LEU 55 Ca 0.14 0.04 0.05 0.00 0.84 0.00 0.00 57.88 58.96 2qmo h LEU 55 Cb 0.16 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.11 2qmo h LEU 55 CO -0.20 0.29 0.06 -0.61 -0.34 0.00 0.00 178.44 177.64 2qmo h GLN 56 N 0.61 0.17 -0.37 1.25 4.15 -0.95 0.14 115.11 120.10 2qmo h GLN 56 Ca 0.31 -0.01 -0.07 0.00 0.77 0.00 0.00 58.65 59.65 2qmo h GLN 56 Cb 0.26 -0.04 -0.01 0.00 0.21 0.00 0.00 27.48 27.90 2qmo h GLN 56 CO -0.22 0.11 -0.05 -0.44 -1.93 0.00 0.00 178.83 176.30 2qmo h ASP 57 N 0.17 0.68 -0.16 -0.69 3.32 -0.84 -2.90 116.42 116.00 2qmo h ASP 57 Ca 0.16 -0.34 -0.03 0.00 0.02 0.00 0.00 57.03 56.84 2qmo h ASP 57 Cb 0.19 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 2qmo h ASP 57 CO -0.22 0.86 0.02 0.78 -1.72 0.00 0.00 179.24 178.96 2qmo h ASN 58 N 0.48 0.34 0.54 6.45 2.35 0.04 -2.72 115.58 123.06 2qmo h ASN 58 Ca 0.10 -0.05 0.00 0.00 -0.55 0.00 0.00 56.30 55.80 2qmo h ASN 58 Cb 0.54 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 38.82 2qmo h ASN 58 CO 0.03 0.39 0.00 0.54 -1.65 0.00 0.00 177.43 176.74 2qmo n ARG 59 N -4.35 0.05 0.02 0.81 1.74 0.42 -0.60 116.66 114.75 2qmo n ARG 59 Ca 0.01 0.30 0.08 0.00 -0.77 0.00 0.00 57.85 57.47 2qmo n ARG 59 Cb 0.19 -1.59 0.36 0.00 -1.02 0.00 0.00 32.46 30.40 2qmo n ARG 59 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2qmo n LEU 60 N -1.67 0.11 -0.03 0.55 4.77 -1.03 -3.26 117.00 116.44 2qmo n LEU 60 Ca 0.03 0.53 -0.03 0.00 -0.03 0.00 0.00 56.01 56.51 2qmo n LEU 60 Cb 0.18 -0.51 -0.06 0.00 -2.33 0.00 0.00 43.42 40.70 2qmo n LEU 60 CO 0.15 -0.28 -0.74 0.18 -1.33 0.00 0.00 177.39 175.37 2qmo n LEU 61 N -1.62 0.00 -3.15 2.23 4.77 0.23 -4.97 117.00 114.50 2qmo n LEU 61 Ca 0.04 0.00 0.04 0.00 -0.03 0.00 0.00 56.01 56.06 2qmo n LEU 61 Cb 0.19 0.17 -0.01 0.00 -2.33 0.00 0.00 43.42 41.45 2qmo n LEU 61 CO 0.16 0.17 0.18 -0.62 -1.33 0.00 0.00 177.39 175.94 2qmo s ASP 62 N -3.83 -1.38 0.55 -1.43 -1.08 -0.81 -5.04 116.67 103.65 2qmo s ASP 62 Ca -0.04 0.50 0.30 0.00 -0.52 0.00 0.00 52.55 52.79 2qmo s ASP 62 Cb 0.03 2.01 1.58 0.00 -1.46 0.00 0.00 42.92 45.08 2qmo s ASP 62 CO 0.34 -0.26 2.11 0.03 0.52 0.00 0.00 175.17 177.91 2qmo h ARG 63 N 7.96 0.00 -0.00 4.34 2.47 -1.85 -2.63 114.38 124.66 2qmo h ARG 63 Ca -0.12 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.60 2qmo h ARG 63 Cb 1.17 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.49 2qmo h ARG 63 CO 0.17 0.09 -0.03 -1.13 0.56 0.00 0.00 179.97 179.63 2qmo n SER 64 N -3.52 0.04 -4.76 7.04 3.41 -1.26 -4.85 113.62 109.71 2qmo n SER 64 Ca -0.02 0.31 -0.38 0.00 -0.26 0.00 0.00 58.87 58.52 2qmo n SER 64 Cb 0.22 -0.41 0.00 0.00 -0.26 0.00 0.00 64.21 63.76 2qmo n SER 64 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2qmo s LEU 65 N -2.90 4.04 0.34 1.04 1.43 -0.99 -5.04 118.68 116.60 2qmo s LEU 65 Ca 0.17 2.51 0.03 0.00 -1.03 0.00 0.00 54.13 55.81 2qmo s LEU 65 Cb 0.19 -4.14 -0.05 0.00 0.03 0.00 0.00 46.19 42.22 2qmo s LEU 65 CO 0.52 -1.03 0.07 0.42 0.23 0.00 0.00 176.35 176.57 2qmo s THR 66 N -1.40 1.02 0.21 5.49 -4.23 -1.26 -4.98 115.64 110.49 2qmo s THR 66 Ca 0.63 -2.00 -0.11 0.00 -1.18 0.00 0.00 61.69 59.03 2qmo s THR 66 Cb -0.34 -2.68 0.15 0.00 1.34 0.00 0.00 72.50 70.97 2qmo s THR 66 CO 0.42 0.00 1.88 0.25 -0.54 0.00 0.00 174.62 176.62 2qmo h LEU 67 N 2.05 0.84 -0.88 4.79 5.85 -1.95 -1.07 115.31 124.94 2qmo h LEU 67 Ca -0.40 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.30 2qmo h LEU 67 Cb 1.25 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 42.07 2qmo h LEU 67 CO 0.67 0.60 0.00 2.29 -0.34 0.00 0.00 178.44 181.66 2qmo n LYS 68 N -4.58 0.18 0.21 1.25 2.85 -1.26 -1.68 118.16 115.12 2qmo n LYS 68 Ca 0.07 0.48 0.13 0.00 -1.05 0.00 0.00 58.31 57.94 2qmo n LYS 68 Cb 0.02 -1.89 0.31 0.00 -0.65 0.00 0.00 35.03 32.82 2qmo n LYS 68 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 177.40 176.91 2qmo h ASP 69 N 0.00 0.00 0.00 -5.58 3.32 -1.60 -3.37 116.42 109.19 2qmo h ASP 69 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2qmo h ASP 69 Cb 0.27 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.82 2qmo h ASP 69 CO 0.00 0.00 0.00 2.30 -1.72 0.00 0.00 179.24 179.82 2qmo n ILE 70 N -2.93 0.00 -3.69 0.35 -5.35 -0.68 -5.02 119.36 102.04 2qmo n ILE 70 Ca 0.04 -0.37 -0.10 0.00 -0.27 0.00 0.00 62.75 62.04 2qmo n ILE 70 Cb 0.46 1.17 -0.11 0.00 -1.74 0.00 0.00 39.64 39.43 2qmo n ILE 70 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 2qmo s SER 71 N -0.25 -0.47 -0.00 7.28 0.15 -0.82 -1.30 113.70 118.30 2qmo s SER 71 Ca 0.00 0.89 0.00 0.00 0.70 0.00 0.00 55.95 57.55 2qmo s SER 71 Cb 0.00 0.83 -0.01 0.00 -1.71 0.00 0.00 66.02 65.13 2qmo s SER 71 CO 0.00 -0.20 0.01 0.49 1.20 0.00 0.00 173.24 174.74 2qmo n PHE 72 N 4.41 0.00 -3.73 3.44 3.72 -0.18 -4.36 117.46 120.76 2qmo n PHE 72 Ca -0.21 0.00 -0.28 0.00 -0.05 0.00 0.00 57.45 56.91 2qmo n PHE 72 Cb 0.54 -0.02 -0.16 0.00 -0.94 0.00 0.00 39.48 38.90 2qmo n PHE 72 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 176.76 177.42 2qmo s TYR 73 N -2.02 1.02 -0.07 1.38 2.02 -0.64 -5.04 117.35 114.00 2qmo s TYR 73 Ca -0.00 -0.87 0.02 0.00 -0.37 0.00 0.00 57.07 55.85 2qmo s TYR 73 Cb 0.00 -1.03 0.02 0.00 -0.40 0.00 0.00 41.96 40.55 2qmo s TYR 73 CO 0.02 -0.62 -0.09 1.03 -1.57 0.00 0.00 175.55 174.32 2qmo s ARG 74 N 1.86 1.41 0.05 -0.62 0.52 -1.26 -0.90 118.95 120.01 2qmo s ARG 74 Ca -0.01 -0.30 0.06 0.00 -0.52 0.00 0.00 55.73 54.97 2qmo s ARG 74 Cb -0.17 -1.26 -0.02 0.00 0.52 0.00 0.00 34.95 34.01 2qmo s ARG 74 CO -0.09 -0.05 -0.17 0.71 0.02 0.00 0.00 175.30 175.73 2qmo s TYR 75 N 0.89 1.51 0.13 -0.53 2.02 -0.46 -5.00 117.35 115.92 2qmo s TYR 75 Ca -0.11 -0.37 -0.10 0.00 -0.37 0.00 0.00 57.07 56.12 2qmo s TYR 75 Cb -0.15 -0.89 -0.06 0.00 -0.40 0.00 0.00 41.96 40.46 2qmo s TYR 75 CO 0.01 0.07 1.42 0.45 -1.57 0.00 0.00 175.55 175.93 2qmo h HIS 76 N 4.83 1.06 -4.01 2.71 3.86 -1.89 -0.23 115.15 121.48 2qmo h HIS 76 Ca -0.41 -0.38 -0.55 0.00 -1.16 0.00 0.00 60.37 57.88 2qmo h HIS 76 Cb 1.17 -0.20 0.13 0.00 1.06 0.00 0.00 27.41 29.57 2qmo h HIS 76 CO 0.53 1.20 0.66 0.21 0.86 0.00 0.00 177.93 181.39 2qmo s LYS 77 N -4.11 3.46 0.00 2.45 2.20 -1.26 -3.28 119.74 119.21 2qmo s LYS 77 Ca -0.10 2.34 0.30 0.00 -0.36 0.00 0.00 55.97 58.15 2qmo s LYS 77 Cb 0.10 -2.49 1.49 0.00 -1.51 0.00 0.00 37.83 35.42 2qmo s LYS 77 CO 0.89 -0.97 2.04 1.33 -0.36 0.00 0.00 175.35 178.28 2qmo n VAL 78 N -0.54 0.00 -1.10 4.02 0.24 -1.26 -0.91 118.33 118.79 2qmo n VAL 78 Ca 0.07 0.00 -0.30 0.00 -2.04 0.00 0.00 64.34 62.08 2qmo n VAL 78 Cb 0.43 -0.50 0.15 0.00 -1.47 0.00 0.00 33.84 32.45 2qmo n VAL 78 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 2qmo s SER 79 N -2.62 3.25 0.44 -1.34 0.01 -1.26 -4.77 113.70 107.42 2qmo s SER 79 Ca 0.27 1.58 -0.21 0.00 1.31 0.00 0.00 55.95 58.90 2qmo s SER 79 Cb 0.20 -2.24 -0.14 0.00 0.21 0.00 0.00 66.02 64.06 2qmo s SER 79 CO 0.47 -2.79 0.28 0.00 0.41 0.00 0.00 173.24 171.61 2qmo n ALA 80 N -3.99 -2.23 -0.34 1.44 0.00 -1.26 -4.51 120.51 109.62 2qmo n ALA 80 Ca 0.07 0.09 0.07 0.00 0.00 0.00 0.00 53.44 53.67 2qmo n ALA 80 Cb 0.55 -1.62 0.25 0.00 0.00 0.00 0.00 19.45 18.63 2qmo n ALA 80 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2qmo h PRO 81 N 0.44 0.95 -0.36 0.00 0.11 -1.91 -1.18 132.00 130.05 2qmo h PRO 81 Ca -0.40 -0.06 0.04 0.00 0.11 0.00 0.00 66.00 65.70 2qmo h PRO 81 Cb 1.42 -0.22 -0.04 0.00 0.11 0.00 0.00 31.00 32.28 2qmo h PRO 81 CO 0.48 0.63 0.12 1.25 -0.21 0.00 0.00 178.00 180.27 2qmo h LEU 82 N 0.98 0.12 -0.35 2.35 5.85 -1.36 0.77 115.31 123.67 2qmo h LEU 82 Ca 0.46 0.04 -0.09 0.00 0.84 0.00 0.00 57.88 59.13 2qmo h LEU 82 Cb 0.43 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.48 2qmo h LEU 82 CO -0.22 0.10 -0.14 0.40 -0.34 0.00 0.00 178.44 178.24 2qmo h ILE 83 N 0.26 1.28 -0.72 4.05 1.08 -1.59 -1.07 117.51 120.80 2qmo h ILE 83 Ca 0.17 -1.25 0.00 0.00 -0.39 0.00 0.00 64.86 63.39 2qmo h ILE 83 Cb 0.15 1.36 -0.04 0.00 -3.07 0.00 0.00 36.82 35.22 2qmo h ILE 83 CO -0.18 0.41 0.47 0.00 -0.69 0.00 0.00 178.15 178.16 2qmo h ALA 84 N 0.79 0.92 0.11 1.87 0.00 -0.89 -1.39 119.26 120.66 2qmo h ALA 84 Ca 0.08 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 2qmo h ALA 84 Cb 0.67 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.17 2qmo h ALA 84 CO 0.05 0.35 -0.05 0.37 0.00 0.00 0.00 179.25 179.97 2qmo h GLN 85 N 0.98 -0.14 -0.84 0.00 -0.00 -0.75 0.11 115.11 114.47 2qmo h GLN 85 Ca 0.26 0.01 0.04 0.00 -0.00 0.00 0.00 58.65 58.97 2qmo h GLN 85 Cb -0.09 0.03 -0.05 0.00 0.00 0.00 0.00 27.48 27.37 2qmo h GLN 85 CO -0.05 -0.01 0.55 1.96 0.00 0.00 0.00 178.83 181.28 2qmo h GLN 86 N -0.24 0.99 0.21 1.69 4.20 -0.90 0.23 115.11 121.29 2qmo h GLN 86 Ca -0.02 -0.06 -0.29 0.00 0.06 0.00 0.00 58.65 58.35 2qmo h GLN 86 Cb 0.20 -0.22 0.03 0.00 0.30 0.00 0.00 27.48 27.78 2qmo h GLN 86 CO 0.02 0.65 -1.29 0.93 -0.67 0.00 0.00 178.83 178.48 2qmo h GLU 87 N 1.02 0.44 0.01 1.46 5.08 -1.03 -3.32 114.58 118.25 2qmo h GLU 87 Ca 0.34 -0.75 -0.29 0.00 -1.00 0.00 0.00 59.36 57.66 2qmo h GLU 87 Cb 0.08 0.28 -0.05 0.00 0.50 0.00 0.00 28.75 29.57 2qmo h GLU 87 CO -0.11 1.36 -1.67 0.93 -1.00 0.00 0.00 179.01 178.52 2qmo h GLU 88 N -0.05 0.03 -1.95 2.33 5.08 -0.63 -3.42 114.58 115.97 2qmo h GLU 88 Ca -0.23 -0.04 -0.48 0.00 -1.00 0.00 0.00 59.36 57.60 2qmo h GLU 88 Cb 1.98 0.02 -0.39 0.00 0.50 0.00 0.00 28.75 30.85 2qmo h GLU 88 CO 0.22 0.60 -1.17 -0.25 -1.00 0.00 0.00 179.01 177.41 2qmo n ASP 89 N -3.11 0.65 0.22 1.42 9.92 0.80 -4.99 116.55 121.46 2qmo n ASP 89 Ca -0.17 -2.98 0.16 0.00 -0.53 0.00 0.00 54.79 51.27 2qmo n ASP 89 Cb 1.04 -0.56 0.81 0.00 -0.64 0.00 0.00 41.12 41.78 2qmo n ASP 89 CO 0.00 0.00 0.00 1.55 0.13 0.00 0.00 177.20 178.88 2qmo h PRO 90 N 3.14 0.00 -0.26 -0.24 0.13 -1.63 -0.65 132.00 132.50 2qmo h PRO 90 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 2qmo h PRO 90 Cb 0.96 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.09 2qmo h PRO 90 CO 0.49 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.35 2qmo n ASN 91 N -3.95 2.00 -3.44 1.44 5.03 -1.26 -4.57 115.26 110.51 2qmo n ASN 91 Ca 0.01 -1.82 -0.26 0.00 0.87 0.00 0.00 54.58 53.37 2qmo n ASN 91 Cb 0.26 -0.17 -0.09 0.00 -1.02 0.00 0.00 39.78 38.76 2qmo n ASN 91 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2qmo n ALA 92 N 0.55 3.08 -1.42 5.41 0.00 -0.25 -5.11 120.51 122.77 2qmo n ALA 92 Ca 0.16 -3.80 -0.35 0.00 0.00 0.00 0.00 53.44 49.44 2qmo n ALA 92 Cb 0.36 -0.85 0.09 0.00 0.00 0.00 0.00 19.45 19.05 2qmo n ALA 92 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2qmo n PRO 93 N 1.86 0.64 -2.10 0.00 -0.04 -1.26 -4.91 135.00 129.20 2qmo n PRO 93 Ca 0.25 0.28 -0.42 0.00 -0.04 0.00 0.00 63.50 63.58 2qmo n PRO 93 Cb 0.45 -2.42 -0.03 0.00 -0.04 0.00 0.00 33.50 31.47 2qmo n PRO 93 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2qmo s ILE 94 N -1.75 3.27 -0.44 0.52 1.01 -1.26 -4.97 121.20 117.58 2qmo s ILE 94 Ca 0.77 0.82 -0.08 0.00 0.00 0.00 0.00 60.65 62.16 2qmo s ILE 94 Cb -0.34 -3.52 0.11 0.00 0.01 0.00 0.00 42.46 38.71 2qmo s ILE 94 CO 0.46 0.03 0.29 -0.62 0.00 0.00 0.00 174.94 175.10 2qmo s ASP 95 N 1.60 5.58 0.49 3.58 -1.08 -1.26 -4.88 116.67 120.70 2qmo s ASP 95 Ca 0.67 -1.82 0.28 0.00 -0.52 0.00 0.00 52.55 51.16 2qmo s ASP 95 Cb -0.37 -1.96 1.02 0.00 -1.46 0.00 0.00 42.92 40.15 2qmo s ASP 95 CO 0.30 -0.62 1.86 0.71 0.52 0.00 0.00 175.17 177.94 2qmo h THR 96 N 6.18 0.18 -0.30 1.71 1.35 -1.98 -1.89 112.91 118.15 2qmo h THR 96 Ca -0.20 -0.82 -0.04 0.00 -0.55 0.00 0.00 66.41 64.80 2qmo h THR 96 Cb 1.07 1.70 -0.01 0.00 -1.73 0.00 0.00 68.15 69.18 2qmo h THR 96 CO 0.79 0.08 0.04 0.44 -0.25 0.00 0.00 175.52 176.62 2qmo h ASP 97 N 0.00 0.49 -0.42 5.36 3.32 -1.99 0.08 116.42 123.25 2qmo h ASP 97 Ca -0.00 -0.27 -0.00 0.00 0.02 0.00 0.00 57.03 56.77 2qmo h ASP 97 Cb 0.69 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 40.09 2qmo h ASP 97 CO 0.01 0.64 0.25 -1.13 -1.72 0.00 0.00 179.24 177.28 2qmo h ASN 98 N 0.32 0.51 -0.76 6.45 -1.24 -1.91 -2.17 115.58 116.78 2qmo h ASN 98 Ca 0.09 -0.07 -0.05 0.00 0.71 0.00 0.00 56.30 56.98 2qmo h ASN 98 Cb 0.37 -0.13 -0.03 0.00 0.73 0.00 0.00 38.32 39.25 2qmo h ASN 98 CO 0.01 0.43 0.26 -0.07 -1.29 0.00 0.00 177.43 176.77 2qmo h LEU 99 N 0.55 1.08 -0.93 0.34 3.38 -1.22 -1.11 115.31 117.40 2qmo h LEU 99 Ca 0.15 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2qmo h LEU 99 Cb 0.02 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.44 2qmo h LEU 99 CO -0.03 0.99 0.59 0.74 0.09 0.00 0.00 178.44 180.82 2qmo h THR 100 N 1.11 1.25 -0.32 0.22 2.02 -0.65 -0.40 112.91 116.14 2qmo h THR 100 Ca 0.25 -0.48 -0.05 0.00 0.77 0.00 0.00 66.41 66.89 2qmo h THR 100 Cb 0.28 -0.10 -0.01 0.00 -1.74 0.00 0.00 68.15 66.58 2qmo h THR 100 CO -0.01 0.25 0.00 1.56 0.37 0.00 0.00 175.52 177.69 2qmo h GLN 101 N 1.27 0.56 -0.43 6.66 1.08 -0.76 -1.64 115.11 121.84 2qmo h GLN 101 Ca 0.34 -0.18 -0.06 0.00 -1.45 0.00 0.00 58.65 57.30 2qmo h GLN 101 Cb -0.11 -0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 27.25 2qmo h GLN 101 CO -0.07 0.69 0.03 0.00 -0.95 0.00 0.00 178.83 178.53 2qmo h ARG 102 N 0.36 0.75 -0.41 1.46 3.08 -0.88 -1.13 114.38 117.61 2qmo h ARG 102 Ca 0.09 -0.22 -0.08 0.00 0.07 0.00 0.00 59.98 59.84 2qmo h ARG 102 Cb 0.44 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.40 2qmo h ARG 102 CO 0.02 0.80 -0.06 -0.07 -1.07 0.00 0.00 179.97 179.58 2qmo h LEU 103 N 0.59 0.76 -0.66 3.04 3.38 -1.10 -3.13 115.31 118.19 2qmo h LEU 103 Ca 0.13 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.75 2qmo h LEU 103 Cb 0.45 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.99 2qmo h LEU 103 CO 0.02 0.93 0.00 0.45 0.09 0.00 0.00 178.44 179.92 2qmo h HIS 104 N 0.58 0.00 -0.13 1.13 3.86 -1.11 -2.54 115.15 116.94 2qmo h HIS 104 Ca 0.11 0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.28 2qmo h HIS 104 Cb 0.57 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.03 2qmo h HIS 104 CO 0.05 0.00 -0.09 -0.97 0.86 0.00 0.00 177.93 177.78 2qmo h ASN 105 N 0.00 0.18 0.68 2.45 -1.24 -1.14 -2.49 115.58 114.02 2qmo h ASN 105 Ca 0.00 -0.03 0.00 0.00 0.71 0.00 0.00 56.30 56.98 2qmo h ASN 105 Cb 0.70 -0.05 0.00 0.00 0.73 0.00 0.00 38.32 39.70 2qmo h ASN 105 CO 0.00 0.29 0.00 0.49 -1.29 0.00 0.00 177.43 176.92 2qmo n PHE 106 N -4.33 0.68 0.50 0.67 3.72 -0.96 -2.21 117.46 115.53 2qmo n PHE 106 Ca -0.01 0.27 0.09 0.00 -0.05 0.00 0.00 57.45 57.75 2qmo n PHE 106 Cb 0.22 -0.93 0.39 0.00 -0.94 0.00 0.00 39.48 38.22 2qmo n PHE 106 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 2qmo n THR 107 N -2.12 0.87 -0.07 4.37 -2.24 -0.94 -1.66 114.28 112.49 2qmo n THR 107 Ca 0.02 0.21 -0.07 0.00 -2.27 0.00 0.00 64.05 61.94 2qmo n THR 107 Cb 0.22 -1.01 0.11 0.00 -2.10 0.00 0.00 70.33 67.55 2qmo n THR 107 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 2qmo h LYS 108 N 0.00 0.73 -0.00 -0.78 1.57 -1.63 -3.36 116.57 113.10 2qmo h LYS 108 Ca 0.00 -0.28 0.00 0.00 -1.87 0.00 0.00 60.65 58.50 2qmo h LYS 108 Cb 0.32 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.59 2qmo h LYS 108 CO 0.00 0.88 -0.25 0.25 -0.57 0.00 0.00 179.45 179.75 2qmo n THR 109 N -4.12 0.00 -4.48 -0.16 -2.24 -0.96 -5.00 114.28 97.31 2qmo n THR 109 Ca 0.00 -0.37 -0.21 0.00 -2.27 0.00 0.00 64.05 61.20 2qmo n THR 109 Cb 0.41 1.05 -0.14 0.00 -2.10 0.00 0.00 70.33 69.55 2qmo n THR 109 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 2qmo s TYR 110 N -1.43 1.21 0.29 4.78 2.02 -0.66 -5.02 117.35 118.55 2qmo s TYR 110 Ca 0.05 -0.29 0.09 0.00 -0.37 0.00 0.00 57.07 56.55 2qmo s TYR 110 Cb 0.06 -0.75 0.43 0.00 -0.40 0.00 0.00 41.96 41.31 2qmo s TYR 110 CO 0.25 0.01 1.66 -0.44 -1.57 0.00 0.00 175.55 175.46 2qmo h ASP 111 N 5.38 0.09 -3.58 2.29 3.32 -0.88 -3.42 116.42 119.62 2qmo h ASP 111 Ca -0.36 -0.05 -0.27 0.00 0.02 0.00 0.00 57.03 56.38 2qmo h ASP 111 Cb 1.17 -0.03 -0.32 0.00 0.22 0.00 0.00 39.33 40.38 2qmo h ASP 111 CO 0.46 0.60 -0.70 -0.22 -1.72 0.00 0.00 179.24 177.67 2qmo s LEU 112 N -7.91 1.31 -0.28 1.55 2.96 -0.64 -3.62 118.68 112.06 2qmo s LEU 112 Ca -0.03 0.08 -0.03 0.00 -0.22 0.00 0.00 54.13 53.93 2qmo s LEU 112 Cb 0.13 0.04 0.03 0.00 0.50 0.00 0.00 46.19 46.89 2qmo s LEU 112 CO 0.76 -0.09 -0.00 -0.69 -1.32 0.00 0.00 176.35 175.01 2qmo s VAL 113 N 0.73 3.24 -0.20 1.68 1.01 -0.50 -1.71 120.40 124.64 2qmo s VAL 113 Ca -0.06 -1.01 -0.13 0.00 0.00 0.00 0.00 61.98 60.78 2qmo s VAL 113 Cb -0.08 -2.70 -0.05 0.00 0.00 0.00 0.00 36.38 33.55 2qmo s VAL 113 CO -0.02 0.09 0.27 -0.63 0.00 0.00 0.00 175.10 174.81 2qmo s ILE 114 N 1.36 5.30 -0.28 2.22 1.01 -0.00 -1.03 121.20 129.78 2qmo s ILE 114 Ca -0.00 0.46 0.01 0.00 0.00 0.00 0.00 60.65 61.12 2qmo s ILE 114 Cb -0.18 -3.61 0.06 0.00 0.01 0.00 0.00 42.46 38.74 2qmo s ILE 114 CO -0.02 0.34 -0.06 -0.69 0.00 0.00 0.00 174.94 174.52 2qmo s VAL 115 N 0.87 2.54 -0.07 2.92 1.01 -0.07 -0.40 120.40 127.20 2qmo s VAL 115 Ca 0.14 -1.55 -0.21 0.00 0.00 0.00 0.00 61.98 60.37 2qmo s VAL 115 Cb -0.13 -2.49 -0.04 0.00 0.00 0.00 0.00 36.38 33.71 2qmo s VAL 115 CO 0.05 -0.08 0.58 -0.70 0.00 0.00 0.00 175.10 174.95 2qmo s GLU 116 N 1.16 4.36 0.00 2.72 2.12 0.01 -0.56 118.70 128.52 2qmo s GLU 116 Ca -0.07 0.67 0.00 0.00 0.36 0.00 0.00 54.97 55.93 2qmo s GLU 116 Cb -0.20 -3.41 0.00 0.00 0.26 0.00 0.00 34.13 30.78 2qmo s GLU 116 CO -0.03 0.18 0.00 0.41 -0.54 0.00 0.00 175.26 175.28 2qmo n GLY 117 N 2.99 -0.74 2.94 -1.50 0.00 -0.13 -4.11 105.19 104.64 2qmo n GLY 117 Ca -0.05 -1.71 -0.17 0.00 0.00 0.00 0.00 46.02 44.09 2qmo n GLY 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qmo s ALA 118 N -3.78 0.49 0.00 4.61 0.00 -1.26 -4.96 121.76 116.86 2qmo s ALA 118 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 51.96 51.79 2qmo s ALA 118 Cb 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 23.12 22.93 2qmo s ALA 118 CO 0.00 0.08 0.00 0.41 0.00 0.00 0.00 175.76 176.25 2qmo n GLY 119 N 3.25 2.49 0.00 0.00 0.00 -1.26 -4.84 105.19 104.83 2qmo n GLY 119 Ca -0.17 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.26 2qmo n GLY 119 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qmo n GLY 120 N 0.00 2.53 0.23 -0.02 0.00 -1.26 -4.80 105.19 101.86 2qmo n GLY 120 Ca 0.00 -1.91 0.07 0.00 0.00 0.00 0.00 46.02 44.18 2qmo n GLY 120 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2qmo h LEU 121 N 0.00 0.00 -0.83 0.99 3.38 -1.90 -2.98 115.31 113.97 2qmo h LEU 121 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2qmo h LEU 121 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2qmo h LEU 121 CO 0.00 0.19 -0.51 0.00 0.09 0.00 0.00 178.44 178.21 2qmo s VAL 123 N -2.39 2.93 0.18 0.00 -7.23 -1.13 -4.88 120.40 107.89 2qmo s VAL 123 Ca 0.16 0.82 -0.30 0.00 -1.81 0.00 0.00 61.98 60.84 2qmo s VAL 123 Cb 0.16 -3.47 -0.08 0.00 0.56 0.00 0.00 36.38 33.55 2qmo s VAL 123 CO 0.56 0.11 0.98 -2.16 -0.31 0.00 0.00 175.10 174.28 2qmo s PRO 124 N -2.20 4.74 -0.20 4.82 0.04 -1.26 -4.38 135.00 136.55 2qmo s PRO 124 Ca 0.56 1.53 -0.06 0.00 0.04 0.00 0.00 61.00 63.07 2qmo s PRO 124 Cb -0.34 -3.31 -0.10 0.00 0.04 0.00 0.00 34.50 30.78 2qmo s PRO 124 CO 0.44 0.31 -0.23 -0.89 0.04 0.00 0.00 177.00 176.66 2qmo n ILE 125 N 2.11 1.14 -4.55 0.56 2.08 0.16 -1.51 119.36 119.35 2qmo n ILE 125 Ca 0.00 -0.34 -0.26 0.00 0.56 0.00 0.00 62.75 62.72 2qmo n ILE 125 Cb 0.48 -1.57 -0.10 0.00 -0.75 0.00 0.00 39.64 37.70 2qmo n ILE 125 CO 0.00 0.00 0.00 0.42 0.56 0.00 0.00 176.55 177.53 2qmo s THR 126 N -2.38 1.29 0.46 1.39 -4.23 -0.64 -3.75 115.64 107.77 2qmo s THR 126 Ca -0.28 -2.00 0.27 0.00 -1.18 0.00 0.00 61.69 58.49 2qmo s THR 126 Cb 0.10 -2.68 0.30 0.00 1.34 0.00 0.00 72.50 71.56 2qmo s THR 126 CO 0.40 0.00 2.11 -0.07 -0.54 0.00 0.00 174.62 176.52 2qmo h LEU 127 N 1.86 0.00 0.00 4.79 3.38 -1.98 -2.96 115.31 120.40 2qmo h LEU 127 Ca -0.41 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.43 2qmo h LEU 127 Cb 1.26 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.99 2qmo h LEU 127 CO 0.71 0.09 -1.69 -0.62 0.09 0.00 0.00 178.44 177.03 2qmo n GLU 128 N -3.77 0.64 -4.87 1.13 -0.58 -1.26 -4.94 120.64 107.00 2qmo n GLU 128 Ca -0.02 0.05 -0.26 0.00 -0.42 0.00 0.00 57.16 56.50 2qmo n GLU 128 Cb 0.20 -1.68 -0.16 0.00 -0.57 0.00 0.00 31.44 29.23 2qmo n GLU 128 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 2qmo s GLU 129 N -3.09 1.77 0.00 3.49 2.02 -1.12 -5.07 118.70 116.71 2qmo s GLU 129 Ca -0.05 -0.63 0.00 0.00 0.02 0.00 0.00 54.97 54.30 2qmo s GLU 129 Cb 0.10 -1.56 0.00 0.00 0.10 0.00 0.00 34.13 32.76 2qmo s GLU 129 CO 0.84 0.28 0.00 0.27 0.02 0.00 0.00 175.26 176.67 2qmo n ASN 130 N 3.03 0.00 0.00 -0.19 0.23 -1.26 -0.66 115.26 116.41 2qmo n ASN 130 Ca -0.17 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 53.88 2qmo n ASN 130 Cb 0.53 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.23 2qmo n ASN 130 CO 0.00 0.00 0.00 -0.11 -0.93 0.00 0.00 177.26 176.22 2qmo n LEU 132 N 0.00 0.00 -0.21 -4.53 7.94 -0.36 -1.74 117.00 118.09 2qmo n LEU 132 Ca 0.00 0.00 -0.02 0.00 -1.11 0.00 0.00 56.01 54.88 2qmo n LEU 132 Cb 0.00 0.00 0.18 0.00 0.53 0.00 0.00 43.42 44.13 2qmo n LEU 132 CO 0.00 0.00 1.12 0.44 -1.11 0.00 0.00 177.39 177.84 2qmo h ASP 133 N 0.00 0.90 -0.26 1.96 3.32 -1.94 0.87 116.42 121.28 2qmo h ASP 133 Ca 0.00 -0.09 -0.05 0.00 0.02 0.00 0.00 57.03 56.91 2qmo h ASP 133 Cb 0.00 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.31 2qmo h ASP 133 CO 0.00 0.76 -0.04 0.15 -1.72 0.00 0.00 179.24 178.39 2qmo h PHE 134 N 1.00 0.53 -0.81 4.55 3.57 -1.72 -0.24 116.94 123.82 2qmo h PHE 134 Ca 0.25 -0.11 0.06 0.00 3.53 0.00 0.00 57.97 61.70 2qmo h PHE 134 Cb 0.08 -0.13 -0.05 0.00 2.79 0.00 0.00 35.95 38.64 2qmo h PHE 134 CO 0.01 0.67 0.53 0.00 -2.23 0.00 0.00 178.31 177.29 2qmo h ALA 135 N 0.78 1.61 -0.27 2.41 0.00 -1.68 -0.62 119.26 121.49 2qmo h ALA 135 Ca 0.07 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.80 2qmo h ALA 135 Cb 0.49 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 2qmo h ALA 135 CO 0.02 0.27 -0.43 -0.07 0.00 0.00 0.00 179.25 179.04 2qmo h LEU 136 N 0.89 0.85 -1.10 0.00 3.38 -0.51 -2.79 115.31 116.04 2qmo h LEU 136 Ca 0.35 -0.52 -0.00 0.00 0.09 0.00 0.00 57.88 57.80 2qmo h LEU 136 Cb 0.22 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.68 2qmo h LEU 136 CO -0.12 1.21 0.52 0.50 0.09 0.00 0.00 178.44 180.63 2qmo h LYS 137 N 0.53 1.13 0.00 1.13 3.64 -0.31 -1.91 116.57 120.78 2qmo h LYS 137 Ca 0.02 -0.09 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 2qmo h LYS 137 Cb 1.03 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 32.61 2qmo h LYS 137 CO 0.10 0.78 0.00 -0.07 -2.27 0.00 0.00 179.45 177.99 2qmo h LEU 138 N 1.15 0.00 2.25 5.20 3.38 -0.91 -3.46 115.31 122.91 2qmo h LEU 138 Ca 0.30 0.00 -0.41 0.00 0.09 0.00 0.00 57.88 57.86 2qmo h LEU 138 Cb -0.07 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.62 2qmo h LEU 138 CO -0.06 0.00 -0.47 0.29 0.09 0.00 0.00 178.44 178.29 2qmo n LYS 139 N -2.87 -1.55 -1.78 1.13 4.76 -0.72 -4.99 118.16 112.15 2qmo n LYS 139 Ca 0.01 1.06 -0.31 0.00 -2.87 0.00 0.00 58.31 56.19 2qmo n LYS 139 Cb 0.27 -5.60 0.03 0.00 -1.84 0.00 0.00 35.03 27.88 2qmo n LYS 139 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2qmo s ALA 140 N -2.92 2.86 0.93 7.82 0.00 -1.17 -5.07 121.76 124.20 2qmo s ALA 140 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 51.96 52.03 2qmo s ALA 140 Cb 0.00 -3.15 0.00 0.00 0.00 0.00 0.00 23.12 19.97 2qmo s ALA 140 CO 0.00 -0.93 0.00 1.63 0.00 0.00 0.00 175.76 176.46 2qmo n LYS 141 N -2.78 2.94 -3.30 0.00 5.02 -1.26 -4.66 118.16 114.12 2qmo n LYS 141 Ca 0.07 0.00 0.03 0.00 -2.02 0.00 0.00 58.31 56.39 2qmo n LYS 141 Cb 0.54 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.52 2qmo n LYS 141 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2qmo s LEU 143 N 0.00 -0.65 -0.24 -0.35 2.96 0.92 -0.36 118.68 120.97 2qmo s LEU 143 Ca 0.00 0.67 -0.12 0.00 -0.22 0.00 0.00 54.13 54.46 2qmo s LEU 143 Cb 0.00 1.65 -0.05 0.00 0.50 0.00 0.00 46.19 48.29 2qmo s LEU 143 CO 0.00 -0.12 0.21 -0.22 -1.32 0.00 0.00 176.35 174.89 2qmo s LEU 144 N 2.66 4.12 -0.17 -0.68 0.20 0.02 -1.52 118.68 123.31 2qmo s LEU 144 Ca 0.01 0.18 -0.12 0.00 0.69 0.00 0.00 54.13 54.88 2qmo s LEU 144 Cb -0.09 -2.18 -0.05 0.00 -0.43 0.00 0.00 46.19 43.45 2qmo s LEU 144 CO -0.16 0.03 0.22 -0.63 -0.29 0.00 0.00 176.35 175.52 2qmo s ILE 145 N 1.16 5.35 0.08 6.68 -1.09 0.86 -0.21 121.20 134.03 2qmo s ILE 145 Ca 0.10 0.39 0.03 0.00 -2.23 0.00 0.00 60.65 58.94 2qmo s ILE 145 Cb -0.14 -3.55 -0.04 0.00 -1.58 0.00 0.00 42.46 37.15 2qmo s ILE 145 CO 0.05 0.43 0.07 -0.55 -1.23 0.00 0.00 174.94 173.71 2qmo s SER 146 N 0.29 5.44 1.06 3.58 0.15 -0.14 -0.68 113.70 123.40 2qmo s SER 146 Ca 0.13 -0.04 -0.14 0.00 0.70 0.00 0.00 55.95 56.60 2qmo s SER 146 Cb -0.12 -1.43 0.22 0.00 -1.71 0.00 0.00 66.02 62.97 2qmo s SER 146 CO 0.02 0.17 1.10 -1.38 1.20 0.00 0.00 173.24 174.35 2qmo s HIS 147 N -1.39 1.66 -0.17 3.44 -3.43 -1.26 -0.86 115.29 113.27 2qmo s HIS 147 Ca 0.29 0.81 0.16 0.00 -0.80 0.00 0.00 55.06 55.52 2qmo s HIS 147 Cb -0.12 -3.35 0.40 0.00 -1.43 0.00 0.00 32.58 28.08 2qmo s HIS 147 CO 0.21 -3.17 1.27 -0.40 -2.00 0.00 0.00 174.74 170.65 2qmo n ASP 148 N -4.33 2.73 -4.98 7.38 5.75 -1.25 -4.57 116.55 117.27 2qmo n ASP 148 Ca 0.07 -3.24 -0.20 0.00 -0.01 0.00 0.00 54.79 51.41 2qmo n ASP 148 Cb 0.58 -0.50 0.01 0.00 -1.03 0.00 0.00 41.12 40.18 2qmo n ASP 148 CO 0.00 0.00 0.00 0.20 -0.11 0.00 0.00 177.20 177.29 2qmo s ASN 149 N -2.62 5.83 0.04 -1.12 0.01 -1.26 -4.70 114.94 111.12 2qmo s ASN 149 Ca 0.37 -0.08 -0.37 0.00 -0.71 0.00 0.00 52.86 52.07 2qmo s ASN 149 Cb 0.32 -1.20 -0.16 0.00 0.41 0.00 0.00 41.25 40.62 2qmo s ASN 149 CO 0.03 -0.61 1.43 -0.11 -1.51 0.00 0.00 177.10 176.34 2qmo n LEU 150 N -1.84 1.95 0.00 0.60 7.94 -1.26 -1.52 117.00 122.87 2qmo n LEU 150 Ca 0.02 1.11 0.00 0.00 -1.11 0.00 0.00 56.01 56.03 2qmo n LEU 150 Cb 0.58 -1.21 0.00 0.00 0.53 0.00 0.00 43.42 43.32 2qmo n LEU 150 CO 0.43 -0.86 0.00 0.61 -1.11 0.00 0.00 177.39 176.47 2qmo n GLY 151 N 2.89 1.57 0.21 -3.96 0.00 -1.26 -4.97 105.19 99.67 2qmo n GLY 151 Ca 0.19 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.26 2qmo n GLY 151 CO 0.00 0.00 0.00 0.17 0.00 0.00 0.00 173.32 173.49 2qmo h LEU 152 N 0.00 0.00 -0.15 0.99 8.10 -1.59 -2.67 115.31 119.98 2qmo h LEU 152 Ca 0.00 0.00 0.01 0.00 0.11 0.00 0.00 57.88 58.00 2qmo h LEU 152 Cb 0.00 0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 40.20 2qmo h LEU 152 CO 0.00 0.24 0.06 0.40 -4.11 0.00 0.00 178.44 175.03 2qmo h ILE 153 N 0.00 0.97 -0.60 0.15 2.04 -1.93 0.16 117.51 118.30 2qmo h ILE 153 Ca -0.00 -0.05 -0.05 0.00 1.00 0.00 0.00 64.86 65.76 2qmo h ILE 153 Cb 0.44 0.82 -0.03 0.00 -0.74 0.00 0.00 36.82 37.31 2qmo h ILE 153 CO 0.03 0.03 0.18 -1.13 0.00 0.00 0.00 178.15 177.26 2qmo h ASN 154 N 0.14 0.88 -0.20 1.72 -1.24 -1.93 -0.47 115.58 114.47 2qmo h ASN 154 Ca 0.06 -0.21 -0.04 0.00 0.71 0.00 0.00 56.30 56.83 2qmo h ASN 154 Cb 0.03 -0.23 -0.01 0.00 0.73 0.00 0.00 38.32 38.84 2qmo h ASN 154 CO -0.06 0.86 -0.01 0.44 -1.29 0.00 0.00 177.43 177.37 2qmo h ASP 155 N 0.85 0.36 -0.52 1.15 3.32 -1.29 -0.55 116.42 119.75 2qmo h ASP 155 Ca 0.19 -0.32 0.02 0.00 0.02 0.00 0.00 57.03 56.94 2qmo h ASP 155 Cb 0.30 -0.10 -0.03 0.00 0.22 0.00 0.00 39.33 39.72 2qmo h ASP 155 CO -0.00 0.60 0.32 0.00 -1.72 0.00 0.00 179.24 178.43 2qmo h LEU 157 N 0.65 0.00 -0.05 0.00 4.07 -0.89 0.10 115.31 119.19 2qmo h LEU 157 Ca 0.20 0.00 -0.00 0.00 0.08 0.00 0.00 57.88 58.16 2qmo h LEU 157 Cb -0.02 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 41.72 2qmo h LEU 157 CO -0.07 0.18 0.02 -0.07 -1.08 0.00 0.00 178.44 177.42 2qmo h LEU 158 N 0.00 0.08 -0.85 1.67 3.38 -0.92 -2.14 115.31 116.53 2qmo h LEU 158 Ca -0.00 -0.21 -0.08 0.00 0.09 0.00 0.00 57.88 57.68 2qmo h LEU 158 Cb 1.08 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.79 2qmo h LEU 158 CO 0.02 0.26 0.01 0.78 0.09 0.00 0.00 178.44 179.61 2qmo h ASN 159 N -0.11 0.84 -0.77 -0.43 2.35 -1.18 -2.72 115.58 113.55 2qmo h ASN 159 Ca 0.02 -0.21 0.01 0.00 -0.55 0.00 0.00 56.30 55.57 2qmo h ASN 159 Cb 0.21 -0.22 -0.04 0.00 0.05 0.00 0.00 38.32 38.32 2qmo h ASN 159 CO -0.00 0.89 0.51 -0.78 -1.65 0.00 0.00 177.43 176.40 2qmo h ASP 160 N 0.81 0.89 -0.64 5.81 3.58 -0.76 0.19 116.42 126.29 2qmo h ASP 160 Ca 0.16 -0.03 -0.02 0.00 0.42 0.00 0.00 57.03 57.56 2qmo h ASP 160 Cb 0.47 -0.22 -0.03 0.00 1.72 0.00 0.00 39.33 41.27 2qmo h ASP 160 CO 0.02 0.65 0.32 0.15 -2.88 0.00 0.00 179.24 177.50 2qmo h PHE 161 N 1.05 0.91 -0.15 0.28 3.57 -1.23 0.61 116.94 121.99 2qmo h PHE 161 Ca 0.28 -0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.73 2qmo h PHE 161 Cb -0.12 -0.29 -0.01 0.00 2.79 0.00 0.00 35.95 38.33 2qmo h PHE 161 CO -0.02 0.68 0.05 1.25 -2.23 0.00 0.00 178.31 178.04 2qmo h LEU 162 N 0.88 0.21 -0.45 0.59 5.85 -1.15 -2.74 115.31 118.50 2qmo h LEU 162 Ca 0.22 -0.20 -0.10 0.00 0.84 0.00 0.00 57.88 58.64 2qmo h LEU 162 Cb 0.09 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.06 2qmo h LEU 162 CO -0.03 0.35 -0.11 -0.07 -0.34 0.00 0.00 178.44 178.24 2qmo h LEU 163 N 0.06 0.89 -1.58 2.25 3.38 -0.75 -2.74 115.31 116.80 2qmo h LEU 163 Ca 0.05 -0.36 -0.03 0.00 0.09 0.00 0.00 57.88 57.62 2qmo h LEU 163 Cb 0.22 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 2qmo h LEU 163 CO -0.00 1.05 -0.16 0.07 0.09 0.00 0.00 178.44 179.48 2qmo h LYS 164 N 0.72 0.00 0.00 1.13 2.10 -0.89 -2.27 116.57 117.36 2qmo h LYS 164 Ca 0.11 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 58.74 2qmo h LYS 164 Cb 0.66 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.99 2qmo h LYS 164 CO 0.05 0.16 -0.12 0.66 -2.00 0.00 0.00 179.45 178.20 2qmo h SER 165 N 0.00 0.00 -1.68 7.07 4.64 -1.17 -3.46 113.55 118.96 2qmo h SER 165 Ca -0.00 0.00 -0.48 0.00 -0.47 0.00 0.00 61.79 60.84 2qmo h SER 165 Cb 0.51 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.58 2qmo h SER 165 CO 0.02 0.12 -0.39 -1.00 -0.87 0.00 0.00 176.83 174.71 2qmo s HIS 166 N -3.42 2.83 -1.11 4.77 3.76 -0.85 -5.04 115.29 116.23 2qmo s HIS 166 Ca 0.03 -0.38 -0.12 0.00 -0.15 0.00 0.00 55.06 54.45 2qmo s HIS 166 Cb 0.08 -2.01 0.23 0.00 1.11 0.00 0.00 32.58 31.98 2qmo s HIS 166 CO 0.63 -0.01 1.20 -0.65 -0.85 0.00 0.00 174.74 175.07 2qmo s GLN 167 N -4.10 4.08 0.08 1.40 -1.52 -1.26 -4.93 119.66 113.41 2qmo s GLN 167 Ca 0.45 -2.85 -0.23 0.00 -1.95 0.00 0.00 55.36 50.78 2qmo s GLN 167 Cb -0.05 -4.75 0.06 0.00 -0.22 0.00 0.00 33.01 28.04 2qmo s GLN 167 CO 0.28 -1.47 0.56 -0.48 -0.25 0.00 0.00 175.29 173.94 2qmo s LEU 168 N 0.10 -0.29 -0.01 2.90 2.34 -1.26 -5.04 118.68 117.43 2qmo s LEU 168 Ca 0.34 0.16 -0.22 0.00 0.06 0.00 0.00 54.13 54.47 2qmo s LEU 168 Cb -0.07 2.32 -0.05 0.00 -0.56 0.00 0.00 46.19 47.83 2qmo s LEU 168 CO -0.05 -0.80 0.65 -0.62 -1.06 0.00 0.00 176.35 174.47 2qmo s ASP 169 N -2.18 7.02 0.11 1.48 -1.08 -1.26 -4.96 116.67 115.80 2qmo s ASP 169 Ca -0.03 1.22 -0.09 0.00 -0.52 0.00 0.00 52.55 53.12 2qmo s ASP 169 Cb -0.00 -2.39 -0.00 0.00 -1.46 0.00 0.00 42.92 39.06 2qmo s ASP 169 CO -0.04 0.04 0.22 -0.72 0.52 0.00 0.00 175.17 175.19 2qmo s TYR 170 N 0.03 0.21 0.01 -5.34 -0.85 -1.26 -4.59 117.35 105.55 2qmo s TYR 170 Ca 0.34 -0.62 0.00 0.00 -0.52 0.00 0.00 57.07 56.26 2qmo s TYR 170 Cb -0.19 -0.05 -0.01 0.00 0.38 0.00 0.00 41.96 42.10 2qmo s TYR 170 CO 0.18 -0.59 -0.01 0.15 -1.52 0.00 0.00 175.55 173.76 2qmo s LYS 171 N -3.89 0.09 -0.18 -3.49 -0.14 -1.26 -5.02 119.74 105.85 2qmo s LYS 171 Ca 0.08 -0.17 -0.05 0.00 -1.36 0.00 0.00 55.97 54.48 2qmo s LYS 171 Cb 0.04 0.02 -0.03 0.00 -1.68 0.00 0.00 37.83 36.18 2qmo s LYS 171 CO -0.08 -0.01 0.00 0.42 -0.76 0.00 0.00 175.35 174.92 2qmo s ILE 172 N -0.39 4.16 -0.06 2.17 1.01 -1.26 -0.80 121.20 126.04 2qmo s ILE 172 Ca -0.04 -0.25 0.02 0.00 0.00 0.00 0.00 60.65 60.38 2qmo s ILE 172 Cb -0.03 -2.86 0.01 0.00 0.01 0.00 0.00 42.46 39.59 2qmo s ILE 172 CO -0.00 0.46 -0.12 0.00 0.00 0.00 0.00 174.94 175.27 2qmo s ALA 173 N 0.61 1.23 -0.04 9.38 0.00 0.71 -1.47 121.76 132.19 2qmo s ALA 173 Ca -0.00 -0.42 -0.25 0.00 0.00 0.00 0.00 51.96 51.29 2qmo s ALA 173 Cb -0.14 -0.54 -0.04 0.00 0.00 0.00 0.00 23.12 22.41 2qmo s ALA 173 CO 0.02 0.13 0.78 0.42 0.00 0.00 0.00 175.76 177.11 2qmo s ILE 174 N 0.58 4.97 -0.78 0.00 1.01 0.17 -0.97 121.20 126.18 2qmo s ILE 174 Ca -0.13 1.62 -0.21 0.00 0.00 0.00 0.00 60.65 61.93 2qmo s ILE 174 Cb -0.15 -4.12 0.09 0.00 0.01 0.00 0.00 42.46 38.29 2qmo s ILE 174 CO 0.03 0.24 1.06 0.21 0.00 0.00 0.00 174.94 176.49 2qmo s ASN 175 N 0.74 6.36 -0.26 3.58 2.47 -0.04 -0.23 114.94 127.56 2qmo s ASN 175 Ca 0.41 -1.38 -0.21 0.00 0.42 0.00 0.00 52.86 52.10 2qmo s ASN 175 Cb -0.19 -2.43 -0.02 0.00 -1.45 0.00 0.00 41.25 37.17 2qmo s ASN 175 CO 0.21 -1.32 0.65 -0.22 -3.72 0.00 0.00 177.10 172.70 2qmo s LEU 176 N 3.69 4.07 0.31 3.21 2.96 -1.26 -3.93 118.68 127.73 2qmo s LEU 176 Ca 0.28 0.72 -0.18 0.00 -0.22 0.00 0.00 54.13 54.74 2qmo s LEU 176 Cb -0.11 -2.89 -0.09 0.00 0.50 0.00 0.00 46.19 43.60 2qmo s LEU 176 CO 0.02 -0.39 0.77 -0.54 -1.32 0.00 0.00 176.35 174.89 2qmo s LYS 177 N 2.55 4.13 0.47 1.98 -0.14 -1.26 -4.91 119.74 122.55 2qmo s LYS 177 Ca 0.27 0.82 0.13 0.00 -1.36 0.00 0.00 55.97 55.83 2qmo s LYS 177 Cb -0.15 -2.53 1.09 0.00 -1.68 0.00 0.00 37.83 34.55 2qmo s LYS 177 CO 0.09 0.20 2.09 0.78 -0.76 0.00 0.00 175.35 177.74 2qmo h GLY 178 N 2.56 0.29 -2.87 -3.33 0.00 -2.05 -2.02 103.07 95.65 2qmo h GLY 178 Ca -0.48 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 46.75 2qmo h GLY 178 CO 0.65 0.09 0.00 1.16 0.00 0.00 0.00 176.54 178.44 2qmo n ASN 179 N -4.50 4.45 -4.59 0.19 6.94 -1.26 -4.88 115.26 111.61 2qmo n ASN 179 Ca 0.02 -2.55 -0.43 0.00 -0.02 0.00 0.00 54.58 51.60 2qmo n ASN 179 Cb 0.14 -0.59 -0.02 0.00 -2.36 0.00 0.00 39.78 36.95 2qmo n ASN 179 CO 0.00 0.00 0.00 0.21 -1.03 0.00 0.00 177.26 176.44 2qmo s ASN 180 N -0.74 6.59 -0.03 0.53 3.84 -0.76 -4.87 114.94 119.51 2qmo s ASN 180 Ca 0.44 0.37 0.22 0.00 0.21 0.00 0.00 52.86 54.10 2qmo s ASN 180 Cb 0.31 -2.53 0.67 0.00 -0.55 0.00 0.00 41.25 39.15 2qmo s ASN 180 CO 0.17 -1.24 1.57 0.35 -2.79 0.00 0.00 177.10 175.16 2qmo n THR 181 N 6.77 1.19 0.00 -5.21 -2.24 -1.26 -4.42 114.28 109.11 2qmo n THR 181 Ca 0.11 -1.04 0.00 0.00 -2.27 0.00 0.00 64.05 60.84 2qmo n THR 181 Cb 0.49 0.42 0.00 0.00 -2.10 0.00 0.00 70.33 69.14 2qmo n THR 181 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qmo n ALA 182 N 1.56 1.68 -0.15 6.98 0.00 -1.26 -4.83 120.51 124.49 2qmo n ALA 182 Ca 0.25 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.66 2qmo n ALA 182 Cb 0.69 0.16 0.03 0.00 0.00 0.00 0.00 19.45 20.33 2qmo n ALA 182 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 2qmo h PHE 183 N 0.00 -0.25 -0.15 0.00 3.57 -1.84 -0.95 116.94 117.32 2qmo h PHE 183 Ca 0.00 0.04 -0.08 0.00 3.53 0.00 0.00 57.97 61.46 2qmo h PHE 183 Cb 0.64 0.18 -0.01 0.00 2.79 0.00 0.00 35.95 39.55 2qmo h PHE 183 CO 0.00 -0.20 -0.28 0.45 -2.23 0.00 0.00 178.31 176.05 2qmo h HIS 184 N -0.00 0.32 0.00 0.41 3.86 -1.88 -0.62 115.15 117.24 2qmo h HIS 184 Ca 0.23 -0.06 0.00 0.00 -1.16 0.00 0.00 60.37 59.37 2qmo h HIS 184 Cb 0.35 -0.08 0.00 0.00 1.06 0.00 0.00 27.41 28.74 2qmo h HIS 184 CO -0.41 0.55 -1.29 -1.13 0.86 0.00 0.00 177.93 176.51 2qmo n SER 185 N -4.13 0.55 -0.12 2.45 3.41 -0.90 -4.12 113.62 110.76 2qmo n SER 185 Ca -0.01 0.11 -0.23 0.00 -0.26 0.00 0.00 58.87 58.48 2qmo n SER 185 Cb 0.39 0.97 -0.09 0.00 -0.26 0.00 0.00 64.21 65.22 2qmo n SER 185 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 2qmo n ILE 186 N -2.39 1.34 -0.05 -1.33 2.08 -0.41 -4.79 119.36 113.81 2qmo n ILE 186 Ca -0.01 -0.39 -0.07 0.00 0.56 0.00 0.00 62.75 62.84 2qmo n ILE 186 Cb 0.53 -1.67 -0.06 0.00 -0.75 0.00 0.00 39.64 37.69 2qmo n ILE 186 CO 0.00 0.00 0.00 -1.20 0.56 0.00 0.00 176.55 175.91 2qmo n SER 187 N -3.81 3.01 -0.21 4.38 7.64 -0.46 -4.64 113.62 119.54 2qmo n SER 187 Ca -0.46 -0.04 0.06 0.00 1.01 0.00 0.00 58.87 59.44 2qmo n SER 187 Cb 0.87 0.15 0.33 0.00 -1.01 0.00 0.00 64.21 64.55 2qmo n SER 187 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 2qmo h LEU 188 N 0.00 0.71 -1.06 -3.43 5.85 -1.32 -2.29 115.31 113.77 2qmo h LEU 188 Ca -0.25 0.00 0.11 0.00 0.84 0.00 0.00 57.88 58.59 2qmo h LEU 188 Cb 1.45 -0.15 -0.08 0.00 0.37 0.00 0.00 40.66 42.25 2qmo h LEU 188 CO -0.02 0.46 0.62 -0.65 -0.34 0.00 0.00 178.44 178.51 2qmo h PRO 189 N 0.81 0.95 -0.05 5.25 0.11 -1.83 0.42 132.00 137.66 2qmo h PRO 189 Ca 0.33 -0.06 -0.23 0.00 0.11 0.00 0.00 66.00 66.15 2qmo h PRO 189 Cb 0.25 -0.21 0.01 0.00 0.11 0.00 0.00 31.00 31.16 2qmo h PRO 189 CO -0.11 0.63 -0.90 -0.92 -0.21 0.00 0.00 178.00 176.48 2qmo h TYR 190 N 0.98 0.87 -0.81 0.65 3.20 -1.72 -2.68 116.97 117.46 2qmo h TYR 190 Ca 0.48 -0.44 0.13 0.00 3.14 0.00 0.00 58.73 62.04 2qmo h TYR 190 Cb 0.46 -0.11 -0.09 0.00 1.54 0.00 0.00 36.73 38.53 2qmo h TYR 190 CO -0.00 1.26 0.41 0.82 -1.64 0.00 0.00 178.16 179.01 2qmo h ILE 191 N 0.38 0.76 -0.38 1.81 1.08 -1.07 0.10 117.51 120.19 2qmo h ILE 191 Ca -0.08 -0.21 -0.03 0.00 -0.39 0.00 0.00 64.86 64.15 2qmo h ILE 191 Cb 1.54 0.09 -0.02 0.00 -3.07 0.00 0.00 36.82 35.35 2qmo h ILE 191 CO 0.17 0.11 0.13 -0.33 -0.69 0.00 0.00 178.15 177.55 2qmo h GLU 192 N 0.62 0.58 -0.25 2.37 5.08 -0.92 -1.17 114.58 120.89 2qmo h GLU 192 Ca 0.43 -0.12 -0.00 0.00 -1.00 0.00 0.00 59.36 58.67 2qmo h GLU 192 Cb 0.57 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.72 2qmo h GLU 192 CO -0.34 0.58 0.15 -0.07 -1.00 0.00 0.00 179.01 178.33 2qmo h LEU 193 N 0.47 0.29 -0.62 1.33 3.38 -1.05 -2.36 115.31 116.75 2qmo h LEU 193 Ca 0.13 -0.04 0.10 0.00 0.09 0.00 0.00 57.88 58.16 2qmo h LEU 193 Cb 0.23 -0.07 -0.08 0.00 0.09 0.00 0.00 40.66 40.82 2qmo h LEU 193 CO -0.01 0.24 0.21 0.15 0.09 0.00 0.00 178.44 179.12 2qmo h PHE 194 N 0.32 0.35 -0.07 1.13 3.57 -0.68 -2.21 116.94 119.35 2qmo h PHE 194 Ca 0.09 0.03 -0.09 0.00 3.53 0.00 0.00 57.97 61.54 2qmo h PHE 194 Cb -0.00 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.66 2qmo h PHE 194 CO -0.05 0.06 -0.35 -0.91 -2.23 0.00 0.00 178.31 174.83 2qmo h ASN 195 N 0.37 0.14 0.46 0.41 2.35 -0.84 -1.20 115.58 117.28 2qmo h ASN 195 Ca 0.32 -0.05 0.00 0.00 -0.55 0.00 0.00 56.30 56.02 2qmo h ASN 195 Cb 0.43 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.77 2qmo h ASN 195 CO -0.35 0.49 0.00 0.71 -1.65 0.00 0.00 177.43 176.63 2qmo h THR 196 N 0.12 0.00 -0.01 2.81 1.35 -0.89 -3.06 112.91 113.24 2qmo h THR 196 Ca 0.01 -0.23 0.00 0.00 -0.55 0.00 0.00 66.41 65.65 2qmo h THR 196 Cb 0.68 1.22 0.00 0.00 -1.73 0.00 0.00 68.15 68.32 2qmo h THR 196 CO 0.05 0.00 -0.04 0.54 -0.25 0.00 0.00 175.52 175.82 2qmo n ARG 197 N -3.06 0.82 -4.23 4.72 1.74 -0.55 -5.00 116.66 111.10 2qmo n ARG 197 Ca -0.01 -1.09 -0.29 0.00 -0.77 0.00 0.00 57.85 55.69 2qmo n ARG 197 Cb 0.18 -1.20 -0.09 0.00 -1.02 0.00 0.00 32.46 30.32 2qmo n ARG 197 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2qmo s SER 198 N -1.02 4.44 0.00 0.55 0.15 -0.64 -5.01 113.70 112.17 2qmo s SER 198 Ca 0.13 -0.41 0.28 0.00 0.70 0.00 0.00 55.95 56.64 2qmo s SER 198 Cb 0.09 -0.85 1.11 0.00 -1.71 0.00 0.00 66.02 64.66 2qmo s SER 198 CO 0.16 0.15 1.78 -0.46 1.20 0.00 0.00 173.24 176.08 2qmo n ASN 199 N 0.47 1.26 -3.40 5.45 0.23 -1.26 -4.68 115.26 113.33 2qmo n ASN 199 Ca -0.12 -1.35 -0.19 0.00 -0.53 0.00 0.00 54.58 52.39 2qmo n ASN 199 Cb 0.53 0.01 -0.09 0.00 -2.08 0.00 0.00 39.78 38.15 2qmo n ASN 199 CO 0.00 0.00 0.00 0.21 -0.93 0.00 0.00 177.26 176.54 2qmo s ASN 200 N -2.07 1.72 0.50 0.53 2.47 -1.26 -5.14 114.94 111.69 2qmo s ASN 200 Ca 0.37 -1.18 -0.14 0.00 0.42 0.00 0.00 52.86 52.33 2qmo s ASN 200 Cb 0.21 0.40 -0.07 0.00 -1.45 0.00 0.00 41.25 40.34 2qmo s ASN 200 CO 0.36 -0.34 0.93 -2.16 -3.72 0.00 0.00 177.10 172.17 2qmo s PRO 201 N 1.93 3.83 -0.08 0.43 0.04 -1.26 -4.99 135.00 134.90 2qmo s PRO 201 Ca 0.13 0.77 -0.27 0.00 0.04 0.00 0.00 61.00 61.67 2qmo s PRO 201 Cb -0.15 -2.20 -0.03 0.00 0.04 0.00 0.00 34.50 32.17 2qmo s PRO 201 CO -0.21 -0.26 0.87 0.42 0.04 0.00 0.00 177.00 177.87 2qmo s ILE 202 N -2.66 4.91 0.38 0.56 1.01 -1.26 -4.57 121.20 119.56 2qmo s ILE 202 Ca 0.56 1.79 0.08 0.00 0.00 0.00 0.00 60.65 63.07 2qmo s ILE 202 Cb -0.10 -4.20 -0.02 0.00 0.01 0.00 0.00 42.46 38.15 2qmo s ILE 202 CO 0.36 0.13 0.34 0.68 0.00 0.00 0.00 174.94 176.44 2qmo s VAL 203 N 1.39 3.01 -0.27 2.92 -7.23 -0.54 -4.99 120.40 114.68 2qmo s VAL 203 Ca 0.44 -1.36 -0.11 0.00 -1.81 0.00 0.00 61.98 59.14 2qmo s VAL 203 Cb -0.19 -3.07 -0.05 0.00 0.56 0.00 0.00 36.38 33.64 2qmo s VAL 203 CO 0.20 -0.07 0.18 -0.63 -0.31 0.00 0.00 175.10 174.46 2qmo s ILE 204 N -2.41 5.27 0.22 -0.62 1.09 -1.26 -0.65 121.20 122.85 2qmo s ILE 204 Ca 0.45 0.16 -0.10 0.00 -1.10 0.00 0.00 60.65 60.06 2qmo s ILE 204 Cb -0.04 -3.50 0.21 0.00 -1.06 0.00 0.00 42.46 38.07 2qmo s ILE 204 CO 0.27 0.27 1.66 0.15 -0.10 0.00 0.00 174.94 177.19 2qmo h PHE 205 N 8.21 -0.05 0.00 3.97 3.57 -0.88 -1.31 116.94 130.46 2qmo h PHE 205 Ca -0.36 0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.19 2qmo h PHE 205 Cb 1.19 0.12 -0.00 0.00 2.79 0.00 0.00 35.95 40.05 2qmo h PHE 205 CO 0.74 -0.18 -0.03 1.96 -2.23 0.00 0.00 178.31 178.57 2qmo h GLN 206 N 0.11 0.00 -0.01 1.11 7.50 -1.91 0.57 115.11 122.47 2qmo h GLN 206 Ca 0.34 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.49 2qmo h GLN 206 Cb 0.56 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.09 2qmo h GLN 206 CO -0.56 0.03 -0.15 1.04 -1.50 0.00 0.00 178.83 177.69 2qmo n GLN 207 N -3.24 1.43 -0.54 1.46 6.02 -0.51 -4.62 117.38 117.38 2qmo n GLN 207 Ca -0.02 -0.96 0.05 0.00 -0.01 0.00 0.00 57.00 56.06 2qmo n GLN 207 Cb 0.18 -1.48 0.09 0.00 1.02 0.00 0.00 30.24 30.05 2qmo n GLN 207 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 2qmo n SER 208 N 0.06 1.26 -0.16 1.08 7.64 0.19 -4.80 113.62 118.89 2qmo n SER 208 Ca 0.15 -2.70 -0.07 0.00 1.01 0.00 0.00 58.87 57.25 2qmo n SER 208 Cb 0.41 -0.35 0.02 0.00 -1.01 0.00 0.00 64.21 63.28 2qmo n SER 208 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 2qmo h LEU 209 N 0.34 0.53 -0.33 -3.43 3.38 -1.82 0.19 115.31 114.18 2qmo h LEU 209 Ca -0.04 -0.01 -0.07 0.00 0.09 0.00 0.00 57.88 57.85 2qmo h LEU 209 Cb 1.28 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.89 2qmo h LEU 209 CO 0.02 0.38 -0.08 0.50 0.09 0.00 0.00 178.44 179.35 2qmo h LYS 210 N 0.64 0.64 -0.66 1.13 3.64 -1.94 -2.97 116.57 117.05 2qmo h LYS 210 Ca 0.19 -0.25 -0.01 0.00 -1.27 0.00 0.00 60.65 59.31 2qmo h LYS 210 Cb -0.04 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 31.71 2qmo h LYS 210 CO -0.06 0.82 0.37 0.28 -2.27 0.00 0.00 179.45 178.58 2qmo h VAL 211 N 0.42 1.20 0.00 2.00 2.07 -1.84 -0.55 116.25 119.56 2qmo h VAL 211 Ca 0.08 -0.51 0.00 0.00 0.82 0.00 0.00 66.70 67.10 2qmo h VAL 211 Cb 0.58 0.34 0.00 0.00 -1.52 0.00 0.00 31.29 30.69 2qmo h VAL 211 CO 0.03 0.22 0.00 0.18 0.02 0.00 0.00 177.57 178.03 2qmo n LEU 212 N -4.53 2.62 0.00 2.57 4.77 0.66 -0.86 117.00 122.22 2qmo n LEU 212 Ca 0.05 -1.24 0.00 0.00 -0.03 0.00 0.00 56.01 54.80 2qmo n LEU 212 Cb 0.08 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 40.67 2qmo n LEU 212 CO 0.37 0.47 0.00 -0.24 -1.33 0.00 0.00 177.39 176.66 2qmo n SER 214 N 1.10 0.00 -0.01 -1.43 2.88 -0.22 -0.97 113.62 114.98 2qmo n SER 214 Ca 0.00 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.44 2qmo n SER 214 Cb 0.33 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.75 2qmo n SER 214 CO 0.00 0.00 0.00 0.15 -1.23 0.00 0.00 175.04 173.96 2qmo h PHE 215 N 0.00 -0.11 -0.29 0.66 3.57 -1.25 -0.77 116.94 118.75 2qmo h PHE 215 Ca 0.00 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.49 2qmo h PHE 215 Cb 0.00 0.07 -0.02 0.00 2.79 0.00 0.00 35.95 38.79 2qmo h PHE 215 CO 0.00 -0.08 0.10 0.00 -2.23 0.00 0.00 178.31 176.10 2qmo h ALA 216 N 1.09 1.63 -0.01 2.41 0.00 -1.31 -3.02 119.26 120.06 2qmo h ALA 216 Ca 0.07 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2qmo h ALA 216 Cb 0.13 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2qmo h ALA 216 CO -0.15 0.29 -0.68 1.28 0.00 0.00 0.00 179.25 179.99 2qmo n LEU 217 N -4.40 1.44 0.00 0.00 4.77 -1.05 -4.89 117.00 112.86 2qmo n LEU 217 Ca 0.01 -0.57 0.00 0.00 -0.03 0.00 0.00 56.01 55.43 2qmo n LEU 217 Cb 0.14 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 2qmo n LEU 217 CO 0.36 0.30 0.13 1.17 -1.33 0.00 0.00 177.39 178.02