#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1twi n LEU 16 N 0.00 3.04 0.00 4.03 7.94 -1.26 -0.30 117.00 130.45 1twi n LEU 16 Ca 0.00 1.03 0.00 0.00 -1.11 0.00 0.00 56.01 55.93 1twi n LEU 16 Cb 0.00 -1.34 0.00 0.00 0.53 0.00 0.00 43.42 42.61 1twi n LEU 16 CO 0.00 -0.27 0.00 0.61 -1.11 0.00 0.00 177.39 176.62 1twi n GLY 17 N 3.90 3.17 3.17 -3.96 0.00 -1.26 -4.78 105.19 105.43 1twi n GLY 17 Ca 0.21 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.79 1twi n GLY 17 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1twi n ASN 18 N 0.05 5.98 0.21 1.61 3.02 0.59 -4.84 115.26 121.89 1twi n ASN 18 Ca 0.00 -3.23 0.15 0.00 -0.03 0.00 0.00 54.58 51.47 1twi n ASN 18 Cb 0.00 -1.33 0.59 0.00 -0.61 0.00 0.00 39.78 38.43 1twi n ASN 18 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 1twi h ASP 19 N 6.03 0.00 -0.20 6.41 3.32 -1.89 -3.28 116.42 126.80 1twi h ASP 19 Ca 0.19 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.24 1twi h ASP 19 Cb 0.74 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.29 1twi h ASP 19 CO 1.19 0.00 0.00 0.35 -1.72 0.00 0.00 179.24 179.06 1twi n THR 20 N -2.74 1.82 -4.38 0.35 -2.24 -1.26 -5.01 114.28 100.83 1twi n THR 20 Ca 0.01 -1.69 -0.25 0.00 -2.27 0.00 0.00 64.05 59.85 1twi n THR 20 Cb 0.28 -0.03 -0.09 0.00 -2.10 0.00 0.00 70.33 68.40 1twi n THR 20 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1twi s VAL 21 N -2.29 2.54 0.11 2.28 -7.23 -1.24 -0.51 120.40 114.07 1twi s VAL 21 Ca 0.32 -2.02 -0.26 0.00 -1.81 0.00 0.00 61.98 58.21 1twi s VAL 21 Cb 0.25 -2.76 0.08 0.00 0.56 0.00 0.00 36.38 34.50 1twi s VAL 21 CO 0.08 -0.20 1.02 -1.83 -0.31 0.00 0.00 175.10 173.86 1twi s GLU 22 N -3.69 1.03 -0.20 4.82 -1.05 -0.39 -4.98 118.70 114.24 1twi s GLU 22 Ca 0.34 -0.56 -0.06 0.00 -0.15 0.00 0.00 54.97 54.54 1twi s GLU 22 Cb 0.00 0.36 -0.03 0.00 -0.44 0.00 0.00 34.13 34.02 1twi s GLU 22 CO 0.19 -0.47 0.02 0.42 0.95 0.00 0.00 175.26 176.36 1twi s ILE 23 N -3.12 4.15 -0.04 1.83 -1.09 -1.26 0.12 121.20 121.79 1twi s ILE 23 Ca 0.12 -0.25 0.01 0.00 -2.23 0.00 0.00 60.65 58.31 1twi s ILE 23 Cb -0.00 -2.88 0.02 0.00 -1.58 0.00 0.00 42.46 38.02 1twi s ILE 23 CO 0.01 0.43 -0.06 -0.54 -1.23 0.00 0.00 174.94 173.55 1twi s LYS 24 N 0.91 0.92 -1.61 2.79 1.02 0.27 -4.78 119.74 119.26 1twi s LYS 24 Ca 0.02 -0.15 -0.15 0.00 0.02 0.00 0.00 55.97 55.71 1twi s LYS 24 Cb -0.14 -0.88 0.11 0.00 -0.52 0.00 0.00 37.83 36.40 1twi s LYS 24 CO 0.02 -0.05 0.83 -0.25 -0.92 0.00 0.00 175.35 174.98 1twi n ASP 25 N 3.94 -3.56 -1.27 2.83 9.92 -1.26 -0.72 116.55 126.43 1twi n ASP 25 Ca -0.25 -0.92 -0.14 0.00 -0.53 0.00 0.00 54.79 52.95 1twi n ASP 25 Cb 0.51 -3.24 -0.05 0.00 -0.64 0.00 0.00 41.12 37.71 1twi n ASP 25 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1twi n GLY 26 N -1.56 0.99 3.10 0.44 0.00 -1.26 -4.98 105.19 101.91 1twi n GLY 26 Ca 0.02 -0.32 -0.16 0.00 0.00 0.00 0.00 46.02 45.55 1twi n GLY 26 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1twi s ARG 27 N -3.66 0.69 0.02 1.61 0.52 0.11 -1.06 118.95 117.17 1twi s ARG 27 Ca 0.00 -0.76 -0.30 0.00 -0.52 0.00 0.00 55.73 54.15 1twi s ARG 27 Cb 0.00 -0.59 -0.04 0.00 0.52 0.00 0.00 34.95 34.84 1twi s ARG 27 CO 0.00 0.13 0.98 0.12 0.02 0.00 0.00 175.30 176.55 1twi s PHE 28 N -1.13 3.69 0.06 -0.53 5.36 0.21 -0.57 117.98 125.07 1twi s PHE 28 Ca -0.04 1.71 0.09 0.00 -0.96 0.00 0.00 56.93 57.73 1twi s PHE 28 Cb -0.09 -3.11 -0.03 0.00 -0.34 0.00 0.00 43.02 39.45 1twi s PHE 28 CO 0.01 0.01 -0.24 -0.06 -1.46 0.00 0.00 175.22 173.48 1twi s PHE 29 N 0.80 2.08 -0.16 10.12 0.40 0.12 -1.19 117.98 130.14 1twi s PHE 29 Ca 0.51 -0.39 0.00 0.00 -0.60 0.00 0.00 56.93 56.45 1twi s PHE 29 Cb -0.22 -1.22 0.03 0.00 0.51 0.00 0.00 43.02 42.12 1twi s PHE 29 CO 0.28 0.14 -0.12 0.42 0.70 0.00 0.00 175.22 176.65 1twi s ILE 30 N -0.86 1.54 -1.52 0.64 1.01 -0.53 -1.26 121.20 120.23 1twi s ILE 30 Ca 0.10 -0.74 -0.00 0.00 0.00 0.00 0.00 60.65 60.00 1twi s ILE 30 Cb -0.10 -1.53 0.00 0.00 0.01 0.00 0.00 42.46 40.85 1twi s ILE 30 CO 0.03 0.34 0.02 0.47 0.00 0.00 0.00 174.94 175.80 1twi n ASP 31 N 4.76 -5.21 0.00 3.58 8.00 0.33 -0.67 116.55 127.34 1twi n ASP 31 Ca -0.16 0.04 0.00 0.00 0.71 0.00 0.00 54.79 55.39 1twi n ASP 31 Cb 0.49 -4.35 0.00 0.00 -0.02 0.00 0.00 41.12 37.23 1twi n ASP 31 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1twi n GLY 32 N -0.96 0.87 3.72 0.44 0.00 -1.26 -4.92 105.19 103.08 1twi n GLY 32 Ca -0.21 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.46 1twi n GLY 32 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1twi s TYR 33 N -3.48 3.37 0.04 1.61 2.02 0.15 -5.05 117.35 116.01 1twi s TYR 33 Ca 0.00 0.26 -0.30 0.00 -0.37 0.00 0.00 57.07 56.66 1twi s TYR 33 Cb 0.00 -2.06 -0.08 0.00 -0.40 0.00 0.00 41.96 39.42 1twi s TYR 33 CO 0.00 0.34 1.81 0.34 -1.57 0.00 0.00 175.55 176.47 1twi s ASP 34 N 0.00 6.52 0.21 2.29 -1.08 -1.26 -1.45 116.67 121.90 1twi s ASP 34 Ca 0.08 2.56 -0.06 0.00 -0.52 0.00 0.00 52.55 54.61 1twi s ASP 34 Cb -0.12 -2.55 0.16 0.00 -1.46 0.00 0.00 42.92 38.96 1twi s ASP 34 CO 0.00 -0.98 1.64 0.00 0.52 0.00 0.00 175.17 176.35 1twi h ALA 35 N 9.48 0.88 -0.66 3.66 0.00 -1.52 -1.25 119.26 129.85 1twi h ALA 35 Ca -0.45 -0.34 -0.04 0.00 0.00 0.00 0.00 54.91 54.07 1twi h ALA 35 Cb 1.21 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.80 1twi h ALA 35 CO 0.94 0.64 0.24 0.82 0.00 0.00 0.00 179.25 181.89 1twi h ILE 36 N 0.78 1.24 -0.25 0.00 2.04 -1.91 -0.74 117.51 118.66 1twi h ILE 36 Ca 0.12 -0.77 -0.12 0.00 1.00 0.00 0.00 64.86 65.10 1twi h ILE 36 Cb 0.66 0.46 -0.01 0.00 -0.74 0.00 0.00 36.82 37.19 1twi h ILE 36 CO 0.05 0.30 -0.33 -0.33 0.00 0.00 0.00 178.15 177.84 1twi h GLU 37 N 0.97 0.53 -0.34 2.37 5.08 -1.83 0.12 114.58 121.48 1twi h GLU 37 Ca 0.22 -0.24 -0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1twi h GLU 37 Cb 0.22 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 1twi h GLU 37 CO -0.02 0.80 0.20 -0.07 -1.00 0.00 0.00 179.01 178.92 1twi h LEU 38 N 0.46 0.42 -0.69 1.33 3.38 -0.65 0.32 115.31 119.87 1twi h LEU 38 Ca 0.05 -0.07 0.05 0.00 0.09 0.00 0.00 57.88 58.01 1twi h LEU 38 Cb 0.80 -0.11 -0.05 0.00 0.09 0.00 0.00 40.66 41.39 1twi h LEU 38 CO 0.06 0.37 0.40 0.00 0.09 0.00 0.00 178.44 179.36 1twi h ALA 39 N 1.07 0.92 -0.39 1.53 0.00 -0.76 -0.51 119.26 121.11 1twi h ALA 39 Ca 0.12 0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.95 1twi h ALA 39 Cb 0.04 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1twi h ALA 39 CO -0.02 0.09 -0.11 0.93 0.00 0.00 0.00 179.25 180.14 1twi h GLU 40 N 0.74 0.76 -0.29 0.00 5.08 -0.47 0.13 114.58 120.52 1twi h GLU 40 Ca 0.30 -0.30 -0.12 0.00 -1.00 0.00 0.00 59.36 58.24 1twi h GLU 40 Cb 0.16 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.36 1twi h GLU 40 CO -0.17 0.91 -0.28 -0.22 -1.00 0.00 0.00 179.01 178.24 1twi h LYS 41 N 0.57 0.71 0.00 2.33 3.64 -0.72 -3.35 116.57 119.75 1twi h LYS 41 Ca 0.10 -0.37 0.00 0.00 -1.27 0.00 0.00 60.65 59.10 1twi h LYS 41 Cb 0.64 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.47 1twi h LYS 41 CO 0.04 0.99 -1.08 1.19 -2.27 0.00 0.00 179.45 178.32 1twi n PHE 42 N -4.26 0.00 0.00 1.91 3.72 -0.22 -5.10 117.46 113.51 1twi n PHE 42 Ca -0.04 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.36 1twi n PHE 42 Cb 0.47 -0.09 0.00 0.00 -0.94 0.00 0.00 39.48 38.92 1twi n PHE 42 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1twi n GLY 43 N 1.44 -0.38 3.43 1.37 0.00 0.44 -4.98 105.19 106.51 1twi n GLY 43 Ca 0.02 -1.66 -0.26 0.00 0.00 0.00 0.00 46.02 44.12 1twi n GLY 43 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1twi s THR 44 N -2.91 2.35 0.74 2.61 -4.23 -1.26 -4.24 115.64 108.71 1twi s THR 44 Ca 0.00 -2.15 -0.12 0.00 -1.18 0.00 0.00 61.69 58.24 1twi s THR 44 Cb 0.00 -2.16 0.04 0.00 1.34 0.00 0.00 72.50 71.72 1twi s THR 44 CO 0.00 -0.22 1.10 -2.16 -0.54 0.00 0.00 174.62 172.80 1twi s PRO 45 N -2.95 2.37 -0.13 3.99 0.04 -1.26 -4.96 135.00 132.10 1twi s PRO 45 Ca 0.23 1.28 -0.05 0.00 0.04 0.00 0.00 61.00 62.51 1twi s PRO 45 Cb -0.07 -1.90 0.06 0.00 0.04 0.00 0.00 34.50 32.63 1twi s PRO 45 CO 0.11 -1.57 0.27 -1.17 0.04 0.00 0.00 177.00 174.68 1twi s LEU 46 N -5.58 -0.11 0.10 -3.56 2.96 -0.66 -4.11 118.68 107.72 1twi s LEU 46 Ca 0.64 0.60 -0.23 0.00 -0.22 0.00 0.00 54.13 54.92 1twi s LEU 46 Cb -0.19 0.76 -0.07 0.00 0.50 0.00 0.00 46.19 47.19 1twi s LEU 46 CO 0.51 -0.22 0.69 -0.31 -1.32 0.00 0.00 176.35 175.71 1twi s TYR 47 N 2.06 3.83 -0.12 5.38 2.02 -0.92 0.06 117.35 129.66 1twi s TYR 47 Ca -0.02 1.46 0.02 0.00 -0.37 0.00 0.00 57.07 58.15 1twi s TYR 47 Cb -0.11 -2.68 0.02 0.00 -0.40 0.00 0.00 41.96 38.78 1twi s TYR 47 CO -0.09 0.48 -0.16 0.08 -1.57 0.00 0.00 175.55 174.29 1twi s VAL 48 N -0.85 1.61 -0.16 0.71 1.01 0.10 -0.88 120.40 121.95 1twi s VAL 48 Ca 0.34 -0.70 -0.01 0.00 0.00 0.00 0.00 61.98 61.60 1twi s VAL 48 Cb -0.21 -1.47 -0.01 0.00 0.00 0.00 0.00 36.38 34.69 1twi s VAL 48 CO 0.23 0.46 -0.11 -0.04 0.00 0.00 0.00 175.10 175.64 1twi s MET 49 N 1.05 3.38 -0.35 2.72 -1.94 0.12 -0.62 119.30 123.67 1twi s MET 49 Ca -0.04 -0.67 -0.22 0.00 -1.71 0.00 0.00 55.69 53.05 1twi s MET 49 Cb -0.15 -2.74 0.00 0.00 2.01 0.00 0.00 34.83 33.95 1twi s MET 49 CO -0.03 0.09 0.71 0.45 -0.01 0.00 0.00 175.02 176.22 1twi s SER 50 N 0.69 6.51 0.17 3.03 0.15 0.63 -0.88 113.70 124.00 1twi s SER 50 Ca -0.05 0.33 -0.12 0.00 0.70 0.00 0.00 55.95 56.80 1twi s SER 50 Cb -0.15 -2.36 0.08 0.00 -1.71 0.00 0.00 66.02 61.88 1twi s SER 50 CO 0.02 -0.63 1.75 -0.08 1.20 0.00 0.00 173.24 175.50 1twi h GLU 51 N 8.39 0.88 -0.32 5.44 4.81 -1.52 -2.74 114.58 129.52 1twi h GLU 51 Ca -0.26 -0.14 -0.08 0.00 -0.13 0.00 0.00 59.36 58.76 1twi h GLU 51 Cb 1.10 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 30.31 1twi h GLU 51 CO 0.87 0.72 -0.13 0.93 -0.73 0.00 0.00 179.01 180.67 1twi h GLU 52 N 0.83 0.55 -0.63 1.92 4.39 -1.93 -1.97 114.58 117.74 1twi h GLU 52 Ca 0.20 -0.17 -0.02 0.00 0.34 0.00 0.00 59.36 59.72 1twi h GLU 52 Cb 0.15 -0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 28.71 1twi h GLU 52 CO -0.02 0.67 0.32 0.37 -1.16 0.00 0.00 179.01 179.18 1twi h GLN 53 N 0.50 0.90 -0.52 2.33 5.75 -1.89 0.20 115.11 122.38 1twi h GLN 53 Ca 0.09 -0.12 0.01 0.00 -0.15 0.00 0.00 58.65 58.48 1twi h GLN 53 Cb 0.52 -0.17 -0.03 0.00 1.07 0.00 0.00 27.48 28.87 1twi h GLN 53 CO 0.03 0.71 0.33 0.82 -2.65 0.00 0.00 178.83 178.07 1twi h ILE 54 N 0.86 1.10 -0.84 2.39 2.04 -1.18 -0.05 117.51 121.83 1twi h ILE 54 Ca 0.22 -0.23 -0.01 0.00 1.00 0.00 0.00 64.86 65.84 1twi h ILE 54 Cb 0.09 0.37 -0.04 0.00 -0.74 0.00 0.00 36.82 36.50 1twi h ILE 54 CO -0.03 0.12 0.50 0.11 0.00 0.00 0.00 178.15 178.85 1twi h LYS 55 N 0.67 1.15 -0.62 2.37 1.57 -0.93 -0.31 116.57 120.47 1twi h LYS 55 Ca 0.20 -0.11 -0.05 0.00 -1.87 0.00 0.00 60.65 58.82 1twi h LYS 55 Cb -0.04 -0.24 -0.03 0.00 0.08 0.00 0.00 32.23 32.01 1twi h LYS 55 CO -0.06 0.81 0.18 0.82 -0.57 0.00 0.00 179.45 180.63 1twi h ILE 56 N 1.16 1.25 -0.44 1.86 2.04 -0.51 0.17 117.51 123.03 1twi h ILE 56 Ca 0.30 -0.86 -0.07 0.00 1.00 0.00 0.00 64.86 65.24 1twi h ILE 56 Cb -0.04 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 36.66 1twi h ILE 56 CO -0.06 0.33 0.01 0.78 0.00 0.00 0.00 178.15 179.20 1twi h ASN 57 N 0.89 0.77 -0.24 1.72 2.35 -0.55 -1.24 115.58 119.27 1twi h ASN 57 Ca 0.20 -0.30 -0.04 0.00 -0.55 0.00 0.00 56.30 55.60 1twi h ASN 57 Cb 0.31 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.46 1twi h ASN 57 CO -0.00 0.88 -0.01 0.22 -1.65 0.00 0.00 177.43 176.87 1twi h TYR 58 N 0.63 0.47 -0.12 1.19 3.20 -0.96 -2.79 116.97 118.59 1twi h TYR 58 Ca 0.13 -0.09 -0.01 0.00 3.14 0.00 0.00 58.73 61.91 1twi h TYR 58 Cb 0.49 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.63 1twi h TYR 58 CO 0.04 0.61 0.05 -0.91 -1.64 0.00 0.00 178.16 176.31 1twi h ASN 59 N 0.19 0.14 -0.80 -2.11 2.35 -0.85 -1.26 115.58 113.24 1twi h ASN 59 Ca 0.07 -0.01 -0.04 0.00 -0.55 0.00 0.00 56.30 55.77 1twi h ASN 59 Cb 0.43 -0.04 -0.04 0.00 0.05 0.00 0.00 38.32 38.73 1twi h ASN 59 CO 0.01 0.13 0.36 0.03 -1.65 0.00 0.00 177.43 176.32 1twi h ARG 60 N 0.16 1.17 -0.38 0.81 3.08 -0.95 0.05 114.38 118.32 1twi h ARG 60 Ca 0.04 -0.19 -0.08 0.00 0.07 0.00 0.00 59.98 59.83 1twi h ARG 60 Cb 0.03 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 29.87 1twi h ARG 60 CO -0.01 0.92 -0.06 1.88 -1.07 0.00 0.00 179.97 181.63 1twi h TYR 61 N 1.15 0.79 -0.15 3.04 0.05 -1.18 -0.43 116.97 120.24 1twi h TYR 61 Ca 0.27 -0.16 0.01 0.00 0.05 0.00 0.00 58.73 58.90 1twi h TYR 61 Cb 0.16 -0.20 -0.01 0.00 1.01 0.00 0.00 36.73 37.68 1twi h TYR 61 CO 0.02 0.84 0.06 0.82 -1.05 0.00 0.00 178.16 178.84 1twi h ILE 62 N 0.52 0.98 -0.65 -2.88 1.08 -0.93 -0.39 117.51 115.23 1twi h ILE 62 Ca 0.10 -0.05 -0.08 0.00 -0.39 0.00 0.00 64.86 64.44 1twi h ILE 62 Cb 0.56 0.83 -0.03 0.00 -3.07 0.00 0.00 36.82 35.12 1twi h ILE 62 CO 0.03 0.02 0.08 -0.08 -0.69 0.00 0.00 178.15 177.52 1twi h GLU 63 N 0.13 1.09 -0.12 2.37 4.57 -0.96 -1.29 114.58 120.39 1twi h GLU 63 Ca 0.06 -0.30 -0.11 0.00 -1.18 0.00 0.00 59.36 57.83 1twi h GLU 63 Cb 0.03 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 28.48 1twi h GLU 63 CO -0.06 1.01 -0.40 0.00 -1.18 0.00 0.00 179.01 178.38 1twi h ALA 64 N 1.06 1.10 -0.27 2.92 0.00 -0.79 -3.27 119.26 120.01 1twi h ALA 64 Ca 0.20 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1twi h ALA 64 Cb 0.47 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1twi h ALA 64 CO 0.02 0.59 0.00 1.19 0.00 0.00 0.00 179.25 181.05 1twi n PHE 65 N -4.03 0.34 0.31 0.00 3.72 -0.18 -4.46 117.46 113.16 1twi n PHE 65 Ca -0.01 -0.23 0.18 0.00 -0.05 0.00 0.00 57.45 57.34 1twi n PHE 65 Cb 0.48 -0.01 1.00 0.00 -0.94 0.00 0.00 39.48 40.01 1twi n PHE 65 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 1twi h LYS 66 N 3.37 0.00 -0.36 -1.08 2.10 -1.29 -0.17 116.57 119.14 1twi h LYS 66 Ca 0.00 0.00 0.05 0.00 -2.00 0.00 0.00 60.65 58.70 1twi h LYS 66 Cb 0.80 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.11 1twi h LYS 66 CO 0.00 0.02 0.24 -0.09 -2.00 0.00 0.00 179.45 177.62 1twi h ARG 67 N 0.00 0.25 -0.18 0.07 2.43 -1.83 -2.84 114.38 112.28 1twi h ARG 67 Ca -0.00 -0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.18 1twi h ARG 67 Cb 0.10 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.57 1twi h ARG 67 CO 0.00 0.16 0.03 2.35 -1.51 0.00 0.00 179.97 181.01 1twi h TRP 68 N 0.26 0.05 -0.51 2.20 2.91 -1.35 0.96 115.95 120.47 1twi h TRP 68 Ca 0.16 0.01 -0.13 0.00 1.13 0.00 0.00 58.89 60.06 1twi h TRP 68 Cb 0.30 0.00 -0.01 0.00 -0.51 0.00 0.00 29.16 28.94 1twi h TRP 68 CO -0.00 0.02 -0.18 1.49 -1.03 0.00 0.00 178.44 178.74 1twi h GLU 69 N 0.10 1.01 -0.59 2.65 4.57 -1.65 -0.23 114.58 120.45 1twi h GLU 69 Ca 0.08 -0.41 -0.05 0.00 -1.18 0.00 0.00 59.36 57.80 1twi h GLU 69 Cb 0.08 -0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 28.60 1twi h GLU 69 CO -0.11 1.10 0.16 0.93 -1.18 0.00 0.00 179.01 179.90 1twi h GLU 70 N 0.88 0.90 0.00 1.92 5.08 -1.22 0.18 114.58 122.33 1twi h GLU 70 Ca 0.12 -0.18 -0.11 0.00 -1.00 0.00 0.00 59.36 58.19 1twi h GLU 70 Cb 0.76 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.85 1twi h GLU 70 CO 0.06 0.80 -1.36 0.39 -1.00 0.00 0.00 179.01 177.90 1twi n GLU 71 N -4.27 0.62 -0.00 2.33 1.02 0.30 -4.49 120.64 116.14 1twi n GLU 71 Ca 0.04 0.15 0.03 0.00 -0.02 0.00 0.00 57.16 57.36 1twi n GLU 71 Cb 0.23 -1.78 -0.04 0.00 -0.02 0.00 0.00 31.44 29.83 1twi n GLU 71 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1twi n THR 72 N -2.76 0.00 -0.92 2.62 -2.24 -0.11 -5.00 114.28 105.87 1twi n THR 72 Ca -0.07 -0.20 0.00 0.00 -2.27 0.00 0.00 64.05 61.52 1twi n THR 72 Cb 0.73 0.56 0.00 0.00 -2.10 0.00 0.00 70.33 69.52 1twi n THR 72 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1twi n GLY 73 N 1.89 0.71 3.99 3.38 0.00 0.64 -5.00 105.19 110.79 1twi n GLY 73 Ca -0.00 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 1twi n GLY 73 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1twi s LYS 74 N -0.25 2.38 0.27 1.61 -0.14 -1.26 -5.01 119.74 117.34 1twi s LYS 74 Ca 0.00 -1.01 -0.09 0.00 -1.36 0.00 0.00 55.97 53.51 1twi s LYS 74 Cb 0.00 -2.51 -0.07 0.00 -1.68 0.00 0.00 37.83 33.57 1twi s LYS 74 CO 0.00 -0.82 0.59 -2.00 -0.76 0.00 0.00 175.35 172.36 1twi s GLU 75 N -4.77 3.77 -0.13 1.68 2.12 -1.26 -3.94 118.70 116.17 1twi s GLU 75 Ca 0.59 0.26 0.03 0.00 0.36 0.00 0.00 54.97 56.21 1twi s GLU 75 Cb -0.09 -2.60 0.00 0.00 0.26 0.00 0.00 34.13 31.70 1twi s GLU 75 CO 0.39 0.24 -0.22 0.12 -0.54 0.00 0.00 175.26 175.26 1twi s PHE 76 N -1.95 2.65 -0.05 5.30 5.36 -1.26 -0.68 117.98 127.35 1twi s PHE 76 Ca 0.47 -1.19 0.04 0.00 -0.96 0.00 0.00 56.93 55.30 1twi s PHE 76 Cb -0.11 -1.79 -0.00 0.00 -0.34 0.00 0.00 43.02 40.78 1twi s PHE 76 CO 0.24 -0.52 -0.17 0.42 -1.46 0.00 0.00 175.22 173.73 1twi s ILE 77 N 0.64 1.44 -0.34 3.12 1.01 -0.37 -4.99 121.20 121.72 1twi s ILE 77 Ca -0.11 -0.72 -0.15 0.00 0.00 0.00 0.00 60.65 59.68 1twi s ILE 77 Cb -0.16 -1.25 -0.01 0.00 0.01 0.00 0.00 42.46 41.05 1twi s ILE 77 CO 0.02 0.42 0.35 -0.69 0.00 0.00 0.00 174.94 175.03 1twi s VAL 78 N 0.10 5.18 -0.62 2.92 1.01 -1.26 -1.45 120.40 126.28 1twi s VAL 78 Ca -0.05 0.03 -0.11 0.00 0.00 0.00 0.00 61.98 61.85 1twi s VAL 78 Cb -0.12 -3.80 0.16 0.00 0.00 0.00 0.00 36.38 32.61 1twi s VAL 78 CO 0.03 -0.07 0.53 0.00 0.00 0.00 0.00 175.10 175.58 1twi s ALA 79 N 1.98 3.70 0.15 5.51 0.00 0.15 0.21 121.76 133.46 1twi s ALA 79 Ca 0.11 -2.89 -0.33 0.00 0.00 0.00 0.00 51.96 48.85 1twi s ALA 79 Cb -0.17 -3.12 -0.13 0.00 0.00 0.00 0.00 23.12 19.71 1twi s ALA 79 CO 0.11 -2.08 1.68 0.98 0.00 0.00 0.00 175.76 176.46 1twi n TYR 80 N 4.48 2.47 -2.37 0.00 9.36 -0.66 -3.71 117.16 126.73 1twi n TYR 80 Ca -0.00 0.12 -0.40 0.00 3.32 0.00 0.00 57.90 60.94 1twi n TYR 80 Cb 0.42 -2.62 -0.03 0.00 -0.63 0.00 0.00 39.34 36.48 1twi n TYR 80 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1twi s ALA 81 N 1.53 2.53 0.54 2.98 0.00 -0.31 -0.61 121.76 128.41 1twi s ALA 81 Ca 0.79 -1.21 0.30 0.00 0.00 0.00 0.00 51.96 51.84 1twi s ALA 81 Cb -0.60 -4.30 1.46 0.00 0.00 0.00 0.00 23.12 19.68 1twi s ALA 81 CO 0.37 -3.56 1.91 1.88 0.00 0.00 0.00 175.76 176.37 1twi h TYR 82 N 11.61 0.00 -0.05 0.00 -1.99 -1.72 -1.75 116.97 123.07 1twi h TYR 82 Ca -0.23 0.00 0.01 0.00 2.00 0.00 0.00 58.73 60.52 1twi h TYR 82 Cb 1.08 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.81 1twi h TYR 82 CO 1.12 0.00 0.10 1.57 -0.00 0.00 0.00 178.16 180.95 1twi h LYS 83 N 0.00 0.00 -0.06 4.88 2.10 -1.90 -0.31 116.57 121.28 1twi h LYS 83 Ca 0.37 0.00 -0.16 0.00 -2.00 0.00 0.00 60.65 58.86 1twi h LYS 83 Cb 1.51 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.83 1twi h LYS 83 CO -0.00 0.00 -0.68 0.00 -2.00 0.00 0.00 179.45 176.77 1twi h ALA 84 N 1.84 0.73 -0.01 0.07 0.00 -1.69 -3.42 119.26 116.79 1twi h ALA 84 Ca 0.02 -0.59 0.31 0.00 0.00 0.00 0.00 54.91 54.65 1twi h ALA 84 Cb 0.22 -0.08 -0.22 0.00 0.00 0.00 0.00 17.79 17.72 1twi h ALA 84 CO -0.00 0.77 0.35 1.21 0.00 0.00 0.00 179.25 181.57 1twi s ASN 85 N -6.92 -0.01 -0.27 0.00 3.84 -0.14 -0.87 114.94 110.58 1twi s ASN 85 Ca -0.04 0.01 0.10 0.00 0.21 0.00 0.00 52.86 53.14 1twi s ASN 85 Cb 0.11 1.01 0.49 0.00 -0.55 0.00 0.00 41.25 42.31 1twi s ASN 85 CO 0.81 -0.00 1.43 0.00 -2.79 0.00 0.00 177.10 176.55 1twi n ALA 86 N 5.43 4.02 -1.71 1.71 0.00 -1.17 -4.78 120.51 124.00 1twi n ALA 86 Ca -0.10 -3.04 -0.43 0.00 0.00 0.00 0.00 53.44 49.88 1twi n ALA 86 Cb 0.55 -0.69 -0.01 0.00 0.00 0.00 0.00 19.45 19.30 1twi n ALA 86 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1twi n ASN 87 N -1.07 3.16 0.24 0.00 2.85 -1.26 -4.78 115.26 114.40 1twi n ASN 87 Ca 0.30 1.18 0.07 0.00 -0.11 0.00 0.00 54.58 56.03 1twi n ASN 87 Cb 0.97 -1.52 0.59 0.00 1.24 0.00 0.00 39.78 41.07 1twi n ASN 87 CO 0.00 0.00 0.00 0.25 -2.11 0.00 0.00 177.26 175.40 1twi h LEU 88 N 3.47 0.00 -0.11 1.20 5.85 -1.96 0.38 115.31 124.14 1twi h LEU 88 Ca -0.47 0.00 -0.20 0.00 0.84 0.00 0.00 57.88 58.06 1twi h LEU 88 Cb 1.26 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.30 1twi h LEU 88 CO 0.69 0.12 -0.70 0.00 -0.34 0.00 0.00 178.44 178.22 1twi h ALA 89 N 1.88 0.24 -0.59 1.25 0.00 -1.89 -1.47 119.26 118.67 1twi h ALA 89 Ca -0.00 -0.57 -0.09 0.00 0.00 0.00 0.00 54.91 54.25 1twi h ALA 89 Cb 0.23 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1twi h ALA 89 CO 0.02 0.56 0.03 0.82 0.00 0.00 0.00 179.25 180.67 1twi h ILE 90 N 0.34 1.26 -0.11 0.00 1.08 -1.59 -0.75 117.51 117.75 1twi h ILE 90 Ca -0.06 -1.10 -0.15 0.00 -0.39 0.00 0.00 64.86 63.17 1twi h ILE 90 Cb 1.34 0.80 -0.01 0.00 -3.07 0.00 0.00 36.82 35.88 1twi h ILE 90 CO 0.14 0.40 -0.56 0.71 -0.69 0.00 0.00 178.15 178.15 1twi h THR 91 N 0.92 1.36 -0.37 -0.27 1.35 -0.97 -1.27 112.91 113.65 1twi h THR 91 Ca 0.17 -1.87 -0.13 0.00 -0.55 0.00 0.00 66.41 64.04 1twi h THR 91 Cb 0.51 1.89 -0.01 0.00 -1.73 0.00 0.00 68.15 68.81 1twi h THR 91 CO 0.02 0.56 -0.28 0.03 -0.25 0.00 0.00 175.52 175.60 1twi h ARG 92 N 0.25 0.79 0.44 4.72 3.08 -1.06 0.11 114.38 122.72 1twi h ARG 92 Ca 0.00 -0.35 -0.01 0.00 0.07 0.00 0.00 59.98 59.69 1twi h ARG 92 Cb 1.07 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 31.09 1twi h ARG 92 CO 0.09 0.97 -0.29 1.25 -1.07 0.00 0.00 179.97 180.93 1twi h LEU 93 N 0.67 -0.72 -1.04 3.04 5.85 -0.89 -0.26 115.31 121.96 1twi h LEU 93 Ca 0.08 0.05 0.03 0.00 0.84 0.00 0.00 57.88 58.88 1twi h LEU 93 Cb 0.81 0.22 -0.06 0.00 0.37 0.00 0.00 40.66 42.00 1twi h LEU 93 CO 0.07 -0.45 0.64 -0.07 -0.34 0.00 0.00 178.44 178.30 1twi h LEU 94 N -0.70 1.08 -0.66 2.25 3.38 -1.10 -1.92 115.31 117.64 1twi h LEU 94 Ca -0.05 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 1twi h LEU 94 Cb 0.58 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.05 1twi h LEU 94 CO 0.04 0.74 0.37 0.00 0.09 0.00 0.00 178.44 179.69 1twi h ALA 95 N 1.42 0.84 0.00 1.53 0.00 -0.74 -1.97 119.26 120.34 1twi h ALA 95 Ca 0.38 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.17 1twi h ALA 95 Cb -0.02 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.50 1twi h ALA 95 CO -0.11 0.34 -0.10 0.87 0.00 0.00 0.00 179.25 180.25 1twi h LYS 96 N 0.89 0.00 0.00 0.00 1.57 -0.31 -1.02 116.57 117.70 1twi h LYS 96 Ca 0.23 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.01 1twi h LYS 96 Cb 0.02 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.33 1twi h LYS 96 CO -0.04 0.10 0.00 1.28 -0.57 0.00 0.00 179.45 180.22 1twi n LEU 97 N -3.69 0.00 0.00 2.94 4.77 -0.80 -4.88 117.00 115.33 1twi n LEU 97 Ca -0.02 0.37 0.00 0.00 -0.03 0.00 0.00 56.01 56.33 1twi n LEU 97 Cb 0.21 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 40.93 1twi n LEU 97 CO 0.30 -0.03 0.00 0.61 -1.33 0.00 0.00 177.39 176.94 1twi n GLY 98 N 1.15 0.86 3.81 -0.72 0.00 -0.38 -5.08 105.19 104.82 1twi n GLY 98 Ca 0.10 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 1twi n GLY 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1twi n GLY 100 N -0.69 1.45 3.19 0.00 0.00 0.13 -4.47 105.19 104.80 1twi n GLY 100 Ca 0.08 -1.99 -0.12 0.00 0.00 0.00 0.00 46.02 43.99 1twi n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1twi s ALA 101 N -2.34 -0.80 -0.34 4.61 0.00 0.03 -1.65 121.76 121.28 1twi s ALA 101 Ca 0.00 1.07 -0.09 0.00 0.00 0.00 0.00 51.96 52.94 1twi s ALA 101 Cb 0.00 -0.64 0.02 0.00 0.00 0.00 0.00 23.12 22.50 1twi s ALA 101 CO 0.00 -0.19 0.16 0.34 0.00 0.00 0.00 175.76 176.07 1twi s ASP 102 N 0.71 5.53 0.06 0.00 2.15 0.22 -1.08 116.67 124.25 1twi s ASP 102 Ca -0.04 -0.87 0.06 0.00 0.43 0.00 0.00 52.55 52.12 1twi s ASP 102 Cb -0.06 -1.97 -0.04 0.00 -0.30 0.00 0.00 42.92 40.56 1twi s ASP 102 CO -0.05 -0.30 -0.10 0.68 -0.17 0.00 0.00 175.17 175.23 1twi s VAL 103 N 1.53 3.38 -0.05 1.11 -7.23 -0.46 -2.07 120.40 116.61 1twi s VAL 103 Ca 0.02 -1.07 0.06 0.00 -1.81 0.00 0.00 61.98 59.18 1twi s VAL 103 Cb -0.18 -2.51 0.10 0.00 0.56 0.00 0.00 36.38 34.34 1twi s VAL 103 CO 0.05 0.26 1.05 1.33 -0.31 0.00 0.00 175.10 177.48 1twi n VAL 104 N 1.17 1.28 -3.56 1.32 0.24 -1.26 -0.38 118.33 117.13 1twi n VAL 104 Ca -0.15 -1.39 -0.10 0.00 -2.04 0.00 0.00 64.34 60.67 1twi n VAL 104 Cb 0.52 0.27 -0.02 0.00 -1.47 0.00 0.00 33.84 33.14 1twi n VAL 104 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1twi s SER 105 N -1.58 -0.44 0.37 -1.34 1.04 -1.26 -4.71 113.70 105.78 1twi s SER 105 Ca 0.10 -0.18 0.08 0.00 0.48 0.00 0.00 55.95 56.43 1twi s SER 105 Cb 0.09 0.60 0.80 0.00 0.10 0.00 0.00 66.02 67.60 1twi s SER 105 CO 0.01 -1.01 1.92 1.23 0.98 0.00 0.00 173.24 176.37 1twi h GLY 106 N 2.00 1.01 0.96 7.32 0.00 -1.97 -0.79 103.07 111.61 1twi h GLY 106 Ca -0.28 -0.29 -0.02 0.00 0.00 0.00 0.00 47.33 46.74 1twi h GLY 106 CO 0.32 0.17 0.20 -1.33 0.00 0.00 0.00 176.54 175.90 1twi h GLY 107 N 0.70 0.65 1.59 4.60 0.00 -1.99 0.10 103.07 108.72 1twi h GLY 107 Ca 0.36 -0.32 -0.16 0.00 0.00 0.00 0.00 47.33 47.21 1twi h GLY 107 CO -0.14 0.31 -0.60 0.83 0.00 0.00 0.00 176.54 176.94 1twi h GLU 108 N 0.54 0.43 -0.49 4.80 5.08 -1.75 -2.19 114.58 121.00 1twi h GLU 108 Ca 0.15 -0.29 -0.02 0.00 -1.00 0.00 0.00 59.36 58.19 1twi h GLU 108 Cb 0.12 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 1twi h GLU 108 CO -0.02 0.90 0.21 1.25 -1.00 0.00 0.00 179.01 180.35 1twi h LEU 109 N 0.32 0.66 -0.34 1.33 5.85 -0.96 0.51 115.31 122.67 1twi h LEU 109 Ca -0.00 -0.15 0.06 0.00 0.84 0.00 0.00 57.88 58.63 1twi h LEU 109 Cb 1.13 -0.17 -0.06 0.00 0.37 0.00 0.00 40.66 41.94 1twi h LEU 109 CO 0.10 0.63 -0.02 0.22 -0.34 0.00 0.00 178.44 179.03 1twi h TYR 110 N 0.64 -0.05 -0.73 1.25 3.20 -0.81 -0.94 116.97 119.52 1twi h TYR 110 Ca 0.16 0.03 -0.06 0.00 3.14 0.00 0.00 58.73 62.01 1twi h TYR 110 Cb 0.16 0.08 -0.03 0.00 1.54 0.00 0.00 36.73 38.48 1twi h TYR 110 CO -0.00 -0.08 0.24 0.82 -1.64 0.00 0.00 178.16 177.49 1twi h ILE 111 N 0.08 1.26 -0.76 1.81 2.04 -1.03 -0.77 117.51 120.13 1twi h ILE 111 Ca 0.17 -0.88 -0.04 0.00 1.00 0.00 0.00 64.86 65.11 1twi h ILE 111 Cb 0.24 0.44 -0.03 0.00 -0.74 0.00 0.00 36.82 36.72 1twi h ILE 111 CO -0.30 0.35 0.34 0.00 0.00 0.00 0.00 178.15 178.54 1twi h ALA 112 N 1.17 0.98 -0.29 1.87 0.00 -0.24 0.24 119.26 123.00 1twi h ALA 112 Ca 0.24 -0.17 -0.18 0.00 0.00 0.00 0.00 54.91 54.79 1twi h ALA 112 Cb 0.29 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1twi h ALA 112 CO -0.01 0.58 -0.54 0.87 0.00 0.00 0.00 179.25 180.15 1twi h LYS 113 N 1.08 0.87 0.00 0.00 1.79 -1.06 -1.30 116.57 117.96 1twi h LYS 113 Ca 0.26 -0.55 0.00 0.00 -2.18 0.00 0.00 60.65 58.17 1twi h LYS 113 Cb 0.16 0.06 0.00 0.00 -1.58 0.00 0.00 32.23 30.88 1twi h LYS 113 CO -0.03 1.19 0.00 1.28 -1.08 0.00 0.00 179.45 180.81 1twi n LEU 114 N -4.02 0.29 -0.90 2.94 4.77 -0.31 -1.46 117.00 118.31 1twi n LEU 114 Ca -0.04 0.56 0.11 0.00 -0.03 0.00 0.00 56.01 56.61 1twi n LEU 114 Cb 0.62 -0.51 0.27 0.00 -2.33 0.00 0.00 43.42 41.47 1twi n LEU 114 CO 0.50 -0.32 0.73 -1.20 -1.33 0.00 0.00 177.39 175.76 1twi n SER 115 N -1.81 2.71 -1.42 -1.43 7.64 0.80 -4.95 113.62 115.17 1twi n SER 115 Ca 0.04 -1.88 -0.13 0.00 1.01 0.00 0.00 58.87 57.91 1twi n SER 115 Cb 0.23 -0.17 -0.01 0.00 -1.01 0.00 0.00 64.21 63.25 1twi n SER 115 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1twi n ASN 116 N 1.02 -4.11 -4.70 6.43 5.15 -0.53 -4.68 115.26 113.85 1twi n ASN 116 Ca 0.18 0.03 -0.42 0.00 -0.60 0.00 0.00 54.58 53.76 1twi n ASN 116 Cb 0.50 -3.23 -0.03 0.00 -0.53 0.00 0.00 39.78 36.49 1twi n ASN 116 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1twi s VAL 117 N -2.63 4.47 0.30 3.44 1.01 -0.54 -4.95 120.40 121.50 1twi s VAL 117 Ca 0.00 1.77 -0.30 0.00 0.00 0.00 0.00 61.98 63.45 1twi s VAL 117 Cb 0.00 -4.14 -0.12 0.00 0.00 0.00 0.00 36.38 32.12 1twi s VAL 117 CO 0.00 0.06 1.54 -2.65 0.00 0.00 0.00 175.10 174.05 1twi n PRO 118 N 4.56 2.57 -0.30 2.72 -0.02 -1.26 -4.70 135.00 138.56 1twi n PRO 118 Ca 0.09 0.91 0.12 0.00 -2.02 0.00 0.00 63.50 62.60 1twi n PRO 118 Cb 0.48 -2.66 0.35 0.00 -0.02 0.00 0.00 33.50 31.66 1twi n PRO 118 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 1twi h SER 119 N 4.36 0.71 0.14 2.55 0.02 -1.87 0.15 113.55 119.61 1twi h SER 119 Ca -0.47 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.53 1twi h SER 119 Cb 1.24 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 63.70 1twi h SER 119 CO 0.76 0.33 0.00 2.29 -1.14 0.00 0.00 176.83 179.07 1twi n LYS 120 N -4.61 0.32 -0.29 3.45 2.85 -1.26 -1.64 118.16 116.97 1twi n LYS 120 Ca 0.19 0.08 0.08 0.00 -1.05 0.00 0.00 58.31 57.61 1twi n LYS 120 Cb 0.50 -1.50 0.20 0.00 -0.65 0.00 0.00 35.03 33.58 1twi n LYS 120 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 1twi n LYS 121 N -1.15 2.55 -4.25 -1.58 5.02 0.52 -4.57 118.16 114.69 1twi n LYS 121 Ca 0.09 -2.59 -0.34 0.00 -2.02 0.00 0.00 58.31 53.45 1twi n LYS 121 Cb 0.08 -1.63 -0.12 0.00 -0.02 0.00 0.00 35.03 33.34 1twi n LYS 121 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1twi s ILE 122 N -2.47 4.00 0.04 -0.18 1.01 -0.65 -0.79 121.20 122.15 1twi s ILE 122 Ca 0.35 -0.31 0.09 0.00 0.00 0.00 0.00 60.65 60.77 1twi s ILE 122 Cb 0.28 -2.78 -0.03 0.00 0.01 0.00 0.00 42.46 39.94 1twi s ILE 122 CO 0.08 0.47 -0.25 0.68 0.00 0.00 0.00 174.94 175.92 1twi s VAL 123 N 0.59 2.01 -0.29 2.92 -7.23 -0.24 -1.28 120.40 116.87 1twi s VAL 123 Ca -0.01 -1.30 -0.03 0.00 -1.81 0.00 0.00 61.98 58.83 1twi s VAL 123 Cb -0.14 -1.71 0.04 0.00 0.56 0.00 0.00 36.38 35.12 1twi s VAL 123 CO 0.02 0.35 0.00 0.12 -0.31 0.00 0.00 175.10 175.29 1twi s PHE 124 N -0.77 3.20 0.35 2.82 2.19 -0.18 -1.36 117.98 124.23 1twi s PHE 124 Ca 0.10 -1.65 0.04 0.00 0.33 0.00 0.00 56.93 55.76 1twi s PHE 124 Cb -0.10 -2.13 -0.01 0.00 -1.31 0.00 0.00 43.02 39.48 1twi s PHE 124 CO 0.02 -0.75 0.51 -0.80 1.83 0.00 0.00 175.22 176.02 1twi s ASN 125 N 1.31 6.01 0.00 6.13 0.01 0.49 -0.73 114.94 128.16 1twi s ASN 125 Ca -0.03 0.01 0.00 0.00 -0.71 0.00 0.00 52.86 52.13 1twi s ASN 125 Cb -0.19 -1.45 0.00 0.00 0.41 0.00 0.00 41.25 40.02 1twi s ASN 125 CO -0.01 -0.44 0.00 0.61 -1.51 0.00 0.00 177.10 175.75 1twi n GLY 126 N -1.72 4.58 0.49 0.66 0.00 -1.26 -4.19 105.19 103.75 1twi n GLY 126 Ca -0.01 -0.74 0.12 0.00 0.00 0.00 0.00 46.02 45.39 1twi n GLY 126 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1twi n ASN 127 N 0.00 1.82 -3.09 1.61 6.94 -1.26 -4.40 115.26 116.87 1twi n ASN 127 Ca 0.00 -1.40 -0.19 0.00 -0.02 0.00 0.00 54.58 52.97 1twi n ASN 127 Cb 0.00 0.26 -0.03 0.00 -2.36 0.00 0.00 39.78 37.65 1twi n ASN 127 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1twi s LYS 129 N -2.67 4.33 0.57 0.00 1.02 -1.26 -5.01 119.74 116.72 1twi s LYS 129 Ca 0.40 1.79 -0.04 0.00 0.02 0.00 0.00 55.97 58.14 1twi s LYS 129 Cb 0.35 -3.55 0.01 0.00 -0.52 0.00 0.00 37.83 34.12 1twi s LYS 129 CO -0.08 -0.48 0.86 0.95 -0.92 0.00 0.00 175.35 175.68 1twi s THR 130 N 2.21 3.55 0.25 2.17 -4.23 -1.26 -4.89 115.64 113.44 1twi s THR 130 Ca 0.59 -0.14 -0.04 0.00 -1.18 0.00 0.00 61.69 60.92 1twi s THR 130 Cb -0.27 -3.40 0.24 0.00 1.34 0.00 0.00 72.50 70.41 1twi s THR 130 CO 0.24 -0.38 1.86 0.50 -0.54 0.00 0.00 174.62 176.30 1twi h LYS 131 N -0.10 1.03 -0.94 3.99 3.64 -1.98 -0.16 116.57 122.06 1twi h LYS 131 Ca -0.45 -0.06 0.01 0.00 -1.27 0.00 0.00 60.65 58.88 1twi h LYS 131 Cb 1.26 -0.23 -0.05 0.00 -0.41 0.00 0.00 32.23 32.80 1twi h LYS 131 CO 0.60 0.68 0.62 1.49 -2.27 0.00 0.00 179.45 180.57 1twi h GLU 132 N 1.06 1.23 -0.27 1.90 4.81 -1.99 -0.31 114.58 121.00 1twi h GLU 132 Ca 0.40 -0.07 -0.11 0.00 -0.13 0.00 0.00 59.36 59.44 1twi h GLU 132 Cb 0.17 -0.28 -0.01 0.00 0.63 0.00 0.00 28.75 29.26 1twi h GLU 132 CO -0.17 0.81 -0.31 0.93 -0.73 0.00 0.00 179.01 179.54 1twi h GLU 133 N 1.27 0.57 -0.26 1.92 5.08 -1.59 -1.57 114.58 119.99 1twi h GLU 133 Ca 0.35 -0.24 -0.18 0.00 -1.00 0.00 0.00 59.36 58.29 1twi h GLU 133 Cb -0.13 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.10 1twi h GLU 133 CO -0.08 0.81 -0.54 0.82 -1.00 0.00 0.00 179.01 179.02 1twi h ILE 134 N 0.49 1.29 -0.45 3.13 2.04 -0.55 -1.44 117.51 122.01 1twi h ILE 134 Ca 0.06 -1.75 0.02 0.00 1.00 0.00 0.00 64.86 64.20 1twi h ILE 134 Cb 0.77 1.67 -0.03 0.00 -0.74 0.00 0.00 36.82 38.49 1twi h ILE 134 CO 0.06 0.56 0.26 0.40 0.00 0.00 0.00 178.15 179.43 1twi h ILE 135 N 0.59 1.03 -0.31 -0.67 2.04 -0.85 -0.80 117.51 118.54 1twi h ILE 135 Ca 0.01 -0.18 0.00 0.00 1.00 0.00 0.00 64.86 65.70 1twi h ILE 135 Cb 1.12 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 37.65 1twi h ILE 135 CO 0.11 0.09 0.20 0.24 0.00 0.00 0.00 178.15 178.80 1twi h MET 136 N 0.52 0.41 -0.92 2.37 2.86 -0.95 -0.74 114.93 118.49 1twi h MET 136 Ca 0.19 -0.03 0.01 0.00 -2.06 0.00 0.00 59.70 57.81 1twi h MET 136 Cb 0.04 -0.09 -0.05 0.00 0.06 0.00 0.00 31.60 31.56 1twi h MET 136 CO -0.10 0.28 0.61 0.78 1.06 0.00 0.00 176.91 179.54 1twi h GLY 137 N 0.41 1.30 0.76 8.32 0.00 -0.97 0.11 103.07 112.99 1twi h GLY 137 Ca 0.11 -0.48 -0.03 0.00 0.00 0.00 0.00 47.33 46.93 1twi h GLY 137 CO -0.02 0.47 -0.03 -2.22 0.00 0.00 0.00 176.54 174.73 1twi h ILE 138 N 1.24 1.29 -0.42 2.60 2.04 -0.89 -1.58 117.51 121.79 1twi h ILE 138 Ca 0.34 -0.98 -0.03 0.00 1.00 0.00 0.00 64.86 65.19 1twi h ILE 138 Cb -0.13 1.65 -0.02 0.00 -0.74 0.00 0.00 36.82 37.57 1twi h ILE 138 CO -0.08 0.29 0.13 -0.33 0.00 0.00 0.00 178.15 178.16 1twi h GLU 139 N -0.02 0.62 -0.00 2.37 4.39 -0.99 -1.02 114.58 119.93 1twi h GLU 139 Ca 0.04 -0.09 0.00 0.00 0.34 0.00 0.00 59.36 59.64 1twi h GLU 139 Cb 0.46 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.00 1twi h GLU 139 CO 0.01 0.54 -0.01 0.00 -1.16 0.00 0.00 179.01 178.40 1twi n ALA 140 N -2.47 2.66 -3.95 3.43 0.00 0.36 -4.93 120.51 115.61 1twi n ALA 140 Ca 0.03 -0.23 -0.25 0.00 0.00 0.00 0.00 53.44 52.99 1twi n ALA 140 Cb 0.17 -1.46 -0.02 0.00 0.00 0.00 0.00 19.45 18.15 1twi n ALA 140 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1twi n ASN 141 N -0.89 -0.48 -4.69 0.00 4.05 -0.39 -4.78 115.26 108.08 1twi n ASN 141 Ca 0.21 -1.00 -0.30 0.00 0.45 0.00 0.00 54.58 53.94 1twi n ASN 141 Cb 0.17 -3.10 0.15 0.00 1.23 0.00 0.00 39.78 38.23 1twi n ASN 141 CO 0.00 0.00 0.00 0.27 -3.05 0.00 0.00 177.26 174.48 1twi s ILE 142 N -3.92 2.55 0.22 -1.44 -4.36 -1.02 -4.43 121.20 108.79 1twi s ILE 142 Ca 0.03 0.18 -0.09 0.00 -0.26 0.00 0.00 60.65 60.51 1twi s ILE 142 Cb -0.02 -2.44 0.17 0.00 1.25 0.00 0.00 42.46 41.43 1twi s ILE 142 CO 0.89 -0.23 1.87 -0.09 0.24 0.00 0.00 174.94 177.62 1twi h ARG 143 N -1.69 1.07 -1.43 0.37 2.43 -0.34 -3.44 114.38 111.34 1twi h ARG 143 Ca -0.47 -0.08 0.11 0.00 -0.81 0.00 0.00 59.98 58.74 1twi h ARG 143 Cb 1.27 -0.23 -0.25 0.00 -0.42 0.00 0.00 29.97 30.33 1twi h ARG 143 CO 0.48 0.73 0.63 0.00 -1.51 0.00 0.00 179.97 180.30 1twi s ALA 144 N -6.05 -2.00 -0.09 2.80 0.00 -1.20 -4.73 121.76 110.49 1twi s ALA 144 Ca -0.13 1.71 -0.20 0.00 0.00 0.00 0.00 51.96 53.34 1twi s ALA 144 Cb 0.15 -1.11 -0.04 0.00 0.00 0.00 0.00 23.12 22.12 1twi s ALA 144 CO 0.79 -0.26 0.55 -0.06 0.00 0.00 0.00 175.76 176.78 1twi s PHE 145 N -0.70 3.55 -0.79 0.00 0.08 -0.72 -1.01 117.98 118.38 1twi s PHE 145 Ca 0.02 1.02 -0.19 0.00 0.12 0.00 0.00 56.93 57.91 1twi s PHE 145 Cb -0.02 -2.63 0.13 0.00 -0.57 0.00 0.00 43.02 39.93 1twi s PHE 145 CO -0.03 0.17 0.95 -0.80 -0.10 0.00 0.00 175.22 175.41 1twi s ASN 146 N 0.59 6.47 0.11 1.36 0.01 0.09 0.15 114.94 123.72 1twi s ASN 146 Ca 0.30 -1.82 -0.31 0.00 -0.71 0.00 0.00 52.86 50.31 1twi s ASN 146 Cb -0.16 -2.35 -0.08 0.00 0.41 0.00 0.00 41.25 39.06 1twi s ASN 146 CO 0.13 -1.07 1.49 -0.69 -1.51 0.00 0.00 177.10 175.45 1twi s VAL 147 N 2.56 3.11 -0.11 1.60 1.01 -0.20 -4.40 120.40 123.97 1twi s VAL 147 Ca 0.24 0.74 0.17 0.00 0.00 0.00 0.00 61.98 63.12 1twi s VAL 147 Cb -0.12 -3.47 -0.19 0.00 0.00 0.00 0.00 36.38 32.60 1twi s VAL 147 CO -0.03 0.04 0.63 -0.67 0.00 0.00 0.00 175.10 175.07 1twi n ASP 148 N 4.42 0.65 -3.68 3.32 -0.08 -1.26 -0.53 116.55 119.38 1twi n ASP 148 Ca 0.13 0.29 -0.10 0.00 -1.51 0.00 0.00 54.79 53.60 1twi n ASP 148 Cb 0.41 0.40 -0.05 0.00 2.34 0.00 0.00 41.12 44.23 1twi n ASP 148 CO 0.00 0.00 0.00 -0.94 0.12 0.00 0.00 177.20 176.38 1twi s SER 149 N -5.69 -0.21 0.32 1.67 1.04 -1.26 -3.73 113.70 105.83 1twi s SER 149 Ca -0.05 -0.40 0.04 0.00 0.48 0.00 0.00 55.95 56.02 1twi s SER 149 Cb 0.08 0.49 0.54 0.00 0.10 0.00 0.00 66.02 67.23 1twi s SER 149 CO 0.82 -0.90 1.82 0.40 0.98 0.00 0.00 173.24 176.36 1twi h ILE 150 N 2.34 1.22 -0.56 -1.02 2.04 -1.95 -1.53 117.51 118.06 1twi h ILE 150 Ca -0.33 -0.98 0.07 0.00 1.00 0.00 0.00 64.86 64.63 1twi h ILE 150 Cb 1.25 1.12 -0.06 0.00 -0.74 0.00 0.00 36.82 38.40 1twi h ILE 150 CO 0.45 0.32 0.24 -1.28 0.00 0.00 0.00 178.15 177.88 1twi h SER 151 N 0.46 0.30 -0.51 1.72 0.87 -2.00 -1.68 113.55 112.71 1twi h SER 151 Ca 0.09 0.05 -0.04 0.00 -1.23 0.00 0.00 61.79 60.66 1twi h SER 151 Cb 0.47 0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 62.41 1twi h SER 151 CO 0.03 0.20 0.15 -0.08 -0.53 0.00 0.00 176.83 176.59 1twi h GLU 152 N 0.46 0.80 -0.55 2.24 4.81 -1.81 -2.45 114.58 118.07 1twi h GLU 152 Ca 0.26 -0.18 0.07 0.00 -0.13 0.00 0.00 59.36 59.39 1twi h GLU 152 Cb 0.25 -0.11 -0.06 0.00 0.63 0.00 0.00 28.75 29.46 1twi h GLU 152 CO -0.23 0.75 0.23 1.25 -0.73 0.00 0.00 179.01 180.28 1twi h LEU 153 N 0.69 0.26 -0.65 1.64 6.46 -0.61 -0.87 115.31 122.24 1twi h LEU 153 Ca 0.16 0.06 -0.02 0.00 -0.12 0.00 0.00 57.88 57.96 1twi h LEU 153 Cb 0.29 0.02 -0.03 0.00 -0.73 0.00 0.00 40.66 40.22 1twi h LEU 153 CO -0.00 0.17 0.34 0.40 -0.62 0.00 0.00 178.44 178.73 1twi h ILE 154 N 0.43 1.21 -0.44 4.05 2.04 -1.21 -1.59 117.51 121.99 1twi h ILE 154 Ca 0.26 -0.55 -0.04 0.00 1.00 0.00 0.00 64.86 65.53 1twi h ILE 154 Cb 0.27 0.38 -0.02 0.00 -0.74 0.00 0.00 36.82 36.71 1twi h ILE 154 CO -0.24 0.24 0.10 0.25 0.00 0.00 0.00 178.15 178.50 1twi h LEU 155 N 0.89 0.67 -0.24 1.44 5.85 -0.89 -1.06 115.31 121.97 1twi h LEU 155 Ca 0.23 -0.23 0.01 0.00 0.84 0.00 0.00 57.88 58.72 1twi h LEU 155 Cb 0.07 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 40.90 1twi h LEU 155 CO -0.03 0.73 0.14 0.40 -0.34 0.00 0.00 178.44 179.34 1twi h ILE 156 N 0.58 1.02 -0.32 4.05 2.04 -0.96 0.16 117.51 124.08 1twi h ILE 156 Ca 0.14 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 65.91 1twi h ILE 156 Cb 0.32 0.71 -0.02 0.00 -0.74 0.00 0.00 36.82 37.10 1twi h ILE 156 CO 0.00 0.05 0.21 -1.13 0.00 0.00 0.00 178.15 177.28 1twi h ASN 157 N 0.28 0.36 -0.12 1.72 -0.73 -1.08 0.29 115.58 116.30 1twi h ASN 157 Ca 0.10 -0.01 -0.09 0.00 1.87 0.00 0.00 56.30 58.17 1twi h ASN 157 Cb 0.00 -0.09 -0.01 0.00 0.27 0.00 0.00 38.32 38.49 1twi h ASN 157 CO -0.05 0.26 -0.19 -0.33 -0.37 0.00 0.00 177.43 176.74 1twi h GLU 158 N 0.42 0.53 -0.27 6.67 5.08 -0.96 -0.78 114.58 125.27 1twi h GLU 158 Ca 0.12 -0.18 -0.18 0.00 -1.00 0.00 0.00 59.36 58.12 1twi h GLU 158 Cb -0.04 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.16 1twi h GLU 158 CO -0.03 0.70 -0.52 1.15 -1.00 0.00 0.00 179.01 179.30 1twi h THR 159 N 0.48 1.29 -0.70 1.13 2.02 -0.27 -1.86 112.91 114.99 1twi h THR 159 Ca 0.08 -1.72 -0.05 0.00 0.77 0.00 0.00 66.41 65.48 1twi h THR 159 Cb 0.60 1.63 -0.03 0.00 -1.74 0.00 0.00 68.15 68.61 1twi h THR 159 CO 0.04 0.56 0.23 0.00 0.37 0.00 0.00 175.52 176.72 1twi h ALA 160 N 0.79 0.92 -0.18 6.16 0.00 -0.02 -0.77 119.26 126.15 1twi h ALA 160 Ca 0.02 -0.21 0.03 0.00 0.00 0.00 0.00 54.91 54.74 1twi h ALA 160 Cb 1.11 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 1twi h ALA 160 CO 0.11 0.59 0.02 -0.22 0.00 0.00 0.00 179.25 179.75 1twi h LYS 161 N 1.03 0.08 -0.74 0.00 3.64 -1.02 0.09 116.57 119.65 1twi h LYS 161 Ca 0.23 -0.00 0.02 0.00 -1.27 0.00 0.00 60.65 59.62 1twi h LYS 161 Cb 0.28 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.05 1twi h LYS 161 CO -0.01 0.05 0.49 0.93 -2.27 0.00 0.00 179.45 178.64 1twi h GLU 162 N 0.08 0.94 -0.00 1.90 5.08 -0.93 -1.34 114.58 120.32 1twi h GLU 162 Ca 0.08 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1twi h GLU 162 Cb 0.09 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.13 1twi h GLU 162 CO -0.13 0.62 -0.07 1.28 -1.00 0.00 0.00 179.01 179.72 1twi n LEU 163 N -4.43 0.45 -0.82 1.33 4.77 -0.33 -4.90 117.00 113.07 1twi n LEU 163 Ca 0.08 -0.01 -0.09 0.00 -0.03 0.00 0.00 56.01 55.96 1twi n LEU 163 Cb 0.06 -0.15 -0.03 0.00 -2.33 0.00 0.00 43.42 40.97 1twi n LEU 163 CO 0.36 0.08 -0.10 0.61 -1.33 0.00 0.00 177.39 177.01 1twi n GLY 164 N 1.23 0.75 3.59 -0.72 0.00 -0.14 -5.02 105.19 104.89 1twi n GLY 164 Ca 0.16 -0.58 -0.30 0.00 0.00 0.00 0.00 46.02 45.30 1twi n GLY 164 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1twi n GLU 165 N -2.47 0.68 -4.58 1.61 -0.58 -0.27 -5.02 120.64 110.00 1twi n GLU 165 Ca -0.10 -3.68 -0.31 0.00 -0.42 0.00 0.00 57.16 52.66 1twi n GLU 165 Cb 0.39 1.38 -0.17 0.00 -0.57 0.00 0.00 31.44 32.47 1twi n GLU 165 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 1twi s THR 166 N -2.97 1.83 0.05 2.62 2.01 -1.26 -4.26 115.64 113.67 1twi s THR 166 Ca 0.09 -0.84 -0.11 0.00 0.31 0.00 0.00 61.69 61.13 1twi s THR 166 Cb 0.00 -1.64 -0.06 0.00 0.01 0.00 0.00 72.50 70.82 1twi s THR 166 CO 0.06 0.51 0.40 0.00 -0.69 0.00 0.00 174.62 174.90 1twi s ALA 167 N 0.89 3.72 -0.11 7.40 0.00 -0.07 -4.88 121.76 128.71 1twi s ALA 167 Ca -0.07 -0.33 -0.23 0.00 0.00 0.00 0.00 51.96 51.34 1twi s ALA 167 Cb -0.15 -2.31 -0.03 0.00 0.00 0.00 0.00 23.12 20.63 1twi s ALA 167 CO -0.02 0.54 0.68 -0.80 0.00 0.00 0.00 175.76 176.16 1twi s ASN 168 N -1.55 6.90 -0.05 0.00 0.01 -1.26 -0.06 114.94 118.93 1twi s ASN 168 Ca 0.30 1.09 0.02 0.00 -0.71 0.00 0.00 52.86 53.56 1twi s ASN 168 Cb -0.15 -2.39 0.01 0.00 0.41 0.00 0.00 41.25 39.13 1twi s ASN 168 CO 0.16 -0.17 -0.11 0.68 -1.51 0.00 0.00 177.10 176.16 1twi s VAL 169 N 1.15 0.99 0.49 1.60 -7.23 0.45 -1.76 120.40 116.09 1twi s VAL 169 Ca 0.35 -0.42 0.06 0.00 -1.81 0.00 0.00 61.98 60.15 1twi s VAL 169 Cb -0.17 -0.90 0.00 0.00 0.56 0.00 0.00 36.38 35.87 1twi s VAL 169 CO 0.15 0.31 0.31 0.00 -0.31 0.00 0.00 175.10 175.56 1twi s ALA 170 N 0.50 4.14 -0.10 1.32 0.00 0.12 -1.05 121.76 126.70 1twi s ALA 170 Ca -0.10 -1.47 -0.00 0.00 0.00 0.00 0.00 51.96 50.39 1twi s ALA 170 Cb -0.13 -0.61 0.02 0.00 0.00 0.00 0.00 23.12 22.40 1twi s ALA 170 CO 0.02 -0.31 -0.07 -0.06 0.00 0.00 0.00 175.76 175.35 1twi s PHE 171 N -2.70 1.34 -0.35 0.00 0.40 -0.30 -1.03 117.98 115.34 1twi s PHE 171 Ca 0.35 -0.61 -0.29 0.00 -0.60 0.00 0.00 56.93 55.78 1twi s PHE 171 Cb -0.00 -1.12 0.02 0.00 0.51 0.00 0.00 43.02 42.42 1twi s PHE 171 CO 0.21 -0.44 1.10 0.50 0.70 0.00 0.00 175.22 177.29 1twi s ARG 172 N 1.54 3.99 0.17 0.44 3.52 0.31 -0.70 118.95 128.22 1twi s ARG 172 Ca 0.01 0.98 0.07 0.00 -0.13 0.00 0.00 55.73 56.67 1twi s ARG 172 Cb -0.13 -3.78 -0.04 0.00 -1.56 0.00 0.00 34.95 29.44 1twi s ARG 172 CO -0.06 -1.01 -0.02 0.96 -0.81 0.00 0.00 175.30 174.37 1twi s ILE 173 N 3.85 3.64 -0.57 4.11 -4.36 -0.09 0.17 121.20 127.94 1twi s ILE 173 Ca 0.47 -1.43 -0.04 0.00 -0.26 0.00 0.00 60.65 59.38 1twi s ILE 173 Cb -0.11 -2.82 0.15 0.00 1.25 0.00 0.00 42.46 40.93 1twi s ILE 173 CO 0.19 -0.09 0.39 0.20 0.24 0.00 0.00 174.94 175.87 1twi s ASN 174 N -2.87 5.37 0.60 4.36 0.01 0.20 -4.61 114.94 118.00 1twi s ASN 174 Ca 0.27 -2.56 -0.19 0.00 -0.71 0.00 0.00 52.86 49.66 1twi s ASN 174 Cb -0.09 -1.88 -0.03 0.00 0.41 0.00 0.00 41.25 39.66 1twi s ASN 174 CO 0.18 -0.45 1.29 -2.16 -1.51 0.00 0.00 177.10 174.45 1twi s PRO 175 N 0.37 2.84 -0.76 -0.60 0.04 -1.26 -0.92 135.00 134.71 1twi s PRO 175 Ca 0.14 2.05 -0.19 0.00 0.04 0.00 0.00 61.00 63.04 1twi s PRO 175 Cb -0.21 -1.99 -0.14 0.00 0.04 0.00 0.00 34.50 32.20 1twi s PRO 175 CO -0.04 -1.37 1.93 -1.71 0.04 0.00 0.00 177.00 175.86 1twi n ASN 176 N -1.55 2.87 -4.77 6.66 4.05 -1.26 -4.88 115.26 116.37 1twi n ASN 176 Ca 0.14 -2.59 -0.39 0.00 0.45 0.00 0.00 54.58 52.19 1twi n ASN 176 Cb 0.48 -1.08 -0.01 0.00 1.23 0.00 0.00 39.78 40.39 1twi n ASN 176 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 177.26 174.75 1twi s VAL 177 N 4.76 2.99 -0.34 3.44 0.11 -1.26 -4.94 120.40 125.16 1twi s VAL 177 Ca 0.53 0.85 -0.28 0.00 -2.93 0.00 0.00 61.98 60.15 1twi s VAL 177 Cb 0.13 -3.48 -0.02 0.00 -1.53 0.00 0.00 36.38 31.48 1twi s VAL 177 CO 0.09 0.09 1.83 0.21 -3.33 0.00 0.00 175.10 173.99 1twi s ASN 178 N -1.02 5.83 0.55 3.54 3.84 -1.26 -4.86 114.94 121.55 1twi s ASN 178 Ca 0.57 1.28 0.33 0.00 0.21 0.00 0.00 52.86 55.25 1twi s ASN 178 Cb -0.33 -2.53 1.54 0.00 -0.55 0.00 0.00 41.25 39.38 1twi s ASN 178 CO 0.42 -1.77 2.06 1.55 -2.79 0.00 0.00 177.10 176.57 1twi h PRO 179 N 13.15 0.00 -0.02 0.43 0.13 -1.93 -0.03 132.00 143.74 1twi h PRO 179 Ca -0.33 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.69 1twi h PRO 179 Cb 1.17 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.31 1twi h PRO 179 CO 1.04 0.07 -0.41 0.87 -0.23 0.00 0.00 178.00 179.34 1twi h LYS 180 N 0.00 0.31 0.02 0.86 1.57 -1.97 -2.91 116.57 114.45 1twi h LYS 180 Ca -0.00 -0.31 -0.25 0.00 -1.87 0.00 0.00 60.65 58.23 1twi h LYS 180 Cb 0.39 0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.76 1twi h LYS 180 CO 0.01 0.99 -1.25 1.79 -0.57 0.00 0.00 179.45 180.42 1twi h THR 181 N -0.26 1.42 -2.10 -0.16 1.35 -1.95 -3.39 112.91 107.81 1twi h THR 181 Ca -0.05 -3.15 -0.57 0.00 -0.55 0.00 0.00 66.41 62.09 1twi h THR 181 Cb 1.12 2.74 -0.41 0.00 -1.73 0.00 0.00 68.15 69.87 1twi h THR 181 CO 0.08 0.83 -0.87 1.41 -0.25 0.00 0.00 175.52 176.72 1twi n HIS 182 N -3.30 1.65 -0.20 4.73 8.25 -0.03 -4.97 115.22 121.35 1twi n HIS 182 Ca -0.07 -3.86 -0.06 0.00 -0.26 0.00 0.00 57.72 53.47 1twi n HIS 182 Cb 0.99 -0.45 0.03 0.00 1.12 0.00 0.00 29.99 31.68 1twi n HIS 182 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1twi h PRO 183 N 3.89 0.76 -0.65 -0.41 0.13 -1.70 -1.11 132.00 132.91 1twi h PRO 183 Ca 0.13 -0.05 -0.06 0.00 -0.87 0.00 0.00 66.00 65.14 1twi h PRO 183 Cb 0.77 -0.17 -0.03 0.00 0.13 0.00 0.00 31.00 31.70 1twi h PRO 183 CO 0.64 0.52 0.15 0.87 -0.23 0.00 0.00 178.00 179.95 1twi h LYS 184 N 0.78 1.04 -0.15 0.86 1.57 -1.93 -1.51 116.57 117.23 1twi h LYS 184 Ca 0.21 -0.25 -0.04 0.00 -1.87 0.00 0.00 60.65 58.69 1twi h LYS 184 Cb -0.07 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.10 1twi h LYS 184 CO -0.04 0.94 -0.08 0.82 -0.57 0.00 0.00 179.45 180.51 1twi h ILE 185 N 0.96 1.32 -0.94 1.86 1.08 -1.90 -2.41 117.51 117.48 1twi h ILE 185 Ca 0.20 -1.13 0.03 0.00 -0.39 0.00 0.00 64.86 63.57 1twi h ILE 185 Cb 0.37 1.75 -0.05 0.00 -3.07 0.00 0.00 36.82 35.81 1twi h ILE 185 CO 0.00 0.33 0.61 -1.28 -0.69 0.00 0.00 178.15 177.13 1twi h SER 186 N -0.02 1.03 -0.56 1.72 0.87 -1.12 -1.14 113.55 114.34 1twi h SER 186 Ca 0.03 -0.01 -0.09 0.00 -1.23 0.00 0.00 61.79 60.49 1twi h SER 186 Cb 0.55 -0.24 -0.02 0.00 -0.44 0.00 0.00 62.40 62.25 1twi h SER 186 CO 0.02 0.72 -0.00 0.74 -0.53 0.00 0.00 176.83 177.78 1twi h THR 187 N 1.21 1.26 0.37 2.23 2.02 -1.26 -2.08 112.91 116.65 1twi h THR 187 Ca 0.36 -1.13 -0.02 0.00 0.77 0.00 0.00 66.41 66.40 1twi h THR 187 Cb -0.04 0.88 0.00 0.00 -1.74 0.00 0.00 68.15 67.25 1twi h THR 187 CO -0.11 0.40 -0.18 1.23 0.37 0.00 0.00 175.52 177.24 1twi h GLY 188 N 0.87 -0.51 0.58 2.16 0.00 -0.98 0.71 103.07 105.90 1twi h GLY 188 Ca 0.16 0.19 0.19 0.00 0.00 0.00 0.00 47.33 47.87 1twi h GLY 188 CO 0.03 -0.19 0.51 1.41 0.00 0.00 0.00 176.54 178.31 1twi h LEU 189 N -0.66 0.12 0.06 3.11 3.38 -1.15 0.40 115.31 120.57 1twi h LEU 189 Ca -0.05 0.01 -0.23 0.00 0.09 0.00 0.00 57.88 57.70 1twi h LEU 189 Cb 0.47 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 1twi h LEU 189 CO 0.08 0.05 -1.20 0.11 0.09 0.00 0.00 178.44 177.57 1twi h LYS 190 N 0.12 0.13 0.00 1.13 1.79 -1.07 -3.40 116.57 115.28 1twi h LYS 190 Ca 0.36 -0.22 0.00 0.00 -2.18 0.00 0.00 60.65 58.60 1twi h LYS 190 Cb 1.23 0.08 0.00 0.00 -1.58 0.00 0.00 32.23 31.96 1twi h LYS 190 CO -0.05 1.11 -0.51 1.57 -1.08 0.00 0.00 179.45 180.49 1twi h LYS 191 N -0.61 0.00 -7.42 3.15 2.10 -0.64 -3.47 116.57 109.68 1twi h LYS 191 Ca -0.28 0.00 -0.48 0.00 -2.00 0.00 0.00 60.65 57.88 1twi h LYS 191 Cb 1.52 0.00 0.12 0.00 -0.90 0.00 0.00 32.23 32.97 1twi h LYS 191 CO -0.04 0.00 0.33 -0.80 -2.00 0.00 0.00 179.45 176.94 1twi s ASN 192 N -5.44 4.32 0.00 7.07 0.02 0.14 -4.94 114.94 116.10 1twi s ASN 192 Ca 0.04 1.26 0.30 0.00 -1.02 0.00 0.00 52.86 53.44 1twi s ASN 192 Cb 0.09 -1.97 1.59 0.00 0.02 0.00 0.00 41.25 40.97 1twi s ASN 192 CO 0.72 -2.07 2.08 2.29 0.02 0.00 0.00 177.10 180.13 1twi n LYS 193 N -3.49 0.54 -3.53 -0.60 2.85 -1.26 -4.92 118.16 107.75 1twi n LYS 193 Ca 0.07 0.00 -0.29 0.00 -1.05 0.00 0.00 58.31 57.04 1twi n LYS 193 Cb 0.57 -1.50 -0.04 0.00 -0.65 0.00 0.00 35.03 33.41 1twi n LYS 193 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 177.40 177.29 1twi s PHE 194 N -2.45 3.48 0.11 5.58 0.08 -1.26 -5.00 117.98 118.52 1twi s PHE 194 Ca 0.32 0.53 0.00 0.00 0.12 0.00 0.00 56.93 57.90 1twi s PHE 194 Cb 0.20 -2.00 0.00 0.00 -0.57 0.00 0.00 43.02 40.65 1twi s PHE 194 CO 0.44 0.30 0.00 0.41 -0.10 0.00 0.00 175.22 176.26 1twi n GLY 195 N -0.61 -2.09 3.51 4.36 0.00 -1.24 -4.87 105.19 104.25 1twi n GLY 195 Ca -0.03 -1.41 -0.39 0.00 0.00 0.00 0.00 46.02 44.19 1twi n GLY 195 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1twi s LEU 196 N -5.46 4.11 0.11 0.99 1.43 0.13 -4.81 118.68 115.18 1twi s LEU 196 Ca 0.00 -0.30 -0.31 0.00 -1.03 0.00 0.00 54.13 52.49 1twi s LEU 196 Cb 0.00 -2.07 -0.10 0.00 0.03 0.00 0.00 46.19 44.05 1twi s LEU 196 CO 0.00 -0.14 1.82 -0.62 0.23 0.00 0.00 176.35 177.64 1twi s ASP 197 N 1.69 6.44 -0.10 2.29 -1.08 -1.26 -0.63 116.67 124.02 1twi s ASP 197 Ca 0.06 2.73 -0.25 0.00 -0.52 0.00 0.00 52.55 54.57 1twi s ASP 197 Cb -0.17 -2.56 -0.28 0.00 -1.46 0.00 0.00 42.92 38.45 1twi s ASP 197 CO 0.09 -0.99 0.79 0.58 0.52 0.00 0.00 175.17 176.15 1twi h VAL 198 N 4.73 1.60 -0.92 1.11 2.07 -1.37 -1.54 116.25 121.93 1twi h VAL 198 Ca -0.46 -2.43 0.13 0.00 0.82 0.00 0.00 66.70 64.76 1twi h VAL 198 Cb 1.22 3.23 -0.09 0.00 -1.52 0.00 0.00 31.29 34.13 1twi h VAL 198 CO 0.95 0.65 0.54 -0.08 0.02 0.00 0.00 177.57 179.65 1twi h GLU 199 N -0.69 0.81 -0.00 1.57 4.81 -1.92 -0.35 114.58 118.81 1twi h GLU 199 Ca -0.09 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.09 1twi h GLU 199 Cb 1.34 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 30.53 1twi h GLU 199 CO 0.06 0.53 -0.03 -1.13 -0.73 0.00 0.00 179.01 177.71 1twi n SER 200 N -4.73 0.32 0.00 1.04 3.41 -1.26 -4.90 113.62 107.50 1twi n SER 200 Ca 0.18 -0.77 0.00 0.00 -0.26 0.00 0.00 58.87 58.02 1twi n SER 200 Cb 0.38 -0.08 0.00 0.00 -0.26 0.00 0.00 64.21 64.25 1twi n SER 200 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1twi n GLY 201 N 1.16 0.82 0.33 5.00 0.00 -0.14 -4.97 105.19 107.39 1twi n GLY 201 Ca 0.19 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.14 1twi n GLY 201 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1twi h ILE 202 N 0.00 1.26 -0.17 -0.61 2.04 -1.68 -0.90 117.51 117.45 1twi h ILE 202 Ca 0.00 -0.93 -0.00 0.00 1.00 0.00 0.00 64.86 64.93 1twi h ILE 202 Cb 0.00 0.45 -0.01 0.00 -0.74 0.00 0.00 36.82 36.52 1twi h ILE 202 CO 0.00 0.36 0.09 0.00 0.00 0.00 0.00 178.15 178.60 1twi h ALA 203 N 1.12 0.21 -0.46 1.87 0.00 -1.50 -0.98 119.26 119.53 1twi h ALA 203 Ca 0.24 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1twi h ALA 203 Cb 0.32 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1twi h ALA 203 CO -0.01 -0.24 0.27 1.98 0.00 0.00 0.00 179.25 181.25 1twi h MET 204 N 0.16 0.63 -0.78 0.00 1.85 -1.82 -2.19 114.93 112.78 1twi h MET 204 Ca 0.06 -0.06 0.04 0.00 -0.61 0.00 0.00 59.70 59.13 1twi h MET 204 Cb 0.08 -0.13 -0.05 0.00 0.43 0.00 0.00 31.60 31.93 1twi h MET 204 CO -0.01 0.48 0.49 -0.22 -0.40 0.00 0.00 176.91 177.25 1twi h LYS 205 N 0.61 0.90 -0.38 0.39 3.64 -0.86 -0.87 116.57 119.99 1twi h LYS 205 Ca 0.16 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.48 1twi h LYS 205 Cb 0.02 -0.20 -0.02 0.00 -0.41 0.00 0.00 32.23 31.62 1twi h LYS 205 CO -0.03 0.59 0.19 0.00 -2.27 0.00 0.00 179.45 177.93 1twi h ALA 206 N 1.35 0.49 -0.36 5.00 0.00 -0.95 -0.36 119.26 124.43 1twi h ALA 206 Ca 0.33 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 55.09 1twi h ALA 206 Cb 0.08 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1twi h ALA 206 CO -0.14 0.04 0.06 0.82 0.00 0.00 0.00 179.25 180.03 1twi h ILE 207 N 0.48 1.24 0.00 0.00 2.04 -1.13 0.17 117.51 120.30 1twi h ILE 207 Ca 0.13 -0.84 -0.04 0.00 1.00 0.00 0.00 64.86 65.10 1twi h ILE 207 Cb 0.11 1.10 -0.01 0.00 -0.74 0.00 0.00 36.82 37.28 1twi h ILE 207 CO -0.02 0.28 -0.21 0.11 0.00 0.00 0.00 178.15 178.32 1twi h LYS 208 N 0.43 0.00 -0.16 2.37 1.57 -1.02 -0.90 116.57 118.86 1twi h LYS 208 Ca 0.11 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.70 1twi h LYS 208 Cb 0.36 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.67 1twi h LYS 208 CO 0.01 0.21 -0.66 0.52 -0.57 0.00 0.00 179.45 178.96 1twi h MET 209 N 0.00 0.61 -0.41 3.15 2.86 -0.33 -2.72 114.93 118.10 1twi h MET 209 Ca -0.00 -0.44 -0.05 0.00 -2.06 0.00 0.00 59.70 57.14 1twi h MET 209 Cb 0.43 0.08 -0.02 0.00 0.06 0.00 0.00 31.60 32.15 1twi h MET 209 CO 0.03 1.06 0.04 0.00 1.06 0.00 0.00 176.91 179.10 1twi h ALA 210 N 0.82 1.31 -0.03 6.32 0.00 -0.32 -2.20 119.26 125.16 1twi h ALA 210 Ca -0.02 -0.20 -0.08 0.00 0.00 0.00 0.00 54.91 54.61 1twi h ALA 210 Cb 1.24 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 1twi h ALA 210 CO 0.13 0.48 -0.34 -0.07 0.00 0.00 0.00 179.25 179.45 1twi h LEU 211 N 0.61 0.06 0.00 0.00 3.38 -0.93 -2.21 115.31 116.22 1twi h LEU 211 Ca 0.13 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1twi h LEU 211 Cb 0.32 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1twi h LEU 211 CO 0.01 0.40 -0.04 -0.62 0.09 0.00 0.00 178.44 178.27 1twi n GLU 212 N -4.12 0.04 -3.09 1.13 -0.58 -0.87 -4.84 120.64 108.31 1twi n GLU 212 Ca -0.02 0.03 -0.34 0.00 -0.42 0.00 0.00 57.16 56.41 1twi n GLU 212 Cb 0.39 -1.54 -0.06 0.00 -0.57 0.00 0.00 31.44 29.65 1twi n GLU 212 CO 0.00 0.00 0.00 -1.64 -0.48 0.00 0.00 177.13 175.01 1twi s MET 213 N -3.02 4.16 0.00 3.49 -1.94 -0.83 -4.99 119.30 116.17 1twi s MET 213 Ca 0.13 0.82 0.24 0.00 -1.71 0.00 0.00 55.69 55.17 1twi s MET 213 Cb 0.18 -2.65 0.37 0.00 2.01 0.00 0.00 34.83 34.74 1twi s MET 213 CO 0.55 0.26 1.32 0.39 -0.01 0.00 0.00 175.02 177.54 1twi n GLU 214 N 0.17 0.12 -0.19 2.03 1.02 -1.26 -4.34 120.64 118.20 1twi n GLU 214 Ca 0.01 -0.08 0.09 0.00 -0.02 0.00 0.00 57.16 57.16 1twi n GLU 214 Cb 0.52 -1.50 0.16 0.00 -0.02 0.00 0.00 31.44 30.60 1twi n GLU 214 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1twi n TYR 215 N -1.37 0.12 -4.22 -0.32 4.02 -1.26 -5.00 117.16 109.13 1twi n TYR 215 Ca 0.06 -1.07 -0.13 0.00 -0.01 0.00 0.00 57.90 56.75 1twi n TYR 215 Cb 0.34 -0.19 -0.10 0.00 -0.02 0.00 0.00 39.34 39.37 1twi n TYR 215 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 176.86 175.99 1twi s VAL 216 N -2.93 0.99 -0.17 -0.72 -7.23 -1.26 -0.89 120.40 108.19 1twi s VAL 216 Ca 0.34 -1.98 -0.00 0.00 -1.81 0.00 0.00 61.98 58.53 1twi s VAL 216 Cb 0.30 -1.74 0.04 0.00 0.56 0.00 0.00 36.38 35.54 1twi s VAL 216 CO 0.02 -0.77 -0.07 0.21 -0.31 0.00 0.00 175.10 174.18 1twi s ASN 217 N -3.05 2.87 -0.23 4.85 3.04 0.92 -4.85 114.94 118.48 1twi s ASN 217 Ca 0.14 -0.66 -0.29 0.00 0.04 0.00 0.00 52.86 52.09 1twi s ASN 217 Cb 0.03 -0.99 -0.01 0.00 -1.54 0.00 0.00 41.25 38.73 1twi s ASN 217 CO -0.01 -0.16 1.33 -0.69 -3.04 0.00 0.00 177.10 174.53 1twi s VAL 218 N 1.58 4.13 0.00 -5.21 1.01 -1.26 -0.41 120.40 120.23 1twi s VAL 218 Ca 0.01 1.32 0.00 0.00 0.00 0.00 0.00 61.98 63.31 1twi s VAL 218 Cb -0.15 -4.02 0.00 0.00 0.00 0.00 0.00 36.38 32.21 1twi s VAL 218 CO -0.08 -0.30 0.00 1.33 0.00 0.00 0.00 175.10 176.04 1twi n VAL 219 N 5.87 0.00 -3.94 2.92 0.24 -0.22 -4.82 118.33 118.38 1twi n VAL 219 Ca 0.15 -0.36 0.01 0.00 -2.04 0.00 0.00 64.34 62.10 1twi n VAL 219 Cb 0.46 0.88 0.01 0.00 -1.47 0.00 0.00 33.84 33.72 1twi n VAL 219 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1twi n GLY 220 N 1.24 0.39 3.19 7.63 0.00 -1.24 -0.78 105.19 115.61 1twi n GLY 220 Ca 0.00 -1.01 -0.22 0.00 0.00 0.00 0.00 46.02 44.80 1twi n GLY 220 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1twi s VAL 221 N -2.07 1.30 0.07 1.61 1.01 -0.89 -1.14 120.40 120.28 1twi s VAL 221 Ca 0.22 -1.13 0.02 0.00 0.00 0.00 0.00 61.98 61.09 1twi s VAL 221 Cb -0.01 -1.17 -0.03 0.00 0.00 0.00 0.00 36.38 35.17 1twi s VAL 221 CO 0.00 0.02 -0.08 -2.28 0.00 0.00 0.00 175.10 172.77 1twi s HIS 222 N -0.91 0.81 -0.18 5.22 5.04 0.12 -0.89 115.29 124.51 1twi s HIS 222 Ca 0.03 -0.66 -0.20 0.00 -1.54 0.00 0.00 55.06 52.69 1twi s HIS 222 Cb -0.08 -0.47 0.05 0.00 0.04 0.00 0.00 32.58 32.12 1twi s HIS 222 CO 0.02 -0.09 0.54 0.00 -2.34 0.00 0.00 174.74 172.86 1twi s HIS 224 N 0.03 -0.06 -0.56 0.00 5.04 -1.26 -1.47 115.29 117.00 1twi s HIS 224 Ca -0.02 0.39 0.22 0.00 -1.54 0.00 0.00 55.06 54.11 1twi s HIS 224 Cb -0.04 -0.38 -0.14 0.00 0.04 0.00 0.00 32.58 32.06 1twi s HIS 224 CO 0.02 -0.27 0.84 0.44 -2.34 0.00 0.00 174.74 173.43 1twi n ILE 225 N 5.31 0.08 -3.94 0.89 -5.35 -1.26 -5.04 119.36 110.05 1twi n ILE 225 Ca -0.04 -0.25 0.00 0.00 -0.27 0.00 0.00 62.75 62.19 1twi n ILE 225 Cb 0.50 0.38 0.00 0.00 -1.74 0.00 0.00 39.64 38.78 1twi n ILE 225 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1twi n GLY 226 N 1.38 -1.39 3.09 3.28 0.00 -1.26 -4.91 105.19 105.37 1twi n GLY 226 Ca 0.01 -1.21 -0.09 0.00 0.00 0.00 0.00 46.02 44.73 1twi n GLY 226 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1twi s SER 227 N -3.99 0.63 -1.34 1.61 0.15 -1.26 -4.00 113.70 105.50 1twi s SER 227 Ca 0.00 -0.90 -0.03 0.00 0.70 0.00 0.00 55.95 55.72 1twi s SER 227 Cb 0.00 0.15 0.02 0.00 -1.71 0.00 0.00 66.02 64.48 1twi s SER 227 CO 0.00 -0.50 0.78 1.67 1.20 0.00 0.00 173.24 176.39 1twi n GLN 228 N 0.38 -5.22 -3.07 5.44 -0.06 -1.12 -4.95 117.38 108.78 1twi n GLN 228 Ca -0.16 0.64 -0.41 0.00 -2.00 0.00 0.00 57.00 55.07 1twi n GLN 228 Cb 0.60 -5.29 -0.06 0.00 -4.06 0.00 0.00 30.24 21.42 1twi n GLN 228 CO 0.00 0.00 0.00 -0.51 -0.20 0.00 0.00 177.06 176.35 1twi s LEU 229 N -6.79 4.07 -0.27 1.69 1.43 -0.38 -4.67 118.68 113.77 1twi s LEU 229 Ca 0.14 0.79 0.11 0.00 -1.03 0.00 0.00 54.13 54.13 1twi s LEU 229 Cb -0.07 -2.92 0.53 0.00 0.03 0.00 0.00 46.19 43.76 1twi s LEU 229 CO 0.81 -0.39 1.50 0.35 0.23 0.00 0.00 176.35 178.85 1twi n THR 230 N 5.15 2.54 -4.33 5.49 -2.24 -1.26 -0.60 114.28 119.02 1twi n THR 230 Ca 0.01 -2.38 -0.20 0.00 -2.27 0.00 0.00 64.05 59.21 1twi n THR 230 Cb 0.49 -0.31 -0.15 0.00 -2.10 0.00 0.00 70.33 68.25 1twi n THR 230 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1twi s ASP 231 N -2.21 1.10 0.36 3.42 -1.08 -1.26 -4.46 116.67 112.55 1twi s ASP 231 Ca 0.45 -0.17 0.25 0.00 -0.52 0.00 0.00 52.55 52.57 1twi s ASP 231 Cb 0.39 -0.31 0.69 0.00 -1.46 0.00 0.00 42.92 42.23 1twi s ASP 231 CO 0.04 0.05 1.72 0.16 0.52 0.00 0.00 175.17 177.66 1twi h ILE 232 N 5.45 0.00 -0.58 4.11 3.07 -1.98 -3.36 117.51 124.23 1twi h ILE 232 Ca -0.33 -0.69 0.12 0.00 1.55 0.00 0.00 64.86 65.51 1twi h ILE 232 Cb 1.17 1.66 -0.10 0.00 -0.27 0.00 0.00 36.82 39.28 1twi h ILE 232 CO 0.49 0.00 -0.03 -1.28 -1.05 0.00 0.00 178.15 176.27 1twi h SER 233 N 0.00 -0.32 0.34 2.16 0.87 -2.00 0.19 113.55 114.79 1twi h SER 233 Ca 0.00 0.15 -0.05 0.00 -1.23 0.00 0.00 61.79 60.66 1twi h SER 233 Cb 0.79 0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 63.02 1twi h SER 233 CO 0.00 -0.12 -0.26 -0.65 -0.53 0.00 0.00 176.83 175.27 1twi h PRO 234 N 0.09 0.00 0.00 2.24 0.11 -2.00 -1.49 132.00 130.95 1twi h PRO 234 Ca 0.29 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 66.26 1twi h PRO 234 Cb 0.47 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.56 1twi h PRO 234 CO -0.52 0.26 -0.68 0.74 -0.21 0.00 0.00 178.00 177.59 1twi h PHE 235 N 0.00 0.00 -0.24 0.65 0.04 -1.22 0.20 116.94 116.37 1twi h PHE 235 Ca -0.00 0.00 -0.13 0.00 2.80 0.00 0.00 57.97 60.64 1twi h PHE 235 Cb 0.50 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.65 1twi h PHE 235 CO 0.00 0.68 -0.35 0.82 -0.60 0.00 0.00 178.31 178.86 1twi h ILE 236 N 0.00 1.32 -0.53 -0.55 2.04 -0.75 -0.46 117.51 118.58 1twi h ILE 236 Ca -0.01 -1.55 -0.06 0.00 1.00 0.00 0.00 64.86 64.25 1twi h ILE 236 Cb 1.21 1.74 -0.02 0.00 -0.74 0.00 0.00 36.82 39.01 1twi h ILE 236 CO 0.09 0.49 0.11 -0.08 0.00 0.00 0.00 178.15 178.75 1twi h GLU 237 N 0.36 0.86 -0.11 2.37 4.57 -1.12 0.57 114.58 122.08 1twi h GLU 237 Ca 0.02 -0.22 0.03 0.00 -1.18 0.00 0.00 59.36 58.01 1twi h GLU 237 Cb 0.93 -0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 29.39 1twi h GLU 237 CO 0.08 0.83 -0.06 1.49 -1.18 0.00 0.00 179.01 180.17 1twi h GLU 238 N 0.75 -0.05 -0.37 1.92 4.81 -0.56 -1.72 114.58 119.37 1twi h GLU 238 Ca 0.16 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.39 1twi h GLU 238 Cb 0.37 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.74 1twi h GLU 238 CO 0.01 -0.04 0.20 1.15 -0.73 0.00 0.00 179.01 179.60 1twi h THR 239 N -0.06 1.14 -0.70 0.32 2.02 -0.71 0.36 112.91 115.28 1twi h THR 239 Ca 0.07 -0.36 -0.03 0.00 0.77 0.00 0.00 66.41 66.86 1twi h THR 239 Cb 0.15 0.71 -0.03 0.00 -1.74 0.00 0.00 68.15 67.24 1twi h THR 239 CO -0.15 0.14 0.31 0.03 0.37 0.00 0.00 175.52 176.23 1twi h ARG 240 N 0.47 1.02 -0.04 6.66 3.08 -0.82 -1.00 114.38 123.75 1twi h ARG 240 Ca 0.13 -0.16 -0.16 0.00 0.07 0.00 0.00 59.98 59.86 1twi h ARG 240 Cb 0.05 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 29.91 1twi h ARG 240 CO -0.02 0.82 -0.69 0.87 -1.07 0.00 0.00 179.97 179.89 1twi h LYS 241 N 0.98 0.19 -0.18 0.04 1.79 -1.02 0.73 116.57 119.10 1twi h LYS 241 Ca 0.24 -0.15 -0.04 0.00 -2.18 0.00 0.00 60.65 58.52 1twi h LYS 241 Cb 0.15 0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 30.83 1twi h LYS 241 CO -0.03 0.80 -0.03 0.28 -1.08 0.00 0.00 179.45 179.40 1twi h VAL 242 N 0.13 1.28 -0.30 0.50 2.07 -0.80 -2.38 116.25 116.75 1twi h VAL 242 Ca -0.02 -0.97 -0.06 0.00 0.82 0.00 0.00 66.70 66.47 1twi h VAL 242 Cb 1.22 1.54 -0.02 0.00 -1.52 0.00 0.00 31.29 32.52 1twi h VAL 242 CO 0.10 0.29 -0.09 0.24 0.02 0.00 0.00 177.57 178.14 1twi h MET 243 N 0.07 0.49 -0.83 1.57 2.86 -1.08 -0.60 114.93 117.42 1twi h MET 243 Ca 0.05 -0.13 0.01 0.00 -2.06 0.00 0.00 59.70 57.57 1twi h MET 243 Cb 0.45 -0.06 -0.04 0.00 0.06 0.00 0.00 31.60 32.01 1twi h MET 243 CO 0.02 0.59 0.54 -0.44 1.06 0.00 0.00 176.91 178.67 1twi h ASP 244 N 0.46 0.96 0.21 1.22 3.32 -0.79 -0.84 116.42 120.96 1twi h ASP 244 Ca 0.09 -0.03 -0.18 0.00 0.02 0.00 0.00 57.03 56.93 1twi h ASP 244 Cb 0.44 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.74 1twi h ASP 244 CO 0.02 0.71 -0.68 0.15 -1.72 0.00 0.00 179.24 177.72 1twi h PHE 245 N 1.13 0.56 -0.19 4.55 3.57 -0.78 -1.19 116.94 124.60 1twi h PHE 245 Ca 0.30 -0.24 -0.04 0.00 3.53 0.00 0.00 57.97 61.53 1twi h PHE 245 Cb -0.12 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 38.52 1twi h PHE 245 CO 0.00 0.98 -0.06 0.28 -2.23 0.00 0.00 178.31 177.28 1twi h VAL 246 N 0.30 1.16 -0.19 1.41 2.07 -0.30 0.93 116.25 121.64 1twi h VAL 246 Ca -0.02 -0.67 -0.08 0.00 0.82 0.00 0.00 66.70 66.76 1twi h VAL 246 Cb 1.24 1.08 -0.00 0.00 -1.52 0.00 0.00 31.29 32.09 1twi h VAL 246 CO 0.12 0.22 -0.18 0.58 0.02 0.00 0.00 177.57 178.32 1twi h VAL 247 N 0.29 1.33 -0.91 2.57 2.07 -0.89 -0.64 116.25 120.06 1twi h VAL 247 Ca 0.06 -1.34 0.07 0.00 0.82 0.00 0.00 66.70 66.31 1twi h VAL 247 Cb 0.30 1.79 -0.06 0.00 -1.52 0.00 0.00 31.29 31.80 1twi h VAL 247 CO 0.01 0.40 0.59 -0.08 0.02 0.00 0.00 177.57 178.52 1twi h GLU 248 N 0.11 0.99 -0.48 1.57 4.81 -0.44 0.13 114.58 121.27 1twi h GLU 248 Ca 0.03 -0.06 -0.10 0.00 -0.13 0.00 0.00 59.36 59.10 1twi h GLU 248 Cb 0.72 -0.22 -0.02 0.00 0.63 0.00 0.00 28.75 29.86 1twi h GLU 248 CO 0.05 0.66 -0.09 -0.07 -0.73 0.00 0.00 179.01 178.83 1twi h LEU 249 N 1.02 0.91 -1.01 1.64 3.38 -0.54 -2.52 115.31 118.19 1twi h LEU 249 Ca 0.39 -0.35 0.05 0.00 0.09 0.00 0.00 57.88 58.07 1twi h LEU 249 Cb 0.22 -0.25 -0.06 0.00 0.09 0.00 0.00 40.66 40.66 1twi h LEU 249 CO -0.15 1.05 0.66 0.50 0.09 0.00 0.00 178.44 180.58 1twi h LYS 250 N 0.76 1.20 -0.01 1.13 3.11 -0.23 0.07 116.57 122.60 1twi h LYS 250 Ca 0.13 -0.07 0.00 0.00 -2.81 0.00 0.00 60.65 57.90 1twi h LYS 250 Cb 0.63 -0.27 -0.00 0.00 -1.00 0.00 0.00 32.23 31.59 1twi h LYS 250 CO 0.04 0.79 0.01 0.93 -2.81 0.00 0.00 179.45 178.41 1twi h GLU 251 N 1.24 0.00 -0.51 1.90 5.08 -0.57 -0.07 114.58 121.65 1twi h GLU 251 Ca 0.42 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.78 1twi h GLU 251 Cb 0.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.32 1twi h GLU 251 CO -0.15 0.00 0.00 0.39 -1.00 0.00 0.00 179.01 178.25 1twi n GLU 252 N -4.19 2.20 -0.85 2.33 -0.58 -0.14 -4.92 120.64 114.49 1twi n GLU 252 Ca -0.03 -1.82 0.00 0.00 -0.42 0.00 0.00 57.16 54.89 1twi n GLU 252 Cb 0.10 -1.41 0.00 0.00 -0.57 0.00 0.00 31.44 29.56 1twi n GLU 252 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1twi n GLY 253 N 1.28 0.54 3.53 0.62 0.00 -0.04 -5.05 105.19 106.08 1twi n GLY 253 Ca 0.17 -0.26 -0.35 0.00 0.00 0.00 0.00 46.02 45.58 1twi n GLY 253 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1twi s ILE 254 N -2.00 4.32 0.02 -0.61 1.01 -0.34 -4.98 121.20 118.61 1twi s ILE 254 Ca 0.00 -0.19 -0.00 0.00 0.00 0.00 0.00 60.65 60.45 1twi s ILE 254 Cb 0.00 -2.95 -0.04 0.00 0.01 0.00 0.00 42.46 39.48 1twi s ILE 254 CO 0.00 0.44 0.15 -1.61 0.00 0.00 0.00 174.94 173.91 1twi s GLU 255 N 0.74 3.25 -0.20 2.79 2.02 -1.26 -2.80 118.70 123.24 1twi s GLU 255 Ca 0.02 -0.45 0.01 0.00 0.02 0.00 0.00 54.97 54.56 1twi s GLU 255 Cb -0.14 -2.96 0.04 0.00 0.10 0.00 0.00 34.13 31.17 1twi s GLU 255 CO 0.02 0.63 -0.14 0.42 0.02 0.00 0.00 175.26 176.22 1twi s ILE 256 N -1.35 1.89 0.12 -1.63 -1.09 -1.26 -4.92 121.20 112.96 1twi s ILE 256 Ca 0.28 -1.12 -0.05 0.00 -2.23 0.00 0.00 60.65 57.54 1twi s ILE 256 Cb -0.12 -1.88 -0.20 0.00 -1.58 0.00 0.00 42.46 38.68 1twi s ILE 256 CO 0.20 0.25 1.27 -0.33 -1.23 0.00 0.00 174.94 175.11 1twi h GLU 257 N 7.92 0.40 -5.78 2.79 4.39 -1.82 -3.43 114.58 119.05 1twi h GLU 257 Ca -0.32 -0.46 -0.55 0.00 0.34 0.00 0.00 59.36 58.37 1twi h GLU 257 Cb 1.10 0.14 -0.28 0.00 -0.10 0.00 0.00 28.75 29.61 1twi h GLU 257 CO 0.52 1.13 -0.83 -0.51 -1.16 0.00 0.00 179.01 178.16 1twi s ASP 258 N -7.11 2.16 -0.15 1.42 1.01 0.04 -1.26 116.67 112.78 1twi s ASP 258 Ca -0.06 -0.40 0.01 0.00 0.71 0.00 0.00 52.55 52.81 1twi s ASP 258 Cb 0.08 -0.21 0.02 0.00 1.01 0.00 0.00 42.92 43.82 1twi s ASP 258 CO 0.87 0.18 -0.17 -0.69 0.21 0.00 0.00 175.17 175.57 1twi s VAL 259 N -0.59 1.77 -0.22 -1.27 1.01 -0.42 -2.10 120.40 118.58 1twi s VAL 259 Ca 0.06 -0.77 -0.01 0.00 0.00 0.00 0.00 61.98 61.27 1twi s VAL 259 Cb -0.08 -1.62 0.02 0.00 0.00 0.00 0.00 36.38 34.71 1twi s VAL 259 CO 0.00 0.49 -0.12 0.21 0.00 0.00 0.00 175.10 175.69 1twi s ASN 260 N 1.27 3.87 -0.03 3.32 3.84 -0.07 -1.01 114.94 126.14 1twi s ASN 260 Ca 0.02 -0.76 0.18 0.00 0.21 0.00 0.00 52.86 52.50 1twi s ASN 260 Cb -0.14 -1.59 0.55 0.00 -0.55 0.00 0.00 41.25 39.52 1twi s ASN 260 CO -0.09 -0.07 1.46 0.18 -2.79 0.00 0.00 177.10 175.79 1twi n LEU 261 N 4.65 3.47 0.00 3.21 4.77 -0.75 -0.86 117.00 131.48 1twi n LEU 261 Ca -0.18 -1.74 0.00 0.00 -0.03 0.00 0.00 56.01 54.06 1twi n LEU 261 Cb 0.48 -0.44 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 1twi n LEU 261 CO 0.26 0.78 0.00 0.61 -1.33 0.00 0.00 177.39 177.71 1twi n GLY 262 N 1.34 -0.81 0.00 -0.72 0.00 -0.54 -4.51 105.19 99.95 1twi n GLY 262 Ca 0.21 -1.17 0.00 0.00 0.00 0.00 0.00 46.02 45.06 1twi n GLY 262 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1twi n GLY 263 N 0.00 4.98 0.00 -0.02 0.00 -1.24 -0.83 105.19 108.09 1twi n GLY 263 Ca 0.00 -1.76 0.00 0.00 0.00 0.00 0.00 46.02 44.26 1twi n GLY 263 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1twi n GLY 264 N 5.00 0.69 3.73 -0.02 0.00 -1.26 -4.69 105.19 108.65 1twi n GLY 264 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1twi n GLY 264 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1twi s LEU 265 N 0.00 4.36 0.64 0.99 2.96 -1.26 -1.24 118.68 125.13 1twi s LEU 265 Ca 0.00 2.88 -0.11 0.00 -0.22 0.00 0.00 54.13 56.68 1twi s LEU 265 Cb 0.00 -3.61 -0.02 0.00 0.50 0.00 0.00 46.19 43.06 1twi s LEU 265 CO 0.00 -0.95 1.05 -0.83 -1.32 0.00 0.00 176.35 174.29 1twi s GLY 266 N 1.01 1.65 0.31 7.98 0.00 0.23 -4.25 107.32 114.26 1twi s GLY 266 Ca 0.72 -0.14 0.09 0.00 0.00 0.00 0.00 44.72 45.39 1twi s GLY 266 CO 0.36 0.16 -0.00 -0.26 0.00 0.00 0.00 173.10 173.35 1twi s ILE 267 N -3.21 2.87 -1.24 0.90 -5.25 -1.26 -4.91 121.20 109.10 1twi s ILE 267 Ca 0.56 -1.98 -0.17 0.00 -0.99 0.00 0.00 60.65 58.07 1twi s ILE 267 Cb -0.11 -2.77 -0.01 0.00 2.95 0.00 0.00 42.46 42.51 1twi s ILE 267 CO 0.54 -0.27 2.05 -0.81 -1.79 0.00 0.00 174.94 174.66 1twi n PRO 268 N -0.92 2.49 -0.17 0.37 -0.04 -1.26 -4.72 135.00 130.75 1twi n PRO 268 Ca -0.05 -2.53 -0.08 0.00 -0.04 0.00 0.00 63.50 60.81 1twi n PRO 268 Cb 0.61 -3.27 0.01 0.00 -0.04 0.00 0.00 33.50 30.81 1twi n PRO 268 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 1twi h TYR 269 N 7.01 0.72 -3.41 0.54 0.05 -1.91 -3.39 116.97 116.57 1twi h TYR 269 Ca 0.49 -0.04 -0.55 0.00 0.05 0.00 0.00 58.73 58.68 1twi h TYR 269 Cb 0.71 -0.22 -0.04 0.00 1.01 0.00 0.00 36.73 38.19 1twi h TYR 269 CO 1.38 0.58 0.19 0.71 -1.05 0.00 0.00 178.16 179.98 1twi s TYR 270 N -5.64 3.67 -2.02 4.88 2.02 -1.26 -4.13 117.35 114.87 1twi s TYR 270 Ca -0.13 1.46 0.26 0.00 -0.37 0.00 0.00 57.07 58.28 1twi s TYR 270 Cb 0.11 -2.89 0.62 0.00 -0.40 0.00 0.00 41.96 39.40 1twi s TYR 270 CO 0.77 0.14 1.48 1.63 -1.57 0.00 0.00 175.55 178.00 1twi n LYS 271 N 3.39 1.15 -0.48 -0.62 4.76 -1.26 -4.23 118.16 120.87 1twi n LYS 271 Ca 0.00 -0.77 0.11 0.00 -2.87 0.00 0.00 58.31 54.78 1twi n LYS 271 Cb 0.51 -1.48 0.34 0.00 -1.84 0.00 0.00 35.03 32.55 1twi n LYS 271 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 1twi n ASP 272 N -0.25 4.25 -3.77 4.39 3.85 -1.26 -4.59 116.55 119.17 1twi n ASP 272 Ca 0.13 -2.19 -0.16 0.00 -0.71 0.00 0.00 54.79 51.86 1twi n ASP 272 Cb 0.39 -0.53 -0.16 0.00 -1.35 0.00 0.00 41.12 39.47 1twi n ASP 272 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 177.20 174.60 1twi s LYS 273 N -1.38 0.05 0.32 0.11 -2.85 -1.26 -5.13 119.74 109.60 1twi s LYS 273 Ca 0.50 0.18 -0.28 0.00 -1.00 0.00 0.00 55.97 55.37 1twi s LYS 273 Cb 0.28 -0.34 -0.09 0.00 -2.06 0.00 0.00 37.83 35.62 1twi s LYS 273 CO 0.29 -0.18 1.10 -1.14 0.10 0.00 0.00 175.35 175.52 1twi s GLN 274 N 1.18 4.45 0.25 1.78 0.74 -1.26 -4.99 119.66 121.81 1twi s GLN 274 Ca -0.08 1.75 0.02 0.00 0.05 0.00 0.00 55.36 57.11 1twi s GLN 274 Cb -0.13 -2.97 -0.05 0.00 1.10 0.00 0.00 33.01 30.95 1twi s GLN 274 CO -0.03 0.06 0.05 0.96 -0.55 0.00 0.00 175.29 175.78 1twi s ILE 275 N -1.31 0.82 0.46 -2.34 -4.36 -1.26 -5.12 121.20 108.09 1twi s ILE 275 Ca 0.49 -2.01 -0.25 0.00 -0.26 0.00 0.00 60.65 58.63 1twi s ILE 275 Cb -0.30 -2.50 -0.08 0.00 1.25 0.00 0.00 42.46 40.83 1twi s ILE 275 CO 0.38 -0.16 1.36 -2.65 0.24 0.00 0.00 174.94 174.11 1twi n PRO 276 N -0.46 2.04 -3.29 0.37 -0.02 -1.26 -5.01 135.00 127.38 1twi n PRO 276 Ca -0.03 0.73 -0.21 0.00 -2.02 0.00 0.00 63.50 61.97 1twi n PRO 276 Cb 0.65 -2.54 0.02 0.00 -0.02 0.00 0.00 33.50 31.61 1twi n PRO 276 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1twi n THR 277 N -0.37 0.00 -0.01 3.45 -2.24 -1.26 -4.90 114.28 108.94 1twi n THR 277 Ca 0.07 -1.87 0.02 0.00 -2.27 0.00 0.00 64.05 60.00 1twi n THR 277 Cb 0.41 -0.25 0.37 0.00 -2.10 0.00 0.00 70.33 68.76 1twi n THR 277 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 1twi h GLN 278 N 0.00 0.56 -0.35 -0.78 7.50 -1.95 -0.42 115.11 119.67 1twi h GLN 278 Ca -0.29 -0.06 -0.09 0.00 0.50 0.00 0.00 58.65 58.72 1twi h GLN 278 Cb 1.13 -0.11 -0.01 0.00 0.05 0.00 0.00 27.48 28.53 1twi h GLN 278 CO 0.44 0.44 -0.11 -0.22 -1.50 0.00 0.00 178.83 177.88 1twi h LYS 279 N 0.56 0.70 -0.69 1.46 1.63 -1.91 0.32 116.57 118.64 1twi h LYS 279 Ca 0.14 -0.28 -0.01 0.00 -0.85 0.00 0.00 60.65 59.65 1twi h LYS 279 Cb 0.07 -0.03 -0.03 0.00 -0.60 0.00 0.00 32.23 31.64 1twi h LYS 279 CO -0.02 0.87 0.38 -0.44 -3.45 0.00 0.00 179.45 176.79 1twi h ASP 280 N 0.49 0.87 -0.37 4.20 3.32 -1.71 -0.90 116.42 122.31 1twi h ASP 280 Ca 0.09 -0.10 -0.02 0.00 0.02 0.00 0.00 57.03 57.02 1twi h ASP 280 Cb 0.63 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.94 1twi h ASP 280 CO 0.04 0.71 0.14 0.25 -1.72 0.00 0.00 179.24 178.67 1twi h LEU 281 N 0.95 0.52 -0.53 1.55 5.85 -0.83 -1.84 115.31 120.98 1twi h LEU 281 Ca 0.24 -0.17 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 1twi h LEU 281 Cb 0.04 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 40.91 1twi h LEU 281 CO -0.04 0.55 0.29 0.00 -0.34 0.00 0.00 178.44 178.90 1twi h ALA 282 N 0.99 0.68 -0.49 1.25 0.00 -0.03 0.31 119.26 121.97 1twi h ALA 282 Ca 0.12 -0.10 0.05 0.00 0.00 0.00 0.00 54.91 54.99 1twi h ALA 282 Cb 0.20 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 17.73 1twi h ALA 282 CO -0.01 0.20 0.21 -0.44 0.00 0.00 0.00 179.25 179.21 1twi h ASP 283 N 0.71 0.27 -0.16 0.00 3.32 -1.06 0.26 116.42 119.76 1twi h ASP 283 Ca 0.19 0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.26 1twi h ASP 283 Cb 0.05 -0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 1twi h ASP 283 CO -0.03 0.19 0.03 0.00 -1.72 0.00 0.00 179.24 177.71 1twi h ALA 284 N 1.29 0.21 -0.03 3.45 0.00 -0.90 -1.71 119.26 121.57 1twi h ALA 284 Ca 0.22 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1twi h ALA 284 Cb 0.18 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1twi h ALA 284 CO -0.19 -0.14 -0.06 0.82 0.00 0.00 0.00 179.25 179.68 1twi h ILE 285 N 0.05 1.45 -0.26 0.00 2.04 -0.67 -2.66 117.51 117.46 1twi h ILE 285 Ca 0.05 -1.44 -0.05 0.00 1.00 0.00 0.00 64.86 64.43 1twi h ILE 285 Cb 0.29 2.35 -0.01 0.00 -0.74 0.00 0.00 36.82 38.71 1twi h ILE 285 CO 0.00 0.39 -0.02 0.40 0.00 0.00 0.00 178.15 178.92 1twi h ILE 286 N -0.47 1.26 -0.58 -0.67 2.04 -0.58 -0.47 117.51 118.04 1twi h ILE 286 Ca -0.00 -0.95 -0.02 0.00 1.00 0.00 0.00 64.86 64.88 1twi h ILE 286 Cb 0.66 1.37 -0.03 0.00 -0.74 0.00 0.00 36.82 38.08 1twi h ILE 286 CO 0.01 0.30 0.28 0.78 0.00 0.00 0.00 178.15 179.53 1twi h ASN 287 N 0.24 0.74 -0.02 1.72 2.35 -1.42 -1.92 115.58 117.27 1twi h ASN 287 Ca 0.07 -0.07 -0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1twi h ASN 287 Cb 0.45 -0.19 -0.00 0.00 0.05 0.00 0.00 38.32 38.63 1twi h ASN 287 CO 0.02 0.63 0.00 0.74 -1.65 0.00 0.00 177.43 177.17 1twi h THR 288 N 0.82 1.21 -0.61 2.81 2.02 -1.24 -3.18 112.91 114.74 1twi h THR 288 Ca 0.20 -0.62 0.02 0.00 0.77 0.00 0.00 66.41 66.79 1twi h THR 288 Cb 0.08 1.58 -0.03 0.00 -1.74 0.00 0.00 68.15 68.04 1twi h THR 288 CO -0.03 0.16 0.39 0.24 0.37 0.00 0.00 175.52 176.65 1twi h MET 289 N -0.21 0.76 0.00 6.66 2.86 -0.79 -2.50 114.93 121.71 1twi h MET 289 Ca 0.01 -0.05 -0.00 0.00 -2.06 0.00 0.00 59.70 57.60 1twi h MET 289 Cb 0.26 -0.17 -0.00 0.00 0.06 0.00 0.00 31.60 31.75 1twi h MET 289 CO 0.00 0.50 -0.02 -0.07 1.06 0.00 0.00 176.91 178.38 1twi h LEU 290 N 0.78 0.00 -1.81 1.22 3.38 -1.39 0.56 115.31 118.05 1twi h LEU 290 Ca 0.23 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.20 1twi h LEU 290 Cb -0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.71 1twi h LEU 290 CO -0.07 0.02 0.00 0.11 0.09 0.00 0.00 178.44 178.58 1twi h LYS 291 N 0.00 0.00 -0.24 1.13 1.57 -1.42 -1.81 116.57 115.80 1twi h LYS 291 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1twi h LYS 291 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.36 1twi h LYS 291 CO 0.00 0.00 0.00 0.66 -0.57 0.00 0.00 179.45 179.54 1twi n TYR 292 N -2.55 0.30 0.18 -1.35 4.02 0.19 -4.45 117.16 113.49 1twi n TYR 292 Ca -0.01 -0.15 0.09 0.00 -0.01 0.00 0.00 57.90 57.82 1twi n TYR 292 Cb 0.09 0.00 0.47 0.00 -0.02 0.00 0.00 39.34 39.88 1twi n TYR 292 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 176.86 176.21 1twi n LYS 293 N 0.97 0.12 0.01 -0.72 2.85 -0.68 -0.52 118.16 120.18 1twi n LYS 293 Ca 0.17 0.57 0.12 0.00 -1.05 0.00 0.00 58.31 58.13 1twi n LYS 293 Cb 0.49 -1.86 0.25 0.00 -0.65 0.00 0.00 35.03 33.26 1twi n LYS 293 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1twi n ASP 294 N -2.11 0.50 -0.09 -5.58 8.00 -1.26 -4.31 116.55 111.71 1twi n ASP 294 Ca -0.01 -0.14 -0.12 0.00 0.71 0.00 0.00 54.79 55.24 1twi n ASP 294 Cb 0.06 0.20 -0.09 0.00 -0.02 0.00 0.00 41.12 41.27 1twi n ASP 294 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1twi n LYS 295 N -1.61 0.69 -4.17 -1.24 5.02 0.32 -5.04 118.16 112.13 1twi n LYS 295 Ca 0.05 0.08 -0.11 0.00 -2.02 0.00 0.00 58.31 56.31 1twi n LYS 295 Cb 0.36 -1.37 -0.10 0.00 -0.02 0.00 0.00 35.03 33.89 1twi n LYS 295 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1twi s VAL 296 N -2.37 0.73 0.26 -0.18 -7.23 -0.79 -5.02 120.40 105.80 1twi s VAL 296 Ca -0.22 -1.87 -0.30 0.00 -1.81 0.00 0.00 61.98 57.79 1twi s VAL 296 Cb 0.06 -1.60 -0.09 0.00 0.56 0.00 0.00 36.38 35.31 1twi s VAL 296 CO 0.46 -0.81 1.11 -0.70 -0.31 0.00 0.00 175.10 174.85 1twi s GLU 297 N -3.61 4.62 0.26 4.82 2.56 -1.26 -4.35 118.70 121.73 1twi s GLU 297 Ca 0.10 1.80 -0.30 0.00 0.00 0.00 0.00 54.97 56.57 1twi s GLU 297 Cb 0.04 -3.20 -0.10 0.00 2.00 0.00 0.00 34.13 32.86 1twi s GLU 297 CO -0.04 0.17 1.41 -1.64 -0.56 0.00 0.00 175.26 174.60 1twi s MET 298 N -1.21 4.29 0.70 4.30 -1.94 -1.26 -4.97 119.30 119.21 1twi s MET 298 Ca 0.46 2.27 0.02 0.00 -1.71 0.00 0.00 55.69 56.73 1twi s MET 298 Cb -0.32 -3.11 0.13 0.00 2.01 0.00 0.00 34.83 33.54 1twi s MET 298 CO 0.40 -0.38 0.97 -1.25 -0.01 0.00 0.00 175.02 174.75 1twi s PRO 299 N -0.53 1.74 0.45 2.03 0.04 -1.26 -4.93 135.00 132.53 1twi s PRO 299 Ca 0.58 -1.33 -0.24 0.00 0.04 0.00 0.00 61.00 60.05 1twi s PRO 299 Cb -0.41 -2.40 -0.07 0.00 0.04 0.00 0.00 34.50 31.65 1twi s PRO 299 CO 0.44 -1.38 1.20 -0.80 0.04 0.00 0.00 177.00 176.50 1twi s ASN 300 N -4.76 6.16 -0.15 6.66 0.01 -0.39 -4.72 114.94 117.74 1twi s ASN 300 Ca 0.66 2.40 -0.01 0.00 -0.71 0.00 0.00 52.86 55.20 1twi s ASN 300 Cb -0.05 -2.61 -0.01 0.00 0.41 0.00 0.00 41.25 38.99 1twi s ASN 300 CO 0.44 -0.93 -0.10 -0.22 -1.51 0.00 0.00 177.10 174.77 1twi s LEU 301 N -2.90 2.79 -0.02 0.60 2.96 0.14 -1.30 118.68 120.96 1twi s LEU 301 Ca 0.62 -0.33 0.07 0.00 -0.22 0.00 0.00 54.13 54.27 1twi s LEU 301 Cb -0.31 -1.65 -0.02 0.00 0.50 0.00 0.00 46.19 44.71 1twi s LEU 301 CO 0.39 0.12 -0.23 -0.63 -1.32 0.00 0.00 176.35 174.67 1twi s ILE 302 N 0.64 1.82 0.18 6.68 1.01 -0.18 -1.23 121.20 130.11 1twi s ILE 302 Ca -0.06 -0.98 0.09 0.00 0.00 0.00 0.00 60.65 59.70 1twi s ILE 302 Cb -0.15 -1.51 -0.04 0.00 0.01 0.00 0.00 42.46 40.76 1twi s ILE 302 CO 0.03 0.51 -0.19 -0.76 0.00 0.00 0.00 174.94 174.53 1twi s LEU 303 N -0.49 2.45 -0.48 2.97 1.43 -0.53 -1.82 118.68 122.21 1twi s LEU 303 Ca 0.08 -0.88 0.06 0.00 -1.03 0.00 0.00 54.13 52.36 1twi s LEU 303 Cb -0.09 -0.88 0.39 0.00 0.03 0.00 0.00 46.19 45.64 1twi s LEU 303 CO -0.00 -0.02 1.01 -0.62 0.23 0.00 0.00 176.35 176.95 1twi n GLU 304 N 0.19 3.03 -2.19 1.70 1.02 -0.01 0.31 120.64 124.71 1twi n GLU 304 Ca -0.12 -4.48 -0.38 0.00 -0.02 0.00 0.00 57.16 52.16 1twi n GLU 304 Cb 0.57 -2.13 -0.00 0.00 -0.02 0.00 0.00 31.44 29.85 1twi n GLU 304 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1twi s PRO 305 N -3.42 3.76 0.00 3.49 0.04 -1.25 -3.61 135.00 134.00 1twi s PRO 305 Ca 0.46 1.88 0.00 0.00 0.04 0.00 0.00 61.00 63.38 1twi s PRO 305 Cb 0.36 -2.47 0.00 0.00 0.04 0.00 0.00 34.50 32.43 1twi s PRO 305 CO -0.15 -0.58 0.00 0.41 0.04 0.00 0.00 177.00 176.72 1twi n GLY 306 N 0.53 0.05 0.24 0.56 0.00 -1.26 -1.16 105.19 104.15 1twi n GLY 306 Ca 0.07 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.10 1twi n GLY 306 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1twi h ARG 307 N 0.00 0.26 0.00 1.61 2.43 -1.89 -1.19 114.38 115.61 1twi h ARG 307 Ca 0.00 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1twi h ARG 307 Cb 0.00 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.49 1twi h ARG 307 CO 0.00 0.17 0.00 -1.13 -1.51 0.00 0.00 179.97 177.50 1twi n SER 308 N -5.12 0.00 -0.12 -3.80 3.41 -1.26 -0.88 113.62 105.85 1twi n SER 308 Ca 0.10 -0.16 -0.17 0.00 -0.26 0.00 0.00 58.87 58.38 1twi n SER 308 Cb 0.34 -0.19 -0.13 0.00 -0.26 0.00 0.00 64.21 63.97 1twi n SER 308 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1twi n LEU 309 N -1.19 2.41 -0.00 1.04 4.77 -0.48 -4.82 117.00 118.73 1twi n LEU 309 Ca 0.10 -0.09 0.01 0.00 -0.03 0.00 0.00 56.01 56.00 1twi n LEU 309 Cb 0.11 -0.66 -0.02 0.00 -2.33 0.00 0.00 43.42 40.53 1twi n LEU 309 CO 0.12 0.85 -0.44 1.33 -1.33 0.00 0.00 177.39 177.92 1twi n VAL 310 N -3.18 0.00 -0.06 4.08 0.24 -1.03 -4.56 118.33 113.82 1twi n VAL 310 Ca -0.42 -0.12 -0.10 0.00 -2.04 0.00 0.00 64.34 61.66 1twi n VAL 310 Cb 1.02 0.54 -0.04 0.00 -1.47 0.00 0.00 33.84 33.89 1twi n VAL 310 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1twi h ALA 311 N 0.22 -0.42 0.00 2.33 0.00 -1.23 -2.33 119.26 117.83 1twi h ALA 311 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1twi h ALA 311 Cb 0.09 0.76 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1twi h ALA 311 CO 0.00 -0.84 0.00 0.25 0.00 0.00 0.00 179.25 178.66 1twi n THR 312 N -5.42 0.68 0.91 0.00 -2.24 -1.26 -1.22 114.28 105.72 1twi n THR 312 Ca -0.02 0.17 0.13 0.00 -2.27 0.00 0.00 64.05 62.06 1twi n THR 312 Cb 0.35 -0.89 0.36 0.00 -2.10 0.00 0.00 70.33 68.04 1twi n THR 312 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1twi n ALA 313 N -1.38 3.01 -2.67 6.98 0.00 -0.88 -4.75 120.51 120.81 1twi n ALA 313 Ca 0.06 -0.24 -0.34 0.00 0.00 0.00 0.00 53.44 52.92 1twi n ALA 313 Cb 0.16 -1.25 -0.10 0.00 0.00 0.00 0.00 19.45 18.26 1twi n ALA 313 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1twi s GLY 314 N -3.14 1.79 -0.01 0.00 0.00 -0.89 -0.27 107.32 104.80 1twi s GLY 314 Ca 0.11 -0.83 0.04 0.00 0.00 0.00 0.00 44.72 44.04 1twi s GLY 314 CO 0.65 -0.56 -0.12 -0.19 0.00 0.00 0.00 173.10 172.88 1twi s TYR 315 N -0.76 1.10 -0.22 1.90 1.51 0.21 -1.60 117.35 119.50 1twi s TYR 315 Ca 0.12 -0.21 -0.04 0.00 -1.01 0.00 0.00 57.07 55.92 1twi s TYR 315 Cb -0.11 -0.71 -0.01 0.00 -0.11 0.00 0.00 41.96 41.02 1twi s TYR 315 CO 0.02 -0.02 -0.03 -1.17 -1.11 0.00 0.00 175.55 173.24 1twi s LEU 316 N -0.30 2.98 -0.17 -1.29 2.96 -0.35 0.01 118.68 122.51 1twi s LEU 316 Ca 0.05 -0.36 -0.11 0.00 -0.22 0.00 0.00 54.13 53.49 1twi s LEU 316 Cb -0.05 -1.76 -0.05 0.00 0.50 0.00 0.00 46.19 44.83 1twi s LEU 316 CO -0.00 -0.01 0.19 -0.76 -1.32 0.00 0.00 176.35 174.45 1twi s LEU 317 N 1.44 4.26 -0.04 -0.68 1.43 0.11 -1.00 118.68 124.21 1twi s LEU 317 Ca 0.05 0.39 0.01 0.00 -1.03 0.00 0.00 54.13 53.55 1twi s LEU 317 Cb -0.14 -2.20 0.02 0.00 0.03 0.00 0.00 46.19 43.90 1twi s LEU 317 CO -0.02 0.20 -0.05 -0.83 0.23 0.00 0.00 176.35 175.88 1twi s GLY 318 N 0.10 0.44 0.28 -3.19 0.00 -0.45 -1.66 107.32 102.83 1twi s GLY 318 Ca 0.12 -0.06 -0.25 0.00 0.00 0.00 0.00 44.72 44.53 1twi s GLY 318 CO 0.01 0.38 0.88 1.25 0.00 0.00 0.00 173.10 175.63 1twi s LYS 319 N 0.83 4.54 -0.23 2.90 2.20 -1.26 -0.64 119.74 128.09 1twi s LYS 319 Ca -0.11 1.23 -0.23 0.00 -0.36 0.00 0.00 55.97 56.50 1twi s LYS 319 Cb -0.14 -2.92 -0.01 0.00 -1.51 0.00 0.00 37.83 33.25 1twi s LYS 319 CO 0.00 0.36 0.74 0.08 -0.36 0.00 0.00 175.35 176.18 1twi s VAL 320 N -1.50 4.92 -0.07 4.02 1.01 -0.16 -1.45 120.40 127.17 1twi s VAL 320 Ca 0.46 1.39 0.16 0.00 0.00 0.00 0.00 61.98 63.99 1twi s VAL 320 Cb -0.19 -4.04 -0.24 0.00 0.00 0.00 0.00 36.38 31.91 1twi s VAL 320 CO 0.24 0.00 0.25 1.41 0.00 0.00 0.00 175.10 177.01 1twi n HIS 321 N 5.64 0.00 -3.75 5.22 -0.00 -0.29 -0.81 115.22 121.23 1twi n HIS 321 Ca 0.03 0.00 -0.14 0.00 -0.00 0.00 0.00 57.72 57.61 1twi n HIS 321 Cb 0.48 -0.54 -0.09 0.00 -0.00 0.00 0.00 29.99 29.85 1twi n HIS 321 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 1twi s HIS 322 N -2.87 -0.22 -0.04 4.41 3.76 -1.20 -4.88 115.29 114.25 1twi s HIS 322 Ca -0.07 0.35 0.07 0.00 -0.15 0.00 0.00 55.06 55.26 1twi s HIS 322 Cb 0.08 0.12 -0.01 0.00 1.11 0.00 0.00 32.58 33.88 1twi s HIS 322 CO 0.68 -0.39 -0.25 0.42 -0.85 0.00 0.00 174.74 174.35 1twi s ILE 323 N -1.23 2.01 -0.16 0.60 -1.09 -1.26 -0.87 121.20 119.20 1twi s ILE 323 Ca -0.13 -1.06 -0.04 0.00 -2.23 0.00 0.00 60.65 57.20 1twi s ILE 323 Cb -0.05 -1.69 0.06 0.00 -1.58 0.00 0.00 42.46 39.20 1twi s ILE 323 CO 0.04 0.56 0.07 -0.75 -1.23 0.00 0.00 174.94 173.64 1twi s LYS 324 N -0.30 0.16 -0.13 2.79 2.20 0.11 -5.01 119.74 119.57 1twi s LYS 324 Ca 0.01 -0.08 -0.23 0.00 -0.36 0.00 0.00 55.97 55.31 1twi s LYS 324 Cb -0.12 -1.70 -0.03 0.00 -1.51 0.00 0.00 37.83 34.47 1twi s LYS 324 CO 0.02 -0.61 0.69 -1.21 -0.36 0.00 0.00 175.35 173.88 1twi s GLU 325 N 2.09 4.34 0.33 4.03 2.02 -1.26 -0.86 118.70 129.39 1twi s GLU 325 Ca 0.02 0.80 0.08 0.00 0.02 0.00 0.00 54.97 55.89 1twi s GLU 325 Cb -0.16 -3.51 -0.06 0.00 0.10 0.00 0.00 34.13 30.50 1twi s GLU 325 CO -0.08 -0.09 -0.05 0.95 0.02 0.00 0.00 175.26 176.01 1twi s THR 326 N 1.37 1.90 0.49 3.63 -4.23 -0.30 -5.00 115.64 113.51 1twi s THR 326 Ca 0.34 -2.12 0.23 0.00 -1.18 0.00 0.00 61.69 58.96 1twi s THR 326 Cb -0.17 -2.65 0.40 0.00 1.34 0.00 0.00 72.50 71.42 1twi s THR 326 CO 0.14 -0.18 1.95 -0.65 -0.54 0.00 0.00 174.62 175.34 1twi h PRO 327 N 2.07 0.15 -0.00 3.99 0.11 -2.06 -3.03 132.00 133.23 1twi h PRO 327 Ca -0.42 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1twi h PRO 327 Cb 1.24 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1twi h PRO 327 CO 0.71 0.10 -0.34 1.33 -0.21 0.00 0.00 178.00 179.59 1twi n VAL 328 N -4.40 0.00 -3.67 3.15 0.24 -1.26 -5.05 118.33 107.34 1twi n VAL 328 Ca 0.13 -0.33 -0.14 0.00 -2.04 0.00 0.00 64.34 61.96 1twi n VAL 328 Cb 0.65 1.03 -0.08 0.00 -1.47 0.00 0.00 33.84 33.96 1twi n VAL 328 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 1twi s THR 329 N -1.64 0.01 -0.36 3.34 2.01 -1.15 -5.11 115.64 112.75 1twi s THR 329 Ca 0.04 -0.08 -0.13 0.00 0.31 0.00 0.00 61.69 61.84 1twi s THR 329 Cb 0.06 -0.78 -0.00 0.00 0.01 0.00 0.00 72.50 71.79 1twi s THR 329 CO 0.31 -0.04 0.24 -0.75 -0.69 0.00 0.00 174.62 173.68 1twi s LYS 330 N -0.24 3.26 -0.02 4.92 2.20 -1.26 -1.15 119.74 127.45 1twi s LYS 330 Ca -0.04 -0.80 -0.14 0.00 -0.36 0.00 0.00 55.97 54.63 1twi s LYS 330 Cb -0.03 -3.81 -0.05 0.00 -1.51 0.00 0.00 37.83 32.43 1twi s LYS 330 CO 0.03 -0.55 0.37 -1.58 -0.36 0.00 0.00 175.35 173.27 1twi s TRP 331 N 1.68 3.71 -0.15 4.03 0.52 -0.04 -1.23 118.94 127.46 1twi s TRP 331 Ca 0.05 0.93 0.01 0.00 0.02 0.00 0.00 56.10 57.12 1twi s TRP 331 Cb -0.18 -2.25 0.02 0.00 -1.15 0.00 0.00 33.47 29.91 1twi s TRP 331 CO 0.09 0.65 -0.18 0.08 0.02 0.00 0.00 176.95 177.62 1twi s VAL 332 N -1.05 1.84 -0.24 4.03 1.01 -0.36 0.05 120.40 125.68 1twi s VAL 332 Ca 0.23 -0.81 -0.09 0.00 0.00 0.00 0.00 61.98 61.31 1twi s VAL 332 Cb -0.16 -1.67 -0.04 0.00 0.00 0.00 0.00 36.38 34.51 1twi s VAL 332 CO 0.12 0.50 0.11 -0.04 0.00 0.00 0.00 175.10 175.80 1twi s MET 333 N 1.23 3.88 0.32 2.72 1.00 -0.05 -1.31 119.30 127.09 1twi s MET 333 Ca 0.01 -0.37 0.10 0.00 0.00 0.00 0.00 55.69 55.43 1twi s MET 333 Cb -0.14 -3.40 -0.06 0.00 0.00 0.00 0.00 34.83 31.23 1twi s MET 333 CO -0.09 -0.02 -0.11 0.96 0.00 0.00 0.00 175.02 175.76 1twi s ILE 334 N 1.21 2.39 -2.14 2.53 -4.36 0.08 -1.14 121.20 119.78 1twi s ILE 334 Ca 0.06 -2.23 0.26 0.00 -0.26 0.00 0.00 60.65 58.48 1twi s ILE 334 Cb -0.14 -2.57 0.68 0.00 1.25 0.00 0.00 42.46 41.68 1twi s ILE 334 CO 0.05 -0.26 1.91 -0.90 0.24 0.00 0.00 174.94 175.97 1twi n ASP 335 N -0.77 0.51 -4.85 4.36 5.68 -0.53 -3.70 116.55 117.25 1twi n ASP 335 Ca -0.05 -1.30 -0.33 0.00 -0.50 0.00 0.00 54.79 52.61 1twi n ASP 335 Cb 0.62 -0.01 -0.06 0.00 -1.14 0.00 0.00 41.12 40.53 1twi n ASP 335 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1twi s ALA 336 N -1.97 3.49 0.31 2.12 0.00 -1.26 -4.26 121.76 120.19 1twi s ALA 336 Ca 0.39 -0.12 -0.02 0.00 0.00 0.00 0.00 51.96 52.21 1twi s ALA 336 Cb 0.19 -2.58 -0.01 0.00 0.00 0.00 0.00 23.12 20.72 1twi s ALA 336 CO 0.31 0.43 0.40 0.20 0.00 0.00 0.00 175.76 177.10 1twi s GLY 337 N -2.10 1.49 0.55 0.00 0.00 -1.26 -4.02 107.32 101.98 1twi s GLY 337 Ca 0.46 -1.55 0.24 0.00 0.00 0.00 0.00 44.72 43.87 1twi s GLY 337 CO 0.20 -1.08 2.07 0.00 0.00 0.00 0.00 173.10 174.29 1twi h MET 338 N 2.20 0.00 0.00 2.90 -0.00 -1.90 0.78 114.93 118.91 1twi h MET 338 Ca -0.28 0.00 -0.05 0.00 -0.00 0.00 0.00 59.70 59.37 1twi h MET 338 Cb 1.24 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.83 1twi h MET 338 CO 0.40 0.00 -0.22 -2.95 -0.00 0.00 0.00 176.91 174.14 1twi h ASN 339 N 0.00 0.00 0.77 -0.10 -1.07 -1.88 -2.66 115.58 110.64 1twi h ASN 339 Ca 0.13 0.00 -0.24 0.00 0.07 0.00 0.00 56.30 56.27 1twi h ASN 339 Cb 0.59 0.00 -0.01 0.00 -2.07 0.00 0.00 38.32 36.83 1twi h ASN 339 CO -0.00 0.22 -1.10 0.44 0.07 0.00 0.00 177.43 177.06 1twi h ASP 340 N 0.00 0.24 -1.42 6.14 3.32 -1.10 0.18 116.42 123.78 1twi h ASP 340 Ca -0.00 -0.25 -0.03 0.00 0.02 0.00 0.00 57.03 56.77 1twi h ASP 340 Cb 0.62 -0.08 -0.25 0.00 0.22 0.00 0.00 39.33 39.85 1twi h ASP 340 CO 0.03 1.17 -0.38 -0.32 -1.72 0.00 0.00 179.24 178.02 1twi s MET 341 N -2.75 0.47 0.00 3.56 1.75 -1.02 -4.42 119.30 116.88 1twi s MET 341 Ca -0.02 0.74 0.27 0.00 -1.25 0.00 0.00 55.69 55.43 1twi s MET 341 Cb 0.09 0.06 0.84 0.00 2.84 0.00 0.00 34.83 38.65 1twi s MET 341 CO 0.85 -0.67 1.62 -1.33 -0.65 0.00 0.00 175.02 174.84 1twi n MET 342 N 5.40 1.27 -0.18 4.11 2.81 -1.08 -4.30 117.12 125.14 1twi n MET 342 Ca -0.02 -0.77 -0.08 0.00 -1.81 0.00 0.00 57.70 55.02 1twi n MET 342 Cb 0.51 -1.48 0.02 0.00 -0.71 0.00 0.00 33.22 31.55 1twi n MET 342 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1twi h ARG 343 N 1.88 0.76 -0.32 0.03 3.08 -1.88 0.22 114.38 118.14 1twi h ARG 343 Ca 0.00 -0.12 -0.01 0.00 0.07 0.00 0.00 59.98 59.92 1twi h ARG 343 Cb 0.53 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.43 1twi h ARG 343 CO 0.00 0.63 0.15 -1.35 -1.07 0.00 0.00 179.97 178.33 1twi h PRO 344 N 0.70 0.47 -0.48 0.04 0.11 -1.81 0.49 132.00 131.52 1twi h PRO 344 Ca 0.18 -0.07 -0.04 0.00 0.11 0.00 0.00 66.00 66.17 1twi h PRO 344 Cb 0.13 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 31.14 1twi h PRO 344 CO -0.02 0.44 0.13 0.00 -0.21 0.00 0.00 178.00 178.34 1twi h ALA 345 N 1.00 1.32 0.13 -0.75 0.00 -1.66 0.51 119.26 119.82 1twi h ALA 345 Ca 0.11 -0.18 -0.22 0.00 0.00 0.00 0.00 54.91 54.62 1twi h ALA 345 Cb 0.14 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 17.74 1twi h ALA 345 CO -0.01 0.48 -1.06 1.98 0.00 0.00 0.00 179.25 180.64 1twi h MET 346 N 0.70 0.27 0.00 0.00 -1.53 -0.39 -3.41 114.93 110.58 1twi h MET 346 Ca 0.16 -0.47 0.00 0.00 -3.44 0.00 0.00 59.70 55.95 1twi h MET 346 Cb 0.24 0.17 0.00 0.00 -0.55 0.00 0.00 31.60 31.47 1twi h MET 346 CO -0.00 1.22 0.00 0.66 0.14 0.00 0.00 176.91 178.93 1twi n TYR 347 N -4.05 0.00 -3.22 1.39 4.01 0.15 -4.97 117.16 110.47 1twi n TYR 347 Ca -0.19 -0.27 -0.23 0.00 -0.16 0.00 0.00 57.90 57.05 1twi n TYR 347 Cb 0.85 -0.03 0.02 0.00 -0.31 0.00 0.00 39.34 39.88 1twi n TYR 347 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 1twi n GLU 348 N -0.27 -4.44 -2.49 -0.72 1.02 0.18 -4.92 120.64 109.00 1twi n GLU 348 Ca 0.00 0.72 -0.37 0.00 -0.02 0.00 0.00 57.16 57.49 1twi n GLU 348 Cb 0.16 -5.53 -0.04 0.00 -0.02 0.00 0.00 31.44 26.02 1twi n GLU 348 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1twi s ALA 349 N -3.09 3.10 -0.08 0.62 0.00 -1.19 -4.94 121.76 116.19 1twi s ALA 349 Ca 0.37 0.76 -0.22 0.00 0.00 0.00 0.00 51.96 52.87 1twi s ALA 349 Cb -0.18 -3.30 -0.04 0.00 0.00 0.00 0.00 23.12 19.61 1twi s ALA 349 CO 0.46 -0.28 0.63 -0.47 0.00 0.00 0.00 175.76 176.09 1twi s TYR 350 N -1.59 3.56 -0.01 0.00 6.14 -1.26 -4.25 117.35 119.95 1twi s TYR 350 Ca 0.57 1.14 0.05 0.00 0.64 0.00 0.00 57.07 59.47 1twi s TYR 350 Cb -0.24 -2.72 -0.01 0.00 0.42 0.00 0.00 41.96 39.40 1twi s TYR 350 CO 0.30 0.12 -0.17 -1.01 0.64 0.00 0.00 175.55 175.43 1twi s HIS 351 N 0.73 1.51 0.26 4.97 3.76 -1.26 -4.80 115.29 120.45 1twi s HIS 351 Ca 0.34 -0.29 -0.30 0.00 -0.15 0.00 0.00 55.06 54.66 1twi s HIS 351 Cb -0.17 -0.96 -0.09 0.00 1.11 0.00 0.00 32.58 32.46 1twi s HIS 351 CO 0.16 -0.01 1.23 -1.58 -0.85 0.00 0.00 174.74 173.69 1twi s HIS 352 N -0.45 3.31 -0.02 1.40 2.46 -1.26 -4.86 115.29 115.88 1twi s HIS 352 Ca 0.06 1.44 0.03 0.00 0.47 0.00 0.00 55.06 57.06 1twi s HIS 352 Cb -0.07 -3.51 -0.00 0.00 -0.13 0.00 0.00 32.58 28.87 1twi s HIS 352 CO -0.00 -1.41 -0.11 0.42 -2.47 0.00 0.00 174.74 171.17 1twi s ILE 353 N -0.62 0.89 0.16 0.89 1.01 -1.26 -0.71 121.20 121.56 1twi s ILE 353 Ca 0.51 -0.45 0.00 0.00 0.00 0.00 0.00 60.65 60.71 1twi s ILE 353 Cb -0.36 -0.76 -0.04 0.00 0.01 0.00 0.00 42.46 41.31 1twi s ILE 353 CO 0.43 0.26 0.04 0.27 0.00 0.00 0.00 174.94 175.95 1twi s ILE 354 N -0.03 0.35 0.10 2.92 -4.36 -0.67 -4.93 121.20 114.57 1twi s ILE 354 Ca 0.00 -1.95 -0.22 0.00 -0.26 0.00 0.00 60.65 58.23 1twi s ILE 354 Cb -0.07 -2.15 -0.07 0.00 1.25 0.00 0.00 42.46 41.42 1twi s ILE 354 CO 0.00 -0.40 0.66 0.21 0.24 0.00 0.00 174.94 175.65 1twi s ASN 355 N -3.13 7.18 0.01 4.36 3.84 -1.26 -0.63 114.94 125.32 1twi s ASN 355 Ca 0.26 1.40 0.15 0.00 0.21 0.00 0.00 52.86 54.88 1twi s ASN 355 Cb 0.07 -2.42 0.64 0.00 -0.55 0.00 0.00 41.25 39.00 1twi s ASN 355 CO 0.04 0.22 1.48 0.00 -2.79 0.00 0.00 177.10 176.06 1twi s LYS 357 N -3.01 2.99 0.29 0.00 2.20 -1.26 -0.62 119.74 120.33 1twi s LYS 357 Ca 0.07 -0.84 -0.29 0.00 -0.36 0.00 0.00 55.97 54.55 1twi s LYS 357 Cb 0.10 -2.49 -0.10 0.00 -1.51 0.00 0.00 37.83 33.83 1twi s LYS 357 CO 0.27 -0.10 1.30 0.08 -0.36 0.00 0.00 175.35 176.54 1twi s VAL 358 N 1.03 2.91 0.23 4.02 1.01 -0.23 -4.84 120.40 124.53 1twi s VAL 358 Ca -0.02 0.86 0.04 0.00 0.00 0.00 0.00 61.98 62.87 1twi s VAL 358 Cb -0.14 -3.55 -0.05 0.00 0.00 0.00 0.00 36.38 32.64 1twi s VAL 358 CO -0.07 0.18 -0.04 -0.54 0.00 0.00 0.00 175.10 174.64 1twi s LYS 359 N -1.23 1.34 0.20 2.72 -0.14 -1.26 -4.98 119.74 116.39 1twi s LYS 359 Ca 0.51 -1.66 0.02 0.00 -1.36 0.00 0.00 55.97 53.48 1twi s LYS 359 Cb -0.38 -0.75 0.13 0.00 -1.68 0.00 0.00 37.83 35.14 1twi s LYS 359 CO 0.47 -0.03 1.47 -0.91 -0.76 0.00 0.00 175.35 175.60 1twi h ASN 360 N 2.48 0.33 -2.74 2.83 2.35 -1.97 -3.44 115.58 115.42 1twi h ASN 360 Ca -0.38 -0.22 -0.66 0.00 -0.55 0.00 0.00 56.30 54.49 1twi h ASN 360 Cb 1.22 -0.10 -0.07 0.00 0.05 0.00 0.00 38.32 39.42 1twi h ASN 360 CO 0.65 0.94 -0.44 -0.70 -1.65 0.00 0.00 177.43 176.22 1twi s GLU 361 N -3.58 3.56 0.04 0.81 2.12 -1.26 -5.03 118.70 115.36 1twi s GLU 361 Ca -0.04 -0.06 0.05 0.00 0.36 0.00 0.00 54.97 55.28 1twi s GLU 361 Cb 0.11 -3.21 -0.03 0.00 0.26 0.00 0.00 34.13 31.25 1twi s GLU 361 CO 0.82 0.73 -0.11 0.15 -0.54 0.00 0.00 175.26 176.31 1twi s LYS 362 N -0.92 2.32 0.15 4.30 3.01 -1.26 -0.37 119.74 126.97 1twi s LYS 362 Ca 0.16 -0.87 -0.07 0.00 -1.01 0.00 0.00 55.97 54.18 1twi s LYS 362 Cb -0.13 -2.37 -0.01 0.00 -1.01 0.00 0.00 37.83 34.32 1twi s LYS 362 CO 0.05 0.56 0.22 -1.83 0.51 0.00 0.00 175.35 174.86 1twi s GLU 363 N -1.60 1.06 -0.25 1.68 -1.05 0.31 -4.85 118.70 114.00 1twi s GLU 363 Ca 0.17 -1.20 -0.11 0.00 -0.15 0.00 0.00 54.97 53.69 1twi s GLU 363 Cb -0.11 0.34 -0.05 0.00 -0.44 0.00 0.00 34.13 33.88 1twi s GLU 363 CO 0.08 -0.36 0.19 0.08 0.95 0.00 0.00 175.26 176.20 1twi s VAL 364 N -3.97 5.33 0.15 1.83 1.01 -1.26 -0.81 120.40 122.69 1twi s VAL 364 Ca 0.17 0.23 -0.02 0.00 0.00 0.00 0.00 61.98 62.36 1twi s VAL 364 Cb 0.04 -3.53 -0.04 0.00 0.00 0.00 0.00 36.38 32.86 1twi s VAL 364 CO -0.01 0.31 0.11 0.68 0.00 0.00 0.00 175.10 176.18 1twi s VAL 365 N 1.28 0.07 -0.03 2.92 -7.23 0.55 -4.52 120.40 113.45 1twi s VAL 365 Ca 0.09 -1.87 0.05 0.00 -1.81 0.00 0.00 61.98 58.44 1twi s VAL 365 Cb -0.14 -2.13 -0.03 0.00 0.56 0.00 0.00 36.38 34.64 1twi s VAL 365 CO 0.06 -0.33 -0.18 -0.44 -0.31 0.00 0.00 175.10 173.90 1twi s SER 366 N -3.07 3.72 -0.18 4.85 0.01 -0.36 -0.63 113.70 118.03 1twi s SER 366 Ca 0.27 -0.30 -0.02 0.00 1.31 0.00 0.00 55.95 57.20 1twi s SER 366 Cb 0.07 -0.67 -0.01 0.00 0.21 0.00 0.00 66.02 65.62 1twi s SER 366 CO 0.04 0.33 -0.08 -0.63 0.41 0.00 0.00 173.24 173.30 1twi s ILE 367 N -0.72 3.18 0.14 1.44 1.09 -0.15 -1.22 121.20 124.96 1twi s ILE 367 Ca 0.11 -0.58 0.05 0.00 -1.10 0.00 0.00 60.65 59.14 1twi s ILE 367 Cb -0.10 -2.40 -0.04 0.00 -1.06 0.00 0.00 42.46 38.85 1twi s ILE 367 CO 0.01 0.47 -0.12 0.00 -0.10 0.00 0.00 174.94 175.20 1twi s ALA 368 N 1.04 1.50 0.70 9.38 0.00 -0.43 -0.16 121.76 133.79 1twi s ALA 368 Ca -0.00 -1.44 -0.03 0.00 0.00 0.00 0.00 51.96 50.50 1twi s ALA 368 Cb -0.15 0.00 0.09 0.00 0.00 0.00 0.00 23.12 23.06 1twi s ALA 368 CO -0.01 -0.03 0.57 0.41 0.00 0.00 0.00 175.76 176.70 1twi n GLY 369 N 0.02 0.10 1.74 0.00 0.00 -1.12 -0.75 105.19 105.18 1twi n GLY 369 Ca -0.12 -1.90 0.09 0.00 0.00 0.00 0.00 46.02 44.09 1twi n GLY 369 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1twi n GLY 370 N 0.87 2.84 3.88 -0.02 0.00 -1.24 -4.74 105.19 106.79 1twi n GLY 370 Ca 0.09 -0.89 -0.30 0.00 0.00 0.00 0.00 46.02 44.92 1twi n GLY 370 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1twi s LEU 371 N -2.22 3.74 0.48 0.99 1.02 -1.26 -4.97 118.68 116.46 1twi s LEU 371 Ca 0.53 1.10 0.32 0.00 0.02 0.00 0.00 54.13 56.10 1twi s LEU 371 Cb 0.37 -4.01 1.75 0.00 0.02 0.00 0.00 46.19 44.32 1twi s LEU 371 CO 0.22 -0.48 1.99 0.00 0.02 0.00 0.00 176.35 178.09 1twi s GLU 373 N -3.83 4.59 0.40 0.00 2.56 -1.26 -4.94 118.70 116.23 1twi s GLU 373 Ca -0.04 1.33 0.29 0.00 0.00 0.00 0.00 54.97 56.55 1twi s GLU 373 Cb 0.09 -3.41 1.16 0.00 2.00 0.00 0.00 34.13 33.97 1twi s GLU 373 CO 0.29 0.12 1.85 0.66 -0.56 0.00 0.00 175.26 177.62 1twi h SER 374 N 6.14 0.00 0.43 -1.70 4.64 -2.03 -0.33 113.55 120.69 1twi h SER 374 Ca -0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.90 1twi h SER 374 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1twi h SER 374 CO 0.73 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 175.15 1twi n SER 375 N -2.67 0.00 -3.83 4.97 3.41 -1.26 -4.34 113.62 109.90 1twi n SER 375 Ca 0.01 -0.21 -0.42 0.00 -0.26 0.00 0.00 58.87 57.99 1twi n SER 375 Cb 0.28 -0.24 0.00 0.00 -0.26 0.00 0.00 64.21 63.99 1twi n SER 375 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1twi n ASP 376 N -1.24 4.28 -3.75 4.04 2.03 -0.14 -4.17 116.55 117.61 1twi n ASP 376 Ca 0.14 -2.92 -0.20 0.00 0.52 0.00 0.00 54.79 52.33 1twi n ASP 376 Cb 0.19 -1.62 -0.17 0.00 -0.72 0.00 0.00 41.12 38.81 1twi n ASP 376 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1twi s VAL 377 N 2.49 0.15 0.08 5.18 1.01 -1.26 -2.80 120.40 125.24 1twi s VAL 377 Ca 0.45 0.22 0.07 0.00 0.00 0.00 0.00 61.98 62.72 1twi s VAL 377 Cb 0.12 -0.32 -0.22 0.00 0.00 0.00 0.00 36.38 35.96 1twi s VAL 377 CO -0.05 0.20 1.12 -0.26 0.00 0.00 0.00 175.10 176.10 1twi h PHE 378 N 8.03 0.05 -2.13 5.22 0.04 -0.87 -3.42 116.94 123.86 1twi h PHE 378 Ca -0.24 -0.04 0.01 0.00 2.80 0.00 0.00 57.97 60.50 1twi h PHE 378 Cb 1.13 -0.00 -0.18 0.00 2.20 0.00 0.00 35.95 39.09 1twi h PHE 378 CO 0.49 1.03 0.33 0.20 -0.60 0.00 0.00 178.31 179.76 1twi s GLY 379 N -4.81 -0.49 0.02 -1.45 0.00 -1.15 -4.72 107.32 94.73 1twi s GLY 379 Ca -0.01 1.28 0.07 0.00 0.00 0.00 0.00 44.72 46.06 1twi s GLY 379 CO 0.83 0.72 -0.21 0.50 0.00 0.00 0.00 173.10 174.94 1twi s ARG 380 N -1.99 1.49 -1.34 2.90 0.52 -1.26 -0.97 118.95 118.29 1twi s ARG 380 Ca -0.04 -0.86 -0.03 0.00 -0.52 0.00 0.00 55.73 54.28 1twi s ARG 380 Cb -0.00 -1.54 -0.00 0.00 0.52 0.00 0.00 34.95 33.93 1twi s ARG 380 CO 0.00 0.40 0.53 -0.25 0.02 0.00 0.00 175.30 176.00 1twi n ASP 381 N 2.13 -1.23 -4.87 0.23 8.00 -1.08 -4.94 116.55 114.79 1twi n ASP 381 Ca -0.16 -0.97 -0.37 0.00 0.71 0.00 0.00 54.79 53.99 1twi n ASP 381 Cb 0.53 -3.29 -0.06 0.00 -0.02 0.00 0.00 41.12 38.28 1twi n ASP 381 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1twi s ARG 382 N -6.36 3.51 -0.28 -1.24 1.81 0.19 -4.81 118.95 111.78 1twi s ARG 382 Ca 0.07 -0.06 -0.20 0.00 -1.72 0.00 0.00 55.73 53.83 1twi s ARG 382 Cb -0.03 -3.19 -0.01 0.00 -0.45 0.00 0.00 34.95 31.27 1twi s ARG 382 CO 0.87 0.76 0.62 -2.00 -0.68 0.00 0.00 175.30 174.87 1twi s GLU 383 N -1.10 4.00 0.20 3.54 2.12 -1.26 -0.33 118.70 125.86 1twi s GLU 383 Ca 0.17 0.40 0.06 0.00 0.36 0.00 0.00 54.97 55.96 1twi s GLU 383 Cb -0.13 -3.69 -0.05 0.00 0.26 0.00 0.00 34.13 30.52 1twi s GLU 383 CO 0.06 -0.49 -0.11 -0.51 -0.54 0.00 0.00 175.26 173.67 1twi s LEU 384 N 2.54 2.51 0.24 2.70 1.02 0.01 -4.92 118.68 122.78 1twi s LEU 384 Ca 0.25 -1.05 -0.30 0.00 0.02 0.00 0.00 54.13 53.05 1twi s LEU 384 Cb -0.15 -0.55 -0.10 0.00 0.02 0.00 0.00 46.19 45.41 1twi s LEU 384 CO 0.10 -0.26 1.46 -1.81 0.02 0.00 0.00 176.35 175.86 1twi s ASP 385 N -3.29 6.64 -0.31 2.29 1.11 -1.26 -0.53 116.67 121.33 1twi s ASP 385 Ca 0.22 2.66 -0.29 0.00 0.18 0.00 0.00 52.55 55.33 1twi s ASP 385 Cb 0.01 -2.62 -0.12 0.00 1.07 0.00 0.00 42.92 41.26 1twi s ASP 385 CO 0.06 -0.72 1.04 1.17 1.18 0.00 0.00 175.17 177.90 1twi n LYS 386 N 2.52 0.00 -3.29 8.23 3.00 0.50 -4.75 118.16 124.37 1twi n LYS 386 Ca 0.08 0.00 -0.38 0.00 -0.00 0.00 0.00 58.31 58.00 1twi n LYS 386 Cb 0.40 -0.92 -0.06 0.00 0.00 0.00 0.00 35.03 34.45 1twi n LYS 386 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 1twi s VAL 387 N 2.15 5.14 0.15 3.15 1.01 -1.26 -4.93 120.40 125.80 1twi s VAL 387 Ca 0.66 1.02 0.09 0.00 0.00 0.00 0.00 61.98 63.75 1twi s VAL 387 Cb -0.92 -3.84 -0.04 0.00 0.00 0.00 0.00 36.38 31.58 1twi s VAL 387 CO 0.49 0.35 -0.20 -1.61 0.00 0.00 0.00 175.10 174.12 1twi s GLU 388 N 0.44 1.28 0.35 2.72 0.41 -1.26 -5.04 118.70 117.59 1twi s GLU 388 Ca 0.27 -1.36 -0.29 0.00 -0.41 0.00 0.00 54.97 53.18 1twi s GLU 388 Cb -0.16 -1.44 -0.11 0.00 -1.78 0.00 0.00 34.13 30.64 1twi s GLU 388 CO 0.12 0.31 1.51 0.08 -0.49 0.00 0.00 175.26 176.79 1twi s VAL 389 N -1.74 2.09 0.00 2.63 1.01 -1.26 -1.52 120.40 121.61 1twi s VAL 389 Ca 0.14 0.08 0.00 0.00 0.00 0.00 0.00 61.98 62.21 1twi s VAL 389 Cb -0.07 -3.05 0.00 0.00 0.00 0.00 0.00 36.38 33.25 1twi s VAL 389 CO 0.06 0.02 0.00 0.61 0.00 0.00 0.00 175.10 175.79 1twi n GLY 390 N 1.03 3.45 3.78 4.51 0.00 0.01 -5.00 105.19 112.96 1twi n GLY 390 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.75 1twi n GLY 390 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1twi s ASP 391 N -0.93 4.54 -0.10 1.61 1.01 -0.57 -4.73 116.67 117.48 1twi s ASP 391 Ca 0.00 1.58 0.03 0.00 0.71 0.00 0.00 52.55 54.88 1twi s ASP 391 Cb 0.00 -2.33 -0.00 0.00 1.01 0.00 0.00 42.92 41.59 1twi s ASP 391 CO 0.00 -1.98 -0.22 -0.69 0.21 0.00 0.00 175.17 172.49 1twi s VAL 392 N -3.01 2.24 0.00 -1.27 1.01 -1.26 -0.99 120.40 117.13 1twi s VAL 392 Ca 0.61 -0.96 -0.01 0.00 0.00 0.00 0.00 61.98 61.62 1twi s VAL 392 Cb -0.16 -1.87 -0.04 0.00 0.00 0.00 0.00 36.38 34.31 1twi s VAL 392 CO 0.56 0.55 0.13 -0.76 0.00 0.00 0.00 175.10 175.58 1twi s LEU 393 N 0.30 4.13 -0.15 3.92 1.43 0.19 -0.24 118.68 128.25 1twi s LEU 393 Ca -0.16 0.23 -0.01 0.00 -1.03 0.00 0.00 54.13 53.16 1twi s LEU 393 Cb -0.17 -2.47 -0.01 0.00 0.03 0.00 0.00 46.19 43.57 1twi s LEU 393 CO 0.08 0.26 -0.11 0.00 0.23 0.00 0.00 176.35 176.81 1twi s ALA 394 N -1.28 2.68 -0.25 4.21 0.00 0.20 -1.35 121.76 125.98 1twi s ALA 394 Ca 0.26 -0.96 -0.08 0.00 0.00 0.00 0.00 51.96 51.17 1twi s ALA 394 Cb -0.12 -1.35 -0.04 0.00 0.00 0.00 0.00 23.12 21.62 1twi s ALA 394 CO 0.17 0.07 0.10 0.42 0.00 0.00 0.00 175.76 176.51 1twi s ILE 395 N 0.65 4.61 0.56 0.00 1.01 -0.17 -1.67 121.20 126.19 1twi s ILE 395 Ca -0.06 -0.07 -0.08 0.00 0.00 0.00 0.00 60.65 60.44 1twi s ILE 395 Cb -0.15 -3.16 -0.03 0.00 0.01 0.00 0.00 42.46 39.13 1twi s ILE 395 CO 0.03 0.34 0.92 -0.36 0.00 0.00 0.00 174.94 175.86 1twi s PHE 396 N 1.46 3.57 -1.26 3.97 0.40 0.12 -1.21 117.98 125.03 1twi s PHE 396 Ca 0.06 1.03 -0.00 0.00 -0.60 0.00 0.00 56.93 57.42 1twi s PHE 396 Cb -0.15 -2.55 0.00 0.00 0.51 0.00 0.00 43.02 40.83 1twi s PHE 396 CO 0.05 -0.54 0.84 -0.25 0.70 0.00 0.00 175.22 176.03 1twi n ASP 397 N -2.54 -1.62 -0.83 1.36 8.00 -0.84 -4.48 116.55 115.61 1twi n ASP 397 Ca 0.04 -0.72 0.09 0.00 0.71 0.00 0.00 54.79 54.90 1twi n ASP 397 Cb 0.55 -4.57 0.25 0.00 -0.02 0.00 0.00 41.12 37.33 1twi n ASP 397 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 1twi n VAL 398 N -4.21 2.23 0.25 2.53 0.24 -0.63 -4.63 118.33 114.12 1twi n VAL 398 Ca -0.29 -1.89 0.14 0.00 -2.04 0.00 0.00 64.34 60.25 1twi n VAL 398 Cb 0.67 -0.24 0.57 0.00 -1.47 0.00 0.00 33.84 33.37 1twi n VAL 398 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 1twi h GLY 399 N 1.68 0.00 -4.97 7.63 0.00 -1.29 -3.34 103.07 102.78 1twi h GLY 399 Ca 0.00 0.00 -0.69 0.00 0.00 0.00 0.00 47.33 46.64 1twi h GLY 399 CO 0.20 0.00 -0.82 0.00 0.00 0.00 0.00 176.54 175.92 1twi s ALA 400 N -3.66 2.44 -1.41 3.60 0.00 -1.26 -4.48 121.76 116.99 1twi s ALA 400 Ca 0.01 -1.01 -0.10 0.00 0.00 0.00 0.00 51.96 50.86 1twi s ALA 400 Cb 0.09 -0.85 0.07 0.00 0.00 0.00 0.00 23.12 22.43 1twi s ALA 400 CO 0.59 0.47 0.64 0.66 0.00 0.00 0.00 175.76 178.12 1twi n TYR 401 N 2.67 -1.94 0.00 0.00 4.01 -0.05 -4.88 117.16 116.97 1twi n TYR 401 Ca -0.17 0.59 0.00 0.00 -0.16 0.00 0.00 57.90 58.16 1twi n TYR 401 Cb 0.52 -3.47 0.00 0.00 -0.31 0.00 0.00 39.34 36.08 1twi n TYR 401 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1twi n GLY 402 N -1.37 0.30 0.28 2.72 0.00 -1.25 -4.58 105.19 101.28 1twi n GLY 402 Ca -0.02 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.14 1twi n GLY 402 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1twi h ILE 403 N 0.00 0.59 0.00 -0.61 6.09 -1.77 -2.09 117.51 119.71 1twi h ILE 403 Ca 0.00 -0.29 0.00 0.00 -1.37 0.00 0.00 64.86 63.20 1twi h ILE 403 Cb 0.00 1.19 0.00 0.00 0.47 0.00 0.00 36.82 38.48 1twi h ILE 403 CO 0.00 0.07 0.00 0.77 -3.07 0.00 0.00 178.15 175.92 1twi h SER 404 N 0.00 0.00 -0.10 2.19 4.64 -1.86 -1.77 113.55 116.64 1twi h SER 404 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1twi h SER 404 Cb 0.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.27 1twi h SER 404 CO 0.01 0.00 0.00 0.23 -0.87 0.00 0.00 176.83 176.20 1twi n MET 405 N -2.50 2.17 -1.27 4.77 2.81 -0.81 -5.04 117.12 117.25 1twi n MET 405 Ca 0.01 -1.49 -0.33 0.00 -1.81 0.00 0.00 57.70 54.08 1twi n MET 405 Cb 0.20 -1.10 0.10 0.00 -0.71 0.00 0.00 33.22 31.72 1twi n MET 405 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1twi s ALA 406 N -0.85 2.04 0.02 3.04 0.00 -0.67 -4.74 121.76 120.60 1twi s ALA 406 Ca 0.08 0.64 -0.00 0.00 0.00 0.00 0.00 51.96 52.68 1twi s ALA 406 Cb 0.04 -3.40 0.00 0.00 0.00 0.00 0.00 23.12 19.76 1twi s ALA 406 CO 0.06 -1.99 0.04 0.27 0.00 0.00 0.00 175.76 174.14 1twi n ASN 407 N -3.20 -0.11 -0.79 0.00 6.94 0.64 -5.02 115.26 113.72 1twi n ASN 407 Ca 0.12 -1.10 0.09 0.00 -0.02 0.00 0.00 54.58 53.66 1twi n ASN 407 Cb 0.51 0.19 0.24 0.00 -2.36 0.00 0.00 39.78 38.37 1twi n ASN 407 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 1twi n ASN 408 N -1.57 3.65 -4.55 0.53 3.02 -1.26 -4.53 115.26 110.55 1twi n ASN 408 Ca -0.00 -3.05 -0.49 0.00 -0.03 0.00 0.00 54.58 51.01 1twi n ASN 408 Cb 0.04 -0.53 -0.04 0.00 -0.61 0.00 0.00 39.78 38.63 1twi n ASN 408 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1twi n TYR 409 N -0.65 1.02 -1.76 3.10 9.36 -1.26 -0.53 117.16 126.43 1twi n TYR 409 Ca 0.21 0.75 -0.07 0.00 3.32 0.00 0.00 57.90 62.11 1twi n TYR 409 Cb 0.86 -2.22 -0.01 0.00 -0.63 0.00 0.00 39.34 37.34 1twi n TYR 409 CO 0.00 0.00 0.00 0.09 0.22 0.00 0.00 176.86 177.17 1twi n ASN 410 N 1.86 -3.19 -3.83 2.98 5.03 -1.26 -3.69 115.26 113.16 1twi n ASN 410 Ca 0.15 0.07 -0.29 0.00 0.87 0.00 0.00 54.58 55.38 1twi n ASN 410 Cb 0.24 -2.04 0.01 0.00 -1.02 0.00 0.00 39.78 36.97 1twi n ASN 410 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1twi n ALA 411 N -0.35 -2.27 -3.08 5.41 0.00 0.31 -5.00 120.51 115.53 1twi n ALA 411 Ca -0.08 -0.27 -0.32 0.00 0.00 0.00 0.00 53.44 52.77 1twi n ALA 411 Cb 0.43 -2.68 -0.16 0.00 0.00 0.00 0.00 19.45 17.04 1twi n ALA 411 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1twi s ARG 412 N -6.32 3.04 0.55 0.00 0.52 -0.92 -5.09 118.95 110.73 1twi s ARG 412 Ca 0.23 -0.83 -0.19 0.00 -0.52 0.00 0.00 55.73 54.42 1twi s ARG 412 Cb -0.09 -2.36 -0.05 0.00 0.52 0.00 0.00 34.95 32.97 1twi s ARG 412 CO 0.88 0.24 1.12 0.20 0.02 0.00 0.00 175.30 177.76 1twi s GLY 413 N 0.23 2.58 0.52 -3.53 0.00 -1.26 -4.25 107.32 101.61 1twi s GLY 413 Ca -0.14 0.79 -0.21 0.00 0.00 0.00 0.00 44.72 45.17 1twi s GLY 413 CO 0.07 1.14 1.15 0.50 0.00 0.00 0.00 173.10 175.96 1twi s ARG 414 N -3.36 3.48 0.82 2.90 0.52 -1.26 -4.76 118.95 117.29 1twi s ARG 414 Ca 0.72 1.68 -0.12 0.00 -0.52 0.00 0.00 55.73 57.50 1twi s ARG 414 Cb -0.23 -2.14 0.08 0.00 0.52 0.00 0.00 34.95 33.17 1twi s ARG 414 CO 0.28 -0.76 1.13 -1.25 0.02 0.00 0.00 175.30 174.72 1twi s PRO 415 N -3.08 1.92 0.74 3.54 0.04 -1.26 -2.26 135.00 134.64 1twi s PRO 415 Ca 0.70 0.37 -0.11 0.00 0.04 0.00 0.00 61.00 62.00 1twi s PRO 415 Cb -0.26 -1.92 0.04 0.00 0.04 0.00 0.00 34.50 32.39 1twi s PRO 415 CO 0.30 -1.68 1.08 1.03 0.04 0.00 0.00 177.00 177.77 1twi s ARG 416 N -5.34 2.54 -0.04 4.56 0.52 -1.26 -4.46 118.95 115.48 1twi s ARG 416 Ca 0.61 0.98 -0.02 0.00 -0.52 0.00 0.00 55.73 56.78 1twi s ARG 416 Cb -0.13 -1.94 0.02 0.00 0.52 0.00 0.00 34.95 33.41 1twi s ARG 416 CO 0.52 -1.38 0.09 1.41 0.02 0.00 0.00 175.30 175.96 1twi s MET 417 N -5.01 0.07 0.19 3.54 -2.45 -0.76 -2.17 119.30 112.72 1twi s MET 417 Ca 0.60 0.19 0.10 0.00 -1.25 0.00 0.00 55.69 55.32 1twi s MET 417 Cb -0.15 -0.05 -0.04 0.00 1.25 0.00 0.00 34.83 35.83 1twi s MET 417 CO 0.55 -0.07 -0.20 0.14 1.05 0.00 0.00 175.02 176.49 1twi s VAL 418 N 0.47 2.07 -0.18 10.11 -7.23 -0.06 -0.81 120.40 124.77 1twi s VAL 418 Ca -0.04 -2.04 -0.02 0.00 -1.81 0.00 0.00 61.98 58.07 1twi s VAL 418 Cb -0.05 -2.01 -0.01 0.00 0.56 0.00 0.00 36.38 34.87 1twi s VAL 418 CO -0.02 -0.28 -0.09 -0.22 -0.31 0.00 0.00 175.10 174.18 1twi s LEU 419 N -2.83 2.75 -0.10 1.32 2.96 0.72 -0.71 118.68 122.81 1twi s LEU 419 Ca 0.20 -0.39 -0.16 0.00 -0.22 0.00 0.00 54.13 53.55 1twi s LEU 419 Cb -0.06 -1.67 -0.05 0.00 0.50 0.00 0.00 46.19 44.92 1twi s LEU 419 CO 0.09 0.05 0.40 0.42 -1.32 0.00 0.00 176.35 175.99 1twi s THR 420 N 1.05 5.18 0.10 3.68 -4.23 -0.06 -1.32 115.64 120.04 1twi s THR 420 Ca 0.00 0.80 -0.06 0.00 -1.18 0.00 0.00 61.69 61.25 1twi s THR 420 Cb -0.15 -3.73 -0.02 0.00 1.34 0.00 0.00 72.50 69.95 1twi s THR 420 CO -0.01 0.42 0.13 -0.55 -0.54 0.00 0.00 174.62 174.06 1twi s SER 421 N 0.09 0.23 0.51 3.99 0.15 -0.38 -1.26 113.70 117.03 1twi s SER 421 Ca 0.23 -0.85 0.24 0.00 0.70 0.00 0.00 55.95 56.26 1twi s SER 421 Cb -0.15 0.31 1.38 0.00 -1.71 0.00 0.00 66.02 65.86 1twi s SER 421 CO 0.09 -0.72 2.09 0.11 1.20 0.00 0.00 173.24 176.01 1twi h LYS 422 N 2.83 0.00 0.00 5.44 1.57 -1.97 -1.85 116.57 122.59 1twi h LYS 422 Ca -0.34 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.44 1twi h LYS 422 Cb 1.19 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.50 1twi h LYS 422 CO 0.58 0.11 0.00 1.63 -0.57 0.00 0.00 179.45 181.20 1twi n LYS 423 N -3.92 0.40 0.00 3.15 5.02 -1.26 -5.03 118.16 116.53 1twi n LYS 423 Ca -0.02 0.02 0.00 0.00 -2.02 0.00 0.00 58.31 56.28 1twi n LYS 423 Cb 0.20 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.71 1twi n LYS 423 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1twi n GLY 424 N 1.15 0.81 3.32 0.72 0.00 -0.70 -5.05 105.19 105.45 1twi n GLY 424 Ca 0.13 -2.01 -0.33 0.00 0.00 0.00 0.00 46.02 43.81 1twi n GLY 424 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1twi s VAL 425 N -1.73 2.92 0.00 1.61 1.01 -1.26 -1.25 120.40 121.70 1twi s VAL 425 Ca 0.00 -0.69 0.07 0.00 0.00 0.00 0.00 61.98 61.36 1twi s VAL 425 Cb 0.00 -2.24 -0.02 0.00 0.00 0.00 0.00 36.38 34.12 1twi s VAL 425 CO 0.00 0.51 -0.23 -0.36 0.00 0.00 0.00 175.10 175.02 1twi s PHE 426 N 0.67 2.07 -0.29 5.22 0.40 -0.43 -4.95 117.98 120.66 1twi s PHE 426 Ca -0.07 -0.39 -0.28 0.00 -0.60 0.00 0.00 56.93 55.59 1twi s PHE 426 Cb -0.15 -1.31 0.01 0.00 0.51 0.00 0.00 43.02 42.08 1twi s PHE 426 CO 0.02 0.01 0.99 -1.17 0.70 0.00 0.00 175.22 175.77 1twi s LEU 427 N -0.74 4.01 0.00 -0.37 2.96 -1.26 -0.20 118.68 123.08 1twi s LEU 427 Ca 0.09 1.03 0.15 0.00 -0.22 0.00 0.00 54.13 55.18 1twi s LEU 427 Cb -0.09 -3.42 -0.02 0.00 0.50 0.00 0.00 46.19 43.16 1twi s LEU 427 CO -0.00 -0.76 0.79 2.30 -1.32 0.00 0.00 176.35 177.36 1twi n ILE 428 N 5.65 0.00 -3.70 6.68 -5.35 0.01 -4.92 119.36 117.73 1twi n ILE 428 Ca 0.10 -0.32 -0.12 0.00 -0.27 0.00 0.00 62.75 62.13 1twi n ILE 428 Cb 0.47 1.16 -0.13 0.00 -1.74 0.00 0.00 39.64 39.40 1twi n ILE 428 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 1twi s ARG 429 N -1.86 0.22 0.46 6.28 3.52 -0.88 -4.78 118.95 121.91 1twi s ARG 429 Ca 0.12 0.65 -0.08 0.00 -0.13 0.00 0.00 55.73 56.28 1twi s ARG 429 Cb 0.12 -0.07 -0.05 0.00 -1.56 0.00 0.00 34.95 33.39 1twi s ARG 429 CO 0.40 -0.20 0.80 -1.21 -0.81 0.00 0.00 175.30 174.28 1twi s GLU 430 N 1.64 3.66 0.57 5.12 0.41 -1.26 -1.83 118.70 127.02 1twi s GLU 430 Ca -0.06 0.37 -0.07 0.00 -0.41 0.00 0.00 54.97 54.79 1twi s GLU 430 Cb -0.11 -2.36 -0.01 0.00 -1.78 0.00 0.00 34.13 29.87 1twi s GLU 430 CO -0.09 -0.15 0.91 -0.98 -0.49 0.00 0.00 175.26 174.45 1twi s ARG 431 N -4.35 3.19 -0.07 1.61 1.70 -1.26 -4.56 118.95 115.20 1twi s ARG 431 Ca 0.50 0.21 -0.14 0.00 -0.47 0.00 0.00 55.73 55.82 1twi s ARG 431 Cb -0.10 -2.25 -0.05 0.00 -0.57 0.00 0.00 34.95 31.98 1twi s ARG 431 CO 0.39 -0.57 0.36 -1.21 -1.08 0.00 0.00 175.30 173.19 1twi s GLU 432 N -4.98 4.00 0.69 3.89 2.02 -0.96 -4.97 118.70 118.39 1twi s GLU 432 Ca 0.53 0.28 0.01 0.00 0.02 0.00 0.00 54.97 55.81 1twi s GLU 432 Cb -0.11 -3.29 0.12 0.00 0.10 0.00 0.00 34.13 30.95 1twi s GLU 432 CO 0.47 0.52 0.96 0.95 0.02 0.00 0.00 175.26 178.18 1twi s THR 433 N -0.48 2.13 0.41 3.63 -4.23 -1.26 -4.45 115.64 111.39 1twi s THR 433 Ca 0.21 -0.68 0.11 0.00 -1.18 0.00 0.00 61.69 60.15 1twi s THR 433 Cb -0.15 -2.45 0.19 0.00 1.34 0.00 0.00 72.50 71.43 1twi s THR 433 CO 0.10 0.00 1.97 1.88 -0.54 0.00 0.00 174.62 178.03 1twi h TYR 434 N -0.39 0.22 -0.25 3.99 0.05 -1.98 -2.02 116.97 116.59 1twi h TYR 434 Ca -0.35 -0.02 -0.09 0.00 0.05 0.00 0.00 58.73 58.32 1twi h TYR 434 Cb 1.27 -0.07 -0.01 0.00 1.01 0.00 0.00 36.73 38.93 1twi h TYR 434 CO -0.08 0.29 -0.24 0.00 -1.05 0.00 0.00 178.16 177.08 1twi h ALA 435 N 1.72 1.13 -0.49 3.88 0.00 -1.99 -2.47 119.26 121.04 1twi h ALA 435 Ca 0.05 -0.33 -0.07 0.00 0.00 0.00 0.00 54.91 54.55 1twi h ALA 435 Cb 0.26 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1twi h ALA 435 CO 0.01 0.55 0.02 -0.44 0.00 0.00 0.00 179.25 179.39 1twi h ASP 436 N 0.41 0.76 -0.86 0.00 3.32 -1.74 -2.39 116.42 115.92 1twi h ASP 436 Ca 0.06 -0.18 0.11 0.00 0.02 0.00 0.00 57.03 57.05 1twi h ASP 436 Cb 0.64 -0.20 -0.06 0.00 0.22 0.00 0.00 39.33 39.93 1twi h ASP 436 CO 0.05 0.82 0.56 -0.07 -1.72 0.00 0.00 179.24 178.87 1twi h LEU 437 N 0.75 0.71 -3.19 1.55 3.38 -1.08 -2.50 115.31 114.93 1twi h LEU 437 Ca 0.15 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1twi h LEU 437 Cb 0.43 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.06 1twi h LEU 437 CO 0.02 0.40 0.00 2.30 0.09 0.00 0.00 178.44 181.24 1twi n ILE 438 N -4.53 2.01 0.55 1.22 -5.35 -1.10 -4.64 119.36 107.52 1twi n ILE 438 Ca 0.15 -1.62 0.08 0.00 -0.27 0.00 0.00 62.75 61.10 1twi n ILE 438 Cb 0.37 -0.07 0.36 0.00 -1.74 0.00 0.00 39.64 38.56 1twi n ILE 438 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1twi n ALA 439 N -0.12 1.75 0.26 -1.28 0.00 -0.92 -1.96 120.51 118.24 1twi n ALA 439 Ca 0.20 -0.05 0.06 0.00 0.00 0.00 0.00 53.44 53.65 1twi n ALA 439 Cb 0.81 -1.28 0.09 0.00 0.00 0.00 0.00 19.45 19.08 1twi n ALA 439 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1twi n LYS 440 N -1.56 1.48 -3.65 0.00 4.76 -1.26 -5.01 118.16 112.92 1twi n LYS 440 Ca 0.04 -1.55 -0.34 0.00 -2.87 0.00 0.00 58.31 53.59 1twi n LYS 440 Cb 0.20 -1.26 -0.05 0.00 -1.84 0.00 0.00 35.03 32.08 1twi n LYS 440 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1twi s ASP 441 N -1.01 6.58 -0.06 4.39 1.01 -0.83 -5.08 116.67 121.67 1twi s ASP 441 Ca 0.18 0.69 0.01 0.00 0.71 0.00 0.00 52.55 54.15 1twi s ASP 441 Cb 0.11 -2.14 0.02 0.00 1.01 0.00 0.00 42.92 41.92 1twi s ASP 441 CO 0.16 0.20 -0.07 -0.63 0.21 0.00 0.00 175.17 175.04 1twi s ILE 442 N -1.37 0.75 -0.21 0.77 1.01 -1.26 -5.05 121.20 115.84 1twi s ILE 442 Ca 0.31 -0.23 -0.18 0.00 0.00 0.00 0.00 60.65 60.55 1twi s ILE 442 Cb -0.14 -0.75 -0.03 0.00 0.01 0.00 0.00 42.46 41.55 1twi s ILE 442 CO 0.18 0.28 0.51 -0.69 0.00 0.00 0.00 174.94 175.22 1twi s VAL 443 N 0.99 5.10 0.93 2.92 1.01 -1.26 -5.06 120.40 125.04 1twi s VAL 443 Ca -0.09 0.93 -0.11 0.00 0.00 0.00 0.00 61.98 62.70 1twi s VAL 443 Cb -0.14 -3.83 0.15 0.00 0.00 0.00 0.00 36.38 32.55 1twi s VAL 443 CO 0.00 0.16 1.09 -2.84 0.00 0.00 0.00 175.10 173.51 1twi s PRO 444 N 1.75 0.96 0.22 2.72 0.02 -1.26 -4.82 135.00 134.59 1twi s PRO 444 Ca 0.23 1.00 -0.08 0.00 0.02 0.00 0.00 61.00 62.17 1twi s PRO 444 Cb -0.15 -1.76 0.33 0.00 0.02 0.00 0.00 34.50 32.94 1twi s PRO 444 CO 0.09 -2.50 1.72 -1.35 -0.33 0.00 0.00 177.00 174.63 1twi h PRO 445 N -1.75 0.32 0.00 5.54 0.11 -2.02 -0.94 132.00 133.27 1twi h PRO 445 Ca -0.50 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.59 1twi h PRO 445 Cb 1.28 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1twi h PRO 445 CO 0.51 0.21 0.00 -2.39 -0.21 0.00 0.00 178.00 176.12 1twi n HIS 446 N -5.07 0.00 0.81 0.65 1.44 -1.26 -2.45 115.22 109.34 1twi n HIS 446 Ca 0.10 0.00 0.10 0.00 -2.01 0.00 0.00 57.72 55.91 1twi n HIS 446 Cb 0.34 -0.39 0.07 0.00 0.12 0.00 0.00 29.99 30.13 1twi n HIS 446 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 1twi n LEU 447 N -1.39 2.50 0.00 2.39 4.77 -0.37 -5.27 117.00 119.63 1twi n LEU 447 Ca 0.07 -0.96 0.07 0.00 -0.03 0.00 0.00 56.01 55.16 1twi n LEU 447 Cb 0.18 0.00 0.42 0.00 -2.33 0.00 0.00 43.42 41.69 1twi n LEU 447 CO 0.16 0.44 0.63 0.18 -1.33 0.00 0.00 177.39 177.47