#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3inr s SER 3 N 0.00 6.78 0.35 4.39 1.04 -1.26 -4.97 113.70 120.03 3inr s SER 3 Ca 0.00 0.94 -0.13 0.00 0.48 0.00 0.00 55.95 57.24 3inr s SER 3 Cb 0.00 -2.35 -0.08 0.00 0.10 0.00 0.00 66.02 63.69 3inr s SER 3 CO 0.00 -0.14 0.75 -0.54 0.98 0.00 0.00 173.24 174.29 3inr s LYS 4 N 1.16 3.92 -0.25 4.02 -0.14 -1.26 -4.80 119.74 122.38 3inr s LYS 4 Ca 0.31 0.60 -0.22 0.00 -1.36 0.00 0.00 55.97 55.29 3inr s LYS 4 Cb -0.16 -2.41 -0.01 0.00 -1.68 0.00 0.00 37.83 33.56 3inr s LYS 4 CO 0.13 0.08 0.71 0.15 -0.76 0.00 0.00 175.35 175.67 3inr s LYS 5 N -3.30 4.13 -0.13 1.68 1.02 -1.26 -1.31 119.74 120.57 3inr s LYS 5 Ca 0.53 0.70 0.01 0.00 0.02 0.00 0.00 55.97 57.24 3inr s LYS 5 Cb -0.10 -3.65 -0.01 0.00 -0.52 0.00 0.00 37.83 33.55 3inr s LYS 5 CO 0.23 -0.46 -0.18 0.42 -0.92 0.00 0.00 175.35 174.44 3inr s ILE 6 N 2.65 2.59 -0.15 2.17 -1.09 0.82 -1.38 121.20 126.82 3inr s ILE 6 Ca 0.30 -0.82 -0.06 0.00 -2.23 0.00 0.00 60.65 57.83 3inr s ILE 6 Cb -0.15 -2.06 -0.04 0.00 -1.58 0.00 0.00 42.46 38.63 3inr s ILE 6 CO 0.08 0.53 0.07 -0.22 -1.23 0.00 0.00 174.94 174.18 3inr s LEU 7 N 0.50 3.92 -0.09 2.97 2.96 -0.68 -0.15 118.68 128.11 3inr s LEU 7 Ca -0.12 0.19 0.01 0.00 -0.22 0.00 0.00 54.13 53.99 3inr s LEU 7 Cb -0.16 -1.97 0.02 0.00 0.50 0.00 0.00 46.19 44.58 3inr s LEU 7 CO 0.05 0.27 -0.09 -0.63 -1.32 0.00 0.00 176.35 174.62 3inr s ILE 8 N -0.19 1.05 -0.39 6.68 1.01 0.12 -0.91 121.20 128.57 3inr s ILE 8 Ca 0.08 -0.36 -0.14 0.00 0.00 0.00 0.00 60.65 60.22 3inr s ILE 8 Cb -0.12 -1.02 0.01 0.00 0.01 0.00 0.00 42.46 41.34 3inr s ILE 8 CO 0.01 0.36 0.28 -0.69 0.00 0.00 0.00 174.94 174.90 3inr s VAL 9 N 1.21 5.23 0.00 2.92 1.01 0.55 -1.48 120.40 129.85 3inr s VAL 9 Ca -0.04 -0.57 0.00 0.00 0.00 0.00 0.00 61.98 61.37 3inr s VAL 9 Cb -0.14 -3.86 0.00 0.00 0.00 0.00 0.00 36.38 32.38 3inr s VAL 9 CO -0.03 -0.24 0.00 0.61 0.00 0.00 0.00 175.10 175.45 3inr n GLY 10 N 5.14 3.27 1.42 4.51 0.00 0.66 -1.32 105.19 118.87 3inr n GLY 10 Ca -0.11 -1.43 -0.11 0.00 0.00 0.00 0.00 46.02 44.37 3inr n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3inr n ALA 11 N 0.68 4.65 -1.79 4.61 0.00 -1.25 -3.99 120.51 123.42 3inr n ALA 11 Ca 0.00 -3.31 0.00 0.00 0.00 0.00 0.00 53.44 50.13 3inr n ALA 11 Cb 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 19.45 18.70 3inr n ALA 11 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3inr n GLY 12 N -1.03 0.29 0.25 0.00 0.00 -1.26 -0.12 105.19 103.32 3inr n GLY 12 Ca 0.38 -1.86 0.03 0.00 0.00 0.00 0.00 46.02 44.56 3inr n GLY 12 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 3inr h PHE 13 N -0.41 0.28 0.25 1.61 -1.00 -1.95 -0.66 116.94 115.07 3inr h PHE 13 Ca 0.00 0.04 -0.01 0.00 2.81 0.00 0.00 57.97 60.81 3inr h PHE 13 Cb 0.00 -0.02 -0.00 0.00 3.61 0.00 0.00 35.95 39.54 3inr h PHE 13 CO 0.00 -0.02 -0.14 0.77 -1.61 0.00 0.00 178.31 177.32 3inr h SER 14 N 0.30 -0.33 -0.51 2.17 0.02 -1.92 -1.01 113.55 112.27 3inr h SER 14 Ca 0.35 0.02 -0.08 0.00 -0.84 0.00 0.00 61.79 61.24 3inr h SER 14 Cb 0.54 0.09 -0.02 0.00 0.14 0.00 0.00 62.40 63.16 3inr h SER 14 CO -0.42 -0.23 0.02 1.23 -1.14 0.00 0.00 176.83 176.29 3inr h GLY 15 N -0.37 0.97 0.97 -3.77 0.00 -1.66 -2.40 103.07 96.81 3inr h GLY 15 Ca -0.03 -0.70 -0.05 0.00 0.00 0.00 0.00 47.33 46.55 3inr h GLY 15 CO 0.04 0.64 0.12 0.00 0.00 0.00 0.00 176.54 177.35 3inr h ALA 16 N 0.95 0.64 -0.00 3.60 0.00 -1.04 0.16 119.26 123.57 3inr h ALA 16 Ca 0.15 -0.21 -0.13 0.00 0.00 0.00 0.00 54.91 54.72 3inr h ALA 16 Cb 0.50 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 18.11 3inr h ALA 16 CO 0.02 0.33 -0.51 0.28 0.00 0.00 0.00 179.25 179.38 3inr h VAL 17 N 0.66 1.46 -0.44 0.00 2.07 -1.18 -1.37 116.25 117.46 3inr h VAL 17 Ca 0.15 -2.05 0.06 0.00 0.82 0.00 0.00 66.70 65.68 3inr h VAL 17 Cb 0.33 2.65 -0.05 0.00 -1.52 0.00 0.00 31.29 32.70 3inr h VAL 17 CO 0.00 0.59 0.16 0.40 0.02 0.00 0.00 177.57 178.74 3inr h ILE 18 N -0.21 0.87 -0.75 4.57 2.04 -1.43 -1.50 117.51 121.10 3inr h ILE 18 Ca -0.06 -0.11 -0.06 0.00 1.00 0.00 0.00 64.86 65.63 3inr h ILE 18 Cb 1.23 0.50 -0.03 0.00 -0.74 0.00 0.00 36.82 37.79 3inr h ILE 18 CO 0.10 0.06 0.25 1.23 0.00 0.00 0.00 178.15 179.79 3inr h GLY 19 N 0.33 1.24 0.92 5.37 0.00 -0.48 -2.60 103.07 107.86 3inr h GLY 19 Ca 0.21 -0.72 -0.02 0.00 0.00 0.00 0.00 47.33 46.80 3inr h GLY 19 CO -0.21 0.67 0.13 -0.09 0.00 0.00 0.00 176.54 177.04 3inr h ARG 20 N 1.11 0.52 -0.88 4.80 9.65 -1.12 -0.23 114.38 128.23 3inr h ARG 20 Ca 0.25 -0.10 0.13 0.00 -1.10 0.00 0.00 59.98 59.15 3inr h ARG 20 Cb 0.28 -0.08 -0.07 0.00 -1.39 0.00 0.00 29.97 28.71 3inr h ARG 20 CO -0.01 0.52 0.57 1.96 2.80 0.00 0.00 179.97 185.81 3inr h GLN 21 N 0.41 0.72 0.11 0.20 1.08 -1.04 -1.61 115.11 114.97 3inr h GLN 21 Ca 0.11 -0.04 -0.32 0.00 -1.45 0.00 0.00 58.65 56.95 3inr h GLN 21 Cb 0.21 -0.16 -0.01 0.00 -0.05 0.00 0.00 27.48 27.46 3inr h GLN 21 CO -0.01 0.47 -1.64 -0.07 -0.95 0.00 0.00 178.83 176.64 3inr h LEU 22 N 0.74 0.36 -1.27 1.46 3.38 -1.35 -3.25 115.31 115.38 3inr h LEU 22 Ca 0.43 -0.57 0.11 0.00 0.09 0.00 0.00 57.88 57.94 3inr h LEU 22 Cb 0.62 -0.12 -0.06 0.00 0.09 0.00 0.00 40.66 41.19 3inr h LEU 22 CO -0.19 1.48 0.55 0.00 0.09 0.00 0.00 178.44 180.37 3inr h ALA 23 N 0.46 1.72 0.00 1.53 0.00 -0.82 -1.15 119.26 121.01 3inr h ALA 23 Ca -0.28 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.63 3inr h ALA 23 Cb 2.02 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.64 3inr h ALA 23 CO 0.14 0.09 0.00 0.93 0.00 0.00 0.00 179.25 180.41 3inr h GLU 24 N 0.79 0.00 -0.53 0.00 5.08 -1.34 -2.29 114.58 116.30 3inr h GLU 24 Ca 0.40 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.76 3inr h GLU 24 Cb 0.48 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.73 3inr h GLU 24 CO -0.17 0.00 0.00 1.63 -1.00 0.00 0.00 179.01 179.47 3inr n LYS 25 N -2.92 4.09 -0.21 2.33 4.76 -0.50 -4.92 118.16 120.79 3inr n LYS 25 Ca 0.01 -2.98 0.00 0.00 -2.87 0.00 0.00 58.31 52.48 3inr n LYS 25 Cb 0.32 -2.03 0.00 0.00 -1.84 0.00 0.00 35.03 31.48 3inr n LYS 25 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3inr n GLY 26 N 0.54 0.75 3.81 0.72 0.00 -0.86 -5.01 105.19 105.13 3inr n GLY 26 Ca 0.25 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.94 3inr n GLY 26 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3inr s HIS 27 N -2.52 3.13 -0.26 1.61 3.76 -0.82 -4.71 115.29 115.47 3inr s HIS 27 Ca 0.00 1.54 -0.18 0.00 -0.15 0.00 0.00 55.06 56.27 3inr s HIS 27 Cb 0.00 -2.96 -0.03 0.00 1.11 0.00 0.00 32.58 30.70 3inr s HIS 27 CO 0.00 -0.74 0.51 -0.65 -0.85 0.00 0.00 174.74 173.01 3inr s GLN 28 N -3.68 4.06 -0.19 1.40 -0.21 -0.43 -4.31 119.66 116.30 3inr s GLN 28 Ca 0.64 0.30 -0.00 0.00 0.02 0.00 0.00 55.36 56.31 3inr s GLN 28 Cb -0.14 -3.66 0.01 0.00 1.00 0.00 0.00 33.01 30.23 3inr s GLN 28 CO 0.27 -0.35 -0.16 0.08 -2.12 0.00 0.00 175.29 173.01 3inr s VAL 29 N 2.30 2.40 -0.30 1.09 1.01 -0.26 -0.12 120.40 126.52 3inr s VAL 29 Ca 0.21 -0.84 -0.05 0.00 0.00 0.00 0.00 61.98 61.30 3inr s VAL 29 Cb -0.16 -2.05 0.03 0.00 0.00 0.00 0.00 36.38 34.20 3inr s VAL 29 CO 0.09 0.49 0.04 -2.28 0.00 0.00 0.00 175.10 173.45 3inr s HIS 30 N 1.33 3.17 -0.13 5.22 5.04 0.79 -0.27 115.29 130.45 3inr s HIS 30 Ca 0.05 -1.36 -0.04 0.00 -1.54 0.00 0.00 55.06 52.17 3inr s HIS 30 Cb -0.14 -2.19 -0.03 0.00 0.04 0.00 0.00 32.58 30.26 3inr s HIS 30 CO -0.10 -0.68 0.01 0.42 -2.34 0.00 0.00 174.74 172.04 3inr s ILE 31 N 1.40 4.31 0.20 0.89 1.01 0.42 0.12 121.20 129.55 3inr s ILE 31 Ca -0.00 -0.23 0.05 0.00 0.00 0.00 0.00 60.65 60.47 3inr s ILE 31 Cb -0.18 -2.87 -0.05 0.00 0.01 0.00 0.00 42.46 39.38 3inr s ILE 31 CO 0.00 0.54 -0.06 0.27 0.00 0.00 0.00 174.94 175.69 3inr s ILE 32 N -0.24 1.20 -0.24 2.92 -4.36 -0.55 -1.33 121.20 118.60 3inr s ILE 32 Ca 0.06 -2.07 -0.18 0.00 -0.26 0.00 0.00 60.65 58.20 3inr s ILE 32 Cb -0.12 -2.13 0.07 0.00 1.25 0.00 0.00 42.46 41.53 3inr s ILE 32 CO 0.02 -0.52 0.61 -0.62 0.24 0.00 0.00 174.94 174.67 3inr s ASP 33 N -3.26 -0.72 0.26 4.36 -1.08 -0.84 -0.24 116.67 115.14 3inr s ASP 33 Ca 0.23 1.27 0.25 0.00 -0.52 0.00 0.00 52.55 53.78 3inr s ASP 33 Cb 0.04 1.22 0.93 0.00 -1.46 0.00 0.00 42.92 43.65 3inr s ASP 33 CO 0.05 -0.22 1.74 0.00 0.52 0.00 0.00 175.17 177.27 3inr n GLN 34 N 3.48 0.23 -2.07 4.34 10.64 -0.87 -0.58 117.38 132.55 3inr n GLN 34 Ca -0.17 0.36 -0.27 0.00 -1.83 0.00 0.00 57.00 55.09 3inr n GLN 34 Cb 0.57 -1.87 0.09 0.00 -0.86 0.00 0.00 30.24 28.17 3inr n GLN 34 CO 0.00 0.00 0.00 1.03 -1.83 0.00 0.00 177.06 176.26 3inr s ARG 35 N -3.26 1.88 -0.04 2.61 0.52 -1.26 -4.18 118.95 115.23 3inr s ARG 35 Ca 0.06 -0.18 0.09 0.00 -0.52 0.00 0.00 55.73 55.19 3inr s ARG 35 Cb 0.10 -2.05 0.34 0.00 0.52 0.00 0.00 34.95 33.86 3inr s ARG 35 CO 0.47 -1.54 1.20 -0.40 0.02 0.00 0.00 175.30 175.06 3inr n ASP 36 N -3.18 2.37 -3.75 0.23 5.68 -1.26 -0.91 116.55 115.74 3inr n ASP 36 Ca 0.09 -2.15 -0.10 0.00 -0.50 0.00 0.00 54.79 52.13 3inr n ASP 36 Cb 0.61 -0.36 -0.06 0.00 -1.14 0.00 0.00 41.12 40.17 3inr n ASP 36 CO 0.00 0.00 0.00 -1.38 -1.33 0.00 0.00 177.20 174.49 3inr s HIS 37 N -1.64 -0.02 0.93 2.11 -3.43 -1.26 -4.89 115.29 107.09 3inr s HIS 37 Ca 0.24 -0.35 -0.15 0.00 -0.80 0.00 0.00 55.06 54.00 3inr s HIS 37 Cb 0.15 0.10 0.17 0.00 -1.43 0.00 0.00 32.58 31.58 3inr s HIS 37 CO 0.13 -0.63 1.29 0.96 -2.00 0.00 0.00 174.74 174.49 3inr s ILE 38 N -3.83 2.00 0.00 -5.38 -4.36 -1.26 -4.65 121.20 103.72 3inr s ILE 38 Ca 0.04 -0.00 0.00 0.00 -0.26 0.00 0.00 60.65 60.43 3inr s ILE 38 Cb 0.03 -3.00 0.00 0.00 1.25 0.00 0.00 42.46 40.74 3inr s ILE 38 CO -0.11 0.00 0.00 0.61 0.24 0.00 0.00 174.94 175.68 3inr n GLY 39 N -3.67 3.19 7.00 6.27 0.00 0.84 -4.73 105.19 114.09 3inr n GLY 39 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 3inr n GLY 39 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3inr n GLY 40 N -1.34 1.85 0.00 -0.02 0.00 -1.25 -2.53 105.19 101.91 3inr n GLY 40 Ca 0.00 -0.56 0.11 0.00 0.00 0.00 0.00 46.02 45.58 3inr n GLY 40 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3inr n ASN 41 N 0.18 0.00 -0.24 1.61 4.13 -1.26 -2.55 115.26 117.13 3inr n ASN 41 Ca 0.00 -0.18 0.14 0.00 1.68 0.00 0.00 54.58 56.23 3inr n ASN 41 Cb 0.00 -0.23 0.64 0.00 -1.54 0.00 0.00 39.78 38.65 3inr n ASN 41 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 3inr n SER 42 N -1.23 0.81 -4.73 6.41 7.64 -1.05 -4.38 113.62 117.09 3inr n SER 42 Ca 0.12 -1.07 -0.42 0.00 1.01 0.00 0.00 58.87 58.51 3inr n SER 42 Cb 0.16 -0.01 -0.03 0.00 -1.01 0.00 0.00 64.21 63.33 3inr n SER 42 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 3inr s TYR 43 N -2.17 2.99 0.21 1.43 5.04 -1.06 -4.54 117.35 119.25 3inr s TYR 43 Ca 0.37 0.77 0.09 0.00 -2.44 0.00 0.00 57.07 55.85 3inr s TYR 43 Cb 0.21 -3.93 -0.05 0.00 0.35 0.00 0.00 41.96 38.55 3inr s TYR 43 CO 0.40 -3.25 -0.16 0.16 -1.34 0.00 0.00 175.55 171.36 3inr s ASP 44 N 0.78 2.75 0.02 4.32 1.47 -1.26 -2.61 116.67 122.14 3inr s ASP 44 Ca 0.66 -0.98 -0.28 0.00 1.18 0.00 0.00 52.55 53.13 3inr s ASP 44 Cb -0.44 -0.17 0.08 0.00 -0.34 0.00 0.00 42.92 42.05 3inr s ASP 44 CO 0.38 -0.11 0.70 0.00 0.68 0.00 0.00 175.17 176.82 3inr s ALA 45 N -2.67 -1.73 -0.18 2.11 0.00 -0.63 -4.60 121.76 114.06 3inr s ALA 45 Ca 0.22 1.01 -0.29 0.00 0.00 0.00 0.00 51.96 52.90 3inr s ALA 45 Cb -0.03 0.30 -0.01 0.00 0.00 0.00 0.00 23.12 23.38 3inr s ALA 45 CO 0.08 -0.54 1.29 1.03 0.00 0.00 0.00 175.76 177.62 3inr s ARG 46 N -2.28 4.17 0.34 0.00 0.52 -1.26 -0.65 118.95 119.79 3inr s ARG 46 Ca -0.04 1.61 -0.28 0.00 -0.52 0.00 0.00 55.73 56.49 3inr s ARG 46 Cb -0.00 -3.79 -0.12 0.00 0.52 0.00 0.00 34.95 31.55 3inr s ARG 46 CO -0.01 -0.79 1.40 -3.47 0.02 0.00 0.00 175.30 172.45 3inr n ASP 47 N 6.82 3.25 0.05 0.23 2.03 -0.35 -4.90 116.55 123.68 3inr n ASP 47 Ca 0.14 1.21 -0.13 0.00 0.52 0.00 0.00 54.79 56.53 3inr n ASP 47 Cb 0.45 -1.54 -0.09 0.00 -0.72 0.00 0.00 41.12 39.22 3inr n ASP 47 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 3inr h SER 48 N 3.01 -0.09 -0.29 1.67 0.02 -1.95 -1.61 113.55 114.31 3inr h SER 48 Ca -0.48 -0.26 -0.01 0.00 -0.84 0.00 0.00 61.79 60.20 3inr h SER 48 Cb 1.26 0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.81 3inr h SER 48 CO 0.65 0.21 0.13 -0.08 -1.14 0.00 0.00 176.83 176.61 3inr h GLU 49 N -0.39 0.43 -0.00 3.45 4.81 -1.99 -3.32 114.58 117.56 3inr h GLU 49 Ca -0.01 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.15 3inr h GLU 49 Cb 0.34 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.65 3inr h GLU 49 CO 0.02 0.43 -0.81 0.25 -0.73 0.00 0.00 179.01 178.16 3inr n THR 50 N -4.76 0.00 -1.39 0.32 -2.24 -1.25 -5.00 114.28 99.96 3inr n THR 50 Ca -0.02 -0.09 -0.14 0.00 -2.27 0.00 0.00 64.05 61.52 3inr n THR 50 Cb 0.12 1.03 -0.06 0.00 -2.10 0.00 0.00 70.33 69.32 3inr n THR 50 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3inr n ASN 51 N -1.24 -4.06 -4.73 3.42 5.15 -0.60 -4.76 115.26 108.44 3inr n ASN 51 Ca 0.04 0.35 -0.41 0.00 -0.60 0.00 0.00 54.58 53.96 3inr n ASN 51 Cb 0.31 -3.61 -0.04 0.00 -0.53 0.00 0.00 39.78 35.90 3inr n ASN 51 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3inr s VAL 52 N -2.17 4.74 -0.22 3.44 1.01 -1.26 -4.78 120.40 121.16 3inr s VAL 52 Ca 0.00 1.84 -0.29 0.00 0.00 0.00 0.00 61.98 63.53 3inr s VAL 52 Cb 0.00 -4.21 -0.01 0.00 0.00 0.00 0.00 36.38 32.15 3inr s VAL 52 CO 0.00 0.29 1.39 -0.32 0.00 0.00 0.00 175.10 176.46 3inr s MET 53 N 0.34 3.99 -0.18 2.72 1.75 -1.26 -1.22 119.30 125.44 3inr s MET 53 Ca 0.44 1.53 -0.08 0.00 -1.25 0.00 0.00 55.69 56.34 3inr s MET 53 Cb -0.21 -3.89 -0.04 0.00 2.84 0.00 0.00 34.83 33.52 3inr s MET 53 CO 0.25 -1.03 0.07 0.08 -0.65 0.00 0.00 175.02 173.75 3inr s VAL 54 N 4.31 4.90 -0.85 10.11 1.01 0.18 -4.70 120.40 135.37 3inr s VAL 54 Ca 0.61 0.01 -0.23 0.00 0.00 0.00 0.00 61.98 62.36 3inr s VAL 54 Cb -0.21 -3.21 0.06 0.00 0.00 0.00 0.00 36.38 33.02 3inr s VAL 54 CO 0.23 0.46 1.23 -1.00 0.00 0.00 0.00 175.10 176.03 3inr s HIS 55 N 0.30 2.61 0.28 5.22 3.76 -1.26 -1.60 115.29 124.59 3inr s HIS 55 Ca 0.04 -0.67 -0.03 0.00 -0.15 0.00 0.00 55.06 54.25 3inr s HIS 55 Cb -0.12 -4.51 0.39 0.00 1.11 0.00 0.00 32.58 29.44 3inr s HIS 55 CO -0.00 -1.83 1.94 0.28 -0.85 0.00 0.00 174.74 174.28 3inr h VAL 56 N 6.22 1.20 -0.80 -0.90 2.07 -1.85 -1.56 116.25 120.63 3inr h VAL 56 Ca -0.05 -0.41 -0.37 0.00 0.82 0.00 0.00 66.70 66.69 3inr h VAL 56 Cb 1.04 -0.11 -0.22 0.00 -1.52 0.00 0.00 31.29 30.48 3inr h VAL 56 CO 1.27 0.22 0.42 -1.22 0.02 0.00 0.00 177.57 178.28 3inr n TYR 57 N -4.41 2.53 0.00 1.57 4.02 -1.26 -5.03 117.16 114.58 3inr n TYR 57 Ca 0.11 -1.61 0.00 0.00 -0.01 0.00 0.00 57.90 56.39 3inr n TYR 57 Cb 0.05 -0.79 0.00 0.00 -0.02 0.00 0.00 39.34 38.59 3inr n TYR 57 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3inr n GLY 58 N -0.86 1.01 3.69 2.72 0.00 -0.59 -5.01 105.19 106.15 3inr n GLY 58 Ca 0.49 -1.88 -0.44 0.00 0.00 0.00 0.00 46.02 44.20 3inr n GLY 58 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3inr n PRO 59 N 1.25 2.23 -3.87 1.61 -0.02 -1.26 -4.75 135.00 130.19 3inr n PRO 59 Ca 0.00 0.80 -0.29 0.00 -2.02 0.00 0.00 63.50 61.98 3inr n PRO 59 Cb 0.00 -2.50 -0.16 0.00 -0.02 0.00 0.00 33.50 30.82 3inr n PRO 59 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 3inr s HIS 60 N 0.06 1.91 -0.22 6.00 3.76 -1.26 -5.10 115.29 120.45 3inr s HIS 60 Ca 0.68 -1.44 -0.05 0.00 -0.15 0.00 0.00 55.06 54.10 3inr s HIS 60 Cb -0.61 -1.38 -0.02 0.00 1.11 0.00 0.00 32.58 31.68 3inr s HIS 60 CO 0.48 -0.72 -0.00 0.42 -0.85 0.00 0.00 174.74 174.07 3inr s ILE 61 N 1.56 3.77 -0.06 0.60 -1.09 -1.26 -5.01 121.20 119.70 3inr s ILE 61 Ca -0.04 -0.36 -0.30 0.00 -2.23 0.00 0.00 60.65 57.72 3inr s ILE 61 Cb -0.18 -2.72 -0.03 0.00 -1.58 0.00 0.00 42.46 37.95 3inr s ILE 61 CO -0.07 0.41 1.13 0.12 -1.23 0.00 0.00 174.94 175.30 3inr s PHE 62 N 1.35 3.32 -0.10 3.97 5.36 -1.12 -4.94 117.98 125.81 3inr s PHE 62 Ca 0.04 1.36 -0.12 0.00 -0.96 0.00 0.00 56.93 57.25 3inr s PHE 62 Cb -0.15 -3.34 0.03 0.00 -0.34 0.00 0.00 43.02 39.23 3inr s PHE 62 CO 0.00 -0.93 0.32 -3.38 -1.46 0.00 0.00 175.22 169.78 3inr s HIS 63 N 2.05 -0.32 -0.12 10.12 -3.43 -1.26 -1.47 115.29 120.86 3inr s HIS 63 Ca 0.53 0.76 -0.30 0.00 -0.80 0.00 0.00 55.06 55.25 3inr s HIS 63 Cb -0.23 0.12 0.11 0.00 -1.43 0.00 0.00 32.58 31.15 3inr s HIS 63 CO 0.21 -0.21 0.89 -0.08 -2.00 0.00 0.00 174.74 173.55 3inr s THR 64 N -0.11 0.00 -2.72 -5.38 -1.32 -0.48 -4.53 115.64 101.10 3inr s THR 64 Ca -0.03 0.00 0.24 0.00 -1.21 0.00 0.00 61.69 60.69 3inr s THR 64 Cb -0.03 -1.00 0.32 0.00 -1.51 0.00 0.00 72.50 70.28 3inr s THR 64 CO 0.01 0.00 1.35 0.47 -2.21 0.00 0.00 174.62 174.24 3inr n ASP 65 N 0.76 3.17 -4.38 8.08 8.00 -1.26 -0.39 116.55 130.52 3inr n ASP 65 Ca -0.13 -1.98 -0.45 0.00 0.71 0.00 0.00 54.79 52.94 3inr n ASP 65 Cb 0.58 -0.13 -0.07 0.00 -0.02 0.00 0.00 41.12 41.48 3inr n ASP 65 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 3inr s ASN 66 N -1.74 6.17 0.31 -2.24 3.84 -1.26 -4.93 114.94 115.09 3inr s ASN 66 Ca 0.34 -1.34 0.15 0.00 0.21 0.00 0.00 52.86 52.22 3inr s ASN 66 Cb 0.21 -2.21 0.43 0.00 -0.55 0.00 0.00 41.25 39.14 3inr s ASN 66 CO 0.31 -0.73 1.62 -0.08 -2.79 0.00 0.00 177.10 175.43 3inr h GLU 67 N 8.82 0.00 -0.96 0.43 4.81 -1.99 -0.92 114.58 124.78 3inr h GLU 67 Ca -0.29 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.95 3inr h GLU 67 Cb 1.11 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 30.44 3inr h GLU 67 CO 0.92 0.51 0.61 1.15 -0.73 0.00 0.00 179.01 181.47 3inr h THR 68 N 0.00 1.25 0.02 0.32 2.02 -1.99 0.12 112.91 114.66 3inr h THR 68 Ca -0.01 -0.51 -0.00 0.00 0.77 0.00 0.00 66.41 66.67 3inr h THR 68 Cb 1.10 -0.13 0.00 0.00 -1.74 0.00 0.00 68.15 67.38 3inr h THR 68 CO 0.07 0.26 -0.01 0.58 0.37 0.00 0.00 175.52 176.78 3inr h VAL 69 N 1.31 1.43 -0.54 3.16 2.07 -1.65 0.12 116.25 122.15 3inr h VAL 69 Ca 0.35 -1.42 0.11 0.00 0.82 0.00 0.00 66.70 66.56 3inr h VAL 69 Cb -0.11 2.38 -0.11 0.00 -1.52 0.00 0.00 31.29 31.94 3inr h VAL 69 CO -0.07 0.36 -0.20 -0.25 0.02 0.00 0.00 177.57 177.43 3inr h TRP 70 N -0.64 -0.48 -0.30 1.57 2.91 -1.13 0.47 115.95 118.35 3inr h TRP 70 Ca -0.00 0.06 -0.02 0.00 1.13 0.00 0.00 58.89 60.06 3inr h TRP 70 Cb 0.61 0.30 -0.02 0.00 -0.51 0.00 0.00 29.16 29.54 3inr h TRP 70 CO 0.14 -0.29 0.11 -0.91 -1.03 0.00 0.00 178.44 176.45 3inr h ASN 71 N -0.07 0.38 -0.07 2.65 2.35 -0.60 -1.62 115.58 118.59 3inr h ASN 71 Ca 0.26 -0.03 -0.02 0.00 -0.55 0.00 0.00 56.30 55.95 3inr h ASN 71 Cb 0.46 -0.10 -0.00 0.00 0.05 0.00 0.00 38.32 38.74 3inr h ASN 71 CO -0.60 0.36 -0.03 0.22 -1.65 0.00 0.00 177.43 175.73 3inr h TYR 72 N 0.42 0.17 0.00 1.19 3.20 0.11 -2.91 116.97 119.15 3inr h TYR 72 Ca 0.11 -0.04 -0.05 0.00 3.14 0.00 0.00 58.73 61.89 3inr h TYR 72 Cb 0.11 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.33 3inr h TYR 72 CO 0.00 0.50 -0.23 -0.84 -1.64 0.00 0.00 178.16 175.95 3inr h ILE 73 N -0.22 0.78 0.00 1.81 3.07 -1.06 -2.06 117.51 119.84 3inr h ILE 73 Ca 0.02 -0.95 0.00 0.00 1.55 0.00 0.00 64.86 65.47 3inr h ILE 73 Cb 0.46 1.58 0.00 0.00 -0.27 0.00 0.00 36.82 38.59 3inr h ILE 73 CO 0.01 0.23 0.00 0.59 -1.05 0.00 0.00 178.15 177.93 3inr n ASN 74 N -3.70 0.51 -0.04 2.16 3.02 -0.63 -0.56 115.26 116.03 3inr n ASN 74 Ca -0.01 0.63 0.14 0.00 -0.03 0.00 0.00 54.58 55.31 3inr n ASN 74 Cb 0.35 -0.74 0.63 0.00 -0.61 0.00 0.00 39.78 39.41 3inr n ASN 74 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 3inr n LYS 75 N -2.07 0.36 0.00 3.52 4.81 -0.77 -3.91 118.16 120.09 3inr n LYS 75 Ca 0.02 -0.07 0.00 0.00 -0.87 0.00 0.00 58.31 57.39 3inr n LYS 75 Cb 0.20 -1.50 0.00 0.00 0.02 0.00 0.00 35.03 33.75 3inr n LYS 75 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 3inr n HIS 76 N -1.26 0.00 -3.61 5.64 8.25 0.28 -5.07 115.22 119.46 3inr n HIS 76 Ca 0.12 -0.07 -0.07 0.00 -0.26 0.00 0.00 57.72 57.44 3inr n HIS 76 Cb 0.29 -0.01 -0.02 0.00 1.12 0.00 0.00 29.99 31.37 3inr n HIS 76 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3inr s ALA 77 N -0.15 -1.72 -0.36 -1.41 0.00 -0.70 -4.37 121.76 113.05 3inr s ALA 77 Ca 0.00 0.58 -0.11 0.00 0.00 0.00 0.00 51.96 52.43 3inr s ALA 77 Cb 0.00 0.56 0.02 0.00 0.00 0.00 0.00 23.12 23.70 3inr s ALA 77 CO 0.00 -0.85 0.20 -2.00 0.00 0.00 0.00 175.76 173.11 3inr s GLU 78 N -3.26 2.96 -0.19 0.00 2.12 -1.26 -4.47 118.70 114.60 3inr s GLU 78 Ca 0.08 -0.99 -0.29 0.00 0.36 0.00 0.00 54.97 54.13 3inr s GLU 78 Cb -0.01 -3.70 0.00 0.00 0.26 0.00 0.00 34.13 30.68 3inr s GLU 78 CO -0.04 -0.63 1.01 -1.64 -0.54 0.00 0.00 175.26 173.42 3inr s MET 79 N 1.57 4.30 -0.01 4.30 -1.94 -1.26 -0.48 119.30 125.78 3inr s MET 79 Ca 0.03 1.33 -0.12 0.00 -1.71 0.00 0.00 55.69 55.22 3inr s MET 79 Cb -0.19 -3.61 -0.05 0.00 2.01 0.00 0.00 34.83 32.99 3inr s MET 79 CO 0.07 -0.52 0.35 -1.64 -0.01 0.00 0.00 175.02 173.26 3inr s MET 80 N 2.79 3.78 0.59 2.03 1.00 0.24 -4.89 119.30 124.84 3inr s MET 80 Ca 0.44 0.24 -0.19 0.00 0.00 0.00 0.00 55.69 56.19 3inr s MET 80 Cb -0.16 -3.17 -0.03 0.00 0.00 0.00 0.00 34.83 31.46 3inr s MET 80 CO 0.10 0.69 1.19 -1.25 0.00 0.00 0.00 175.02 175.74 3inr s PRO 81 N -1.24 3.00 -0.29 2.03 0.04 -1.26 -1.37 135.00 135.92 3inr s PRO 81 Ca 0.24 1.76 -0.21 0.00 0.04 0.00 0.00 61.00 62.82 3inr s PRO 81 Cb -0.15 -1.94 0.14 0.00 0.04 0.00 0.00 34.50 32.58 3inr s PRO 81 CO 0.12 -1.17 1.02 -0.47 0.04 0.00 0.00 177.00 176.55 3inr s TYR 82 N -1.69 -0.50 -0.15 0.56 5.04 -1.25 -4.72 117.35 114.63 3inr s TYR 82 Ca 0.76 1.11 -0.00 0.00 -2.44 0.00 0.00 57.07 56.50 3inr s TYR 82 Cb -0.28 0.36 0.03 0.00 0.35 0.00 0.00 41.96 42.42 3inr s TYR 82 CO 0.33 -0.25 -0.08 0.08 -1.34 0.00 0.00 175.55 174.29 3inr s VAL 83 N 0.72 1.26 -0.07 3.14 1.01 -1.26 -4.06 120.40 121.14 3inr s VAL 83 Ca -0.02 -0.60 -0.30 0.00 0.00 0.00 0.00 61.98 61.06 3inr s VAL 83 Cb -0.04 -1.33 -0.05 0.00 0.00 0.00 0.00 36.38 34.96 3inr s VAL 83 CO -0.11 0.26 1.60 0.21 0.00 0.00 0.00 175.10 177.06 3inr s ASN 84 N 1.59 6.71 -0.39 3.32 3.04 -1.26 -4.96 114.94 122.98 3inr s ASN 84 Ca 0.02 2.16 0.01 0.00 0.04 0.00 0.00 52.86 55.09 3inr s ASN 84 Cb -0.14 -2.53 0.13 0.00 -1.54 0.00 0.00 41.25 37.16 3inr s ASN 84 CO -0.08 -0.90 0.20 -0.13 -3.04 0.00 0.00 177.10 173.14 3inr s ARG 85 N 3.96 1.05 0.13 0.43 0.52 -1.26 -0.36 118.95 123.41 3inr s ARG 85 Ca 0.71 -1.68 -0.30 0.00 -0.52 0.00 0.00 55.73 53.94 3inr s ARG 85 Cb -0.32 -2.13 -0.07 0.00 0.52 0.00 0.00 34.95 32.96 3inr s ARG 85 CO 0.27 -1.12 1.16 0.08 0.02 0.00 0.00 175.30 175.72 3inr s VAL 86 N 0.78 3.86 0.21 3.52 1.01 -1.26 -4.80 120.40 123.72 3inr s VAL 86 Ca 0.16 1.48 0.07 0.00 0.00 0.00 0.00 61.98 63.69 3inr s VAL 86 Cb -0.22 -3.94 -0.04 0.00 0.00 0.00 0.00 36.38 32.17 3inr s VAL 86 CO -0.06 0.19 0.09 -0.54 0.00 0.00 0.00 175.10 174.78 3inr s LYS 87 N 0.23 2.65 -0.03 2.72 -0.14 -1.01 -1.43 119.74 122.72 3inr s LYS 87 Ca 0.54 -1.10 0.01 0.00 -1.36 0.00 0.00 55.97 54.06 3inr s LYS 87 Cb -0.30 -2.44 0.01 0.00 -1.68 0.00 0.00 37.83 33.42 3inr s LYS 87 CO 0.33 0.43 -0.04 0.00 -0.76 0.00 0.00 175.35 175.31 3inr s ALA 88 N -1.98 0.53 -0.24 5.17 0.00 0.13 -0.60 121.76 124.78 3inr s ALA 88 Ca 0.31 -0.07 -0.09 0.00 0.00 0.00 0.00 51.96 52.10 3inr s ALA 88 Cb -0.08 -0.29 -0.04 0.00 0.00 0.00 0.00 23.12 22.70 3inr s ALA 88 CO 0.22 0.03 0.12 0.99 0.00 0.00 0.00 175.76 177.11 3inr s THR 89 N 0.56 4.88 -0.12 0.00 2.01 0.63 0.07 115.64 123.68 3inr s THR 89 Ca -0.07 0.02 -0.29 0.00 0.31 0.00 0.00 61.69 61.66 3inr s THR 89 Cb -0.10 -3.28 0.08 0.00 0.01 0.00 0.00 72.50 69.20 3inr s THR 89 CO -0.00 0.34 0.73 0.54 -0.69 0.00 0.00 174.62 175.53 3inr s VAL 90 N 1.32 0.00 -1.42 3.82 0.11 -0.60 -3.03 120.40 120.60 3inr s VAL 90 Ca 0.06 0.00 -0.10 0.00 -2.93 0.00 0.00 61.98 59.01 3inr s VAL 90 Cb -0.15 -1.00 0.04 0.00 -1.53 0.00 0.00 36.38 33.74 3inr s VAL 90 CO 0.05 0.00 1.09 0.59 -3.33 0.00 0.00 175.10 173.51 3inr n ASN 91 N 1.33 -5.49 -0.41 3.54 3.02 -1.26 -2.19 115.26 113.80 3inr n ASN 91 Ca -0.17 -0.64 -0.05 0.00 -0.03 0.00 0.00 54.58 53.69 3inr n ASN 91 Cb 0.57 -4.58 -0.02 0.00 -0.61 0.00 0.00 39.78 35.13 3inr n ASN 91 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3inr n GLY 92 N -1.85 0.71 3.27 7.41 0.00 -1.26 -5.00 105.19 108.47 3inr n GLY 92 Ca 0.00 -0.23 -0.15 0.00 0.00 0.00 0.00 46.02 45.64 3inr n GLY 92 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3inr s GLN 93 N -1.97 1.15 -0.11 1.61 -0.21 -0.93 -5.16 119.66 114.05 3inr s GLN 93 Ca 0.00 -1.54 0.01 0.00 0.02 0.00 0.00 55.36 53.85 3inr s GLN 93 Cb 0.00 -0.47 -0.02 0.00 1.00 0.00 0.00 33.01 33.52 3inr s GLN 93 CO 0.00 -0.06 -0.13 0.08 -2.12 0.00 0.00 175.29 173.07 3inr s VAL 94 N -3.49 3.11 0.18 1.09 1.01 -1.26 -1.56 120.40 119.48 3inr s VAL 94 Ca 0.23 -0.66 0.06 0.00 0.00 0.00 0.00 61.98 61.60 3inr s VAL 94 Cb 0.05 -2.28 -0.05 0.00 0.00 0.00 0.00 36.38 34.10 3inr s VAL 94 CO 0.04 0.55 -0.11 -0.36 0.00 0.00 0.00 175.10 175.21 3inr s PHE 95 N -0.00 1.49 0.15 5.22 0.40 0.11 -4.93 117.98 120.41 3inr s PHE 95 Ca -0.03 -0.69 -0.20 0.00 -0.60 0.00 0.00 56.93 55.41 3inr s PHE 95 Cb -0.14 -0.74 -0.07 0.00 0.51 0.00 0.00 43.02 42.58 3inr s PHE 95 CO 0.04 0.19 0.65 -1.54 0.70 0.00 0.00 175.22 175.27 3inr s SER 96 N -3.25 7.09 0.28 1.36 1.04 -1.26 0.23 113.70 119.19 3inr s SER 96 Ca 0.20 1.36 0.09 0.00 0.48 0.00 0.00 55.95 58.08 3inr s SER 96 Cb 0.01 -2.39 -0.04 0.00 0.10 0.00 0.00 66.02 63.70 3inr s SER 96 CO 0.04 0.17 0.07 -0.76 0.98 0.00 0.00 173.24 173.74 3inr s LEU 97 N -1.49 3.34 0.88 2.42 1.43 -0.52 -4.45 118.68 120.29 3inr s LEU 97 Ca 0.36 -0.59 -0.12 0.00 -1.03 0.00 0.00 54.13 52.75 3inr s LEU 97 Cb -0.19 -1.85 0.12 0.00 0.03 0.00 0.00 46.19 44.30 3inr s LEU 97 CO 0.21 -0.07 1.10 -2.16 0.23 0.00 0.00 176.35 175.66 3inr s PRO 98 N -3.75 1.39 0.01 1.29 0.04 -1.26 -4.22 135.00 128.50 3inr s PRO 98 Ca 0.33 0.63 -0.36 0.00 0.04 0.00 0.00 61.00 61.64 3inr s PRO 98 Cb -0.06 -1.84 -0.15 0.00 0.04 0.00 0.00 34.50 32.49 3inr s PRO 98 CO 0.22 -2.10 1.56 -0.89 0.04 0.00 0.00 177.00 175.82 3inr n ILE 99 N -3.76 0.14 -3.97 0.56 -0.00 -1.26 -4.89 119.36 106.18 3inr n ILE 99 Ca 0.07 -0.03 -0.04 0.00 -0.00 0.00 0.00 62.75 62.75 3inr n ILE 99 Cb 0.56 -1.23 -0.01 0.00 -0.00 0.00 0.00 39.64 38.96 3inr n ILE 99 CO 0.00 0.00 0.00 -0.46 -0.00 0.00 0.00 176.55 176.09 3inr n ASN 100 N 3.90 -0.17 0.19 4.38 0.23 -1.26 -2.15 115.26 120.38 3inr n ASN 100 Ca 0.20 -1.43 0.03 0.00 -0.53 0.00 0.00 54.58 52.86 3inr n ASN 100 Cb 0.22 0.38 0.39 0.00 -2.08 0.00 0.00 39.78 38.69 3inr n ASN 100 CO 0.00 0.00 0.00 0.25 -0.93 0.00 0.00 177.26 176.58 3inr h LEU 101 N 0.00 0.00 -0.45 -4.53 5.85 -0.73 -2.20 115.31 113.26 3inr h LEU 101 Ca -0.05 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.65 3inr h LEU 101 Cb 0.24 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 3inr h LEU 101 CO 0.07 0.33 0.20 -0.74 -0.34 0.00 0.00 178.44 177.96 3inr h HIS 102 N 0.00 0.66 -0.53 1.25 2.76 -1.91 -0.46 115.15 116.92 3inr h HIS 102 Ca -0.00 -0.04 0.07 0.00 -2.20 0.00 0.00 60.37 58.19 3inr h HIS 102 Cb 0.60 -0.20 -0.06 0.00 1.55 0.00 0.00 27.41 29.30 3inr h HIS 102 CO 0.00 0.55 0.22 1.15 -1.30 0.00 0.00 177.93 178.54 3inr h THR 103 N 0.58 0.86 0.20 6.26 2.02 -1.69 0.90 112.91 122.03 3inr h THR 103 Ca 0.15 -0.14 -0.01 0.00 0.77 0.00 0.00 66.41 67.18 3inr h THR 103 Cb 0.15 0.40 0.00 0.00 -1.74 0.00 0.00 68.15 66.97 3inr h THR 103 CO -0.02 0.08 -0.10 0.40 0.37 0.00 0.00 175.52 176.25 3inr h ILE 104 N 0.42 0.88 -0.82 3.11 2.04 -1.35 0.92 117.51 122.70 3inr h ILE 104 Ca 0.25 -0.79 0.07 0.00 1.00 0.00 0.00 64.86 65.39 3inr h ILE 104 Cb 0.24 1.32 -0.06 0.00 -0.74 0.00 0.00 36.82 37.58 3inr h ILE 104 CO -0.23 0.17 0.50 0.78 0.00 0.00 0.00 178.15 179.36 3inr h ASN 105 N -0.69 0.76 -0.12 1.72 2.35 -0.99 -1.88 115.58 116.73 3inr h ASN 105 Ca -0.03 0.03 -0.21 0.00 -0.55 0.00 0.00 56.30 55.54 3inr h ASN 105 Cb 0.48 -0.13 0.01 0.00 0.05 0.00 0.00 38.32 38.73 3inr h ASN 105 CO 0.05 0.47 -0.74 -0.61 -1.65 0.00 0.00 177.43 174.95 3inr h GLN 106 N 0.89 0.76 -0.12 0.81 4.15 -0.70 0.12 115.11 121.03 3inr h GLN 106 Ca 0.37 -0.60 -0.01 0.00 0.77 0.00 0.00 58.65 59.19 3inr h GLN 106 Cb 0.22 0.12 -0.01 0.00 0.21 0.00 0.00 27.48 28.02 3inr h GLN 106 CO -0.19 1.21 0.04 0.35 -1.93 0.00 0.00 178.83 178.31 3inr h PHE 107 N 0.53 0.18 -0.02 3.99 3.57 -0.58 -3.05 116.94 121.56 3inr h PHE 107 Ca -0.04 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.45 3inr h PHE 107 Cb 1.35 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 40.04 3inr h PHE 107 CO 0.08 0.29 -0.07 1.19 -2.23 0.00 0.00 178.31 177.57 3inr n PHE 108 N -4.90 0.00 -3.23 0.41 3.01 -0.73 -4.99 117.46 107.04 3inr n PHE 108 Ca -0.05 0.00 -0.15 0.00 1.01 0.00 0.00 57.45 58.26 3inr n PHE 108 Cb 0.12 -0.02 0.08 0.00 -0.01 0.00 0.00 39.48 39.65 3inr n PHE 108 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 3inr n SER 109 N 0.26 -2.39 -4.50 4.37 7.64 0.29 -5.02 113.62 114.27 3inr n SER 109 Ca 0.16 -0.52 -0.24 0.00 1.01 0.00 0.00 58.87 59.29 3inr n SER 109 Cb 0.41 -4.40 -0.11 0.00 -1.01 0.00 0.00 64.21 59.11 3inr n SER 109 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 3inr s LYS 110 N -5.24 1.77 -0.33 1.43 -0.14 -0.40 -5.05 119.74 111.78 3inr s LYS 110 Ca 0.05 -1.99 0.08 0.00 -1.36 0.00 0.00 55.97 52.74 3inr s LYS 110 Cb -0.02 -1.12 0.45 0.00 -1.68 0.00 0.00 37.83 35.46 3inr s LYS 110 CO 0.62 -0.15 1.16 0.25 -0.76 0.00 0.00 175.35 176.46 3inr n THR 111 N -0.79 2.35 -1.75 2.17 -2.24 -1.26 -4.65 114.28 108.10 3inr n THR 111 Ca -0.04 -4.28 -0.42 0.00 -2.27 0.00 0.00 64.05 57.04 3inr n THR 111 Cb 0.67 -0.94 -0.00 0.00 -2.10 0.00 0.00 70.33 67.95 3inr n THR 111 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3inr s SER 113 N -0.13 2.99 0.21 0.00 1.04 -1.26 -4.79 113.70 111.76 3inr s SER 113 Ca 0.55 1.20 -0.09 0.00 0.48 0.00 0.00 55.95 58.09 3inr s SER 113 Cb -0.51 -1.86 0.28 0.00 0.10 0.00 0.00 66.02 64.04 3inr s SER 113 CO 0.62 -2.90 1.76 -0.65 0.98 0.00 0.00 173.24 173.05 3inr h PRO 114 N -1.74 0.47 -0.11 4.02 0.11 -1.97 0.89 132.00 133.67 3inr h PRO 114 Ca -0.53 -0.03 -0.19 0.00 0.11 0.00 0.00 66.00 65.37 3inr h PRO 114 Cb 1.32 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 3inr h PRO 114 CO 0.58 0.31 -0.71 -0.44 -0.21 0.00 0.00 178.00 177.53 3inr h ASP 115 N 0.48 0.58 -0.99 -2.05 3.32 -1.94 -2.00 116.42 113.82 3inr h ASP 115 Ca 0.31 -0.37 0.01 0.00 0.02 0.00 0.00 57.03 57.00 3inr h ASP 115 Cb 0.35 -0.17 -0.05 0.00 0.22 0.00 0.00 39.33 39.68 3inr h ASP 115 CO -0.28 1.11 0.65 -0.33 -1.72 0.00 0.00 179.24 178.67 3inr h GLU 116 N 0.34 1.31 -0.55 3.56 5.08 -1.86 -1.73 114.58 120.74 3inr h GLU 116 Ca -0.03 -0.08 -0.10 0.00 -1.00 0.00 0.00 59.36 58.15 3inr h GLU 116 Cb 1.28 -0.29 -0.02 0.00 0.50 0.00 0.00 28.75 30.22 3inr h GLU 116 CO 0.13 0.87 -0.06 0.00 -1.00 0.00 0.00 179.01 178.95 3inr h ALA 117 N 1.36 0.85 -0.71 3.43 0.00 -0.56 -1.32 119.26 122.30 3inr h ALA 117 Ca 0.36 -0.33 0.14 0.00 0.00 0.00 0.00 54.91 55.09 3inr h ALA 117 Cb -0.15 -0.20 -0.10 0.00 0.00 0.00 0.00 17.79 17.34 3inr h ALA 117 CO -0.08 0.66 0.21 0.00 0.00 0.00 0.00 179.25 180.04 3inr h ARG 118 N 0.90 0.32 -0.01 0.00 3.08 -1.10 0.12 114.38 117.69 3inr h ARG 118 Ca 0.15 -0.02 -0.10 0.00 0.07 0.00 0.00 59.98 60.09 3inr h ARG 118 Cb 0.61 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.57 3inr h ARG 118 CO 0.04 0.21 -0.45 0.00 -1.07 0.00 0.00 179.97 178.70 3inr h ALA 119 N 1.56 1.24 -0.08 0.04 0.00 -0.99 -1.23 119.26 119.79 3inr h ALA 119 Ca 0.39 -0.41 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 3inr h ALA 119 Cb 0.62 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.34 3inr h ALA 119 CO -0.44 0.57 -0.23 1.25 0.00 0.00 0.00 179.25 180.40 3inr h LEU 120 N 0.02 0.34 -0.39 0.00 5.85 -0.56 -2.45 115.31 118.12 3inr h LEU 120 Ca -0.00 -0.60 -0.11 0.00 0.84 0.00 0.00 57.88 58.01 3inr h LEU 120 Cb 0.80 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.72 3inr h LEU 120 CO 0.06 0.88 -0.18 0.40 -0.34 0.00 0.00 178.44 179.26 3inr h ILE 121 N -0.18 1.28 -0.29 4.05 1.08 -0.65 -2.83 117.51 119.97 3inr h ILE 121 Ca -0.01 -1.31 0.07 0.00 -0.39 0.00 0.00 64.86 63.22 3inr h ILE 121 Cb 0.84 1.30 -0.08 0.00 -3.07 0.00 0.00 36.82 35.82 3inr h ILE 121 CO 0.05 0.44 -0.27 0.00 -0.69 0.00 0.00 178.15 177.68 3inr h ALA 122 N 0.81 -0.15 -0.76 1.87 0.00 -1.27 0.16 119.26 119.92 3inr h ALA 122 Ca 0.09 0.08 0.17 0.00 0.00 0.00 0.00 54.91 55.25 3inr h ALA 122 Cb 0.73 0.57 -0.13 0.00 0.00 0.00 0.00 17.79 18.96 3inr h ALA 122 CO 0.06 -0.69 0.04 1.49 0.00 0.00 0.00 179.25 180.14 3inr h GLU 123 N -0.26 0.12 0.00 0.00 4.22 -1.39 -2.50 114.58 114.77 3inr h GLU 123 Ca 0.15 -0.01 -0.02 0.00 0.08 0.00 0.00 59.36 59.56 3inr h GLU 123 Cb 0.49 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.71 3inr h GLU 123 CO -0.43 0.08 -0.10 0.87 -2.18 0.00 0.00 179.01 177.25 3inr h LYS 124 N 0.12 0.00 -7.30 1.92 1.57 -1.02 -3.44 116.57 108.42 3inr h LYS 124 Ca 0.42 0.00 -0.52 0.00 -1.87 0.00 0.00 60.65 58.68 3inr h LYS 124 Cb 0.74 0.00 0.15 0.00 0.08 0.00 0.00 32.23 33.20 3inr h LYS 124 CO -0.65 0.10 0.29 0.20 -0.57 0.00 0.00 179.45 178.82 3inr s GLY 125 N -4.26 1.69 0.00 3.86 0.00 -0.06 -3.94 107.32 104.62 3inr s GLY 125 Ca 0.06 0.38 0.00 0.00 0.00 0.00 0.00 44.72 45.16 3inr s GLY 125 CO 0.68 0.75 0.36 1.34 0.00 0.00 0.00 173.10 176.23 3inr n ASP 126 N -3.72 0.00 0.00 1.64 2.03 -0.37 -4.91 116.55 111.22 3inr n ASP 126 Ca 0.10 0.45 0.00 0.00 0.52 0.00 0.00 54.79 55.86 3inr n ASP 126 Cb 0.53 -0.19 0.00 0.00 -0.72 0.00 0.00 41.12 40.73 3inr n ASP 126 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 3inr n SER 127 N -1.08 0.00 0.06 1.67 7.64 -1.26 -5.04 113.62 115.61 3inr n SER 127 Ca 0.00 0.00 0.11 0.00 1.01 0.00 0.00 58.87 59.99 3inr n SER 127 Cb 0.00 -0.16 0.44 0.00 -1.01 0.00 0.00 64.21 63.48 3inr n SER 127 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 3inr n THR 128 N -0.85 0.73 -0.58 0.44 5.66 -1.26 -5.16 114.28 113.26 3inr n THR 128 Ca 0.00 0.13 0.06 0.00 -3.05 0.00 0.00 64.05 61.19 3inr n THR 128 Cb 0.00 -0.92 -0.03 0.00 -1.55 0.00 0.00 70.33 67.82 3inr n THR 128 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 3inr n THR 134 N -1.88 -0.47 0.22 1.09 -2.24 -1.25 -5.12 114.28 104.63 3inr n THR 134 Ca 0.04 0.40 -0.11 0.00 -2.27 0.00 0.00 64.05 62.11 3inr n THR 134 Cb 0.26 -0.62 -0.06 0.00 -2.10 0.00 0.00 70.33 67.81 3inr n THR 134 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 3inr h PHE 135 N -0.49 -0.58 0.00 4.78 3.57 0.34 -0.27 116.94 124.29 3inr h PHE 135 Ca -0.07 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.41 3inr h PHE 135 Cb 0.53 0.19 -0.00 0.00 2.79 0.00 0.00 35.95 39.46 3inr h PHE 135 CO 0.02 -0.31 -0.01 1.49 -2.23 0.00 0.00 178.31 177.27 3inr h GLU 136 N -1.12 0.00 0.01 1.11 4.81 -1.75 -0.87 114.58 116.77 3inr h GLU 136 Ca -0.06 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.17 3inr h GLU 136 Cb 0.53 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.91 3inr h GLU 136 CO 0.10 0.01 -0.00 0.93 -0.73 0.00 0.00 179.01 179.32 3inr h GLU 137 N 0.00 -0.01 -0.56 1.92 5.08 -1.87 -3.11 114.58 116.03 3inr h GLU 137 Ca -0.00 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.29 3inr h GLU 137 Cb 0.04 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 3inr h GLU 137 CO 0.00 0.76 0.04 0.37 -1.00 0.00 0.00 179.01 179.18 3inr h GLN 138 N -0.81 0.92 0.37 2.33 5.75 -0.36 -2.20 115.11 121.11 3inr h GLN 138 Ca -0.00 -0.25 -0.02 0.00 -0.15 0.00 0.00 58.65 58.23 3inr h GLN 138 Cb 0.77 -0.11 0.00 0.00 1.07 0.00 0.00 27.48 29.22 3inr h GLN 138 CO 0.00 0.89 -0.18 0.00 -2.65 0.00 0.00 178.83 176.89 3inr h ALA 139 N 1.18 -0.49 -0.51 3.38 0.00 -1.32 0.16 119.26 121.66 3inr h ALA 139 Ca 0.17 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 3inr h ALA 139 Cb 0.45 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 3inr h ALA 139 CO 0.02 -0.72 -0.02 -0.07 0.00 0.00 0.00 179.25 178.46 3inr h LEU 140 N -0.61 0.85 -0.29 0.00 3.38 -1.52 0.14 115.31 117.26 3inr h LEU 140 Ca -0.05 -0.23 -0.06 0.00 0.09 0.00 0.00 57.88 57.63 3inr h LEU 140 Cb 0.45 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 3inr h LEU 140 CO 0.08 0.93 -0.06 -0.09 0.09 0.00 0.00 178.44 179.39 3inr h ARG 141 N 0.81 0.55 0.00 1.13 9.65 -1.34 -0.98 114.38 124.20 3inr h ARG 141 Ca 0.15 -0.21 -0.27 0.00 -1.10 0.00 0.00 59.98 58.55 3inr h ARG 141 Cb 0.51 -0.03 -0.05 0.00 -1.39 0.00 0.00 29.97 29.01 3inr h ARG 141 CO 0.03 0.74 -1.73 1.19 2.80 0.00 0.00 179.97 183.00 3inr n PHE 142 N -4.51 0.85 -0.13 2.20 3.72 0.56 -2.75 117.46 117.41 3inr n PHE 142 Ca -0.03 0.30 0.00 0.00 -0.05 0.00 0.00 57.45 57.67 3inr n PHE 142 Cb 0.31 -1.13 0.00 0.00 -0.94 0.00 0.00 39.48 37.72 3inr n PHE 142 CO 0.00 0.00 0.00 0.44 -0.05 0.00 0.00 176.76 177.15 3inr n ILE 143 N -2.96 0.00 0.00 4.37 -5.35 0.43 -4.73 119.36 111.12 3inr n ILE 143 Ca -0.17 -0.19 0.00 0.00 -0.27 0.00 0.00 62.75 62.12 3inr n ILE 143 Cb 1.01 1.13 0.00 0.00 -1.74 0.00 0.00 39.64 40.04 3inr n ILE 143 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3inr n GLY 144 N 0.31 -1.05 0.20 3.28 0.00 -1.04 -4.42 105.19 102.46 3inr n GLY 144 Ca 0.00 -1.58 -0.02 0.00 0.00 0.00 0.00 46.02 44.42 3inr n GLY 144 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3inr h LYS 145 N 0.00 0.14 0.15 1.61 3.64 -1.82 -1.78 116.57 118.52 3inr h LYS 145 Ca 0.00 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.36 3inr h LYS 145 Cb 0.00 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.79 3inr h LYS 145 CO 0.00 0.10 -0.07 0.93 -2.27 0.00 0.00 179.45 178.13 3inr h GLU 146 N 0.15 -0.20 -0.18 1.90 5.08 -1.94 0.12 114.58 119.51 3inr h GLU 146 Ca 0.26 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.63 3inr h GLU 146 Cb 0.39 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 3inr h GLU 146 CO -0.41 0.02 0.07 -0.07 -1.00 0.00 0.00 179.01 177.62 3inr h LEU 147 N -0.38 0.25 -0.48 1.33 3.38 -1.77 -1.13 115.31 116.52 3inr h LEU 147 Ca -0.02 -0.17 0.07 0.00 0.09 0.00 0.00 57.88 57.85 3inr h LEU 147 Cb 0.30 -0.06 -0.06 0.00 0.09 0.00 0.00 40.66 40.93 3inr h LEU 147 CO 0.03 0.35 0.16 0.22 0.09 0.00 0.00 178.44 179.29 3inr h TYR 148 N 0.13 0.28 -0.00 1.13 3.20 -1.21 -0.89 116.97 119.61 3inr h TYR 148 Ca 0.06 0.02 -0.15 0.00 3.14 0.00 0.00 58.73 61.81 3inr h TYR 148 Cb 0.18 -0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.37 3inr h TYR 148 CO -0.01 0.09 -0.69 0.93 -1.64 0.00 0.00 178.16 176.83 3inr h GLU 149 N 0.33 0.01 0.11 1.82 5.08 -0.71 -0.52 114.58 120.70 3inr h GLU 149 Ca 0.23 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.57 3inr h GLU 149 Cb 0.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.50 3inr h GLU 149 CO -0.24 0.70 -0.05 0.00 -1.00 0.00 0.00 179.01 178.41 3inr h ALA 150 N 1.30 -0.15 0.00 3.43 0.00 -0.77 -3.39 119.26 119.68 3inr h ALA 150 Ca -0.01 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 3inr h ALA 150 Cb 1.23 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 19.07 3inr h ALA 150 CO 0.09 -0.25 -1.91 1.19 0.00 0.00 0.00 179.25 178.38 3inr n PHE 151 N -4.87 0.00 -0.02 0.00 3.01 -0.38 -4.61 117.46 110.59 3inr n PHE 151 Ca -0.08 0.00 -0.03 0.00 1.01 0.00 0.00 57.45 58.35 3inr n PHE 151 Cb 0.28 -0.46 -0.02 0.00 -0.01 0.00 0.00 39.48 39.27 3inr n PHE 151 CO 0.00 0.00 0.00 1.19 1.01 0.00 0.00 176.76 178.96 3inr n PHE 152 N -2.20 0.00 0.10 1.38 3.01 -0.57 -4.60 117.46 114.59 3inr n PHE 152 Ca -0.04 0.00 -0.10 0.00 1.01 0.00 0.00 57.45 58.32 3inr n PHE 152 Cb 0.53 -0.17 -0.06 0.00 -0.01 0.00 0.00 39.48 39.76 3inr n PHE 152 CO 0.00 0.00 0.00 -0.22 1.01 0.00 0.00 176.76 177.55 3inr h LYS 153 N 0.00 -0.33 -0.53 -1.08 3.64 -1.34 -0.76 116.57 116.17 3inr h LYS 153 Ca -0.10 0.02 0.07 0.00 -1.27 0.00 0.00 60.65 59.38 3inr h LYS 153 Cb 1.17 0.07 -0.06 0.00 -0.41 0.00 0.00 32.23 33.00 3inr h LYS 153 CO -0.01 -0.00 0.20 0.78 -2.27 0.00 0.00 179.45 178.14 3inr h GLY 154 N -0.96 0.72 0.97 5.01 0.00 -1.76 -2.29 103.07 104.77 3inr h GLY 154 Ca -0.03 -0.11 -0.11 0.00 0.00 0.00 0.00 47.33 47.08 3inr h GLY 154 CO 0.06 0.01 -0.22 -1.82 0.00 0.00 0.00 176.54 174.56 3inr h TYR 155 N 0.38 0.85 -0.41 5.60 3.20 -1.48 -2.21 116.97 122.91 3inr h TYR 155 Ca 0.26 -0.23 0.04 0.00 3.14 0.00 0.00 58.73 61.94 3inr h TYR 155 Cb 0.28 -0.19 -0.04 0.00 1.54 0.00 0.00 36.73 38.33 3inr h TYR 155 CO -0.16 0.96 0.19 1.15 -1.64 0.00 0.00 178.16 178.66 3inr h THR 156 N 0.49 0.94 -0.66 1.81 2.02 -1.09 0.38 112.91 116.80 3inr h THR 156 Ca 0.06 -0.13 0.04 0.00 0.77 0.00 0.00 66.41 67.15 3inr h THR 156 Cb 0.78 0.53 -0.05 0.00 -1.74 0.00 0.00 68.15 67.67 3inr h THR 156 CO 0.06 0.07 0.40 0.40 0.37 0.00 0.00 175.52 176.82 3inr h ILE 157 N 0.38 1.05 -0.29 3.11 2.04 -1.33 -0.05 117.51 122.42 3inr h ILE 157 Ca 0.18 -0.26 -0.16 0.00 1.00 0.00 0.00 64.86 65.62 3inr h ILE 157 Cb 0.11 0.22 -0.01 0.00 -0.74 0.00 0.00 36.82 36.41 3inr h ILE 157 CO -0.15 0.14 -0.45 0.11 0.00 0.00 0.00 178.15 177.81 3inr h LYS 158 N 0.76 0.75 -0.08 2.37 1.57 -1.08 0.21 116.57 121.07 3inr h LYS 158 Ca 0.27 -0.42 -0.19 0.00 -1.87 0.00 0.00 60.65 58.44 3inr h LYS 158 Cb 0.07 0.03 0.01 0.00 0.08 0.00 0.00 32.23 32.41 3inr h LYS 158 CO -0.13 1.04 -0.69 0.37 -0.57 0.00 0.00 179.45 179.47 3inr h GLN 159 N 0.60 0.60 0.00 3.15 5.75 0.17 -3.38 115.11 122.01 3inr h GLN 159 Ca 0.04 -0.55 0.00 0.00 -0.15 0.00 0.00 58.65 57.99 3inr h GLN 159 Cb 1.01 0.13 0.00 0.00 1.07 0.00 0.00 27.48 29.69 3inr h GLN 159 CO 0.10 1.17 -1.77 0.91 -2.65 0.00 0.00 178.83 176.58 3inr n TRP 160 N -4.09 0.00 -1.82 3.99 7.02 -0.07 -4.83 117.44 117.64 3inr n TRP 160 Ca -0.09 0.00 -0.03 0.00 -1.02 0.00 0.00 57.50 56.36 3inr n TRP 160 Cb 0.70 -0.39 -0.00 0.00 -2.42 0.00 0.00 31.31 29.20 3inr n TRP 160 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3inr n GLY 161 N 1.43 0.33 3.14 6.99 0.00 0.72 -4.98 105.19 112.82 3inr n GLY 161 Ca -0.03 -0.79 -0.11 0.00 0.00 0.00 0.00 46.02 45.09 3inr n GLY 161 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3inr s MET 162 N -3.70 0.57 0.56 1.61 -1.94 -1.23 -5.05 119.30 110.12 3inr s MET 162 Ca 0.00 -0.45 -0.19 0.00 -1.71 0.00 0.00 55.69 53.33 3inr s MET 162 Cb 0.00 0.24 -0.05 0.00 2.01 0.00 0.00 34.83 37.03 3inr s MET 162 CO 0.00 -0.15 1.18 -0.65 -0.01 0.00 0.00 175.02 175.39 3inr s GLN 163 N -1.75 3.20 0.48 2.03 -1.52 -1.26 -3.75 119.66 117.08 3inr s GLN 163 Ca -0.12 1.74 0.27 0.00 -1.95 0.00 0.00 55.36 55.30 3inr s GLN 163 Cb -0.05 -2.01 1.09 0.00 -0.22 0.00 0.00 33.01 31.82 3inr s GLN 163 CO 0.00 -1.00 1.89 -1.35 -0.25 0.00 0.00 175.29 174.59 3inr h PRO 164 N 1.13 0.00 0.00 2.91 0.11 -1.94 -2.73 132.00 131.48 3inr h PRO 164 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3inr h PRO 164 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 3inr h PRO 164 CO 0.56 0.16 0.10 -1.13 -0.21 0.00 0.00 178.00 177.48 3inr n SER 165 N -3.36 0.00 -0.77 -2.05 3.41 -1.26 -2.03 113.62 107.56 3inr n SER 165 Ca -0.00 0.40 0.08 0.00 -0.26 0.00 0.00 58.87 59.09 3inr n SER 165 Cb 0.38 -0.40 0.22 0.00 -0.26 0.00 0.00 64.21 64.15 3inr n SER 165 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3inr n GLU 166 N -1.40 2.83 -4.12 4.33 1.02 -1.03 -4.86 120.64 117.41 3inr n GLU 166 Ca 0.00 -2.62 -0.11 0.00 -0.02 0.00 0.00 57.16 54.41 3inr n GLU 166 Cb 0.10 -1.68 -0.10 0.00 -0.02 0.00 0.00 31.44 29.73 3inr n GLU 166 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3inr s LEU 167 N -2.38 2.42 0.40 -4.62 1.43 -0.86 -5.02 118.68 110.05 3inr s LEU 167 Ca 0.36 -0.84 -0.23 0.00 -1.03 0.00 0.00 54.13 52.40 3inr s LEU 167 Cb 0.28 -0.07 -0.10 0.00 0.03 0.00 0.00 46.19 46.33 3inr s LEU 167 CO 0.10 -0.39 0.98 -2.16 0.23 0.00 0.00 176.35 175.11 3inr s PRO 168 N -3.03 4.26 0.36 1.29 0.04 -1.26 0.82 135.00 137.49 3inr s PRO 168 Ca 0.03 1.27 0.16 0.00 0.04 0.00 0.00 61.00 62.51 3inr s PRO 168 Cb 0.00 -2.40 1.08 0.00 0.04 0.00 0.00 34.50 33.23 3inr s PRO 168 CO -0.03 -0.02 1.70 0.00 0.04 0.00 0.00 177.00 178.69 3inr h ALA 169 N 2.31 2.09 -1.92 8.56 0.00 -1.93 -3.34 119.26 125.03 3inr h ALA 169 Ca -0.48 0.13 -0.42 0.00 0.00 0.00 0.00 54.91 54.13 3inr h ALA 169 Cb 1.19 0.09 0.22 0.00 0.00 0.00 0.00 17.79 19.30 3inr h ALA 169 CO 0.62 -0.61 -0.41 -1.13 0.00 0.00 0.00 179.25 177.72 3inr n SER 170 N -4.84 -2.34 0.00 0.00 3.41 -1.26 -2.63 113.62 105.95 3inr n SER 170 Ca 0.29 -0.26 0.00 0.00 -0.26 0.00 0.00 58.87 58.64 3inr n SER 170 Cb 0.95 -1.10 0.00 0.00 -0.26 0.00 0.00 64.21 63.80 3inr n SER 170 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 3inr n ILE 171 N -4.92 0.00 0.04 -1.33 5.41 -1.26 -4.37 119.36 112.92 3inr n ILE 171 Ca 0.03 0.00 -0.20 0.00 1.00 0.00 0.00 62.75 63.58 3inr n ILE 171 Cb 0.57 0.00 -0.11 0.00 -0.71 0.00 0.00 39.64 39.38 3inr n ILE 171 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 176.55 176.80 3inr h LEU 172 N 0.00 0.76 -1.75 1.39 5.85 -1.84 -2.85 115.31 116.87 3inr h LEU 172 Ca 0.00 -0.77 0.21 0.00 0.84 0.00 0.00 57.88 58.16 3inr h LEU 172 Cb 0.00 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 40.75 3inr h LEU 172 CO 0.00 1.44 0.58 0.50 -0.34 0.00 0.00 178.44 180.62 3inr h LYS 173 N 0.17 0.21 0.00 1.25 1.63 -1.70 0.28 116.57 118.40 3inr h LYS 173 Ca -0.13 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.66 3inr h LYS 173 Cb 1.62 -0.05 0.00 0.00 -0.60 0.00 0.00 32.23 33.20 3inr h LYS 173 CO 0.18 0.14 0.00 0.54 -3.45 0.00 0.00 179.45 176.86 3inr n ARG 174 N -4.41 0.35 -3.45 1.90 1.74 -1.08 -4.19 116.66 107.52 3inr n ARG 174 Ca 0.17 0.05 -0.26 0.00 -0.77 0.00 0.00 57.85 57.04 3inr n ARG 174 Cb 0.76 -1.50 -0.09 0.00 -1.02 0.00 0.00 32.46 30.61 3inr n ARG 174 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3inr n LEU 175 N -1.29 1.73 -4.77 0.55 4.77 0.10 -5.03 117.00 113.06 3inr n LEU 175 Ca 0.12 -4.97 -0.37 0.00 -0.03 0.00 0.00 56.01 50.76 3inr n LEU 175 Cb 0.20 -0.07 -0.02 0.00 -2.33 0.00 0.00 43.42 41.20 3inr n LEU 175 CO 0.19 1.96 0.80 -2.16 -1.33 0.00 0.00 177.39 176.85 3inr s PRO 176 N -1.39 4.01 0.15 3.23 0.04 -1.25 -4.94 135.00 134.84 3inr s PRO 176 Ca 0.34 1.71 -0.34 0.00 0.04 0.00 0.00 61.00 62.75 3inr s PRO 176 Cb 0.09 -2.56 -0.16 0.00 0.04 0.00 0.00 34.50 31.92 3inr s PRO 176 CO -0.11 -0.33 1.29 0.28 0.04 0.00 0.00 177.00 178.18 3inr n VAL 177 N -0.13 0.50 -3.55 -0.36 0.31 -1.26 -4.87 118.33 108.97 3inr n VAL 177 Ca 0.05 -0.13 -0.38 0.00 -0.01 0.00 0.00 64.34 63.87 3inr n VAL 177 Cb 0.48 -0.98 -0.11 0.00 -0.91 0.00 0.00 33.84 32.32 3inr n VAL 177 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 3inr s ARG 178 N 0.04 3.90 -0.83 5.55 0.52 -0.91 -4.99 118.95 122.23 3inr s ARG 178 Ca 0.77 -0.30 -0.04 0.00 -0.52 0.00 0.00 55.73 55.64 3inr s ARG 178 Cb -0.85 -3.68 0.16 0.00 0.52 0.00 0.00 34.95 31.11 3inr s ARG 178 CO 0.49 -0.23 2.41 1.19 0.02 0.00 0.00 175.30 179.18 3inr n PHE 179 N 5.12 2.26 -3.88 -0.53 3.01 -1.26 -2.22 117.46 119.96 3inr n PHE 179 Ca -0.13 -2.32 -0.11 0.00 1.01 0.00 0.00 57.45 55.90 3inr n PHE 179 Cb 0.51 -1.44 -0.00 0.00 -0.01 0.00 0.00 39.48 38.54 3inr n PHE 179 CO 0.00 0.00 0.00 0.27 1.01 0.00 0.00 176.76 178.04 3inr n ASN 180 N 0.72 -1.62 -1.47 4.37 0.23 -1.26 -4.64 115.26 111.59 3inr n ASN 180 Ca 0.53 -2.59 0.07 0.00 -0.53 0.00 0.00 54.58 52.05 3inr n ASN 180 Cb 0.37 2.84 0.31 0.00 -2.08 0.00 0.00 39.78 41.22 3inr n ASN 180 CO 0.00 0.00 0.00 -1.22 -0.93 0.00 0.00 177.26 175.11 3inr n TYR 181 N -0.51 1.42 -2.65 -2.53 4.02 -1.26 -1.34 117.16 114.32 3inr n TYR 181 Ca -0.03 -0.53 -0.43 0.00 -0.01 0.00 0.00 57.90 56.90 3inr n TYR 181 Cb 0.53 -0.30 -0.02 0.00 -0.02 0.00 0.00 39.34 39.53 3inr n TYR 181 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 3inr s ASP 182 N -0.74 6.96 -0.13 7.72 2.15 -1.26 -4.88 116.67 126.49 3inr s ASP 182 Ca 0.43 1.10 0.15 0.00 0.43 0.00 0.00 52.55 54.66 3inr s ASP 182 Cb 0.30 -2.54 0.48 0.00 -0.30 0.00 0.00 42.92 40.85 3inr s ASP 182 CO 0.17 -0.84 1.39 -0.90 -0.17 0.00 0.00 175.17 174.81 3inr n ASP 183 N 6.77 3.68 -4.68 -0.34 5.75 -1.26 -4.90 116.55 121.56 3inr n ASP 183 Ca 0.12 -2.72 -0.42 0.00 -0.01 0.00 0.00 54.79 51.76 3inr n ASP 183 Cb 0.47 -0.46 -0.03 0.00 -1.03 0.00 0.00 41.12 40.07 3inr n ASP 183 CO 0.00 0.00 0.00 0.21 -0.11 0.00 0.00 177.20 177.30 3inr s ASN 184 N -1.62 6.53 0.44 -1.12 3.84 -1.26 -4.58 114.94 117.17 3inr s ASN 184 Ca 0.37 2.57 0.10 0.00 0.21 0.00 0.00 52.86 56.11 3inr s ASN 184 Cb 0.28 -2.56 0.98 0.00 -0.55 0.00 0.00 41.25 39.40 3inr s ASN 184 CO 0.11 -0.95 2.09 0.22 -2.79 0.00 0.00 177.10 175.77 3inr h TYR 185 N 8.91 0.36 -3.30 0.43 3.20 -0.99 -3.43 116.97 122.16 3inr h TYR 185 Ca -0.44 0.01 -0.66 0.00 3.14 0.00 0.00 58.73 60.77 3inr h TYR 185 Cb 1.21 -0.12 -0.29 0.00 1.54 0.00 0.00 36.73 39.06 3inr h TYR 185 CO 0.82 0.23 -0.79 -0.06 -1.64 0.00 0.00 178.16 176.72 3inr s PHE 186 N -5.37 2.79 -1.55 -3.82 0.40 -1.26 -4.95 117.98 104.23 3inr s PHE 186 Ca -0.07 -0.92 0.02 0.00 -0.60 0.00 0.00 56.93 55.35 3inr s PHE 186 Cb 0.17 -1.88 0.08 0.00 0.51 0.00 0.00 43.02 41.91 3inr s PHE 186 CO 0.71 -0.40 0.89 0.09 0.70 0.00 0.00 175.22 177.21 3inr n ASN 187 N 3.92 0.92 -4.84 1.36 3.02 -1.26 -4.91 115.26 113.47 3inr n ASN 187 Ca -0.19 -2.05 -0.33 0.00 -0.03 0.00 0.00 54.58 51.99 3inr n ASN 187 Cb 0.52 -0.25 -0.07 0.00 -0.61 0.00 0.00 39.78 39.37 3inr n ASN 187 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 3inr s HIS 188 N -1.60 3.34 0.14 3.10 3.76 -1.26 -4.98 115.29 117.79 3inr s HIS 188 Ca 0.06 1.40 -0.20 0.00 -0.15 0.00 0.00 55.06 56.18 3inr s HIS 188 Cb 0.04 -2.68 0.01 0.00 1.11 0.00 0.00 32.58 31.05 3inr s HIS 188 CO 0.03 -0.00 1.69 -0.22 -0.85 0.00 0.00 174.74 175.39 3inr h LYS 189 N 2.10 -0.03 -5.55 1.40 3.64 -1.89 -3.42 116.57 112.81 3inr h LYS 189 Ca -0.48 0.00 -0.65 0.00 -1.27 0.00 0.00 60.65 58.25 3inr h LYS 189 Cb 1.18 0.01 -0.19 0.00 -0.41 0.00 0.00 32.23 32.82 3inr h LYS 189 CO 0.63 -0.02 -0.64 -0.06 -2.27 0.00 0.00 179.45 177.09 3inr s PHE 190 N -6.20 3.09 -0.16 1.91 0.40 0.47 -5.00 117.98 112.49 3inr s PHE 190 Ca -0.14 -0.07 -0.12 0.00 -0.60 0.00 0.00 56.93 56.00 3inr s PHE 190 Cb 0.11 -1.91 0.05 0.00 0.51 0.00 0.00 43.02 41.78 3inr s PHE 190 CO 0.69 0.17 0.42 -1.14 0.70 0.00 0.00 175.22 176.06 3inr s GLN 191 N -0.08 0.45 -0.03 0.44 0.74 -1.26 -1.39 119.66 118.52 3inr s GLN 191 Ca 0.03 0.68 -0.18 0.00 0.05 0.00 0.00 55.36 55.94 3inr s GLN 191 Cb -0.13 0.12 0.06 0.00 1.10 0.00 0.00 33.01 34.17 3inr s GLN 191 CO 0.02 -0.10 0.82 0.41 -0.55 0.00 0.00 175.29 175.89 3inr n GLY 192 N 3.47 0.30 3.11 2.59 0.00 -0.54 -3.89 105.19 110.23 3inr n GLY 192 Ca -0.18 -0.95 -0.21 0.00 0.00 0.00 0.00 46.02 44.68 3inr n GLY 192 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3inr s MET 193 N -2.01 1.00 0.24 1.61 -1.94 -0.47 -2.81 119.30 114.93 3inr s MET 193 Ca 0.19 -0.58 -0.30 0.00 -1.71 0.00 0.00 55.69 53.30 3inr s MET 193 Cb -0.00 -0.99 -0.09 0.00 2.01 0.00 0.00 34.83 35.76 3inr s MET 193 CO -0.01 0.26 1.03 -1.25 -0.01 0.00 0.00 175.02 175.04 3inr s PRO 194 N -0.63 4.72 0.18 2.03 0.04 -1.26 -0.60 135.00 139.49 3inr s PRO 194 Ca 0.04 1.65 -0.12 0.00 0.04 0.00 0.00 61.00 62.61 3inr s PRO 194 Cb -0.06 -3.25 0.09 0.00 0.04 0.00 0.00 34.50 31.32 3inr s PRO 194 CO 0.00 0.31 1.78 -0.22 0.04 0.00 0.00 177.00 178.90 3inr h LYS 195 N 4.26 0.89 -0.71 4.56 3.64 -1.15 -1.76 116.57 126.30 3inr h LYS 195 Ca -0.45 -0.12 0.00 0.00 -1.27 0.00 0.00 60.65 58.80 3inr h LYS 195 Cb 1.21 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.86 3inr h LYS 195 CO 0.68 0.70 0.00 0.00 -2.27 0.00 0.00 179.45 178.56 3inr n GLY 197 N 1.46 0.00 0.22 0.00 0.00 -0.66 -4.28 105.19 101.93 3inr n GLY 197 Ca 0.25 -1.71 -0.00 0.00 0.00 0.00 0.00 46.02 44.56 3inr n GLY 197 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3inr h TYR 198 N 0.00 0.29 -0.11 1.61 -1.99 -1.86 -2.46 116.97 112.46 3inr h TYR 198 Ca 0.00 -0.06 -0.00 0.00 2.00 0.00 0.00 58.73 60.67 3inr h TYR 198 Cb 0.00 -0.07 -0.01 0.00 2.00 0.00 0.00 36.73 38.65 3inr h TYR 198 CO 0.00 0.52 0.06 1.15 -0.00 0.00 0.00 178.16 179.89 3inr h THR 199 N 0.24 1.07 -0.93 -2.88 2.02 -1.81 0.24 112.91 110.85 3inr h THR 199 Ca 0.04 -0.18 0.01 0.00 0.77 0.00 0.00 66.41 67.04 3inr h THR 199 Cb 0.61 1.00 -0.05 0.00 -1.74 0.00 0.00 68.15 67.97 3inr h THR 199 CO 0.04 0.06 0.62 1.56 0.37 0.00 0.00 175.52 178.17 3inr h GLN 200 N 0.10 1.22 -0.76 6.66 1.08 -1.73 0.22 115.11 121.91 3inr h GLN 200 Ca 0.04 -0.07 0.00 0.00 -1.45 0.00 0.00 58.65 57.17 3inr h GLN 200 Cb 0.04 -0.28 -0.04 0.00 -0.05 0.00 0.00 27.48 27.16 3inr h GLN 200 CO -0.01 0.81 0.49 1.98 -0.95 0.00 0.00 178.83 181.15 3inr h MET 201 N 1.26 1.01 0.06 1.46 4.05 -0.88 -0.43 114.93 121.46 3inr h MET 201 Ca 0.34 -0.07 -0.24 0.00 -0.28 0.00 0.00 59.70 59.45 3inr h MET 201 Cb -0.14 -0.22 -0.01 0.00 -0.80 0.00 0.00 31.60 30.42 3inr h MET 201 CO -0.07 0.69 -1.13 0.82 0.23 0.00 0.00 176.91 177.44 3inr h ILE 202 N 1.04 1.59 -0.82 1.77 2.04 0.15 -2.33 117.51 120.95 3inr h ILE 202 Ca 0.28 -3.24 0.06 0.00 1.00 0.00 0.00 64.86 62.96 3inr h ILE 202 Cb -0.09 2.88 -0.06 0.00 -0.74 0.00 0.00 36.82 38.81 3inr h ILE 202 CO -0.06 0.93 0.50 0.50 0.00 0.00 0.00 178.15 180.02 3inr h LYS 203 N 0.03 0.88 -0.20 2.37 3.64 -0.32 0.34 116.57 123.31 3inr h LYS 203 Ca -0.08 -0.05 -0.16 0.00 -1.27 0.00 0.00 60.65 59.09 3inr h LYS 203 Cb 1.87 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 33.48 3inr h LYS 203 CO 0.16 0.58 -0.53 1.03 -2.27 0.00 0.00 179.45 178.42 3inr h SER 204 N 0.91 0.65 -0.42 4.20 0.87 -1.00 -2.24 113.55 116.52 3inr h SER 204 Ca 0.36 -0.34 -0.03 0.00 -1.23 0.00 0.00 61.79 60.55 3inr h SER 204 Cb 0.18 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 61.93 3inr h SER 204 CO -0.18 1.06 0.17 0.40 -0.53 0.00 0.00 176.83 177.75 3inr h ILE 205 N 0.46 1.19 0.00 2.23 2.04 -0.80 -2.47 117.51 120.16 3inr h ILE 205 Ca 0.01 -0.61 0.00 0.00 1.00 0.00 0.00 64.86 65.26 3inr h ILE 205 Cb 1.08 0.65 0.00 0.00 -0.74 0.00 0.00 36.82 37.81 3inr h ILE 205 CO 0.10 0.23 0.00 0.18 0.00 0.00 0.00 178.15 178.67 3inr n LEU 206 N -4.34 0.00 -4.54 1.44 4.77 0.04 -4.61 117.00 109.76 3inr n LEU 206 Ca 0.03 0.44 -0.42 0.00 -0.03 0.00 0.00 56.01 56.04 3inr n LEU 206 Cb 0.17 -0.44 -0.03 0.00 -2.33 0.00 0.00 43.42 40.79 3inr n LEU 206 CO 0.38 -0.02 1.42 0.21 -1.33 0.00 0.00 177.39 178.05 3inr s ASN 207 N -2.89 6.57 -0.12 -1.43 2.47 -0.87 -4.81 114.94 113.86 3inr s ASN 207 Ca 0.17 -1.71 -0.23 0.00 0.42 0.00 0.00 52.86 51.51 3inr s ASN 207 Cb 0.18 -2.53 0.05 0.00 -1.45 0.00 0.00 41.25 37.51 3inr s ASN 207 CO 0.48 -1.37 0.56 -2.28 -3.72 0.00 0.00 177.10 170.78 3inr s HIS 208 N 4.35 -0.56 0.40 0.43 2.46 -1.26 -5.03 115.29 116.07 3inr s HIS 208 Ca 0.44 1.17 0.09 0.00 0.47 0.00 0.00 55.06 57.23 3inr s HIS 208 Cb -0.01 0.26 0.83 0.00 -0.13 0.00 0.00 32.58 33.53 3inr s HIS 208 CO -0.08 -0.42 1.97 1.49 -2.47 0.00 0.00 174.74 175.23 3inr h GLU 209 N 4.23 0.35 -0.40 2.88 4.81 -1.96 -1.75 114.58 122.74 3inr h GLU 209 Ca -0.28 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.90 3inr h GLU 209 Cb 1.16 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.48 3inr h GLU 209 CO 0.27 0.36 0.00 0.09 -0.73 0.00 0.00 179.01 179.00 3inr n ASN 210 N -4.36 1.65 -4.24 1.04 3.02 -1.26 -4.80 115.26 106.31 3inr n ASN 210 Ca 0.00 -2.08 -0.33 0.00 -0.03 0.00 0.00 54.58 52.14 3inr n ASN 210 Cb 0.18 -0.27 -0.15 0.00 -0.61 0.00 0.00 39.78 38.94 3inr n ASN 210 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3inr s ILE 211 N -1.65 2.63 -0.13 2.41 1.01 -0.66 -1.10 121.20 123.71 3inr s ILE 211 Ca 0.17 -0.77 -0.01 0.00 0.00 0.00 0.00 60.65 60.04 3inr s ILE 211 Cb 0.10 -2.12 -0.02 0.00 0.01 0.00 0.00 42.46 40.43 3inr s ILE 211 CO 0.10 0.51 -0.12 -0.75 0.00 0.00 0.00 174.94 174.68 3inr s LYS 212 N 0.98 3.39 -0.15 2.79 2.47 0.63 -4.81 119.74 125.04 3inr s LYS 212 Ca -0.02 -0.66 -0.01 0.00 -1.56 0.00 0.00 55.97 53.72 3inr s LYS 212 Cb -0.15 -2.67 -0.01 0.00 -1.46 0.00 0.00 37.83 33.54 3inr s LYS 212 CO -0.03 0.24 -0.11 0.08 0.16 0.00 0.00 175.35 175.69 3inr s VAL 213 N 0.29 3.07 -0.13 4.02 1.01 -1.26 -0.44 120.40 126.98 3inr s VAL 213 Ca -0.09 -0.64 0.02 0.00 0.00 0.00 0.00 61.98 61.27 3inr s VAL 213 Cb -0.15 -2.32 0.01 0.00 0.00 0.00 0.00 36.38 33.92 3inr s VAL 213 CO 0.05 0.50 -0.18 -1.81 0.00 0.00 0.00 175.10 173.67 3inr s ASP 214 N 0.64 2.75 0.57 3.32 1.01 -0.45 -4.99 116.67 119.53 3inr s ASP 214 Ca -0.06 -0.51 0.02 0.00 0.71 0.00 0.00 52.55 52.71 3inr s ASP 214 Cb -0.15 -1.25 0.05 0.00 1.01 0.00 0.00 42.92 42.58 3inr s ASP 214 CO 0.03 0.03 0.80 -0.76 0.21 0.00 0.00 175.17 175.47 3inr s LEU 215 N 0.99 3.24 -1.41 1.23 1.43 -1.26 -1.99 118.68 120.92 3inr s LEU 215 Ca -0.05 -0.18 -0.10 0.00 -1.03 0.00 0.00 54.13 52.77 3inr s LEU 215 Cb -0.15 -2.59 0.06 0.00 0.03 0.00 0.00 46.19 43.54 3inr s LEU 215 CO -0.03 -1.26 0.63 0.00 0.23 0.00 0.00 176.35 175.92 3inr n GLN 216 N -2.38 -4.16 -4.03 1.70 6.02 -0.08 -4.87 117.38 109.57 3inr n GLN 216 Ca 0.10 0.59 -0.29 0.00 -0.01 0.00 0.00 57.00 57.38 3inr n GLN 216 Cb 0.60 -5.37 -0.17 0.00 1.02 0.00 0.00 30.24 26.32 3inr n GLN 216 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 3inr s ARG 217 N -6.11 2.17 0.09 -1.09 3.52 0.25 -4.90 118.95 112.89 3inr s ARG 217 Ca 0.45 -0.51 -0.23 0.00 -0.13 0.00 0.00 55.73 55.31 3inr s ARG 217 Cb -0.23 -2.01 -0.07 0.00 -1.56 0.00 0.00 34.95 31.08 3inr s ARG 217 CO 0.55 -0.23 0.70 -1.21 -0.81 0.00 0.00 175.30 174.31 3inr s GLU 218 N 1.49 4.44 0.37 5.12 0.41 -1.26 -2.05 118.70 127.21 3inr s GLU 218 Ca 0.04 0.99 -0.28 0.00 -0.41 0.00 0.00 54.97 55.31 3inr s GLU 218 Cb -0.13 -3.29 -0.10 0.00 -1.78 0.00 0.00 34.13 28.82 3inr s GLU 218 CO -0.10 0.49 1.43 0.12 -0.49 0.00 0.00 175.26 176.71 3inr s PHE 219 N -0.74 2.71 -0.08 1.61 5.36 -1.26 -5.02 117.98 120.55 3inr s PHE 219 Ca 0.34 1.25 -0.00 0.00 -0.96 0.00 0.00 56.93 57.56 3inr s PHE 219 Cb -0.21 -3.91 0.02 0.00 -0.34 0.00 0.00 43.02 38.58 3inr s PHE 219 CO 0.23 -2.65 -0.05 0.42 -1.46 0.00 0.00 175.22 171.70 3inr s ILE 220 N -1.14 0.76 0.47 3.12 1.01 -1.26 -5.04 121.20 119.11 3inr s ILE 220 Ca 0.53 -0.16 0.23 0.00 0.00 0.00 0.00 60.65 61.25 3inr s ILE 220 Cb -0.44 -0.81 0.41 0.00 0.01 0.00 0.00 42.46 41.63 3inr s ILE 220 CO 0.59 0.31 1.88 -0.37 0.00 0.00 0.00 174.94 177.36 3inr h VAL 221 N 6.20 0.65 -0.26 2.92 -1.51 -1.98 -1.36 116.25 120.90 3inr h VAL 221 Ca -0.28 -0.08 0.08 0.00 -1.23 0.00 0.00 66.70 65.18 3inr h VAL 221 Cb 1.14 0.39 -0.01 0.00 -2.13 0.00 0.00 31.29 30.68 3inr h VAL 221 CO 0.38 0.04 0.23 0.44 -1.23 0.00 0.00 177.57 177.43 3inr h ASP 222 N 0.24 0.00 0.41 4.19 3.45 -2.02 -1.78 116.42 120.90 3inr h ASP 222 Ca 0.43 0.00 -0.05 0.00 0.43 0.00 0.00 57.03 57.84 3inr h ASP 222 Cb 1.30 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 40.06 3inr h ASP 222 CO -0.10 0.00 -0.24 -0.33 -1.57 0.00 0.00 179.24 177.00 3inr h GLU 223 N 0.00 0.00 -1.12 3.56 5.08 -1.68 -3.32 114.58 117.10 3inr h GLU 223 Ca 0.12 0.00 0.33 0.00 -1.00 0.00 0.00 59.36 58.82 3inr h GLU 223 Cb 0.57 0.00 -0.12 0.00 0.50 0.00 0.00 28.75 29.70 3inr h GLU 223 CO -0.00 0.24 0.71 0.00 -1.00 0.00 0.00 179.01 178.95 3inr h ARG 224 N 0.00 0.28 0.00 2.33 3.08 -1.48 -0.94 114.38 117.65 3inr h ARG 224 Ca -0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.03 3inr h ARG 224 Cb 0.50 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.49 3inr h ARG 224 CO 0.03 0.18 0.00 0.25 -1.07 0.00 0.00 179.97 179.36 3inr n THR 225 N -4.75 0.56 1.89 2.04 -2.24 -1.25 -2.24 114.28 108.29 3inr n THR 225 Ca 0.31 -0.07 0.05 0.00 -2.27 0.00 0.00 64.05 62.06 3inr n THR 225 Cb 1.08 -0.73 0.28 0.00 -2.10 0.00 0.00 70.33 68.86 3inr n THR 225 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 3inr n HIS 226 N -2.03 0.00 -4.03 4.78 8.25 -0.36 -4.90 115.22 116.93 3inr n HIS 226 Ca 0.05 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.39 3inr n HIS 226 Cb 0.35 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.34 3inr n HIS 226 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 3inr s TYR 227 N -2.00 0.50 0.23 4.41 1.51 -0.95 -4.97 117.35 116.08 3inr s TYR 227 Ca 0.14 -0.50 0.10 0.00 -1.01 0.00 0.00 57.07 55.81 3inr s TYR 227 Cb 0.06 -0.31 0.25 0.00 -0.11 0.00 0.00 41.96 41.85 3inr s TYR 227 CO 0.11 -0.12 1.54 -0.44 -1.11 0.00 0.00 175.55 175.53 3inr h ASP 228 N 4.61 0.00 -5.00 2.29 3.32 -1.52 -3.47 116.42 116.65 3inr h ASP 228 Ca -0.34 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.63 3inr h ASP 228 Cb 1.21 0.00 -0.19 0.00 0.22 0.00 0.00 39.33 40.57 3inr h ASP 228 CO 0.41 0.69 0.04 -2.28 -1.72 0.00 0.00 179.24 176.37 3inr s HIS 229 N -3.41 -0.49 -0.04 4.55 2.46 -1.18 -4.81 115.29 112.37 3inr s HIS 229 Ca -0.01 0.77 0.05 0.00 0.47 0.00 0.00 55.06 56.35 3inr s HIS 229 Cb 0.12 0.31 -0.01 0.00 -0.13 0.00 0.00 32.58 32.88 3inr s HIS 229 CO 0.77 -0.56 -0.20 0.08 -2.47 0.00 0.00 174.74 172.36 3inr s VAL 230 N -1.46 1.68 -0.18 0.89 1.01 -0.45 -1.69 120.40 120.19 3inr s VAL 230 Ca -0.11 -0.86 -0.02 0.00 0.00 0.00 0.00 61.98 60.99 3inr s VAL 230 Cb -0.02 -1.42 -0.01 0.00 0.00 0.00 0.00 36.38 34.93 3inr s VAL 230 CO 0.06 0.47 -0.08 -0.36 0.00 0.00 0.00 175.10 175.20 3inr s PHE 231 N -0.11 2.91 -0.23 5.22 0.40 -0.09 -0.93 117.98 125.16 3inr s PHE 231 Ca -0.02 -0.77 -0.01 0.00 -0.60 0.00 0.00 56.93 55.54 3inr s PHE 231 Cb -0.12 -1.99 0.03 0.00 0.51 0.00 0.00 43.02 41.45 3inr s PHE 231 CO 0.02 -0.37 -0.10 -0.47 0.70 0.00 0.00 175.22 175.00 3inr s TYR 232 N 0.93 3.01 -0.50 0.36 5.04 0.08 -0.33 117.35 125.95 3inr s TYR 232 Ca -0.01 -1.62 0.11 0.00 -2.44 0.00 0.00 57.07 53.11 3inr s TYR 232 Cb -0.15 -2.01 0.32 0.00 0.35 0.00 0.00 41.96 40.47 3inr s TYR 232 CO 0.00 -0.75 1.26 -1.13 -1.34 0.00 0.00 175.55 173.59 3inr n SER 233 N 4.64 3.02 -4.72 4.32 3.41 -0.43 -1.24 113.62 122.62 3inr n SER 233 Ca -0.17 -2.39 -0.26 0.00 -0.26 0.00 0.00 58.87 55.78 3inr n SER 233 Cb 0.47 -0.30 0.10 0.00 -0.26 0.00 0.00 64.21 64.22 3inr n SER 233 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 3inr s GLY 234 N -1.43 1.72 0.23 5.00 0.00 -1.26 -3.96 107.32 107.62 3inr s GLY 234 Ca 0.26 -1.13 -0.32 0.00 0.00 0.00 0.00 44.72 43.54 3inr s GLY 234 CO 0.10 -0.61 1.50 -1.05 0.00 0.00 0.00 173.10 173.04 3inr n PRO 235 N -3.09 2.23 -0.20 2.90 -0.02 -1.26 -2.97 135.00 132.60 3inr n PRO 235 Ca 0.11 0.80 -0.07 0.00 -2.02 0.00 0.00 63.50 62.31 3inr n PRO 235 Cb 0.60 -2.51 0.03 0.00 -0.02 0.00 0.00 33.50 31.60 3inr n PRO 235 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3inr h LEU 236 N 4.82 0.77 -1.04 2.45 5.85 -1.65 -2.39 115.31 124.12 3inr h LEU 236 Ca -0.45 -0.14 -0.02 0.00 0.84 0.00 0.00 57.88 58.11 3inr h LEU 236 Cb 1.26 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 42.05 3inr h LEU 236 CO 0.80 0.69 0.40 -2.24 -0.34 0.00 0.00 178.44 177.75 3inr h ASP 237 N 0.79 0.97 -0.46 1.25 2.03 -1.90 -2.91 116.42 116.18 3inr h ASP 237 Ca 0.20 -0.09 -0.14 0.00 -0.73 0.00 0.00 57.03 56.27 3inr h ASP 237 Cb 0.14 -0.25 -0.01 0.00 -0.83 0.00 0.00 39.33 38.38 3inr h ASP 237 CO -0.02 0.79 -0.25 0.00 -1.03 0.00 0.00 179.24 178.73 3inr h ALA 238 N 1.36 0.67 -0.93 4.15 0.00 -1.88 -0.35 119.26 122.28 3inr h ALA 238 Ca 0.27 -0.41 0.20 0.00 0.00 0.00 0.00 54.91 54.98 3inr h ALA 238 Cb 0.06 -0.16 -0.11 0.00 0.00 0.00 0.00 17.79 17.58 3inr h ALA 238 CO -0.04 0.68 0.49 0.35 0.00 0.00 0.00 179.25 180.73 3inr h PHE 239 N 0.84 0.84 -0.76 0.00 3.57 -1.23 -0.56 116.94 119.64 3inr h PHE 239 Ca 0.10 0.04 -0.31 0.00 3.53 0.00 0.00 57.97 61.33 3inr h PHE 239 Cb 0.83 -0.23 -0.19 0.00 2.79 0.00 0.00 35.95 39.16 3inr h PHE 239 CO 0.05 0.08 0.39 0.66 -2.23 0.00 0.00 178.31 177.27 3inr n TYR 240 N -4.92 2.43 -1.19 0.41 4.02 -0.50 -4.90 117.16 112.51 3inr n TYR 240 Ca 0.22 -1.35 -0.07 0.00 -0.01 0.00 0.00 57.90 56.69 3inr n TYR 240 Cb 0.61 -0.74 -0.03 0.00 -0.02 0.00 0.00 39.34 39.16 3inr n TYR 240 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3inr n GLY 241 N -0.47 0.86 2.60 2.72 0.00 -0.22 -2.08 105.19 108.60 3inr n GLY 241 Ca 0.44 -0.44 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 3inr n GLY 241 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3inr n TYR 242 N -2.68 -1.45 0.29 1.61 4.01 -0.26 -4.85 117.16 113.83 3inr n TYR 242 Ca -0.07 0.10 0.20 0.00 -0.16 0.00 0.00 57.90 57.97 3inr n TYR 242 Cb 0.28 -3.11 1.03 0.00 -0.31 0.00 0.00 39.34 37.22 3inr n TYR 242 CO 0.00 0.00 0.00 -0.56 -0.46 0.00 0.00 176.86 175.84 3inr h GLN 243 N -0.24 0.00 -0.04 -0.72 3.07 -1.66 0.61 115.11 116.12 3inr h GLN 243 Ca -0.36 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.38 3inr h GLN 243 Cb 1.26 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.82 3inr h GLN 243 CO 0.43 0.00 0.00 0.66 0.09 0.00 0.00 178.83 180.01 3inr n TYR 244 N -2.86 0.04 0.00 0.06 0.53 -1.26 -5.11 117.16 108.56 3inr n TYR 244 Ca -0.02 -0.04 0.00 0.00 -1.02 0.00 0.00 57.90 56.81 3inr n TYR 244 Cb 0.08 -0.00 0.00 0.00 -1.03 0.00 0.00 39.34 38.38 3inr n TYR 244 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 3inr n GLY 245 N 0.63 2.28 3.67 2.72 0.00 0.20 -5.07 105.19 109.63 3inr n GLY 245 Ca 0.07 -2.09 -0.35 0.00 0.00 0.00 0.00 46.02 43.65 3inr n GLY 245 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3inr s ARG 246 N -2.12 4.07 0.20 1.61 0.52 -1.26 -4.74 118.95 117.23 3inr s ARG 246 Ca 0.00 -0.28 -0.32 0.00 -0.52 0.00 0.00 55.73 54.61 3inr s ARG 246 Cb 0.00 -3.37 -0.11 0.00 0.52 0.00 0.00 34.95 31.99 3inr s ARG 246 CO 0.00 0.22 1.63 -0.51 0.02 0.00 0.00 175.30 176.67 3inr s LEU 247 N 0.56 4.37 0.12 2.53 1.43 -1.26 -4.93 118.68 121.50 3inr s LEU 247 Ca 0.06 2.77 -0.30 0.00 -1.03 0.00 0.00 54.13 55.62 3inr s LEU 247 Cb -0.12 -3.60 -0.07 0.00 0.03 0.00 0.00 46.19 42.43 3inr s LEU 247 CO 0.00 -0.89 1.21 -0.83 0.23 0.00 0.00 176.35 176.07 3inr s GLY 248 N 1.06 2.49 0.12 -3.19 0.00 -1.26 -5.00 107.32 101.54 3inr s GLY 248 Ca 0.71 0.91 0.04 0.00 0.00 0.00 0.00 44.72 46.38 3inr s GLY 248 CO 0.34 1.98 -0.09 -0.19 0.00 0.00 0.00 173.10 175.13 3inr s TYR 249 N 0.58 1.14 0.08 1.90 1.51 -1.26 -1.26 117.35 120.03 3inr s TYR 249 Ca 0.57 -0.76 -0.13 0.00 -1.01 0.00 0.00 57.07 55.74 3inr s TYR 249 Cb -0.31 -0.60 -0.06 0.00 -0.11 0.00 0.00 41.96 40.87 3inr s TYR 249 CO 0.32 0.01 0.45 1.03 -1.11 0.00 0.00 175.55 176.26 3inr s ARG 250 N -3.49 3.89 0.46 -0.62 1.81 0.68 -1.27 118.95 120.41 3inr s ARG 250 Ca 0.13 0.36 0.06 0.00 -1.72 0.00 0.00 55.73 54.56 3inr s ARG 250 Cb 0.02 -3.06 -0.02 0.00 -0.45 0.00 0.00 34.95 31.44 3inr s ARG 250 CO -0.01 0.58 0.22 -0.08 -0.68 0.00 0.00 175.30 175.33 3inr s THR 251 N -1.31 2.01 -0.01 0.02 -1.32 0.97 -1.79 115.64 114.21 3inr s THR 251 Ca 0.31 -1.67 0.03 0.00 -1.21 0.00 0.00 61.69 59.15 3inr s THR 251 Cb -0.15 -2.69 -0.01 0.00 -1.51 0.00 0.00 72.50 68.14 3inr s THR 251 CO 0.17 0.00 -0.10 -0.76 -2.21 0.00 0.00 174.62 171.72 3inr s LEU 252 N -4.00 1.96 -0.11 9.08 1.43 -1.26 -1.80 118.68 123.98 3inr s LEU 252 Ca 0.35 -0.19 -0.02 0.00 -1.03 0.00 0.00 54.13 53.24 3inr s LEU 252 Cb 0.02 -0.56 -0.03 0.00 0.03 0.00 0.00 46.19 45.65 3inr s LEU 252 CO 0.20 0.12 -0.03 -1.81 0.23 0.00 0.00 176.35 175.06 3inr s ASP 253 N -0.14 4.93 -0.21 2.29 1.01 0.78 -4.93 116.67 120.40 3inr s ASP 253 Ca 0.02 0.00 -0.03 0.00 0.71 0.00 0.00 52.55 53.25 3inr s ASP 253 Cb -0.05 -1.51 -0.01 0.00 1.01 0.00 0.00 42.92 42.35 3inr s ASP 253 CO -0.00 0.29 -0.05 -0.36 0.21 0.00 0.00 175.17 175.26 3inr s PHE 254 N -0.39 2.95 -0.41 4.23 0.40 -1.26 0.10 117.98 123.60 3inr s PHE 254 Ca 0.07 -0.86 -0.16 0.00 -0.60 0.00 0.00 56.93 55.38 3inr s PHE 254 Cb -0.12 -2.07 0.02 0.00 0.51 0.00 0.00 43.02 41.36 3inr s PHE 254 CO 0.02 -0.48 0.35 0.21 0.70 0.00 0.00 175.22 176.02 3inr s LYS 255 N 1.29 3.03 0.22 0.44 2.20 0.84 -4.95 119.74 122.82 3inr s LYS 255 Ca 0.04 -0.92 -0.30 0.00 -0.36 0.00 0.00 55.97 54.43 3inr s LYS 255 Cb -0.14 -3.97 -0.08 0.00 -1.51 0.00 0.00 37.83 32.12 3inr s LYS 255 CO -0.02 -0.78 1.04 0.21 -0.36 0.00 0.00 175.35 175.44 3inr s LYS 256 N 1.84 4.70 0.13 4.03 2.20 -1.26 -1.83 119.74 129.55 3inr s LYS 256 Ca 0.07 1.65 -0.02 0.00 -0.36 0.00 0.00 55.97 57.31 3inr s LYS 256 Cb -0.18 -3.26 -0.03 0.00 -1.51 0.00 0.00 37.83 32.84 3inr s LYS 256 CO 0.11 0.26 0.09 -0.59 -0.36 0.00 0.00 175.35 174.86 3inr s PHE 257 N -0.78 0.76 -0.13 4.03 -0.12 -0.22 -4.99 117.98 116.54 3inr s PHE 257 Ca 0.45 -1.15 0.02 0.00 -0.05 0.00 0.00 56.93 56.21 3inr s PHE 257 Cb -0.29 -0.41 0.00 0.00 -0.63 0.00 0.00 43.02 41.70 3inr s PHE 257 CO 0.35 -0.54 -0.20 0.42 -0.05 0.00 0.00 175.22 175.20 3inr s ILE 258 N -4.03 2.28 -0.11 -4.49 1.01 -1.26 -0.90 121.20 113.70 3inr s ILE 258 Ca 0.22 -0.92 0.00 0.00 0.00 0.00 0.00 60.65 59.96 3inr s ILE 258 Cb 0.07 -1.92 -0.02 0.00 0.01 0.00 0.00 42.46 40.60 3inr s ILE 258 CO 0.01 0.54 -0.13 -0.47 0.00 0.00 0.00 174.94 174.89 3inr s TYR 259 N 0.66 2.80 -0.70 3.97 5.04 0.23 -4.95 117.35 124.39 3inr s TYR 259 Ca -0.10 -0.53 -0.24 0.00 -2.44 0.00 0.00 57.07 53.76 3inr s TYR 259 Cb -0.16 -1.80 0.06 0.00 0.35 0.00 0.00 41.96 40.40 3inr s TYR 259 CO 0.02 -0.12 1.09 -0.65 -1.34 0.00 0.00 175.55 174.55 3inr s GLN 260 N 0.13 3.16 0.00 4.97 -1.52 -1.26 0.13 119.66 125.27 3inr s GLN 260 Ca -0.06 -0.65 0.00 0.00 -1.95 0.00 0.00 55.36 52.70 3inr s GLN 260 Cb -0.15 -4.25 0.00 0.00 -0.22 0.00 0.00 33.01 28.39 3inr s GLN 260 CO 0.05 -1.94 0.00 0.41 -0.25 0.00 0.00 175.29 173.55 3inr n GLY 261 N 5.38 0.53 3.20 3.09 0.00 0.79 -4.98 105.19 113.20 3inr n GLY 261 Ca -0.00 -1.99 -0.36 0.00 0.00 0.00 0.00 46.02 43.67 3inr n GLY 261 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3inr s ASP 262 N -4.00 4.99 0.14 1.61 1.01 -1.26 -4.08 116.67 115.07 3inr s ASP 262 Ca 0.00 -1.24 -0.11 0.00 0.71 0.00 0.00 52.55 51.91 3inr s ASP 262 Cb 0.00 -1.75 -0.06 0.00 1.01 0.00 0.00 42.92 42.12 3inr s ASP 262 CO 0.00 -0.28 1.45 0.22 0.21 0.00 0.00 175.17 176.77 3inr h TYR 263 N 8.05 1.13 0.00 4.23 3.20 -1.94 -3.41 116.97 128.23 3inr h TYR 263 Ca -0.22 -0.36 0.00 0.00 3.14 0.00 0.00 58.73 61.29 3inr h TYR 263 Cb 1.07 -0.23 0.00 0.00 1.54 0.00 0.00 36.73 39.11 3inr h TYR 263 CO 0.61 1.20 -0.11 0.00 -1.64 0.00 0.00 178.16 178.22 3inr n GLN 264 N -4.04 3.76 -0.55 1.82 10.64 -1.26 -5.07 117.38 122.68 3inr n GLN 264 Ca -0.03 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.14 3inr n GLN 264 Cb 0.58 -0.56 0.00 0.00 -0.86 0.00 0.00 30.24 29.40 3inr n GLN 264 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 3inr n GLY 265 N 0.44 0.79 3.53 2.61 0.00 -1.26 -5.04 105.19 106.26 3inr n GLY 265 Ca 0.00 -0.51 -0.12 0.00 0.00 0.00 0.00 46.02 45.40 3inr n GLY 265 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3inr h ALA 267 N 2.44 0.89 -3.24 0.00 0.00 -1.84 -3.37 119.26 114.14 3inr h ALA 267 Ca -0.23 0.05 -0.44 0.00 0.00 0.00 0.00 54.91 54.29 3inr h ALA 267 Cb 1.19 -0.05 -0.39 0.00 0.00 0.00 0.00 17.79 18.55 3inr h ALA 267 CO 0.33 -0.06 -0.76 0.08 0.00 0.00 0.00 179.25 178.85 3inr s VAL 268 N -6.08 0.24 -0.22 0.00 1.01 -1.26 -0.28 120.40 113.81 3inr s VAL 268 Ca -0.13 0.02 -0.03 0.00 0.00 0.00 0.00 61.98 61.84 3inr s VAL 268 Cb 0.17 -0.55 0.00 0.00 0.00 0.00 0.00 36.38 36.00 3inr s VAL 268 CO 0.76 0.09 -0.06 -0.32 0.00 0.00 0.00 175.10 175.56 3inr s MET 269 N 2.01 3.25 0.24 2.72 0.00 0.10 -2.42 119.30 125.20 3inr s MET 269 Ca 0.04 -0.71 -0.16 0.00 0.00 0.00 0.00 55.69 54.86 3inr s MET 269 Cb -0.14 -2.98 -0.08 0.00 0.00 0.00 0.00 34.83 31.64 3inr s MET 269 CO -0.06 -0.24 0.67 -0.80 0.00 0.00 0.00 175.02 174.59 3inr s ASN 270 N 1.44 6.87 -0.33 1.11 -0.87 0.23 -0.89 114.94 122.50 3inr s ASN 270 Ca 0.05 1.24 0.01 0.00 -1.57 0.00 0.00 52.86 52.60 3inr s ASN 270 Cb -0.15 -2.35 0.09 0.00 -0.02 0.00 0.00 41.25 38.82 3inr s ASN 270 CO -0.04 -0.04 0.04 -0.31 -2.57 0.00 0.00 177.10 174.17 3inr s TYR 271 N -1.69 3.54 -0.74 2.20 1.51 -0.87 -0.27 117.35 121.04 3inr s TYR 271 Ca 0.46 -2.56 0.26 0.00 -1.01 0.00 0.00 57.07 54.22 3inr s TYR 271 Cb -0.14 -2.64 0.75 0.00 -0.11 0.00 0.00 41.96 39.82 3inr s TYR 271 CO 0.19 -0.92 1.70 0.00 -1.11 0.00 0.00 175.55 175.42 3inr s SER 273 N -4.38 6.92 0.57 0.00 0.15 -1.26 -2.21 113.70 113.49 3inr s SER 273 Ca 0.10 2.24 0.29 0.00 0.70 0.00 0.00 55.95 59.28 3inr s SER 273 Cb 0.13 -2.59 1.73 0.00 -1.71 0.00 0.00 66.02 63.58 3inr s SER 273 CO 0.62 -0.57 2.22 1.62 1.20 0.00 0.00 173.24 178.32 3inr h VAL 274 N 4.24 0.56 0.00 4.45 3.04 -1.89 -2.40 116.25 124.25 3inr h VAL 274 Ca -0.42 -0.11 0.00 0.00 -1.01 0.00 0.00 66.70 65.16 3inr h VAL 274 Cb 1.21 1.07 0.00 0.00 -2.01 0.00 0.00 31.29 31.56 3inr h VAL 274 CO 0.83 0.02 0.00 0.47 -1.01 0.00 0.00 177.57 177.89 3inr n ASP 275 N -3.84 0.00 -4.70 3.17 8.00 -1.26 -4.60 116.55 113.31 3inr n ASP 275 Ca -0.03 -0.07 -0.36 0.00 0.71 0.00 0.00 54.79 55.04 3inr n ASP 275 Cb 0.11 -0.29 -0.08 0.00 -0.02 0.00 0.00 41.12 40.83 3inr n ASP 275 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3inr s VAL 276 N -2.58 5.36 0.09 2.53 1.01 -0.91 -5.00 120.40 120.90 3inr s VAL 276 Ca 0.25 0.26 0.02 0.00 0.00 0.00 0.00 61.98 62.50 3inr s VAL 276 Cb 0.18 -3.52 -0.25 0.00 0.00 0.00 0.00 36.38 32.79 3inr s VAL 276 CO 0.41 0.38 1.17 1.55 0.00 0.00 0.00 175.10 178.61 3inr h PRO 277 N 7.07 0.13 -7.32 2.72 0.13 -1.86 -3.44 132.00 129.44 3inr h PRO 277 Ca -0.39 -0.23 -0.51 0.00 -0.87 0.00 0.00 66.00 64.00 3inr h PRO 277 Cb 1.16 0.09 0.09 0.00 0.13 0.00 0.00 31.00 32.47 3inr h PRO 277 CO 0.71 1.09 0.37 1.52 -0.23 0.00 0.00 178.00 181.46 3inr s TYR 278 N -2.68 3.10 -0.06 1.56 -0.85 -1.26 -4.79 117.35 112.37 3inr s TYR 278 Ca -0.02 1.43 0.05 0.00 -0.52 0.00 0.00 57.07 58.01 3inr s TYR 278 Cb 0.08 -2.90 -0.24 0.00 0.38 0.00 0.00 41.96 39.28 3inr s TYR 278 CO 0.85 -1.21 0.59 0.00 -1.52 0.00 0.00 175.55 174.26 3inr h THR 279 N -0.54 0.80 -2.60 -3.49 1.03 -0.42 -3.44 112.91 104.25 3inr h THR 279 Ca -0.44 -2.60 0.09 0.00 -0.01 0.00 0.00 66.41 63.45 3inr h THR 279 Cb 1.21 2.48 -0.10 0.00 -1.07 0.00 0.00 68.15 70.67 3inr h THR 279 CO 0.57 0.65 0.38 0.00 -0.01 0.00 0.00 175.52 177.11 3inr s ARG 280 N -2.59 1.23 -0.11 0.00 1.70 -1.24 -2.05 118.95 115.88 3inr s ARG 280 Ca -0.11 -0.59 0.02 0.00 -0.47 0.00 0.00 55.73 54.59 3inr s ARG 280 Cb 0.07 0.48 -0.00 0.00 -0.57 0.00 0.00 34.95 34.93 3inr s ARG 280 CO 0.81 -0.55 -0.20 0.42 -1.08 0.00 0.00 175.30 174.70 3inr s ILE 281 N -3.47 2.41 -0.10 4.99 1.01 -0.07 -0.82 121.20 125.15 3inr s ILE 281 Ca 0.08 -0.89 0.00 0.00 0.00 0.00 0.00 60.65 59.84 3inr s ILE 281 Cb -0.02 -1.96 -0.02 0.00 0.01 0.00 0.00 42.46 40.46 3inr s ILE 281 CO -0.03 0.55 -0.09 0.42 0.00 0.00 0.00 174.94 175.78 3inr s THR 282 N 0.37 3.48 -0.33 2.92 -4.23 -0.81 -0.72 115.64 116.32 3inr s THR 282 Ca -0.15 -0.54 0.04 0.00 -1.18 0.00 0.00 61.69 59.86 3inr s THR 282 Cb -0.17 -2.45 0.09 0.00 1.34 0.00 0.00 72.50 71.31 3inr s THR 282 CO 0.07 0.56 0.02 -0.70 -0.54 0.00 0.00 174.62 174.03 3inr s GLU 283 N -0.24 1.63 0.55 3.99 2.12 0.62 -1.95 118.70 125.42 3inr s GLU 283 Ca 0.03 -1.78 0.26 0.00 0.36 0.00 0.00 54.97 53.84 3inr s GLU 283 Cb -0.13 -3.15 1.60 0.00 0.26 0.00 0.00 34.13 32.71 3inr s GLU 283 CO 0.03 -0.87 2.18 0.45 -0.54 0.00 0.00 175.26 176.50 3inr h HIS 284 N 7.64 0.00 0.00 5.30 3.86 -1.73 -2.33 115.15 127.90 3inr h HIS 284 Ca -0.07 0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 59.09 3inr h HIS 284 Cb 1.02 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.49 3inr h HIS 284 CO 0.49 0.04 -0.25 1.57 0.86 0.00 0.00 177.93 180.65 3inr h LYS 285 N 0.00 0.00 0.00 2.45 2.10 -1.84 -1.68 116.57 117.60 3inr h LYS 285 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3inr h LYS 285 Cb 0.10 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.43 3inr h LYS 285 CO 0.01 0.25 0.00 0.66 -2.00 0.00 0.00 179.45 178.37 3inr n TYR 286 N -3.79 0.60 0.81 0.07 4.02 -0.87 -1.05 117.16 116.95 3inr n TYR 286 Ca -0.01 0.29 0.13 0.00 -0.01 0.00 0.00 57.90 58.29 3inr n TYR 286 Cb 0.35 -0.96 0.51 0.00 -0.02 0.00 0.00 39.34 39.23 3inr n TYR 286 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 3inr n PHE 287 N -2.09 0.44 -3.07 -0.72 3.01 -0.63 -4.00 117.46 110.39 3inr n PHE 287 Ca 0.00 0.13 -0.26 0.00 1.01 0.00 0.00 57.45 58.33 3inr n PHE 287 Cb 0.09 -0.71 -0.05 0.00 -0.01 0.00 0.00 39.48 38.80 3inr n PHE 287 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 3inr n SER 288 N -1.86 3.85 0.26 4.37 7.64 -0.21 -4.91 113.62 122.75 3inr n SER 288 Ca 0.06 -3.54 0.17 0.00 1.01 0.00 0.00 58.87 56.57 3inr n SER 288 Cb 0.38 -0.59 0.91 0.00 -1.01 0.00 0.00 64.21 63.90 3inr n SER 288 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 3inr h PRO 289 N 3.25 0.00 0.00 1.43 0.13 -1.70 0.18 132.00 135.29 3inr h PRO 289 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 3inr h PRO 289 Cb 0.59 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.72 3inr h PRO 289 CO 0.78 0.00 0.00 -2.67 -0.23 0.00 0.00 178.00 175.88 3inr n TRP 290 N -2.71 0.00 -4.20 1.56 2.14 -1.26 -4.78 117.44 108.18 3inr n TRP 290 Ca -0.02 0.00 -0.25 0.00 2.07 0.00 0.00 57.50 59.30 3inr n TRP 290 Cb 0.08 -0.11 -0.07 0.00 -0.81 0.00 0.00 31.31 30.40 3inr n TRP 290 CO 0.00 0.00 0.00 -1.21 2.07 0.00 0.00 177.69 178.55 3inr s GLU 291 N -2.22 2.51 -0.04 -2.67 2.02 0.62 -5.12 118.70 113.79 3inr s GLU 291 Ca 0.34 -1.16 0.06 0.00 0.02 0.00 0.00 54.97 54.24 3inr s GLU 291 Cb 0.18 -2.37 -0.01 0.00 0.10 0.00 0.00 34.13 32.03 3inr s GLU 291 CO 0.34 0.43 -0.23 1.14 0.02 0.00 0.00 175.26 176.96 3inr s GLN 292 N -3.30 2.20 -0.07 1.61 1.03 -1.26 -5.00 119.66 114.87 3inr s GLN 292 Ca 0.30 -0.84 -0.03 0.00 0.04 0.00 0.00 55.36 54.83 3inr s GLN 292 Cb -0.08 -1.95 0.04 0.00 0.03 0.00 0.00 33.01 31.04 3inr s GLN 292 CO 0.20 0.40 0.17 -1.01 -2.54 0.00 0.00 175.29 172.52 3inr s HIS 293 N -0.27 -0.20 -0.02 9.60 3.76 -1.26 -5.03 115.29 121.87 3inr s HIS 293 Ca 0.01 0.55 -0.14 0.00 -0.15 0.00 0.00 55.06 55.33 3inr s HIS 293 Cb -0.12 -0.05 -0.33 0.00 1.11 0.00 0.00 32.58 33.20 3inr s HIS 293 CO 0.02 -0.18 0.82 -0.44 -0.85 0.00 0.00 174.74 174.11 3inr h ASP 294 N 7.17 0.71 -3.33 1.40 3.32 -1.90 -3.45 116.42 120.33 3inr h ASP 294 Ca -0.42 -0.93 -0.56 0.00 0.02 0.00 0.00 57.03 55.15 3inr h ASP 294 Cb 1.15 -0.23 -0.04 0.00 0.22 0.00 0.00 39.33 40.43 3inr h ASP 294 CO 0.41 1.73 0.04 -0.83 -1.72 0.00 0.00 179.24 178.87 3inr s GLY 295 N -4.85 2.75 -0.09 2.75 0.00 -1.26 -0.15 107.32 106.46 3inr s GLY 295 Ca -0.13 0.14 0.04 0.00 0.00 0.00 0.00 44.72 44.77 3inr s GLY 295 CO 0.89 0.62 -0.23 -0.45 0.00 0.00 0.00 173.10 173.94 3inr s SER 296 N -1.01 3.23 -0.17 1.64 0.15 0.35 -4.86 113.70 113.03 3inr s SER 296 Ca 0.31 -0.51 -0.18 0.00 0.70 0.00 0.00 55.95 56.27 3inr s SER 296 Cb -0.20 -1.29 -0.04 0.00 -1.71 0.00 0.00 66.02 62.78 3inr s SER 296 CO 0.21 0.19 0.50 -0.69 1.20 0.00 0.00 173.24 174.65 3inr s VAL 297 N 0.20 5.14 0.24 4.45 1.01 -1.26 -0.60 120.40 129.57 3inr s VAL 297 Ca -0.14 0.96 0.09 0.00 0.00 0.00 0.00 61.98 62.89 3inr s VAL 297 Cb -0.17 -3.83 -0.05 0.00 0.00 0.00 0.00 36.38 32.33 3inr s VAL 297 CO 0.07 0.24 -0.15 0.00 0.00 0.00 0.00 175.10 175.26 3inr s TYR 299 N -2.83 0.63 0.15 0.00 1.51 -0.82 -1.05 117.35 114.93 3inr s TYR 299 Ca 0.26 -0.15 -0.25 0.00 -1.01 0.00 0.00 57.07 55.91 3inr s TYR 299 Cb -0.01 -0.67 -0.08 0.00 -0.11 0.00 0.00 41.96 41.09 3inr s TYR 299 CO 0.10 -0.24 0.78 0.15 -1.11 0.00 0.00 175.55 175.24 3inr s LYS 300 N 1.39 4.57 -0.12 -0.62 1.02 -0.76 -1.93 119.74 123.29 3inr s LYS 300 Ca -0.04 1.16 0.03 0.00 0.02 0.00 0.00 55.97 57.14 3inr s LYS 300 Cb -0.13 -3.28 -0.00 0.00 -0.52 0.00 0.00 37.83 33.90 3inr s LYS 300 CO -0.03 0.53 -0.21 -2.00 -0.92 0.00 0.00 175.35 172.73 3inr s GLU 301 N -0.99 3.13 -0.04 1.68 2.12 0.00 -0.11 118.70 124.49 3inr s GLU 301 Ca 0.36 -0.82 0.05 0.00 0.36 0.00 0.00 54.97 54.92 3inr s GLU 301 Cb -0.23 -2.42 -0.01 0.00 0.26 0.00 0.00 34.13 31.73 3inr s GLU 301 CO 0.26 0.15 -0.21 0.71 -0.54 0.00 0.00 175.26 175.63 3inr s TYR 302 N 0.45 1.99 -0.17 5.30 1.51 0.12 0.33 117.35 126.87 3inr s TYR 302 Ca -0.14 -0.54 -0.08 0.00 -1.01 0.00 0.00 57.07 55.30 3inr s TYR 302 Cb -0.17 -1.31 -0.04 0.00 -0.11 0.00 0.00 41.96 40.32 3inr s TYR 302 CO 0.06 -0.15 0.11 0.45 -1.11 0.00 0.00 175.55 174.91 3inr s SER 303 N -0.15 6.10 0.18 2.29 0.15 -1.26 -0.16 113.70 120.85 3inr s SER 303 Ca -0.01 0.27 -0.01 0.00 0.70 0.00 0.00 55.95 56.90 3inr s SER 303 Cb -0.11 -2.03 -0.04 0.00 -1.71 0.00 0.00 66.02 62.13 3inr s SER 303 CO 0.02 0.26 0.09 -0.13 1.20 0.00 0.00 173.24 174.68 3inr s ARG 304 N -0.10 1.12 0.23 5.44 0.52 -0.75 -4.93 118.95 120.48 3inr s ARG 304 Ca 0.09 -1.57 -0.31 0.00 -0.52 0.00 0.00 55.73 53.42 3inr s ARG 304 Cb -0.12 0.18 -0.12 0.00 0.52 0.00 0.00 34.95 35.42 3inr s ARG 304 CO 0.00 -0.32 1.67 0.00 0.02 0.00 0.00 175.30 176.67 3inr s ALA 305 N -4.06 3.86 -0.49 2.13 0.00 -1.26 -0.02 121.76 121.92 3inr s ALA 305 Ca 0.33 1.56 -0.28 0.00 0.00 0.00 0.00 51.96 53.57 3inr s ALA 305 Cb 0.07 -3.67 0.01 0.00 0.00 0.00 0.00 23.12 19.53 3inr s ALA 305 CO 0.08 -0.93 1.38 0.00 0.00 0.00 0.00 175.76 176.29 3inr s GLU 307 N 5.16 1.50 0.49 0.00 2.02 -1.26 -4.74 118.70 121.86 3inr s GLU 307 Ca 0.55 -0.97 0.20 0.00 0.02 0.00 0.00 54.97 54.77 3inr s GLU 307 Cb -0.11 -2.24 1.24 0.00 0.10 0.00 0.00 34.13 33.12 3inr s GLU 307 CO 0.29 -1.62 2.00 1.49 0.02 0.00 0.00 175.26 177.43 3inr h GLU 308 N -0.73 0.16 -0.05 1.61 4.81 -2.02 -2.77 114.58 115.58 3inr h GLU 308 Ca -0.38 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.84 3inr h GLU 308 Cb 1.26 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.61 3inr h GLU 308 CO 0.40 0.11 0.00 0.09 -0.73 0.00 0.00 179.01 178.88 3inr n ASN 309 N -4.43 2.01 -4.93 1.04 3.02 -1.26 -4.97 115.26 105.74 3inr n ASN 309 Ca 0.09 -1.68 -0.27 0.00 -0.03 0.00 0.00 54.58 52.69 3inr n ASN 309 Cb 0.49 -0.02 -0.03 0.00 -0.61 0.00 0.00 39.78 39.61 3inr n ASN 309 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 3inr s ASP 310 N -1.94 6.38 0.11 6.41 1.01 -1.05 -5.08 116.67 122.51 3inr s ASP 310 Ca 0.35 0.40 -0.29 0.00 0.71 0.00 0.00 52.55 53.71 3inr s ASP 310 Cb 0.20 -2.01 -0.06 0.00 1.01 0.00 0.00 42.92 42.07 3inr s ASP 310 CO 0.32 -0.05 0.94 -0.63 0.21 0.00 0.00 175.17 175.96 3inr s ILE 311 N -1.89 4.51 -0.15 0.77 1.01 -1.26 -4.88 121.20 119.31 3inr s ILE 311 Ca 0.38 2.02 -0.25 0.00 0.00 0.00 0.00 60.65 62.81 3inr s ILE 311 Cb -0.11 -4.30 -0.02 0.00 0.01 0.00 0.00 42.46 38.04 3inr s ILE 311 CO 0.29 0.33 0.79 -2.16 0.00 0.00 0.00 174.94 174.19 3inr s PRO 312 N -0.05 4.31 0.00 2.79 0.04 -1.26 -4.50 135.00 136.33 3inr s PRO 312 Ca 0.46 0.96 0.00 0.00 0.04 0.00 0.00 61.00 62.46 3inr s PRO 312 Cb -0.23 -3.55 0.00 0.00 0.04 0.00 0.00 34.50 30.75 3inr s PRO 312 CO 0.29 -0.26 0.00 0.66 0.04 0.00 0.00 177.00 177.73 3inr n TYR 313 N 4.98 0.00 -3.59 0.56 4.02 -0.74 -5.00 117.16 117.39 3inr n TYR 313 Ca 0.03 0.00 -0.39 0.00 -0.01 0.00 0.00 57.90 57.53 3inr n TYR 313 Cb 0.49 0.00 -0.11 0.00 -0.02 0.00 0.00 39.34 39.70 3inr n TYR 313 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 176.86 176.56 3inr s TYR 314 N -0.78 3.20 0.12 -0.72 1.51 -0.97 -4.94 117.35 114.78 3inr s TYR 314 Ca 0.00 -0.33 -0.31 0.00 -1.01 0.00 0.00 57.07 55.42 3inr s TYR 314 Cb 0.00 -2.41 -0.08 0.00 -0.11 0.00 0.00 41.96 39.36 3inr s TYR 314 CO 0.00 -0.38 1.38 -1.25 -1.11 0.00 0.00 175.55 174.19 3inr s PRO 315 N 1.68 4.33 0.00 -1.71 0.04 -1.26 -0.23 135.00 137.85 3inr s PRO 315 Ca 0.06 2.07 -0.25 0.00 0.04 0.00 0.00 61.00 62.91 3inr s PRO 315 Cb -0.17 -3.24 -0.17 0.00 0.04 0.00 0.00 34.50 30.95 3inr s PRO 315 CO 0.09 -0.41 1.24 0.82 0.04 0.00 0.00 177.00 178.77 3inr h ILE 316 N 4.20 0.88 -4.43 0.56 2.04 -1.53 -3.47 117.51 115.76 3inr h ILE 316 Ca -0.42 -0.73 -0.30 0.00 1.00 0.00 0.00 64.86 64.40 3inr h ILE 316 Cb 1.21 1.30 0.10 0.00 -0.74 0.00 0.00 36.82 38.68 3inr h ILE 316 CO 0.85 0.16 -0.50 0.54 0.00 0.00 0.00 178.15 179.20 3inr n ARG 317 N -5.05 -5.61 -1.85 2.37 1.74 -1.26 -5.02 116.66 101.98 3inr n ARG 317 Ca -0.09 0.63 -0.08 0.00 -0.77 0.00 0.00 57.85 57.54 3inr n ARG 317 Cb 0.25 -5.03 0.02 0.00 -1.02 0.00 0.00 32.46 26.68 3inr n ARG 317 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 3inr n GLN 318 N -3.76 0.90 -0.10 5.56 1.13 -1.26 -4.82 117.38 115.03 3inr n GLN 318 Ca -0.01 -1.20 -0.06 0.00 -1.94 0.00 0.00 57.00 53.80 3inr n GLN 318 Cb 0.55 -0.05 0.01 0.00 0.11 0.00 0.00 30.24 30.86 3inr n GLN 318 CO 0.00 0.00 0.00 1.98 -1.44 0.00 0.00 177.06 177.60 3inr h MET 319 N 0.00 0.05 -0.67 -1.09 4.05 -1.99 -1.72 114.93 113.55 3inr h MET 319 Ca -0.11 -0.00 -0.04 0.00 -0.28 0.00 0.00 59.70 59.27 3inr h MET 319 Cb 0.47 -0.01 -0.03 0.00 -0.80 0.00 0.00 31.60 31.23 3inr h MET 319 CO 0.16 0.03 0.27 0.78 0.23 0.00 0.00 176.91 178.37 3inr h GLY 320 N 0.05 1.08 1.28 1.39 0.00 -1.99 -1.72 103.07 103.15 3inr h GLY 320 Ca 0.17 -0.59 -0.12 0.00 0.00 0.00 0.00 47.33 46.79 3inr h GLY 320 CO -0.32 0.56 -0.21 0.83 0.00 0.00 0.00 176.54 177.40 3inr h GLU 321 N 0.96 0.83 -0.18 4.80 3.07 -1.82 0.43 114.58 122.67 3inr h GLU 321 Ca 0.22 -0.33 -0.13 0.00 -0.50 0.00 0.00 59.36 58.62 3inr h GLU 321 Cb 0.21 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.07 3inr h GLU 321 CO -0.02 0.97 -0.44 0.52 -1.40 0.00 0.00 179.01 178.63 3inr h MET 322 N 0.73 0.45 -0.34 2.33 2.86 -1.17 0.34 114.93 120.12 3inr h MET 322 Ca 0.10 -0.24 -0.17 0.00 -2.06 0.00 0.00 59.70 57.33 3inr h MET 322 Cb 0.73 0.01 -0.00 0.00 0.06 0.00 0.00 31.60 32.40 3inr h MET 322 CO 0.06 0.81 -0.46 0.00 1.06 0.00 0.00 176.91 178.38 3inr h ALA 323 N 1.16 0.52 -0.24 6.32 0.00 -1.14 -1.47 119.26 124.41 3inr h ALA 323 Ca 0.03 -0.48 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 3inr h ALA 323 Cb 0.93 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 3inr h ALA 323 CO 0.08 0.68 0.11 1.25 0.00 0.00 0.00 179.25 181.37 3inr h LEU 324 N 0.73 0.32 -0.52 0.00 5.85 -0.62 -2.99 115.31 118.08 3inr h LEU 324 Ca 0.04 -0.14 0.09 0.00 0.84 0.00 0.00 57.88 58.71 3inr h LEU 324 Cb 1.07 -0.08 -0.08 0.00 0.37 0.00 0.00 40.66 41.94 3inr h LEU 324 CO 0.11 0.37 0.09 0.25 -0.34 0.00 0.00 178.44 178.92 3inr h LEU 325 N 0.25 -0.04 -0.92 2.25 5.85 -0.13 -2.17 115.31 120.39 3inr h LEU 325 Ca 0.08 0.10 0.20 0.00 0.84 0.00 0.00 57.88 59.10 3inr h LEU 325 Cb 0.14 0.15 -0.11 0.00 0.37 0.00 0.00 40.66 41.21 3inr h LEU 325 CO -0.01 0.00 0.49 -0.08 -0.34 0.00 0.00 178.44 178.50 3inr h GLU 326 N 0.22 0.56 -0.13 1.25 4.57 -1.13 0.36 114.58 120.28 3inr h GLU 326 Ca 0.26 -0.03 -0.08 0.00 -1.18 0.00 0.00 59.36 58.33 3inr h GLU 326 Cb 0.37 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 28.82 3inr h GLU 326 CO -0.36 0.37 -0.27 0.87 -1.18 0.00 0.00 179.01 178.44 3inr h LYS 327 N 0.58 0.24 0.17 1.92 1.57 -1.28 -0.85 116.57 118.93 3inr h LYS 327 Ca 0.55 -0.08 -0.30 0.00 -1.87 0.00 0.00 60.65 58.95 3inr h LYS 327 Cb 0.93 -0.02 0.02 0.00 0.08 0.00 0.00 32.23 33.25 3inr h LYS 327 CO -0.44 0.50 -1.32 1.88 -0.57 0.00 0.00 179.45 179.50 3inr h TYR 328 N 0.22 0.78 -1.01 -1.35 -1.99 -0.68 -2.97 116.97 109.97 3inr h TYR 328 Ca 0.03 -0.55 0.15 0.00 2.00 0.00 0.00 58.73 60.37 3inr h TYR 328 Cb 0.60 -0.04 -0.10 0.00 2.00 0.00 0.00 36.73 39.19 3inr h TYR 328 CO 0.01 1.42 0.62 -0.07 -0.00 0.00 0.00 178.16 180.14 3inr h LEU 329 N 0.14 0.86 -0.20 3.88 3.38 -0.16 -0.53 115.31 122.68 3inr h LEU 329 Ca -0.19 0.07 -0.05 0.00 0.09 0.00 0.00 57.88 57.80 3inr h LEU 329 Cb 2.02 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 42.67 3inr h LEU 329 CO 0.24 0.39 -0.23 0.77 0.09 0.00 0.00 178.44 179.69 3inr h SER 330 N 0.89 0.00 0.75 -0.43 4.64 -1.09 -1.20 113.55 117.10 3inr h SER 330 Ca 0.54 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.61 3inr h SER 330 Cb 0.69 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.74 3inr h SER 330 CO -0.32 0.23 -1.35 0.17 -0.87 0.00 0.00 176.83 174.69 3inr h LEU 331 N 0.00 0.00 -1.60 5.97 8.10 -1.28 -3.32 115.31 123.18 3inr h LEU 331 Ca -0.00 0.00 0.03 0.00 0.11 0.00 0.00 57.88 58.02 3inr h LEU 331 Cb 1.11 0.00 -0.03 0.00 -0.44 0.00 0.00 40.66 41.30 3inr h LEU 331 CO 0.03 0.96 0.31 0.00 -4.11 0.00 0.00 178.44 175.64 3inr h ALA 332 N 1.04 1.80 0.00 0.17 0.00 -0.59 -2.35 119.26 119.33 3inr h ALA 332 Ca -0.15 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.73 3inr h ALA 332 Cb 1.87 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.52 3inr h ALA 332 CO 0.10 0.15 0.00 1.49 0.00 0.00 0.00 179.25 180.98 3inr h GLU 333 N 0.52 0.00 -0.50 0.00 4.57 -1.34 -0.60 114.58 117.23 3inr h GLU 333 Ca 0.19 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.37 3inr h GLU 333 Cb 0.12 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.71 3inr h GLU 333 CO -0.05 0.00 0.00 0.09 -1.18 0.00 0.00 179.01 177.87 3inr n ASN 334 N -2.37 5.12 -4.90 1.04 3.02 -0.88 -4.98 115.26 111.31 3inr n ASN 334 Ca 0.00 -2.88 -0.28 0.00 -0.03 0.00 0.00 54.58 51.39 3inr n ASN 334 Cb 0.16 -0.63 -0.00 0.00 -0.61 0.00 0.00 39.78 38.69 3inr n ASN 334 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 3inr s GLU 335 N -2.65 3.59 0.13 3.52 2.56 -0.24 -5.11 118.70 120.51 3inr s GLU 335 Ca 0.51 0.34 0.06 0.00 0.00 0.00 0.00 54.97 55.88 3inr s GLU 335 Cb 0.38 -2.32 -0.04 0.00 2.00 0.00 0.00 34.13 34.15 3inr s GLU 335 CO 0.15 -0.25 -0.15 0.95 -0.56 0.00 0.00 175.26 175.41 3inr s THR 336 N -2.77 1.42 -1.59 -1.70 -4.23 -1.26 -4.83 115.64 100.68 3inr s THR 336 Ca 0.49 -1.79 0.00 0.00 -1.18 0.00 0.00 61.69 59.21 3inr s THR 336 Cb -0.10 -1.62 0.00 0.00 1.34 0.00 0.00 72.50 72.11 3inr s THR 336 CO 0.45 -0.43 0.00 0.59 -0.54 0.00 0.00 174.62 174.69 3inr n ASN 337 N 0.41 -5.21 -3.88 3.99 3.02 -1.26 -4.99 115.26 107.34 3inr n ASN 337 Ca -0.14 0.10 -0.11 0.00 -0.03 0.00 0.00 54.58 54.39 3inr n ASN 337 Cb 0.57 -4.39 -0.13 0.00 -0.61 0.00 0.00 39.78 35.22 3inr n ASN 337 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 3inr s ILE 338 N -2.86 0.02 -0.08 2.41 2.07 -1.26 -1.34 121.20 120.16 3inr s ILE 338 Ca 0.00 -0.19 0.02 0.00 -1.41 0.00 0.00 60.65 59.07 3inr s ILE 338 Cb 0.00 -0.09 0.01 0.00 0.13 0.00 0.00 42.46 42.51 3inr s ILE 338 CO 0.00 -0.11 -0.14 -0.89 -1.91 0.00 0.00 174.94 171.90 3inr s THR 339 N -0.31 1.30 -0.08 4.00 2.01 -0.11 -4.23 115.64 118.23 3inr s THR 339 Ca -0.03 -0.56 -0.18 0.00 0.31 0.00 0.00 61.69 61.22 3inr s THR 339 Cb -0.02 -1.19 -0.05 0.00 0.01 0.00 0.00 72.50 71.25 3inr s THR 339 CO -0.00 0.40 0.50 -0.36 -0.69 0.00 0.00 174.62 174.46 3inr s PHE 340 N 0.77 3.57 0.12 4.92 0.40 -0.05 -0.74 117.98 126.97 3inr s PHE 340 Ca -0.12 0.97 -0.01 0.00 -0.60 0.00 0.00 56.93 57.17 3inr s PHE 340 Cb -0.16 -2.54 -0.04 0.00 0.51 0.00 0.00 43.02 40.80 3inr s PHE 340 CO 0.02 0.26 0.03 0.14 0.70 0.00 0.00 175.22 176.37 3inr s VAL 341 N 0.28 0.21 0.00 -0.44 -7.23 -0.37 -4.69 120.40 108.16 3inr s VAL 341 Ca 0.27 -1.90 0.00 0.00 -1.81 0.00 0.00 61.98 58.54 3inr s VAL 341 Cb -0.16 -1.94 0.00 0.00 0.56 0.00 0.00 36.38 34.84 3inr s VAL 341 CO 0.12 -0.58 0.00 0.61 -0.31 0.00 0.00 175.10 174.94 3inr n GLY 342 N -0.07 0.12 0.36 2.32 0.00 -1.26 -2.57 105.19 104.09 3inr n GLY 342 Ca -0.07 -1.81 0.10 0.00 0.00 0.00 0.00 46.02 44.24 3inr n GLY 342 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3inr h ARG 343 N 0.00 0.86 0.08 1.61 0.11 -1.89 -2.49 114.38 112.66 3inr h ARG 343 Ca 0.00 -0.05 -0.31 0.00 0.10 0.00 0.00 59.98 59.71 3inr h ARG 343 Cb 0.00 -0.19 -0.02 0.00 1.11 0.00 0.00 29.97 30.86 3inr h ARG 343 CO 0.00 0.57 -1.69 -0.07 0.10 0.00 0.00 179.97 178.87 3inr h LEU 344 N 0.88 0.27 -0.82 0.08 3.38 -1.77 -1.44 115.31 115.88 3inr h LEU 344 Ca 0.54 -0.47 0.00 0.00 0.09 0.00 0.00 57.88 58.03 3inr h LEU 344 Cb 0.69 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.36 3inr h LEU 344 CO -0.32 1.41 0.00 1.23 0.09 0.00 0.00 178.44 180.85 3inr h GLY 345 N 2.12 0.00 0.00 0.83 0.00 -1.34 -2.46 103.07 102.22 3inr h GLY 345 Ca -0.30 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.03 3inr h GLY 345 CO 0.12 0.00 0.00 -1.30 0.00 0.00 0.00 176.54 175.36 3inr n THR 346 N -2.98 0.07 -3.45 4.70 -2.24 -0.95 -4.40 114.28 105.02 3inr n THR 346 Ca 0.02 -0.33 -0.20 0.00 -2.27 0.00 0.00 64.05 61.27 3inr n THR 346 Cb 0.38 1.32 0.08 0.00 -2.10 0.00 0.00 70.33 70.01 3inr n THR 346 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3inr n TYR 347 N -0.03 -2.42 -4.13 4.78 9.36 -0.60 -5.02 117.16 119.10 3inr n TYR 347 Ca 0.00 0.93 -0.15 0.00 3.32 0.00 0.00 57.90 61.99 3inr n TYR 347 Cb 0.13 -4.87 -0.12 0.00 -0.63 0.00 0.00 39.34 33.85 3inr n TYR 347 CO 0.00 0.00 0.00 1.03 0.22 0.00 0.00 176.86 178.11 3inr s ARG 348 N -5.79 0.65 -0.21 2.98 0.52 -0.85 -4.99 118.95 111.26 3inr s ARG 348 Ca 0.29 -0.79 -0.27 0.00 -0.52 0.00 0.00 55.73 54.44 3inr s ARG 348 Cb -0.13 -0.53 -0.00 0.00 0.52 0.00 0.00 34.95 34.81 3inr s ARG 348 CO 0.69 0.11 0.94 -0.47 0.02 0.00 0.00 175.30 176.59 3inr s TYR 349 N -1.23 3.36 -0.11 -0.53 5.04 -1.26 -4.16 117.35 118.46 3inr s TYR 349 Ca -0.06 1.34 0.02 0.00 -2.44 0.00 0.00 57.07 55.93 3inr s TYR 349 Cb -0.09 -3.15 0.02 0.00 0.35 0.00 0.00 41.96 39.08 3inr s TYR 349 CO 0.01 -0.40 -0.15 -0.51 -1.34 0.00 0.00 175.55 173.17 3inr s LEU 350 N 2.82 1.70 0.97 6.97 1.43 -1.26 -5.04 118.68 126.27 3inr s LEU 350 Ca 0.41 -0.42 -0.11 0.00 -1.03 0.00 0.00 54.13 52.97 3inr s LEU 350 Cb -0.16 -1.08 0.14 0.00 0.03 0.00 0.00 46.19 45.13 3inr s LEU 350 CO 0.08 0.01 0.92 0.47 0.23 0.00 0.00 176.35 178.06 3inr n ASP 351 N 4.26 -0.61 -0.29 2.29 8.00 -1.26 -4.77 116.55 124.16 3inr n ASP 351 Ca -0.19 0.29 -0.06 0.00 0.71 0.00 0.00 54.79 55.55 3inr n ASP 351 Cb 0.51 -1.37 0.07 0.00 -0.02 0.00 0.00 41.12 40.32 3inr n ASP 351 CO 0.00 0.00 0.00 0.24 -0.39 0.00 0.00 177.20 177.05 3inr h MET 352 N -1.96 1.20 -0.08 -1.24 2.86 -1.92 -0.96 114.93 112.82 3inr h MET 352 Ca -0.46 -0.21 -0.01 0.00 -2.06 0.00 0.00 59.70 56.96 3inr h MET 352 Cb 1.29 -0.20 -0.00 0.00 0.06 0.00 0.00 31.60 32.75 3inr h MET 352 CO 0.41 0.96 0.03 0.38 1.06 0.00 0.00 176.91 179.75 3inr h ASP 353 N 1.17 0.12 -0.94 1.22 2.03 -1.92 -0.38 116.42 117.73 3inr h ASP 353 Ca 0.27 -0.20 0.04 0.00 -0.73 0.00 0.00 57.03 56.41 3inr h ASP 353 Cb 0.21 -0.03 -0.06 0.00 -0.83 0.00 0.00 39.33 38.62 3inr h ASP 353 CO -0.02 0.29 0.62 0.58 -1.03 0.00 0.00 179.24 179.67 3inr h VAL 354 N -0.05 1.14 -0.42 4.15 2.07 -1.89 0.21 116.25 121.46 3inr h VAL 354 Ca 0.03 -0.40 -0.04 0.00 0.82 0.00 0.00 66.70 67.11 3inr h VAL 354 Cb 0.21 -0.12 -0.02 0.00 -1.52 0.00 0.00 31.29 29.84 3inr h VAL 354 CO -0.00 0.21 0.10 0.74 0.02 0.00 0.00 177.57 178.64 3inr h THR 355 N 1.16 1.23 -0.28 2.57 2.02 -0.77 1.00 112.91 119.84 3inr h THR 355 Ca 0.38 -0.80 -0.06 0.00 0.77 0.00 0.00 66.41 66.71 3inr h THR 355 Cb 0.06 0.95 -0.01 0.00 -1.74 0.00 0.00 68.15 67.41 3inr h THR 355 CO -0.13 0.28 -0.05 0.40 0.37 0.00 0.00 175.52 176.40 3inr h ILE 356 N 0.54 1.27 -0.11 3.11 2.04 -0.77 -0.66 117.51 122.94 3inr h ILE 356 Ca 0.13 -1.04 0.03 0.00 1.00 0.00 0.00 64.86 64.98 3inr h ILE 356 Cb 0.32 1.38 -0.03 0.00 -0.74 0.00 0.00 36.82 37.74 3inr h ILE 356 CO 0.00 0.33 -0.09 0.00 0.00 0.00 0.00 178.15 178.40 3inr h ALA 357 N 0.80 0.00 -0.51 1.87 0.00 -0.76 -0.88 119.26 119.77 3inr h ALA 357 Ca 0.07 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 3inr h ALA 357 Cb 0.51 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 3inr h ALA 357 CO 0.02 -0.54 0.17 0.93 0.00 0.00 0.00 179.25 179.83 3inr h GLU 358 N -0.10 0.75 -0.44 0.00 5.08 -0.67 -2.19 114.58 117.00 3inr h GLU 358 Ca 0.07 -0.12 -0.08 0.00 -1.00 0.00 0.00 59.36 58.23 3inr h GLU 358 Cb 0.20 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 3inr h GLU 358 CO -0.17 0.64 -0.04 0.00 -1.00 0.00 0.00 179.01 178.44 3inr h ALA 359 N 1.46 0.60 -0.68 3.43 0.00 -0.69 0.65 119.26 124.03 3inr h ALA 359 Ca 0.17 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 3inr h ALA 359 Cb 0.19 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 3inr h ALA 359 CO -0.01 0.44 0.42 -0.07 0.00 0.00 0.00 179.25 180.02 3inr h LEU 360 N 0.65 0.82 -0.60 0.00 3.38 -1.05 -1.73 115.31 116.78 3inr h LEU 360 Ca 0.12 -0.06 -0.08 0.00 0.09 0.00 0.00 57.88 57.95 3inr h LEU 360 Cb 0.55 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 3inr h LEU 360 CO 0.03 0.64 0.05 0.50 0.09 0.00 0.00 178.44 179.75 3inr h LYS 361 N 0.93 1.02 -0.05 1.13 1.63 -1.16 -2.32 116.57 117.76 3inr h LYS 361 Ca 0.25 -0.30 0.02 0.00 -0.85 0.00 0.00 60.65 59.76 3inr h LYS 361 Cb -0.03 -0.11 -0.02 0.00 -0.60 0.00 0.00 32.23 31.47 3inr h LYS 361 CO -0.05 0.98 -0.06 1.15 -3.45 0.00 0.00 179.45 178.03 3inr h THR 362 N 0.92 0.83 -0.97 1.00 2.02 -0.56 0.47 112.91 116.63 3inr h THR 362 Ca 0.17 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.43 3inr h THR 362 Cb 0.49 0.83 -0.07 0.00 -1.74 0.00 0.00 68.15 67.67 3inr h THR 362 CO 0.02 0.00 0.62 0.00 0.37 0.00 0.00 175.52 176.53 3inr h ALA 363 N 0.96 1.35 -0.44 6.16 0.00 -1.30 -2.19 119.26 123.80 3inr h ALA 363 Ca 0.04 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 3inr h ALA 363 Cb 0.14 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 3inr h ALA 363 CO -0.10 0.38 0.21 1.49 0.00 0.00 0.00 179.25 181.23 3inr h GLU 364 N 1.10 0.64 -0.71 0.00 4.81 -0.85 0.86 114.58 120.43 3inr h GLU 364 Ca 0.43 -0.09 -0.07 0.00 -0.13 0.00 0.00 59.36 59.50 3inr h GLU 364 Cb 0.20 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.44 3inr h GLU 364 CO -0.18 0.54 0.19 0.28 -0.73 0.00 0.00 179.01 179.11 3inr h VAL 365 N 0.57 1.26 -0.13 0.32 2.07 -0.70 -1.14 116.25 118.50 3inr h VAL 365 Ca 0.15 -0.95 -0.02 0.00 0.82 0.00 0.00 66.70 66.70 3inr h VAL 365 Cb 0.12 0.51 -0.00 0.00 -1.52 0.00 0.00 31.29 30.39 3inr h VAL 365 CO -0.02 0.37 0.01 0.22 0.02 0.00 0.00 177.57 178.17 3inr h TYR 366 N 1.07 0.25 -0.85 1.57 3.20 -1.12 -0.55 116.97 120.55 3inr h TYR 366 Ca 0.23 -0.04 -0.02 0.00 3.14 0.00 0.00 58.73 62.03 3inr h TYR 366 Cb 0.35 -0.07 -0.04 0.00 1.54 0.00 0.00 36.73 38.52 3inr h TYR 366 CO 0.03 0.45 0.44 -0.07 -1.64 0.00 0.00 178.16 177.37 3inr h LEU 367 N -0.02 1.07 -1.42 2.82 3.38 -0.68 -1.07 115.31 119.39 3inr h LEU 367 Ca 0.04 -0.11 -0.04 0.00 0.09 0.00 0.00 57.88 57.86 3inr h LEU 367 Cb 0.35 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 3inr h LEU 367 CO 0.01 0.88 -0.19 0.78 0.09 0.00 0.00 178.44 180.00 3inr h ASN 368 N 1.19 0.00 0.55 -0.43 4.21 -1.05 -2.87 115.58 117.19 3inr h ASN 368 Ca 0.30 0.00 -0.20 0.00 1.21 0.00 0.00 56.30 57.61 3inr h ASN 368 Cb 0.06 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.25 3inr h ASN 368 CO -0.04 0.19 -0.87 0.77 -1.29 0.00 0.00 177.43 176.19 3inr h SER 369 N 0.00 0.28 -0.28 5.81 4.64 0.17 -2.47 113.55 121.71 3inr h SER 369 Ca -0.00 -0.22 -0.12 0.00 -0.47 0.00 0.00 61.79 60.97 3inr h SER 369 Cb 0.59 -0.09 -0.00 0.00 -0.31 0.00 0.00 62.40 62.59 3inr h SER 369 CO 0.02 1.02 -0.31 -0.07 -0.87 0.00 0.00 176.83 176.62 3inr h LEU 370 N 0.12 0.75 -0.37 5.97 3.38 -1.17 0.27 115.31 124.26 3inr h LEU 370 Ca -0.04 -0.49 -0.19 0.00 0.09 0.00 0.00 57.88 57.25 3inr h LEU 370 Cb 1.49 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 42.02 3inr h LEU 370 CO 0.13 1.09 -0.72 0.71 0.09 0.00 0.00 178.44 179.74 3inr h THR 371 N 0.44 1.35 -0.03 0.22 1.35 -1.59 -2.83 112.91 111.82 3inr h THR 371 Ca 0.04 -2.07 0.00 0.00 -0.55 0.00 0.00 66.41 63.83 3inr h THR 371 Cb 0.89 2.05 0.00 0.00 -1.73 0.00 0.00 68.15 69.36 3inr h THR 371 CO 0.08 0.63 0.00 0.47 -0.25 0.00 0.00 175.52 176.45 3inr n ASP 372 N -3.87 0.30 -4.11 5.36 10.43 -0.93 -4.94 116.55 118.79 3inr n ASP 372 Ca -0.05 -1.50 -0.32 0.00 2.57 0.00 0.00 54.79 55.50 3inr n ASP 372 Cb 0.70 -0.02 -0.04 0.00 1.84 0.00 0.00 41.12 43.60 3inr n ASP 372 CO 0.00 0.00 0.00 0.59 -1.07 0.00 0.00 177.20 176.72 3inr n ASN 373 N -0.58 -0.75 -4.50 -2.24 3.02 -0.95 -4.99 115.26 104.27 3inr n ASN 373 Ca 0.14 -1.17 -0.26 0.00 -0.03 0.00 0.00 54.58 53.26 3inr n ASN 373 Cb 0.11 -2.23 -0.10 0.00 -0.61 0.00 0.00 39.78 36.94 3inr n ASN 373 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 3inr s GLN 374 N -7.01 1.80 0.18 3.52 -1.52 0.90 -5.04 119.66 112.49 3inr s GLN 374 Ca 0.12 -1.49 -0.30 0.00 -1.95 0.00 0.00 55.36 51.74 3inr s GLN 374 Cb -0.06 -1.96 -0.08 0.00 -0.22 0.00 0.00 33.01 30.70 3inr s GLN 374 CO 0.95 0.39 1.13 -1.25 -0.25 0.00 0.00 175.29 176.25 3inr s PRO 375 N -3.00 4.56 -0.09 2.91 0.04 -1.26 -4.51 135.00 133.65 3inr s PRO 375 Ca 0.25 1.76 -0.30 0.00 0.04 0.00 0.00 61.00 62.75 3inr s PRO 375 Cb -0.07 -3.27 -0.03 0.00 0.04 0.00 0.00 34.50 31.17 3inr s PRO 375 CO 0.14 0.03 1.24 1.41 0.04 0.00 0.00 177.00 179.86 3inr s MET 376 N -0.33 4.30 0.89 4.56 1.75 -1.26 -5.00 119.30 124.21 3inr s MET 376 Ca 0.50 1.69 -0.12 0.00 -1.25 0.00 0.00 55.69 56.52 3inr s MET 376 Cb -0.30 -3.64 0.12 0.00 2.84 0.00 0.00 34.83 33.85 3inr s MET 376 CO 0.35 -0.55 1.09 -1.25 -0.65 0.00 0.00 175.02 174.01 3inr s PRO 377 N 2.72 1.35 0.05 4.11 0.04 -1.26 -4.82 135.00 137.18 3inr s PRO 377 Ca 0.56 0.79 -0.05 0.00 0.04 0.00 0.00 61.00 62.34 3inr s PRO 377 Cb -0.24 -1.82 -0.29 0.00 0.04 0.00 0.00 34.50 32.19 3inr s PRO 377 CO 0.20 -2.17 1.03 0.28 0.04 0.00 0.00 177.00 176.37 3inr h VAL 378 N -1.50 1.36 -4.15 -0.36 2.07 -1.93 -3.42 116.25 108.32 3inr h VAL 378 Ca -0.49 -2.94 -0.60 0.00 0.82 0.00 0.00 66.70 63.49 3inr h VAL 378 Cb 1.28 2.89 -0.25 0.00 -1.52 0.00 0.00 31.29 33.69 3inr h VAL 378 CO 0.55 0.86 -0.85 -0.36 0.02 0.00 0.00 177.57 177.80 3inr s PHE 379 N -2.64 1.91 -1.19 1.57 0.40 -1.26 -0.87 117.98 115.90 3inr s PHE 379 Ca -0.06 -0.39 0.12 0.00 -0.60 0.00 0.00 56.93 56.00 3inr s PHE 379 Cb 0.07 -1.12 0.23 0.00 0.51 0.00 0.00 43.02 42.71 3inr s PHE 379 CO 0.88 0.12 1.11 0.25 0.70 0.00 0.00 175.22 178.28 3inr n THR 380 N 1.69 0.60 -4.31 0.64 -2.24 -1.26 -4.96 114.28 104.44 3inr n THR 380 Ca -0.17 -0.80 -0.16 0.00 -2.27 0.00 0.00 64.05 60.64 3inr n THR 380 Cb 0.53 0.80 -0.10 0.00 -2.10 0.00 0.00 70.33 69.46 3inr n THR 380 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3inr s VAL 381 N -1.00 0.92 0.22 2.28 0.11 -1.26 -4.97 120.40 116.70 3inr s VAL 381 Ca 0.20 -2.02 -0.13 0.00 -2.93 0.00 0.00 61.98 57.10 3inr s VAL 381 Cb 0.12 -2.33 -0.08 0.00 -1.53 0.00 0.00 36.38 32.57 3inr s VAL 381 CO 0.16 -0.33 0.60 -0.94 -3.33 0.00 0.00 175.10 171.27 3inr s SER 382 N -3.28 6.78 0.00 3.54 1.04 -1.26 -4.97 113.70 115.55 3inr s SER 382 Ca 0.28 1.10 0.00 0.00 0.48 0.00 0.00 55.95 57.82 3inr s SER 382 Cb 0.06 -2.30 0.00 0.00 0.10 0.00 0.00 66.02 63.88 3inr s SER 382 CO 0.08 -0.02 0.00 0.55 0.98 0.00 0.00 173.24 174.83 3inr n VAL 383 N 0.26 0.00 0.83 5.02 3.14 -1.26 -5.20 118.33 121.12 3inr n VAL 383 Ca -0.01 0.00 0.10 0.00 -2.96 0.00 0.00 64.34 61.47 3inr n VAL 383 Cb 0.52 0.84 0.08 0.00 -1.06 0.00 0.00 33.84 34.22 3inr n VAL 383 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98