#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h5r s ASP 2 N 0.00 5.50 0.28 6.12 1.01 -1.26 -4.06 116.67 124.26 3h5r s ASP 2 Ca 0.00 2.07 0.10 0.00 0.71 0.00 0.00 52.55 55.43 3h5r s ASP 2 Cb 0.00 -2.56 -0.05 0.00 1.01 0.00 0.00 42.92 41.31 3h5r s ASP 2 CO 0.00 -1.36 -0.15 -0.31 0.21 0.00 0.00 175.17 173.56 3h5r s TYR 3 N -2.06 2.16 -0.07 4.23 1.51 0.13 -1.90 117.35 121.35 3h5r s TYR 3 Ca 0.69 -0.46 -0.09 0.00 -1.01 0.00 0.00 57.07 56.21 3h5r s TYR 3 Cb -0.22 -1.04 0.02 0.00 -0.11 0.00 0.00 41.96 40.61 3h5r s TYR 3 CO 0.33 0.57 0.24 -1.50 -1.11 0.00 0.00 175.55 174.08 3h5r s ILE 4 N -2.68 0.01 -0.01 2.71 2.07 0.78 -0.69 121.20 123.39 3h5r s ILE 4 Ca 0.29 -0.12 -0.30 0.00 -1.41 0.00 0.00 60.65 59.11 3h5r s ILE 4 Cb -0.02 -0.38 -0.05 0.00 0.13 0.00 0.00 42.46 42.14 3h5r s ILE 4 CO 0.13 -0.07 1.31 -0.22 -1.91 0.00 0.00 174.94 174.19 3h5r s LEU 5 N -0.17 4.31 0.34 8.50 2.96 0.17 -0.43 118.68 134.36 3h5r s LEU 5 Ca -0.03 2.01 -0.29 0.00 -0.22 0.00 0.00 54.13 55.61 3h5r s LEU 5 Cb -0.03 -3.56 -0.11 0.00 0.50 0.00 0.00 46.19 42.99 3h5r s LEU 5 CO 0.01 -0.64 1.41 -0.83 -1.32 0.00 0.00 176.35 174.98 3h5r s GLY 6 N 1.62 2.88 0.32 7.98 0.00 0.42 -4.90 107.32 115.64 3h5r s GLY 6 Ca 0.61 1.42 0.26 0.00 0.00 0.00 0.00 44.72 47.01 3h5r s GLY 6 CO 0.25 2.13 1.78 3.21 0.00 0.00 0.00 173.10 180.47 3h5r h ARG 7 N 3.42 0.00 -0.04 2.90 2.47 -1.94 -2.68 114.38 118.50 3h5r h ARG 7 Ca -0.49 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.23 3h5r h ARG 7 Cb 1.23 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.55 3h5r h ARG 7 CO 0.66 0.00 0.00 2.48 0.56 0.00 0.00 179.97 183.67 3h5r n TYR 8 N -2.45 0.06 -3.55 3.04 0.18 -1.26 -4.84 117.16 108.33 3h5r n TYR 8 Ca 0.02 -0.03 -0.37 0.00 1.88 0.00 0.00 57.90 59.40 3h5r n TYR 8 Cb 0.28 0.00 -0.06 0.00 -0.38 0.00 0.00 39.34 39.18 3h5r n TYR 8 CO 0.00 0.00 0.00 0.14 -2.08 0.00 0.00 176.86 174.92 3h5r s VAL 9 N -1.94 5.20 0.30 -3.48 -7.23 -1.01 -4.43 120.40 107.80 3h5r s VAL 9 Ca 0.25 0.67 0.03 0.00 -1.81 0.00 0.00 61.98 61.12 3h5r s VAL 9 Cb 0.12 -3.65 -0.06 0.00 0.56 0.00 0.00 36.38 33.35 3h5r s VAL 9 CO 0.19 0.50 0.06 -1.59 -0.31 0.00 0.00 175.10 173.95 3h5r s LYS 10 N -0.45 1.56 -0.07 4.82 -2.85 -1.26 -4.91 119.74 116.59 3h5r s LYS 10 Ca 0.20 -1.85 -0.04 0.00 -1.00 0.00 0.00 55.97 53.28 3h5r s LYS 10 Cb -0.15 -0.72 0.03 0.00 -2.06 0.00 0.00 37.83 34.93 3h5r s LYS 10 CO 0.09 -0.19 0.16 0.42 0.10 0.00 0.00 175.35 175.92 3h5r s ILE 11 N -3.40 -0.03 -0.00 3.79 1.01 -1.26 -0.07 121.20 121.24 3h5r s ILE 11 Ca 0.36 0.11 0.02 0.00 0.00 0.00 0.00 60.65 61.14 3h5r s ILE 11 Cb 0.08 -0.25 -0.00 0.00 0.01 0.00 0.00 42.46 42.30 3h5r s ILE 11 CO 0.14 0.05 -0.06 0.00 0.00 0.00 0.00 174.94 175.07 3h5r s ALA 12 N 0.79 0.47 -0.08 9.38 0.00 -1.02 -4.98 121.76 126.31 3h5r s ALA 12 Ca -0.06 -0.25 -0.29 0.00 0.00 0.00 0.00 51.96 51.35 3h5r s ALA 12 Cb -0.08 -0.12 -0.05 0.00 0.00 0.00 0.00 23.12 22.87 3h5r s ALA 12 CO -0.04 0.11 1.73 0.50 0.00 0.00 0.00 175.76 178.06 3h5r s ARG 13 N -0.16 4.04 -0.01 0.00 6.06 -1.26 -0.51 118.95 127.10 3h5r s ARG 13 Ca 0.02 2.14 -0.03 0.00 -2.50 0.00 0.00 55.73 55.36 3h5r s ARG 13 Cb -0.02 -4.05 -0.00 0.00 0.06 0.00 0.00 34.95 30.94 3h5r s ARG 13 CO -0.00 -1.03 0.06 -0.47 -2.50 0.00 0.00 175.30 171.36 3h5r s TYR 14 N 4.59 0.05 0.00 5.12 5.04 -0.66 -4.88 117.35 126.60 3h5r s TYR 14 Ca 0.77 -0.09 0.00 0.00 -2.44 0.00 0.00 57.07 55.31 3h5r s TYR 14 Cb -0.33 -0.05 0.00 0.00 0.35 0.00 0.00 41.96 41.93 3h5r s TYR 14 CO 0.32 -0.14 0.00 0.41 -1.34 0.00 0.00 175.55 174.79 3h5r n GLY 15 N 2.24 2.59 0.09 8.97 0.00 -1.26 -1.53 105.19 116.30 3h5r n GLY 15 Ca -0.18 0.32 -0.11 0.00 0.00 0.00 0.00 46.02 46.05 3h5r n GLY 15 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3h5r h SER 16 N 0.00 0.07 0.00 1.61 4.64 -1.90 -3.47 113.55 114.50 3h5r h SER 16 Ca 0.00 -0.16 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 3h5r h SER 16 Cb 0.00 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.07 3h5r h SER 16 CO 0.00 1.15 0.00 0.61 -0.87 0.00 0.00 176.83 177.72 3h5r n GLY 17 N 1.62 1.28 3.57 -0.77 0.00 -0.58 -4.11 105.19 106.21 3h5r n GLY 17 Ca -0.19 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.78 3h5r n GLY 17 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h5r n GLY 18 N 4.99 0.77 3.76 -0.02 0.00 -0.78 -1.66 105.19 112.26 3h5r n GLY 18 Ca 0.00 -1.17 -0.33 0.00 0.00 0.00 0.00 46.02 44.52 3h5r n GLY 18 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h5r s LEU 19 N 0.00 3.83 -0.09 0.99 1.43 0.33 -1.29 118.68 123.89 3h5r s LEU 19 Ca 0.19 0.14 0.03 0.00 -1.03 0.00 0.00 54.13 53.46 3h5r s LEU 19 Cb -0.03 -2.18 0.01 0.00 0.03 0.00 0.00 46.19 44.02 3h5r s LEU 19 CO 0.07 0.29 -0.17 -0.69 0.23 0.00 0.00 176.35 176.08 3h5r s VAL 20 N -1.14 1.54 0.00 -1.59 1.01 0.44 -2.44 120.40 118.21 3h5r s VAL 20 Ca 0.21 -0.70 0.00 0.00 0.00 0.00 0.00 61.98 61.49 3h5r s VAL 20 Cb -0.12 -1.37 0.00 0.00 0.00 0.00 0.00 36.38 34.89 3h5r s VAL 20 CO 0.12 0.45 0.00 0.61 0.00 0.00 0.00 175.10 176.27 3h5r n GLY 21 N 3.80 -1.31 3.26 4.51 0.00 0.90 -0.91 105.19 115.44 3h5r n GLY 21 Ca -0.21 -1.55 -0.10 0.00 0.00 0.00 0.00 46.02 44.16 3h5r n GLY 21 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3h5r s GLY 22 N -2.34 -0.09 0.00 -0.02 0.00 -1.26 -4.55 107.32 99.07 3h5r s GLY 22 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 44.72 44.45 3h5r s GLY 22 CO 0.00 -0.49 0.00 0.61 0.00 0.00 0.00 173.10 173.22 3h5r n GLY 23 N 0.01 0.04 0.25 0.20 0.00 -1.26 -4.07 105.19 100.36 3h5r n GLY 23 Ca -0.16 -0.98 0.12 0.00 0.00 0.00 0.00 46.02 44.99 3h5r n GLY 23 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3h5r h GLY 24 N 0.00 0.00 -0.76 -0.02 0.00 -2.02 -2.44 103.07 97.83 3h5r h GLY 24 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3h5r h GLY 24 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.82 3h5r n LYS 25 N -3.57 1.79 -1.67 4.80 4.76 -1.26 -4.94 118.16 118.07 3h5r n LYS 25 Ca -0.01 -1.15 -0.48 0.00 -2.87 0.00 0.00 58.31 53.79 3h5r n LYS 25 Cb 0.29 -1.47 -0.05 0.00 -1.84 0.00 0.00 35.03 31.96 3h5r n LYS 25 CO 0.00 0.00 0.00 -1.91 -1.37 0.00 0.00 177.40 174.12 3h5r n GLU 26 N 0.40 1.96 -4.36 1.97 2.13 -0.92 -4.77 120.64 117.05 3h5r n GLU 26 Ca 0.18 0.71 -0.34 0.00 0.66 0.00 0.00 57.16 58.37 3h5r n GLU 26 Cb 0.40 -2.48 -0.15 0.00 0.27 0.00 0.00 31.44 29.48 3h5r n GLU 26 CO 0.00 0.00 0.00 -0.65 -0.41 0.00 0.00 177.13 176.07 3h5r s GLN 27 N 2.13 3.27 -0.40 5.31 -1.52 -0.09 -4.96 119.66 123.40 3h5r s GLN 27 Ca 0.86 -0.71 -0.19 0.00 -1.95 0.00 0.00 55.36 53.36 3h5r s GLN 27 Cb -0.75 -2.72 0.01 0.00 -0.22 0.00 0.00 33.01 29.33 3h5r s GLN 27 CO 0.46 -0.03 0.55 -0.47 -0.25 0.00 0.00 175.29 175.56 3h5r s TYR 28 N 0.95 3.13 -0.33 0.91 5.04 -1.26 -0.42 117.35 125.37 3h5r s TYR 28 Ca -0.02 -0.02 -0.12 0.00 -2.44 0.00 0.00 57.07 54.47 3h5r s TYR 28 Cb -0.15 -3.10 -0.02 0.00 0.35 0.00 0.00 41.96 39.05 3h5r s TYR 28 CO -0.01 -0.71 0.21 0.54 -1.34 0.00 0.00 175.55 174.24 3h5r s VAL 29 N 2.52 5.08 0.25 3.14 0.11 -0.41 -4.98 120.40 126.12 3h5r s VAL 29 Ca 0.19 -0.24 0.08 0.00 -2.93 0.00 0.00 61.98 59.08 3h5r s VAL 29 Cb -0.15 -3.59 -0.05 0.00 -1.53 0.00 0.00 36.38 31.07 3h5r s VAL 29 CO 0.16 0.04 1.57 1.05 -3.33 0.00 0.00 175.10 174.58 3h5r h GLU 30 N 8.44 0.09 -6.51 1.54 9.09 -1.95 -2.07 114.58 123.22 3h5r h GLU 30 Ca -0.32 -0.07 -0.57 0.00 0.05 0.00 0.00 59.36 58.45 3h5r h GLU 30 Cb 1.16 0.01 -0.06 0.00 -1.65 0.00 0.00 28.75 28.21 3h5r h GLU 30 CO 0.62 0.71 0.92 1.21 0.05 0.00 0.00 179.01 182.52 3h5r s ASN 31 N -6.87 6.71 0.12 3.06 2.47 -1.26 -2.73 114.94 116.45 3h5r s ASN 31 Ca -0.02 0.81 -0.24 0.00 0.42 0.00 0.00 52.86 53.82 3h5r s ASN 31 Cb 0.12 -2.55 -0.06 0.00 -1.45 0.00 0.00 41.25 37.32 3h5r s ASN 31 CO 0.78 -1.12 1.66 0.25 -3.72 0.00 0.00 177.10 174.95 3h5r h LEU 32 N 10.88 -0.55 -1.62 3.21 6.46 -1.85 0.72 115.31 132.56 3h5r h LEU 32 Ca -0.23 0.08 0.03 0.00 -0.12 0.00 0.00 57.88 57.63 3h5r h LEU 32 Cb 1.07 0.23 -0.02 0.00 -0.73 0.00 0.00 40.66 41.20 3h5r h LEU 32 CO 1.08 -0.25 0.29 -0.37 -0.62 0.00 0.00 178.44 178.57 3h5r h VAL 33 N -0.31 1.05 0.21 1.05 -1.51 -1.92 0.27 116.25 115.10 3h5r h VAL 33 Ca 0.06 -0.17 -0.01 0.00 -1.23 0.00 0.00 66.70 65.34 3h5r h VAL 33 Cb 0.38 0.51 0.00 0.00 -2.13 0.00 0.00 31.29 30.05 3h5r h VAL 33 CO -0.17 0.09 -0.10 0.25 -1.23 0.00 0.00 177.57 176.40 3h5r h LEU 34 N 0.50 -0.24 -0.49 4.19 5.85 -1.75 -1.67 115.31 121.70 3h5r h LEU 34 Ca 0.17 -0.28 0.10 0.00 0.84 0.00 0.00 57.88 58.71 3h5r h LEU 34 Cb 0.08 0.06 -0.10 0.00 0.37 0.00 0.00 40.66 41.08 3h5r h LEU 34 CO -0.04 0.23 -0.14 -0.25 -0.34 0.00 0.00 178.44 177.89 3h5r h TRP 35 N -0.80 -0.32 -0.56 1.25 7.01 -0.56 0.40 115.95 122.37 3h5r h TRP 35 Ca -0.03 0.05 0.09 0.00 2.11 0.00 0.00 58.89 61.11 3h5r h TRP 35 Cb 0.51 0.22 -0.07 0.00 -2.10 0.00 0.00 29.16 27.72 3h5r h TRP 35 CO 0.06 -0.23 0.17 0.93 -2.79 0.00 0.00 178.44 176.58 3h5r h GLU 36 N -0.03 0.32 -0.38 2.65 5.08 -0.50 -1.53 114.58 120.20 3h5r h GLU 36 Ca 0.24 -0.02 -0.07 0.00 -1.00 0.00 0.00 59.36 58.51 3h5r h GLU 36 Cb 0.38 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.54 3h5r h GLU 36 CO -0.52 0.21 -0.04 -0.91 -1.00 0.00 0.00 179.01 176.75 3h5r h ASN 37 N 0.33 0.60 -0.76 1.42 2.35 -0.50 -2.23 115.58 116.78 3h5r h ASN 37 Ca 0.28 -0.14 -0.04 0.00 -0.55 0.00 0.00 56.30 55.85 3h5r h ASN 37 Cb 0.36 -0.16 -0.03 0.00 0.05 0.00 0.00 38.32 38.54 3h5r h ASN 37 CO -0.31 0.70 0.33 0.40 -1.65 0.00 0.00 177.43 176.90 3h5r h ILE 38 N 0.59 1.25 0.01 2.81 2.04 0.02 -1.23 117.51 123.01 3h5r h ILE 38 Ca 0.12 -0.76 -0.23 0.00 1.00 0.00 0.00 64.86 64.98 3h5r h ILE 38 Cb 0.44 0.31 0.00 0.00 -0.74 0.00 0.00 36.82 36.83 3h5r h ILE 38 CO 0.02 0.32 -0.97 0.16 0.00 0.00 0.00 178.15 177.68 3h5r h ILE 39 N 1.11 1.42 -0.97 -0.67 -0.00 -1.12 0.12 117.51 117.41 3h5r h ILE 39 Ca 0.26 -2.52 -0.00 0.00 -0.00 0.00 0.00 64.86 62.60 3h5r h ILE 39 Cb 0.18 2.47 -0.05 0.00 -0.00 0.00 0.00 36.82 39.42 3h5r h ILE 39 CO -0.03 0.75 0.60 0.11 -0.00 0.00 0.00 178.15 179.58 3h5r h LYS 40 N 0.21 1.30 -0.00 0.16 1.57 -1.16 0.77 116.57 119.42 3h5r h LYS 40 Ca -0.08 -0.11 -0.00 0.00 -1.87 0.00 0.00 60.65 58.59 3h5r h LYS 40 Cb 1.61 -0.28 0.00 0.00 0.08 0.00 0.00 32.23 33.64 3h5r h LYS 40 CO 0.17 0.90 -0.01 1.15 -0.57 0.00 0.00 179.45 181.08 3h5r h THR 41 N 1.33 1.46 -0.57 -0.16 2.02 -1.13 -3.09 112.91 112.77 3h5r h THR 41 Ca 0.35 -1.35 0.12 0.00 0.77 0.00 0.00 66.41 66.29 3h5r h THR 41 Cb -0.08 2.37 -0.10 0.00 -1.74 0.00 0.00 68.15 68.59 3h5r h THR 41 CO -0.07 0.35 -0.06 0.00 0.37 0.00 0.00 175.52 176.12 3h5r h ALA 42 N 0.43 0.49 -0.96 6.16 0.00 -0.52 -1.23 119.26 123.63 3h5r h ALA 42 Ca 0.00 0.20 0.16 0.00 0.00 0.00 0.00 54.91 55.27 3h5r h ALA 42 Cb 0.58 0.36 -0.09 0.00 0.00 0.00 0.00 17.79 18.64 3h5r h ALA 42 CO 0.00 -0.41 0.61 -0.92 0.00 0.00 0.00 179.25 178.53 3h5r h TYR 43 N 0.07 0.94 0.00 0.00 3.20 -0.86 0.65 116.97 120.96 3h5r h TYR 43 Ca 0.29 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.19 3h5r h TYR 43 Cb 0.46 -0.29 0.00 0.00 1.54 0.00 0.00 36.73 38.43 3h5r h TYR 43 CO -0.40 0.29 0.00 0.00 -1.64 0.00 0.00 178.16 176.41 3h5r n PHE 45 N -3.01 1.07 -0.04 0.00 3.72 0.22 -4.47 117.46 114.94 3h5r n PHE 45 Ca -0.02 -0.68 0.01 0.00 -0.05 0.00 0.00 57.45 56.71 3h5r n PHE 45 Cb 0.11 -0.23 0.33 0.00 -0.94 0.00 0.00 39.48 38.75 3h5r n PHE 45 CO 0.00 0.00 0.00 0.82 -0.05 0.00 0.00 176.76 177.53 3h5r h ILE 46 N 2.77 1.16 -2.69 4.37 2.04 -1.52 0.49 117.51 124.13 3h5r h ILE 46 Ca 0.00 -0.49 -0.66 0.00 1.00 0.00 0.00 64.86 64.71 3h5r h ILE 46 Cb 1.29 0.62 -0.06 0.00 -0.74 0.00 0.00 36.82 37.93 3h5r h ILE 46 CO 0.18 0.20 -0.48 -0.89 0.00 0.00 0.00 178.15 177.16 3h5r s THR 47 N -5.32 5.48 -0.24 -0.27 2.01 -1.26 -4.57 115.64 111.46 3h5r s THR 47 Ca -0.09 0.13 -0.29 0.00 0.31 0.00 0.00 61.69 61.76 3h5r s THR 47 Cb 0.17 -3.44 -0.03 0.00 0.01 0.00 0.00 72.50 69.20 3h5r s THR 47 CO 0.76 0.54 1.85 -2.16 -0.69 0.00 0.00 174.62 174.91 3h5r s PRO 48 N -1.27 3.50 -0.01 4.92 0.04 -1.26 -4.71 135.00 136.20 3h5r s PRO 48 Ca 0.18 1.72 0.01 0.00 0.04 0.00 0.00 61.00 62.96 3h5r s PRO 48 Cb -0.12 -4.18 0.01 0.00 0.04 0.00 0.00 34.50 30.25 3h5r s PRO 48 CO 0.08 -1.66 -0.01 -1.12 0.04 0.00 0.00 177.00 174.33 3h5r s SER 49 N 5.85 0.32 0.86 6.66 0.01 0.13 -4.82 113.70 122.71 3h5r s SER 49 Ca 0.82 -0.03 -0.11 0.00 1.31 0.00 0.00 55.95 57.94 3h5r s SER 49 Cb -0.27 -0.11 0.11 0.00 0.21 0.00 0.00 66.02 65.96 3h5r s SER 49 CO 0.33 -0.03 1.16 -0.94 0.41 0.00 0.00 173.24 174.17 3h5r s SER 50 N 0.43 3.35 0.36 2.44 1.04 -1.26 0.19 113.70 120.26 3h5r s SER 50 Ca -0.04 2.21 0.12 0.00 0.48 0.00 0.00 55.95 58.72 3h5r s SER 50 Cb -0.07 -2.57 0.93 0.00 0.10 0.00 0.00 66.02 64.41 3h5r s SER 50 CO -0.01 -2.82 1.80 0.22 0.98 0.00 0.00 173.24 173.42 3h5r h TYR 51 N -1.43 0.81 0.03 5.02 3.20 -1.95 -0.54 116.97 122.10 3h5r h TYR 51 Ca -0.44 0.03 -0.33 0.00 3.14 0.00 0.00 58.73 61.13 3h5r h TYR 51 Cb 1.27 -0.24 -0.05 0.00 1.54 0.00 0.00 36.73 39.25 3h5r h TYR 51 CO 0.50 0.18 -1.93 0.25 -1.64 0.00 0.00 178.16 175.51 3h5r n THR 52 N -4.64 1.61 -0.30 1.81 -2.24 -1.26 -0.83 114.28 108.42 3h5r n THR 52 Ca 0.22 -0.76 -0.03 0.00 -2.27 0.00 0.00 64.05 61.21 3h5r n THR 52 Cb 0.67 -1.14 0.12 0.00 -2.10 0.00 0.00 70.33 67.89 3h5r n THR 52 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3h5r h ALA 53 N 0.72 1.22 -0.10 6.98 0.00 -1.91 0.30 119.26 126.47 3h5r h ALA 53 Ca -0.38 -0.12 -0.18 0.00 0.00 0.00 0.00 54.91 54.23 3h5r h ALA 53 Cb 2.05 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 19.49 3h5r h ALA 53 CO 0.06 0.63 -0.70 0.00 0.00 0.00 0.00 179.25 179.24 3h5r h ALA 54 N 1.32 0.60 -0.78 0.00 0.00 -1.18 -3.29 119.26 115.94 3h5r h ALA 54 Ca 0.30 -0.59 -0.04 0.00 0.00 0.00 0.00 54.91 54.58 3h5r h ALA 54 Cb 0.02 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 3h5r h ALA 54 CO -0.05 0.75 0.32 1.25 0.00 0.00 0.00 179.25 181.52 3h5r h LEU 55 N 0.31 1.07 0.00 0.00 5.85 -0.42 -2.76 115.31 119.36 3h5r h LEU 55 Ca -0.03 -0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.53 3h5r h LEU 55 Cb 1.27 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 42.03 3h5r h LEU 55 CO 0.12 0.94 0.00 -0.62 -0.34 0.00 0.00 178.44 178.55 3h5r n GLU 56 N -4.31 0.46 -0.00 1.25 4.71 0.10 -2.53 120.64 120.33 3h5r n GLU 56 Ca 0.07 0.00 0.03 0.00 -0.01 0.00 0.00 57.16 57.25 3h5r n GLU 56 Cb 0.18 -1.48 -0.04 0.00 -1.01 0.00 0.00 31.44 29.09 3h5r n GLU 56 CO 0.00 0.00 0.00 2.41 0.09 0.00 0.00 177.13 179.63 3h5r n THR 57 N -0.98 0.00 -2.97 2.62 -1.04 -1.04 -5.03 114.28 105.83 3h5r n THR 57 Ca 0.11 -0.28 -0.19 0.00 -2.04 0.00 0.00 64.05 61.65 3h5r n THR 57 Cb 0.05 0.76 0.02 0.00 -1.82 0.00 0.00 70.33 69.33 3h5r n THR 57 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3h5r s ALA 58 N -1.89 4.25 -0.24 2.41 0.00 -1.05 -5.03 121.76 120.22 3h5r s ALA 58 Ca 0.01 -1.50 0.12 0.00 0.00 0.00 0.00 51.96 50.58 3h5r s ALA 58 Cb 0.04 -1.80 0.45 0.00 0.00 0.00 0.00 23.12 21.81 3h5r s ALA 58 CO 0.25 -0.38 1.19 0.09 0.00 0.00 0.00 175.76 176.90 3h5r n ASN 59 N -1.98 3.15 -4.44 0.00 5.03 -1.26 -5.04 115.26 110.72 3h5r n ASN 59 Ca 0.06 -3.49 -0.22 0.00 0.87 0.00 0.00 54.58 51.80 3h5r n ASN 59 Cb 0.59 -0.42 -0.10 0.00 -1.02 0.00 0.00 39.78 38.83 3h5r n ASN 59 CO 0.00 0.00 0.00 0.27 -1.83 0.00 0.00 177.26 175.70 3h5r s ILE 60 N -3.68 2.09 0.40 2.41 -4.36 -1.26 -5.12 121.20 111.67 3h5r s ILE 60 Ca 0.43 -2.27 -0.25 0.00 -0.26 0.00 0.00 60.65 58.30 3h5r s ILE 60 Cb 0.39 -2.33 -0.11 0.00 1.25 0.00 0.00 42.46 41.65 3h5r s ILE 60 CO -0.02 -0.39 0.96 -2.65 0.24 0.00 0.00 174.94 173.07 3h5r n PRO 61 N -0.58 1.27 -0.31 0.37 -0.02 -1.26 -4.78 135.00 129.68 3h5r n PRO 61 Ca -0.06 0.45 0.01 0.00 -2.02 0.00 0.00 63.50 61.88 3h5r n PRO 61 Cb 0.61 -1.95 0.14 0.00 -0.02 0.00 0.00 33.50 32.29 3h5r n PRO 61 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 3h5r h GLU 62 N 1.54 0.95 -0.18 -0.52 9.09 -1.99 -0.57 114.58 122.90 3h5r h GLU 62 Ca -0.43 -0.06 -0.14 0.00 0.05 0.00 0.00 59.36 58.79 3h5r h GLU 62 Cb 1.34 -0.21 -0.01 0.00 -1.65 0.00 0.00 28.75 28.22 3h5r h GLU 62 CO 0.57 0.63 -0.47 1.57 0.05 0.00 0.00 179.01 181.36 3h5r h LYS 63 N 0.97 0.45 -0.61 1.06 5.09 -2.00 -2.59 116.57 118.94 3h5r h LYS 63 Ca 0.38 -0.25 -0.07 0.00 0.09 0.00 0.00 60.65 60.80 3h5r h LYS 63 Cb 0.18 0.01 -0.02 0.00 0.10 0.00 0.00 32.23 32.50 3h5r h LYS 63 CO -0.18 0.83 0.12 -0.44 -2.09 0.00 0.00 179.45 177.70 3h5r h ASP 64 N 0.36 0.95 -0.95 7.07 3.32 -1.73 -2.47 116.42 122.97 3h5r h ASP 64 Ca 0.02 -0.25 0.10 0.00 0.02 0.00 0.00 57.03 56.92 3h5r h ASP 64 Cb 0.96 -0.25 -0.07 0.00 0.22 0.00 0.00 39.33 40.19 3h5r h ASP 64 CO 0.08 0.95 0.61 0.15 -1.72 0.00 0.00 179.24 179.31 3h5r h PHE 65 N 0.90 1.06 -0.36 4.55 3.57 -1.06 -2.54 116.94 123.06 3h5r h PHE 65 Ca 0.19 0.03 -0.09 0.00 3.53 0.00 0.00 57.97 61.62 3h5r h PHE 65 Cb 0.39 -0.34 -0.01 0.00 2.79 0.00 0.00 35.95 38.78 3h5r h PHE 65 CO 0.03 0.48 -0.14 0.77 -2.23 0.00 0.00 178.31 177.21 3h5r h SER 66 N 0.97 0.76 0.18 0.41 0.02 -1.05 0.30 113.55 115.14 3h5r h SER 66 Ca 0.44 -0.39 0.01 0.00 -0.84 0.00 0.00 61.79 61.01 3h5r h SER 66 Cb 0.40 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.70 3h5r h SER 66 CO -0.20 0.98 -0.24 -1.13 -1.14 0.00 0.00 176.83 175.10 3h5r h ASN 67 N 0.53 -0.65 -0.77 3.07 -0.73 -1.34 0.13 115.58 115.82 3h5r h ASN 67 Ca 0.09 0.07 -0.03 0.00 1.87 0.00 0.00 56.30 58.29 3h5r h ASN 67 Cb 0.68 0.24 -0.04 0.00 0.27 0.00 0.00 38.32 39.47 3h5r h ASN 67 CO 0.05 -0.34 0.37 0.00 -0.37 0.00 0.00 177.43 177.14 3h5r h PHE 69 N 1.11 0.84 -0.37 0.00 3.57 -0.26 -1.48 116.94 120.35 3h5r h PHE 69 Ca 0.27 -0.12 -0.03 0.00 3.53 0.00 0.00 57.97 61.62 3h5r h PHE 69 Cb 0.12 -0.23 -0.02 0.00 2.79 0.00 0.00 35.95 38.62 3h5r h PHE 69 CO 0.01 0.79 0.13 0.00 -2.23 0.00 0.00 178.31 177.01 3h5r h ARG 70 N 0.72 0.56 -0.36 1.11 -0.00 -0.04 -1.18 114.38 115.20 3h5r h ARG 70 Ca 0.14 -0.11 0.00 0.00 -0.50 0.00 0.00 59.98 59.51 3h5r h ARG 70 Cb 0.48 -0.09 -0.02 0.00 0.00 0.00 0.00 29.97 30.35 3h5r h ARG 70 CO 0.02 0.56 0.23 0.35 0.00 0.00 0.00 179.97 181.13 3h5r h PHE 71 N 0.45 0.46 -0.38 3.04 3.57 -1.07 -1.24 116.94 121.76 3h5r h PHE 71 Ca 0.12 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.56 3h5r h PHE 71 Cb 0.22 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 38.79 3h5r h PHE 71 CO 0.00 0.30 -0.02 -0.07 -2.23 0.00 0.00 178.31 176.29 3h5r h LEU 72 N 0.47 0.69 -0.55 0.59 3.38 -1.18 -2.58 115.31 116.13 3h5r h LEU 72 Ca 0.13 -0.32 -0.14 0.00 0.09 0.00 0.00 57.88 57.64 3h5r h LEU 72 Cb -0.03 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 3h5r h LEU 72 CO -0.03 0.84 -0.33 0.50 0.09 0.00 0.00 178.44 179.52 3h5r h LYS 73 N 0.51 0.81 -0.07 1.13 3.64 -1.13 0.57 116.57 122.04 3h5r h LYS 73 Ca 0.11 -0.39 -0.13 0.00 -1.27 0.00 0.00 60.65 58.96 3h5r h LYS 73 Cb 0.51 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.31 3h5r h LYS 73 CO 0.02 1.02 -0.56 0.93 -2.27 0.00 0.00 179.45 178.60 3h5r h GLU 74 N 0.68 0.21 -0.05 1.90 5.08 -1.18 -2.71 114.58 118.51 3h5r h GLU 74 Ca 0.07 -0.13 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 3h5r h GLU 74 Cb 0.88 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.14 3h5r h GLU 74 CO 0.08 0.71 0.00 0.09 -1.00 0.00 0.00 179.01 178.89 3h5r n ASN 75 N -3.90 1.33 -2.09 1.42 3.02 -0.98 -4.94 115.26 109.13 3h5r n ASN 75 Ca -0.02 -1.49 -0.17 0.00 -0.03 0.00 0.00 54.58 52.86 3h5r n ASN 75 Cb 0.58 -0.03 0.00 0.00 -0.61 0.00 0.00 39.78 39.73 3h5r n ASN 75 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 3h5r n PHE 76 N 0.05 -1.04 0.08 3.10 3.72 -1.00 -4.91 117.46 117.45 3h5r n PHE 76 Ca 0.19 0.13 -0.18 0.00 -0.05 0.00 0.00 57.45 57.54 3h5r n PHE 76 Cb 0.31 -3.53 -0.14 0.00 -0.94 0.00 0.00 39.48 35.18 3h5r n PHE 76 CO 0.00 0.00 0.00 0.74 -0.05 0.00 0.00 176.76 177.45 3h5r h PHE 77 N -0.34 0.52 -3.37 1.38 0.04 -1.15 -3.43 116.94 110.60 3h5r h PHE 77 Ca -0.41 -0.38 -0.66 0.00 2.80 0.00 0.00 57.97 59.32 3h5r h PHE 77 Cb 1.30 -0.02 -0.13 0.00 2.20 0.00 0.00 35.95 39.29 3h5r h PHE 77 CO 0.44 1.41 -0.65 0.96 -0.60 0.00 0.00 178.31 179.87 3h5r s ILE 78 N -2.62 4.09 0.07 -0.55 -4.36 -1.10 -0.43 121.20 116.30 3h5r s ILE 78 Ca -0.09 -0.75 0.01 0.00 -0.26 0.00 0.00 60.65 59.57 3h5r s ILE 78 Cb 0.06 -2.87 -0.04 0.00 1.25 0.00 0.00 42.46 40.87 3h5r s ILE 78 CO 0.86 0.28 -0.06 0.27 0.24 0.00 0.00 174.94 176.54 3h5r s ILE 79 N -1.17 0.53 0.17 8.37 -4.36 0.42 -4.53 121.20 120.64 3h5r s ILE 79 Ca 0.22 -1.60 -0.33 0.00 -0.26 0.00 0.00 60.65 58.68 3h5r s ILE 79 Cb -0.12 -1.25 -0.15 0.00 1.25 0.00 0.00 42.46 42.19 3h5r s ILE 79 CO 0.13 -0.73 1.28 -2.65 0.24 0.00 0.00 174.94 173.21 3h5r n PRO 80 N 0.52 1.44 0.28 0.37 -0.02 -1.26 -0.16 135.00 136.17 3h5r n PRO 80 Ca -0.16 0.51 0.15 0.00 -2.02 0.00 0.00 63.50 61.98 3h5r n PRO 80 Cb 0.59 -2.09 0.80 0.00 -0.02 0.00 0.00 33.50 32.78 3h5r n PRO 80 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 3h5r h GLY 81 N 3.95 0.00 1.73 -1.23 0.00 -1.66 -0.62 103.07 105.24 3h5r h GLY 81 Ca -0.44 0.00 0.02 0.00 0.00 0.00 0.00 47.33 46.91 3h5r h GLY 81 CO 0.74 0.00 0.13 1.05 0.00 0.00 0.00 176.54 178.46 3h5r h GLU 82 N 0.00 0.18 0.00 4.80 -0.00 -1.88 -2.66 114.58 115.01 3h5r h GLU 82 Ca -0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 59.36 59.35 3h5r h GLU 82 Cb 0.30 -0.04 0.00 0.00 -0.00 0.00 0.00 28.75 29.01 3h5r h GLU 82 CO 0.01 0.12 0.00 0.66 -0.00 0.00 0.00 179.01 179.80 3h5r n TYR 83 N -4.50 0.00 -0.53 2.06 4.02 -0.24 -3.53 117.16 114.44 3h5r n TYR 83 Ca 0.01 0.00 0.07 0.00 -0.01 0.00 0.00 57.90 57.96 3h5r n TYR 83 Cb 0.14 -0.29 0.20 0.00 -0.02 0.00 0.00 39.34 39.37 3h5r n TYR 83 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 3h5r n ASN 84 N -1.29 3.34 -4.40 7.72 5.15 -1.00 -4.60 115.26 120.17 3h5r n ASN 84 Ca 0.05 -2.45 -0.44 0.00 -0.60 0.00 0.00 54.58 51.14 3h5r n ASN 84 Cb 0.08 -0.37 -0.00 0.00 -0.53 0.00 0.00 39.78 38.97 3h5r n ASN 84 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 3h5r s ASN 85 N -1.41 7.20 -0.13 1.20 0.01 -1.23 -4.96 114.94 115.63 3h5r s ASN 85 Ca 0.31 -3.30 -0.07 0.00 -0.71 0.00 0.00 52.86 49.10 3h5r s ASN 85 Cb 0.22 -2.31 -0.04 0.00 0.41 0.00 0.00 41.25 39.53 3h5r s ASN 85 CO 0.13 -0.52 0.11 -0.94 -1.51 0.00 0.00 177.10 174.37 3h5r s SER 86 N 2.09 6.16 0.22 -1.22 1.04 -1.26 -4.99 113.70 115.74 3h5r s SER 86 Ca 0.37 0.38 0.08 0.00 0.48 0.00 0.00 55.95 57.25 3h5r s SER 86 Cb -0.06 -1.98 0.42 0.00 0.10 0.00 0.00 66.02 64.50 3h5r s SER 86 CO -0.04 0.37 1.07 0.35 0.98 0.00 0.00 173.24 175.97 3h5r n THR 87 N 2.25 0.68 0.00 2.02 -2.24 -1.26 -4.72 114.28 111.02 3h5r n THR 87 Ca -0.19 0.67 0.00 0.00 -2.27 0.00 0.00 64.05 62.25 3h5r n THR 87 Cb 0.54 -1.67 0.00 0.00 -2.10 0.00 0.00 70.33 67.11 3h5r n THR 87 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 3h5r n GLU 88 N -1.77 0.00 -0.64 -0.78 0.00 -1.26 -4.59 120.64 111.60 3h5r n GLU 88 Ca -0.01 0.00 0.08 0.00 0.00 0.00 0.00 57.16 57.23 3h5r n GLU 88 Cb 0.34 -1.05 0.34 0.00 0.00 0.00 0.00 31.44 31.07 3h5r n GLU 88 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.13 177.40 3h5r n ASN 89 N 0.32 4.64 -4.65 -1.84 6.94 -1.26 -4.93 115.26 114.48 3h5r n ASN 89 Ca 0.00 -2.53 -0.42 0.00 -0.02 0.00 0.00 54.58 51.61 3h5r n ASN 89 Cb 0.00 -0.59 -0.03 0.00 -2.36 0.00 0.00 39.78 36.80 3h5r n ASN 89 CO 0.00 0.00 0.00 0.21 -1.03 0.00 0.00 177.26 176.44 3h5r s ASN 90 N -0.81 6.93 0.42 0.53 3.04 -1.26 -4.94 114.94 118.85 3h5r s ASN 90 Ca 0.47 1.14 0.20 0.00 0.04 0.00 0.00 52.86 54.71 3h5r s ASN 90 Cb 0.32 -2.48 1.15 0.00 -1.54 0.00 0.00 41.25 38.70 3h5r s ASN 90 CO 0.20 -0.61 1.80 0.08 -3.04 0.00 0.00 177.10 175.54 3h5r h ARG 91 N 7.65 0.34 -0.73 0.43 0.11 -2.01 -1.21 114.38 118.96 3h5r h ARG 91 Ca -0.21 -0.02 0.00 0.00 0.10 0.00 0.00 59.98 59.85 3h5r h ARG 91 Cb 1.08 -0.08 0.00 0.00 1.11 0.00 0.00 29.97 32.08 3h5r h ARG 91 CO 0.93 0.23 0.00 0.66 0.10 0.00 0.00 179.97 181.88 3h5r n TYR 92 N -4.54 1.03 -0.21 4.08 4.01 -1.26 -4.49 117.16 115.78 3h5r n TYR 92 Ca 0.23 -0.37 -0.01 0.00 -0.16 0.00 0.00 57.90 57.59 3h5r n TYR 92 Cb 0.85 -0.28 0.05 0.00 -0.31 0.00 0.00 39.34 39.66 3h5r n TYR 92 CO 0.00 0.00 0.00 0.77 -0.46 0.00 0.00 176.86 177.17 3h5r h SER 93 N 2.14 -0.68 0.27 7.72 0.02 -1.61 0.13 113.55 121.55 3h5r h SER 93 Ca 0.00 0.19 -0.13 0.00 -0.84 0.00 0.00 61.79 61.01 3h5r h SER 93 Cb 1.19 0.42 -0.01 0.00 0.14 0.00 0.00 62.40 64.13 3h5r h SER 93 CO 0.23 -0.23 -0.51 0.03 -1.14 0.00 0.00 176.83 175.21 3h5r h ARG 94 N -0.03 0.28 -0.72 3.45 -0.00 -1.86 -2.45 114.38 113.04 3h5r h ARG 94 Ca 0.29 -0.16 -0.05 0.00 -0.50 0.00 0.00 59.98 59.56 3h5r h ARG 94 Cb 0.48 0.01 -0.03 0.00 0.00 0.00 0.00 29.97 30.43 3h5r h ARG 94 CO -0.65 0.73 0.24 -0.91 0.00 0.00 0.00 179.97 179.38 3h5r h ASN 95 N 0.22 1.02 -0.77 7.04 4.21 -1.76 -3.17 115.58 122.37 3h5r h ASN 95 Ca 0.01 -0.18 0.06 0.00 1.21 0.00 0.00 56.30 57.40 3h5r h ASN 95 Cb 0.98 -0.27 -0.06 0.00 -1.12 0.00 0.00 38.32 37.85 3h5r h ASN 95 CO 0.08 0.94 0.45 -0.26 -1.29 0.00 0.00 177.43 177.35 3h5r h PHE 96 N 1.06 0.84 -0.47 1.19 -1.00 -0.27 -1.99 116.94 116.29 3h5r h PHE 96 Ca 0.24 0.03 0.06 0.00 2.81 0.00 0.00 57.97 61.10 3h5r h PHE 96 Cb 0.27 -0.26 -0.05 0.00 3.61 0.00 0.00 35.95 39.51 3h5r h PHE 96 CO 0.02 0.41 0.19 -0.07 -1.61 0.00 0.00 178.31 177.25 3h5r h LEU 97 N 0.82 0.22 -0.18 1.54 3.38 -1.50 -0.89 115.31 118.70 3h5r h LEU 97 Ca 0.34 0.05 0.04 0.00 0.09 0.00 0.00 57.88 58.40 3h5r h LEU 97 Cb 0.19 0.02 -0.07 0.00 0.09 0.00 0.00 40.66 40.89 3h5r h LEU 97 CO -0.18 0.16 -0.48 -0.74 0.09 0.00 0.00 178.44 177.29 3h5r h HIS 98 N 0.37 -1.39 -0.82 1.13 2.76 -1.45 -1.34 115.15 114.41 3h5r h HIS 98 Ca 0.22 0.06 0.05 0.00 -2.20 0.00 0.00 60.37 58.50 3h5r h HIS 98 Cb 0.20 0.63 -0.06 0.00 1.55 0.00 0.00 27.41 29.74 3h5r h HIS 98 CO -0.14 -0.50 0.51 1.88 -1.30 0.00 0.00 177.93 178.38 3h5r h TYR 99 N -0.50 0.95 -0.87 5.26 0.05 -0.97 -2.45 116.97 118.44 3h5r h TYR 99 Ca 0.07 0.03 0.02 0.00 0.05 0.00 0.00 58.73 58.90 3h5r h TYR 99 Cb 0.64 -0.31 -0.05 0.00 1.01 0.00 0.00 36.73 38.03 3h5r h TYR 99 CO -0.56 0.51 0.57 1.96 -1.05 0.00 0.00 178.16 179.59 3h5r h GLN 100 N 0.96 1.11 0.00 4.88 4.20 -0.86 -2.13 115.11 123.27 3h5r h GLN 100 Ca 0.35 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.99 3h5r h GLN 100 Cb 0.11 -0.25 0.00 0.00 0.30 0.00 0.00 27.48 27.64 3h5r h GLN 100 CO -0.15 0.73 0.00 0.66 -0.67 0.00 0.00 178.83 179.40 3h5r h SER 101 N 1.14 0.00 -0.50 1.46 4.64 -0.75 -0.46 113.55 119.08 3h5r h SER 101 Ca 0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.65 3h5r h SER 101 Cb -0.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.02 3h5r h SER 101 CO -0.09 0.00 0.00 -1.22 -0.87 0.00 0.00 176.83 174.65 3h5r n TYR 102 N -2.61 0.65 -0.98 4.77 4.02 -1.01 -4.80 117.16 117.20 3h5r n TYR 102 Ca -0.00 -0.33 0.00 0.00 -0.01 0.00 0.00 57.90 57.56 3h5r n TYR 102 Cb 0.17 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.49 3h5r n TYR 102 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3h5r n GLY 103 N 1.54 0.44 3.94 2.72 0.00 -0.18 -4.96 105.19 108.69 3h5r n GLY 103 Ca 0.21 -0.65 -0.26 0.00 0.00 0.00 0.00 46.02 45.31 3h5r n GLY 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h5r s ALA 104 N -2.00 3.92 -0.46 4.61 0.00 -0.83 -5.01 121.76 121.99 3h5r s ALA 104 Ca 0.00 -0.97 -0.26 0.00 0.00 0.00 0.00 51.96 50.72 3h5r s ALA 104 Cb 0.00 -1.85 0.03 0.00 0.00 0.00 0.00 23.12 21.30 3h5r s ALA 104 CO 0.00 0.49 0.98 1.21 0.00 0.00 0.00 175.76 178.43 3h5r s ASN 105 N -3.25 6.54 0.47 0.00 3.84 -1.26 -3.97 114.94 117.31 3h5r s ASN 105 Ca 0.36 0.23 0.21 0.00 0.21 0.00 0.00 52.86 53.86 3h5r s ASN 105 Cb -0.11 -2.48 1.17 0.00 -0.55 0.00 0.00 41.25 39.29 3h5r s ASN 105 CO 0.29 -1.09 2.00 1.55 -2.79 0.00 0.00 177.10 177.06 3h5r h PRO 106 N 9.08 0.00 -0.38 0.43 0.13 -1.88 -1.18 132.00 138.21 3h5r h PRO 106 Ca -0.24 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.79 3h5r h PRO 106 Cb 1.07 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.19 3h5r h PRO 106 CO 1.05 0.18 -0.18 0.28 -0.23 0.00 0.00 178.00 179.10 3h5r h VAL 107 N 0.00 1.26 -0.06 1.56 2.07 -1.91 -0.20 116.25 118.96 3h5r h VAL 107 Ca -0.00 -1.26 -0.24 0.00 0.82 0.00 0.00 66.70 66.02 3h5r h VAL 107 Cb 0.39 1.17 0.01 0.00 -1.52 0.00 0.00 31.29 31.35 3h5r h VAL 107 CO 0.02 0.42 -0.92 -0.07 0.02 0.00 0.00 177.57 177.05 3h5r h LEU 108 N 0.63 0.86 -0.37 2.57 3.38 -1.64 -1.85 115.31 118.89 3h5r h LEU 108 Ca 0.10 -0.64 0.00 0.00 0.09 0.00 0.00 57.88 57.43 3h5r h LEU 108 Cb 0.66 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 3h5r h LEU 108 CO 0.05 1.43 0.24 0.58 0.09 0.00 0.00 178.44 180.83 3h5r h VAL 109 N 0.43 1.11 -0.86 1.22 2.07 -1.40 -2.11 116.25 116.71 3h5r h VAL 109 Ca -0.09 -0.22 0.01 0.00 0.82 0.00 0.00 66.70 67.22 3h5r h VAL 109 Cb 1.55 0.59 -0.04 0.00 -1.52 0.00 0.00 31.29 31.87 3h5r h VAL 109 CO 0.18 0.11 0.57 -0.61 0.02 0.00 0.00 177.57 177.83 3h5r h GLN 110 N 0.49 1.13 -0.91 1.57 5.75 -0.95 -1.61 115.11 120.58 3h5r h GLN 110 Ca 0.13 -0.07 -0.01 0.00 -0.15 0.00 0.00 58.65 58.56 3h5r h GLN 110 Cb -0.03 -0.25 -0.04 0.00 1.07 0.00 0.00 27.48 28.22 3h5r h GLN 110 CO -0.03 0.75 0.53 0.22 -2.65 0.00 0.00 178.83 177.65 3h5r h ASP 111 N 1.16 1.11 -0.71 -0.69 3.58 -1.21 -0.19 116.42 119.47 3h5r h ASP 111 Ca 0.31 -0.08 -0.06 0.00 0.42 0.00 0.00 57.03 57.63 3h5r h ASP 111 Cb -0.13 -0.28 -0.03 0.00 1.72 0.00 0.00 39.33 40.60 3h5r h ASP 111 CO -0.07 0.86 0.23 0.11 -2.88 0.00 0.00 179.24 177.50 3h5r h LYS 112 N 1.26 1.12 -0.59 0.28 1.57 -0.67 -1.13 116.57 118.41 3h5r h LYS 112 Ca 0.32 -0.23 -0.04 0.00 -1.87 0.00 0.00 60.65 58.84 3h5r h LYS 112 Cb -0.02 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.09 3h5r h LYS 112 CO -0.06 0.94 0.23 -0.07 -0.57 0.00 0.00 179.45 179.93 3h5r h LEU 113 N 1.07 0.82 -1.30 2.94 3.38 -0.83 -2.73 115.31 118.66 3h5r h LEU 113 Ca 0.24 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 3h5r h LEU 113 Cb 0.29 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 3h5r h LEU 113 CO -0.01 0.77 0.39 0.50 0.09 0.00 0.00 178.44 180.19 3h5r h LYS 114 N 0.82 0.87 -0.02 1.13 3.64 -0.63 -1.57 116.57 120.80 3h5r h LYS 114 Ca 0.20 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 3h5r h LYS 114 Cb 0.21 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 3h5r h LYS 114 CO -0.02 0.61 0.00 0.09 -2.27 0.00 0.00 179.45 177.86 3h5r n ASN 115 N -4.41 1.06 -4.92 4.20 3.02 -0.46 -3.33 115.26 110.42 3h5r n ASN 115 Ca 0.06 -1.38 -0.27 0.00 -0.03 0.00 0.00 54.58 52.96 3h5r n ASN 115 Cb 0.07 -0.01 -0.03 0.00 -0.61 0.00 0.00 39.78 39.20 3h5r n ASN 115 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3h5r s ALA 116 N -1.98 3.76 -0.10 5.41 0.00 -0.93 -4.96 121.76 122.96 3h5r s ALA 116 Ca 0.40 -0.78 0.02 0.00 0.00 0.00 0.00 51.96 51.59 3h5r s ALA 116 Cb 0.21 -2.08 0.02 0.00 0.00 0.00 0.00 23.12 21.26 3h5r s ALA 116 CO 0.33 0.32 -0.14 0.21 0.00 0.00 0.00 175.76 176.49 3h5r s LYS 117 N -3.53 2.04 -0.09 0.00 2.20 -1.26 -2.07 119.74 117.03 3h5r s LYS 117 Ca 0.40 -0.50 0.03 0.00 -0.36 0.00 0.00 55.97 55.54 3h5r s LYS 117 Cb -0.11 -1.75 0.01 0.00 -1.51 0.00 0.00 37.83 34.47 3h5r s LYS 117 CO 0.30 -0.06 -0.18 0.08 -0.36 0.00 0.00 175.35 175.13 3h5r s VAL 118 N 0.99 1.59 -0.16 4.02 1.01 0.49 -1.07 120.40 127.27 3h5r s VAL 118 Ca -0.07 -0.74 -0.18 0.00 0.00 0.00 0.00 61.98 60.99 3h5r s VAL 118 Cb -0.15 -1.41 -0.04 0.00 0.00 0.00 0.00 36.38 34.78 3h5r s VAL 118 CO -0.01 0.46 0.50 -0.69 0.00 0.00 0.00 175.10 175.36 3h5r s VAL 119 N 0.58 5.15 -0.50 2.92 1.01 -0.83 -1.17 120.40 127.56 3h5r s VAL 119 Ca -0.15 0.96 -0.13 0.00 0.00 0.00 0.00 61.98 62.66 3h5r s VAL 119 Cb -0.17 -3.83 0.11 0.00 0.00 0.00 0.00 36.38 32.49 3h5r s VAL 119 CO 0.05 0.25 0.42 -0.63 0.00 0.00 0.00 175.10 175.19 3h5r s ILE 120 N 1.11 4.84 -0.78 2.22 -1.09 0.29 0.00 121.20 127.79 3h5r s ILE 120 Ca 0.25 -1.49 -0.17 0.00 -2.23 0.00 0.00 60.65 57.01 3h5r s ILE 120 Cb -0.15 -4.07 0.15 0.00 -1.58 0.00 0.00 42.46 36.81 3h5r s ILE 120 CO 0.10 -0.76 0.85 -0.22 -1.23 0.00 0.00 174.94 173.69 3h5r s LEU 121 N 1.53 5.79 0.00 2.97 2.96 0.84 -2.02 118.68 130.75 3h5r s LEU 121 Ca 0.04 -2.08 0.00 0.00 -0.22 0.00 0.00 54.13 51.87 3h5r s LEU 121 Cb -0.27 -2.30 0.00 0.00 0.50 0.00 0.00 46.19 44.12 3h5r s LEU 121 CO 0.03 -0.90 0.00 0.61 -1.32 0.00 0.00 176.35 174.76 3h5r n GLY 122 N 4.88 2.91 0.75 7.98 0.00 -0.75 -1.78 105.19 119.18 3h5r n GLY 122 Ca 0.09 -1.18 0.03 0.00 0.00 0.00 0.00 46.02 44.96 3h5r n GLY 122 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h5r n GLY 124 N -1.13 -0.95 0.24 0.00 0.00 -1.26 -4.26 105.19 97.84 3h5r n GLY 124 Ca 0.23 -1.27 -0.02 0.00 0.00 0.00 0.00 46.02 44.96 3h5r n GLY 124 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3h5r h GLY 125 N 0.00 0.51 0.31 -0.02 0.00 -1.94 0.71 103.07 102.64 3h5r h GLY 125 Ca 0.00 -0.38 -0.00 0.00 0.00 0.00 0.00 47.33 46.95 3h5r h GLY 125 CO 0.00 0.35 -0.03 -2.22 0.00 0.00 0.00 176.54 174.64 3h5r h ILE 126 N 0.43 1.21 -0.77 2.60 2.04 -1.91 -2.89 117.51 118.22 3h5r h ILE 126 Ca 0.07 -1.42 0.17 0.00 1.00 0.00 0.00 64.86 64.68 3h5r h ILE 126 Cb 0.57 2.07 -0.11 0.00 -0.74 0.00 0.00 36.82 38.61 3h5r h ILE 126 CO 0.04 0.33 0.23 1.23 0.00 0.00 0.00 178.15 179.98 3h5r h GLY 127 N -0.79 1.13 0.06 5.37 0.00 -1.69 0.15 103.07 107.30 3h5r h GLY 127 Ca -0.01 -0.07 0.01 0.00 0.00 0.00 0.00 47.33 47.26 3h5r h GLY 127 CO 0.02 -0.20 -0.49 3.43 0.00 0.00 0.00 176.54 179.30 3h5r h ASN 128 N 0.32 -1.49 -0.35 0.19 2.35 -0.89 -0.02 115.58 115.68 3h5r h ASN 128 Ca 0.44 0.16 -0.05 0.00 -0.55 0.00 0.00 56.30 56.30 3h5r h ASN 128 Cb 0.76 0.56 -0.01 0.00 0.05 0.00 0.00 38.32 39.68 3h5r h ASN 128 CO -0.50 -0.50 0.01 0.45 -1.65 0.00 0.00 177.43 175.24 3h5r h HIS 129 N -0.66 0.67 0.17 1.19 3.86 -1.20 -2.36 115.15 116.82 3h5r h HIS 129 Ca 0.00 -0.11 -0.01 0.00 -1.16 0.00 0.00 60.37 59.09 3h5r h HIS 129 Cb 0.68 -0.18 0.00 0.00 1.06 0.00 0.00 27.41 28.98 3h5r h HIS 129 CO -0.47 0.71 -0.08 0.28 0.86 0.00 0.00 177.93 179.23 3h5r h VAL 130 N 0.43 0.85 -0.89 2.45 2.07 -0.70 -2.62 116.25 117.84 3h5r h VAL 130 Ca 0.10 -0.08 0.14 0.00 0.82 0.00 0.00 66.70 67.69 3h5r h VAL 130 Cb 0.44 0.90 -0.07 0.00 -1.52 0.00 0.00 31.29 31.03 3h5r h VAL 130 CO 0.02 0.02 0.58 0.77 0.02 0.00 0.00 177.57 178.97 3h5r h SER 131 N -0.26 0.65 -0.17 0.57 4.64 -0.86 -1.53 113.55 116.59 3h5r h SER 131 Ca -0.02 0.04 -0.15 0.00 -0.47 0.00 0.00 61.79 61.19 3h5r h SER 131 Cb 0.20 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 3h5r h SER 131 CO 0.04 0.33 -0.46 0.58 -0.87 0.00 0.00 176.83 176.45 3h5r h VAL 132 N 0.69 1.33 -0.53 0.95 2.07 -1.26 -0.43 116.25 119.07 3h5r h VAL 132 Ca 0.45 -1.71 0.06 0.00 0.82 0.00 0.00 66.70 66.32 3h5r h VAL 132 Cb 0.73 1.95 -0.05 0.00 -1.52 0.00 0.00 31.29 32.39 3h5r h VAL 132 CO -0.21 0.53 0.24 0.40 0.02 0.00 0.00 177.57 178.55 3h5r h ILE 133 N 0.29 0.90 -0.29 4.57 2.04 -1.08 -1.72 117.51 122.22 3h5r h ILE 133 Ca -0.01 -0.16 -0.02 0.00 1.00 0.00 0.00 64.86 65.67 3h5r h ILE 133 Cb 1.07 0.40 -0.01 0.00 -0.74 0.00 0.00 36.82 37.54 3h5r h ILE 133 CO 0.10 0.09 0.09 -0.07 0.00 0.00 0.00 178.15 178.36 3h5r h LEU 134 N 0.47 0.42 -0.20 1.44 3.38 -1.14 -0.34 115.31 119.34 3h5r h LEU 134 Ca 0.24 -0.20 0.04 0.00 0.09 0.00 0.00 57.88 58.05 3h5r h LEU 134 Cb 0.20 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 3h5r h LEU 134 CO -0.20 0.50 -0.03 0.00 0.09 0.00 0.00 178.44 178.81 3h5r h ALA 135 N 0.93 0.15 0.00 1.53 0.00 -0.95 -1.12 119.26 119.81 3h5r h ALA 135 Ca 0.09 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.07 3h5r h ALA 135 Cb 0.23 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.15 3h5r h ALA 135 CO -0.00 -0.46 0.00 0.25 0.00 0.00 0.00 179.25 179.04 3h5r n THR 136 N -5.17 0.61 1.09 0.00 -2.24 -0.66 -1.62 114.28 106.29 3h5r n THR 136 Ca -0.02 -0.08 0.12 0.00 -2.27 0.00 0.00 64.05 61.80 3h5r n THR 136 Cb 0.12 -0.76 0.30 0.00 -2.10 0.00 0.00 70.33 67.89 3h5r n THR 136 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3h5r n SER 137 N -2.12 0.66 -0.05 3.42 7.64 -0.15 -4.96 113.62 118.08 3h5r n SER 137 Ca 0.05 -0.46 0.00 0.00 1.01 0.00 0.00 58.87 59.47 3h5r n SER 137 Cb 0.35 0.20 0.00 0.00 -1.01 0.00 0.00 64.21 63.75 3h5r n SER 137 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3h5r n GLY 138 N 1.44 1.28 3.71 0.23 0.00 -0.64 -4.97 105.19 106.24 3h5r n GLY 138 Ca 0.08 -0.33 -0.42 0.00 0.00 0.00 0.00 46.02 45.35 3h5r n GLY 138 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h5r s ILE 139 N -2.09 2.72 0.29 -0.61 -1.09 -0.51 -3.35 121.20 116.55 3h5r s ILE 139 Ca 0.00 0.44 0.15 0.00 -2.23 0.00 0.00 60.65 59.01 3h5r s ILE 139 Cb 0.00 -3.28 0.08 0.00 -1.58 0.00 0.00 42.46 37.68 3h5r s ILE 139 CO 0.00 0.02 1.75 1.23 -1.23 0.00 0.00 174.94 176.72 3h5r h GLY 140 N 7.29 0.00 -6.10 6.18 0.00 -1.29 -3.44 103.07 105.71 3h5r h GLY 140 Ca -0.43 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 46.70 3h5r h GLY 140 CO 0.92 0.00 -0.49 1.85 0.00 0.00 0.00 176.54 178.82 3h5r s GLU 141 N -3.85 0.20 -0.06 4.80 2.12 -0.88 -1.07 118.70 119.96 3h5r s GLU 141 Ca -0.02 0.56 0.01 0.00 0.36 0.00 0.00 54.97 55.89 3h5r s GLU 141 Cb 0.13 -0.11 0.02 0.00 0.26 0.00 0.00 34.13 34.43 3h5r s GLU 141 CO 0.72 -0.18 -0.07 0.42 -0.54 0.00 0.00 175.26 175.60 3h5r s ILE 142 N 1.43 0.78 -0.23 -3.70 1.01 -0.11 -0.38 121.20 120.01 3h5r s ILE 142 Ca -0.08 -0.25 -0.02 0.00 0.00 0.00 0.00 60.65 60.30 3h5r s ILE 142 Cb -0.11 -0.77 0.01 0.00 0.01 0.00 0.00 42.46 41.61 3h5r s ILE 142 CO -0.09 0.28 -0.08 -0.63 0.00 0.00 0.00 174.94 174.43 3h5r s ILE 143 N 0.92 2.90 -0.16 2.92 1.09 -0.32 -1.54 121.20 127.00 3h5r s ILE 143 Ca -0.11 -0.82 -0.13 0.00 -1.10 0.00 0.00 60.65 58.49 3h5r s ILE 143 Cb -0.15 -2.37 -0.05 0.00 -1.06 0.00 0.00 42.46 38.83 3h5r s ILE 143 CO 0.01 0.34 0.28 -0.76 -0.10 0.00 0.00 174.94 174.71 3h5r s LEU 144 N 1.37 4.24 -0.25 2.97 1.43 0.80 -0.55 118.68 128.70 3h5r s LEU 144 Ca 0.03 0.49 -0.01 0.00 -1.03 0.00 0.00 54.13 53.61 3h5r s LEU 144 Cb -0.15 -2.35 0.08 0.00 0.03 0.00 0.00 46.19 43.79 3h5r s LEU 144 CO -0.06 0.11 0.04 -0.63 0.23 0.00 0.00 176.35 176.04 3h5r s ILE 145 N 0.43 0.90 -0.22 -0.59 1.01 -0.85 0.19 121.20 122.06 3h5r s ILE 145 Ca 0.16 -1.04 -0.28 0.00 0.00 0.00 0.00 60.65 59.49 3h5r s ILE 145 Cb -0.13 -1.46 0.13 0.00 0.01 0.00 0.00 42.46 41.02 3h5r s ILE 145 CO 0.03 -0.37 1.05 -0.62 0.00 0.00 0.00 174.94 175.04 3h5r s ASP 146 N 1.65 -0.37 -0.07 3.58 -1.08 -0.79 -1.80 116.67 117.80 3h5r s ASP 146 Ca 0.02 0.55 0.10 0.00 -0.52 0.00 0.00 52.55 52.70 3h5r s ASP 146 Cb -0.18 0.50 0.16 0.00 -1.46 0.00 0.00 42.92 41.95 3h5r s ASP 146 CO -0.14 -0.23 1.09 -3.20 0.52 0.00 0.00 175.17 173.21 3h5r n ASN 147 N 1.35 2.24 -4.87 -0.34 5.15 -1.16 -3.26 115.26 114.38 3h5r n ASN 147 Ca -0.11 -2.53 -0.32 0.00 -0.60 0.00 0.00 54.58 51.03 3h5r n ASN 147 Cb 0.57 -0.22 -0.05 0.00 -0.53 0.00 0.00 39.78 39.55 3h5r n ASN 147 CO 0.00 0.00 0.00 -1.81 1.40 0.00 0.00 177.26 176.85 3h5r s ASP 148 N -1.89 6.67 0.19 1.20 1.01 -1.26 -4.97 116.67 117.62 3h5r s ASP 148 Ca 0.17 1.09 -0.01 0.00 0.71 0.00 0.00 52.55 54.50 3h5r s ASP 148 Cb 0.14 -2.30 -0.04 0.00 1.01 0.00 0.00 42.92 41.73 3h5r s ASP 148 CO 0.02 -0.18 0.39 -1.10 0.21 0.00 0.00 175.17 174.51 3h5r s GLN 149 N -3.06 3.54 0.14 8.23 1.11 -1.26 -2.19 119.66 126.16 3h5r s GLN 149 Ca 0.51 -0.29 -0.30 0.00 0.01 0.00 0.00 55.36 55.28 3h5r s GLN 149 Cb -0.11 -2.84 -0.08 0.00 -1.01 0.00 0.00 33.01 28.98 3h5r s GLN 149 CO 0.21 0.41 1.27 0.42 0.01 0.00 0.00 175.29 177.62 3h5r s ILE 150 N -1.83 3.54 0.29 1.08 1.01 0.95 -4.82 121.20 121.42 3h5r s ILE 150 Ca 0.39 1.19 0.12 0.00 0.00 0.00 0.00 60.65 62.34 3h5r s ILE 150 Cb -0.11 -3.76 -0.05 0.00 0.01 0.00 0.00 42.46 38.55 3h5r s ILE 150 CO 0.28 0.14 -0.17 -1.61 0.00 0.00 0.00 174.94 173.58 3h5r s GLU 151 N 0.48 1.75 0.41 2.79 2.02 -1.26 0.32 118.70 125.21 3h5r s GLU 151 Ca 0.58 -1.76 0.19 0.00 0.02 0.00 0.00 54.97 54.01 3h5r s GLU 151 Cb -0.34 -1.80 0.88 0.00 0.10 0.00 0.00 34.13 32.97 3h5r s GLU 151 CO 0.33 0.31 1.84 -2.95 0.02 0.00 0.00 175.26 174.82 3h5r h ASN 152 N 2.21 0.00 0.59 -0.19 -1.07 -1.97 -1.82 115.58 113.32 3h5r h ASN 152 Ca -0.41 0.00 0.00 0.00 0.07 0.00 0.00 56.30 55.96 3h5r h ASN 152 Cb 1.26 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.51 3h5r h ASN 152 CO 0.61 0.31 0.00 0.35 0.07 0.00 0.00 177.43 178.77 3h5r n THR 153 N -3.73 0.69 0.15 6.14 -2.24 -1.26 -2.82 114.28 111.22 3h5r n THR 153 Ca -0.01 0.17 0.02 0.00 -2.27 0.00 0.00 64.05 61.97 3h5r n THR 153 Cb 0.41 -0.86 0.19 0.00 -2.10 0.00 0.00 70.33 67.97 3h5r n THR 153 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 3h5r h ASN 154 N 0.00 0.00 0.45 3.42 2.35 -1.74 -3.35 115.58 116.71 3h5r h ASN 154 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3h5r h ASN 154 Cb 0.30 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.67 3h5r h ASN 154 CO 0.00 0.51 0.00 -0.07 -1.65 0.00 0.00 177.43 176.22 3h5r h LEU 155 N 0.00 0.00 -1.01 1.61 3.38 -1.67 -2.47 115.31 115.14 3h5r h LEU 155 Ca -0.01 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.87 3h5r h LEU 155 Cb 1.14 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.88 3h5r h LEU 155 CO 0.07 0.00 -0.28 0.71 0.09 0.00 0.00 178.44 179.03 3h5r h THR 156 N 0.00 1.26 0.00 0.22 1.35 -1.83 -3.36 112.91 110.56 3h5r h THR 156 Ca 0.00 -1.26 0.00 0.00 -0.55 0.00 0.00 66.41 64.60 3h5r h THR 156 Cb 0.23 1.42 0.00 0.00 -1.73 0.00 0.00 68.15 68.07 3h5r h THR 156 CO 0.00 0.39 -0.97 0.54 -0.25 0.00 0.00 175.52 175.23 3h5r n ARG 157 N -4.12 0.16 -2.88 4.72 1.74 -1.09 -4.58 116.66 110.62 3h5r n ARG 157 Ca -0.01 0.00 -0.44 0.00 -0.77 0.00 0.00 57.85 56.64 3h5r n ARG 157 Cb 0.40 -0.99 -0.02 0.00 -1.02 0.00 0.00 32.46 30.84 3h5r n ARG 157 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 3h5r s GLN 158 N -1.95 3.76 0.41 5.56 -0.21 -0.95 -4.80 119.66 121.48 3h5r s GLN 158 Ca 0.00 -1.95 0.08 0.00 0.02 0.00 0.00 55.36 53.51 3h5r s GLN 158 Cb 0.00 -5.03 0.86 0.00 1.00 0.00 0.00 33.01 29.84 3h5r s GLN 158 CO 0.00 -1.83 2.01 -0.24 -2.12 0.00 0.00 175.29 173.11 3h5r h VAL 159 N 5.57 1.12 0.00 1.09 3.04 -1.89 -2.05 116.25 123.13 3h5r h VAL 159 Ca 0.22 -0.38 0.00 0.00 -1.01 0.00 0.00 66.70 65.53 3h5r h VAL 159 Cb 0.97 0.79 0.00 0.00 -2.01 0.00 0.00 31.29 31.04 3h5r h VAL 159 CO 1.19 0.14 0.00 0.18 -1.01 0.00 0.00 177.57 178.08 3h5r n LEU 160 N -4.41 0.20 -4.74 3.16 4.77 -1.26 -4.88 117.00 109.84 3h5r n LEU 160 Ca 0.01 0.54 -0.36 0.00 -0.03 0.00 0.00 56.01 56.17 3h5r n LEU 160 Cb 0.14 -0.50 -0.07 0.00 -2.33 0.00 0.00 43.42 40.66 3h5r n LEU 160 CO 0.36 -0.23 -0.12 -0.36 -1.33 0.00 0.00 177.39 175.71 3h5r s PHE 161 N -3.07 3.45 0.54 -1.77 0.08 -0.77 -4.95 117.98 111.48 3h5r s PHE 161 Ca 0.09 0.44 -0.01 0.00 0.12 0.00 0.00 56.93 57.57 3h5r s PHE 161 Cb 0.12 -2.21 0.02 0.00 -0.57 0.00 0.00 43.02 40.39 3h5r s PHE 161 CO 0.39 0.31 0.79 -1.12 -0.10 0.00 0.00 175.22 175.50 3h5r s SER 162 N 0.26 5.47 0.22 1.36 0.01 -1.26 -4.95 113.70 114.82 3h5r s SER 162 Ca 0.12 0.29 -0.07 0.00 1.31 0.00 0.00 55.95 57.59 3h5r s SER 162 Cb -0.12 -1.29 0.31 0.00 0.21 0.00 0.00 66.02 65.14 3h5r s SER 162 CO 0.01 -1.03 1.80 -0.33 0.41 0.00 0.00 173.24 174.09 3h5r h GLU 163 N 0.06 0.66 0.00 12.44 5.08 -2.00 -1.78 114.58 129.03 3h5r h GLU 163 Ca -0.44 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 57.88 3h5r h GLU 163 Cb 1.28 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.38 3h5r h GLU 163 CO 0.57 0.43 0.00 -0.25 -1.00 0.00 0.00 179.01 178.76 3h5r n ASP 164 N -4.81 0.00 0.02 1.42 9.92 -1.26 -2.67 116.55 119.16 3h5r n ASP 164 Ca 0.11 0.45 0.12 0.00 -0.53 0.00 0.00 54.79 54.94 3h5r n ASP 164 Cb 0.24 -0.47 0.27 0.00 -0.64 0.00 0.00 41.12 40.51 3h5r n ASP 164 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 3h5r n ASP 165 N -1.47 0.50 -4.62 -2.24 8.00 -0.67 -4.91 116.55 111.14 3h5r n ASP 165 Ca 0.02 -0.07 -0.56 0.00 0.71 0.00 0.00 54.79 54.89 3h5r n ASP 165 Cb 0.10 0.15 -0.07 0.00 -0.02 0.00 0.00 41.12 41.27 3h5r n ASP 165 CO 0.00 0.00 0.00 0.55 -0.39 0.00 0.00 177.20 177.36 3h5r n VAL 166 N -1.66 0.08 0.00 2.53 3.14 -1.09 -1.53 118.33 119.80 3h5r n VAL 166 Ca 0.05 -0.01 0.00 0.00 -2.96 0.00 0.00 64.34 61.42 3h5r n VAL 166 Cb 0.36 -0.74 0.00 0.00 -1.06 0.00 0.00 33.84 32.40 3h5r n VAL 166 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3h5r n GLY 167 N 2.88 3.19 3.83 7.55 0.00 0.15 -4.95 105.19 117.84 3h5r n GLY 167 Ca 0.22 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.94 3h5r n GLY 167 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h5r s LYS 168 N -0.56 2.37 0.25 1.61 1.02 -0.58 -4.53 119.74 119.31 3h5r s LYS 168 Ca 0.00 0.60 -0.30 0.00 0.02 0.00 0.00 55.97 56.29 3h5r s LYS 168 Cb 0.00 -1.95 -0.09 0.00 -0.52 0.00 0.00 37.83 35.26 3h5r s LYS 168 CO 0.00 -1.41 1.23 -0.80 -0.92 0.00 0.00 175.35 173.45 3h5r s ASN 169 N -4.04 7.00 0.25 2.83 0.01 -1.26 -0.03 114.94 119.68 3h5r s ASN 169 Ca 0.60 2.42 -0.04 0.00 -0.71 0.00 0.00 52.86 55.12 3h5r s ASN 169 Cb -0.13 -2.62 0.36 0.00 0.41 0.00 0.00 41.25 39.26 3h5r s ASN 169 CO 0.53 -0.40 1.86 0.11 -1.51 0.00 0.00 177.10 177.70 3h5r h LYS 170 N 4.39 1.01 -0.66 -0.60 1.57 -1.76 -2.73 116.57 117.79 3h5r h LYS 170 Ca -0.46 -0.06 -0.07 0.00 -1.87 0.00 0.00 60.65 58.19 3h5r h LYS 170 Cb 1.22 -0.23 -0.03 0.00 0.08 0.00 0.00 32.23 33.27 3h5r h LYS 170 CO 0.71 0.67 0.15 1.79 -0.57 0.00 0.00 179.45 182.20 3h5r h THR 171 N 1.04 1.26 -0.49 -0.16 1.35 -1.86 0.64 112.91 114.69 3h5r h THR 171 Ca 0.39 -0.95 -0.07 0.00 -0.55 0.00 0.00 66.41 65.24 3h5r h THR 171 Cb 0.17 0.58 -0.02 0.00 -1.73 0.00 0.00 68.15 67.15 3h5r h THR 171 CO -0.17 0.36 0.01 -0.08 -0.25 0.00 0.00 175.52 175.39 3h5r h GLU 172 N 1.00 0.80 -0.01 4.72 4.81 -1.90 -2.02 114.58 121.99 3h5r h GLU 172 Ca 0.21 -0.21 -0.06 0.00 -0.13 0.00 0.00 59.36 59.17 3h5r h GLU 172 Cb 0.36 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.65 3h5r h GLU 172 CO 0.00 0.80 -0.23 0.28 -0.73 0.00 0.00 179.01 179.13 3h5r h VAL 173 N 0.75 1.54 -0.64 0.32 2.07 -1.12 -2.79 116.25 116.37 3h5r h VAL 173 Ca 0.15 -1.91 0.12 0.00 0.82 0.00 0.00 66.70 65.87 3h5r h VAL 173 Cb 0.44 2.73 -0.08 0.00 -1.52 0.00 0.00 31.29 32.85 3h5r h VAL 173 CO 0.02 0.52 0.20 0.40 0.02 0.00 0.00 177.57 178.73 3h5r h ILE 174 N -0.50 0.68 -0.00 4.57 2.04 -0.88 -1.33 117.51 122.08 3h5r h ILE 174 Ca -0.03 -0.12 -0.00 0.00 1.00 0.00 0.00 64.86 65.71 3h5r h ILE 174 Cb 0.98 0.30 -0.00 0.00 -0.74 0.00 0.00 36.82 37.36 3h5r h ILE 174 CO 0.05 0.06 0.00 0.50 0.00 0.00 0.00 178.15 178.76 3h5r h LYS 175 N 0.35 0.01 -0.73 2.37 3.64 -1.37 0.52 116.57 121.35 3h5r h LYS 175 Ca 0.34 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.70 3h5r h LYS 175 Cb 0.49 -0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.27 3h5r h LYS 175 CO -0.38 0.08 0.38 0.07 -2.27 0.00 0.00 179.45 177.34 3h5r h ARG 176 N -0.07 1.02 -0.35 1.90 0.11 -1.30 -1.35 114.38 114.34 3h5r h ARG 176 Ca 0.00 -0.12 -0.09 0.00 0.10 0.00 0.00 59.98 59.87 3h5r h ARG 176 Cb 0.08 -0.20 -0.02 0.00 1.11 0.00 0.00 29.97 30.94 3h5r h ARG 176 CO -0.00 0.76 -0.15 0.93 0.10 0.00 0.00 179.97 181.61 3h5r h GLU 177 N 1.03 0.62 -0.61 0.08 4.39 -0.74 -1.35 114.58 118.00 3h5r h GLU 177 Ca 0.26 -0.21 -0.10 0.00 0.34 0.00 0.00 59.36 59.65 3h5r h GLU 177 Cb 0.05 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 28.63 3h5r h GLU 177 CO -0.04 0.75 0.00 -0.07 -1.16 0.00 0.00 179.01 178.49 3h5r h LEU 178 N 0.56 1.05 0.00 1.33 3.38 -0.64 -2.89 115.31 118.11 3h5r h LEU 178 Ca 0.09 -0.30 0.00 0.00 0.09 0.00 0.00 57.88 57.77 3h5r h LEU 178 Cb 0.59 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.05 3h5r h LEU 178 CO 0.04 1.10 -0.02 -0.07 0.09 0.00 0.00 178.44 179.57 3h5r h LEU 179 N 0.98 0.00 -1.00 1.67 3.38 -0.94 0.27 115.31 119.67 3h5r h LEU 179 Ca 0.17 -0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.06 3h5r h LEU 179 Cb 0.56 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 3h5r h LEU 179 CO 0.03 0.00 -0.17 0.11 0.09 0.00 0.00 178.44 178.50 3h5r h LYS 180 N 0.00 0.52 0.03 1.13 1.57 -1.19 -3.22 116.57 115.41 3h5r h LYS 180 Ca 0.00 -0.17 -0.33 0.00 -1.87 0.00 0.00 60.65 58.28 3h5r h LYS 180 Cb 0.97 -0.05 -0.05 0.00 0.08 0.00 0.00 32.23 33.18 3h5r h LYS 180 CO 0.00 0.67 -1.97 0.54 -0.57 0.00 0.00 179.45 178.12 3h5r n ARG 181 N -4.17 0.67 -3.43 3.15 1.74 -0.84 -4.74 116.66 109.04 3h5r n ARG 181 Ca 0.00 0.21 -0.20 0.00 -0.77 0.00 0.00 57.85 57.10 3h5r n ARG 181 Cb 0.36 -1.70 -0.11 0.00 -1.02 0.00 0.00 32.46 29.99 3h5r n ARG 181 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 3h5r s ASN 182 N -6.20 2.10 0.20 0.55 3.84 0.03 -4.93 114.94 110.52 3h5r s ASN 182 Ca -0.12 -1.00 0.24 0.00 0.21 0.00 0.00 52.86 52.18 3h5r s ASN 182 Cb 0.07 0.29 0.91 0.00 -0.55 0.00 0.00 41.25 41.97 3h5r s ASN 182 CO 0.80 -0.39 1.73 -1.54 -2.79 0.00 0.00 177.10 174.90 3h5r n SER 183 N 5.15 0.60 0.11 -4.21 3.41 -1.21 -3.42 113.62 114.05 3h5r n SER 183 Ca -0.01 0.61 -0.03 0.00 -0.26 0.00 0.00 58.87 59.18 3h5r n SER 183 Cb 0.45 -0.75 0.17 0.00 -0.26 0.00 0.00 64.21 63.82 3h5r n SER 183 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 3h5r h GLU 184 N 0.00 0.13 -7.28 4.33 5.08 -1.94 -3.46 114.58 111.44 3h5r h GLU 184 Ca 0.00 -0.09 -0.47 0.00 -1.00 0.00 0.00 59.36 57.80 3h5r h GLU 184 Cb 0.49 0.01 0.07 0.00 0.50 0.00 0.00 28.75 29.82 3h5r h GLU 184 CO 0.00 0.66 0.26 0.96 -1.00 0.00 0.00 179.01 179.90 3h5r s ILE 185 N -3.79 3.18 -0.14 3.13 -4.36 -1.22 -5.08 121.20 112.92 3h5r s ILE 185 Ca -0.03 0.06 -0.00 0.00 -0.26 0.00 0.00 60.65 60.41 3h5r s ILE 185 Cb 0.13 -3.32 -0.01 0.00 1.25 0.00 0.00 42.46 40.50 3h5r s ILE 185 CO 0.78 -0.37 -0.13 -0.55 0.24 0.00 0.00 174.94 174.91 3h5r s SER 186 N -4.39 3.90 -0.06 4.36 0.15 -0.23 -5.02 113.70 112.42 3h5r s SER 186 Ca 0.57 -0.38 0.03 0.00 0.70 0.00 0.00 55.95 56.87 3h5r s SER 186 Cb -0.11 -1.60 0.00 0.00 -1.71 0.00 0.00 66.02 62.60 3h5r s SER 186 CO 0.47 0.12 -0.16 -0.69 1.20 0.00 0.00 173.24 174.19 3h5r s VAL 187 N 0.59 1.35 0.26 4.45 1.01 -1.26 -0.93 120.40 125.88 3h5r s VAL 187 Ca -0.08 -0.64 0.06 0.00 0.00 0.00 0.00 61.98 61.32 3h5r s VAL 187 Cb -0.16 -1.18 -0.06 0.00 0.00 0.00 0.00 36.38 34.98 3h5r s VAL 187 CO 0.03 0.40 -0.04 -0.94 0.00 0.00 0.00 175.10 174.55 3h5r s SER 188 N 0.32 2.45 -0.02 3.32 1.04 -0.59 -5.00 113.70 115.23 3h5r s SER 188 Ca -0.09 -1.20 0.03 0.00 0.48 0.00 0.00 55.95 55.17 3h5r s SER 188 Cb -0.14 -0.11 -0.01 0.00 0.10 0.00 0.00 66.02 65.87 3h5r s SER 188 CO 0.03 -0.40 -0.12 -1.61 0.98 0.00 0.00 173.24 172.13 3h5r s GLU 189 N -3.77 1.03 -0.17 4.02 2.02 -1.26 -0.14 118.70 120.43 3h5r s GLU 189 Ca 0.29 -0.41 0.01 0.00 0.02 0.00 0.00 54.97 54.88 3h5r s GLU 189 Cb 0.04 -0.97 0.01 0.00 0.10 0.00 0.00 34.13 33.31 3h5r s GLU 189 CO 0.11 0.21 -0.18 0.42 0.02 0.00 0.00 175.26 175.84 3h5r s ILE 190 N -0.12 2.27 -1.25 -1.63 1.01 0.13 -4.91 121.20 116.71 3h5r s ILE 190 Ca 0.02 -0.88 -0.20 0.00 0.00 0.00 0.00 60.65 59.59 3h5r s ILE 190 Cb -0.06 -1.95 0.01 0.00 0.01 0.00 0.00 42.46 40.46 3h5r s ILE 190 CO 0.00 0.53 1.81 0.00 0.00 0.00 0.00 174.94 177.27 3h5r s ALA 191 N 1.13 2.73 -0.10 9.38 0.00 -1.26 -1.88 121.76 131.75 3h5r s ALA 191 Ca 0.01 -2.61 -0.11 0.00 0.00 0.00 0.00 51.96 49.25 3h5r s ALA 191 Cb -0.14 -4.66 0.03 0.00 0.00 0.00 0.00 23.12 18.35 3h5r s ALA 191 CO -0.08 -4.04 0.30 -1.17 0.00 0.00 0.00 175.76 170.77 3h5r s LEU 192 N 6.82 0.87 -0.08 0.00 2.96 -1.20 -4.80 118.68 123.24 3h5r s LEU 192 Ca 0.59 0.55 0.04 0.00 -0.22 0.00 0.00 54.13 55.09 3h5r s LEU 192 Cb 0.02 1.04 0.00 0.00 0.50 0.00 0.00 46.19 47.75 3h5r s LEU 192 CO 0.09 -0.14 -0.20 0.20 -1.32 0.00 0.00 176.35 174.99 3h5r s ASN 193 N 0.01 2.63 -0.38 3.68 0.01 -1.26 -2.84 114.94 116.79 3h5r s ASN 193 Ca -0.01 -0.46 -0.29 0.00 -0.71 0.00 0.00 52.86 51.39 3h5r s ASN 193 Cb -0.02 -1.12 0.00 0.00 0.41 0.00 0.00 41.25 40.52 3h5r s ASN 193 CO 0.01 0.13 1.53 -0.63 -1.51 0.00 0.00 177.10 176.63 3h5r s ILE 194 N 0.36 3.77 -0.04 0.60 1.09 -1.26 -4.78 121.20 120.95 3h5r s ILE 194 Ca -0.15 0.79 0.01 0.00 -1.10 0.00 0.00 60.65 60.21 3h5r s ILE 194 Cb -0.16 -4.03 -0.04 0.00 -1.06 0.00 0.00 42.46 37.17 3h5r s ILE 194 CO 0.06 -0.65 -0.02 0.59 -0.10 0.00 0.00 174.94 174.83 3h5r n ASN 195 N 9.23 3.82 -4.89 3.58 3.02 -1.26 -4.28 115.26 124.47 3h5r n ASN 195 Ca 0.18 -0.02 -0.29 0.00 -0.03 0.00 0.00 54.58 54.43 3h5r n ASN 195 Cb 0.48 0.18 -0.03 0.00 -0.61 0.00 0.00 39.78 39.80 3h5r n ASN 195 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 3h5r s ASP 196 N -4.07 6.44 0.39 6.41 1.01 -1.26 -4.99 116.67 120.60 3h5r s ASP 196 Ca -0.05 0.91 0.06 0.00 0.71 0.00 0.00 52.55 54.18 3h5r s ASP 196 Cb 0.01 -2.23 0.78 0.00 1.01 0.00 0.00 42.92 42.49 3h5r s ASP 196 CO 0.12 -0.34 2.02 0.22 0.21 0.00 0.00 175.17 177.40 3h5r h TYR 197 N 1.24 0.56 0.00 4.23 3.20 -1.99 -3.14 116.97 121.07 3h5r h TYR 197 Ca -0.47 -0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.37 3h5r h TYR 197 Cb 1.19 -0.18 -0.00 0.00 1.54 0.00 0.00 36.73 39.27 3h5r h TYR 197 CO 0.59 0.39 -0.14 1.79 -1.64 0.00 0.00 178.16 179.15 3h5r h THR 198 N 0.59 0.58 -0.05 1.81 1.35 -2.00 -2.56 112.91 112.62 3h5r h THR 198 Ca 0.15 -0.63 0.02 0.00 -0.55 0.00 0.00 66.41 65.40 3h5r h THR 198 Cb 0.01 1.41 -0.00 0.00 -1.73 0.00 0.00 68.15 67.84 3h5r h THR 198 CO -0.03 0.14 0.26 0.44 -0.25 0.00 0.00 175.52 176.08 3h5r h ASP 199 N 0.00 0.00 0.71 5.36 3.32 -1.95 -2.59 116.42 121.27 3h5r h ASP 199 Ca -0.00 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.99 3h5r h ASP 199 Cb 0.40 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.94 3h5r h ASP 199 CO 0.02 0.00 -0.30 -0.07 -1.72 0.00 0.00 179.24 177.17 3h5r h LEU 200 N 0.00 0.00 -2.92 1.55 3.38 -1.66 -1.90 115.31 113.75 3h5r h LEU 200 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3h5r h LEU 200 Cb 0.54 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.29 3h5r h LEU 200 CO -0.00 0.30 0.01 0.45 0.09 0.00 0.00 178.44 179.29 3h5r h HIS 201 N 0.00 0.00 0.00 1.13 3.86 -1.70 -0.21 115.15 118.23 3h5r h HIS 201 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 3h5r h HIS 201 Cb 0.74 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.21 3h5r h HIS 201 CO 0.00 0.00 -0.05 0.87 0.86 0.00 0.00 177.93 179.61 3h5r h LYS 202 N 0.00 0.00 -6.16 2.45 1.57 -1.54 -3.44 116.57 109.46 3h5r h LYS 202 Ca 0.00 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 58.21 3h5r h LYS 202 Cb 0.03 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.29 3h5r h LYS 202 CO -0.00 0.00 0.77 0.08 -0.57 0.00 0.00 179.45 179.73 3h5r s VAL 203 N -3.17 4.54 0.55 0.50 1.01 -0.09 -5.03 120.40 118.72 3h5r s VAL 203 Ca 0.08 1.85 -0.19 0.00 0.00 0.00 0.00 61.98 63.72 3h5r s VAL 203 Cb 0.08 -4.19 -0.06 0.00 0.00 0.00 0.00 36.38 32.21 3h5r s VAL 203 CO 0.65 -0.11 1.12 -2.16 0.00 0.00 0.00 175.10 174.60 3h5r s PRO 204 N 2.92 3.34 0.53 2.72 0.04 -1.26 -5.01 135.00 138.28 3h5r s PRO 204 Ca 0.49 1.57 -0.22 0.00 0.04 0.00 0.00 61.00 62.88 3h5r s PRO 204 Cb -0.19 -2.01 -0.05 0.00 0.04 0.00 0.00 34.50 32.29 3h5r s PRO 204 CO 0.13 -0.85 1.32 -1.83 0.04 0.00 0.00 177.00 175.81 3h5r s GLU 205 N -3.36 3.25 0.25 4.56 -1.05 -1.26 -4.96 118.70 116.13 3h5r s GLU 205 Ca 0.72 2.15 -0.10 0.00 -0.15 0.00 0.00 54.97 57.58 3h5r s GLU 205 Cb -0.23 -2.28 -0.01 0.00 -0.44 0.00 0.00 34.13 31.17 3h5r s GLU 205 CO 0.28 -1.08 0.44 0.00 0.95 0.00 0.00 175.26 175.85 3h5r s ALA 206 N -1.35 0.02 0.32 -0.84 0.00 -1.26 -5.01 121.76 113.64 3h5r s ALA 206 Ca 0.70 -1.04 0.04 0.00 0.00 0.00 0.00 51.96 51.66 3h5r s ALA 206 Cb -0.38 1.11 0.66 0.00 0.00 0.00 0.00 23.12 24.51 3h5r s ALA 206 CO 0.45 -0.82 1.87 -0.44 0.00 0.00 0.00 175.76 176.82 3h5r h ASP 207 N 2.28 0.80 -4.78 0.00 3.32 -1.48 -3.44 116.42 113.11 3h5r h ASP 207 Ca -0.28 0.04 -0.06 0.00 0.02 0.00 0.00 57.03 56.75 3h5r h ASP 207 Cb 1.25 -0.13 -0.19 0.00 0.22 0.00 0.00 39.33 40.48 3h5r h ASP 207 CO 0.38 0.44 0.16 -0.51 -1.72 0.00 0.00 179.24 177.99 3h5r s ILE 208 N -5.82 0.00 -0.18 0.35 2.07 -1.23 -4.48 121.20 111.91 3h5r s ILE 208 Ca -0.11 -0.01 -0.08 0.00 -1.41 0.00 0.00 60.65 59.03 3h5r s ILE 208 Cb 0.22 -0.99 -0.04 0.00 0.13 0.00 0.00 42.46 41.77 3h5r s ILE 208 CO 0.80 -0.01 0.10 0.26 -1.91 0.00 0.00 174.94 174.18 3h5r s TRP 209 N -0.85 3.35 -0.39 3.50 0.52 -0.28 -1.97 118.94 122.81 3h5r s TRP 209 Ca -0.09 0.23 -0.17 0.00 0.02 0.00 0.00 56.10 56.10 3h5r s TRP 209 Cb -0.01 -2.10 0.01 0.00 -1.15 0.00 0.00 33.47 30.22 3h5r s TRP 209 CO 0.08 0.27 0.42 0.08 0.02 0.00 0.00 176.95 177.83 3h5r s VAL 210 N 0.22 5.10 -0.32 4.03 1.01 0.10 -0.10 120.40 130.44 3h5r s VAL 210 Ca 0.06 -0.12 -0.07 0.00 0.00 0.00 0.00 61.98 61.86 3h5r s VAL 210 Cb -0.12 -3.96 0.02 0.00 0.00 0.00 0.00 36.38 32.33 3h5r s VAL 210 CO -0.01 -0.29 0.09 -0.69 0.00 0.00 0.00 175.10 174.21 3h5r s VAL 211 N 2.14 3.87 0.00 2.92 1.01 0.17 -0.11 120.40 130.41 3h5r s VAL 211 Ca 0.13 -0.91 0.00 0.00 0.00 0.00 0.00 61.98 61.19 3h5r s VAL 211 Cb -0.17 -3.10 0.00 0.00 0.00 0.00 0.00 36.38 33.12 3h5r s VAL 211 CO 0.13 -0.05 0.00 -1.54 0.00 0.00 0.00 175.10 173.64 3h5r n SER 212 N 4.84 3.11 -4.68 3.32 3.41 -0.73 -2.00 113.62 120.89 3h5r n SER 212 Ca -0.13 0.00 -0.53 0.00 -0.26 0.00 0.00 58.87 57.95 3h5r n SER 212 Cb 0.46 0.57 -0.06 0.00 -0.26 0.00 0.00 64.21 64.92 3h5r n SER 212 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3h5r n ALA 213 N -1.02 0.43 0.70 7.33 0.00 -1.08 -4.85 120.51 122.02 3h5r n ALA 213 Ca 0.00 0.30 0.12 0.00 0.00 0.00 0.00 53.44 53.86 3h5r n ALA 213 Cb 0.05 -2.39 0.26 0.00 0.00 0.00 0.00 19.45 17.38 3h5r n ALA 213 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3h5r n ASP 214 N 6.40 0.62 -4.53 0.00 5.68 -1.26 -4.83 116.55 118.63 3h5r n ASP 214 Ca 0.26 0.16 -0.34 0.00 -0.50 0.00 0.00 54.79 54.37 3h5r n ASP 214 Cb 0.22 -0.03 -0.12 0.00 -1.14 0.00 0.00 41.12 40.05 3h5r n ASP 214 CO 0.00 0.00 0.00 -1.00 -1.33 0.00 0.00 177.20 174.87 3h5r s HIS 215 N -3.11 3.03 1.03 2.11 4.02 -1.26 -3.46 115.29 117.66 3h5r s HIS 215 Ca 0.09 -0.20 -0.14 0.00 1.02 0.00 0.00 55.06 55.82 3h5r s HIS 215 Cb 0.14 -1.92 0.21 0.00 -1.02 0.00 0.00 32.58 29.99 3h5r s HIS 215 CO 0.68 0.06 1.11 -1.25 1.02 0.00 0.00 174.74 176.37 3h5r s PRO 216 N 0.10 0.14 0.29 8.40 0.04 -1.26 -4.79 135.00 137.92 3h5r s PRO 216 Ca -0.00 0.30 0.04 0.00 0.04 0.00 0.00 61.00 61.37 3h5r s PRO 216 Cb -0.13 -1.72 0.73 0.00 0.04 0.00 0.00 34.50 33.41 3h5r s PRO 216 CO 0.03 -2.88 1.71 0.27 0.04 0.00 0.00 177.00 176.17 3h5r h PHE 217 N -1.99 0.73 -0.97 0.56 -0.00 -1.97 -0.74 116.94 112.55 3h5r h PHE 217 Ca -0.52 0.04 -0.54 0.00 -0.00 0.00 0.00 57.97 56.95 3h5r h PHE 217 Cb 1.32 -0.18 -0.30 0.00 -0.00 0.00 0.00 35.95 36.80 3h5r h PHE 217 CO -0.29 0.00 0.66 0.27 -0.00 0.00 0.00 178.31 178.96 3h5r n ASN 218 N -5.00 4.55 -0.03 -0.68 6.94 -1.26 -4.53 115.26 115.25 3h5r n ASN 218 Ca 0.22 -3.66 -0.09 0.00 -0.02 0.00 0.00 54.58 51.04 3h5r n ASN 218 Cb 0.64 -0.86 -0.03 0.00 -2.36 0.00 0.00 39.78 37.17 3h5r n ASN 218 CO 0.00 0.00 0.00 0.25 -1.03 0.00 0.00 177.26 176.48 3h5r h LEU 219 N 1.22 -0.20 -1.58 -4.53 5.85 -1.41 -2.85 115.31 111.81 3h5r h LEU 219 Ca 0.61 0.06 0.04 0.00 0.84 0.00 0.00 57.88 59.43 3h5r h LEU 219 Cb 2.37 0.12 -0.03 0.00 0.37 0.00 0.00 40.66 43.50 3h5r h LEU 219 CO 1.18 -0.07 0.34 -0.29 -0.34 0.00 0.00 178.44 179.25 3h5r h ILE 220 N -0.01 1.03 -0.47 4.05 6.09 -1.84 -0.70 117.51 125.67 3h5r h ILE 220 Ca 0.09 -0.18 -0.10 0.00 -1.37 0.00 0.00 64.86 63.30 3h5r h ILE 220 Cb 0.15 0.45 -0.02 0.00 0.47 0.00 0.00 36.82 37.87 3h5r h ILE 220 CO -0.20 0.10 -0.11 0.78 -3.07 0.00 0.00 178.15 175.65 3h5r h ASN 221 N 0.54 0.85 -0.12 2.19 4.21 -1.85 0.30 115.58 121.69 3h5r h ASN 221 Ca 0.21 -0.26 -0.11 0.00 1.21 0.00 0.00 56.30 57.34 3h5r h ASN 221 Cb 0.15 -0.23 0.00 0.00 -1.12 0.00 0.00 38.32 37.13 3h5r h ASN 221 CO -0.05 0.98 -0.36 -0.50 -1.29 0.00 0.00 177.43 176.21 3h5r h TRP 222 N 0.77 0.60 -0.15 1.19 6.55 -1.22 -1.44 115.95 122.24 3h5r h TRP 222 Ca 0.13 -0.24 0.04 0.00 0.95 0.00 0.00 58.89 59.76 3h5r h TRP 222 Cb 0.62 -0.10 -0.04 0.00 -0.86 0.00 0.00 29.16 28.78 3h5r h TRP 222 CO 0.04 0.97 -0.07 0.28 -1.05 0.00 0.00 178.44 178.60 3h5r h VAL 223 N 0.05 0.76 0.01 1.49 2.07 -0.99 0.52 116.25 120.17 3h5r h VAL 223 Ca -0.01 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.52 3h5r h VAL 223 Cb 0.97 0.76 -0.01 0.00 -1.52 0.00 0.00 31.29 31.49 3h5r h VAL 223 CO 0.08 0.00 -0.05 -1.13 0.02 0.00 0.00 177.57 176.48 3h5r h ASN 224 N -0.06 -0.15 -0.64 0.57 -1.24 -0.43 0.58 115.58 114.20 3h5r h ASN 224 Ca 0.08 0.02 0.07 0.00 0.71 0.00 0.00 56.30 57.19 3h5r h ASN 224 Cb 0.18 0.06 -0.06 0.00 0.73 0.00 0.00 38.32 39.24 3h5r h ASN 224 CO -0.19 -0.08 0.32 0.50 -1.29 0.00 0.00 177.43 176.69 3h5r h LYS 225 N -0.10 0.56 -0.47 6.67 3.64 -1.11 -1.71 116.57 124.05 3h5r h LYS 225 Ca 0.02 -0.03 -0.10 0.00 -1.27 0.00 0.00 60.65 59.27 3h5r h LYS 225 Cb 0.12 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 31.80 3h5r h LYS 225 CO -0.05 0.37 -0.08 -0.92 -2.27 0.00 0.00 179.45 176.50 3h5r h TYR 226 N 0.58 0.99 -0.03 1.91 3.20 -0.55 -2.66 116.97 120.41 3h5r h TYR 226 Ca 0.30 -0.20 -0.22 0.00 3.14 0.00 0.00 58.73 61.76 3h5r h TYR 226 Cb 0.27 -0.25 0.00 0.00 1.54 0.00 0.00 36.73 38.30 3h5r h TYR 226 CO -0.11 0.96 -0.89 0.00 -1.64 0.00 0.00 178.16 176.48 3h5r h VAL 228 N 0.28 1.08 -0.56 0.00 2.07 -1.34 0.92 116.25 118.70 3h5r h VAL 228 Ca -0.07 -0.17 -0.06 0.00 0.82 0.00 0.00 66.70 67.22 3h5r h VAL 228 Cb 1.51 0.69 -0.03 0.00 -1.52 0.00 0.00 31.29 31.94 3h5r h VAL 228 CO 0.16 0.08 0.11 0.03 0.02 0.00 0.00 177.57 177.97 3h5r h ARG 229 N 0.38 0.88 -0.26 1.57 3.08 -1.30 -3.15 114.38 115.57 3h5r h ARG 229 Ca 0.10 -0.20 0.00 0.00 0.07 0.00 0.00 59.98 59.96 3h5r h ARG 229 Cb -0.02 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 29.90 3h5r h ARG 229 CO -0.02 0.81 0.00 0.00 -1.07 0.00 0.00 179.97 179.69 3h5r n ALA 230 N -2.46 2.48 -4.05 0.04 0.00 0.23 -4.93 120.51 111.81 3h5r n ALA 230 Ca 0.04 -0.57 -0.29 0.00 0.00 0.00 0.00 53.44 52.62 3h5r n ALA 230 Cb 0.25 -1.03 -0.02 0.00 0.00 0.00 0.00 19.45 18.64 3h5r n ALA 230 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3h5r n ASN 231 N 0.42 -1.28 -4.20 0.00 5.03 -0.61 -4.98 115.26 109.65 3h5r n ASN 231 Ca 0.14 -1.01 -0.35 0.00 0.87 0.00 0.00 54.58 54.23 3h5r n ASN 231 Cb 0.31 -2.93 -0.14 0.00 -1.02 0.00 0.00 39.78 36.00 3h5r n ASN 231 CO 0.00 0.00 0.00 -1.58 -1.83 0.00 0.00 177.26 173.85 3h5r s GLN 232 N -6.71 2.70 0.45 3.52 2.00 0.22 -4.88 119.66 116.97 3h5r s GLN 232 Ca 0.24 -1.08 -0.24 0.00 -2.00 0.00 0.00 55.36 52.28 3h5r s GLN 232 Cb -0.13 -3.10 -0.09 0.00 0.80 0.00 0.00 33.01 30.49 3h5r s GLN 232 CO 0.90 -0.49 1.21 -2.30 -0.50 0.00 0.00 175.29 174.11 3h5r n PRO 233 N 4.67 1.71 -3.75 1.67 -0.02 -1.26 -4.65 135.00 133.37 3h5r n PRO 233 Ca -0.15 0.61 -0.11 0.00 -2.02 0.00 0.00 63.50 61.83 3h5r n PRO 233 Cb 0.46 -2.33 -0.07 0.00 -0.02 0.00 0.00 33.50 31.53 3h5r n PRO 233 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 3h5r s TYR 234 N -1.25 -0.10 -0.02 6.00 -0.85 -1.15 -1.13 117.35 118.85 3h5r s TYR 234 Ca 0.64 -0.06 0.05 0.00 -0.52 0.00 0.00 57.07 57.18 3h5r s TYR 234 Cb -0.50 0.10 -0.01 0.00 0.38 0.00 0.00 41.96 41.94 3h5r s TYR 234 CO 0.56 -0.52 -0.17 -1.50 -1.52 0.00 0.00 175.55 172.40 3h5r s ILE 235 N -2.72 1.33 -0.11 -3.49 2.07 0.86 -1.00 121.20 118.13 3h5r s ILE 235 Ca -0.04 -0.71 -0.06 0.00 -1.41 0.00 0.00 60.65 58.43 3h5r s ILE 235 Cb -0.00 -1.11 -0.04 0.00 0.13 0.00 0.00 42.46 41.44 3h5r s ILE 235 CO -0.04 0.38 0.13 0.21 -1.91 0.00 0.00 174.94 173.70 3h5r s ASN 236 N -0.35 6.28 0.07 4.50 3.04 -1.12 0.46 114.94 127.82 3h5r s ASN 236 Ca 0.05 0.44 -0.08 0.00 0.04 0.00 0.00 52.86 53.31 3h5r s ASN 236 Cb -0.07 -2.01 -0.00 0.00 -1.54 0.00 0.00 41.25 37.62 3h5r s ASN 236 CO -0.00 0.40 0.17 0.00 -3.04 0.00 0.00 177.10 174.63 3h5r s ALA 237 N -1.02 -0.18 0.00 1.71 0.00 -0.85 -0.18 121.76 121.24 3h5r s ALA 237 Ca 0.15 -0.60 0.00 0.00 0.00 0.00 0.00 51.96 51.51 3h5r s ALA 237 Cb -0.12 0.42 0.00 0.00 0.00 0.00 0.00 23.12 23.42 3h5r s ALA 237 CO 0.04 -0.46 0.00 0.41 0.00 0.00 0.00 175.76 175.75 3h5r n GLY 238 N 0.14 -0.56 3.46 0.00 0.00 -0.12 -4.34 105.19 103.77 3h5r n GLY 238 Ca -0.16 -0.77 -0.13 0.00 0.00 0.00 0.00 46.02 44.96 3h5r n GLY 238 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3h5r s TYR 239 N -3.20 -0.55 -0.42 1.61 1.13 -1.26 -0.91 117.35 113.74 3h5r s TYR 239 Ca 0.00 0.55 0.03 0.00 -1.41 0.00 0.00 57.07 56.24 3h5r s TYR 239 Cb 0.00 0.51 0.12 0.00 -1.10 0.00 0.00 41.96 41.49 3h5r s TYR 239 CO 0.00 -0.74 0.17 0.08 -2.51 0.00 0.00 175.55 172.54 3h5r s VAL 240 N -2.92 2.11 0.00 -3.49 1.01 0.19 -4.93 120.40 112.36 3h5r s VAL 240 Ca -0.02 -2.66 0.00 0.00 0.00 0.00 0.00 61.98 59.30 3h5r s VAL 240 Cb -0.01 -2.51 0.00 0.00 0.00 0.00 0.00 36.38 33.86 3h5r s VAL 240 CO -0.06 -0.73 0.00 0.59 0.00 0.00 0.00 175.10 174.90 3h5r n ASN 241 N 3.75 0.00 -0.11 3.32 3.02 -1.26 -1.56 115.26 122.42 3h5r n ASN 241 Ca 0.04 0.00 0.15 0.00 -0.03 0.00 0.00 54.58 54.75 3h5r n ASN 241 Cb 0.37 0.00 0.84 0.00 -0.61 0.00 0.00 39.78 40.37 3h5r n ASN 241 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 3h5r n ASP 242 N 8.32 0.36 -4.62 6.41 5.68 -1.26 -4.74 116.55 126.70 3h5r n ASP 242 Ca 0.00 -1.07 -0.35 0.00 -0.50 0.00 0.00 54.79 52.86 3h5r n ASP 242 Cb 0.00 -0.01 -0.10 0.00 -1.14 0.00 0.00 41.12 39.87 3h5r n ASP 242 CO 0.00 0.00 0.00 -0.63 -1.33 0.00 0.00 177.20 175.24 3h5r s ILE 243 N -2.03 4.93 -0.01 2.12 1.01 -0.60 -2.77 121.20 123.85 3h5r s ILE 243 Ca 0.44 0.02 -0.23 0.00 0.00 0.00 0.00 60.65 60.89 3h5r s ILE 243 Cb 0.22 -3.26 -0.05 0.00 0.01 0.00 0.00 42.46 39.38 3h5r s ILE 243 CO 0.37 0.40 0.69 0.00 0.00 0.00 0.00 174.94 176.41 3h5r s ALA 244 N 0.77 3.39 -0.06 9.38 0.00 -0.06 -0.64 121.76 134.54 3h5r s ALA 244 Ca 0.05 0.16 0.03 0.00 0.00 0.00 0.00 51.96 52.20 3h5r s ALA 244 Cb -0.13 -2.91 0.01 0.00 0.00 0.00 0.00 23.12 20.09 3h5r s ALA 244 CO 0.02 0.04 -0.15 0.08 0.00 0.00 0.00 175.76 175.75 3h5r s VAL 245 N 0.20 1.30 0.02 0.00 1.01 -0.09 -0.56 120.40 122.27 3h5r s VAL 245 Ca 0.36 -0.59 -0.03 0.00 0.00 0.00 0.00 61.98 61.72 3h5r s VAL 245 Cb -0.19 -1.16 -0.01 0.00 0.00 0.00 0.00 36.38 35.02 3h5r s VAL 245 CO 0.20 0.39 0.03 0.72 0.00 0.00 0.00 175.10 176.44 3h5r s PHE 246 N 0.49 0.20 0.00 5.22 -0.71 -0.46 -0.95 117.98 121.77 3h5r s PHE 246 Ca -0.13 -0.44 0.00 0.00 -1.04 0.00 0.00 56.93 55.32 3h5r s PHE 246 Cb -0.15 -0.15 0.00 0.00 -1.21 0.00 0.00 43.02 41.51 3h5r s PHE 246 CO 0.04 -0.25 0.00 0.41 -1.34 0.00 0.00 175.22 174.08 3h5r n GLY 247 N 1.38 1.39 3.83 1.99 0.00 0.75 -0.54 105.19 113.99 3h5r n GLY 247 Ca -0.23 -1.83 -0.32 0.00 0.00 0.00 0.00 46.02 43.65 3h5r n GLY 247 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3h5r s PRO 248 N -2.97 3.43 -0.46 1.61 0.04 -1.20 -4.50 135.00 130.95 3h5r s PRO 248 Ca 0.00 0.99 -0.18 0.00 0.04 0.00 0.00 61.00 61.85 3h5r s PRO 248 Cb 0.00 -2.06 0.04 0.00 0.04 0.00 0.00 34.50 32.52 3h5r s PRO 248 CO 0.00 -0.71 0.50 -1.17 0.04 0.00 0.00 177.00 175.66 3h5r s LEU 249 N -4.80 4.98 -0.14 -3.56 2.96 -0.48 -2.78 118.68 114.85 3h5r s LEU 249 Ca 0.59 -0.82 -0.22 0.00 -0.22 0.00 0.00 54.13 53.47 3h5r s LEU 249 Cb -0.13 -2.40 -0.03 0.00 0.50 0.00 0.00 46.19 44.13 3h5r s LEU 249 CO 0.44 -0.70 0.66 -0.47 -1.32 0.00 0.00 176.35 174.95 3h5r s TYR 250 N 2.26 3.46 -0.22 5.38 5.04 -0.17 -4.33 117.35 128.78 3h5r s TYR 250 Ca 0.13 1.07 0.01 0.00 -2.44 0.00 0.00 57.07 55.83 3h5r s TYR 250 Cb -0.18 -2.79 0.05 0.00 0.35 0.00 0.00 41.96 39.38 3h5r s TYR 250 CO 0.12 -0.05 -0.06 0.08 -1.34 0.00 0.00 175.55 174.30 3h5r s VAL 251 N 1.42 1.49 -0.01 3.14 1.01 -1.26 -2.94 120.40 123.24 3h5r s VAL 251 Ca 0.32 -1.09 -0.38 0.00 0.00 0.00 0.00 61.98 60.83 3h5r s VAL 251 Cb -0.16 -1.70 -0.17 0.00 0.00 0.00 0.00 36.38 34.35 3h5r s VAL 251 CO 0.13 -0.02 1.44 -2.65 0.00 0.00 0.00 175.10 174.01 3h5r n PRO 252 N 4.70 1.12 -0.51 2.72 -0.02 -1.26 -1.51 135.00 140.24 3h5r n PRO 252 Ca -0.13 0.41 0.00 0.00 -2.02 0.00 0.00 63.50 61.76 3h5r n PRO 252 Cb 0.45 -2.06 0.00 0.00 -0.02 0.00 0.00 33.50 31.87 3h5r n PRO 252 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3h5r n GLY 253 N 2.94 1.52 0.70 -1.23 0.00 -1.26 -4.76 105.19 103.11 3h5r n GLY 253 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 3h5r n GLY 253 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3h5r n LYS 254 N -2.00 0.00 -3.63 1.61 4.81 -0.60 -5.08 118.16 113.26 3h5r n LYS 254 Ca 0.00 0.00 -0.23 0.00 -0.87 0.00 0.00 58.31 57.21 3h5r n LYS 254 Cb 0.00 -0.65 -0.01 0.00 0.02 0.00 0.00 35.03 34.39 3h5r n LYS 254 CO 0.00 0.00 0.00 0.95 1.17 0.00 0.00 177.40 179.52 3h5r s THR 255 N -1.99 2.23 0.82 3.15 -4.23 -0.57 -4.93 115.64 110.11 3h5r s THR 255 Ca 0.00 -1.37 -0.12 0.00 -1.18 0.00 0.00 61.69 59.02 3h5r s THR 255 Cb 0.00 -2.60 0.09 0.00 1.34 0.00 0.00 72.50 71.33 3h5r s THR 255 CO 0.00 0.00 1.15 -0.83 -0.54 0.00 0.00 174.62 174.40 3h5r s GLY 256 N -4.24 1.60 0.53 3.99 0.00 -1.22 -4.62 107.32 103.36 3h5r s GLY 256 Ca 0.45 -0.52 0.06 0.00 0.00 0.00 0.00 44.72 44.71 3h5r s GLY 256 CO 0.27 -0.03 0.45 0.00 0.00 0.00 0.00 173.10 173.78 3h5r h TYR 258 N 0.72 0.00 -0.00 0.00 3.20 -1.93 -2.23 116.97 116.72 3h5r h TYR 258 Ca -0.36 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.51 3h5r h TYR 258 Cb 1.29 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.56 3h5r h TYR 258 CO 0.83 0.00 -0.81 -1.91 -1.64 0.00 0.00 178.16 174.64 3h5r n GLU 259 N -4.07 0.19 -0.18 1.82 4.07 -1.26 -4.44 120.64 116.77 3h5r n GLU 259 Ca 0.07 -0.15 -0.04 0.00 -0.06 0.00 0.00 57.16 56.99 3h5r n GLU 259 Cb 0.54 -1.50 0.06 0.00 -0.06 0.00 0.00 31.44 30.48 3h5r n GLU 259 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 3h5r s GLN 261 N -6.12 2.88 -0.30 0.00 -1.52 -1.26 -4.68 119.66 108.65 3h5r s GLN 261 Ca -0.13 -2.96 -0.13 0.00 -1.95 0.00 0.00 55.36 50.19 3h5r s GLN 261 Cb 0.14 -3.80 0.17 0.00 -0.22 0.00 0.00 33.01 29.30 3h5r s GLN 261 CO 0.74 -1.23 0.97 0.15 -0.25 0.00 0.00 175.29 175.67 3h5r s LYS 262 N -0.80 0.29 -0.27 2.91 3.01 -1.23 -5.00 119.74 118.64 3h5r s LYS 262 Ca 0.22 0.64 0.21 0.00 -1.01 0.00 0.00 55.97 56.04 3h5r s LYS 262 Cb -0.13 0.38 0.49 0.00 -1.01 0.00 0.00 37.83 37.56 3h5r s LYS 262 CO -0.09 -0.19 1.19 1.33 0.51 0.00 0.00 175.35 178.10 3h5r n VAL 263 N 5.18 1.04 -3.51 3.17 0.24 -1.26 -5.02 118.33 118.17 3h5r n VAL 263 Ca -0.08 -2.57 -0.32 0.00 -2.04 0.00 0.00 64.34 59.34 3h5r n VAL 263 Cb 0.53 1.25 -0.05 0.00 -1.47 0.00 0.00 33.84 34.10 3h5r n VAL 263 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 3h5r s SER 270 N -3.33 6.57 0.00 -1.34 0.15 -1.26 -5.27 113.70 109.22 3h5r s SER 270 Ca 0.24 0.80 -0.01 0.00 0.70 0.00 0.00 55.95 57.68 3h5r s SER 270 Cb 0.34 -2.17 -0.26 0.00 -1.71 0.00 0.00 66.02 62.21 3h5r s SER 270 CO -0.06 -0.03 0.84 1.05 1.20 0.00 0.00 173.24 176.25 3h5r h GLU 271 N 2.63 0.20 -6.26 5.44 9.09 -2.00 -3.43 114.58 120.24 3h5r h GLU 271 Ca -0.47 -0.34 -0.55 0.00 0.05 0.00 0.00 59.36 58.05 3h5r h GLU 271 Cb 1.17 0.13 -0.02 0.00 -1.65 0.00 0.00 28.75 28.37 3h5r h GLU 271 CO 0.70 1.04 0.87 0.15 0.05 0.00 0.00 179.01 181.82 3h5r s LYS 272 N -2.62 4.26 0.30 1.06 3.01 -1.26 -4.92 119.74 119.57 3h5r s LYS 272 Ca -0.08 1.83 0.15 0.00 -1.01 0.00 0.00 55.97 56.85 3h5r s LYS 272 Cb 0.07 -3.70 0.35 0.00 -1.01 0.00 0.00 37.83 33.54 3h5r s LYS 272 CO 0.84 -0.64 1.58 1.49 0.51 0.00 0.00 175.35 179.14 3h5r h GLU 273 N 8.14 0.00 0.00 1.68 4.57 -1.98 -0.00 114.58 126.98 3h5r h GLU 273 Ca -0.33 0.00 -0.07 0.00 -1.18 0.00 0.00 59.36 57.78 3h5r h GLU 273 Cb 1.15 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.73 3h5r h GLU 273 CO 0.93 0.55 -0.31 -2.95 -1.18 0.00 0.00 179.01 176.04 3h5r h ASN 274 N 0.00 0.00 0.14 1.04 -1.07 -1.98 -2.17 115.58 111.54 3h5r h ASN 274 Ca -0.01 0.00 -0.35 0.00 0.07 0.00 0.00 56.30 56.02 3h5r h ASN 274 Cb 1.17 0.00 -0.06 0.00 -2.07 0.00 0.00 38.32 37.36 3h5r h ASN 274 CO 0.07 0.31 -2.19 2.30 0.07 0.00 0.00 177.43 177.99 3h5r n ILE 275 N -3.92 1.46 -0.26 6.14 -5.35 -1.09 -4.01 119.36 112.32 3h5r n ILE 275 Ca -0.02 -0.84 0.09 0.00 -0.27 0.00 0.00 62.75 61.72 3h5r n ILE 275 Cb 0.38 -0.64 0.34 0.00 -1.74 0.00 0.00 39.64 37.98 3h5r n ILE 275 CO 0.00 0.00 0.00 -0.78 -1.76 0.00 0.00 176.55 174.01 3h5r h ASP 276 N 0.00 0.71 0.33 7.28 3.58 -0.92 -0.46 116.42 126.95 3h5r h ASP 276 Ca -0.47 0.03 -0.10 0.00 0.42 0.00 0.00 57.03 56.90 3h5r h ASP 276 Cb 2.18 -0.12 -0.01 0.00 1.72 0.00 0.00 39.33 43.10 3h5r h ASP 276 CO 0.04 0.40 -0.44 1.12 -2.88 0.00 0.00 179.24 177.48 3h5r h HIS 277 N 0.77 0.17 -0.18 0.28 2.07 -1.56 -2.04 115.15 114.66 3h5r h HIS 277 Ca 0.42 -0.05 -0.11 0.00 -2.85 0.00 0.00 60.37 57.77 3h5r h HIS 277 Cb 0.54 -0.04 0.00 0.00 2.57 0.00 0.00 27.41 30.48 3h5r h HIS 277 CO -0.00 0.56 -0.33 0.87 -3.07 0.00 0.00 177.93 175.96 3h5r h LYS 278 N 0.12 0.54 -0.76 5.12 1.57 -1.37 -2.50 116.57 119.30 3h5r h LYS 278 Ca 0.01 -0.34 0.07 0.00 -1.87 0.00 0.00 60.65 58.51 3h5r h LYS 278 Cb 0.83 0.04 -0.06 0.00 0.08 0.00 0.00 32.23 33.12 3h5r h LYS 278 CO 0.06 0.95 0.44 0.82 -0.57 0.00 0.00 179.45 181.16 3h5r h ILE 279 N 0.20 0.97 -0.16 1.86 2.04 -1.10 -1.67 117.51 119.65 3h5r h ILE 279 Ca 0.01 -0.27 -0.15 0.00 1.00 0.00 0.00 64.86 65.44 3h5r h ILE 279 Cb 0.92 0.11 -0.01 0.00 -0.74 0.00 0.00 36.82 37.11 3h5r h ILE 279 CO 0.07 0.14 -0.55 0.11 0.00 0.00 0.00 178.15 177.93 3h5r h LYS 280 N 0.79 0.48 0.22 2.37 1.57 -1.21 -0.67 116.57 120.12 3h5r h LYS 280 Ca 0.34 -0.30 -0.01 0.00 -1.87 0.00 0.00 60.65 58.81 3h5r h LYS 280 Cb 0.22 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.57 3h5r h LYS 280 CO -0.20 0.90 -0.11 1.25 -0.57 0.00 0.00 179.45 180.73 3h5r h LEU 281 N 0.37 -0.25 -0.52 2.94 5.85 -1.30 0.60 115.31 123.01 3h5r h LEU 281 Ca 0.01 -0.18 0.10 0.00 0.84 0.00 0.00 57.88 58.65 3h5r h LEU 281 Cb 1.07 0.06 -0.10 0.00 0.37 0.00 0.00 40.66 42.07 3h5r h LEU 281 CO 0.10 0.05 -0.11 0.40 -0.34 0.00 0.00 178.44 178.53 3h5r h ILE 282 N -0.56 0.50 -0.02 4.05 2.04 -1.30 -1.52 117.51 120.70 3h5r h ILE 282 Ca -0.03 -0.00 -0.10 0.00 1.00 0.00 0.00 64.86 65.73 3h5r h ILE 282 Cb 0.41 0.48 -0.01 0.00 -0.74 0.00 0.00 36.82 36.96 3h5r h ILE 282 CO 0.05 0.00 -0.45 0.78 0.00 0.00 0.00 178.15 178.53 3h5r h ASN 283 N 0.01 0.04 0.45 1.72 2.35 -1.10 -2.92 115.58 116.14 3h5r h ASN 283 Ca 0.25 -0.02 -0.07 0.00 -0.55 0.00 0.00 56.30 55.91 3h5r h ASN 283 Cb 0.38 -0.01 -0.01 0.00 0.05 0.00 0.00 38.32 38.73 3h5r h ASN 283 CO -0.52 0.49 -0.33 0.77 -1.65 0.00 0.00 177.43 176.19 3h5r h SER 284 N 0.04 0.00 0.72 5.81 4.64 0.08 -2.72 113.55 122.11 3h5r h SER 284 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3h5r h SER 284 Cb 0.81 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.90 3h5r h SER 284 CO 0.06 0.33 -0.09 -1.14 -0.87 0.00 0.00 176.83 175.12 3h5r n ARG 285 N -3.92 0.21 -1.74 4.77 0.63 -0.70 -4.93 116.66 110.99 3h5r n ARG 285 Ca -0.02 -0.04 -0.42 0.00 -0.92 0.00 0.00 57.85 56.45 3h5r n ARG 285 Cb 0.39 -1.50 -0.02 0.00 0.45 0.00 0.00 32.46 31.79 3h5r n ARG 285 CO 0.00 0.00 0.00 0.34 -2.51 0.00 0.00 177.63 175.46 3h5r n PHE 286 N -1.36 2.80 -3.80 -0.14 7.35 -1.03 -5.02 117.46 116.26 3h5r n PHE 286 Ca 0.10 0.21 -0.17 0.00 -0.76 0.00 0.00 57.45 56.83 3h5r n PHE 286 Cb 0.31 -2.61 -0.16 0.00 0.35 0.00 0.00 39.48 37.36 3h5r n PHE 286 CO 0.00 0.00 0.00 0.15 -0.76 0.00 0.00 176.76 176.15 3h5r s LYS 287 N -0.07 0.07 0.46 -4.13 3.01 -1.26 -5.10 119.74 112.71 3h5r s LYS 287 Ca 0.67 0.18 -0.24 0.00 -1.01 0.00 0.00 55.97 55.57 3h5r s LYS 287 Cb -0.51 -0.38 -0.07 0.00 -1.01 0.00 0.00 37.83 35.86 3h5r s LYS 287 CO 0.44 -0.19 1.27 -2.14 0.51 0.00 0.00 175.35 175.24 3h5r s PRO 288 N 1.26 3.71 -1.49 -1.68 0.02 -1.26 -4.86 135.00 130.69 3h5r s PRO 288 Ca -0.07 2.04 -0.12 0.00 0.02 0.00 0.00 61.00 62.87 3h5r s PRO 288 Cb -0.13 -2.52 -0.04 0.00 0.02 0.00 0.00 34.50 31.83 3h5r s PRO 288 CO -0.03 -0.67 2.58 0.00 -0.33 0.00 0.00 177.00 178.55 3h5r n ALA 289 N -0.35 6.43 -1.41 -1.55 0.00 -1.26 -4.95 120.51 117.41 3h5r n ALA 289 Ca 0.06 -3.59 -0.43 0.00 0.00 0.00 0.00 53.44 49.48 3h5r n ALA 289 Cb 0.45 -3.44 -0.01 0.00 0.00 0.00 0.00 19.45 16.46 3h5r n ALA 289 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 3h5r n THR 290 N 4.34 1.54 -3.30 0.00 -1.04 -1.26 -4.50 114.28 110.06 3h5r n THR 290 Ca 0.65 -0.50 -0.03 0.00 -2.04 0.00 0.00 64.05 62.12 3h5r n THR 290 Cb 0.30 -0.33 -0.05 0.00 -1.82 0.00 0.00 70.33 68.43 3h5r n THR 290 CO 0.00 0.00 0.00 0.12 -0.64 0.00 0.00 175.07 174.55 3h5r s PHE 291 N -1.39 -1.16 0.26 -1.42 5.36 -1.26 -5.07 117.98 113.30 3h5r s PHE 291 Ca 0.62 1.31 -0.03 0.00 -0.96 0.00 0.00 56.93 57.87 3h5r s PHE 291 Cb -0.69 0.30 0.55 0.00 -0.34 0.00 0.00 43.02 42.84 3h5r s PHE 291 CO 0.59 -0.77 1.64 0.00 -1.46 0.00 0.00 175.22 175.22 3h5r h ALA 292 N 8.10 0.99 -0.89 11.12 0.00 -1.95 0.78 119.26 137.41 3h5r h ALA 292 Ca -0.21 0.24 0.12 0.00 0.00 0.00 0.00 54.91 55.06 3h5r h ALA 292 Cb 1.15 0.38 -0.07 0.00 0.00 0.00 0.00 17.79 19.25 3h5r h ALA 292 CO 0.25 -0.44 0.57 -1.35 0.00 0.00 0.00 179.25 178.28 3h5r h PRO 293 N 0.15 0.76 0.42 0.00 0.11 -1.98 -1.26 132.00 130.20 3h5r h PRO 293 Ca 0.47 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 66.52 3h5r h PRO 293 Cb 0.89 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 31.83 3h5r h PRO 293 CO -0.67 0.50 -0.20 0.28 -0.21 0.00 0.00 178.00 177.70 3h5r h VAL 294 N 0.78 0.59 -0.74 3.15 2.07 -1.22 -1.84 116.25 119.03 3h5r h VAL 294 Ca 0.43 -0.15 0.17 0.00 0.82 0.00 0.00 66.70 67.97 3h5r h VAL 294 Cb 0.58 0.66 -0.12 0.00 -1.52 0.00 0.00 31.29 30.88 3h5r h VAL 294 CO -0.20 0.03 0.08 -1.13 0.02 0.00 0.00 177.57 176.37 3h5r h ASN 295 N -0.65 -0.20 -0.22 0.57 -1.24 -1.22 -2.29 115.58 110.33 3h5r h ASN 295 Ca -0.06 0.18 -0.16 0.00 0.71 0.00 0.00 56.30 56.97 3h5r h ASN 295 Cb 0.48 0.28 0.00 0.00 0.73 0.00 0.00 38.32 39.82 3h5r h ASN 295 CO 0.09 -0.13 -0.47 0.78 -1.29 0.00 0.00 177.43 176.41 3h5r h ASN 296 N 0.16 0.79 -0.70 1.15 4.21 -1.09 0.14 115.58 120.24 3h5r h ASN 296 Ca 0.41 -0.55 -0.00 0.00 1.21 0.00 0.00 56.30 57.37 3h5r h ASN 296 Cb 0.73 -0.23 -0.03 0.00 -1.12 0.00 0.00 38.32 37.67 3h5r h ASN 296 CO -0.60 1.20 0.43 0.58 -1.29 0.00 0.00 177.43 177.75 3h5r h VAL 297 N 0.41 1.19 -0.06 2.81 2.07 -1.20 0.27 116.25 121.75 3h5r h VAL 297 Ca 0.00 -0.41 -0.01 0.00 0.82 0.00 0.00 66.70 67.11 3h5r h VAL 297 Cb 1.08 0.21 -0.00 0.00 -1.52 0.00 0.00 31.29 31.06 3h5r h VAL 297 CO 0.10 0.20 0.02 0.00 0.02 0.00 0.00 177.57 177.91 3h5r h ALA 298 N 1.23 0.08 -0.34 1.67 0.00 -1.02 -2.22 119.26 118.67 3h5r h ALA 298 Ca 0.25 -0.12 0.05 0.00 0.00 0.00 0.00 54.91 55.09 3h5r h ALA 298 Cb -0.05 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 3h5r h ALA 298 CO -0.05 -0.30 0.08 0.00 0.00 0.00 0.00 179.25 178.98 3h5r h ALA 299 N 0.81 0.36 -0.06 0.00 0.00 -0.61 -2.13 119.26 117.63 3h5r h ALA 299 Ca 0.02 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 3h5r h ALA 299 Cb 0.23 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 3h5r h ALA 299 CO -0.00 -0.33 0.03 0.00 0.00 0.00 0.00 179.25 178.95 3h5r h ALA 300 N 1.24 0.07 -0.27 0.00 0.00 -0.81 -0.55 119.26 118.94 3h5r h ALA 300 Ca 0.16 -0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.92 3h5r h ALA 300 Cb 0.17 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 3h5r h ALA 300 CO -0.20 -0.37 -0.16 -0.07 0.00 0.00 0.00 179.25 178.46 3h5r h LEU 301 N -0.04 0.46 -0.13 0.00 3.38 -1.41 -0.65 115.31 116.93 3h5r h LEU 301 Ca 0.02 -0.13 -0.00 0.00 0.09 0.00 0.00 57.88 57.86 3h5r h LEU 301 Cb 0.12 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 3h5r h LEU 301 CO -0.00 0.64 0.07 0.00 0.09 0.00 0.00 178.44 179.23 3h5r h ALA 303 N 0.95 0.51 -0.75 0.00 0.00 -0.89 -0.38 119.26 118.70 3h5r h ALA 303 Ca 0.05 -0.09 0.13 0.00 0.00 0.00 0.00 54.91 55.00 3h5r h ALA 303 Cb 0.10 -0.16 -0.09 0.00 0.00 0.00 0.00 17.79 17.64 3h5r h ALA 303 CO -0.01 0.04 0.32 0.00 0.00 0.00 0.00 179.25 179.61 3h5r h ALA 304 N 1.07 1.05 -0.17 0.00 0.00 -1.09 0.51 119.26 120.64 3h5r h ALA 304 Ca 0.14 0.10 -0.14 0.00 0.00 0.00 0.00 54.91 55.01 3h5r h ALA 304 Cb 0.07 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3h5r h ALA 304 CO -0.02 -0.16 -0.48 -0.44 0.00 0.00 0.00 179.25 178.15 3h5r h ASP 305 N 0.50 0.47 -0.52 0.00 5.19 -0.85 -0.47 116.42 120.74 3h5r h ASP 305 Ca 0.40 -0.23 -0.02 0.00 -0.62 0.00 0.00 57.03 56.57 3h5r h ASP 305 Cb 0.56 -0.13 -0.02 0.00 0.18 0.00 0.00 39.33 39.92 3h5r h ASP 305 CO -0.36 0.88 0.26 0.58 -3.12 0.00 0.00 179.24 177.47 3h5r h VAL 306 N 0.35 1.20 -0.45 -1.35 2.07 -0.19 -0.11 116.25 117.76 3h5r h VAL 306 Ca 0.02 -0.55 -0.05 0.00 0.82 0.00 0.00 66.70 66.94 3h5r h VAL 306 Cb 0.97 0.59 -0.02 0.00 -1.52 0.00 0.00 31.29 31.31 3h5r h VAL 306 CO 0.08 0.22 0.07 0.40 0.02 0.00 0.00 177.57 178.36 3h5r h ILE 307 N 0.70 1.25 -0.55 4.57 2.04 -0.53 -1.77 117.51 123.21 3h5r h ILE 307 Ca 0.18 -0.91 -0.09 0.00 1.00 0.00 0.00 64.86 65.04 3h5r h ILE 307 Cb 0.11 0.97 -0.02 0.00 -0.74 0.00 0.00 36.82 37.14 3h5r h ILE 307 CO -0.02 0.32 -0.03 0.11 0.00 0.00 0.00 178.15 178.53 3h5r h LYS 308 N 0.61 0.96 -0.14 2.37 1.57 -1.03 0.14 116.57 121.05 3h5r h LYS 308 Ca 0.14 -0.30 -0.00 0.00 -1.87 0.00 0.00 60.65 58.61 3h5r h LYS 308 Cb 0.39 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.60 3h5r h LYS 308 CO 0.01 0.96 0.08 0.35 -0.57 0.00 0.00 179.45 180.28 3h5r h PHE 309 N 0.88 0.19 -0.14 -1.35 3.57 -0.68 0.21 116.94 119.61 3h5r h PHE 309 Ca 0.16 -0.00 -0.21 0.00 3.53 0.00 0.00 57.97 61.45 3h5r h PHE 309 Cb 0.55 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 39.24 3h5r h PHE 309 CO 0.03 0.17 -0.75 0.82 -2.23 0.00 0.00 178.31 176.36 3h5r h ILE 310 N 0.14 1.31 -0.00 1.41 2.04 -1.31 -3.32 117.51 117.77 3h5r h ILE 310 Ca 0.05 -2.00 -0.18 0.00 1.00 0.00 0.00 64.86 63.73 3h5r h ILE 310 Cb 0.05 1.99 -0.02 0.00 -0.74 0.00 0.00 36.82 38.10 3h5r h ILE 310 CO -0.01 0.63 -0.81 1.23 0.00 0.00 0.00 178.15 179.19 3h5r h GLY 311 N 0.80 0.10 -0.03 5.37 0.00 -0.66 -3.44 103.07 105.21 3h5r h GLY 311 Ca -0.04 -0.18 -0.01 0.00 0.00 0.00 0.00 47.33 47.10 3h5r h GLY 311 CO 0.15 0.16 -0.01 0.28 0.00 0.00 0.00 176.54 177.11 3h5r n LYS 312 N -3.64 -0.74 0.00 4.80 4.76 0.72 -4.74 118.16 119.31 3h5r n LYS 312 Ca -0.02 0.24 0.11 0.00 -2.87 0.00 0.00 58.31 55.77 3h5r n LYS 312 Cb 0.77 -3.84 0.02 0.00 -1.84 0.00 0.00 35.03 30.14 3h5r n LYS 312 CO 0.00 0.00 0.00 2.48 -1.37 0.00 0.00 177.40 178.51 3h5r n TYR 313 N -2.63 0.00 -3.62 2.13 0.18 -1.25 -4.89 117.16 107.07 3h5r n TYR 313 Ca -0.01 0.00 -0.16 0.00 1.88 0.00 0.00 57.90 59.61 3h5r n TYR 313 Cb 0.20 -0.07 -0.07 0.00 -0.38 0.00 0.00 39.34 39.01 3h5r n TYR 313 CO 0.00 0.00 0.00 0.45 -2.08 0.00 0.00 176.86 175.23 3h5r s SER 314 N -2.90 -0.47 -0.01 9.48 0.15 -1.26 -4.89 113.70 113.80 3h5r s SER 314 Ca 0.11 0.48 -0.30 0.00 0.70 0.00 0.00 55.95 56.94 3h5r s SER 314 Cb 0.17 0.47 -0.05 0.00 -1.71 0.00 0.00 66.02 64.90 3h5r s SER 314 CO 0.77 -0.53 1.32 -1.83 1.20 0.00 0.00 173.24 174.17 3h5r s GLU 315 N -1.19 4.32 0.56 5.44 1.03 -1.26 -4.57 118.70 123.03 3h5r s GLU 315 Ca -0.12 1.86 -0.20 0.00 0.03 0.00 0.00 54.97 56.55 3h5r s GLU 315 Cb -0.02 -3.54 -0.06 0.00 -0.80 0.00 0.00 34.13 29.71 3h5r s GLU 315 CO 0.07 -0.51 1.01 -2.30 -1.33 0.00 0.00 175.26 172.20 3h5r n PRO 316 N 5.15 1.07 0.16 -4.83 -0.02 -1.26 -4.91 135.00 130.37 3h5r n PRO 316 Ca 0.12 0.41 0.02 0.00 -2.02 0.00 0.00 63.50 62.03 3h5r n PRO 316 Cb 0.45 -2.18 0.22 0.00 -0.02 0.00 0.00 33.50 31.97 3h5r n PRO 316 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 3h5r h LEU 317 N 0.81 0.00 -2.57 2.45 4.07 -1.93 -3.31 115.31 114.83 3h5r h LEU 317 Ca -0.48 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.48 3h5r h LEU 317 Cb 1.35 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.09 3h5r h LEU 317 CO 0.53 0.52 0.00 -1.54 -1.08 0.00 0.00 178.44 176.86 3h5r n SER 318 N -3.59 3.91 -4.70 -0.43 3.41 -1.26 -4.80 113.62 106.17 3h5r n SER 318 Ca -0.00 -2.38 -0.42 0.00 -0.26 0.00 0.00 58.87 55.81 3h5r n SER 318 Cb 0.60 -0.52 -0.03 0.00 -0.26 0.00 0.00 64.21 64.00 3h5r n SER 318 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3h5r s LEU 319 N -1.59 4.39 -1.95 1.04 1.02 -1.25 -1.38 118.68 118.95 3h5r s LEU 319 Ca 0.40 2.70 0.00 0.00 0.02 0.00 0.00 54.13 57.26 3h5r s LEU 319 Cb 0.26 -3.57 0.00 0.00 0.02 0.00 0.00 46.19 42.90 3h5r s LEU 319 CO 0.19 -0.96 0.00 0.59 0.02 0.00 0.00 176.35 176.19 3h5r n ASN 320 N 5.30 -5.52 -3.80 2.29 3.02 -1.26 -4.94 115.26 110.35 3h5r n ASN 320 Ca 0.17 0.45 -0.13 0.00 -0.03 0.00 0.00 54.58 55.05 3h5r n ASN 320 Cb 0.38 -4.64 -0.11 0.00 -0.61 0.00 0.00 39.78 34.80 3h5r n ASN 320 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3h5r s LYS 321 N -3.55 0.30 -0.24 3.52 1.02 -1.13 -0.31 119.74 119.35 3h5r s LYS 321 Ca 0.00 0.24 -0.08 0.00 0.02 0.00 0.00 55.97 56.15 3h5r s LYS 321 Cb 0.00 0.14 -0.03 0.00 -0.52 0.00 0.00 37.83 37.42 3h5r s LYS 321 CO 0.00 -0.04 0.09 0.50 -0.92 0.00 0.00 175.35 174.98 3h5r s ARG 322 N -0.06 3.77 -0.16 1.68 3.52 -0.67 -3.25 118.95 123.77 3h5r s ARG 322 Ca -0.02 -0.42 -0.03 0.00 -0.13 0.00 0.00 55.73 55.12 3h5r s ARG 322 Cb -0.02 -3.37 -0.02 0.00 -1.56 0.00 0.00 34.95 29.97 3h5r s ARG 322 CO 0.01 -0.11 -0.04 0.42 -0.81 0.00 0.00 175.30 174.77 3h5r s ILE 323 N 1.43 3.75 -0.16 4.11 1.01 0.30 0.01 121.20 131.65 3h5r s ILE 323 Ca 0.06 -0.40 -0.01 0.00 0.00 0.00 0.00 60.65 60.30 3h5r s ILE 323 Cb -0.15 -2.65 -0.01 0.00 0.01 0.00 0.00 42.46 39.66 3h5r s ILE 323 CO 0.05 0.48 -0.11 -0.83 0.00 0.00 0.00 174.94 174.52 3h5r s GLY 324 N 0.56 1.55 -0.22 6.18 0.00 0.53 -1.36 107.32 114.56 3h5r s GLY 324 Ca -0.03 -0.99 -0.05 0.00 0.00 0.00 0.00 44.72 43.65 3h5r s GLY 324 CO 0.03 0.00 -0.01 -0.42 0.00 0.00 0.00 173.10 172.70 3h5r s ILE 325 N 0.71 3.75 0.42 0.90 1.01 0.28 -1.55 121.20 126.72 3h5r s ILE 325 Ca -0.05 -0.37 -0.22 0.00 0.00 0.00 0.00 60.65 60.01 3h5r s ILE 325 Cb -0.15 -2.71 -0.10 0.00 0.01 0.00 0.00 42.46 39.51 3h5r s ILE 325 CO 0.02 0.41 0.99 0.26 0.00 0.00 0.00 174.94 176.61 3h5r s TRP 326 N 1.33 3.28 -0.17 3.97 0.23 -0.41 -0.88 118.94 126.29 3h5r s TRP 326 Ca 0.04 1.63 0.15 0.00 -2.03 0.00 0.00 56.10 55.89 3h5r s TRP 326 Cb -0.15 -2.96 -0.21 0.00 0.03 0.00 0.00 33.47 30.19 3h5r s TRP 326 CO 0.00 -0.32 0.38 -1.13 0.96 0.00 0.00 176.95 176.85 3h5r n SER 327 N -0.45 1.44 -0.68 2.95 3.41 -1.11 -4.51 113.62 114.66 3h5r n SER 327 Ca 0.06 -0.19 0.07 0.00 -0.26 0.00 0.00 58.87 58.55 3h5r n SER 327 Cb 0.52 1.52 0.14 0.00 -0.26 0.00 0.00 64.21 66.13 3h5r n SER 327 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3h5r n ASP 328 N -1.85 2.77 -4.08 4.04 5.68 -1.26 -4.96 116.55 116.89 3h5r n ASP 328 Ca -0.01 -1.85 -0.10 0.00 -0.50 0.00 0.00 54.79 52.32 3h5r n ASP 328 Cb 0.34 -0.19 -0.08 0.00 -1.14 0.00 0.00 41.12 40.06 3h5r n ASP 328 CO 0.00 0.00 0.00 -1.61 -1.33 0.00 0.00 177.20 174.26 3h5r s GLU 329 N -1.03 1.20 -0.85 0.11 2.02 -1.26 -5.09 118.70 113.80 3h5r s GLU 329 Ca 0.23 -1.38 -0.23 0.00 0.02 0.00 0.00 54.97 53.61 3h5r s GLU 329 Cb 0.13 0.34 0.07 0.00 0.10 0.00 0.00 34.13 34.76 3h5r s GLU 329 CO 0.18 -0.43 1.23 0.42 0.02 0.00 0.00 175.26 176.68 3h5r s ILE 330 N -4.05 4.13 -0.25 -1.63 1.01 -1.26 -4.58 121.20 114.56 3h5r s ILE 330 Ca 0.26 -0.55 -0.10 0.00 0.00 0.00 0.00 60.65 60.26 3h5r s ILE 330 Cb 0.04 -4.88 0.10 0.00 0.01 0.00 0.00 42.46 37.73 3h5r s ILE 330 CO 0.06 -1.72 0.55 -0.75 0.00 0.00 0.00 174.94 173.08 3h5r s LYS 331 N 4.48 0.49 -0.05 2.79 2.20 -1.26 -5.06 119.74 123.32 3h5r s LYS 331 Ca 0.35 1.21 0.06 0.00 -0.36 0.00 0.00 55.97 57.23 3h5r s LYS 331 Cb -0.07 0.48 -0.01 0.00 -1.51 0.00 0.00 37.83 36.72 3h5r s LYS 331 CO 0.01 -0.20 -0.24 0.42 -0.36 0.00 0.00 175.35 174.98 3h5r s ILE 332 N 2.44 1.95 -0.02 5.43 1.01 -1.26 -1.29 121.20 129.45 3h5r s ILE 332 Ca -0.06 -1.01 0.02 0.00 0.00 0.00 0.00 60.65 59.60 3h5r s ILE 332 Cb -0.11 -1.65 0.01 0.00 0.01 0.00 0.00 42.46 40.72 3h5r s ILE 332 CO -0.16 0.54 -0.05 -2.28 0.00 0.00 0.00 174.94 172.99 3h5r s HIS 333 N -0.17 0.65 0.06 3.97 2.46 -0.59 -5.01 115.29 116.66 3h5r s HIS 333 Ca -0.03 -0.15 0.06 0.00 0.47 0.00 0.00 55.06 55.41 3h5r s HIS 333 Cb -0.13 -0.52 -0.04 0.00 -0.13 0.00 0.00 32.58 31.76 3h5r s HIS 333 CO 0.03 -0.10 -0.09 -1.12 -2.47 0.00 0.00 174.74 170.99 3h5r s SER 334 N 0.41 4.42 -0.14 9.88 0.01 -1.26 -0.34 113.70 126.68 3h5r s SER 334 Ca -0.05 -0.29 -0.04 0.00 1.31 0.00 0.00 55.95 56.87 3h5r s SER 334 Cb -0.09 -0.91 -0.03 0.00 0.21 0.00 0.00 66.02 65.20 3h5r s SER 334 CO -0.00 0.23 0.02 -1.10 0.41 0.00 0.00 173.24 172.80 3h5r s GLN 335 N -1.80 3.52 -0.12 12.44 -0.21 0.10 -4.97 119.66 128.62 3h5r s GLN 335 Ca 0.19 -0.40 -0.29 0.00 0.02 0.00 0.00 55.36 54.88 3h5r s GLN 335 Cb -0.11 -2.99 -0.05 0.00 1.00 0.00 0.00 33.01 30.87 3h5r s GLN 335 CO 0.10 0.45 1.71 1.21 -2.12 0.00 0.00 175.29 176.64 3h5r s ASN 336 N -0.16 6.45 -0.28 5.90 2.47 -1.26 -1.68 114.94 126.39 3h5r s ASN 336 Ca 0.05 2.01 0.12 0.00 0.42 0.00 0.00 52.86 55.47 3h5r s ASN 336 Cb -0.12 -2.53 0.47 0.00 -1.45 0.00 0.00 41.25 37.62 3h5r s ASN 336 CO 0.02 -1.14 1.17 0.23 -3.72 0.00 0.00 177.10 173.65 3h5r n MET 337 N 7.48 2.96 -1.24 0.43 2.81 0.58 -4.69 117.12 125.45 3h5r n MET 337 Ca 0.19 -3.93 -0.31 0.00 -1.81 0.00 0.00 57.70 51.85 3h5r n MET 337 Cb 0.44 -2.04 0.11 0.00 -0.71 0.00 0.00 33.22 31.02 3h5r n MET 337 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 3h5r s GLY 338 N -3.64 1.66 0.17 3.03 0.00 -1.17 -3.37 107.32 103.99 3h5r s GLY 338 Ca 0.43 0.15 -0.32 0.00 0.00 0.00 0.00 44.72 44.99 3h5r s GLY 338 CO 0.01 0.55 1.56 -1.60 0.00 0.00 0.00 173.10 173.62 3h5r s ARG 339 N -4.92 4.22 -0.18 2.90 3.52 -1.26 -4.49 118.95 118.75 3h5r s ARG 339 Ca 0.62 2.35 -0.06 0.00 -0.13 0.00 0.00 55.73 58.52 3h5r s ARG 339 Cb -0.17 -3.16 -0.03 0.00 -1.56 0.00 0.00 34.95 30.03 3h5r s ARG 339 CO 0.56 -0.60 0.02 0.45 -0.81 0.00 0.00 175.30 174.92 3h5r s SER 340 N 1.13 5.19 0.41 -2.12 0.15 -1.26 -4.94 113.70 112.26 3h5r s SER 340 Ca 0.70 -0.05 0.29 0.00 0.70 0.00 0.00 55.95 57.59 3h5r s SER 340 Cb -0.44 -1.87 1.14 0.00 -1.71 0.00 0.00 66.02 63.14 3h5r s SER 340 CO 0.31 0.15 1.85 1.55 1.20 0.00 0.00 173.24 178.30 3h5r h PRO 341 N 6.85 0.00 -0.63 5.44 0.13 -1.95 -2.46 132.00 139.37 3h5r h PRO 341 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 3h5r h PRO 341 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 3h5r h PRO 341 CO 0.66 0.00 0.00 0.28 -0.23 0.00 0.00 178.00 178.71 3h5r n VAL 342 N -2.71 1.34 -2.05 1.56 0.31 -1.26 -4.81 118.33 110.70 3h5r n VAL 342 Ca 0.02 -0.82 -0.39 0.00 -0.01 0.00 0.00 64.34 63.14 3h5r n VAL 342 Cb 0.29 -0.07 0.00 0.00 -0.91 0.00 0.00 33.84 33.16 3h5r n VAL 342 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3h5r n SER 344 N -0.20 1.38 -0.03 0.00 3.41 -1.26 -3.14 113.62 113.77 3h5r n SER 344 Ca 0.06 -1.14 -0.08 0.00 -0.26 0.00 0.00 58.87 57.44 3h5r n SER 344 Cb 0.45 0.19 -0.03 0.00 -0.26 0.00 0.00 64.21 64.56 3h5r n SER 344 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 3h5r n VAL 345 N -0.34 0.63 0.94 -3.33 0.31 -1.26 -4.86 118.33 110.42 3h5r n VAL 345 Ca 0.12 -0.04 0.11 0.00 -0.01 0.00 0.00 64.34 64.52 3h5r n VAL 345 Cb 0.39 -1.66 0.08 0.00 -0.91 0.00 0.00 33.84 31.74 3h5r n VAL 345 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3h5r n GLY 347 N 1.28 -2.61 3.63 0.00 0.00 -1.19 -4.80 105.19 101.50 3h5r n GLY 347 Ca 0.12 0.83 -0.28 0.00 0.00 0.00 0.00 46.02 46.70 3h5r n GLY 347 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3h5r n ASN 348 N -4.09 -1.37 0.00 1.61 4.13 -1.26 -5.03 115.26 109.25 3h5r n ASN 348 Ca 0.01 -0.73 0.00 0.00 1.68 0.00 0.00 54.58 55.54 3h5r n ASN 348 Cb 0.13 -1.22 0.00 0.00 -1.54 0.00 0.00 39.78 37.15 3h5r n ASN 348 CO 0.00 0.00 0.00 -2.11 0.28 0.00 0.00 177.26 175.43