#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 7.02 0.15 6.12 1.01 -1.26 -4.18 116.67 125.53 3h5r s ASP 2 Ca 0.00 1.58 0.09 0.00 0.71 0.00 0.00 52.55 54.93 3h5r s ASP 2 Cb 0.00 -2.49 -0.04 0.00 1.01 0.00 0.00 42.92 41.40 3h5r s ASP 2 CO 0.00 -0.18 -0.21 -0.31 0.21 0.00 0.00 175.17 174.68 3h5r s TYR 3 N -1.88 1.97 0.02 4.23 1.51 0.71 -0.23 117.35 123.68 3h5r s TYR 3 Ca 0.54 -0.42 0.00 0.00 -1.01 0.00 0.00 57.07 56.18 3h5r s TYR 3 Cb -0.13 -1.01 -0.02 0.00 -0.11 0.00 0.00 41.96 40.69 3h5r s TYR 3 CO 0.18 0.33 -0.03 -1.50 -1.11 0.00 0.00 175.55 173.42 3h5r s ILE 4 N -1.61 0.17 0.00 2.71 2.07 0.46 -0.49 121.20 124.50 3h5r s ILE 4 Ca 0.14 -0.78 -0.30 0.00 -1.41 0.00 0.00 60.65 58.30 3h5r s ILE 4 Cb -0.08 -0.28 -0.04 0.00 0.13 0.00 0.00 42.46 42.19 3h5r s ILE 4 CO 0.07 -0.39 1.15 -0.22 -1.91 0.00 0.00 174.94 173.63 3h5r s LEU 5 N -1.22 4.33 0.52 8.50 2.96 0.13 -0.88 118.68 133.02 3h5r s LEU 5 Ca -0.12 1.85 -0.21 0.00 -0.22 0.00 0.00 54.13 55.43 3h5r s LEU 5 Cb -0.08 -3.57 -0.06 0.00 0.50 0.00 0.00 46.19 42.98 3h5r s LEU 5 CO -0.01 -0.46 1.16 -0.83 -1.32 0.00 0.00 176.35 174.89 3h5r s GLY 6 N 1.19 2.71 0.35 7.98 0.00 0.08 -4.89 107.32 114.73 3h5r s GLY 6 Ca 0.56 0.90 0.26 0.00 0.00 0.00 0.00 44.72 46.44 3h5r s GLY 6 CO 0.26 1.30 1.76 3.21 0.00 0.00 0.00 173.10 179.63 3h5r h ARG 7 N 1.48 0.00 -0.05 2.90 2.47 -1.94 -2.76 114.38 116.48 3h5r h ARG 7 Ca -0.50 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.22 3h5r h ARG 7 Cb 1.26 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.58 3h5r h ARG 7 CO 0.58 0.00 0.00 2.48 0.56 0.00 0.00 179.97 183.59 3h5r n TYR 8 N -2.63 0.07 -3.02 3.04 0.18 -1.26 -4.81 117.16 108.71 3h5r n TYR 8 Ca 0.03 -0.03 -0.38 0.00 1.88 0.00 0.00 57.90 59.40 3h5r n TYR 8 Cb 0.39 0.00 -0.06 0.00 -0.38 0.00 0.00 39.34 39.29 3h5r n TYR 8 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 3h5r s VAL 9 N -1.93 4.44 0.02 -3.48 0.11 -1.04 -4.28 120.40 114.23 3h5r s VAL 9 Ca 0.27 1.55 0.02 0.00 -2.93 0.00 0.00 61.98 60.89 3h5r s VAL 9 Cb 0.13 -4.03 -0.01 0.00 -1.53 0.00 0.00 36.38 30.94 3h5r s VAL 9 CO 0.21 0.40 -0.06 -0.75 -3.33 0.00 0.00 175.10 171.57 3h5r s LYS 10 N -1.47 0.43 0.01 1.54 2.20 -1.26 -4.98 119.74 116.21 3h5r s LYS 10 Ca 0.39 -0.48 0.01 0.00 -0.36 0.00 0.00 55.97 55.53 3h5r s LYS 10 Cb -0.21 -0.28 -0.01 0.00 -1.51 0.00 0.00 37.83 35.83 3h5r s LYS 10 CO 0.24 0.06 -0.03 0.42 -0.36 0.00 0.00 175.35 175.68 3h5r s ILE 11 N -0.82 0.17 -0.17 5.43 1.09 -1.26 -0.09 121.20 125.55 3h5r s ILE 11 Ca -0.05 -0.32 -0.17 0.00 -1.10 0.00 0.00 60.65 59.01 3h5r s ILE 11 Cb -0.06 -0.20 0.05 0.00 -1.06 0.00 0.00 42.46 41.19 3h5r s ILE 11 CO 0.00 -0.09 0.47 0.00 -0.10 0.00 0.00 174.94 175.22 3h5r s ALA 12 N -0.41 -1.18 0.22 9.38 0.00 -0.80 -4.99 121.76 123.98 3h5r s ALA 12 Ca -0.03 1.32 -0.31 0.00 0.00 0.00 0.00 51.96 52.94 3h5r s ALA 12 Cb -0.03 -0.76 -0.10 0.00 0.00 0.00 0.00 23.12 22.23 3h5r s ALA 12 CO -0.00 -0.23 1.55 0.50 0.00 0.00 0.00 175.76 177.58 3h5r s ARG 13 N 0.21 4.20 -0.28 0.00 3.00 -1.26 0.05 118.95 124.87 3h5r s ARG 13 Ca -0.00 2.41 -0.17 0.00 -1.00 0.00 0.00 55.73 56.96 3h5r s ARG 13 Cb -0.03 -3.11 0.10 0.00 0.00 0.00 0.00 34.95 31.91 3h5r s ARG 13 CO 0.01 -0.57 0.80 -0.47 0.00 0.00 0.00 175.30 175.07 3h5r s TYR 14 N 0.55 -0.86 0.00 5.12 5.04 -0.69 -4.82 117.35 121.69 3h5r s TYR 14 Ca 0.66 1.77 0.00 0.00 -2.44 0.00 0.00 57.07 57.05 3h5r s TYR 14 Cb -0.44 0.50 0.00 0.00 0.35 0.00 0.00 41.96 42.37 3h5r s TYR 14 CO 0.38 -0.43 0.00 0.41 -1.34 0.00 0.00 175.55 174.58 3h5r n GLY 15 N 3.87 3.48 0.22 8.97 0.00 -1.26 -1.33 105.19 119.14 3h5r n GLY 15 Ca -0.19 0.01 0.13 0.00 0.00 0.00 0.00 46.02 45.97 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 0.00 0.00 1.61 4.64 -1.89 -3.46 113.55 114.45 3h5r h SER 16 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3h5r h SER 16 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3h5r h SER 16 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 3h5r n GLY 17 N 0.91 1.39 0.00 -0.77 0.00 -0.44 -3.74 105.19 102.54 3h5r n GLY 17 Ca 0.03 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.94 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 0.00 -0.23 3.83 -0.02 0.00 -0.63 -1.71 105.19 106.43 3h5r n GLY 18 Ca 0.00 -0.93 -0.37 0.00 0.00 0.00 0.00 46.02 44.72 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 4.37 -0.15 0.99 1.43 0.11 -0.92 118.68 124.51 3h5r s LEU 19 Ca 0.00 0.60 0.02 0.00 -1.03 0.00 0.00 54.13 53.72 3h5r s LEU 19 Cb 0.00 -2.28 0.01 0.00 0.03 0.00 0.00 46.19 43.95 3h5r s LEU 19 CO 0.00 0.31 -0.20 -0.69 0.23 0.00 0.00 176.35 176.00 3h5r s VAL 20 N -0.66 1.94 0.00 -1.59 1.01 -0.59 -1.90 120.40 118.62 3h5r s VAL 20 Ca 0.17 -0.90 0.00 0.00 0.00 0.00 0.00 61.98 61.26 3h5r s VAL 20 Cb -0.13 -1.74 0.00 0.00 0.00 0.00 0.00 36.38 34.50 3h5r s VAL 20 CO 0.06 0.53 0.00 0.61 0.00 0.00 0.00 175.10 176.30 3h5r n GLY 21 N 4.29 1.81 2.93 4.51 0.00 0.88 -0.62 105.19 118.98 3h5r n GLY 21 Ca -0.20 -1.99 -0.16 0.00 0.00 0.00 0.00 46.02 43.67 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 0.00 0.25 0.00 -0.02 0.00 -1.26 -4.56 107.32 101.74 3h5r s GLY 22 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 44.72 44.58 3h5r s GLY 22 CO 0.00 -0.00 0.00 0.61 0.00 0.00 0.00 173.10 173.71 3h5r n GLY 23 N 3.23 -0.28 0.24 0.20 0.00 -1.26 -4.31 105.19 103.01 3h5r n GLY 23 Ca -0.16 -1.85 0.16 0.00 0.00 0.00 0.00 46.02 44.17 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 -1.09 -0.02 0.00 -2.03 -1.53 103.07 98.41 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 -0.15 0.28 0.00 0.00 0.00 176.54 176.67 3h5r n LYS 25 N -2.69 1.71 -1.67 4.80 4.76 -1.26 -4.95 118.16 118.86 3h5r n LYS 25 Ca -0.01 -1.30 -0.45 0.00 -2.87 0.00 0.00 58.31 53.68 3h5r n LYS 25 Cb 0.13 -1.47 -0.03 0.00 -1.84 0.00 0.00 35.03 31.82 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 0.49 2.05 -4.41 1.97 2.13 -0.58 -4.78 120.64 117.52 3h5r n GLU 26 Ca 0.14 0.73 -0.22 0.00 0.66 0.00 0.00 57.16 58.47 3h5r n GLU 26 Cb 0.48 -2.40 -0.16 0.00 0.27 0.00 0.00 31.44 29.63 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 -0.28 1.17 -0.49 5.31 -0.21 0.21 -4.98 119.66 120.39 3h5r s GLN 27 Ca 0.69 -0.29 -0.23 0.00 0.02 0.00 0.00 55.36 55.55 3h5r s GLN 27 Cb -0.65 -1.05 0.04 0.00 1.00 0.00 0.00 33.01 32.34 3h5r s GLN 27 CO 0.48 0.04 0.80 -0.47 -2.12 0.00 0.00 175.29 174.02 3h5r s TYR 28 N 0.52 2.94 -0.56 0.91 5.04 -1.26 -1.54 117.35 123.39 3h5r s TYR 28 Ca -0.09 -0.04 -0.22 0.00 -2.44 0.00 0.00 57.07 54.28 3h5r s TYR 28 Cb -0.12 -3.76 0.06 0.00 0.35 0.00 0.00 41.96 38.49 3h5r s TYR 28 CO 0.01 -1.11 0.82 0.08 -1.34 0.00 0.00 175.55 174.01 3h5r s VAL 29 N 3.36 4.58 0.26 3.14 1.01 -0.10 -4.93 120.40 127.73 3h5r s VAL 29 Ca 0.27 -0.26 -0.02 0.00 0.00 0.00 0.00 61.98 61.97 3h5r s VAL 29 Cb -0.14 -4.49 0.11 0.00 0.00 0.00 0.00 36.38 31.86 3h5r s VAL 29 CO 0.19 -1.09 1.75 1.05 0.00 0.00 0.00 175.10 177.00 3h5r h GLU 30 N 9.25 0.79 -6.28 2.72 9.09 -1.93 -1.67 114.58 126.55 3h5r h GLU 30 Ca -0.28 -0.22 -0.58 0.00 0.05 0.00 0.00 59.36 58.33 3h5r h GLU 30 Cb 1.08 -0.09 -0.08 0.00 -1.65 0.00 0.00 28.75 28.01 3h5r h GLU 30 CO 1.07 0.81 0.72 1.21 0.05 0.00 0.00 179.01 182.87 3h5r s ASN 31 N -6.65 6.69 0.22 3.06 3.84 -1.26 -3.46 114.94 117.38 3h5r s ASN 31 Ca -0.09 0.58 -0.09 0.00 0.21 0.00 0.00 52.86 53.47 3h5r s ASN 31 Cb 0.14 -2.50 0.18 0.00 -0.55 0.00 0.00 41.25 38.53 3h5r s ASN 31 CO 0.81 -0.98 1.86 0.25 -2.79 0.00 0.00 177.10 176.26 3h5r h LEU 32 N 10.41 0.98 -0.38 3.21 5.85 -1.81 0.40 115.31 133.97 3h5r h LEU 32 Ca -0.23 -0.06 0.05 0.00 0.84 0.00 0.00 57.88 58.48 3h5r h LEU 32 Cb 1.07 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.81 3h5r h LEU 32 CO 1.03 0.76 0.13 -0.37 -0.34 0.00 0.00 178.44 179.64 3h5r h VAL 33 N 1.12 0.87 -0.64 1.05 -1.51 -1.91 0.15 116.25 115.39 3h5r h VAL 33 Ca 0.29 -0.10 -0.09 0.00 -1.23 0.00 0.00 66.70 65.58 3h5r h VAL 33 Cb -0.05 0.57 -0.02 0.00 -2.13 0.00 0.00 31.29 29.66 3h5r h VAL 33 CO -0.06 0.05 0.05 0.25 -1.23 0.00 0.00 177.57 176.64 3h5r h LEU 34 N 0.28 1.07 -0.18 4.19 5.85 -1.83 -1.35 115.31 123.35 3h5r h LEU 34 Ca 0.18 -0.28 -0.00 0.00 0.84 0.00 0.00 57.88 58.61 3h5r h LEU 34 Cb 0.16 -0.29 -0.01 0.00 0.37 0.00 0.00 40.66 40.90 3h5r h LEU 34 CO -0.19 1.09 0.11 -0.25 -0.34 0.00 0.00 178.44 178.86 3h5r h TRP 35 N 1.02 0.23 -0.70 1.25 7.01 -0.53 -0.21 115.95 124.02 3h5r h TRP 35 Ca 0.19 -0.00 0.02 0.00 2.11 0.00 0.00 58.89 61.20 3h5r h TRP 35 Cb 0.51 -0.08 -0.04 0.00 -2.10 0.00 0.00 29.16 27.46 3h5r h TRP 35 CO 0.04 0.19 0.45 0.93 -2.79 0.00 0.00 178.44 177.26 3h5r h GLU 36 N 0.21 0.89 -0.49 2.65 5.08 -0.88 -1.85 114.58 120.19 3h5r h GLU 36 Ca 0.06 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.37 3h5r h GLU 36 Cb 0.02 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.05 3h5r h GLU 36 CO -0.01 0.59 0.28 -0.91 -1.00 0.00 0.00 179.01 177.96 3h5r h ASN 37 N 0.92 0.58 -0.45 1.42 2.35 -0.96 0.26 115.58 119.69 3h5r h ASN 37 Ca 0.27 -0.03 -0.05 0.00 -0.55 0.00 0.00 56.30 55.94 3h5r h ASN 37 Cb -0.06 -0.15 -0.02 0.00 0.05 0.00 0.00 38.32 38.14 3h5r h ASN 37 CO -0.07 0.45 0.10 0.40 -1.65 0.00 0.00 177.43 176.66 3h5r h ILE 38 N 0.67 1.24 -0.27 2.81 2.04 -0.48 -2.00 117.51 121.53 3h5r h ILE 38 Ca 0.17 -0.84 -0.16 0.00 1.00 0.00 0.00 64.86 65.03 3h5r h ILE 38 Cb -0.01 0.92 -0.00 0.00 -0.74 0.00 0.00 36.82 36.99 3h5r h ILE 38 CO -0.03 0.30 -0.44 0.16 0.00 0.00 0.00 178.15 178.13 3h5r h ILE 39 N 0.60 1.30 -0.42 -0.67 3.07 -0.69 0.36 117.51 121.06 3h5r h ILE 39 Ca 0.14 -1.64 0.06 0.00 1.55 0.00 0.00 64.86 64.97 3h5r h ILE 39 Cb 0.34 1.69 -0.02 0.00 -0.27 0.00 0.00 36.82 38.55 3h5r h ILE 39 CO 0.00 0.53 0.28 0.11 -1.05 0.00 0.00 178.15 178.02 3h5r h LYS 40 N 0.51 0.32 0.07 0.16 1.57 -1.00 -1.38 116.57 116.82 3h5r h LYS 40 Ca 0.02 -0.02 -0.17 0.00 -1.87 0.00 0.00 60.65 58.61 3h5r h LYS 40 Cb 1.04 -0.07 0.02 0.00 0.08 0.00 0.00 32.23 33.30 3h5r h LYS 40 CO 0.10 0.21 -0.70 1.15 -0.57 0.00 0.00 179.45 179.64 3h5r h THR 41 N 0.33 1.47 -0.58 -0.16 2.02 -0.94 -3.25 112.91 111.80 3h5r h THR 41 Ca 0.18 -2.29 0.06 0.00 0.77 0.00 0.00 66.41 65.13 3h5r h THR 41 Cb 0.31 2.88 -0.03 0.00 -1.74 0.00 0.00 68.15 69.57 3h5r h THR 41 CO -0.04 0.66 0.38 0.00 0.37 0.00 0.00 175.52 176.89 3h5r h ALA 42 N 0.21 1.82 0.00 6.16 0.00 -0.53 -2.40 119.26 124.51 3h5r h ALA 42 Ca -0.11 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 3h5r h ALA 42 Cb 1.47 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 19.11 3h5r h ALA 42 CO 0.13 0.09 -0.12 -0.92 0.00 0.00 0.00 179.25 178.43 3h5r h TYR 43 N 0.57 0.00 0.00 0.00 3.20 -1.29 -1.71 116.97 117.74 3h5r h TYR 43 Ca 0.25 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.12 3h5r h TYR 43 Cb 0.26 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.53 3h5r h TYR 43 CO -0.00 0.12 0.00 0.00 -1.64 0.00 0.00 178.16 176.64 3h5r n PHE 45 N -1.18 0.00 -0.24 0.00 3.72 -0.64 -4.52 117.46 114.59 3h5r n PHE 45 Ca 0.15 -0.42 -0.06 0.00 -0.05 0.00 0.00 57.45 57.06 3h5r n PHE 45 Cb 0.16 -0.05 0.05 0.00 -0.94 0.00 0.00 39.48 38.69 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 0.99 1.22 -3.23 4.37 2.04 -1.59 0.36 117.51 121.67 3h5r h ILE 46 Ca 0.00 -0.59 -0.66 0.00 1.00 0.00 0.00 64.86 64.61 3h5r h ILE 46 Cb 0.71 0.37 -0.12 0.00 -0.74 0.00 0.00 36.82 37.05 3h5r h ILE 46 CO 0.00 0.25 -0.61 0.42 0.00 0.00 0.00 178.15 178.21 3h5r s THR 47 N -5.77 4.45 0.29 -0.27 -4.23 -1.26 -4.64 115.64 104.21 3h5r s THR 47 Ca -0.13 -0.51 -0.30 0.00 -1.18 0.00 0.00 61.69 59.57 3h5r s THR 47 Cb 0.14 -3.01 -0.12 0.00 1.34 0.00 0.00 72.50 70.84 3h5r s THR 47 CO 0.79 0.35 1.51 -0.81 -0.54 0.00 0.00 174.62 175.93 3h5r n PRO 48 N 1.26 2.47 -3.87 3.99 -0.04 -1.26 -4.88 135.00 132.68 3h5r n PRO 48 Ca -0.14 0.88 -0.11 0.00 -0.04 0.00 0.00 63.50 64.09 3h5r n PRO 48 Cb 0.53 -2.60 -0.10 0.00 -0.04 0.00 0.00 33.50 31.28 3h5r n PRO 48 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3h5r s SER 49 N 0.32 0.01 0.69 3.54 0.15 0.36 -4.86 113.70 113.91 3h5r s SER 49 Ca 0.64 -0.17 -0.11 0.00 0.70 0.00 0.00 55.95 57.00 3h5r s SER 49 Cb -0.54 0.21 0.01 0.00 -1.71 0.00 0.00 66.02 63.99 3h5r s SER 49 CO 0.51 -0.35 1.06 -0.94 1.20 0.00 0.00 173.24 174.72 3h5r s SER 50 N -1.30 5.41 0.09 5.45 1.04 -1.26 -0.21 113.70 122.92 3h5r s SER 50 Ca -0.14 1.59 -0.34 0.00 0.48 0.00 0.00 55.95 57.54 3h5r s SER 50 Cb -0.07 -2.48 -0.15 0.00 0.10 0.00 0.00 66.02 63.42 3h5r s SER 50 CO 0.02 -1.42 1.58 0.22 0.98 0.00 0.00 173.24 174.61 3h5r h TYR 51 N -0.70 -1.28 -0.72 5.02 3.20 -1.97 -2.11 116.97 118.41 3h5r h TYR 51 Ca -0.44 0.01 0.12 0.00 3.14 0.00 0.00 58.73 61.57 3h5r h TYR 51 Cb 1.21 0.50 -0.09 0.00 1.54 0.00 0.00 36.73 39.90 3h5r h TYR 51 CO 0.62 -0.62 0.29 1.79 -1.64 0.00 0.00 178.16 178.61 3h5r h THR 52 N -0.90 0.72 -0.48 1.81 1.35 -1.96 -0.93 112.91 112.52 3h5r h THR 52 Ca -0.04 -0.16 -0.06 0.00 -0.55 0.00 0.00 66.41 65.60 3h5r h THR 52 Cb 0.81 0.21 -0.02 0.00 -1.73 0.00 0.00 68.15 67.42 3h5r h THR 52 CO -0.09 0.09 0.07 0.00 -0.25 0.00 0.00 175.52 175.33 3h5r h ALA 53 N 1.50 0.64 -0.21 6.62 0.00 -1.94 -2.66 119.26 123.21 3h5r h ALA 53 Ca 0.38 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 3h5r h ALA 53 Cb 0.53 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 3h5r h ALA 53 CO -0.36 0.38 -0.10 0.00 0.00 0.00 0.00 179.25 179.17 3h5r h ALA 54 N 0.96 1.44 -0.33 0.00 0.00 -0.68 -2.20 119.26 118.45 3h5r h ALA 54 Ca 0.14 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 3h5r h ALA 54 Cb 0.41 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 3h5r h ALA 54 CO 0.01 0.39 0.20 1.25 0.00 0.00 0.00 179.25 181.10 3h5r h LEU 55 N 0.32 0.40 -1.09 0.00 5.85 -0.93 0.20 115.31 120.06 3h5r h LEU 55 Ca 0.07 -0.05 -0.07 0.00 0.84 0.00 0.00 57.88 58.66 3h5r h LEU 55 Cb 0.38 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.29 3h5r h LEU 55 CO 0.02 0.34 -0.08 -0.33 -0.34 0.00 0.00 178.44 178.04 3h5r h GLU 56 N 0.43 0.55 -0.21 1.25 4.39 -1.31 -3.03 114.58 116.64 3h5r h GLU 56 Ca 0.12 -0.15 -0.16 0.00 0.34 0.00 0.00 59.36 59.51 3h5r h GLU 56 Cb 0.01 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.59 3h5r h GLU 56 CO -0.02 0.63 -0.53 1.15 -1.16 0.00 0.00 179.01 179.08 3h5r h THR 57 N 0.51 1.31 -3.65 1.13 2.02 -0.93 -3.45 112.91 109.85 3h5r h THR 57 Ca 0.10 -1.76 -0.50 0.00 0.77 0.00 0.00 66.41 65.01 3h5r h THR 57 Cb 0.46 1.72 -0.02 0.00 -1.74 0.00 0.00 68.15 68.57 3h5r h THR 57 CO 0.02 0.55 0.33 0.00 0.37 0.00 0.00 175.52 176.79 3h5r s ALA 58 N -4.04 3.32 -1.13 6.16 0.00 0.65 -4.98 121.76 121.74 3h5r s ALA 58 Ca -0.08 0.56 -0.05 0.00 0.00 0.00 0.00 51.96 52.40 3h5r s ALA 58 Cb 0.11 -3.20 0.27 0.00 0.00 0.00 0.00 23.12 20.30 3h5r s ALA 58 CO 0.85 0.14 1.70 0.09 0.00 0.00 0.00 175.76 178.53 3h5r n ASN 59 N 1.98 6.41 -3.74 0.00 4.13 -1.26 -4.91 115.26 117.87 3h5r n ASN 59 Ca -0.01 -3.37 -0.14 0.00 1.68 0.00 0.00 54.58 52.74 3h5r n ASN 59 Cb 0.48 -1.31 -0.09 0.00 -1.54 0.00 0.00 39.78 37.33 3h5r n ASN 59 CO 0.00 0.00 0.00 0.27 0.28 0.00 0.00 177.26 177.81 3h5r s ILE 60 N -2.23 0.05 0.65 2.41 -4.36 -1.26 -5.14 121.20 111.31 3h5r s ILE 60 Ca 0.36 -0.37 -0.17 0.00 -0.26 0.00 0.00 60.65 60.20 3h5r s ILE 60 Cb 0.09 -0.63 -0.04 0.00 1.25 0.00 0.00 42.46 43.13 3h5r s ILE 60 CO 0.03 -0.20 0.81 -2.65 0.24 0.00 0.00 174.94 173.17 3h5r n PRO 61 N 1.47 0.62 -0.26 0.37 -0.02 -1.26 -4.70 135.00 131.21 3h5r n PRO 61 Ca -0.20 0.26 0.12 0.00 -2.02 0.00 0.00 63.50 61.65 3h5r n PRO 61 Cb 0.56 -2.04 0.38 0.00 -0.02 0.00 0.00 33.50 32.38 3h5r n PRO 61 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 3h5r h GLU 62 N 0.10 0.67 0.23 -0.52 4.22 -1.98 -1.04 114.58 116.27 3h5r h GLU 62 Ca -0.47 -0.04 -0.01 0.00 0.08 0.00 0.00 59.36 58.92 3h5r h GLU 62 Cb 1.36 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.46 3h5r h GLU 62 CO 0.48 0.45 -0.11 0.87 -2.18 0.00 0.00 179.01 178.51 3h5r h LYS 63 N 0.69 -0.30 -0.51 1.92 1.79 -2.00 -1.66 116.57 116.49 3h5r h LYS 63 Ca 0.43 0.02 -0.04 0.00 -2.18 0.00 0.00 60.65 58.88 3h5r h LYS 63 Cb 0.68 0.07 -0.02 0.00 -1.58 0.00 0.00 32.23 31.38 3h5r h LYS 63 CO -0.19 -0.10 0.16 -0.44 -1.08 0.00 0.00 179.45 177.80 3h5r h ASP 64 N -0.45 0.75 -0.71 0.86 5.19 -1.84 -2.82 116.42 117.40 3h5r h ASP 64 Ca -0.03 -0.21 0.01 0.00 -0.62 0.00 0.00 57.03 56.18 3h5r h ASP 64 Cb 0.34 -0.20 -0.04 0.00 0.18 0.00 0.00 39.33 39.62 3h5r h ASP 64 CO 0.05 0.76 0.47 0.15 -3.12 0.00 0.00 179.24 177.55 3h5r h PHE 65 N 0.70 0.89 -0.38 4.55 3.57 -1.17 0.24 116.94 125.34 3h5r h PHE 65 Ca 0.17 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.69 3h5r h PHE 65 Cb 0.28 -0.30 -0.02 0.00 2.79 0.00 0.00 35.95 38.69 3h5r h PHE 65 CO 0.02 0.56 0.25 1.03 -2.23 0.00 0.00 178.31 177.94 3h5r h SER 66 N 0.96 0.42 -0.13 0.41 0.87 -1.26 0.15 113.55 114.97 3h5r h SER 66 Ca 0.26 -0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.80 3h5r h SER 66 Cb -0.11 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 61.74 3h5r h SER 66 CO -0.06 0.30 0.03 0.78 -0.53 0.00 0.00 176.83 177.36 3h5r h ASN 67 N 0.50 0.20 -0.32 6.23 2.35 -1.15 -0.42 115.58 122.98 3h5r h ASN 67 Ca 0.14 -0.23 -0.10 0.00 -0.55 0.00 0.00 56.30 55.57 3h5r h ASN 67 Cb -0.04 -0.05 -0.02 0.00 0.05 0.00 0.00 38.32 38.26 3h5r h ASN 67 CO -0.04 0.38 -0.15 0.00 -1.65 0.00 0.00 177.43 175.97 3h5r h PHE 69 N 0.69 -0.74 -0.79 0.00 3.57 -0.75 -1.05 116.94 117.87 3h5r h PHE 69 Ca 0.11 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.62 3h5r h PHE 69 Cb 0.64 0.30 -0.04 0.00 2.79 0.00 0.00 35.95 39.64 3h5r h PHE 69 CO 0.03 -0.39 0.50 0.00 -2.23 0.00 0.00 178.31 176.22 3h5r h ARG 70 N -0.54 1.06 -0.51 1.11 2.47 -0.87 0.24 114.38 117.34 3h5r h ARG 70 Ca 0.01 -0.08 0.05 0.00 -1.26 0.00 0.00 59.98 58.70 3h5r h ARG 70 Cb 0.53 -0.23 -0.05 0.00 -1.65 0.00 0.00 29.97 28.57 3h5r h ARG 70 CO -0.11 0.73 0.25 0.35 0.56 0.00 0.00 179.97 181.75 3h5r h PHE 71 N 1.08 0.46 -0.14 3.04 3.57 -1.02 0.30 116.94 124.24 3h5r h PHE 71 Ca 0.29 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.72 3h5r h PHE 71 Cb -0.08 -0.13 0.00 0.00 2.79 0.00 0.00 35.95 38.53 3h5r h PHE 71 CO 0.00 0.22 -0.25 -0.07 -2.23 0.00 0.00 178.31 175.98 3h5r h LEU 72 N 0.49 0.46 -0.35 0.59 3.38 0.06 -2.93 115.31 117.01 3h5r h LEU 72 Ca 0.23 -0.54 -0.01 0.00 0.09 0.00 0.00 57.88 57.64 3h5r h LEU 72 Cb 0.15 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 3h5r h LEU 72 CO -0.17 0.92 0.18 0.50 0.09 0.00 0.00 178.44 179.96 3h5r h LYS 73 N 0.02 0.49 0.00 1.13 3.64 -0.45 -0.94 116.57 120.46 3h5r h LYS 73 Ca 0.01 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.29 3h5r h LYS 73 Cb 0.83 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.56 3h5r h LYS 73 CO 0.06 0.43 -0.14 0.93 -2.27 0.00 0.00 179.45 178.46 3h5r h GLU 74 N 0.43 0.00 -0.20 1.90 5.08 -1.00 -1.48 114.58 119.30 3h5r h GLU 74 Ca 0.12 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 3h5r h GLU 74 Cb 0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.34 3h5r h GLU 74 CO -0.02 0.14 0.00 0.09 -1.00 0.00 0.00 179.01 178.22 3h5r n ASN 75 N -3.34 2.32 -1.75 1.42 3.02 -1.11 -4.94 115.26 110.88 3h5r n ASN 75 Ca -0.00 -1.80 -0.20 0.00 -0.03 0.00 0.00 54.58 52.55 3h5r n ASN 75 Cb 0.35 -0.12 -0.07 0.00 -0.61 0.00 0.00 39.78 39.32 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 0.76 -0.26 -0.03 3.10 3.72 -0.56 -4.87 117.46 119.32 3h5r n PHE 76 Ca 0.17 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.45 3h5r n PHE 76 Cb 0.44 -3.47 0.00 0.00 -0.94 0.00 0.00 39.48 35.52 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 0.00 0.90 -3.58 1.38 0.04 -1.42 -3.42 116.94 110.83 3h5r h PHE 77 Ca -0.42 -0.32 -0.68 0.00 2.80 0.00 0.00 57.97 59.34 3h5r h PHE 77 Cb 1.31 -0.17 -0.18 0.00 2.20 0.00 0.00 35.95 39.11 3h5r h PHE 77 CO 0.56 1.11 -0.68 0.96 -0.60 0.00 0.00 178.31 179.66 3h5r s ILE 78 N -4.04 3.84 0.15 -0.55 -4.36 -1.03 -0.74 121.20 114.48 3h5r s ILE 78 Ca -0.09 -0.46 0.06 0.00 -0.26 0.00 0.00 60.65 59.90 3h5r s ILE 78 Cb 0.11 -2.59 -0.04 0.00 1.25 0.00 0.00 42.46 41.18 3h5r s ILE 78 CO 0.87 0.58 -0.13 0.27 0.24 0.00 0.00 174.94 176.77 3h5r s ILE 79 N -0.85 1.37 0.17 8.37 -4.36 -0.06 -4.37 121.20 121.47 3h5r s ILE 79 Ca 0.13 -1.97 -0.34 0.00 -0.26 0.00 0.00 60.65 58.21 3h5r s ILE 79 Cb -0.11 -1.78 -0.15 0.00 1.25 0.00 0.00 42.46 41.67 3h5r s ILE 79 CO 0.02 -0.59 1.43 -2.65 0.24 0.00 0.00 174.94 173.39 3h5r n PRO 80 N 0.03 1.77 -0.23 0.37 -0.02 -1.26 -0.41 135.00 135.25 3h5r n PRO 80 Ca -0.12 0.63 0.25 0.00 -2.02 0.00 0.00 63.50 62.25 3h5r n PRO 80 Cb 0.59 -2.31 0.63 0.00 -0.02 0.00 0.00 33.50 32.39 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 4.84 0.44 2.00 -1.23 0.00 -0.89 -0.49 103.07 107.74 3h5r h GLY 81 Ca -0.45 -0.09 -0.02 0.00 0.00 0.00 0.00 47.33 46.77 3h5r h GLY 81 CO 0.80 -0.02 -0.10 1.05 0.00 0.00 0.00 176.54 178.27 3h5r h GLU 82 N 0.18 0.00 0.00 4.80 -0.00 -1.89 -2.23 114.58 115.45 3h5r h GLU 82 Ca 0.47 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.83 3h5r h GLU 82 Cb 1.54 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 30.29 3h5r h GLU 82 CO -0.10 0.10 0.00 0.66 -0.00 0.00 0.00 179.01 179.67 3h5r n TYR 83 N -4.02 0.00 0.43 2.06 4.02 -0.19 -3.61 117.16 115.85 3h5r n TYR 83 Ca -0.02 0.00 0.11 0.00 -0.01 0.00 0.00 57.90 57.98 3h5r n TYR 83 Cb 0.19 -0.26 0.04 0.00 -0.02 0.00 0.00 39.34 39.29 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 -1.26 0.65 0.00 7.72 5.15 -0.84 -4.63 115.26 122.06 3h5r n ASN 84 Ca 0.08 0.01 0.00 0.00 -0.60 0.00 0.00 54.58 54.07 3h5r n ASN 84 Cb 0.12 0.63 0.00 0.00 -0.53 0.00 0.00 39.78 40.00 3h5r n ASN 84 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 3h5r n ASN 85 N -2.18 0.00 0.00 1.20 2.85 -1.24 -5.18 115.26 110.71 3h5r n ASN 85 Ca 0.01 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.48 3h5r n ASN 85 Cb 0.47 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.49 3h5r n ASN 85 CO 0.00 0.00 0.00 -3.20 -2.11 0.00 0.00 177.26 171.95 3h5r n ASN 90 N 0.00 0.00 -0.18 1.20 2.85 -1.26 -5.22 115.26 112.65 3h5r n ASN 90 Ca 0.00 0.00 0.02 0.00 -0.11 0.00 0.00 54.58 54.49 3h5r n ASN 90 Cb 0.00 0.00 0.06 0.00 1.24 0.00 0.00 39.78 41.08 3h5r n ASN 90 CO 0.00 0.00 0.00 -1.14 -2.11 0.00 0.00 177.26 174.01 3h5r n ARG 91 N 0.00 -0.06 -0.65 1.20 0.63 -1.26 -0.82 116.66 115.70 3h5r n ARG 91 Ca 0.00 0.79 0.05 0.00 -0.92 0.00 0.00 57.85 57.77 3h5r n ARG 91 Cb 0.00 -1.17 0.30 0.00 0.45 0.00 0.00 32.46 32.04 3h5r n ARG 91 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 3h5r n TYR 92 N -4.81 1.51 -0.31 -0.14 4.01 -1.26 -4.69 117.16 111.47 3h5r n TYR 92 Ca 0.07 -0.53 0.11 0.00 -0.16 0.00 0.00 57.90 57.39 3h5r n TYR 92 Cb 0.24 -0.38 0.28 0.00 -0.31 0.00 0.00 39.34 39.17 3h5r n TYR 92 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 3h5r h SER 93 N 3.01 0.52 1.02 7.72 4.64 -1.41 -0.66 113.55 128.39 3h5r h SER 93 Ca 0.00 0.12 -0.18 0.00 -0.47 0.00 0.00 61.79 61.26 3h5r h SER 93 Cb 1.55 0.04 -0.03 0.00 -0.31 0.00 0.00 62.40 63.66 3h5r h SER 93 CO 0.35 0.15 -1.03 -0.09 -0.87 0.00 0.00 176.83 175.33 3h5r h ARG 94 N 0.57 0.00 -0.22 4.77 1.12 -1.85 -2.14 114.38 116.63 3h5r h ARG 94 Ca 0.53 0.00 -0.06 0.00 -1.11 0.00 0.00 59.98 59.34 3h5r h ARG 94 Cb 0.87 0.00 -0.01 0.00 -0.01 0.00 0.00 29.97 30.82 3h5r h ARG 94 CO -0.43 0.61 -0.14 -0.91 -3.11 0.00 0.00 179.97 175.99 3h5r h ASN 95 N 0.00 0.35 -0.34 -3.80 2.35 -1.83 -2.78 115.58 109.53 3h5r h ASN 95 Ca -0.08 -0.08 -0.08 0.00 -0.55 0.00 0.00 56.30 55.50 3h5r h ASN 95 Cb 1.64 -0.09 -0.02 0.00 0.05 0.00 0.00 38.32 39.90 3h5r h ASN 95 CO 0.08 0.51 -0.07 -0.26 -1.65 0.00 0.00 177.43 176.04 3h5r h PHE 96 N 0.34 0.81 -0.37 1.19 -1.00 -0.45 -1.46 116.94 116.00 3h5r h PHE 96 Ca 0.06 -0.13 -0.14 0.00 2.81 0.00 0.00 57.97 60.57 3h5r h PHE 96 Cb 0.45 -0.21 -0.01 0.00 3.61 0.00 0.00 35.95 39.79 3h5r h PHE 96 CO 0.01 0.80 -0.33 -0.07 -1.61 0.00 0.00 178.31 177.11 3h5r h LEU 97 N 0.69 0.86 0.14 1.54 3.38 -1.42 -1.72 115.31 118.78 3h5r h LEU 97 Ca 0.12 -0.36 0.01 0.00 0.09 0.00 0.00 57.88 57.75 3h5r h LEU 97 Cb 0.53 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 3h5r h LEU 97 CO 0.03 1.11 -0.25 -0.74 0.09 0.00 0.00 178.44 178.68 3h5r h HIS 98 N 0.69 -0.66 -0.60 1.13 2.76 -1.14 -1.81 115.15 115.52 3h5r h HIS 98 Ca 0.07 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.25 3h5r h HIS 98 Cb 0.88 0.27 -0.03 0.00 1.55 0.00 0.00 27.41 30.08 3h5r h HIS 98 CO 0.05 -0.35 0.36 1.88 -1.30 0.00 0.00 177.93 178.57 3h5r h TYR 99 N -0.46 0.80 -0.96 5.26 0.05 -1.17 -2.70 116.97 117.79 3h5r h TYR 99 Ca 0.02 -0.01 0.11 0.00 0.05 0.00 0.00 58.73 58.90 3h5r h TYR 99 Cb 0.48 -0.26 -0.08 0.00 1.01 0.00 0.00 36.73 37.88 3h5r h TYR 99 CO -0.22 0.56 0.59 1.96 -1.05 0.00 0.00 178.16 180.00 3h5r h GLN 100 N 0.82 0.94 0.00 4.88 4.20 -1.16 -1.01 115.11 123.78 3h5r h GLN 100 Ca 0.22 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.87 3h5r h GLN 100 Cb -0.01 -0.21 0.00 0.00 0.30 0.00 0.00 27.48 27.56 3h5r h GLN 100 CO -0.04 0.62 0.00 -1.13 -0.67 0.00 0.00 178.83 177.62 3h5r n SER 101 N -4.63 0.62 -1.09 1.46 3.41 -0.69 -0.37 113.62 112.33 3h5r n SER 101 Ca 0.17 0.67 0.10 0.00 -0.26 0.00 0.00 58.87 59.55 3h5r n SER 101 Cb 0.31 -0.80 0.25 0.00 -0.26 0.00 0.00 64.21 63.71 3h5r n SER 101 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 3h5r n TYR 102 N -2.21 0.73 -1.00 7.33 4.02 -0.44 -4.77 117.16 120.81 3h5r n TYR 102 Ca 0.02 -0.45 -0.00 0.00 -0.01 0.00 0.00 57.90 57.46 3h5r n TYR 102 Cb 0.19 -0.01 -0.00 0.00 -0.02 0.00 0.00 39.34 39.50 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 1.26 0.42 3.94 2.72 0.00 0.51 -4.94 105.19 109.10 3h5r n GLY 103 Ca 0.19 -0.82 -0.24 0.00 0.00 0.00 0.00 46.02 45.16 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 3.74 -0.43 4.61 0.00 -0.84 -5.01 121.76 121.84 3h5r s ALA 104 Ca 0.00 -0.92 -0.23 0.00 0.00 0.00 0.00 51.96 50.81 3h5r s ALA 104 Cb 0.00 -2.06 0.02 0.00 0.00 0.00 0.00 23.12 21.09 3h5r s ALA 104 CO 0.00 0.10 0.80 1.21 0.00 0.00 0.00 175.76 177.86 3h5r s ASN 105 N -3.85 6.45 0.22 0.00 3.84 -1.26 -3.96 114.94 116.38 3h5r s ASN 105 Ca 0.39 0.03 -0.08 0.00 0.21 0.00 0.00 52.86 53.40 3h5r s ASN 105 Cb -0.10 -2.39 0.27 0.00 -0.55 0.00 0.00 41.25 38.48 3h5r s ASN 105 CO 0.34 -0.88 1.80 -0.65 -2.79 0.00 0.00 177.10 174.91 3h5r h PRO 106 N 8.87 0.65 -0.52 0.43 0.11 -1.86 -0.71 132.00 138.96 3h5r h PRO 106 Ca -0.25 -0.04 0.01 0.00 0.11 0.00 0.00 66.00 65.83 3h5r h PRO 106 Cb 1.09 -0.15 -0.03 0.00 0.11 0.00 0.00 31.00 32.02 3h5r h PRO 106 CO 0.95 0.43 0.35 0.28 -0.21 0.00 0.00 178.00 179.80 3h5r h VAL 107 N 0.67 1.13 -0.12 3.15 2.07 -1.93 0.23 116.25 121.45 3h5r h VAL 107 Ca 0.32 -0.24 -0.23 0.00 0.82 0.00 0.00 66.70 67.37 3h5r h VAL 107 Cb 0.24 0.37 0.01 0.00 -1.52 0.00 0.00 31.29 30.39 3h5r h VAL 107 CO -0.21 0.13 -0.83 -0.07 0.02 0.00 0.00 177.57 176.61 3h5r h LEU 108 N 0.70 0.90 0.16 2.57 3.38 -1.57 -1.38 115.31 120.06 3h5r h LEU 108 Ca 0.19 -0.61 -0.00 0.00 0.09 0.00 0.00 57.88 57.54 3h5r h LEU 108 Cb -0.07 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.41 3h5r h LEU 108 CO -0.04 1.41 -0.09 0.58 0.09 0.00 0.00 178.44 180.39 3h5r h VAL 109 N 0.49 0.80 -0.81 1.22 2.07 -1.10 -2.59 116.25 116.33 3h5r h VAL 109 Ca -0.07 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.53 3h5r h VAL 109 Cb 1.46 0.80 -0.05 0.00 -1.52 0.00 0.00 31.29 31.98 3h5r h VAL 109 CO 0.17 0.00 0.53 -0.61 0.02 0.00 0.00 177.57 177.68 3h5r h GLN 110 N -0.24 0.81 -0.75 1.57 5.75 -0.51 -0.64 115.11 121.10 3h5r h GLN 110 Ca -0.02 -0.05 -0.06 0.00 -0.15 0.00 0.00 58.65 58.38 3h5r h GLN 110 Cb 0.20 -0.18 -0.03 0.00 1.07 0.00 0.00 27.48 28.53 3h5r h GLN 110 CO 0.02 0.54 0.24 0.22 -2.65 0.00 0.00 178.83 177.20 3h5r h ASP 111 N 0.84 1.09 -0.78 -0.69 1.82 -1.13 -0.97 116.42 116.60 3h5r h ASP 111 Ca 0.36 -0.20 -0.05 0.00 -0.39 0.00 0.00 57.03 56.75 3h5r h ASP 111 Cb 0.32 -0.28 -0.03 0.00 0.68 0.00 0.00 39.33 40.01 3h5r h ASP 111 CO -0.14 1.00 0.30 0.11 -1.61 0.00 0.00 179.24 178.90 3h5r h LYS 112 N 1.12 1.17 0.06 0.28 1.57 -0.74 -1.63 116.57 118.41 3h5r h LYS 112 Ca 0.24 -0.22 -0.00 0.00 -1.87 0.00 0.00 60.65 58.80 3h5r h LYS 112 Cb 0.29 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.42 3h5r h LYS 112 CO -0.01 0.96 -0.03 -0.07 -0.57 0.00 0.00 179.45 179.73 3h5r h LEU 113 N 1.14 -0.07 -1.13 2.94 3.38 -1.31 -2.92 115.31 117.33 3h5r h LEU 113 Ca 0.26 -0.24 0.21 0.00 0.09 0.00 0.00 57.88 58.19 3h5r h LEU 113 Cb 0.23 0.02 -0.10 0.00 0.09 0.00 0.00 40.66 40.90 3h5r h LEU 113 CO -0.02 0.21 0.62 0.50 0.09 0.00 0.00 178.44 179.84 3h5r h LYS 114 N -0.35 0.63 -0.41 1.13 3.64 -0.95 0.53 116.57 120.78 3h5r h LYS 114 Ca -0.01 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 3h5r h LYS 114 Cb 0.31 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.99 3h5r h LYS 114 CO 0.01 0.42 0.00 0.09 -2.27 0.00 0.00 179.45 177.70 3h5r n ASN 115 N -4.72 2.08 -4.81 4.20 3.02 -0.62 -3.35 115.26 111.07 3h5r n ASN 115 Ca 0.23 -2.05 -0.28 0.00 -0.03 0.00 0.00 54.58 52.45 3h5r n ASN 115 Cb 0.64 -0.28 -0.06 0.00 -0.61 0.00 0.00 39.78 39.48 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 -1.55 3.63 -0.09 5.41 0.00 -0.71 -4.96 121.76 123.48 3h5r s ALA 116 Ca 0.24 -1.09 0.03 0.00 0.00 0.00 0.00 51.96 51.15 3h5r s ALA 116 Cb 0.13 -1.46 -0.01 0.00 0.00 0.00 0.00 23.12 21.78 3h5r s ALA 116 CO 0.15 0.64 -0.19 0.15 0.00 0.00 0.00 175.76 176.51 3h5r s LYS 117 N -2.76 2.93 -0.08 0.00 1.02 -1.26 -1.80 119.74 117.79 3h5r s LYS 117 Ca 0.31 -0.80 0.03 0.00 0.02 0.00 0.00 55.97 55.53 3h5r s LYS 117 Cb -0.11 -2.38 0.01 0.00 -0.52 0.00 0.00 37.83 34.82 3h5r s LYS 117 CO 0.23 0.32 -0.19 0.08 -0.92 0.00 0.00 175.35 174.88 3h5r s VAL 118 N 0.03 1.64 -0.12 3.17 1.01 -0.70 -1.12 120.40 124.31 3h5r s VAL 118 Ca -0.07 -0.77 -0.20 0.00 0.00 0.00 0.00 61.98 60.94 3h5r s VAL 118 Cb -0.15 -1.44 -0.04 0.00 0.00 0.00 0.00 36.38 34.75 3h5r s VAL 118 CO 0.05 0.47 0.55 -0.69 0.00 0.00 0.00 175.10 175.48 3h5r s VAL 119 N 0.47 5.13 -0.60 2.92 1.01 -0.91 -0.52 120.40 127.90 3h5r s VAL 119 Ca -0.17 1.10 -0.11 0.00 0.00 0.00 0.00 61.98 62.80 3h5r s VAL 119 Cb -0.17 -3.89 0.15 0.00 0.00 0.00 0.00 36.38 32.48 3h5r s VAL 119 CO 0.06 0.28 0.51 -0.63 0.00 0.00 0.00 175.10 175.32 3h5r s ILE 120 N 0.85 4.77 -0.98 2.22 -1.09 0.71 -0.11 121.20 127.57 3h5r s ILE 120 Ca 0.29 -2.04 -0.17 0.00 -2.23 0.00 0.00 60.65 56.50 3h5r s ILE 120 Cb -0.16 -4.06 0.16 0.00 -1.58 0.00 0.00 42.46 36.82 3h5r s ILE 120 CO 0.12 -0.88 1.14 -0.22 -1.23 0.00 0.00 174.94 173.88 3h5r s LEU 121 N 0.93 5.33 0.00 2.97 2.96 -0.25 -0.86 118.68 129.76 3h5r s LEU 121 Ca 0.10 -2.39 0.00 0.00 -0.22 0.00 0.00 54.13 51.62 3h5r s LEU 121 Cb -0.22 -2.37 0.00 0.00 0.50 0.00 0.00 46.19 44.10 3h5r s LEU 121 CO -0.02 -0.90 0.00 0.61 -1.32 0.00 0.00 176.35 174.71 3h5r n GLY 122 N 4.90 3.15 0.95 7.98 0.00 -0.38 -2.33 105.19 119.45 3h5r n GLY 122 Ca 0.25 -1.05 -0.01 0.00 0.00 0.00 0.00 46.02 45.22 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 -1.09 1.21 0.17 0.00 0.00 -1.26 -4.41 105.19 99.80 3h5r n GLY 124 Ca 0.27 -1.53 -0.06 0.00 0.00 0.00 0.00 46.02 44.70 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 0.19 0.60 -0.02 0.00 -1.92 0.11 103.07 102.03 3h5r h GLY 125 Ca 0.00 0.14 -0.06 0.00 0.00 0.00 0.00 47.33 47.41 3h5r h GLY 125 CO 0.00 -0.14 -0.18 -2.22 0.00 0.00 0.00 176.54 174.00 3h5r h ILE 126 N -0.04 1.43 -0.54 2.60 1.08 -1.88 -2.75 117.51 117.42 3h5r h ILE 126 Ca 0.16 -1.55 0.04 0.00 -0.39 0.00 0.00 64.86 63.12 3h5r h ILE 126 Cb 0.28 2.29 -0.04 0.00 -3.07 0.00 0.00 36.82 36.28 3h5r h ILE 126 CO -0.36 0.44 0.29 1.23 -0.69 0.00 0.00 178.15 179.05 3h5r h GLY 127 N -0.28 0.76 0.01 5.37 0.00 -1.62 0.24 103.07 107.56 3h5r h GLY 127 Ca -0.00 -0.20 0.05 0.00 0.00 0.00 0.00 47.33 47.17 3h5r h GLY 127 CO 0.04 0.14 -0.39 3.43 0.00 0.00 0.00 176.54 179.76 3h5r h ASN 128 N 0.56 -1.22 -0.27 0.19 2.35 -0.96 0.12 115.58 116.35 3h5r h ASN 128 Ca 0.23 0.17 -0.18 0.00 -0.55 0.00 0.00 56.30 55.98 3h5r h ASN 128 Cb 0.12 0.51 -0.00 0.00 0.05 0.00 0.00 38.32 39.00 3h5r h ASN 128 CO -0.15 -0.40 -0.50 0.45 -1.65 0.00 0.00 177.43 175.18 3h5r h HIS 129 N -0.44 1.06 0.13 1.19 3.86 -1.15 -2.65 115.15 117.15 3h5r h HIS 129 Ca 0.09 -0.36 -0.01 0.00 -1.16 0.00 0.00 60.37 58.94 3h5r h HIS 129 Cb 0.60 -0.21 0.00 0.00 1.06 0.00 0.00 27.41 28.86 3h5r h HIS 129 CO -0.48 1.18 -0.06 0.28 0.86 0.00 0.00 177.93 179.70 3h5r h VAL 130 N 0.67 0.99 -0.74 2.45 2.07 -0.44 -3.05 116.25 118.19 3h5r h VAL 130 Ca 0.03 -0.53 0.03 0.00 0.82 0.00 0.00 66.70 67.04 3h5r h VAL 130 Cb 1.10 1.32 -0.04 0.00 -1.52 0.00 0.00 31.29 32.15 3h5r h VAL 130 CO 0.11 0.13 0.49 0.77 0.02 0.00 0.00 177.57 179.09 3h5r h SER 131 N -0.43 0.79 -0.51 0.57 4.64 -0.79 -1.67 113.55 116.15 3h5r h SER 131 Ca -0.02 -0.01 -0.11 0.00 -0.47 0.00 0.00 61.79 61.18 3h5r h SER 131 Cb 0.34 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 62.23 3h5r h SER 131 CO 0.03 0.55 -0.12 1.62 -0.87 0.00 0.00 176.83 178.04 3h5r h VAL 132 N 0.92 1.27 0.19 0.95 3.04 -1.51 -0.76 116.25 120.36 3h5r h VAL 132 Ca 0.29 -1.27 0.00 0.00 -1.01 0.00 0.00 66.70 64.71 3h5r h VAL 132 Cb 0.01 1.04 -0.02 0.00 -2.01 0.00 0.00 31.29 30.32 3h5r h VAL 132 CO -0.08 0.44 -0.19 0.40 -1.01 0.00 0.00 177.57 177.14 3h5r h ILE 133 N 0.84 0.59 -0.60 3.17 2.04 -1.36 -1.92 117.51 120.27 3h5r h ILE 133 Ca 0.13 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.06 3h5r h ILE 133 Cb 0.68 0.59 -0.06 0.00 -0.74 0.00 0.00 36.82 37.29 3h5r h ILE 133 CO 0.05 0.00 0.28 -0.07 0.00 0.00 0.00 178.15 178.41 3h5r h LEU 134 N -0.41 0.36 -0.36 1.44 3.38 -1.27 -0.47 115.31 117.98 3h5r h LEU 134 Ca 0.00 0.05 -0.07 0.00 0.09 0.00 0.00 57.88 57.95 3h5r h LEU 134 Cb 0.38 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 3h5r h LEU 134 CO -0.05 0.23 -0.05 0.00 0.09 0.00 0.00 178.44 178.66 3h5r h ALA 135 N 1.36 0.49 0.00 1.53 0.00 -1.05 -1.22 119.26 120.38 3h5r h ALA 135 Ca 0.29 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3h5r h ALA 135 Cb 0.27 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.93 3h5r h ALA 135 CO -0.23 0.31 0.00 0.25 0.00 0.00 0.00 179.25 179.58 3h5r n THR 136 N -4.43 0.60 1.16 0.00 -2.24 -0.73 -2.02 114.28 106.62 3h5r n THR 136 Ca -0.02 -0.28 0.14 0.00 -2.27 0.00 0.00 64.05 61.61 3h5r n THR 136 Cb 0.32 -0.59 0.53 0.00 -2.10 0.00 0.00 70.33 68.49 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 -2.26 0.30 0.00 3.42 7.64 -0.20 -4.93 113.62 117.59 3h5r n SER 137 Ca 0.06 -0.11 0.00 0.00 1.01 0.00 0.00 58.87 59.82 3h5r n SER 137 Cb 0.43 -0.14 0.00 0.00 -1.01 0.00 0.00 64.21 63.49 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 1.41 0.77 3.68 0.23 0.00 -0.86 -4.93 105.19 105.50 3h5r n GLY 138 Ca 0.10 -0.50 -0.44 0.00 0.00 0.00 0.00 46.02 45.17 3h5r n GLY 138 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3h5r n ILE 139 N -2.46 0.40 -0.05 -0.61 2.08 -0.49 -2.69 119.36 115.53 3h5r n ILE 139 Ca 0.00 -0.07 -0.03 0.00 0.56 0.00 0.00 62.75 63.21 3h5r n ILE 139 Cb 0.03 -2.04 0.20 0.00 -0.75 0.00 0.00 39.64 37.08 3h5r n ILE 139 CO 0.00 0.00 0.00 1.23 0.56 0.00 0.00 176.55 178.34 3h5r h GLY 140 N 8.59 0.70 -6.52 7.39 0.00 -0.88 -3.43 103.07 108.92 3h5r h GLY 140 Ca -0.47 -0.48 -0.30 0.00 0.00 0.00 0.00 47.33 46.09 3h5r h GLY 140 CO 0.94 0.44 -0.72 1.85 0.00 0.00 0.00 176.54 179.05 3h5r s GLU 141 N -4.87 -0.03 -0.09 4.80 2.12 -0.74 -1.28 118.70 118.60 3h5r s GLU 141 Ca -0.08 0.21 0.02 0.00 0.36 0.00 0.00 54.97 55.47 3h5r s GLU 141 Cb 0.15 -0.25 0.01 0.00 0.26 0.00 0.00 34.13 34.30 3h5r s GLU 141 CO 0.79 -0.17 -0.14 0.42 -0.54 0.00 0.00 175.26 175.62 3h5r s ILE 142 N 1.11 1.34 -0.33 -3.70 1.01 -0.22 -1.71 121.20 118.70 3h5r s ILE 142 Ca -0.09 -0.56 -0.09 0.00 0.00 0.00 0.00 60.65 59.92 3h5r s ILE 142 Cb -0.13 -1.24 0.02 0.00 0.01 0.00 0.00 42.46 41.13 3h5r s ILE 142 CO -0.03 0.41 0.14 -0.63 0.00 0.00 0.00 174.94 174.83 3h5r s ILE 143 N 0.93 4.22 -0.26 2.92 1.01 0.32 -0.72 121.20 129.63 3h5r s ILE 143 Ca -0.08 -0.81 -0.19 0.00 0.00 0.00 0.00 60.65 59.57 3h5r s ILE 143 Cb -0.15 -3.29 -0.02 0.00 0.01 0.00 0.00 42.46 39.01 3h5r s ILE 143 CO -0.00 -0.09 0.57 -0.76 0.00 0.00 0.00 174.94 174.66 3h5r s LEU 144 N 1.51 4.06 -0.23 2.97 1.43 0.10 -0.21 118.68 128.31 3h5r s LEU 144 Ca 0.02 0.59 0.02 0.00 -1.03 0.00 0.00 54.13 53.73 3h5r s LEU 144 Cb -0.18 -2.75 0.05 0.00 0.03 0.00 0.00 46.19 43.34 3h5r s LEU 144 CO 0.05 -0.33 -0.13 -0.63 0.23 0.00 0.00 176.35 175.53 3h5r s ILE 145 N 2.40 2.08 -0.25 -0.59 1.01 -0.04 -0.57 121.20 125.25 3h5r s ILE 145 Ca 0.23 -1.38 -0.28 0.00 0.00 0.00 0.00 60.65 59.23 3h5r s ILE 145 Cb -0.16 -2.10 0.16 0.00 0.01 0.00 0.00 42.46 40.38 3h5r s ILE 145 CO 0.09 0.15 1.23 -0.62 0.00 0.00 0.00 174.94 175.79 3h5r s ASP 146 N 1.18 -0.19 -0.07 3.58 -1.08 -0.94 -1.25 116.67 117.90 3h5r s ASP 146 Ca -0.04 0.27 0.10 0.00 -0.52 0.00 0.00 52.55 52.36 3h5r s ASP 146 Cb -0.18 0.24 0.22 0.00 -1.46 0.00 0.00 42.92 41.75 3h5r s ASP 146 CO -0.08 -0.13 1.15 -3.20 0.52 0.00 0.00 175.17 173.44 3h5r n ASN 147 N 1.05 2.54 -4.89 -0.34 5.15 -1.14 -2.91 115.26 114.72 3h5r n ASN 147 Ca -0.07 -2.51 -0.30 0.00 -0.60 0.00 0.00 54.58 51.10 3h5r n ASN 147 Cb 0.58 -0.26 -0.04 0.00 -0.53 0.00 0.00 39.78 39.53 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 -1.76 6.50 0.17 1.20 1.11 -1.26 -4.93 116.67 117.70 3h5r s ASP 148 Ca 0.21 0.79 -0.03 0.00 0.18 0.00 0.00 52.55 53.69 3h5r s ASP 148 Cb 0.16 -2.17 -0.05 0.00 1.07 0.00 0.00 42.92 41.93 3h5r s ASP 148 CO 0.05 -0.15 0.38 -1.10 1.18 0.00 0.00 175.17 175.53 3h5r s GLN 149 N -3.29 3.57 0.15 8.23 1.11 -1.26 -1.77 119.66 126.39 3h5r s GLN 149 Ca 0.45 -0.21 -0.30 0.00 0.01 0.00 0.00 55.36 55.31 3h5r s GLN 149 Cb -0.11 -2.85 -0.07 0.00 -1.01 0.00 0.00 33.01 28.97 3h5r s GLN 149 CO 0.27 0.44 1.16 0.42 0.01 0.00 0.00 175.29 177.58 3h5r s ILE 150 N -1.76 3.83 0.22 1.08 1.01 -0.34 -4.84 121.20 120.40 3h5r s ILE 150 Ca 0.40 1.49 0.10 0.00 0.00 0.00 0.00 60.65 62.63 3h5r s ILE 150 Cb -0.12 -3.95 -0.04 0.00 0.01 0.00 0.00 42.46 38.36 3h5r s ILE 150 CO 0.27 0.21 -0.10 -1.61 0.00 0.00 0.00 174.94 173.71 3h5r s GLU 151 N 0.06 2.03 0.60 2.79 2.02 -1.26 -1.41 118.70 123.53 3h5r s GLU 151 Ca 0.53 -1.40 0.30 0.00 0.02 0.00 0.00 54.97 54.42 3h5r s GLU 151 Cb -0.30 -2.08 1.67 0.00 0.10 0.00 0.00 34.13 33.51 3h5r s GLU 151 CO 0.34 0.40 2.07 -2.95 0.02 0.00 0.00 175.26 175.13 3h5r h ASN 152 N 2.57 0.00 1.33 -0.19 -1.07 -1.96 0.19 115.58 116.45 3h5r h ASN 152 Ca -0.45 0.00 0.00 0.00 0.07 0.00 0.00 56.30 55.92 3h5r h ASN 152 Cb 1.22 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.47 3h5r h ASN 152 CO 0.56 0.00 0.00 0.00 0.07 0.00 0.00 177.43 178.06 3h5r h THR 153 N 0.00 0.00 0.00 6.14 1.03 -2.02 -3.18 112.91 114.88 3h5r h THR 153 Ca 0.09 -0.57 0.00 0.00 -0.01 0.00 0.00 66.41 65.93 3h5r h THR 153 Cb 0.59 1.50 0.00 0.00 -1.07 0.00 0.00 68.15 69.17 3h5r h THR 153 CO -0.00 0.00 0.00 0.78 -0.01 0.00 0.00 175.52 176.29 3h5r h ASN 154 N 0.00 0.00 1.36 0.00 -0.26 -1.02 -3.35 115.58 112.31 3h5r h ASN 154 Ca 0.00 0.00 -0.01 0.00 -0.56 0.00 0.00 56.30 55.73 3h5r h ASN 154 Cb 0.67 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 37.92 3h5r h ASN 154 CO 0.00 0.00 -0.06 -0.07 -1.06 0.00 0.00 177.43 176.24 3h5r h LEU 155 N 0.00 0.00 -2.03 1.61 3.38 -1.70 -1.37 115.31 115.20 3h5r h LEU 155 Ca 0.00 0.00 0.12 0.00 0.09 0.00 0.00 57.88 58.09 3h5r h LEU 155 Cb 0.55 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 3h5r h LEU 155 CO 0.00 0.06 0.39 0.00 0.09 0.00 0.00 178.44 178.99 3h5r h THR 156 N 0.00 0.47 0.00 0.22 1.03 -1.84 -3.33 112.91 109.46 3h5r h THR 156 Ca -0.00 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.40 3h5r h THR 156 Cb 0.76 0.70 0.00 0.00 -1.07 0.00 0.00 68.15 68.53 3h5r h THR 156 CO 0.01 0.00 0.00 -2.11 -0.01 0.00 0.00 175.52 173.41 3h5r n ARG 157 N -3.89 2.35 -3.02 0.00 1.85 -1.09 -4.59 116.66 108.28 3h5r n ARG 157 Ca 0.07 0.00 -0.44 0.00 -1.00 0.00 0.00 57.85 56.48 3h5r n ARG 157 Cb 0.58 -0.20 -0.00 0.00 -1.05 0.00 0.00 32.46 31.79 3h5r n ARG 157 CO 0.00 0.00 0.00 -0.65 -0.01 0.00 0.00 177.63 176.97 3h5r s GLN 158 N 0.00 4.05 0.60 2.89 -0.21 -0.54 -4.73 119.66 121.72 3h5r s GLN 158 Ca 0.00 -2.60 0.32 0.00 0.02 0.00 0.00 55.36 53.10 3h5r s GLN 158 Cb 0.00 -4.95 1.91 0.00 1.00 0.00 0.00 33.01 30.96 3h5r s GLN 158 CO 0.00 -1.67 2.26 -0.24 -2.12 0.00 0.00 175.29 173.52 3h5r h VAL 159 N 4.62 0.43 0.00 1.09 3.04 -1.86 -1.99 116.25 121.57 3h5r h VAL 159 Ca 0.27 -0.05 0.00 0.00 -1.01 0.00 0.00 66.70 65.91 3h5r h VAL 159 Cb 0.89 1.03 0.00 0.00 -2.01 0.00 0.00 31.29 31.21 3h5r h VAL 159 CO 1.18 0.01 -0.10 -0.07 -1.01 0.00 0.00 177.57 177.59 3h5r h LEU 160 N 0.00 0.00 -9.90 3.16 3.38 -1.89 -3.46 115.31 106.60 3h5r h LEU 160 Ca -0.00 -0.03 -0.55 0.00 0.09 0.00 0.00 57.88 57.40 3h5r h LEU 160 Cb 0.03 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.75 3h5r h LEU 160 CO 0.00 0.01 -0.09 -0.36 0.09 0.00 0.00 178.44 178.09 3h5r s PHE 161 N -3.13 3.53 0.24 1.13 2.99 -0.75 -4.95 117.98 117.04 3h5r s PHE 161 Ca 0.09 0.99 0.06 0.00 0.00 0.00 0.00 56.93 58.08 3h5r s PHE 161 Cb 0.11 -2.33 -0.05 0.00 0.00 0.00 0.00 43.02 40.75 3h5r s PHE 161 CO 0.63 0.36 -0.08 0.45 -0.00 0.00 0.00 175.22 176.58 3h5r s SER 162 N -1.98 2.51 0.45 1.36 0.15 -1.26 -4.95 113.70 109.98 3h5r s SER 162 Ca 0.42 -1.13 0.16 0.00 0.70 0.00 0.00 55.95 56.10 3h5r s SER 162 Cb -0.13 -0.12 1.10 0.00 -1.71 0.00 0.00 66.02 65.15 3h5r s SER 162 CO 0.20 -0.31 1.96 -0.33 1.20 0.00 0.00 173.24 175.96 3h5r h GLU 163 N 2.42 0.33 0.00 5.44 5.08 -1.99 -1.19 114.58 124.67 3h5r h GLU 163 Ca -0.39 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 57.95 3h5r h GLU 163 Cb 1.23 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.40 3h5r h GLU 163 CO 0.65 0.22 0.00 -0.44 -1.00 0.00 0.00 179.01 178.44 3h5r h ASP 164 N 0.34 0.00 0.24 1.42 3.45 -2.03 -2.78 116.42 117.06 3h5r h ASP 164 Ca 0.30 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.76 3h5r h ASP 164 Cb 0.72 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.49 3h5r h ASP 164 CO -0.08 0.00 -0.35 0.47 -1.57 0.00 0.00 179.24 177.71 3h5r n ASP 165 N -2.79 1.06 -4.67 6.45 8.00 -0.45 -4.92 116.55 119.22 3h5r n ASP 165 Ca 0.01 -0.87 -0.42 0.00 0.71 0.00 0.00 54.79 54.22 3h5r n ASP 165 Cb 0.26 0.23 -0.03 0.00 -0.02 0.00 0.00 41.12 41.56 3h5r n ASP 165 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3h5r s VAL 166 N -2.60 2.92 0.00 2.53 1.01 -1.05 -1.77 120.40 121.44 3h5r s VAL 166 Ca 0.21 0.15 0.00 0.00 0.00 0.00 0.00 61.98 62.34 3h5r s VAL 166 Cb 0.19 -3.10 0.00 0.00 0.00 0.00 0.00 36.38 33.47 3h5r s VAL 166 CO 0.57 -0.01 0.00 0.61 0.00 0.00 0.00 175.10 176.27 3h5r n GLY 167 N 4.34 2.43 3.90 4.51 0.00 -0.50 -4.99 105.19 114.87 3h5r n GLY 167 Ca 0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.31 2.45 0.20 1.61 1.02 -0.73 -4.67 119.74 119.31 3h5r s LYS 168 Ca 0.00 0.16 -0.30 0.00 0.02 0.00 0.00 55.97 55.85 3h5r s LYS 168 Cb 0.00 -2.05 -0.08 0.00 -0.52 0.00 0.00 37.83 35.18 3h5r s LYS 168 CO 0.00 -1.22 1.08 -0.80 -0.92 0.00 0.00 175.35 173.49 3h5r s ASN 169 N -4.45 7.31 0.12 2.83 0.01 -1.26 -1.20 114.94 118.30 3h5r s ASN 169 Ca 0.59 2.10 -0.20 0.00 -0.71 0.00 0.00 52.86 54.64 3h5r s ASN 169 Cb -0.11 -2.61 -0.05 0.00 0.41 0.00 0.00 41.25 38.90 3h5r s ASN 169 CO 0.49 -0.17 1.73 0.11 -1.51 0.00 0.00 177.10 177.76 3h5r h LYS 170 N 4.81 0.10 -0.83 -0.60 1.57 -1.67 -2.44 116.57 117.50 3h5r h LYS 170 Ca -0.45 -0.01 0.11 0.00 -1.87 0.00 0.00 60.65 58.44 3h5r h LYS 170 Cb 1.21 -0.02 -0.08 0.00 0.08 0.00 0.00 32.23 33.42 3h5r h LYS 170 CO 0.71 0.06 0.46 1.79 -0.57 0.00 0.00 179.45 181.90 3h5r h THR 171 N 0.10 0.85 -0.40 -0.16 1.35 -1.84 0.66 112.91 113.47 3h5r h THR 171 Ca 0.08 -0.25 -0.05 0.00 -0.55 0.00 0.00 66.41 65.64 3h5r h THR 171 Cb 0.08 0.06 -0.02 0.00 -1.73 0.00 0.00 68.15 66.54 3h5r h THR 171 CO -0.11 0.13 0.05 -0.08 -0.25 0.00 0.00 175.52 175.26 3h5r h GLU 172 N 0.73 0.67 -0.14 4.72 4.81 -1.87 -1.07 114.58 122.43 3h5r h GLU 172 Ca 0.41 -0.19 -0.23 0.00 -0.13 0.00 0.00 59.36 59.23 3h5r h GLU 172 Cb 0.45 -0.07 0.01 0.00 0.63 0.00 0.00 28.75 29.77 3h5r h GLU 172 CO -0.28 0.73 -0.80 0.28 -0.73 0.00 0.00 179.01 178.20 3h5r h VAL 173 N 0.51 1.27 -0.36 0.32 2.07 -1.03 -1.99 116.25 117.05 3h5r h VAL 173 Ca 0.12 -1.99 0.04 0.00 0.82 0.00 0.00 66.70 65.69 3h5r h VAL 173 Cb 0.39 2.01 -0.04 0.00 -1.52 0.00 0.00 31.29 32.13 3h5r h VAL 173 CO 0.01 0.63 0.13 0.40 0.02 0.00 0.00 177.57 178.77 3h5r h ILE 174 N 0.53 0.91 0.03 4.57 2.04 -0.80 -1.33 117.51 123.47 3h5r h ILE 174 Ca -0.06 -0.10 0.02 0.00 1.00 0.00 0.00 64.86 65.72 3h5r h ILE 174 Cb 1.44 0.60 -0.03 0.00 -0.74 0.00 0.00 36.82 38.09 3h5r h ILE 174 CO 0.17 0.05 -0.16 0.50 0.00 0.00 0.00 178.15 178.71 3h5r h LYS 175 N 0.29 -0.27 -0.68 2.37 3.64 -1.11 0.45 116.57 121.26 3h5r h LYS 175 Ca 0.16 0.02 0.12 0.00 -1.27 0.00 0.00 60.65 59.68 3h5r h LYS 175 Cb 0.12 0.06 -0.09 0.00 -0.41 0.00 0.00 32.23 31.92 3h5r h LYS 175 CO -0.16 -0.18 0.22 -0.09 -2.27 0.00 0.00 179.45 176.98 3h5r h ARG 176 N -0.28 0.36 0.04 1.90 2.43 -1.18 -0.47 114.38 117.18 3h5r h ARG 176 Ca 0.04 -0.02 -0.23 0.00 -0.81 0.00 0.00 59.98 58.96 3h5r h ARG 176 Cb 0.34 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 29.80 3h5r h ARG 176 CO -0.14 0.24 -1.02 0.93 -1.51 0.00 0.00 179.97 178.47 3h5r h GLU 177 N 0.37 0.31 -0.22 0.20 4.39 -0.37 -0.51 114.58 118.75 3h5r h GLU 177 Ca 0.36 -0.39 -0.01 0.00 0.34 0.00 0.00 59.36 59.66 3h5r h GLU 177 Cb 0.53 0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 29.30 3h5r h GLU 177 CO -0.39 1.11 0.09 -0.07 -1.16 0.00 0.00 179.01 178.59 3h5r h LEU 178 N 0.15 0.30 -1.43 1.33 3.38 0.04 -3.04 115.31 116.04 3h5r h LEU 178 Ca -0.09 -0.15 -0.06 0.00 0.09 0.00 0.00 57.88 57.67 3h5r h LEU 178 Cb 1.69 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 42.35 3h5r h LEU 178 CO 0.17 0.37 -0.25 -0.07 0.09 0.00 0.00 178.44 178.75 3h5r h LEU 179 N 0.21 0.05 -2.07 1.67 4.07 -0.97 0.75 115.31 119.03 3h5r h LEU 179 Ca 0.07 -0.01 -0.02 0.00 0.08 0.00 0.00 57.88 58.01 3h5r h LEU 179 Cb 0.16 -0.01 -0.00 0.00 1.08 0.00 0.00 40.66 41.88 3h5r h LEU 179 CO -0.01 0.31 -0.07 0.11 -1.08 0.00 0.00 178.44 177.70 3h5r h LYS 180 N 0.05 0.00 0.00 1.13 6.56 -0.99 -3.15 116.57 120.17 3h5r h LYS 180 Ca 0.01 0.00 -0.37 0.00 -1.06 0.00 0.00 60.65 59.23 3h5r h LYS 180 Cb 0.47 0.00 -0.07 0.00 -0.57 0.00 0.00 32.23 32.06 3h5r h LYS 180 CO 0.03 0.07 -2.40 0.54 -2.06 0.00 0.00 179.45 175.64 3h5r n ARG 181 N -3.99 0.68 -3.44 3.15 1.74 -0.45 -4.77 116.66 109.58 3h5r n ARG 181 Ca -0.03 0.01 -0.21 0.00 -0.77 0.00 0.00 57.85 56.86 3h5r n ARG 181 Cb 0.16 -1.52 -0.11 0.00 -1.02 0.00 0.00 32.46 29.97 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 -5.64 2.17 0.00 0.55 3.84 0.13 -4.93 114.94 111.07 3h5r s ASN 182 Ca -0.14 -0.87 0.29 0.00 0.21 0.00 0.00 52.86 52.35 3h5r s ASN 182 Cb 0.06 0.26 1.49 0.00 -0.55 0.00 0.00 41.25 42.52 3h5r s ASN 182 CO 0.80 -0.40 2.01 -1.54 -2.79 0.00 0.00 177.10 175.18 3h5r n SER 183 N 5.29 0.00 0.12 -4.21 3.41 -1.19 -3.43 113.62 113.62 3h5r n SER 183 Ca -0.03 -0.22 0.13 0.00 -0.26 0.00 0.00 58.87 58.48 3h5r n SER 183 Cb 0.45 -0.25 0.36 0.00 -0.26 0.00 0.00 64.21 64.51 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 0.00 -6.69 4.33 3.07 -1.94 -3.47 114.58 109.88 3h5r h GLU 184 Ca 0.00 0.00 -0.46 0.00 -0.50 0.00 0.00 59.36 58.40 3h5r h GLU 184 Cb 0.24 0.00 0.04 0.00 -0.84 0.00 0.00 28.75 28.19 3h5r h GLU 184 CO 0.00 0.00 -0.10 0.96 -1.40 0.00 0.00 179.01 178.47 3h5r s ILE 185 N -3.12 2.44 -0.06 3.13 -4.36 -1.22 -5.08 121.20 112.93 3h5r s ILE 185 Ca 0.10 -0.89 0.04 0.00 -0.26 0.00 0.00 60.65 59.64 3h5r s ILE 185 Cb 0.11 -2.55 -0.02 0.00 1.25 0.00 0.00 42.46 41.26 3h5r s ILE 185 CO 0.61 0.00 -0.19 -0.94 0.24 0.00 0.00 174.94 174.66 3h5r s SER 186 N -4.56 3.58 -0.05 4.36 1.04 -0.41 -5.03 113.70 112.63 3h5r s SER 186 Ca 0.60 -0.36 0.06 0.00 0.48 0.00 0.00 55.95 56.73 3h5r s SER 186 Cb -0.07 -0.92 -0.01 0.00 0.10 0.00 0.00 66.02 65.12 3h5r s SER 186 CO 0.38 0.28 -0.22 -0.69 0.98 0.00 0.00 173.24 173.97 3h5r s VAL 187 N -0.33 1.77 0.17 5.02 1.01 -1.26 -1.05 120.40 125.72 3h5r s VAL 187 Ca 0.02 -0.91 0.11 0.00 0.00 0.00 0.00 61.98 61.19 3h5r s VAL 187 Cb -0.13 -1.50 -0.04 0.00 0.00 0.00 0.00 36.38 34.71 3h5r s VAL 187 CO 0.02 0.50 -0.21 -0.44 0.00 0.00 0.00 175.10 174.97 3h5r s SER 188 N -0.14 3.62 -0.00 3.32 0.01 0.10 -4.96 113.70 115.65 3h5r s SER 188 Ca -0.02 -0.75 0.05 0.00 1.31 0.00 0.00 55.95 56.55 3h5r s SER 188 Cb -0.12 -0.37 -0.01 0.00 0.21 0.00 0.00 66.02 65.72 3h5r s SER 188 CO 0.02 0.14 -0.16 -1.61 0.41 0.00 0.00 173.24 172.04 3h5r s GLU 189 N -2.49 1.26 -0.13 12.44 2.02 -1.26 0.00 118.70 130.53 3h5r s GLU 189 Ca 0.20 -0.62 0.00 0.00 0.02 0.00 0.00 54.97 54.57 3h5r s GLU 189 Cb -0.09 -1.23 0.02 0.00 0.10 0.00 0.00 34.13 32.93 3h5r s GLU 189 CO 0.10 0.33 -0.13 0.42 0.02 0.00 0.00 175.26 176.00 3h5r s ILE 190 N -0.47 1.47 -1.16 -1.63 1.01 0.27 -4.94 121.20 115.75 3h5r s ILE 190 Ca 0.06 -0.58 -0.18 0.00 0.00 0.00 0.00 60.65 59.95 3h5r s ILE 190 Cb -0.07 -1.38 0.10 0.00 0.01 0.00 0.00 42.46 41.12 3h5r s ILE 190 CO -0.00 0.44 1.51 0.00 0.00 0.00 0.00 174.94 176.89 3h5r s ALA 191 N 1.43 3.35 -0.21 9.38 0.00 -1.26 -2.21 121.76 132.24 3h5r s ALA 191 Ca 0.03 -2.85 -0.12 0.00 0.00 0.00 0.00 51.96 49.01 3h5r s ALA 191 Cb -0.13 -4.41 0.06 0.00 0.00 0.00 0.00 23.12 18.64 3h5r s ALA 191 CO -0.09 -3.20 0.51 -1.17 0.00 0.00 0.00 175.76 171.81 3h5r s LEU 192 N 3.55 -0.35 0.03 0.00 1.98 -1.15 -4.78 118.68 117.96 3h5r s LEU 192 Ca 0.46 1.11 0.02 0.00 -2.89 0.00 0.00 54.13 52.83 3h5r s LEU 192 Cb 0.00 1.73 -0.04 0.00 0.66 0.00 0.00 46.19 48.54 3h5r s LEU 192 CO -0.01 -0.21 0.01 0.20 -1.89 0.00 0.00 176.35 174.46 3h5r s ASN 193 N 1.34 5.15 -0.61 3.68 0.01 -1.26 -2.29 114.94 120.95 3h5r s ASN 193 Ca -0.09 -0.04 -0.23 0.00 -0.71 0.00 0.00 52.86 51.79 3h5r s ASN 193 Cb -0.07 -1.32 0.05 0.00 0.41 0.00 0.00 41.25 40.32 3h5r s ASN 193 CO -0.13 0.25 0.95 -0.63 -1.51 0.00 0.00 177.10 176.03 3h5r s ILE 194 N -1.17 4.35 -0.61 0.60 -1.09 -1.26 -4.77 121.20 117.25 3h5r s ILE 194 Ca 0.22 -0.03 0.13 0.00 -2.23 0.00 0.00 60.65 58.75 3h5r s ILE 194 Cb -0.12 -4.61 -0.15 0.00 -1.58 0.00 0.00 42.46 36.00 3h5r s ILE 194 CO 0.13 -1.29 0.56 0.59 -1.23 0.00 0.00 174.94 173.70 3h5r n ASN 195 N 7.61 0.70 -3.92 3.58 3.02 -1.26 -4.34 115.26 120.64 3h5r n ASN 195 Ca -0.01 -0.78 -0.10 0.00 -0.03 0.00 0.00 54.58 53.67 3h5r n ASN 195 Cb 0.47 1.03 -0.10 0.00 -0.61 0.00 0.00 39.78 40.57 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 -2.35 0.15 0.27 6.41 1.11 -1.26 -5.03 116.67 115.96 3h5r s ASP 196 Ca 0.05 -0.43 -0.00 0.00 0.18 0.00 0.00 52.55 52.34 3h5r s ASP 196 Cb 0.10 0.19 0.57 0.00 1.07 0.00 0.00 42.92 44.86 3h5r s ASP 196 CO 0.56 -0.43 1.73 0.22 1.18 0.00 0.00 175.17 178.43 3h5r h TYR 197 N 4.04 0.63 -0.54 4.23 3.20 -1.97 -1.36 116.97 125.19 3h5r h TYR 197 Ca -0.32 0.04 0.16 0.00 3.14 0.00 0.00 58.73 61.74 3h5r h TYR 197 Cb 1.19 -0.15 -0.02 0.00 1.54 0.00 0.00 36.73 39.29 3h5r h TYR 197 CO 0.58 0.05 0.46 0.00 -1.64 0.00 0.00 178.16 177.62 3h5r h THR 198 N 0.48 0.52 0.00 1.81 1.03 -2.00 -0.78 112.91 113.97 3h5r h THR 198 Ca 0.48 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.88 3h5r h THR 198 Cb 0.79 0.66 0.00 0.00 -1.07 0.00 0.00 68.15 68.53 3h5r h THR 198 CO -0.44 0.00 0.00 0.44 -0.01 0.00 0.00 175.52 175.51 3h5r h ASP 199 N 0.00 0.00 0.85 0.00 3.45 -1.63 -2.96 116.42 116.13 3h5r h ASP 199 Ca 0.25 0.00 -0.00 0.00 0.43 0.00 0.00 57.03 57.71 3h5r h ASP 199 Cb 1.17 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 39.94 3h5r h ASP 199 CO -0.00 0.00 -0.01 -0.07 -1.57 0.00 0.00 179.24 177.59 3h5r h LEU 200 N 0.00 0.00 -1.40 1.55 3.38 -1.29 -2.35 115.31 115.20 3h5r h LEU 200 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3h5r h LEU 200 Cb 0.36 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.11 3h5r h LEU 200 CO 0.00 0.01 0.00 0.45 0.09 0.00 0.00 178.44 178.99 3h5r h HIS 201 N 0.00 0.00 0.00 1.13 3.86 -1.72 -2.03 115.15 116.39 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 0.43 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.90 3h5r h HIS 201 CO 0.00 0.00 -0.09 1.63 0.86 0.00 0.00 177.93 180.33 3h5r n LYS 202 N -2.85 0.02 -3.17 2.45 5.02 -0.88 -4.73 118.16 114.01 3h5r n LYS 202 Ca 0.01 0.01 -0.40 0.00 -2.02 0.00 0.00 58.31 55.91 3h5r n LYS 202 Cb 0.26 -1.52 -0.06 0.00 -0.02 0.00 0.00 35.03 33.69 3h5r n LYS 202 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3h5r s VAL 203 N -3.01 5.04 0.59 -0.18 1.01 -0.76 -5.04 120.40 118.05 3h5r s VAL 203 Ca 0.13 1.07 -0.16 0.00 0.00 0.00 0.00 61.98 63.02 3h5r s VAL 203 Cb 0.18 -3.90 -0.04 0.00 0.00 0.00 0.00 36.38 32.63 3h5r s VAL 203 CO 0.56 0.11 1.06 -2.16 0.00 0.00 0.00 175.10 174.68 3h5r s PRO 204 N 1.99 3.30 0.19 2.72 0.04 -1.26 -5.00 135.00 136.97 3h5r s PRO 204 Ca 0.26 1.23 -0.32 0.00 0.04 0.00 0.00 61.00 62.22 3h5r s PRO 204 Cb -0.16 -2.03 -0.16 0.00 0.04 0.00 0.00 34.50 32.20 3h5r s PRO 204 CO 0.10 -0.83 1.03 -1.91 0.04 0.00 0.00 177.00 175.42 3h5r n GLU 205 N -2.01 0.96 -4.07 4.56 2.13 -1.26 -4.95 120.64 116.00 3h5r n GLU 205 Ca 0.09 0.34 -0.11 0.00 0.66 0.00 0.00 57.16 58.14 3h5r n GLU 205 Cb 0.53 -1.74 -0.06 0.00 0.27 0.00 0.00 31.44 30.44 3h5r n GLU 205 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3h5r s ALA 206 N -0.48 0.36 0.24 4.31 0.00 -1.26 -4.99 121.76 119.94 3h5r s ALA 206 Ca 0.70 -1.24 -0.05 0.00 0.00 0.00 0.00 51.96 51.36 3h5r s ALA 206 Cb -0.86 1.17 0.35 0.00 0.00 0.00 0.00 23.12 23.78 3h5r s ALA 206 CO 0.55 -0.78 1.84 -0.44 0.00 0.00 0.00 175.76 176.93 3h5r h ASP 207 N 2.30 0.77 -4.58 0.00 5.19 -1.50 -3.44 116.42 115.16 3h5r h ASP 207 Ca -0.29 0.03 -0.07 0.00 -0.62 0.00 0.00 57.03 56.08 3h5r h ASP 207 Cb 1.25 -0.13 -0.20 0.00 0.18 0.00 0.00 39.33 40.42 3h5r h ASP 207 CO 0.40 0.48 0.04 -0.51 -3.12 0.00 0.00 179.24 176.53 3h5r s ILE 208 N -6.05 0.01 -0.16 0.35 2.07 -1.25 -4.40 121.20 111.76 3h5r s ILE 208 Ca -0.13 -0.08 -0.07 0.00 -1.41 0.00 0.00 60.65 58.96 3h5r s ILE 208 Cb 0.19 -0.88 -0.04 0.00 0.13 0.00 0.00 42.46 41.86 3h5r s ILE 208 CO 0.79 -0.04 0.08 0.26 -1.91 0.00 0.00 174.94 174.12 3h5r s TRP 209 N -0.60 3.34 -0.36 3.50 0.52 -0.48 -2.15 118.94 122.71 3h5r s TRP 209 Ca -0.07 0.23 -0.14 0.00 0.02 0.00 0.00 56.10 56.15 3h5r s TRP 209 Cb -0.03 -2.03 -0.00 0.00 -1.15 0.00 0.00 33.47 30.26 3h5r s TRP 209 CO 0.05 0.34 0.26 0.08 0.02 0.00 0.00 176.95 177.70 3h5r s VAL 210 N -0.06 5.25 -0.22 4.03 1.01 0.85 -0.34 120.40 130.91 3h5r s VAL 210 Ca 0.08 -0.39 -0.06 0.00 0.00 0.00 0.00 61.98 61.61 3h5r s VAL 210 Cb -0.12 -3.78 -0.03 0.00 0.00 0.00 0.00 36.38 32.45 3h5r s VAL 210 CO 0.01 -0.12 0.03 -0.69 0.00 0.00 0.00 175.10 174.33 3h5r s VAL 211 N 1.70 4.09 -0.46 2.92 1.01 0.53 -1.09 120.40 129.10 3h5r s VAL 211 Ca 0.06 -0.26 0.06 0.00 0.00 0.00 0.00 61.98 61.84 3h5r s VAL 211 Cb -0.18 -2.88 0.30 0.00 0.00 0.00 0.00 36.38 33.62 3h5r s VAL 211 CO 0.10 0.39 1.06 -1.54 0.00 0.00 0.00 175.10 175.10 3h5r n SER 212 N 4.60 -2.33 -4.51 3.32 3.41 -0.99 -2.43 113.62 114.69 3h5r n SER 212 Ca -0.17 -3.60 -0.34 0.00 -0.26 0.00 0.00 58.87 54.51 3h5r n SER 212 Cb 0.51 1.81 -0.12 0.00 -0.26 0.00 0.00 64.21 66.15 3h5r n SER 212 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3h5r s ALA 213 N 0.25 2.95 0.25 7.33 0.00 -1.26 -4.74 121.76 126.54 3h5r s ALA 213 Ca 0.25 -0.85 -0.04 0.00 0.00 0.00 0.00 51.96 51.32 3h5r s ALA 213 Cb 0.28 -1.41 0.37 0.00 0.00 0.00 0.00 23.12 22.36 3h5r s ALA 213 CO -0.09 0.33 1.84 -0.44 0.00 0.00 0.00 175.76 177.40 3h5r h ASP 214 N 6.24 0.80 -3.62 0.00 5.19 -1.98 -3.44 116.42 119.63 3h5r h ASP 214 Ca -0.36 0.03 -0.49 0.00 -0.62 0.00 0.00 57.03 55.59 3h5r h ASP 214 Cb 1.19 -0.14 -0.18 0.00 0.18 0.00 0.00 39.33 40.39 3h5r h ASP 214 CO 0.59 0.49 -0.77 -1.00 -3.12 0.00 0.00 179.24 175.43 3h5r s HIS 215 N -6.04 1.72 0.71 4.55 3.76 -1.26 -4.26 115.29 114.46 3h5r s HIS 215 Ca -0.12 -0.50 -0.15 0.00 -0.15 0.00 0.00 55.06 54.13 3h5r s HIS 215 Cb 0.19 -0.86 0.03 0.00 1.11 0.00 0.00 32.58 33.05 3h5r s HIS 215 CO 0.79 0.29 1.18 -2.14 -0.85 0.00 0.00 174.74 174.02 3h5r s PRO 216 N -2.87 2.31 0.49 8.40 0.02 -1.26 -4.89 135.00 137.20 3h5r s PRO 216 Ca 0.15 1.68 0.30 0.00 0.02 0.00 0.00 61.00 63.15 3h5r s PRO 216 Cb -0.05 -1.86 1.39 0.00 0.02 0.00 0.00 34.50 34.00 3h5r s PRO 216 CO 0.06 -1.69 1.81 0.27 -0.33 0.00 0.00 177.00 177.12 3h5r h PHE 217 N -0.19 0.22 -0.71 6.54 -0.00 -1.94 -0.45 116.94 120.42 3h5r h PHE 217 Ca -0.47 0.01 -0.37 0.00 -0.00 0.00 0.00 57.97 57.13 3h5r h PHE 217 Cb 1.28 -0.06 -0.22 0.00 -0.00 0.00 0.00 35.95 36.95 3h5r h PHE 217 CO 0.49 0.02 0.31 0.27 -0.00 0.00 0.00 178.31 179.40 3h5r n ASN 218 N -4.35 3.25 -0.19 -0.68 6.94 -1.26 -4.64 115.26 114.34 3h5r n ASN 218 Ca 0.24 -3.70 -0.08 0.00 -0.02 0.00 0.00 54.58 51.02 3h5r n ASN 218 Cb 1.07 -0.75 0.02 0.00 -2.36 0.00 0.00 39.78 37.76 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 1.03 0.76 -1.50 -4.53 5.85 -1.42 -2.49 115.31 113.02 3h5r h LEU 219 Ca 0.45 -0.19 -0.05 0.00 0.84 0.00 0.00 57.88 58.93 3h5r h LEU 219 Cb 2.27 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 43.10 3h5r h LEU 219 CO 0.79 0.75 -0.19 -0.29 -0.34 0.00 0.00 178.44 179.16 3h5r h ILE 220 N 0.73 1.17 -0.43 4.05 -0.00 -1.83 0.25 117.51 121.44 3h5r h ILE 220 Ca 0.17 -0.77 -0.09 0.00 -0.00 0.00 0.00 64.86 64.17 3h5r h ILE 220 Cb 0.24 1.34 -0.01 0.00 -0.00 0.00 0.00 36.82 38.39 3h5r h ILE 220 CO -0.01 0.23 -0.07 0.78 -0.00 0.00 0.00 178.15 179.08 3h5r h ASN 221 N 0.08 0.81 -0.46 2.19 4.21 -1.81 0.19 115.58 120.79 3h5r h ASN 221 Ca 0.02 -0.35 -0.05 0.00 1.21 0.00 0.00 56.30 57.13 3h5r h ASN 221 Cb 0.39 -0.22 -0.02 0.00 -1.12 0.00 0.00 38.32 37.35 3h5r h ASN 221 CO 0.03 0.97 0.09 -0.50 -1.29 0.00 0.00 177.43 176.72 3h5r h TRP 222 N 0.64 0.79 -0.50 1.19 6.55 -1.01 -2.09 115.95 121.51 3h5r h TRP 222 Ca 0.11 -0.10 -0.04 0.00 0.95 0.00 0.00 58.89 59.81 3h5r h TRP 222 Cb 0.60 -0.22 -0.02 0.00 -0.86 0.00 0.00 29.16 28.65 3h5r h TRP 222 CO 0.05 0.73 0.17 0.28 -1.05 0.00 0.00 178.44 178.62 3h5r h VAL 223 N 0.62 1.22 0.15 1.49 2.07 -0.91 0.85 116.25 121.74 3h5r h VAL 223 Ca 0.14 -0.73 0.01 0.00 0.82 0.00 0.00 66.70 66.93 3h5r h VAL 223 Cb 0.36 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 30.87 3h5r h VAL 223 CO 0.01 0.27 -0.18 -1.13 0.02 0.00 0.00 177.57 176.56 3h5r h ASN 224 N 0.67 -0.48 -0.66 0.57 -1.24 -0.87 0.37 115.58 113.94 3h5r h ASN 224 Ca 0.16 0.05 -0.03 0.00 0.71 0.00 0.00 56.30 57.20 3h5r h ASN 224 Cb 0.25 0.17 -0.03 0.00 0.73 0.00 0.00 38.32 39.44 3h5r h ASN 224 CO -0.01 -0.26 0.31 0.11 -1.29 0.00 0.00 177.43 176.29 3h5r h LYS 225 N -0.37 0.95 -0.64 6.67 1.79 -1.25 -1.12 116.57 122.59 3h5r h LYS 225 Ca 0.01 -0.14 -0.05 0.00 -2.18 0.00 0.00 60.65 58.28 3h5r h LYS 225 Cb 0.37 -0.17 -0.03 0.00 -1.58 0.00 0.00 32.23 30.82 3h5r h LYS 225 CO -0.06 0.76 0.18 -0.92 -1.08 0.00 0.00 179.45 178.33 3h5r h TYR 226 N 0.91 1.02 0.04 -1.35 3.20 -0.51 -2.87 116.97 117.42 3h5r h TYR 226 Ca 0.23 -0.10 -0.23 0.00 3.14 0.00 0.00 58.73 61.77 3h5r h TYR 226 Cb 0.13 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.09 3h5r h TYR 226 CO 0.00 0.82 -1.02 0.00 -1.64 0.00 0.00 178.16 176.32 3h5r h VAL 228 N 0.09 1.18 -0.14 0.00 2.07 -1.24 0.41 116.25 118.63 3h5r h VAL 228 Ca -0.07 -0.56 -0.10 0.00 0.82 0.00 0.00 66.70 66.79 3h5r h VAL 228 Cb 1.71 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 32.55 3h5r h VAL 228 CO 0.16 0.18 -0.34 0.03 0.02 0.00 0.00 177.57 177.62 3h5r h ARG 229 N 0.24 0.29 -0.00 1.57 -0.00 -1.36 -2.89 114.38 112.22 3h5r h ARG 229 Ca 0.08 -0.12 0.00 0.00 -0.50 0.00 0.00 59.98 59.44 3h5r h ARG 229 Cb 0.20 -0.01 0.00 0.00 0.00 0.00 0.00 29.97 30.16 3h5r h ARG 229 CO -0.01 0.60 -0.30 0.00 0.00 0.00 0.00 179.97 180.27 3h5r n ALA 230 N -2.48 3.14 -3.57 0.04 0.00 -0.06 -4.95 120.51 112.64 3h5r n ALA 230 Ca -0.01 -0.36 -0.21 0.00 0.00 0.00 0.00 53.44 52.86 3h5r n ALA 230 Cb 0.44 -1.17 0.07 0.00 0.00 0.00 0.00 19.45 18.79 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 -0.98 -3.46 -4.32 0.00 4.13 0.75 -4.99 115.26 106.39 3h5r n ASN 231 Ca 0.10 -0.64 -0.38 0.00 1.68 0.00 0.00 54.58 55.35 3h5r n ASN 231 Cb 0.33 -4.83 -0.12 0.00 -1.54 0.00 0.00 39.78 33.62 3h5r n ASN 231 CO 0.00 0.00 0.00 -1.58 0.28 0.00 0.00 177.26 175.96 3h5r s GLN 232 N -5.85 2.88 0.52 3.52 2.00 0.11 -4.85 119.66 117.99 3h5r s GLN 232 Ca 0.24 -1.01 -0.22 0.00 -2.00 0.00 0.00 55.36 52.37 3h5r s GLN 232 Cb -0.11 -3.43 -0.06 0.00 0.80 0.00 0.00 33.01 30.21 3h5r s GLN 232 CO 0.75 -0.55 1.29 -2.30 -0.50 0.00 0.00 175.29 173.98 3h5r n PRO 233 N 4.85 1.66 -3.66 1.67 -0.02 -1.26 -4.65 135.00 133.59 3h5r n PRO 233 Ca -0.13 0.61 -0.12 0.00 -2.02 0.00 0.00 63.50 61.83 3h5r n PRO 233 Cb 0.46 -2.49 -0.06 0.00 -0.02 0.00 0.00 33.50 31.40 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 -1.29 -0.26 -0.02 6.00 -0.85 -1.14 -1.38 117.35 118.42 3h5r s TYR 234 Ca 0.70 0.18 0.03 0.00 -0.52 0.00 0.00 57.07 57.46 3h5r s TYR 234 Cb -0.44 0.22 -0.01 0.00 0.38 0.00 0.00 41.96 42.12 3h5r s TYR 234 CO 0.51 -0.59 -0.11 -1.50 -1.52 0.00 0.00 175.55 172.34 3h5r s ILE 235 N -2.66 0.92 -0.04 -3.49 2.07 0.54 -0.58 121.20 117.96 3h5r s ILE 235 Ca -0.04 -0.48 -0.05 0.00 -1.41 0.00 0.00 60.65 58.67 3h5r s ILE 235 Cb -0.00 -0.79 -0.04 0.00 0.13 0.00 0.00 42.46 41.76 3h5r s ILE 235 CO -0.04 0.27 0.19 0.21 -1.91 0.00 0.00 174.94 173.66 3h5r s ASN 236 N -0.12 6.40 0.03 4.50 3.04 -1.12 -0.35 114.94 127.34 3h5r s ASN 236 Ca 0.02 0.43 -0.16 0.00 0.04 0.00 0.00 52.86 53.18 3h5r s ASN 236 Cb -0.06 -2.04 0.03 0.00 -1.54 0.00 0.00 41.25 37.64 3h5r s ASN 236 CO -0.00 0.31 0.36 0.00 -3.04 0.00 0.00 177.10 174.73 3h5r s ALA 237 N -1.23 -0.87 0.00 1.71 0.00 -1.02 -0.50 121.76 119.86 3h5r s ALA 237 Ca 0.23 0.21 0.00 0.00 0.00 0.00 0.00 51.96 52.41 3h5r s ALA 237 Cb -0.13 0.30 0.00 0.00 0.00 0.00 0.00 23.12 23.29 3h5r s ALA 237 CO 0.14 -0.41 0.00 0.41 0.00 0.00 0.00 175.76 175.89 3h5r n GLY 238 N 0.63 -0.62 3.46 0.00 0.00 -0.05 -4.45 105.19 104.17 3h5r n GLY 238 Ca -0.19 -0.46 -0.13 0.00 0.00 0.00 0.00 46.02 45.24 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 -4.00 -0.53 -0.39 1.61 -0.85 -1.26 -0.46 117.35 111.46 3h5r s TYR 239 Ca 0.00 0.50 0.03 0.00 -0.52 0.00 0.00 57.07 57.09 3h5r s TYR 239 Cb 0.00 0.52 0.11 0.00 0.38 0.00 0.00 41.96 42.97 3h5r s TYR 239 CO 0.00 -0.74 0.12 0.08 -1.52 0.00 0.00 175.55 173.49 3h5r s VAL 240 N -2.99 2.18 0.00 -3.49 1.01 0.05 -4.92 120.40 112.23 3h5r s VAL 240 Ca -0.01 -2.52 0.00 0.00 0.00 0.00 0.00 61.98 59.45 3h5r s VAL 240 Cb -0.01 -2.59 0.00 0.00 0.00 0.00 0.00 36.38 33.79 3h5r s VAL 240 CO -0.07 -0.67 0.00 0.59 0.00 0.00 0.00 175.10 174.95 3h5r n ASN 241 N 3.98 0.00 0.00 3.32 3.02 -1.26 -1.06 115.26 123.26 3h5r n ASN 241 Ca 0.04 0.00 0.10 0.00 -0.03 0.00 0.00 54.58 54.69 3h5r n ASN 241 Cb 0.39 0.00 0.59 0.00 -0.61 0.00 0.00 39.78 40.15 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 4.47 0.00 -4.44 6.41 5.68 -1.26 -4.68 116.55 122.74 3h5r n ASP 242 Ca 0.00 -1.14 -0.38 0.00 -0.50 0.00 0.00 54.79 52.77 3h5r n ASP 242 Cb 0.00 0.00 -0.12 0.00 -1.14 0.00 0.00 41.12 39.86 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 -2.00 4.51 0.22 2.12 1.01 -0.22 -3.03 121.20 123.80 3h5r s ILE 243 Ca 0.30 -0.37 -0.31 0.00 0.00 0.00 0.00 60.65 60.27 3h5r s ILE 243 Cb 0.14 -3.26 -0.10 0.00 0.01 0.00 0.00 42.46 39.25 3h5r s ILE 243 CO 0.23 0.13 1.55 0.00 0.00 0.00 0.00 174.94 176.85 3h5r s ALA 244 N 1.61 3.74 -0.05 9.38 0.00 -0.65 -0.77 121.76 135.01 3h5r s ALA 244 Ca 0.05 1.42 0.02 0.00 0.00 0.00 0.00 51.96 53.45 3h5r s ALA 244 Cb -0.17 -3.62 0.01 0.00 0.00 0.00 0.00 23.12 19.35 3h5r s ALA 244 CO 0.06 -0.82 -0.12 0.08 0.00 0.00 0.00 175.76 174.96 3h5r s VAL 245 N 0.58 1.05 0.05 0.00 1.01 0.39 -0.60 120.40 122.88 3h5r s VAL 245 Ca 0.66 -0.46 -0.02 0.00 0.00 0.00 0.00 61.98 62.16 3h5r s VAL 245 Cb -0.45 -0.96 -0.03 0.00 0.00 0.00 0.00 36.38 34.95 3h5r s VAL 245 CO 0.38 0.33 0.01 0.72 0.00 0.00 0.00 175.10 176.54 3h5r s PHE 246 N 0.51 0.41 0.00 5.22 -0.71 -0.55 -0.87 117.98 121.98 3h5r s PHE 246 Ca -0.11 -0.88 0.00 0.00 -1.04 0.00 0.00 56.93 54.90 3h5r s PHE 246 Cb -0.14 -0.30 0.00 0.00 -1.21 0.00 0.00 43.02 41.38 3h5r s PHE 246 CO 0.03 -0.38 0.00 0.41 -1.34 0.00 0.00 175.22 173.94 3h5r n GLY 247 N 0.33 0.75 3.80 1.99 0.00 0.35 -0.29 105.19 112.12 3h5r n GLY 247 Ca -0.16 -1.76 -0.30 0.00 0.00 0.00 0.00 46.02 43.80 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 -3.03 2.39 -0.37 1.61 0.04 -1.22 -4.44 135.00 129.98 3h5r s PRO 248 Ca 0.00 0.81 -0.11 0.00 0.04 0.00 0.00 61.00 61.74 3h5r s PRO 248 Cb 0.00 -1.94 0.03 0.00 0.04 0.00 0.00 34.50 32.63 3h5r s PRO 248 CO 0.00 -1.45 0.20 -1.17 0.04 0.00 0.00 177.00 174.62 3h5r s LEU 249 N -5.72 4.65 -0.14 -3.56 2.96 -0.62 -2.78 118.68 113.47 3h5r s LEU 249 Ca 0.60 -0.96 -0.21 0.00 -0.22 0.00 0.00 54.13 53.34 3h5r s LEU 249 Cb -0.15 -2.01 -0.03 0.00 0.50 0.00 0.00 46.19 44.50 3h5r s LEU 249 CO 0.55 -0.37 0.61 -0.47 -1.32 0.00 0.00 176.35 175.36 3h5r s TYR 250 N 1.55 3.46 -0.20 5.38 5.04 0.25 -4.06 117.35 128.77 3h5r s TYR 250 Ca 0.02 1.01 -0.00 0.00 -2.44 0.00 0.00 57.07 55.66 3h5r s TYR 250 Cb -0.19 -2.74 0.05 0.00 0.35 0.00 0.00 41.96 39.43 3h5r s TYR 250 CO 0.06 -0.02 -0.04 0.08 -1.34 0.00 0.00 175.55 174.29 3h5r s VAL 251 N 1.30 1.19 0.10 3.14 1.01 -1.26 -2.86 120.40 123.01 3h5r s VAL 251 Ca 0.31 -0.85 -0.36 0.00 0.00 0.00 0.00 61.98 61.07 3h5r s VAL 251 Cb -0.16 -1.45 -0.16 0.00 0.00 0.00 0.00 36.38 34.61 3h5r s VAL 251 CO 0.12 -0.02 1.35 -2.65 0.00 0.00 0.00 175.10 173.91 3h5r n PRO 252 N 4.82 1.27 -0.15 2.72 -0.02 -1.26 -0.60 135.00 141.79 3h5r n PRO 252 Ca -0.12 0.46 0.00 0.00 -2.02 0.00 0.00 63.50 61.82 3h5r n PRO 252 Cb 0.46 -2.10 0.00 0.00 -0.02 0.00 0.00 33.50 31.84 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 2.57 1.71 0.15 -1.23 0.00 -1.26 -4.74 105.19 102.40 3h5r n GLY 253 Ca 0.18 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.15 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 0.14 -3.91 1.61 4.81 0.24 -5.07 118.16 113.98 3h5r n LYS 254 Ca 0.00 0.04 -0.24 0.00 -0.87 0.00 0.00 58.31 57.24 3h5r n LYS 254 Cb 0.00 -1.05 -0.05 0.00 0.02 0.00 0.00 35.03 33.95 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 -2.12 2.27 0.86 3.15 -4.23 -0.39 -4.95 115.64 110.24 3h5r s THR 255 Ca -0.08 -1.54 -0.12 0.00 -1.18 0.00 0.00 61.69 58.77 3h5r s THR 255 Cb 0.02 -2.82 0.11 0.00 1.34 0.00 0.00 72.50 71.15 3h5r s THR 255 CO 0.13 0.00 1.11 -0.83 -0.54 0.00 0.00 174.62 174.49 3h5r s GLY 256 N -4.05 1.60 0.56 3.99 0.00 -1.21 -4.64 107.32 103.58 3h5r s GLY 256 Ca 0.41 -0.33 0.09 0.00 0.00 0.00 0.00 44.72 44.89 3h5r s GLY 256 CO 0.24 0.17 0.71 0.00 0.00 0.00 0.00 173.10 174.22 3h5r h TYR 258 N 0.30 0.00 -0.02 0.00 3.20 -1.94 -2.32 116.97 116.19 3h5r h TYR 258 Ca -0.31 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.56 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 0.53 0.00 -0.14 0.39 -1.64 0.00 0.00 178.16 177.30 3h5r n GLU 259 N -3.27 1.77 0.18 1.82 -0.58 -1.26 -4.64 120.64 114.66 3h5r n GLU 259 Ca -0.03 -1.49 -0.14 0.00 -0.42 0.00 0.00 57.16 55.08 3h5r n GLU 259 Cb 0.08 -1.40 -0.08 0.00 -0.57 0.00 0.00 31.44 29.46 3h5r n GLU 259 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3h5r n GLN 261 N -5.17 0.05 -3.83 0.00 1.13 -1.26 -4.66 117.38 103.64 3h5r n GLN 261 Ca -0.10 -0.02 -0.06 0.00 -1.94 0.00 0.00 57.00 54.88 3h5r n GLN 261 Cb 0.27 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.12 3h5r n GLN 261 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 3h5r s LYS 262 N -2.97 1.74 0.07 -1.09 -0.14 -1.23 -5.11 119.74 111.01 3h5r s LYS 262 Ca 0.13 -1.05 0.00 0.00 -1.36 0.00 0.00 55.97 53.68 3h5r s LYS 262 Cb 0.18 0.53 0.00 0.00 -1.68 0.00 0.00 37.83 36.86 3h5r s LYS 262 CO 0.64 -0.81 0.00 1.17 -0.76 0.00 0.00 175.35 175.60 3h5r n LYS 272 N -0.53 -0.98 0.04 1.68 3.00 -1.26 -4.93 118.16 115.18 3h5r n LYS 272 Ca -0.06 0.76 -0.03 0.00 -0.00 0.00 0.00 58.31 58.98 3h5r n LYS 272 Cb 0.60 -0.77 -0.01 0.00 0.00 0.00 0.00 35.03 34.84 3h5r n LYS 272 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.40 178.33 3h5r h GLU 273 N 0.60 -0.18 -0.33 1.64 5.08 -2.06 -3.29 114.58 116.03 3h5r h GLU 273 Ca 0.00 0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.33 3h5r h GLU 273 Cb 0.00 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 3h5r h GLU 273 CO 0.00 -0.12 0.02 -2.95 -1.00 0.00 0.00 179.01 174.96 3h5r h ASN 274 N -0.81 0.46 0.29 1.42 -1.07 -2.06 -3.03 115.58 110.79 3h5r h ASN 274 Ca -0.02 -0.08 -0.01 0.00 0.07 0.00 0.00 56.30 56.26 3h5r h ASN 274 Cb 0.15 -0.12 0.00 0.00 -2.07 0.00 0.00 38.32 36.28 3h5r h ASN 274 CO 0.03 0.52 -0.14 0.40 0.07 0.00 0.00 177.43 178.31 3h5r h ILE 275 N 0.48 0.53 -1.10 6.14 2.04 -2.00 -2.30 117.51 121.30 3h5r h ILE 275 Ca 0.11 -0.83 0.30 0.00 1.00 0.00 0.00 64.86 65.44 3h5r h ILE 275 Cb 0.29 0.85 -0.09 0.00 -0.74 0.00 0.00 36.82 37.12 3h5r h ILE 275 CO 0.01 0.12 0.72 -0.78 0.00 0.00 0.00 178.15 178.22 3h5r h ASP 276 N -0.94 0.37 0.41 1.72 1.82 -1.62 0.53 116.42 118.70 3h5r h ASP 276 Ca -0.04 0.08 -0.02 0.00 -0.39 0.00 0.00 57.03 56.66 3h5r h ASP 276 Cb 0.50 0.03 0.00 0.00 0.68 0.00 0.00 39.33 40.54 3h5r h ASP 276 CO 0.07 0.03 -0.20 0.45 -1.61 0.00 0.00 179.24 177.98 3h5r h HIS 277 N 0.30 -0.51 -0.56 0.28 -0.00 -1.45 -2.13 115.15 111.07 3h5r h HIS 277 Ca 0.63 -0.01 0.01 0.00 -0.00 0.00 0.00 60.37 61.00 3h5r h HIS 277 Cb 1.76 0.17 -0.03 0.00 -0.00 0.00 0.00 27.41 29.31 3h5r h HIS 277 CO -0.00 -0.27 0.36 0.87 -0.00 0.00 0.00 177.93 178.89 3h5r h LYS 278 N -0.64 0.71 -0.94 2.45 1.57 0.22 -0.99 116.57 118.94 3h5r h LYS 278 Ca -0.06 -0.04 0.10 0.00 -1.87 0.00 0.00 60.65 58.79 3h5r h LYS 278 Cb 0.47 -0.16 -0.07 0.00 0.08 0.00 0.00 32.23 32.55 3h5r h LYS 278 CO 0.09 0.47 0.61 0.82 -0.57 0.00 0.00 179.45 180.87 3h5r h ILE 279 N 0.73 0.96 -0.05 1.86 2.04 -0.23 -2.09 117.51 120.73 3h5r h ILE 279 Ca 0.21 -0.32 -0.18 0.00 1.00 0.00 0.00 64.86 65.57 3h5r h ILE 279 Cb -0.04 -0.07 0.01 0.00 -0.74 0.00 0.00 36.82 35.98 3h5r h ILE 279 CO -0.07 0.17 -0.65 0.11 0.00 0.00 0.00 178.15 177.71 3h5r h LYS 280 N 0.95 0.53 0.04 2.37 1.57 -0.63 -2.29 116.57 119.11 3h5r h LYS 280 Ca 0.45 -0.51 0.01 0.00 -1.87 0.00 0.00 60.65 58.73 3h5r h LYS 280 Cb 0.43 0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.85 3h5r h LYS 280 CO -0.21 1.14 -0.09 1.25 -0.57 0.00 0.00 179.45 180.97 3h5r h LEU 281 N 0.12 -0.25 0.04 2.94 5.85 -1.04 -2.03 115.31 120.93 3h5r h LEU 281 Ca -0.07 0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.70 3h5r h LEU 281 Cb 1.33 0.10 -0.02 0.00 0.37 0.00 0.00 40.66 42.44 3h5r h LEU 281 CO 0.13 -0.14 -0.10 0.40 -0.34 0.00 0.00 178.44 178.39 3h5r h ILE 282 N -0.18 0.75 0.00 4.05 2.04 -1.41 -2.72 117.51 120.04 3h5r h ILE 282 Ca 0.02 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.84 3h5r h ILE 282 Cb 0.20 0.75 -0.01 0.00 -0.74 0.00 0.00 36.82 37.02 3h5r h ILE 282 CO -0.06 0.00 -0.17 0.78 0.00 0.00 0.00 178.15 178.69 3h5r h ASN 283 N -0.20 0.00 1.39 1.72 2.35 -1.44 -1.92 115.58 117.49 3h5r h ASN 283 Ca 0.03 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.78 3h5r h ASN 283 Cb 0.23 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.60 3h5r h ASN 283 CO -0.08 0.17 0.00 0.77 -1.65 0.00 0.00 177.43 176.65 3h5r h SER 284 N 0.00 0.00 -0.04 5.81 4.64 -1.05 -2.79 113.55 120.12 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 0.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 3h5r h SER 284 CO 0.02 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.52 3h5r n ARG 285 N -2.54 1.48 -1.95 4.77 1.74 -0.72 -4.96 116.66 114.47 3h5r n ARG 285 Ca 0.04 -0.71 -0.42 0.00 -0.77 0.00 0.00 57.85 55.99 3h5r n ARG 285 Cb 0.40 -1.45 -0.03 0.00 -1.02 0.00 0.00 32.46 30.35 3h5r n ARG 285 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 3h5r s PHE 286 N -1.96 2.98 -0.05 -1.55 5.36 -1.05 -5.01 117.98 116.70 3h5r s PHE 286 Ca 0.38 0.61 0.03 0.00 -0.96 0.00 0.00 56.93 56.99 3h5r s PHE 286 Cb 0.20 -3.91 0.01 0.00 -0.34 0.00 0.00 43.02 38.97 3h5r s PHE 286 CO 0.32 -3.41 -0.12 0.15 -1.46 0.00 0.00 175.22 170.70 3h5r s LYS 287 N 1.36 1.45 0.47 10.12 1.02 -1.26 -5.12 119.74 127.79 3h5r s LYS 287 Ca 0.70 -0.42 -0.22 0.00 0.02 0.00 0.00 55.97 56.06 3h5r s LYS 287 Cb -0.43 -1.26 -0.08 0.00 -0.52 0.00 0.00 37.83 35.55 3h5r s LYS 287 CO 0.31 0.10 1.09 -1.25 -0.92 0.00 0.00 175.35 174.68 3h5r s PRO 288 N 0.37 3.80 -1.37 -1.68 0.04 -1.26 -4.90 135.00 130.00 3h5r s PRO 288 Ca -0.08 1.54 -0.14 0.00 0.04 0.00 0.00 61.00 62.36 3h5r s PRO 288 Cb -0.12 -2.26 0.09 0.00 0.04 0.00 0.00 34.50 32.24 3h5r s PRO 288 CO 0.02 -0.47 1.98 0.00 0.04 0.00 0.00 177.00 178.58 3h5r n ALA 289 N -0.69 4.95 -1.71 8.56 0.00 -1.26 -4.98 120.51 125.38 3h5r n ALA 289 Ca 0.08 -4.00 -0.40 0.00 0.00 0.00 0.00 53.44 49.12 3h5r n ALA 289 Cb 0.50 -3.39 0.03 0.00 0.00 0.00 0.00 19.45 16.59 3h5r n ALA 289 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3h5r n THR 290 N 4.93 3.18 -3.66 0.00 -2.24 -1.26 -4.47 114.28 110.77 3h5r n THR 290 Ca 0.47 -0.50 -0.06 0.00 -2.27 0.00 0.00 64.05 61.69 3h5r n THR 290 Cb 0.40 -1.56 -0.08 0.00 -2.10 0.00 0.00 70.33 67.00 3h5r n THR 290 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 3h5r s PHE 291 N -1.27 -0.98 0.23 4.78 5.36 -1.26 -5.08 117.98 119.77 3h5r s PHE 291 Ca 0.67 1.81 -0.06 0.00 -0.96 0.00 0.00 56.93 58.40 3h5r s PHE 291 Cb -0.46 0.49 0.40 0.00 -0.34 0.00 0.00 43.02 43.11 3h5r s PHE 291 CO 0.53 -0.53 1.74 0.00 -1.46 0.00 0.00 175.22 175.50 3h5r h ALA 292 N 7.91 1.00 -0.80 11.12 0.00 -1.97 -0.86 119.26 135.67 3h5r h ALA 292 Ca -0.20 0.10 0.16 0.00 0.00 0.00 0.00 54.91 54.97 3h5r h ALA 292 Cb 1.12 0.05 -0.10 0.00 0.00 0.00 0.00 17.79 18.87 3h5r h ALA 292 CO 0.14 -0.17 0.34 -1.35 0.00 0.00 0.00 179.25 178.20 3h5r h PRO 293 N 0.47 0.45 -0.11 0.00 0.11 -1.98 0.40 132.00 131.35 3h5r h PRO 293 Ca 0.38 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 66.44 3h5r h PRO 293 Cb 0.53 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 31.54 3h5r h PRO 293 CO -0.36 0.30 -0.02 0.28 -0.21 0.00 0.00 178.00 177.99 3h5r h VAL 294 N 0.47 1.29 -0.37 3.15 2.07 -1.55 -2.01 116.25 119.29 3h5r h VAL 294 Ca 0.45 -0.94 0.08 0.00 0.82 0.00 0.00 66.70 67.11 3h5r h VAL 294 Cb 0.71 1.69 -0.08 0.00 -1.52 0.00 0.00 31.29 32.09 3h5r h VAL 294 CO -0.42 0.27 -0.14 -1.13 0.02 0.00 0.00 177.57 176.17 3h5r h ASN 295 N -0.11 -0.48 0.11 0.57 -0.73 -1.04 -2.29 115.58 111.62 3h5r h ASN 295 Ca 0.03 0.13 -0.07 0.00 1.87 0.00 0.00 56.30 58.25 3h5r h ASN 295 Cb 0.43 0.28 -0.01 0.00 0.27 0.00 0.00 38.32 39.29 3h5r h ASN 295 CO 0.01 -0.17 -0.25 0.78 -0.37 0.00 0.00 177.43 177.43 3h5r h ASN 296 N -0.06 0.24 0.13 1.15 4.21 -0.11 -1.75 115.58 119.38 3h5r h ASN 296 Ca 0.18 -0.07 -0.01 0.00 1.21 0.00 0.00 56.30 57.62 3h5r h ASN 296 Cb 0.34 -0.06 0.00 0.00 -1.12 0.00 0.00 38.32 37.48 3h5r h ASN 296 CO -0.42 0.50 -0.06 0.58 -1.29 0.00 0.00 177.43 176.74 3h5r h VAL 297 N 0.22 1.03 -0.43 2.81 2.07 -1.03 -0.85 116.25 120.08 3h5r h VAL 297 Ca 0.04 -0.72 0.09 0.00 0.82 0.00 0.00 66.70 66.93 3h5r h VAL 297 Cb 0.57 1.48 -0.08 0.00 -1.52 0.00 0.00 31.29 31.73 3h5r h VAL 297 CO 0.04 0.17 -0.09 0.00 0.02 0.00 0.00 177.57 177.70 3h5r h ALA 298 N 0.30 0.30 -0.53 1.67 0.00 -1.28 -1.95 119.26 117.77 3h5r h ALA 298 Ca -0.02 0.16 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 3h5r h ALA 298 Cb 0.41 0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 3h5r h ALA 298 CO 0.03 -0.44 0.19 0.00 0.00 0.00 0.00 179.25 179.02 3h5r h ALA 299 N 1.43 0.69 -0.59 0.00 0.00 -1.32 -0.21 119.26 119.26 3h5r h ALA 299 Ca 0.21 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 3h5r h ALA 299 Cb 0.32 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 3h5r h ALA 299 CO -0.43 0.32 0.22 0.00 0.00 0.00 0.00 179.25 179.35 3h5r h ALA 300 N 1.04 0.76 0.00 0.00 0.00 -0.83 0.41 119.26 120.64 3h5r h ALA 300 Ca 0.17 -0.18 -0.21 0.00 0.00 0.00 0.00 54.91 54.70 3h5r h ALA 300 Cb 0.24 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 3h5r h ALA 300 CO -0.01 0.40 -1.01 -0.07 0.00 0.00 0.00 179.25 178.56 3h5r h LEU 301 N 0.82 0.00 -0.06 0.00 3.38 -1.31 -0.76 115.31 117.37 3h5r h LEU 301 Ca 0.19 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.19 3h5r h LEU 301 Cb 0.23 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.95 3h5r h LEU 301 CO -0.01 0.99 -0.12 0.00 0.09 0.00 0.00 178.44 179.38 3h5r h ALA 303 N 0.84 1.42 -0.77 0.00 0.00 -0.67 -1.93 119.26 118.14 3h5r h ALA 303 Ca 0.06 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 3h5r h ALA 303 Cb 0.27 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 3h5r h ALA 303 CO -0.16 0.42 0.29 0.00 0.00 0.00 0.00 179.25 179.80 3h5r h ALA 304 N 1.53 1.00 -0.25 0.00 0.00 -1.03 -1.53 119.26 118.97 3h5r h ALA 304 Ca 0.14 -0.20 -0.12 0.00 0.00 0.00 0.00 54.91 54.73 3h5r h ALA 304 Cb 0.22 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3h5r h ALA 304 CO -0.00 0.63 -0.34 -0.44 0.00 0.00 0.00 179.25 179.10 3h5r h ASP 305 N 1.11 0.56 0.19 0.00 5.19 -0.74 -0.78 116.42 121.95 3h5r h ASP 305 Ca 0.25 -0.23 -0.01 0.00 -0.62 0.00 0.00 57.03 56.43 3h5r h ASP 305 Cb 0.23 -0.16 0.00 0.00 0.18 0.00 0.00 39.33 39.59 3h5r h ASP 305 CO -0.02 0.86 -0.09 0.58 -3.12 0.00 0.00 179.24 177.45 3h5r h VAL 306 N 0.46 0.86 -0.67 -1.35 2.07 -1.15 0.31 116.25 116.78 3h5r h VAL 306 Ca 0.05 -0.18 0.04 0.00 0.82 0.00 0.00 66.70 67.43 3h5r h VAL 306 Cb 0.81 0.97 -0.05 0.00 -1.52 0.00 0.00 31.29 31.50 3h5r h VAL 306 CO 0.07 0.04 0.40 0.40 0.02 0.00 0.00 177.57 178.50 3h5r h ILE 307 N -0.34 1.04 -0.48 4.57 2.04 -1.19 0.38 117.51 123.54 3h5r h ILE 307 Ca -0.03 -0.26 -0.09 0.00 1.00 0.00 0.00 64.86 65.48 3h5r h ILE 307 Cb 0.26 0.20 -0.02 0.00 -0.74 0.00 0.00 36.82 36.53 3h5r h ILE 307 CO 0.04 0.14 -0.07 0.11 0.00 0.00 0.00 178.15 178.38 3h5r h LYS 308 N 0.77 0.88 -0.40 2.37 1.57 -1.06 0.50 116.57 121.21 3h5r h LYS 308 Ca 0.28 -0.32 0.03 0.00 -1.87 0.00 0.00 60.65 58.77 3h5r h LYS 308 Cb 0.08 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.30 3h5r h LYS 308 CO -0.13 0.96 0.21 0.35 -0.57 0.00 0.00 179.45 180.27 3h5r h PHE 309 N 0.73 0.40 0.17 -1.35 3.57 0.07 0.13 116.94 120.66 3h5r h PHE 309 Ca 0.13 0.02 -0.25 0.00 3.53 0.00 0.00 57.97 61.39 3h5r h PHE 309 Cb 0.60 -0.12 0.03 0.00 2.79 0.00 0.00 35.95 39.25 3h5r h PHE 309 CO 0.05 0.22 -1.07 0.82 -2.23 0.00 0.00 178.31 176.10 3h5r h ILE 310 N 0.43 1.40 0.00 1.41 2.04 -0.78 -3.33 117.51 118.69 3h5r h ILE 310 Ca 0.17 -2.54 0.00 0.00 1.00 0.00 0.00 64.86 63.48 3h5r h ILE 310 Cb 0.05 3.04 0.00 0.00 -0.74 0.00 0.00 36.82 39.17 3h5r h ILE 310 CO -0.10 0.74 0.00 1.23 0.00 0.00 0.00 178.15 180.02 3h5r h GLY 311 N -0.10 0.00 -4.30 5.37 0.00 0.04 -3.45 103.07 100.63 3h5r h GLY 311 Ca -0.18 0.00 -0.40 0.00 0.00 0.00 0.00 47.33 46.75 3h5r h GLY 311 CO 0.20 0.00 -0.57 0.28 0.00 0.00 0.00 176.54 176.45 3h5r n LYS 312 N -3.05 -4.01 -0.00 4.80 5.02 0.45 -4.74 118.16 116.63 3h5r n LYS 312 Ca 0.03 0.86 0.07 0.00 -2.02 0.00 0.00 58.31 57.25 3h5r n LYS 312 Cb 0.43 -5.66 -0.09 0.00 -0.02 0.00 0.00 35.03 29.70 3h5r n LYS 312 CO 0.00 0.00 0.00 2.48 -0.52 0.00 0.00 177.40 179.36 3h5r n TYR 313 N -4.30 0.00 -3.53 2.13 4.11 -1.25 -5.00 117.16 109.32 3h5r n TYR 313 Ca -0.13 0.00 -0.17 0.00 -0.00 0.00 0.00 57.90 57.61 3h5r n TYR 313 Cb 0.62 -0.03 -0.06 0.00 -0.00 0.00 0.00 39.34 39.88 3h5r n TYR 313 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.86 177.31 3h5r s SER 314 N -2.52 -0.60 -0.01 9.48 0.15 -1.26 -4.87 113.70 114.06 3h5r s SER 314 Ca 0.05 0.55 -0.30 0.00 0.70 0.00 0.00 55.95 56.95 3h5r s SER 314 Cb 0.11 0.53 -0.06 0.00 -1.71 0.00 0.00 66.02 64.90 3h5r s SER 314 CO 0.62 -0.65 1.49 -1.61 1.20 0.00 0.00 173.24 174.28 3h5r s GLU 315 N -1.61 4.24 0.40 5.44 0.41 -1.26 -4.62 118.70 121.71 3h5r s GLU 315 Ca -0.09 2.05 -0.26 0.00 -0.41 0.00 0.00 54.97 56.25 3h5r s GLU 315 Cb -0.00 -3.68 -0.10 0.00 -1.78 0.00 0.00 34.13 28.56 3h5r s GLU 315 CO 0.06 -0.67 1.33 -2.30 -0.49 0.00 0.00 175.26 173.19 3h5r n PRO 316 N 5.90 2.14 -0.13 0.39 -0.02 -1.26 -4.90 135.00 137.11 3h5r n PRO 316 Ca 0.15 0.76 -0.02 0.00 -2.02 0.00 0.00 63.50 62.36 3h5r n PRO 316 Cb 0.43 -2.46 0.22 0.00 -0.02 0.00 0.00 33.50 31.67 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 2.35 0.75 -2.37 2.45 3.38 -1.94 -3.20 115.31 116.73 3h5r h LEU 317 Ca -0.48 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.38 3h5r h LEU 317 Cb 1.28 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.84 3h5r h LEU 317 CO 0.61 0.70 0.00 -1.54 0.09 0.00 0.00 178.44 178.30 3h5r n SER 318 N -4.31 3.56 -4.63 -0.43 3.41 -1.26 -4.77 113.62 105.20 3h5r n SER 318 Ca 0.04 -2.25 -0.47 0.00 -0.26 0.00 0.00 58.87 55.94 3h5r n SER 318 Cb 0.19 -0.47 -0.04 0.00 -0.26 0.00 0.00 64.21 63.62 3h5r n SER 318 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3h5r n LEU 319 N 0.91 3.36 -0.96 1.04 4.77 -1.21 -1.59 117.00 123.31 3h5r n LEU 319 Ca 0.20 0.73 -0.13 0.00 -0.03 0.00 0.00 56.01 56.78 3h5r n LEU 319 Cb 0.65 -1.42 -0.05 0.00 -2.33 0.00 0.00 43.42 40.27 3h5r n LEU 319 CO 0.17 -0.23 -0.12 0.59 -1.33 0.00 0.00 177.39 176.47 3h5r n ASN 320 N 8.26 -4.60 -3.77 -1.43 3.02 -1.26 -4.95 115.26 110.54 3h5r n ASN 320 Ca 0.26 0.31 -0.13 0.00 -0.03 0.00 0.00 54.58 55.00 3h5r n ASN 320 Cb 0.34 -3.20 -0.12 0.00 -0.61 0.00 0.00 39.78 36.18 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 -3.03 0.24 -0.26 3.52 1.02 -0.81 0.08 119.74 120.51 3h5r s LYS 321 Ca 0.00 0.38 -0.08 0.00 0.02 0.00 0.00 55.97 56.29 3h5r s LYS 321 Cb 0.00 0.05 -0.03 0.00 -0.52 0.00 0.00 37.83 37.33 3h5r s LYS 321 CO 0.00 -0.07 0.10 0.50 -0.92 0.00 0.00 175.35 174.96 3h5r s ARG 322 N 0.47 3.74 -0.13 1.68 3.52 -0.21 -3.44 118.95 124.58 3h5r s ARG 322 Ca -0.03 -0.43 -0.02 0.00 -0.13 0.00 0.00 55.73 55.12 3h5r s ARG 322 Cb -0.04 -3.41 -0.02 0.00 -1.56 0.00 0.00 34.95 29.91 3h5r s ARG 322 CO -0.02 -0.17 -0.08 0.42 -0.81 0.00 0.00 175.30 174.63 3h5r s ILE 323 N 1.62 3.50 -0.14 4.11 1.01 0.60 0.16 121.20 132.07 3h5r s ILE 323 Ca 0.06 -0.51 -0.02 0.00 0.00 0.00 0.00 60.65 60.19 3h5r s ILE 323 Cb -0.15 -2.50 -0.02 0.00 0.01 0.00 0.00 42.46 39.80 3h5r s ILE 323 CO 0.05 0.52 -0.09 -0.83 0.00 0.00 0.00 174.94 174.59 3h5r s GLY 324 N 0.21 1.62 -0.22 6.18 0.00 0.82 -1.48 107.32 114.44 3h5r s GLY 324 Ca -0.05 -0.86 -0.05 0.00 0.00 0.00 0.00 44.72 43.76 3h5r s GLY 324 CO 0.04 -0.17 -0.01 -0.42 0.00 0.00 0.00 173.10 172.54 3h5r s ILE 325 N 0.29 3.72 0.59 0.90 1.01 0.23 -0.57 121.20 127.37 3h5r s ILE 325 Ca -0.07 -0.38 -0.15 0.00 0.00 0.00 0.00 60.65 60.05 3h5r s ILE 325 Cb -0.15 -2.70 -0.04 0.00 0.01 0.00 0.00 42.46 39.58 3h5r s ILE 325 CO 0.04 0.40 1.04 0.26 0.00 0.00 0.00 174.94 176.69 3h5r s TRP 326 N 1.42 3.11 -0.04 3.97 0.23 0.49 -1.64 118.94 126.47 3h5r s TRP 326 Ca 0.05 1.49 0.03 0.00 -2.03 0.00 0.00 56.10 55.64 3h5r s TRP 326 Cb -0.15 -2.94 -0.04 0.00 0.03 0.00 0.00 33.47 30.37 3h5r s TRP 326 CO -0.00 -0.97 0.08 -1.13 0.96 0.00 0.00 176.95 175.89 3h5r n SER 327 N -2.08 3.16 -0.90 2.95 3.41 -1.17 -4.55 113.62 114.43 3h5r n SER 327 Ca 0.08 -0.16 0.09 0.00 -0.26 0.00 0.00 58.87 58.63 3h5r n SER 327 Cb 0.53 1.10 0.17 0.00 -0.26 0.00 0.00 64.21 65.75 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 -1.46 3.05 -3.98 4.04 5.68 -1.26 -4.93 116.55 117.69 3h5r n ASP 328 Ca -0.00 -1.89 -0.08 0.00 -0.50 0.00 0.00 54.79 52.32 3h5r n ASP 328 Cb 0.07 -0.20 -0.09 0.00 -1.14 0.00 0.00 41.12 39.76 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 -1.24 0.77 -0.71 0.11 2.02 -1.26 -5.09 118.70 113.30 3h5r s GLU 329 Ca 0.30 -1.11 -0.22 0.00 0.02 0.00 0.00 54.97 53.96 3h5r s GLU 329 Cb 0.18 0.28 0.07 0.00 0.10 0.00 0.00 34.13 34.76 3h5r s GLU 329 CO 0.24 -0.21 1.02 0.42 0.02 0.00 0.00 175.26 176.75 3h5r s ILE 330 N -3.90 4.32 -0.29 -1.63 1.01 -1.26 -4.55 121.20 114.90 3h5r s ILE 330 Ca 0.08 -0.46 -0.16 0.00 0.00 0.00 0.00 60.65 60.11 3h5r s ILE 330 Cb 0.06 -4.72 0.13 0.00 0.01 0.00 0.00 42.46 37.94 3h5r s ILE 330 CO -0.09 -1.50 0.90 -0.75 0.00 0.00 0.00 174.94 173.49 3h5r s LYS 331 N 4.04 0.45 -0.03 2.79 2.20 -1.26 -5.05 119.74 122.87 3h5r s LYS 331 Ca 0.25 0.82 0.05 0.00 -0.36 0.00 0.00 55.97 56.73 3h5r s LYS 331 Cb -0.14 0.18 -0.01 0.00 -1.51 0.00 0.00 37.83 36.34 3h5r s LYS 331 CO 0.08 -0.10 -0.19 0.42 -0.36 0.00 0.00 175.35 175.20 3h5r s ILE 332 N 1.62 1.53 0.00 5.43 1.01 -1.26 -0.38 121.20 129.16 3h5r s ILE 332 Ca -0.08 -0.79 0.00 0.00 0.00 0.00 0.00 60.65 59.78 3h5r s ILE 332 Cb -0.05 -1.30 -0.00 0.00 0.01 0.00 0.00 42.46 41.12 3h5r s ILE 332 CO -0.16 0.44 -0.01 -2.28 0.00 0.00 0.00 174.94 172.92 3h5r s HIS 333 N -0.17 0.12 -0.10 3.97 2.46 0.27 -4.99 115.29 116.84 3h5r s HIS 333 Ca 0.01 -0.12 0.01 0.00 0.47 0.00 0.00 55.06 55.43 3h5r s HIS 333 Cb -0.10 -0.08 -0.02 0.00 -0.13 0.00 0.00 32.58 32.25 3h5r s HIS 333 CO 0.01 -0.04 -0.15 0.45 -2.47 0.00 0.00 174.74 172.54 3h5r s SER 334 N -0.33 3.85 -0.16 9.88 0.15 -1.26 -0.13 113.70 125.70 3h5r s SER 334 Ca -0.03 -0.34 -0.04 0.00 0.70 0.00 0.00 55.95 56.24 3h5r s SER 334 Cb -0.02 -1.38 -0.03 0.00 -1.71 0.00 0.00 66.02 62.88 3h5r s SER 334 CO -0.00 0.21 -0.02 -1.10 1.20 0.00 0.00 173.24 173.53 3h5r s GLN 335 N 0.09 3.72 0.01 5.44 -0.21 0.12 -4.96 119.66 123.87 3h5r s GLN 335 Ca -0.07 -0.49 -0.30 0.00 0.02 0.00 0.00 55.36 54.52 3h5r s GLN 335 Cb -0.15 -2.98 -0.05 0.00 1.00 0.00 0.00 33.01 30.83 3h5r s GLN 335 CO 0.05 0.23 1.34 1.21 -2.12 0.00 0.00 175.29 176.00 3h5r s ASN 336 N 0.40 6.91 -0.32 5.90 3.84 -1.26 -1.04 114.94 129.38 3h5r s ASN 336 Ca -0.02 2.07 0.10 0.00 0.21 0.00 0.00 52.86 55.22 3h5r s ASN 336 Cb -0.14 -2.57 0.46 0.00 -0.55 0.00 0.00 41.25 38.46 3h5r s ASN 336 CO 0.02 -0.66 1.15 0.23 -2.79 0.00 0.00 177.10 175.06 3h5r n MET 337 N 4.99 3.14 -1.20 0.43 2.81 0.11 -4.75 117.12 122.65 3h5r n MET 337 Ca 0.12 -4.08 -0.30 0.00 -1.81 0.00 0.00 57.70 51.63 3h5r n MET 337 Cb 0.44 -2.11 0.12 0.00 -0.71 0.00 0.00 33.22 30.97 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 -3.60 1.64 0.45 3.03 0.00 -1.25 -3.30 107.32 104.28 3h5r s GLY 338 Ca 0.45 0.09 -0.25 0.00 0.00 0.00 0.00 44.72 45.01 3h5r s GLY 338 CO -0.02 0.52 1.39 0.54 0.00 0.00 0.00 173.10 175.53 3h5r n ARG 339 N -3.76 2.15 -4.35 2.90 3.00 -1.26 -4.38 116.66 110.95 3h5r n ARG 339 Ca 0.08 0.77 -0.31 0.00 -0.01 0.00 0.00 57.85 58.37 3h5r n ARG 339 Cb 0.54 -2.56 -0.16 0.00 0.00 0.00 0.00 32.46 30.27 3h5r n ARG 339 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 3h5r s SER 340 N -0.50 2.89 0.54 0.55 0.15 -1.26 -4.93 113.70 111.13 3h5r s SER 340 Ca 0.61 -0.55 0.32 0.00 0.70 0.00 0.00 55.95 57.03 3h5r s SER 340 Cb -0.46 -1.32 1.48 0.00 -1.71 0.00 0.00 66.02 64.01 3h5r s SER 340 CO 0.57 0.02 1.89 1.55 1.20 0.00 0.00 173.24 178.47 3h5r h PRO 341 N 7.65 0.00 -0.10 5.44 0.13 -1.94 -2.70 132.00 140.48 3h5r h PRO 341 Ca -0.37 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 3h5r h PRO 341 Cb 1.16 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 3h5r h PRO 341 CO 0.56 0.00 0.00 1.55 -0.23 0.00 0.00 178.00 179.88 3h5r n VAL 342 N -4.27 0.10 -1.64 1.56 3.14 -1.26 -4.73 118.33 111.23 3h5r n VAL 342 Ca 0.19 -0.46 -0.47 0.00 -2.96 0.00 0.00 64.34 60.63 3h5r n VAL 342 Cb 0.96 1.05 -0.04 0.00 -1.06 0.00 0.00 33.84 34.76 3h5r n VAL 342 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3h5r h SER 344 N 4.54 0.00 0.00 0.00 0.02 -1.92 -3.29 113.55 112.90 3h5r h SER 344 Ca -0.45 0.00 -0.22 0.00 -0.84 0.00 0.00 61.79 60.28 3h5r h SER 344 Cb 1.29 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.80 3h5r h SER 344 CO 0.78 0.14 -1.53 0.52 -1.14 0.00 0.00 176.83 175.60 3h5r n VAL 345 N -3.43 1.50 -2.95 2.27 0.31 -1.26 -5.07 118.33 109.70 3h5r n VAL 345 Ca -0.01 -0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.25 3h5r n VAL 345 Cb 0.32 -2.12 0.00 0.00 -0.91 0.00 0.00 33.84 31.13 3h5r n VAL 345 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51