#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 6.45 0.18 6.12 1.01 -1.26 -4.19 116.67 124.98 3h5r s ASP 2 Ca 0.00 0.61 0.11 0.00 0.71 0.00 0.00 52.55 53.98 3h5r s ASP 2 Cb 0.00 -2.10 -0.04 0.00 1.01 0.00 0.00 42.92 41.79 3h5r s ASP 2 CO 0.00 -0.09 -0.25 -0.31 0.21 0.00 0.00 175.17 174.73 3h5r s TYR 3 N -1.92 2.30 0.00 4.23 1.51 0.30 -0.88 117.35 122.89 3h5r s TYR 3 Ca 0.42 -0.36 0.02 0.00 -1.01 0.00 0.00 57.07 56.13 3h5r s TYR 3 Cb -0.11 -1.16 -0.01 0.00 -0.11 0.00 0.00 41.96 40.57 3h5r s TYR 3 CO 0.28 0.47 -0.06 -1.50 -1.11 0.00 0.00 175.55 173.63 3h5r s ILE 4 N -1.55 0.44 0.14 2.71 2.07 0.25 -0.26 121.20 125.00 3h5r s ILE 4 Ca 0.19 -0.32 -0.31 0.00 -1.41 0.00 0.00 60.65 58.80 3h5r s ILE 4 Cb -0.08 -0.39 -0.09 0.00 0.13 0.00 0.00 42.46 42.03 3h5r s ILE 4 CO 0.09 0.07 1.55 -0.22 -1.91 0.00 0.00 174.94 174.52 3h5r s LEU 5 N -0.28 4.37 0.40 8.50 2.96 0.87 -0.96 118.68 134.53 3h5r s LEU 5 Ca 0.01 2.54 -0.27 0.00 -0.22 0.00 0.00 54.13 56.19 3h5r s LEU 5 Cb -0.03 -3.59 -0.09 0.00 0.50 0.00 0.00 46.19 42.98 3h5r s LEU 5 CO -0.00 -0.80 1.35 -0.83 -1.32 0.00 0.00 176.35 174.75 3h5r s GLY 6 N 1.33 2.94 0.17 7.98 0.00 0.60 -4.90 107.32 115.44 3h5r s GLY 6 Ca 0.70 1.33 0.17 0.00 0.00 0.00 0.00 44.72 46.91 3h5r s GLY 6 CO 0.31 1.94 1.53 -2.13 0.00 0.00 0.00 173.10 174.75 3h5r n ARG 7 N 0.23 0.10 -0.04 2.90 3.00 -1.26 -2.66 116.66 118.93 3h5r n ARG 7 Ca 0.03 0.44 0.13 0.00 -0.00 0.00 0.00 57.85 58.45 3h5r n ARG 7 Cb 0.42 -1.74 0.35 0.00 0.00 0.00 0.00 32.46 31.49 3h5r n ARG 7 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.63 180.11 3h5r n TYR 8 N -1.95 0.10 -3.08 -0.14 0.18 -1.26 -4.85 117.16 106.15 3h5r n TYR 8 Ca 0.01 -0.05 -0.40 0.00 1.88 0.00 0.00 57.90 59.35 3h5r n TYR 8 Cb 0.13 0.00 -0.05 0.00 -0.38 0.00 0.00 39.34 39.04 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 -1.90 5.06 0.14 -3.48 0.11 -1.09 -4.38 120.40 114.86 3h5r s VAL 9 Ca 0.34 1.37 0.06 0.00 -2.93 0.00 0.00 61.98 60.82 3h5r s VAL 9 Cb 0.20 -4.01 -0.04 0.00 -1.53 0.00 0.00 36.38 31.01 3h5r s VAL 9 CO 0.31 0.25 -0.15 -0.54 -3.33 0.00 0.00 175.10 171.64 3h5r s LYS 10 N 0.88 1.10 -0.00 1.54 1.02 -1.26 -4.93 119.74 118.09 3h5r s LYS 10 Ca 0.35 -1.31 0.01 0.00 0.02 0.00 0.00 55.97 55.04 3h5r s LYS 10 Cb -0.17 -0.99 -0.00 0.00 -0.52 0.00 0.00 37.83 36.15 3h5r s LYS 10 CO 0.16 0.19 -0.02 0.42 -0.92 0.00 0.00 175.35 175.18 3h5r s ILE 11 N -2.25 0.17 -0.15 2.17 1.01 -1.26 0.29 121.20 121.18 3h5r s ILE 11 Ca 0.12 -0.08 -0.08 0.00 0.00 0.00 0.00 60.65 60.61 3h5r s ILE 11 Cb -0.04 -0.16 0.06 0.00 0.01 0.00 0.00 42.46 42.33 3h5r s ILE 11 CO 0.04 0.05 0.35 0.00 0.00 0.00 0.00 174.94 175.39 3h5r s ALA 12 N 0.01 -0.88 0.14 9.38 0.00 -0.43 -4.98 121.76 124.99 3h5r s ALA 12 Ca 0.00 1.35 -0.31 0.00 0.00 0.00 0.00 51.96 53.00 3h5r s ALA 12 Cb -0.02 -0.84 -0.11 0.00 0.00 0.00 0.00 23.12 22.15 3h5r s ALA 12 CO -0.00 -0.26 1.81 0.50 0.00 0.00 0.00 175.76 177.81 3h5r s ARG 13 N 1.40 4.13 -0.06 0.00 6.06 -1.26 0.13 118.95 129.35 3h5r s ARG 13 Ca -0.09 2.61 -0.24 0.00 -2.50 0.00 0.00 55.73 55.51 3h5r s ARG 13 Cb -0.09 -3.48 0.05 0.00 0.06 0.00 0.00 34.95 31.49 3h5r s ARG 13 CO -0.11 -0.83 0.53 -0.47 -2.50 0.00 0.00 175.30 171.93 3h5r s TYR 14 N 2.39 -0.49 0.00 5.12 5.04 -0.87 -4.81 117.35 123.73 3h5r s TYR 14 Ca 0.80 0.89 0.00 0.00 -2.44 0.00 0.00 57.07 56.32 3h5r s TYR 14 Cb -0.47 0.27 0.00 0.00 0.35 0.00 0.00 41.96 42.11 3h5r s TYR 14 CO 0.35 -0.48 0.00 0.41 -1.34 0.00 0.00 175.55 174.49 3h5r n GLY 15 N 1.33 3.10 0.61 8.97 0.00 -1.26 -1.16 105.19 116.79 3h5r n GLY 15 Ca -0.19 0.04 0.12 0.00 0.00 0.00 0.00 46.02 46.00 3h5r n GLY 15 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3h5r n SER 16 N 3.59 2.07 0.00 1.61 3.41 -1.26 -4.91 113.62 118.13 3h5r n SER 16 Ca 0.00 -1.58 0.00 0.00 -0.26 0.00 0.00 58.87 57.03 3h5r n SER 16 Cb 0.00 0.13 0.00 0.00 -0.26 0.00 0.00 64.21 64.08 3h5r n SER 16 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3h5r n GLY 17 N 1.32 2.39 3.74 5.00 0.00 -0.31 -3.40 105.19 113.93 3h5r n GLY 17 Ca 0.14 -0.23 -0.01 0.00 0.00 0.00 0.00 46.02 45.92 3h5r n GLY 17 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3h5r s GLY 18 N 0.00 -0.25 0.04 -0.02 0.00 -0.81 -2.06 107.32 104.23 3h5r s GLY 18 Ca 0.00 0.26 -0.06 0.00 0.00 0.00 0.00 44.72 44.92 3h5r s GLY 18 CO 0.00 0.69 0.29 1.08 0.00 0.00 0.00 173.10 175.16 3h5r s LEU 19 N -3.07 4.35 -0.09 0.66 1.43 0.35 -1.17 118.68 121.14 3h5r s LEU 19 Ca 0.15 0.56 -0.01 0.00 -1.03 0.00 0.00 54.13 53.81 3h5r s LEU 19 Cb 0.01 -2.82 0.03 0.00 0.03 0.00 0.00 46.19 43.44 3h5r s LEU 19 CO 0.00 0.21 -0.05 -0.69 0.23 0.00 0.00 176.35 176.06 3h5r s VAL 20 N -1.38 0.75 0.00 -1.59 1.01 -0.14 -1.32 120.40 117.74 3h5r s VAL 20 Ca 0.31 -0.13 0.00 0.00 0.00 0.00 0.00 61.98 62.16 3h5r s VAL 20 Cb -0.13 -0.82 0.00 0.00 0.00 0.00 0.00 36.38 35.43 3h5r s VAL 20 CO 0.18 0.32 0.00 0.61 0.00 0.00 0.00 175.10 176.21 3h5r n GLY 21 N 4.92 0.61 3.12 4.51 0.00 0.14 -0.59 105.19 117.90 3h5r n GLY 21 Ca -0.12 -1.93 -0.09 0.00 0.00 0.00 0.00 46.02 43.89 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 -0.83 0.24 0.00 -0.02 0.00 -1.26 -4.57 107.32 100.88 3h5r s GLY 22 Ca 0.00 -0.73 0.00 0.00 0.00 0.00 0.00 44.72 43.99 3h5r s GLY 22 CO 0.00 -0.86 0.00 0.61 0.00 0.00 0.00 173.10 172.85 3h5r n GLY 23 N 0.50 -0.49 0.27 0.20 0.00 -1.26 -4.13 105.19 100.27 3h5r n GLY 23 Ca -0.17 -1.21 0.09 0.00 0.00 0.00 0.00 46.02 44.73 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 -1.39 -0.02 0.00 -2.02 -2.04 103.07 97.59 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 -4.45 2.06 -1.66 4.80 5.02 -1.26 -4.94 118.16 117.73 3h5r n LYS 25 Ca -0.02 -1.57 -0.58 0.00 -2.02 0.00 0.00 58.31 54.11 3h5r n LYS 25 Cb 0.11 -1.46 -0.08 0.00 -0.02 0.00 0.00 35.03 33.59 3h5r n LYS 25 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 3h5r n GLU 26 N 0.83 0.78 -4.36 1.97 2.13 -0.77 -4.78 120.64 116.44 3h5r n GLU 26 Ca 0.17 0.28 -0.34 0.00 0.66 0.00 0.00 57.16 57.94 3h5r n GLU 26 Cb 0.47 -1.90 -0.14 0.00 0.27 0.00 0.00 31.44 30.14 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 2.18 3.45 -0.37 5.31 -1.52 0.24 -4.99 119.66 123.98 3h5r s GLN 27 Ca 0.95 -0.62 -0.17 0.00 -1.95 0.00 0.00 55.36 53.56 3h5r s GLN 27 Cb -1.15 -2.84 0.00 0.00 -0.22 0.00 0.00 33.01 28.80 3h5r s GLN 27 CO 0.63 0.07 0.47 -0.47 -0.25 0.00 0.00 175.29 175.74 3h5r s TYR 28 N 0.77 3.18 -0.52 0.91 5.04 -1.26 -0.97 117.35 124.50 3h5r s TYR 28 Ca -0.03 0.02 -0.17 0.00 -2.44 0.00 0.00 57.07 54.46 3h5r s TYR 28 Cb -0.15 -2.89 0.10 0.00 0.35 0.00 0.00 41.96 39.38 3h5r s TYR 28 CO 0.02 -0.56 0.51 0.08 -1.34 0.00 0.00 175.55 174.25 3h5r s VAL 29 N 2.29 5.13 0.30 3.14 1.01 -0.32 -4.95 120.40 127.00 3h5r s VAL 29 Ca 0.16 -1.18 0.04 0.00 0.00 0.00 0.00 61.98 61.00 3h5r s VAL 29 Cb -0.16 -4.29 0.30 0.00 0.00 0.00 0.00 36.38 32.23 3h5r s VAL 29 CO 0.13 -0.81 1.81 1.05 0.00 0.00 0.00 175.10 177.29 3h5r h GLU 30 N 8.90 0.83 -5.71 2.72 9.09 -1.93 -2.14 114.58 126.34 3h5r h GLU 30 Ca -0.29 -0.05 -0.60 0.00 0.05 0.00 0.00 59.36 58.47 3h5r h GLU 30 Cb 1.10 -0.19 -0.09 0.00 -1.65 0.00 0.00 28.75 27.92 3h5r h GLU 30 CO 0.99 0.55 0.31 1.21 0.05 0.00 0.00 179.01 182.11 3h5r s ASN 31 N -5.57 6.75 0.09 3.06 3.04 -1.26 -3.01 114.94 118.03 3h5r s ASN 31 Ca -0.11 0.92 -0.20 0.00 0.04 0.00 0.00 52.86 53.51 3h5r s ASN 31 Cb 0.23 -2.39 -0.09 0.00 -1.54 0.00 0.00 41.25 37.47 3h5r s ASN 31 CO 0.80 -0.41 1.60 0.25 -3.04 0.00 0.00 177.10 176.30 3h5r h LEU 32 N 8.80 0.31 -1.05 3.21 5.85 -1.82 -1.00 115.31 129.62 3h5r h LEU 32 Ca -0.27 -0.21 0.07 0.00 0.84 0.00 0.00 57.88 58.32 3h5r h LEU 32 Cb 1.12 -0.08 -0.07 0.00 0.37 0.00 0.00 40.66 42.00 3h5r h LEU 32 CO 0.82 0.44 0.63 -0.37 -0.34 0.00 0.00 178.44 179.62 3h5r h VAL 33 N 0.17 1.07 0.07 1.05 -1.51 -1.94 0.18 116.25 115.35 3h5r h VAL 33 Ca 0.07 -0.39 -0.00 0.00 -1.23 0.00 0.00 66.70 65.15 3h5r h VAL 33 Cb 0.24 -0.15 0.00 0.00 -2.13 0.00 0.00 31.29 29.24 3h5r h VAL 33 CO -0.00 0.21 -0.04 0.25 -1.23 0.00 0.00 177.57 176.76 3h5r h LEU 34 N 1.13 -0.08 -0.48 4.19 5.85 -1.94 -1.47 115.31 122.49 3h5r h LEU 34 Ca 0.43 -0.20 0.02 0.00 0.84 0.00 0.00 57.88 58.97 3h5r h LEU 34 Cb 0.20 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.22 3h5r h LEU 34 CO -0.17 0.15 0.28 -0.25 -0.34 0.00 0.00 178.44 178.11 3h5r h TRP 35 N -0.32 0.53 -0.24 1.25 7.01 -0.34 0.11 115.95 123.94 3h5r h TRP 35 Ca -0.01 0.02 -0.02 0.00 2.11 0.00 0.00 58.89 60.99 3h5r h TRP 35 Cb 0.28 -0.17 -0.01 0.00 -2.10 0.00 0.00 29.16 27.16 3h5r h TRP 35 CO 0.00 0.30 0.07 0.93 -2.79 0.00 0.00 178.44 176.94 3h5r h GLU 36 N 0.56 0.34 -0.14 2.65 4.39 -0.68 -1.39 114.58 120.32 3h5r h GLU 36 Ca 0.20 -0.04 -0.19 0.00 0.34 0.00 0.00 59.36 59.67 3h5r h GLU 36 Cb 0.03 -0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 28.61 3h5r h GLU 36 CO -0.10 0.32 -0.68 -0.91 -1.16 0.00 0.00 179.01 176.48 3h5r h ASN 37 N 0.34 0.66 -0.61 1.42 2.35 -0.02 -2.25 115.58 117.48 3h5r h ASN 37 Ca 0.08 -0.41 -0.00 0.00 -0.55 0.00 0.00 56.30 55.42 3h5r h ASN 37 Cb 0.13 -0.19 -0.03 0.00 0.05 0.00 0.00 38.32 38.27 3h5r h ASN 37 CO -0.00 1.16 0.36 0.40 -1.65 0.00 0.00 177.43 177.69 3h5r h ILE 38 N 0.40 1.18 -0.05 2.81 2.04 -0.27 -0.26 117.51 123.37 3h5r h ILE 38 Ca -0.02 -0.40 0.02 0.00 1.00 0.00 0.00 64.86 65.45 3h5r h ILE 38 Cb 1.26 0.35 -0.02 0.00 -0.74 0.00 0.00 36.82 37.68 3h5r h ILE 38 CO 0.13 0.19 -0.07 0.40 0.00 0.00 0.00 178.15 178.79 3h5r h ILE 39 N 0.82 0.81 -0.74 -0.67 2.04 -1.21 0.14 117.51 118.69 3h5r h ILE 39 Ca 0.22 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.14 3h5r h ILE 39 Cb -0.02 0.81 -0.06 0.00 -0.74 0.00 0.00 36.82 36.81 3h5r h ILE 39 CO -0.04 0.00 0.43 0.11 0.00 0.00 0.00 178.15 178.65 3h5r h LYS 40 N -0.10 0.76 0.07 2.37 1.57 -1.09 -1.15 116.57 119.00 3h5r h LYS 40 Ca 0.04 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3h5r h LYS 40 Cb 0.16 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.30 3h5r h LYS 40 CO -0.11 0.51 -0.03 1.15 -0.57 0.00 0.00 179.45 180.40 3h5r h THR 41 N 0.79 0.99 -0.75 -0.16 2.02 -0.71 -3.17 112.91 111.91 3h5r h THR 41 Ca 0.33 -0.19 -0.01 0.00 0.77 0.00 0.00 66.41 67.32 3h5r h THR 41 Cb 0.20 1.11 -0.04 0.00 -1.74 0.00 0.00 68.15 67.68 3h5r h THR 41 CO -0.19 0.05 0.43 0.00 0.37 0.00 0.00 175.52 176.18 3h5r h ALA 42 N 0.75 1.34 -0.22 6.16 0.00 -0.35 -1.56 119.26 125.38 3h5r h ALA 42 Ca -0.01 -0.10 0.06 0.00 0.00 0.00 0.00 54.91 54.86 3h5r h ALA 42 Cb 0.15 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 3h5r h ALA 42 CO 0.02 0.55 0.17 -0.92 0.00 0.00 0.00 179.25 179.07 3h5r h TYR 43 N 1.04 0.00 0.00 0.00 3.20 -1.21 -0.05 116.97 119.94 3h5r h TYR 43 Ca 0.27 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.14 3h5r h TYR 43 Cb -0.00 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.27 3h5r h TYR 43 CO 0.01 0.00 0.00 0.00 -1.64 0.00 0.00 178.16 176.53 3h5r n PHE 45 N -2.99 0.65 -0.30 0.00 3.72 -0.04 -4.58 117.46 113.91 3h5r n PHE 45 Ca 0.01 -0.64 -0.03 0.00 -0.05 0.00 0.00 57.45 56.74 3h5r n PHE 45 Cb 0.33 -0.13 0.12 0.00 -0.94 0.00 0.00 39.48 38.86 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 1.97 1.25 -3.38 4.37 2.04 -1.57 0.25 117.51 122.43 3h5r h ILE 46 Ca 0.00 -0.62 -0.66 0.00 1.00 0.00 0.00 64.86 64.58 3h5r h ILE 46 Cb 1.00 0.10 -0.14 0.00 -0.74 0.00 0.00 36.82 37.04 3h5r h ILE 46 CO 0.08 0.28 -0.65 0.42 0.00 0.00 0.00 178.15 178.28 3h5r s THR 47 N -5.78 4.09 0.32 -0.27 -4.23 -1.26 -4.68 115.64 103.83 3h5r s THR 47 Ca -0.12 -0.71 -0.27 0.00 -1.18 0.00 0.00 61.69 59.41 3h5r s THR 47 Cb 0.17 -2.85 -0.13 0.00 1.34 0.00 0.00 72.50 71.03 3h5r s THR 47 CO 0.82 0.31 1.06 -2.65 -0.54 0.00 0.00 174.62 173.63 3h5r n PRO 48 N 1.20 1.51 -3.67 3.99 -0.02 -1.26 -4.86 135.00 131.89 3h5r n PRO 48 Ca -0.14 0.53 -0.14 0.00 -2.02 0.00 0.00 63.50 61.73 3h5r n PRO 48 Cb 0.52 -1.98 -0.08 0.00 -0.02 0.00 0.00 33.50 31.95 3h5r n PRO 48 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3h5r s SER 49 N -0.54 -0.52 0.71 2.55 0.15 0.65 -4.87 113.70 111.83 3h5r s SER 49 Ca 0.59 0.87 -0.11 0.00 0.70 0.00 0.00 55.95 57.99 3h5r s SER 49 Cb -0.65 0.88 0.02 0.00 -1.71 0.00 0.00 66.02 64.56 3h5r s SER 49 CO 0.60 -0.29 1.07 -0.94 1.20 0.00 0.00 173.24 174.88 3h5r s SER 50 N -0.20 5.35 0.24 5.45 1.04 -1.26 0.11 113.70 124.43 3h5r s SER 50 Ca -0.04 1.34 -0.06 0.00 0.48 0.00 0.00 55.95 57.67 3h5r s SER 50 Cb -0.03 -2.19 0.29 0.00 0.10 0.00 0.00 66.02 64.19 3h5r s SER 50 CO 0.03 -1.42 1.87 0.22 0.98 0.00 0.00 173.24 174.91 3h5r h TYR 51 N -0.71 1.02 -0.05 5.02 3.20 -1.97 -2.67 116.97 120.80 3h5r h TYR 51 Ca -0.45 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.43 3h5r h TYR 51 Cb 1.23 -0.33 -0.00 0.00 1.54 0.00 0.00 36.73 39.17 3h5r h TYR 51 CO 0.55 0.56 -0.02 1.79 -1.64 0.00 0.00 178.16 179.39 3h5r h THR 52 N 1.03 1.32 -0.62 1.81 1.35 -1.95 -1.52 112.91 114.34 3h5r h THR 52 Ca 0.36 -1.01 0.10 0.00 -0.55 0.00 0.00 66.41 65.31 3h5r h THR 52 Cb 0.08 1.89 -0.04 0.00 -1.73 0.00 0.00 68.15 68.35 3h5r h THR 52 CO -0.14 0.28 0.42 0.00 -0.25 0.00 0.00 175.52 175.82 3h5r h ALA 53 N 0.62 2.02 0.02 6.62 0.00 -1.94 -1.87 119.26 124.73 3h5r h ALA 53 Ca 0.01 -0.01 -0.26 0.00 0.00 0.00 0.00 54.91 54.66 3h5r h ALA 53 Cb 0.45 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 3h5r h ALA 53 CO 0.01 -0.17 -1.34 0.00 0.00 0.00 0.00 179.25 177.75 3h5r h ALA 54 N 1.69 0.49 -0.45 0.00 0.00 -1.34 -0.45 119.26 119.20 3h5r h ALA 54 Ca 0.29 -1.14 0.04 0.00 0.00 0.00 0.00 54.91 54.09 3h5r h ALA 54 Cb 0.58 0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.48 3h5r h ALA 54 CO -0.08 1.35 0.23 1.25 0.00 0.00 0.00 179.25 182.00 3h5r h LEU 55 N 0.01 0.33 -0.24 0.00 5.85 -0.87 0.21 115.31 120.60 3h5r h LEU 55 Ca -0.15 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.57 3h5r h LEU 55 Cb 1.90 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 42.88 3h5r h LEU 55 CO 0.12 0.23 0.07 -0.33 -0.34 0.00 0.00 178.44 178.19 3h5r h GLU 56 N 0.45 0.37 -0.05 1.25 4.39 -1.27 -3.34 114.58 116.39 3h5r h GLU 56 Ca 0.20 -0.09 -0.01 0.00 0.34 0.00 0.00 59.36 59.80 3h5r h GLU 56 Cb 0.10 -0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 28.70 3h5r h GLU 56 CO -0.14 0.47 -0.00 1.15 -1.16 0.00 0.00 179.01 179.33 3h5r h THR 57 N 0.21 1.26 -3.05 1.13 2.02 -0.83 -3.39 112.91 110.26 3h5r h THR 57 Ca 0.08 -0.81 -0.53 0.00 0.77 0.00 0.00 66.41 65.91 3h5r h THR 57 Cb 0.26 1.71 0.01 0.00 -1.74 0.00 0.00 68.15 68.39 3h5r h THR 57 CO -0.00 0.22 0.69 0.00 0.37 0.00 0.00 175.52 176.80 3h5r s ALA 58 N -4.89 3.52 -0.84 6.16 0.00 0.71 -4.94 121.76 121.48 3h5r s ALA 58 Ca -0.15 0.99 -0.02 0.00 0.00 0.00 0.00 51.96 52.79 3h5r s ALA 58 Cb 0.04 -3.52 0.33 0.00 0.00 0.00 0.00 23.12 19.97 3h5r s ALA 58 CO 0.69 -0.60 2.06 0.27 0.00 0.00 0.00 175.76 178.18 3h5r n ASN 59 N 4.16 7.47 -4.43 0.00 6.94 -1.26 -4.69 115.26 123.44 3h5r n ASN 59 Ca 0.11 -3.79 -0.24 0.00 -0.02 0.00 0.00 54.58 50.64 3h5r n ASN 59 Cb 0.44 -1.09 -0.10 0.00 -2.36 0.00 0.00 39.78 36.67 3h5r n ASN 59 CO 0.00 0.00 0.00 0.27 -1.03 0.00 0.00 177.26 176.50 3h5r s ILE 60 N -4.84 2.29 0.41 1.53 -4.36 -1.26 -5.11 121.20 109.85 3h5r s ILE 60 Ca 0.52 -2.27 -0.25 0.00 -0.26 0.00 0.00 60.65 58.39 3h5r s ILE 60 Cb 0.42 -2.19 -0.11 0.00 1.25 0.00 0.00 42.46 41.83 3h5r s ILE 60 CO -0.39 -0.37 1.12 -2.65 0.24 0.00 0.00 174.94 172.89 3h5r n PRO 61 N -0.34 1.59 -0.22 0.37 -0.02 -1.26 -4.69 135.00 130.43 3h5r n PRO 61 Ca -0.08 0.57 -0.02 0.00 -2.02 0.00 0.00 63.50 61.96 3h5r n PRO 61 Cb 0.59 -2.17 0.09 0.00 -0.02 0.00 0.00 33.50 32.00 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 1.81 0.59 0.00 -0.52 9.09 -1.98 0.97 114.58 124.53 3h5r h GLU 62 Ca -0.45 -0.04 -0.02 0.00 0.05 0.00 0.00 59.36 58.90 3h5r h GLU 62 Cb 1.32 -0.13 -0.00 0.00 -1.65 0.00 0.00 28.75 28.28 3h5r h GLU 62 CO 0.58 0.39 -0.08 1.57 0.05 0.00 0.00 179.01 181.52 3h5r h LYS 63 N 0.61 0.00 0.14 1.06 5.09 -1.99 -0.70 116.57 120.77 3h5r h LYS 63 Ca 0.29 0.00 -0.24 0.00 0.09 0.00 0.00 60.65 60.79 3h5r h LYS 63 Cb 0.22 0.00 0.01 0.00 0.10 0.00 0.00 32.23 32.56 3h5r h LYS 63 CO -0.20 0.08 -1.16 -0.44 -2.09 0.00 0.00 179.45 175.64 3h5r h ASP 64 N 0.00 0.45 -0.36 7.07 3.32 -1.52 -3.05 116.42 122.33 3h5r h ASP 64 Ca -0.00 -0.90 -0.01 0.00 0.02 0.00 0.00 57.03 56.14 3h5r h ASP 64 Cb 0.16 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.54 3h5r h ASP 64 CO 0.01 1.53 0.20 0.15 -1.72 0.00 0.00 179.24 179.41 3h5r h PHE 65 N -0.30 0.50 -0.83 4.55 3.57 -0.73 -1.77 116.94 121.92 3h5r h PHE 65 Ca -0.23 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.28 3h5r h PHE 65 Cb 1.74 -0.16 -0.05 0.00 2.79 0.00 0.00 35.95 40.27 3h5r h PHE 65 CO 0.16 0.40 0.54 1.03 -2.23 0.00 0.00 178.31 178.20 3h5r h SER 66 N 0.46 0.90 -0.42 0.41 0.87 -1.27 0.37 113.55 114.87 3h5r h SER 66 Ca 0.13 -0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.67 3h5r h SER 66 Cb 0.06 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 61.80 3h5r h SER 66 CO -0.02 0.63 0.24 0.78 -0.53 0.00 0.00 176.83 177.92 3h5r h ASN 67 N 1.06 0.51 -0.53 6.23 2.35 -1.39 -1.40 115.58 122.41 3h5r h ASN 67 Ca 0.33 -0.07 -0.10 0.00 -0.55 0.00 0.00 56.30 55.90 3h5r h ASN 67 Cb -0.02 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.20 3h5r h ASN 67 CO -0.11 0.44 -0.07 0.00 -1.65 0.00 0.00 177.43 176.04 3h5r h PHE 69 N 0.86 0.34 -0.75 0.00 3.57 -0.88 -0.73 116.94 119.36 3h5r h PHE 69 Ca 0.14 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.60 3h5r h PHE 69 Cb 0.63 -0.11 -0.03 0.00 2.79 0.00 0.00 35.95 39.23 3h5r h PHE 69 CO 0.04 0.33 0.37 0.00 -2.23 0.00 0.00 178.31 176.82 3h5r h ARG 70 N 0.26 1.07 0.08 1.11 3.08 -1.18 1.00 114.38 119.80 3h5r h ARG 70 Ca 0.08 -0.15 0.02 0.00 0.07 0.00 0.00 59.98 60.00 3h5r h ARG 70 Cb 0.11 -0.20 -0.04 0.00 0.08 0.00 0.00 29.97 29.92 3h5r h ARG 70 CO -0.01 0.83 -0.31 0.35 -1.07 0.00 0.00 179.97 179.75 3h5r h PHE 71 N 1.05 -0.85 -0.62 3.04 3.57 -0.96 0.05 116.94 122.21 3h5r h PHE 71 Ca 0.26 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.69 3h5r h PHE 71 Cb 0.10 0.36 -0.02 0.00 2.79 0.00 0.00 35.95 39.19 3h5r h PHE 71 CO 0.01 -0.41 0.02 -0.07 -2.23 0.00 0.00 178.31 175.62 3h5r h LEU 72 N -0.51 1.05 -0.27 0.59 3.38 -0.93 -2.73 115.31 115.89 3h5r h LEU 72 Ca 0.04 -0.30 -0.00 0.00 0.09 0.00 0.00 57.88 57.71 3h5r h LEU 72 Cb 0.56 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 3h5r h LEU 72 CO -0.21 1.09 0.16 0.50 0.09 0.00 0.00 178.44 180.07 3h5r h LYS 73 N 0.98 0.38 -0.18 1.13 3.64 -0.69 0.12 116.57 121.94 3h5r h LYS 73 Ca 0.18 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.48 3h5r h LYS 73 Cb 0.54 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.28 3h5r h LYS 73 CO 0.03 0.31 -0.05 0.93 -2.27 0.00 0.00 179.45 178.40 3h5r h GLU 74 N 0.34 0.26 -0.17 1.90 5.08 -0.86 -1.03 114.58 120.10 3h5r h GLU 74 Ca 0.10 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 3h5r h GLU 74 Cb 0.04 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.24 3h5r h GLU 74 CO -0.02 0.34 0.00 0.09 -1.00 0.00 0.00 179.01 178.42 3h5r n ASN 75 N -4.33 1.95 -2.07 1.42 3.02 -1.04 -4.92 115.26 109.29 3h5r n ASN 75 Ca -0.00 -1.73 -0.20 0.00 -0.03 0.00 0.00 54.58 52.62 3h5r n ASN 75 Cb 0.22 -0.10 -0.03 0.00 -0.61 0.00 0.00 39.78 39.25 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 0.51 -0.69 0.08 3.10 3.72 -0.39 -4.89 117.46 118.91 3h5r n PHE 76 Ca 0.17 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.48 3h5r n PHE 76 Cb 0.38 -3.71 -0.02 0.00 -0.94 0.00 0.00 39.48 35.19 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 0.31 -3.89 1.38 0.04 -1.00 -3.42 116.94 110.35 3h5r h PHE 77 Ca -0.46 -0.18 -0.68 0.00 2.80 0.00 0.00 57.97 59.45 3h5r h PHE 77 Cb 1.34 -0.03 -0.21 0.00 2.20 0.00 0.00 35.95 39.25 3h5r h PHE 77 CO 0.54 1.01 -0.78 0.96 -0.60 0.00 0.00 178.31 179.43 3h5r s ILE 78 N -3.15 2.97 0.15 -0.55 -4.36 -0.95 -0.29 121.20 115.02 3h5r s ILE 78 Ca -0.03 -1.11 0.02 0.00 -0.26 0.00 0.00 60.65 59.28 3h5r s ILE 78 Cb 0.10 -2.26 -0.04 0.00 1.25 0.00 0.00 42.46 41.50 3h5r s ILE 78 CO 0.83 0.34 -0.04 0.27 0.24 0.00 0.00 174.94 176.58 3h5r s ILE 79 N -0.94 0.82 0.26 8.37 -4.36 -0.14 -4.28 121.20 120.93 3h5r s ILE 79 Ca 0.15 -1.99 -0.30 0.00 -0.26 0.00 0.00 60.65 58.25 3h5r s ILE 79 Cb -0.11 -1.93 -0.13 0.00 1.25 0.00 0.00 42.46 41.54 3h5r s ILE 79 CO 0.06 -0.65 1.35 -2.65 0.24 0.00 0.00 174.94 173.28 3h5r n PRO 80 N -0.18 1.97 0.17 0.37 -0.02 -1.26 -0.59 135.00 135.46 3h5r n PRO 80 Ca -0.09 0.70 0.18 0.00 -2.02 0.00 0.00 63.50 62.27 3h5r n PRO 80 Cb 0.62 -2.31 0.80 0.00 -0.02 0.00 0.00 33.50 32.59 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 3.70 0.00 2.00 -1.23 0.00 -1.28 -0.14 103.07 106.11 3h5r h GLY 81 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.88 3h5r h GLY 81 CO 0.72 0.00 0.00 1.05 0.00 0.00 0.00 176.54 178.31 3h5r h GLU 82 N 0.00 0.00 -0.09 4.80 4.11 -1.88 -1.72 114.58 119.80 3h5r h GLU 82 Ca 0.12 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.55 3h5r h GLU 82 Cb 0.68 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.93 3h5r h GLU 82 CO -0.00 0.00 0.00 0.66 0.07 0.00 0.00 179.01 179.74 3h5r n TYR 83 N -2.67 0.11 -4.19 2.06 4.01 -0.07 -4.92 117.16 111.50 3h5r n TYR 83 Ca 0.00 -0.06 -0.24 0.00 -0.16 0.00 0.00 57.90 57.45 3h5r n TYR 83 Cb 0.21 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.18 3h5r n TYR 83 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 3h5r s ASN 84 N -1.62 5.04 0.00 7.72 2.47 -0.65 -4.55 114.94 123.35 3h5r s ASN 84 Ca 0.32 -0.40 0.00 0.00 0.42 0.00 0.00 52.86 53.20 3h5r s ASN 84 Cb 0.16 -1.14 0.00 0.00 -1.45 0.00 0.00 41.25 38.82 3h5r s ASN 84 CO 0.26 0.01 0.00 0.59 -3.72 0.00 0.00 177.10 174.24 3h5r n ASN 85 N -0.77 0.78 0.00 -4.21 4.13 -1.26 -5.08 115.26 108.85 3h5r n ASN 85 Ca -0.08 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.18 3h5r n ASN 85 Cb 0.57 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.81 3h5r n ASN 85 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 3h5r n ASN 90 N 0.00 0.00 0.24 6.41 5.15 -1.26 -5.16 115.26 120.63 3h5r n ASN 90 Ca 0.00 0.00 0.07 0.00 -0.60 0.00 0.00 54.58 54.05 3h5r n ASN 90 Cb 0.00 0.00 0.57 0.00 -0.53 0.00 0.00 39.78 39.82 3h5r n ASN 90 CO 0.00 0.00 0.00 0.08 1.40 0.00 0.00 177.26 178.74 3h5r h ARG 91 N 0.00 0.00 -0.64 1.20 0.11 -2.06 -1.85 114.38 111.15 3h5r h ARG 91 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3h5r h ARG 91 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 3h5r h ARG 91 CO 0.00 0.13 0.00 0.66 0.10 0.00 0.00 179.97 180.86 3h5r n TYR 92 N -4.28 1.41 -0.30 4.08 4.01 -1.26 -4.66 117.16 116.17 3h5r n TYR 92 Ca -0.03 -0.54 0.03 0.00 -0.16 0.00 0.00 57.90 57.20 3h5r n TYR 92 Cb 0.21 -0.28 0.10 0.00 -0.31 0.00 0.00 39.34 39.06 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 3.51 -0.81 0.09 7.72 4.64 -1.78 -0.27 113.55 126.66 3h5r h SER 93 Ca 0.00 0.25 -0.13 0.00 -0.47 0.00 0.00 61.79 61.44 3h5r h SER 93 Cb 1.41 0.53 -0.01 0.00 -0.31 0.00 0.00 62.40 64.01 3h5r h SER 93 CO 0.26 -0.28 -0.43 0.03 -0.87 0.00 0.00 176.83 175.53 3h5r h ARG 94 N -0.00 0.43 -0.71 4.77 2.47 -1.85 -2.31 114.38 117.18 3h5r h ARG 94 Ca 0.40 -0.22 -0.06 0.00 -1.26 0.00 0.00 59.98 58.83 3h5r h ARG 94 Cb 0.61 0.01 -0.03 0.00 -1.65 0.00 0.00 29.97 28.91 3h5r h ARG 94 CO -0.86 0.79 0.20 -0.91 0.56 0.00 0.00 179.97 179.74 3h5r h ASN 95 N 0.35 1.04 -0.87 7.04 -0.26 -1.53 -2.26 115.58 119.09 3h5r h ASN 95 Ca 0.03 -0.20 0.07 0.00 -0.56 0.00 0.00 56.30 55.63 3h5r h ASN 95 Cb 0.91 -0.27 -0.07 0.00 -1.06 0.00 0.00 38.32 37.83 3h5r h ASN 95 CO 0.08 0.98 0.53 -0.26 -1.06 0.00 0.00 177.43 177.70 3h5r h PHE 96 N 1.06 0.98 -0.47 1.19 -1.00 -0.55 -0.98 116.94 117.19 3h5r h PHE 96 Ca 0.23 0.03 0.02 0.00 2.81 0.00 0.00 57.97 61.05 3h5r h PHE 96 Cb 0.33 -0.31 -0.03 0.00 3.61 0.00 0.00 35.95 39.55 3h5r h PHE 96 CO 0.03 0.48 0.28 -0.07 -1.61 0.00 0.00 178.31 177.42 3h5r h LEU 97 N 0.95 0.47 -0.32 1.54 3.38 -1.14 0.11 115.31 120.30 3h5r h LEU 97 Ca 0.39 -0.00 0.07 0.00 0.09 0.00 0.00 57.88 58.43 3h5r h LEU 97 Cb 0.23 -0.10 -0.08 0.00 0.09 0.00 0.00 40.66 40.80 3h5r h LEU 97 CO -0.19 0.33 -0.22 -0.74 0.09 0.00 0.00 178.44 177.71 3h5r h HIS 98 N 0.57 -0.56 -0.33 1.13 2.76 -0.96 -0.99 115.15 116.77 3h5r h HIS 98 Ca 0.18 0.04 -0.05 0.00 -2.20 0.00 0.00 60.37 58.34 3h5r h HIS 98 Cb -0.01 0.30 -0.01 0.00 1.55 0.00 0.00 27.41 29.24 3h5r h HIS 98 CO -0.06 -0.29 -0.01 1.88 -1.30 0.00 0.00 177.93 178.15 3h5r h TYR 99 N -0.18 0.65 -0.85 5.26 0.05 -0.60 -2.71 116.97 118.58 3h5r h TYR 99 Ca 0.16 -0.11 0.17 0.00 0.05 0.00 0.00 58.73 59.00 3h5r h TYR 99 Cb 0.44 -0.17 -0.10 0.00 1.01 0.00 0.00 36.73 37.91 3h5r h TYR 99 CO -0.41 0.71 0.41 1.96 -1.05 0.00 0.00 178.16 179.78 3h5r h GLN 100 N 0.39 0.53 0.00 4.88 4.20 -0.68 -1.62 115.11 122.80 3h5r h GLN 100 Ca 0.09 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.77 3h5r h GLN 100 Cb 0.46 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 28.12 3h5r h GLN 100 CO 0.02 0.35 0.00 0.66 -0.67 0.00 0.00 178.83 179.19 3h5r h SER 101 N 0.54 0.00 -0.39 1.46 4.64 -0.84 0.10 113.55 119.06 3h5r h SER 101 Ca 0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.81 3h5r h SER 101 Cb 0.77 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.86 3h5r h SER 101 CO -0.41 0.00 0.00 -1.22 -0.87 0.00 0.00 176.83 174.33 3h5r n TYR 102 N -2.52 0.50 -1.05 4.77 4.01 -0.82 -4.83 117.16 117.23 3h5r n TYR 102 Ca 0.01 -0.25 -0.02 0.00 -0.16 0.00 0.00 57.90 57.48 3h5r n TYR 102 Cb 0.22 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.25 3h5r n TYR 102 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3h5r n GLY 103 N 1.46 0.51 3.93 2.72 0.00 0.02 -4.96 105.19 108.86 3h5r n GLY 103 Ca 0.19 -0.90 -0.26 0.00 0.00 0.00 0.00 46.02 45.05 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 -2.05 3.54 -0.31 4.61 0.00 -0.67 -5.00 121.76 121.88 3h5r s ALA 104 Ca 0.00 -0.72 -0.23 0.00 0.00 0.00 0.00 51.96 51.01 3h5r s ALA 104 Cb 0.00 -2.36 -0.00 0.00 0.00 0.00 0.00 23.12 20.76 3h5r s ALA 104 CO 0.00 -0.25 0.75 1.21 0.00 0.00 0.00 175.76 177.47 3h5r s ASN 105 N -4.10 6.62 0.32 0.00 3.84 -1.26 -3.99 114.94 116.36 3h5r s ASN 105 Ca 0.45 0.59 0.09 0.00 0.21 0.00 0.00 52.86 54.20 3h5r s ASN 105 Cb -0.10 -2.39 0.55 0.00 -0.55 0.00 0.00 41.25 38.76 3h5r s ASN 105 CO 0.41 -0.59 1.74 1.55 -2.79 0.00 0.00 177.10 177.43 3h5r h PRO 106 N 8.15 0.14 -0.96 0.43 0.13 -1.88 -2.02 132.00 135.99 3h5r h PRO 106 Ca -0.25 -0.06 0.06 0.00 -0.87 0.00 0.00 66.00 64.88 3h5r h PRO 106 Cb 1.10 -0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.17 3h5r h PRO 106 CO 0.86 0.52 0.63 0.28 -0.23 0.00 0.00 178.00 180.07 3h5r h VAL 107 N 0.12 1.10 -0.00 1.56 2.07 -1.93 0.12 116.25 119.29 3h5r h VAL 107 Ca 0.01 -0.39 -0.21 0.00 0.82 0.00 0.00 66.70 66.93 3h5r h VAL 107 Cb 0.77 -0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 30.39 3h5r h VAL 107 CO 0.06 0.21 -0.89 -0.07 0.02 0.00 0.00 177.57 176.90 3h5r h LEU 108 N 1.15 0.38 0.50 2.57 3.38 -1.81 -0.49 115.31 120.98 3h5r h LEU 108 Ca 0.41 -0.30 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 3h5r h LEU 108 Cb 0.13 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.77 3h5r h LEU 108 CO -0.15 1.09 -0.24 0.58 0.09 0.00 0.00 178.44 179.81 3h5r h VAL 109 N 0.17 0.45 -0.93 1.22 2.07 -0.93 -2.46 116.25 115.84 3h5r h VAL 109 Ca -0.06 -0.30 0.14 0.00 0.82 0.00 0.00 66.70 67.30 3h5r h VAL 109 Cb 1.51 0.58 -0.08 0.00 -1.52 0.00 0.00 31.29 31.78 3h5r h VAL 109 CO 0.14 0.05 0.59 -0.61 0.02 0.00 0.00 177.57 177.76 3h5r h GLN 110 N -0.87 0.74 -0.76 1.57 5.75 -0.74 0.36 115.11 121.16 3h5r h GLN 110 Ca -0.07 -0.04 -0.04 0.00 -0.15 0.00 0.00 58.65 58.34 3h5r h GLN 110 Cb 0.59 -0.17 -0.03 0.00 1.07 0.00 0.00 27.48 28.94 3h5r h GLN 110 CO 0.11 0.49 0.30 0.22 -2.65 0.00 0.00 178.83 177.30 3h5r h ASP 111 N 0.76 1.04 -0.62 -0.69 -0.00 -1.05 0.16 116.42 116.02 3h5r h ASP 111 Ca 0.47 -0.17 -0.05 0.00 -0.00 0.00 0.00 57.03 57.28 3h5r h ASP 111 Cb 0.70 -0.27 -0.03 0.00 -0.00 0.00 0.00 39.33 39.73 3h5r h ASP 111 CO -0.23 0.93 0.22 0.11 -0.00 0.00 0.00 179.24 180.27 3h5r h LYS 112 N 1.09 0.98 -0.16 0.28 1.57 -0.47 -2.28 116.57 117.59 3h5r h LYS 112 Ca 0.25 -0.18 -0.11 0.00 -1.87 0.00 0.00 60.65 58.74 3h5r h LYS 112 Cb 0.21 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.37 3h5r h LYS 112 CO -0.02 0.83 -0.32 -0.07 -0.57 0.00 0.00 179.45 179.29 3h5r h LEU 113 N 0.95 0.55 -1.97 2.94 3.38 -0.90 -2.73 115.31 117.54 3h5r h LEU 113 Ca 0.22 -0.56 0.09 0.00 0.09 0.00 0.00 57.88 57.72 3h5r h LEU 113 Cb 0.24 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 3h5r h LEU 113 CO -0.01 1.01 0.23 0.50 0.09 0.00 0.00 178.44 180.25 3h5r h LYS 114 N 0.12 0.03 -0.29 1.13 3.64 -0.84 -1.48 116.57 118.88 3h5r h LYS 114 Ca 0.00 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3h5r h LYS 114 Cb 0.92 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.73 3h5r h LYS 114 CO 0.07 0.02 0.00 0.09 -2.27 0.00 0.00 179.45 177.36 3h5r n ASN 115 N -4.45 3.32 -4.93 4.20 3.02 -0.87 -3.32 115.26 112.23 3h5r n ASN 115 Ca 0.05 -1.98 -0.25 0.00 -0.03 0.00 0.00 54.58 52.36 3h5r n ASN 115 Cb 0.38 -0.18 0.02 0.00 -0.61 0.00 0.00 39.78 39.39 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 -1.60 3.51 -0.04 5.41 0.00 -0.79 -4.96 121.76 123.29 3h5r s ALA 116 Ca 0.35 -0.86 0.01 0.00 0.00 0.00 0.00 51.96 51.46 3h5r s ALA 116 Cb 0.22 -2.39 0.02 0.00 0.00 0.00 0.00 23.12 20.97 3h5r s ALA 116 CO 0.31 -0.60 -0.03 0.21 0.00 0.00 0.00 175.76 175.65 3h5r s LYS 117 N -4.79 0.61 -0.07 0.00 2.20 -1.26 -2.51 119.74 113.92 3h5r s LYS 117 Ca 0.51 -0.03 0.02 0.00 -0.36 0.00 0.00 55.97 56.11 3h5r s LYS 117 Cb -0.10 -0.69 0.01 0.00 -1.51 0.00 0.00 37.83 35.54 3h5r s LYS 117 CO 0.42 -0.10 -0.13 0.08 -0.36 0.00 0.00 175.35 175.26 3h5r s VAL 118 N 0.94 1.21 -0.10 4.02 1.01 -0.85 -1.20 120.40 125.43 3h5r s VAL 118 Ca -0.11 -0.51 -0.22 0.00 0.00 0.00 0.00 61.98 61.14 3h5r s VAL 118 Cb -0.14 -1.11 -0.03 0.00 0.00 0.00 0.00 36.38 35.09 3h5r s VAL 118 CO -0.01 0.38 0.65 -0.69 0.00 0.00 0.00 175.10 175.43 3h5r s VAL 119 N 0.74 5.07 -0.45 2.92 1.01 0.07 -1.61 120.40 128.15 3h5r s VAL 119 Ca -0.13 1.30 -0.11 0.00 0.00 0.00 0.00 61.98 63.04 3h5r s VAL 119 Cb -0.16 -3.98 0.09 0.00 0.00 0.00 0.00 36.38 32.33 3h5r s VAL 119 CO 0.03 0.23 0.32 -0.63 0.00 0.00 0.00 175.10 175.06 3h5r s ILE 120 N 1.01 4.57 -0.78 2.22 -1.09 0.45 0.48 121.20 128.06 3h5r s ILE 120 Ca 0.34 -1.37 -0.15 0.00 -2.23 0.00 0.00 60.65 57.24 3h5r s ILE 120 Cb -0.17 -3.81 0.20 0.00 -1.58 0.00 0.00 42.46 37.10 3h5r s ILE 120 CO 0.15 -0.59 0.74 -0.22 -1.23 0.00 0.00 174.94 173.79 3h5r s LEU 121 N 1.49 6.57 0.00 2.97 2.96 0.42 -0.63 118.68 132.45 3h5r s LEU 121 Ca 0.04 -2.49 0.00 0.00 -0.22 0.00 0.00 54.13 51.45 3h5r s LEU 121 Cb -0.24 -2.22 0.00 0.00 0.50 0.00 0.00 46.19 44.23 3h5r s LEU 121 CO 0.03 -0.65 0.00 0.61 -1.32 0.00 0.00 176.35 175.02 3h5r n GLY 122 N 4.27 2.67 1.34 7.98 0.00 0.08 -1.53 105.19 120.00 3h5r n GLY 122 Ca 0.09 -1.16 -0.08 0.00 0.00 0.00 0.00 46.02 44.87 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 -0.87 1.06 0.08 0.00 0.00 -1.26 -4.50 105.19 99.70 3h5r n GLY 124 Ca 0.30 -1.44 -0.13 0.00 0.00 0.00 0.00 46.02 44.75 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 -0.11 0.90 -0.02 0.00 -1.94 -1.33 103.07 100.57 3h5r h GLY 125 Ca 0.00 0.04 -0.03 0.00 0.00 0.00 0.00 47.33 47.34 3h5r h GLY 125 CO 0.00 -0.04 0.08 -2.22 0.00 0.00 0.00 176.54 174.36 3h5r h ILE 126 N -0.25 1.21 -0.78 2.60 1.08 -1.89 -2.83 117.51 116.65 3h5r h ILE 126 Ca -0.01 -0.70 -0.01 0.00 -0.39 0.00 0.00 64.86 63.75 3h5r h ILE 126 Cb 0.21 1.11 -0.04 0.00 -3.07 0.00 0.00 36.82 35.03 3h5r h ILE 126 CO 0.02 0.23 0.45 1.23 -0.69 0.00 0.00 178.15 179.39 3h5r h GLY 127 N 0.32 1.15 -0.01 5.37 0.00 -1.68 -1.47 103.07 106.74 3h5r h GLY 127 Ca 0.09 -0.50 0.03 0.00 0.00 0.00 0.00 47.33 46.95 3h5r h GLY 127 CO -0.00 0.48 -0.49 3.43 0.00 0.00 0.00 176.54 179.96 3h5r h ASN 128 N 1.07 -1.53 -0.31 0.19 -0.26 -1.21 0.10 115.58 113.64 3h5r h ASN 128 Ca 0.28 0.18 -0.05 0.00 -0.56 0.00 0.00 56.30 56.16 3h5r h ASN 128 Cb -0.00 0.60 -0.01 0.00 -1.06 0.00 0.00 38.32 37.85 3h5r h ASN 128 CO -0.05 -0.48 0.02 0.45 -1.06 0.00 0.00 177.43 176.31 3h5r h HIS 129 N -0.59 0.58 0.09 1.19 3.86 -1.34 -1.98 115.15 116.96 3h5r h HIS 129 Ca 0.04 -0.10 -0.00 0.00 -1.16 0.00 0.00 60.37 59.15 3h5r h HIS 129 Cb 0.68 -0.15 0.00 0.00 1.06 0.00 0.00 27.41 29.00 3h5r h HIS 129 CO -0.51 0.65 -0.04 0.28 0.86 0.00 0.00 177.93 179.17 3h5r h VAL 130 N 0.35 0.97 -0.81 2.45 2.07 -1.26 -2.02 116.25 118.00 3h5r h VAL 130 Ca 0.09 -0.18 0.08 0.00 0.82 0.00 0.00 66.70 67.50 3h5r h VAL 130 Cb 0.41 1.09 -0.07 0.00 -1.52 0.00 0.00 31.29 31.20 3h5r h VAL 130 CO 0.01 0.05 0.47 0.77 0.02 0.00 0.00 177.57 178.89 3h5r h SER 131 N -0.20 0.71 -0.11 0.57 4.64 -0.72 -0.00 113.55 118.44 3h5r h SER 131 Ca -0.01 0.03 -0.11 0.00 -0.47 0.00 0.00 61.79 61.23 3h5r h SER 131 Cb 0.16 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 62.13 3h5r h SER 131 CO 0.02 0.43 -0.28 -0.37 -0.87 0.00 0.00 176.83 175.77 3h5r h VAL 132 N 0.84 1.27 -0.18 0.95 -1.51 -1.10 0.13 116.25 116.64 3h5r h VAL 132 Ca 0.37 -1.35 -0.11 0.00 -1.23 0.00 0.00 66.70 64.38 3h5r h VAL 132 Cb 0.26 1.36 -0.00 0.00 -2.13 0.00 0.00 31.29 30.78 3h5r h VAL 132 CO -0.21 0.43 -0.30 0.40 -1.23 0.00 0.00 177.57 176.66 3h5r h ILE 133 N 0.49 1.34 -0.21 7.19 2.04 -0.71 -2.12 117.51 125.53 3h5r h ILE 133 Ca 0.07 -1.53 0.00 0.00 1.00 0.00 0.00 64.86 64.40 3h5r h ILE 133 Cb 0.73 1.88 -0.01 0.00 -0.74 0.00 0.00 36.82 38.69 3h5r h ILE 133 CO 0.06 0.47 0.14 -0.07 0.00 0.00 0.00 178.15 178.74 3h5r h LEU 134 N 0.18 0.23 -0.02 1.44 3.38 -0.95 -1.30 115.31 118.28 3h5r h LEU 134 Ca 0.01 -0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.01 3h5r h LEU 134 Cb 0.89 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.55 3h5r h LEU 134 CO 0.07 0.17 -0.17 0.00 0.09 0.00 0.00 178.44 178.60 3h5r h ALA 135 N 1.08 -0.19 0.00 1.53 0.00 -0.75 -2.41 119.26 118.52 3h5r h ALA 135 Ca 0.08 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3h5r h ALA 135 Cb -0.02 0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.07 3h5r h ALA 135 CO -0.02 -0.66 0.00 1.79 0.00 0.00 0.00 179.25 180.36 3h5r h THR 136 N -0.27 0.00 0.00 0.00 1.35 -1.32 -2.51 112.91 110.16 3h5r h THR 136 Ca 0.06 -0.40 0.00 0.00 -0.55 0.00 0.00 66.41 65.52 3h5r h THR 136 Cb 0.35 1.28 0.00 0.00 -1.73 0.00 0.00 68.15 68.04 3h5r h THR 136 CO -0.17 0.00 -0.40 -1.20 -0.25 0.00 0.00 175.52 173.50 3h5r n SER 137 N -2.65 0.46 0.00 5.36 7.64 -0.50 -4.95 113.62 118.99 3h5r n SER 137 Ca 0.02 0.04 0.00 0.00 1.01 0.00 0.00 58.87 59.94 3h5r n SER 137 Cb 0.29 0.01 0.00 0.00 -1.01 0.00 0.00 64.21 63.50 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 1.45 1.09 3.64 0.23 0.00 -0.93 -4.95 105.19 105.71 3h5r n GLY 138 Ca 0.05 0.00 -0.53 0.00 0.00 0.00 0.00 46.02 45.54 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 -1.71 0.12 0.02 -0.61 2.08 -1.04 -3.12 119.36 115.09 3h5r n ILE 139 Ca 0.00 -0.02 -0.12 0.00 0.56 0.00 0.00 62.75 63.17 3h5r n ILE 139 Cb 0.00 -1.04 0.00 0.00 -0.75 0.00 0.00 39.64 37.85 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 5.64 0.61 -5.97 7.39 0.00 -1.29 -3.44 103.07 106.00 3h5r h GLY 140 Ca -0.47 -0.83 -0.40 0.00 0.00 0.00 0.00 47.33 45.63 3h5r h GLY 140 CO 0.85 0.74 -0.77 -0.54 0.00 0.00 0.00 176.54 176.82 3h5r s GLU 141 N -3.73 0.78 -0.09 4.80 2.02 -1.04 -1.31 118.70 120.12 3h5r s GLU 141 Ca -0.07 -0.15 0.02 0.00 0.02 0.00 0.00 54.97 54.79 3h5r s GLU 141 Cb 0.10 -0.77 0.01 0.00 0.10 0.00 0.00 34.13 33.57 3h5r s GLU 141 CO 0.86 -0.02 -0.15 0.42 0.02 0.00 0.00 175.26 176.40 3h5r s ILE 142 N 0.62 1.39 -0.30 -1.63 1.01 0.23 -2.00 121.20 120.51 3h5r s ILE 142 Ca -0.08 -0.61 -0.06 0.00 0.00 0.00 0.00 60.65 59.90 3h5r s ILE 142 Cb -0.12 -1.26 0.02 0.00 0.01 0.00 0.00 42.46 41.11 3h5r s ILE 142 CO 0.00 0.41 0.08 -0.63 0.00 0.00 0.00 174.94 174.81 3h5r s ILE 143 N 0.75 3.85 -0.15 2.92 1.09 -0.63 -0.34 121.20 128.70 3h5r s ILE 143 Ca -0.12 -0.83 -0.18 0.00 -1.10 0.00 0.00 60.65 58.42 3h5r s ILE 143 Cb -0.16 -3.04 -0.04 0.00 -1.06 0.00 0.00 42.46 38.17 3h5r s ILE 143 CO 0.02 0.02 0.49 -0.76 -0.10 0.00 0.00 174.94 174.61 3h5r s LEU 144 N 1.46 4.23 -0.18 2.97 1.43 0.43 -0.41 118.68 128.60 3h5r s LEU 144 Ca 0.01 0.76 -0.00 0.00 -1.03 0.00 0.00 54.13 53.87 3h5r s LEU 144 Cb -0.18 -2.69 0.05 0.00 0.03 0.00 0.00 46.19 43.39 3h5r s LEU 144 CO 0.02 -0.06 -0.05 -0.63 0.23 0.00 0.00 176.35 175.86 3h5r s ILE 145 N 0.96 1.18 -0.26 -0.59 1.01 0.20 -0.20 121.20 123.50 3h5r s ILE 145 Ca 0.25 -0.76 -0.28 0.00 0.00 0.00 0.00 60.65 59.85 3h5r s ILE 145 Cb -0.15 -1.39 0.18 0.00 0.01 0.00 0.00 42.46 41.10 3h5r s ILE 145 CO 0.10 0.06 1.28 -0.62 0.00 0.00 0.00 174.94 175.76 3h5r s ASP 146 N 1.59 -0.13 -0.11 3.58 -1.08 -0.95 -0.74 116.67 118.83 3h5r s ASP 146 Ca -0.01 0.17 0.14 0.00 -0.52 0.00 0.00 52.55 52.33 3h5r s ASP 146 Cb -0.16 0.14 0.28 0.00 -1.46 0.00 0.00 42.92 41.72 3h5r s ASP 146 CO -0.07 -0.10 1.14 -3.20 0.52 0.00 0.00 175.17 173.45 3h5r n ASN 147 N 0.83 1.52 -4.91 -0.34 5.15 -1.20 -2.66 115.26 113.64 3h5r n ASN 147 Ca -0.05 -2.94 -0.27 0.00 -0.60 0.00 0.00 54.58 50.73 3h5r n ASN 147 Cb 0.58 -0.39 -0.02 0.00 -0.53 0.00 0.00 39.78 39.42 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 -2.47 6.35 0.41 1.20 1.01 -1.26 -4.94 116.67 116.96 3h5r s ASP 148 Ca 0.27 0.73 0.02 0.00 0.71 0.00 0.00 52.55 54.28 3h5r s ASP 148 Cb 0.26 -2.15 -0.01 0.00 1.01 0.00 0.00 42.92 42.03 3h5r s ASP 148 CO -0.03 -0.35 0.60 -1.10 0.21 0.00 0.00 175.17 174.50 3h5r s GLN 149 N -4.16 3.13 0.06 8.23 1.11 -1.26 -2.08 119.66 124.70 3h5r s GLN 149 Ca 0.44 -0.60 -0.28 0.00 0.01 0.00 0.00 55.36 54.93 3h5r s GLN 149 Cb -0.10 -2.64 -0.05 0.00 -1.01 0.00 0.00 33.01 29.21 3h5r s GLN 149 CO 0.36 -0.13 0.89 0.42 0.01 0.00 0.00 175.29 176.85 3h5r s ILE 150 N -2.42 4.66 0.24 1.08 1.01 0.00 -4.78 121.20 121.00 3h5r s ILE 150 Ca 0.46 1.91 0.11 0.00 0.00 0.00 0.00 60.65 63.14 3h5r s ILE 150 Cb -0.10 -4.25 -0.05 0.00 0.01 0.00 0.00 42.46 38.08 3h5r s ILE 150 CO 0.36 0.30 -0.19 -1.61 0.00 0.00 0.00 174.94 173.80 3h5r s GLU 151 N 0.22 1.71 0.46 2.79 2.02 -1.26 -1.59 118.70 123.05 3h5r s GLU 151 Ca 0.45 -1.62 0.11 0.00 0.02 0.00 0.00 54.97 53.93 3h5r s GLU 151 Cb -0.22 -1.86 1.03 0.00 0.10 0.00 0.00 34.13 33.18 3h5r s GLU 151 CO 0.27 0.36 2.09 -2.95 0.02 0.00 0.00 175.26 175.06 3h5r h ASN 152 N 2.58 0.27 0.36 -0.19 -1.07 -1.97 -0.97 115.58 114.59 3h5r h ASN 152 Ca -0.43 -0.01 -0.05 0.00 0.07 0.00 0.00 56.30 55.88 3h5r h ASN 152 Cb 1.24 -0.07 -0.01 0.00 -2.07 0.00 0.00 38.32 37.41 3h5r h ASN 152 CO 0.56 0.20 -0.23 0.71 0.07 0.00 0.00 177.43 178.73 3h5r h THR 153 N 0.31 0.95 0.00 6.14 1.35 -2.02 -2.80 112.91 116.84 3h5r h THR 153 Ca 0.08 -0.86 -0.00 0.00 -0.55 0.00 0.00 66.41 65.08 3h5r h THR 153 Cb -0.03 1.49 -0.00 0.00 -1.73 0.00 0.00 68.15 67.89 3h5r h THR 153 CO -0.02 0.23 -0.01 0.78 -0.25 0.00 0.00 175.52 176.25 3h5r h ASN 154 N 0.00 0.00 0.91 5.36 2.35 -1.57 -3.25 115.58 119.38 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 0.47 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.84 3h5r h ASN 154 CO 0.03 0.01 0.00 0.18 -1.65 0.00 0.00 177.43 176.00 3h5r n LEU 155 N -3.52 0.58 0.12 1.61 4.77 -1.06 -1.26 117.00 118.24 3h5r n LEU 155 Ca -0.03 0.61 -0.01 0.00 -0.03 0.00 0.00 56.01 56.55 3h5r n LEU 155 Cb 0.10 -0.49 0.10 0.00 -2.33 0.00 0.00 43.42 40.79 3h5r n LEU 155 CO 0.25 -0.38 0.42 0.74 -1.33 0.00 0.00 177.39 177.08 3h5r h THR 156 N 0.00 1.38 0.00 -5.08 2.02 -1.79 -3.38 112.91 106.05 3h5r h THR 156 Ca 0.00 -2.42 0.00 0.00 0.77 0.00 0.00 66.41 64.76 3h5r h THR 156 Cb 0.46 2.35 0.00 0.00 -1.74 0.00 0.00 68.15 69.21 3h5r h THR 156 CO 0.00 0.67 -0.89 0.54 0.37 0.00 0.00 175.52 176.21 3h5r n ARG 157 N -3.57 1.22 -3.41 6.66 1.74 -1.05 -4.60 116.66 113.65 3h5r n ARG 157 Ca -0.00 -0.01 -0.44 0.00 -0.77 0.00 0.00 57.85 56.62 3h5r n ARG 157 Cb 0.71 -0.95 -0.03 0.00 -1.02 0.00 0.00 32.46 31.16 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 -1.93 3.58 0.53 5.56 -0.21 -0.39 -4.73 119.66 122.07 3h5r s GLN 158 Ca -0.00 -2.72 0.25 0.00 0.02 0.00 0.00 55.36 52.90 3h5r s GLN 158 Cb 0.01 -4.33 1.46 0.00 1.00 0.00 0.00 33.01 31.15 3h5r s GLN 158 CO 0.06 -1.26 2.11 -0.24 -2.12 0.00 0.00 175.29 173.85 3h5r h VAL 159 N 4.52 0.69 0.00 1.09 3.04 -1.87 -1.73 116.25 121.99 3h5r h VAL 159 Ca 0.11 -0.38 0.00 0.00 -1.01 0.00 0.00 66.70 65.42 3h5r h VAL 159 Cb 0.97 1.23 0.00 0.00 -2.01 0.00 0.00 31.29 31.48 3h5r h VAL 159 CO 0.81 0.09 0.00 0.18 -1.01 0.00 0.00 177.57 177.65 3h5r n LEU 160 N -3.87 0.48 -4.82 3.16 4.77 -1.26 -4.87 117.00 110.58 3h5r n LEU 160 Ca -0.02 0.55 -0.38 0.00 -0.03 0.00 0.00 56.01 56.13 3h5r n LEU 160 Cb 0.19 -0.40 -0.06 0.00 -2.33 0.00 0.00 43.42 40.82 3h5r n LEU 160 CO 0.31 -0.13 0.06 -0.36 -1.33 0.00 0.00 177.39 175.95 3h5r s PHE 161 N -3.07 3.67 0.52 -1.77 0.08 -0.65 -4.93 117.98 111.84 3h5r s PHE 161 Ca 0.12 0.89 0.08 0.00 0.12 0.00 0.00 56.93 58.14 3h5r s PHE 161 Cb 0.15 -2.27 0.05 0.00 -0.57 0.00 0.00 43.02 40.37 3h5r s PHE 161 CO 0.56 0.59 0.60 -1.12 -0.10 0.00 0.00 175.22 175.74 3h5r s SER 162 N -0.81 5.05 0.19 1.36 0.01 -1.26 -4.99 113.70 113.26 3h5r s SER 162 Ca 0.22 -0.87 -0.09 0.00 1.31 0.00 0.00 55.95 56.52 3h5r s SER 162 Cb -0.16 0.06 0.10 0.00 0.21 0.00 0.00 66.02 66.24 3h5r s SER 162 CO 0.11 -1.09 1.70 -0.33 0.41 0.00 0.00 173.24 174.03 3h5r h GLU 163 N 0.52 1.13 0.00 12.44 5.08 -2.00 -3.10 114.58 128.65 3h5r h GLU 163 Ca -0.35 -0.30 0.00 0.00 -1.00 0.00 0.00 59.36 57.72 3h5r h GLU 163 Cb 1.29 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 30.40 3h5r h GLU 163 CO 0.48 1.02 0.06 0.22 -1.00 0.00 0.00 179.01 179.80 3h5r h ASP 164 N 1.06 0.00 0.60 1.42 3.58 -2.04 -2.63 116.42 118.41 3h5r h ASP 164 Ca 0.21 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.66 3h5r h ASP 164 Cb 0.43 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.48 3h5r h ASP 164 CO 0.01 0.00 -0.80 0.47 -2.88 0.00 0.00 179.24 176.04 3h5r n ASP 165 N -2.81 0.64 -4.67 2.28 8.00 -1.17 -4.89 116.55 113.93 3h5r n ASP 165 Ca -0.02 -0.10 -0.44 0.00 0.71 0.00 0.00 54.79 54.93 3h5r n ASP 165 Cb 0.12 0.48 -0.04 0.00 -0.02 0.00 0.00 41.12 41.66 3h5r n ASP 165 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 3h5r n VAL 166 N -1.94 0.67 0.00 2.53 0.31 -0.99 -2.05 118.33 116.86 3h5r n VAL 166 Ca 0.03 -0.12 0.00 0.00 -0.01 0.00 0.00 64.34 64.24 3h5r n VAL 166 Cb 0.42 -2.14 0.00 0.00 -0.91 0.00 0.00 33.84 31.21 3h5r n VAL 166 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3h5r n GLY 167 N 4.47 0.98 3.92 2.92 0.00 -0.62 -4.97 105.19 111.88 3h5r n GLY 167 Ca 0.21 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.96 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 -0.02 2.82 0.29 1.61 1.02 -0.87 -4.62 119.74 119.97 3h5r s LYS 168 Ca 0.00 0.01 -0.29 0.00 0.02 0.00 0.00 55.97 55.71 3h5r s LYS 168 Cb 0.00 -2.23 -0.10 0.00 -0.52 0.00 0.00 37.83 34.98 3h5r s LYS 168 CO 0.00 -0.81 1.37 -0.80 -0.92 0.00 0.00 175.35 174.19 3h5r s ASN 169 N -4.34 6.72 0.07 2.83 0.01 -1.26 -0.82 114.94 118.16 3h5r s ASN 169 Ca 0.55 2.67 -0.29 0.00 -0.71 0.00 0.00 52.86 55.08 3h5r s ASN 169 Cb -0.11 -2.64 -0.17 0.00 0.41 0.00 0.00 41.25 38.74 3h5r s ASN 169 CO 0.46 -0.62 1.65 0.11 -1.51 0.00 0.00 177.10 177.19 3h5r h LYS 170 N 4.22 -0.51 -0.87 -0.60 1.57 -1.72 -2.27 116.57 116.39 3h5r h LYS 170 Ca -0.47 0.03 0.22 0.00 -1.87 0.00 0.00 60.65 58.56 3h5r h LYS 170 Cb 1.22 0.12 -0.13 0.00 0.08 0.00 0.00 32.23 33.52 3h5r h LYS 170 CO 0.71 -0.33 0.31 1.15 -0.57 0.00 0.00 179.45 180.72 3h5r h THR 171 N -0.55 0.42 0.23 -0.16 2.02 -1.85 0.04 112.91 113.06 3h5r h THR 171 Ca -0.05 -0.11 -0.01 0.00 0.77 0.00 0.00 66.41 67.01 3h5r h THR 171 Cb 0.42 0.08 0.00 0.00 -1.74 0.00 0.00 68.15 66.92 3h5r h THR 171 CO 0.09 0.06 -0.11 -0.08 0.37 0.00 0.00 175.52 175.85 3h5r h GLU 172 N 0.31 -0.29 -0.51 6.66 4.81 -1.87 -2.37 114.58 121.32 3h5r h GLU 172 Ca 0.54 0.02 -0.11 0.00 -0.13 0.00 0.00 59.36 59.67 3h5r h GLU 172 Cb 1.03 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 30.46 3h5r h GLU 172 CO -0.57 -0.12 -0.13 0.28 -0.73 0.00 0.00 179.01 177.74 3h5r h VAL 173 N -0.40 1.27 -0.68 0.32 2.07 -0.84 -2.89 116.25 115.10 3h5r h VAL 173 Ca -0.03 -1.27 0.02 0.00 0.82 0.00 0.00 66.70 66.24 3h5r h VAL 173 Cb 0.31 1.01 -0.04 0.00 -1.52 0.00 0.00 31.29 31.05 3h5r h VAL 173 CO 0.05 0.44 0.44 0.40 0.02 0.00 0.00 177.57 178.92 3h5r h ILE 174 N 0.85 1.14 -0.70 4.57 2.04 -1.02 -2.70 117.51 121.69 3h5r h ILE 174 Ca 0.13 -0.30 0.01 0.00 1.00 0.00 0.00 64.86 65.70 3h5r h ILE 174 Cb 0.68 0.18 -0.03 0.00 -0.74 0.00 0.00 36.82 36.90 3h5r h ILE 174 CO 0.05 0.16 0.46 0.50 0.00 0.00 0.00 178.15 179.32 3h5r h LYS 175 N 0.88 0.92 0.00 2.37 3.64 -1.21 0.32 116.57 123.48 3h5r h LYS 175 Ca 0.26 -0.06 -0.11 0.00 -1.27 0.00 0.00 60.65 59.47 3h5r h LYS 175 Cb -0.05 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 31.54 3h5r h LYS 175 CO -0.08 0.61 -0.51 0.07 -2.27 0.00 0.00 179.45 177.27 3h5r h ARG 176 N 0.94 0.00 0.05 1.90 0.11 -1.44 -2.71 114.38 113.23 3h5r h ARG 176 Ca 0.26 0.00 -0.23 0.00 0.10 0.00 0.00 59.98 60.11 3h5r h ARG 176 Cb -0.11 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 30.96 3h5r h ARG 176 CO -0.06 0.51 -1.05 0.93 0.10 0.00 0.00 179.97 180.40 3h5r h GLU 177 N 0.00 0.13 -0.44 0.08 4.39 -1.16 -1.85 114.58 115.74 3h5r h GLU 177 Ca -0.01 -0.21 -0.06 0.00 0.34 0.00 0.00 59.36 59.43 3h5r h GLU 177 Cb 1.34 0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 30.04 3h5r h GLU 177 CO 0.07 1.06 0.01 -0.07 -1.16 0.00 0.00 179.01 178.92 3h5r h LEU 178 N 0.05 0.67 0.00 1.33 3.38 -0.87 -3.01 115.31 116.86 3h5r h LEU 178 Ca -0.06 -0.14 -0.23 0.00 0.09 0.00 0.00 57.88 57.54 3h5r h LEU 178 Cb 1.77 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 42.31 3h5r h LEU 178 CO 0.16 0.73 -1.17 -0.07 0.09 0.00 0.00 178.44 178.17 3h5r h LEU 179 N 0.66 0.01 -2.15 1.67 4.07 -1.49 0.97 115.31 119.06 3h5r h LEU 179 Ca 0.14 -0.01 0.01 0.00 0.08 0.00 0.00 57.88 58.10 3h5r h LEU 179 Cb 0.39 -0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.13 3h5r h LEU 179 CO 0.01 1.01 0.03 0.11 -1.08 0.00 0.00 178.44 178.52 3h5r h LYS 180 N 0.00 0.00 0.00 1.13 1.57 -1.36 -3.16 116.57 114.75 3h5r h LYS 180 Ca -0.08 0.00 -0.28 0.00 -1.87 0.00 0.00 60.65 58.42 3h5r h LYS 180 Cb 1.83 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 34.10 3h5r h LYS 180 CO 0.12 0.00 -1.56 0.54 -0.57 0.00 0.00 179.45 177.98 3h5r n ARG 181 N -4.30 0.57 -3.75 3.15 1.74 -1.08 -4.82 116.66 108.17 3h5r n ARG 181 Ca -0.02 0.49 -0.30 0.00 -0.77 0.00 0.00 57.85 57.25 3h5r n ARG 181 Cb 0.12 -1.68 -0.14 0.00 -1.02 0.00 0.00 32.46 29.74 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 -6.97 3.97 0.34 0.55 3.84 0.31 -4.98 114.94 112.00 3h5r s ASN 182 Ca -0.31 -2.00 0.14 0.00 0.21 0.00 0.00 52.86 50.90 3h5r s ASN 182 Cb 0.08 -0.98 0.61 0.00 -0.55 0.00 0.00 41.25 40.41 3h5r s ASN 182 CO 0.55 -0.37 1.74 0.77 -2.79 0.00 0.00 177.10 177.00 3h5r h SER 183 N 7.61 0.00 0.08 -4.21 4.64 -1.80 -3.21 113.55 116.67 3h5r h SER 183 Ca -0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.24 3h5r h SER 183 Cb 0.99 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.08 3h5r h SER 183 CO 0.48 0.45 0.00 -0.33 -0.87 0.00 0.00 176.83 176.56 3h5r h GLU 184 N 0.00 0.00 -6.77 4.77 5.08 -1.94 -3.44 114.58 112.28 3h5r h GLU 184 Ca -0.00 0.00 -0.45 0.00 -1.00 0.00 0.00 59.36 57.91 3h5r h GLU 184 Cb 0.86 0.00 0.04 0.00 0.50 0.00 0.00 28.75 30.15 3h5r h GLU 184 CO 0.06 0.00 -0.06 0.96 -1.00 0.00 0.00 179.01 178.97 3h5r s ILE 185 N -3.56 3.40 -0.10 3.13 -4.36 -1.21 -5.02 121.20 113.49 3h5r s ILE 185 Ca -0.02 -0.56 0.03 0.00 -0.26 0.00 0.00 60.65 59.84 3h5r s ILE 185 Cb 0.07 -3.27 -0.01 0.00 1.25 0.00 0.00 42.46 40.51 3h5r s ILE 185 CO 0.23 -0.19 -0.21 -0.94 0.24 0.00 0.00 174.94 174.08 3h5r s SER 186 N -4.31 3.40 -0.13 4.36 1.04 -0.43 -5.01 113.70 112.62 3h5r s SER 186 Ca 0.52 -0.46 0.02 0.00 0.48 0.00 0.00 55.95 56.51 3h5r s SER 186 Cb -0.10 -1.34 -0.00 0.00 0.10 0.00 0.00 66.02 64.68 3h5r s SER 186 CO 0.38 0.19 -0.18 -0.69 0.98 0.00 0.00 173.24 173.92 3h5r s VAL 187 N 0.20 2.49 0.10 5.02 1.01 -1.26 -0.60 120.40 127.35 3h5r s VAL 187 Ca -0.12 -0.85 0.04 0.00 0.00 0.00 0.00 61.98 61.05 3h5r s VAL 187 Cb -0.16 -2.02 -0.04 0.00 0.00 0.00 0.00 36.38 34.16 3h5r s VAL 187 CO 0.07 0.54 0.05 -0.44 0.00 0.00 0.00 175.10 175.31 3h5r s SER 188 N 0.57 5.27 -0.06 3.32 0.01 0.54 -4.97 113.70 118.38 3h5r s SER 188 Ca -0.11 -0.11 0.05 0.00 1.31 0.00 0.00 55.95 57.09 3h5r s SER 188 Cb -0.16 -1.33 -0.02 0.00 0.21 0.00 0.00 66.02 64.72 3h5r s SER 188 CO 0.04 0.16 -0.21 -1.61 0.41 0.00 0.00 173.24 172.03 3h5r s GLU 189 N -2.44 2.59 -0.18 12.44 2.02 -1.26 -0.43 118.70 131.43 3h5r s GLU 189 Ca 0.28 -0.82 0.00 0.00 0.02 0.00 0.00 54.97 54.45 3h5r s GLU 189 Cb -0.12 -2.26 0.04 0.00 0.10 0.00 0.00 34.13 31.89 3h5r s GLU 189 CO 0.20 0.45 -0.08 0.42 0.02 0.00 0.00 175.26 176.27 3h5r s ILE 190 N -0.31 1.41 -1.13 -1.63 1.01 0.72 -4.93 121.20 116.35 3h5r s ILE 190 Ca 0.01 -0.85 -0.19 0.00 0.00 0.00 0.00 60.65 59.63 3h5r s ILE 190 Cb -0.13 -1.53 -0.05 0.00 0.01 0.00 0.00 42.46 40.76 3h5r s ILE 190 CO 0.02 0.15 2.02 0.00 0.00 0.00 0.00 174.94 177.13 3h5r n ALA 191 N 4.77 3.98 -3.63 9.38 0.00 -1.26 -2.51 120.51 131.24 3h5r n ALA 191 Ca -0.13 -3.55 -0.13 0.00 0.00 0.00 0.00 53.44 49.62 3h5r n ALA 191 Cb 0.47 -3.58 -0.14 0.00 0.00 0.00 0.00 19.45 16.20 3h5r n ALA 191 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 3h5r s LEU 192 N 3.05 0.75 -0.03 0.00 1.98 -1.09 -4.72 118.68 118.62 3h5r s LEU 192 Ca 0.54 0.36 0.05 0.00 -2.89 0.00 0.00 54.13 52.19 3h5r s LEU 192 Cb 0.11 0.48 -0.03 0.00 0.66 0.00 0.00 46.19 47.42 3h5r s LEU 192 CO 0.04 -0.14 -0.16 0.20 -1.89 0.00 0.00 176.35 174.40 3h5r s ASN 193 N 1.02 3.92 -0.87 3.68 0.01 -1.26 -2.23 114.94 119.21 3h5r s ASN 193 Ca -0.08 -0.26 -0.21 0.00 -0.71 0.00 0.00 52.86 51.61 3h5r s ASN 193 Cb -0.10 -0.77 0.10 0.00 0.41 0.00 0.00 41.25 40.90 3h5r s ASN 193 CO -0.06 0.33 1.15 -0.63 -1.51 0.00 0.00 177.10 176.37 3h5r s ILE 194 N -0.77 4.46 -0.49 0.60 1.09 -1.26 -4.77 121.20 120.06 3h5r s ILE 194 Ca 0.12 -1.07 0.22 0.00 -1.10 0.00 0.00 60.65 58.82 3h5r s ILE 194 Cb -0.11 -4.81 -0.24 0.00 -1.06 0.00 0.00 42.46 36.24 3h5r s ILE 194 CO 0.01 -1.58 0.76 0.59 -0.10 0.00 0.00 174.94 174.62 3h5r n ASN 195 N 7.33 0.49 -3.99 3.58 3.02 -1.26 -4.50 115.26 119.94 3h5r n ASN 195 Ca 0.18 -0.37 -0.09 0.00 -0.03 0.00 0.00 54.58 54.27 3h5r n ASN 195 Cb 0.48 1.35 -0.10 0.00 -0.61 0.00 0.00 39.78 40.90 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 -3.90 0.28 0.18 6.41 1.01 -1.26 -5.06 116.67 114.32 3h5r s ASP 196 Ca 0.00 -0.63 -0.19 0.00 0.71 0.00 0.00 52.55 52.45 3h5r s ASP 196 Cb 0.15 0.17 0.11 0.00 1.01 0.00 0.00 42.92 44.36 3h5r s ASP 196 CO 0.87 -0.44 1.63 0.22 0.21 0.00 0.00 175.17 177.65 3h5r h TYR 197 N 3.94 -0.52 -1.69 4.23 3.20 -1.98 -1.14 116.97 123.01 3h5r h TYR 197 Ca -0.33 0.05 0.53 0.00 3.14 0.00 0.00 58.73 62.12 3h5r h TYR 197 Cb 1.18 0.30 -0.11 0.00 1.54 0.00 0.00 36.73 39.64 3h5r h TYR 197 CO 0.59 -0.29 1.17 1.15 -1.64 0.00 0.00 178.16 179.14 3h5r h THR 198 N -0.12 0.02 -0.67 1.81 2.02 -2.00 -0.36 112.91 113.61 3h5r h THR 198 Ca 0.21 -0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.51 3h5r h THR 198 Cb 0.44 0.01 -0.04 0.00 -1.74 0.00 0.00 68.15 66.83 3h5r h THR 198 CO -0.51 0.00 0.45 0.44 0.37 0.00 0.00 175.52 176.27 3h5r h ASP 199 N 0.01 0.37 -0.29 4.18 3.32 -1.61 -2.86 116.42 119.53 3h5r h ASP 199 Ca 0.91 0.01 0.07 0.00 0.02 0.00 0.00 57.03 58.04 3h5r h ASP 199 Cb 3.32 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 42.79 3h5r h ASP 199 CO -0.22 0.21 0.21 -0.07 -1.72 0.00 0.00 179.24 177.64 3h5r h LEU 200 N 0.40 0.09 -2.00 1.55 3.38 -1.23 -0.82 115.31 116.67 3h5r h LEU 200 Ca 0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.29 3h5r h LEU 200 Cb 0.69 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.42 3h5r h LEU 200 CO -0.09 0.06 0.10 0.45 0.09 0.00 0.00 178.44 179.04 3h5r h HIS 201 N 0.10 0.00 0.00 1.13 3.86 -1.72 -0.26 115.15 118.26 3h5r h HIS 201 Ca 0.14 0.00 -0.21 0.00 -1.16 0.00 0.00 60.37 59.13 3h5r h HIS 201 Cb 0.41 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.85 3h5r h HIS 201 CO -0.00 0.00 -1.23 0.87 0.86 0.00 0.00 177.93 178.43 3h5r h LYS 202 N 0.00 0.00 -6.27 2.45 6.56 -1.36 -3.43 116.57 114.51 3h5r h LYS 202 Ca 0.00 0.00 -0.57 0.00 -1.06 0.00 0.00 60.65 59.02 3h5r h LYS 202 Cb 0.19 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 31.83 3h5r h LYS 202 CO 0.00 0.63 1.17 0.08 -2.06 0.00 0.00 179.45 179.27 3h5r s VAL 203 N -2.75 3.59 0.79 0.50 1.01 -0.11 -4.98 120.40 118.44 3h5r s VAL 203 Ca -0.01 0.65 -0.12 0.00 0.00 0.00 0.00 61.98 62.50 3h5r s VAL 203 Cb 0.09 -3.61 0.07 0.00 0.00 0.00 0.00 36.38 32.93 3h5r s VAL 203 CO 0.81 -0.27 1.14 -2.16 0.00 0.00 0.00 175.10 174.62 3h5r s PRO 204 N 4.86 1.93 0.46 2.72 0.04 -1.26 -4.99 135.00 138.76 3h5r s PRO 204 Ca 0.75 1.46 -0.24 0.00 0.04 0.00 0.00 61.00 63.01 3h5r s PRO 204 Cb -0.26 -1.84 -0.07 0.00 0.04 0.00 0.00 34.50 32.37 3h5r s PRO 204 CO 0.31 -1.93 1.29 -2.00 0.04 0.00 0.00 177.00 174.71 3h5r s GLU 205 N -4.47 3.67 0.24 4.56 2.12 -1.26 -4.95 118.70 118.61 3h5r s GLU 205 Ca 0.67 2.10 -0.12 0.00 0.36 0.00 0.00 54.97 57.97 3h5r s GLU 205 Cb -0.22 -2.53 -0.01 0.00 0.26 0.00 0.00 34.13 31.64 3h5r s GLU 205 CO 0.52 -0.72 0.45 0.00 -0.54 0.00 0.00 175.26 174.97 3h5r s ALA 206 N -1.34 -0.14 0.25 6.30 0.00 -1.26 -5.01 121.76 120.56 3h5r s ALA 206 Ca 0.63 -0.93 -0.05 0.00 0.00 0.00 0.00 51.96 51.60 3h5r s ALA 206 Cb -0.37 1.09 0.28 0.00 0.00 0.00 0.00 23.12 24.12 3h5r s ALA 206 CO 0.45 -0.83 1.90 -0.44 0.00 0.00 0.00 175.76 176.85 3h5r h ASP 207 N 2.29 1.10 -5.00 0.00 3.32 -1.53 -3.44 116.42 113.16 3h5r h ASP 207 Ca -0.27 -0.06 -0.09 0.00 0.02 0.00 0.00 57.03 56.63 3h5r h ASP 207 Cb 1.25 -0.28 -0.19 0.00 0.22 0.00 0.00 39.33 40.33 3h5r h ASP 207 CO 0.37 0.84 -0.06 -0.51 -1.72 0.00 0.00 179.24 178.15 3h5r s ILE 208 N -5.94 0.03 -0.21 0.35 2.07 -1.21 -4.33 121.20 111.97 3h5r s ILE 208 Ca -0.12 -0.28 -0.07 0.00 -1.41 0.00 0.00 60.65 58.76 3h5r s ILE 208 Cb 0.17 -0.82 -0.04 0.00 0.13 0.00 0.00 42.46 41.91 3h5r s ILE 208 CO 0.82 -0.16 0.07 0.26 -1.91 0.00 0.00 174.94 174.02 3h5r s TRP 209 N -1.48 3.19 -0.24 3.50 0.52 -0.61 -0.75 118.94 123.06 3h5r s TRP 209 Ca -0.11 -0.08 -0.13 0.00 0.02 0.00 0.00 56.10 55.79 3h5r s TRP 209 Cb -0.02 -2.14 -0.04 0.00 -1.15 0.00 0.00 33.47 30.11 3h5r s TRP 209 CO 0.05 -0.03 0.29 0.08 0.02 0.00 0.00 176.95 177.36 3h5r s VAL 210 N 0.84 5.25 -0.38 4.03 1.01 0.18 -0.55 120.40 130.78 3h5r s VAL 210 Ca 0.04 0.44 -0.02 0.00 0.00 0.00 0.00 61.98 62.44 3h5r s VAL 210 Cb -0.14 -3.63 0.10 0.00 0.00 0.00 0.00 36.38 32.72 3h5r s VAL 210 CO 0.02 0.25 0.15 -0.69 0.00 0.00 0.00 175.10 174.84 3h5r s VAL 211 N 1.53 3.12 -0.01 2.92 1.01 0.30 -0.44 120.40 128.82 3h5r s VAL 211 Ca 0.13 -1.99 0.02 0.00 0.00 0.00 0.00 61.98 60.14 3h5r s VAL 211 Cb -0.15 -3.10 -0.03 0.00 0.00 0.00 0.00 36.38 33.09 3h5r s VAL 211 CO 0.08 -0.59 0.03 -1.54 0.00 0.00 0.00 175.10 173.08 3h5r n SER 212 N 4.56 4.43 -4.67 3.32 3.41 -0.58 -2.81 113.62 121.27 3h5r n SER 212 Ca -0.03 0.00 -0.48 0.00 -0.26 0.00 0.00 58.87 58.10 3h5r n SER 212 Cb 0.42 0.80 -0.05 0.00 -0.26 0.00 0.00 64.21 65.13 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 -1.86 0.92 -1.54 7.33 0.00 -1.02 -4.83 120.51 119.50 3h5r n ALA 213 Ca -0.02 0.39 -0.27 0.00 0.00 0.00 0.00 53.44 53.54 3h5r n ALA 213 Cb 0.35 -2.37 0.09 0.00 0.00 0.00 0.00 19.45 17.51 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 4.59 5.84 -3.61 0.00 3.85 -1.26 -4.88 116.55 121.07 3h5r n ASP 214 Ca 0.20 -3.76 -0.22 0.00 -0.71 0.00 0.00 54.79 50.29 3h5r n ASP 214 Cb 0.27 -0.74 -0.16 0.00 -1.35 0.00 0.00 41.12 39.14 3h5r n ASP 214 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.20 175.19 3h5r s HIS 215 N -3.64 0.05 0.00 2.11 0.09 -1.26 -4.50 115.29 108.13 3h5r s HIS 215 Ca 0.58 0.02 0.00 0.00 -0.00 0.00 0.00 55.06 55.65 3h5r s HIS 215 Cb 0.47 -0.54 0.00 0.00 -0.00 0.00 0.00 32.58 32.51 3h5r s HIS 215 CO 0.02 -0.42 0.00 -0.35 -0.00 0.00 0.00 174.74 173.99 3h5r n PRO 216 N 5.30 1.73 -1.15 8.40 -0.04 -1.26 -4.67 135.00 143.31 3h5r n PRO 216 Ca -0.06 0.00 -0.26 0.00 -0.04 0.00 0.00 63.50 63.14 3h5r n PRO 216 Cb 0.49 0.00 0.10 0.00 -0.04 0.00 0.00 33.50 34.06 3h5r n PRO 216 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43 3h5r n PHE 217 N 0.00 2.72 -2.01 0.54 -1.74 -1.26 -4.10 117.46 111.61 3h5r n PHE 217 Ca 0.00 -2.32 -0.00 0.00 -0.56 0.00 0.00 57.45 54.56 3h5r n PHE 217 Cb 0.00 -1.14 -0.00 0.00 1.52 0.00 0.00 39.48 39.86 3h5r n PHE 217 CO 0.00 0.00 0.00 0.27 -0.56 0.00 0.00 176.76 176.47 3h5r n ASN 218 N -0.70 -0.04 -0.07 5.98 6.94 -1.26 -5.03 115.26 121.08 3h5r n ASN 218 Ca 0.53 -1.27 -0.13 0.00 -0.02 0.00 0.00 54.58 53.69 3h5r n ASN 218 Cb 0.97 -0.03 -0.06 0.00 -2.36 0.00 0.00 39.78 38.30 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 0.01 0.45 -1.67 -4.53 5.85 -1.92 -3.01 115.31 110.50 3h5r h LEU 219 Ca -0.03 -0.45 0.12 0.00 0.84 0.00 0.00 57.88 58.36 3h5r h LEU 219 Cb 1.12 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.98 3h5r h LEU 219 CO -0.01 0.80 0.43 -0.29 -0.34 0.00 0.00 178.44 179.03 3h5r h ILE 220 N 0.11 0.84 -0.35 4.05 6.09 -1.92 -0.50 117.51 125.83 3h5r h ILE 220 Ca 0.04 -0.12 -0.05 0.00 -1.37 0.00 0.00 64.86 63.36 3h5r h ILE 220 Cb 0.65 0.46 -0.01 0.00 0.47 0.00 0.00 36.82 38.39 3h5r h ILE 220 CO 0.04 0.06 0.03 0.78 -3.07 0.00 0.00 178.15 175.99 3h5r h ASN 221 N 0.35 0.58 -0.49 2.19 4.21 -1.96 0.32 115.58 120.78 3h5r h ASN 221 Ca 0.31 -0.28 0.01 0.00 1.21 0.00 0.00 56.30 57.55 3h5r h ASN 221 Cb 0.72 -0.15 -0.03 0.00 -1.12 0.00 0.00 38.32 37.74 3h5r h ASN 221 CO -0.08 0.72 0.31 -0.50 -1.29 0.00 0.00 177.43 176.59 3h5r h TRP 222 N 0.42 0.59 -0.31 1.19 6.55 -1.27 -2.24 115.95 120.87 3h5r h TRP 222 Ca 0.10 0.02 -0.05 0.00 0.95 0.00 0.00 58.89 59.90 3h5r h TRP 222 Cb 0.40 -0.19 -0.01 0.00 -0.86 0.00 0.00 29.16 28.50 3h5r h TRP 222 CO 0.03 0.36 -0.02 0.28 -1.05 0.00 0.00 178.44 178.04 3h5r h VAL 223 N 0.63 1.26 -0.13 1.49 2.07 -0.81 -1.90 116.25 118.86 3h5r h VAL 223 Ca 0.19 -0.99 0.05 0.00 0.82 0.00 0.00 66.70 66.76 3h5r h VAL 223 Cb -0.04 1.30 -0.06 0.00 -1.52 0.00 0.00 31.29 30.97 3h5r h VAL 223 CO -0.06 0.32 -0.28 -1.13 0.02 0.00 0.00 177.57 176.44 3h5r h ASN 224 N 0.34 -0.86 -0.63 0.57 -1.24 -0.31 -0.54 115.58 112.90 3h5r h ASN 224 Ca 0.08 0.13 0.03 0.00 0.71 0.00 0.00 56.30 57.26 3h5r h ASN 224 Cb 0.47 0.37 -0.04 0.00 0.73 0.00 0.00 38.32 39.85 3h5r h ASN 224 CO 0.02 -0.32 0.39 0.11 -1.29 0.00 0.00 177.43 176.34 3h5r h LYS 225 N -0.35 0.75 0.37 6.67 1.79 -1.32 -1.09 116.57 123.39 3h5r h LYS 225 Ca 0.10 -0.04 -0.02 0.00 -2.18 0.00 0.00 60.65 58.51 3h5r h LYS 225 Cb 0.50 -0.17 0.00 0.00 -1.58 0.00 0.00 32.23 30.99 3h5r h LYS 225 CO -0.33 0.49 -0.18 -0.92 -1.08 0.00 0.00 179.45 177.43 3h5r h TYR 226 N 0.77 -0.46 0.00 -1.35 3.20 -0.89 -2.56 116.97 115.67 3h5r h TYR 226 Ca 0.26 -0.01 -0.05 0.00 3.14 0.00 0.00 58.73 62.06 3h5r h TYR 226 Cb 0.02 0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.44 3h5r h TYR 226 CO -0.05 -0.24 -0.25 0.00 -1.64 0.00 0.00 178.16 175.98 3h5r h VAL 228 N 0.00 0.06 -0.49 0.00 2.07 -1.17 0.53 116.25 117.25 3h5r h VAL 228 Ca -0.00 -0.18 0.06 0.00 0.82 0.00 0.00 66.70 67.40 3h5r h VAL 228 Cb 0.46 0.07 -0.03 0.00 -1.52 0.00 0.00 31.29 30.28 3h5r h VAL 228 CO 0.03 0.01 0.33 0.03 0.02 0.00 0.00 177.57 177.98 3h5r h ARG 229 N -1.25 0.42 -0.64 1.57 -0.00 -1.23 -3.15 114.38 110.10 3h5r h ARG 229 Ca -0.11 -0.03 0.00 0.00 -0.50 0.00 0.00 59.98 59.34 3h5r h ARG 229 Cb 0.84 -0.10 0.00 0.00 0.00 0.00 0.00 29.97 30.71 3h5r h ARG 229 CO 0.18 0.28 0.00 0.00 0.00 0.00 0.00 179.97 180.43 3h5r n ALA 230 N -2.50 2.94 -4.34 0.04 0.00 0.24 -4.94 120.51 111.95 3h5r n ALA 230 Ca 0.06 -1.35 -0.38 0.00 0.00 0.00 0.00 53.44 51.77 3h5r n ALA 230 Cb 0.24 -1.02 -0.05 0.00 0.00 0.00 0.00 19.45 18.62 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 1.05 -2.49 -4.44 0.00 5.03 -1.06 -4.96 115.26 108.39 3h5r n ASN 231 Ca 0.23 -1.11 -0.41 0.00 0.87 0.00 0.00 54.58 54.16 3h5r n ASN 231 Cb 0.76 -2.31 -0.11 0.00 -1.02 0.00 0.00 39.78 37.11 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 -7.05 3.08 0.29 3.52 2.00 0.18 -4.78 119.66 116.90 3h5r s GLN 232 Ca 0.72 -0.92 -0.30 0.00 -2.00 0.00 0.00 55.36 52.86 3h5r s GLN 232 Cb -0.40 -3.78 -0.12 0.00 0.80 0.00 0.00 33.01 29.51 3h5r s GLN 232 CO 0.97 -0.61 1.52 -2.30 -0.50 0.00 0.00 175.29 174.36 3h5r n PRO 233 N 5.06 2.51 -4.13 1.67 -0.02 -1.26 -4.63 135.00 134.20 3h5r n PRO 233 Ca -0.12 0.89 -0.10 0.00 -2.02 0.00 0.00 63.50 62.15 3h5r n PRO 233 Cb 0.48 -2.62 -0.10 0.00 -0.02 0.00 0.00 33.50 31.23 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 -0.21 0.82 -0.02 6.00 1.13 -0.75 -1.57 117.35 122.74 3h5r s TYR 234 Ca 0.63 -1.19 0.02 0.00 -1.41 0.00 0.00 57.07 55.12 3h5r s TYR 234 Cb -0.53 -0.43 0.01 0.00 -1.10 0.00 0.00 41.96 39.90 3h5r s TYR 234 CO 0.51 -0.54 -0.05 -1.50 -2.51 0.00 0.00 175.55 171.46 3h5r s ILE 235 N -4.04 0.49 -0.00 -3.49 2.07 0.28 -0.11 121.20 116.40 3h5r s ILE 235 Ca 0.24 -0.19 -0.07 0.00 -1.41 0.00 0.00 60.65 59.22 3h5r s ILE 235 Cb 0.07 -0.47 -0.05 0.00 0.13 0.00 0.00 42.46 42.14 3h5r s ILE 235 CO 0.02 0.18 0.27 0.21 -1.91 0.00 0.00 174.94 173.71 3h5r s ASN 236 N 0.36 6.52 -0.21 4.50 3.04 -1.14 -0.54 114.94 127.47 3h5r s ASN 236 Ca -0.04 0.60 -0.17 0.00 0.04 0.00 0.00 52.86 53.28 3h5r s ASN 236 Cb -0.08 -2.10 0.06 0.00 -1.54 0.00 0.00 41.25 37.58 3h5r s ASN 236 CO -0.00 0.27 0.54 0.00 -3.04 0.00 0.00 177.10 174.87 3h5r s ALA 237 N -1.26 -1.36 0.00 1.71 0.00 -1.12 0.85 121.76 120.57 3h5r s ALA 237 Ca 0.26 1.65 0.00 0.00 0.00 0.00 0.00 51.96 53.87 3h5r s ALA 237 Cb -0.13 -0.97 0.00 0.00 0.00 0.00 0.00 23.12 22.02 3h5r s ALA 237 CO 0.15 -0.27 0.00 0.41 0.00 0.00 0.00 175.76 176.04 3h5r n GLY 238 N 3.22 2.44 3.39 0.00 0.00 0.02 -4.33 105.19 109.94 3h5r n GLY 238 Ca -0.16 -0.53 -0.15 0.00 0.00 0.00 0.00 46.02 45.18 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 -1.76 -0.46 -0.53 1.61 1.13 -1.26 -1.14 117.35 114.94 3h5r s TYR 239 Ca 0.00 0.90 -0.06 0.00 -1.41 0.00 0.00 57.07 56.50 3h5r s TYR 239 Cb 0.00 0.23 0.14 0.00 -1.10 0.00 0.00 41.96 41.23 3h5r s TYR 239 CO 0.00 -0.43 0.38 0.08 -2.51 0.00 0.00 175.55 173.07 3h5r s VAL 240 N -0.79 3.98 0.00 -3.49 1.01 -0.19 -4.95 120.40 115.97 3h5r s VAL 240 Ca -0.09 -2.25 0.00 0.00 0.00 0.00 0.00 61.98 59.65 3h5r s VAL 240 Cb -0.03 -3.62 0.00 0.00 0.00 0.00 0.00 36.38 32.73 3h5r s VAL 240 CO 0.05 -0.81 0.00 0.59 0.00 0.00 0.00 175.10 174.93 3h5r n ASN 241 N 4.35 0.00 -0.19 3.32 3.02 -1.26 -1.67 115.26 122.82 3h5r n ASN 241 Ca -0.00 0.00 0.06 0.00 -0.03 0.00 0.00 54.58 54.61 3h5r n ASN 241 Cb 0.41 0.00 0.29 0.00 -0.61 0.00 0.00 39.78 39.87 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 5.57 0.57 -4.47 6.41 5.75 -1.26 -4.74 116.55 124.38 3h5r n ASP 242 Ca 0.00 -1.74 -0.35 0.00 -0.01 0.00 0.00 54.79 52.69 3h5r n ASP 242 Cb 0.00 -0.05 -0.12 0.00 -1.03 0.00 0.00 41.12 39.92 3h5r n ASP 242 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 3h5r s ILE 243 N -1.89 4.17 0.12 2.12 1.01 -0.67 -3.01 121.20 123.05 3h5r s ILE 243 Ca 0.19 -0.23 -0.28 0.00 0.00 0.00 0.00 60.65 60.33 3h5r s ILE 243 Cb 0.10 -2.90 -0.07 0.00 0.01 0.00 0.00 42.46 39.59 3h5r s ILE 243 CO 0.15 0.41 0.88 0.00 0.00 0.00 0.00 174.94 176.37 3h5r s ALA 244 N 1.09 3.33 -0.05 9.38 0.00 0.43 -1.02 121.76 134.92 3h5r s ALA 244 Ca 0.03 0.47 0.03 0.00 0.00 0.00 0.00 51.96 52.49 3h5r s ALA 244 Cb -0.14 -3.14 0.01 0.00 0.00 0.00 0.00 23.12 19.84 3h5r s ALA 244 CO 0.02 0.09 -0.12 0.08 0.00 0.00 0.00 175.76 175.83 3h5r s VAL 245 N -0.40 1.11 0.04 0.00 1.01 -0.29 -0.77 120.40 121.10 3h5r s VAL 245 Ca 0.42 -0.50 -0.03 0.00 0.00 0.00 0.00 61.98 61.86 3h5r s VAL 245 Cb -0.23 -0.99 -0.02 0.00 0.00 0.00 0.00 36.38 35.14 3h5r s VAL 245 CO 0.28 0.34 0.05 0.72 0.00 0.00 0.00 175.10 176.48 3h5r s PHE 246 N 0.40 0.27 0.00 5.22 -0.71 -0.40 -0.80 117.98 121.96 3h5r s PHE 246 Ca -0.09 -0.61 0.00 0.00 -1.04 0.00 0.00 56.93 55.19 3h5r s PHE 246 Cb -0.13 -0.20 0.00 0.00 -1.21 0.00 0.00 43.02 41.48 3h5r s PHE 246 CO 0.02 -0.33 0.00 0.41 -1.34 0.00 0.00 175.22 173.99 3h5r n GLY 247 N 0.84 0.55 3.90 1.99 0.00 0.25 -0.16 105.19 112.56 3h5r n GLY 247 Ca -0.19 -1.70 -0.28 0.00 0.00 0.00 0.00 46.02 43.85 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 -3.29 3.23 -0.39 1.61 0.04 -1.14 -4.53 135.00 130.53 3h5r s PRO 248 Ca 0.00 0.25 -0.18 0.00 0.04 0.00 0.00 61.00 61.11 3h5r s PRO 248 Cb 0.00 -2.24 0.01 0.00 0.04 0.00 0.00 34.50 32.31 3h5r s PRO 248 CO 0.00 -0.56 0.51 -1.17 0.04 0.00 0.00 177.00 175.81 3h5r s LEU 249 N -4.99 4.52 -0.15 -3.56 2.96 0.11 -2.87 118.68 114.70 3h5r s LEU 249 Ca 0.53 -0.28 -0.15 0.00 -0.22 0.00 0.00 54.13 54.00 3h5r s LEU 249 Cb -0.11 -2.54 -0.04 0.00 0.50 0.00 0.00 46.19 44.00 3h5r s LEU 249 CO 0.47 -0.56 0.35 -0.47 -1.32 0.00 0.00 176.35 174.83 3h5r s TYR 250 N 2.38 3.48 -0.15 5.38 5.04 0.84 -4.24 117.35 130.09 3h5r s TYR 250 Ca 0.17 0.69 -0.01 0.00 -2.44 0.00 0.00 57.07 55.48 3h5r s TYR 250 Cb -0.16 -2.40 0.04 0.00 0.35 0.00 0.00 41.96 39.79 3h5r s TYR 250 CO 0.14 0.22 -0.05 0.08 -1.34 0.00 0.00 175.55 174.61 3h5r s VAL 251 N 0.49 1.00 -0.48 3.14 1.01 -1.26 -1.82 120.40 122.49 3h5r s VAL 251 Ca 0.19 -0.47 -0.46 0.00 0.00 0.00 0.00 61.98 61.25 3h5r s VAL 251 Cb -0.14 -1.15 -0.19 0.00 0.00 0.00 0.00 36.38 34.90 3h5r s VAL 251 CO 0.06 0.19 1.75 -2.65 0.00 0.00 0.00 175.10 174.44 3h5r n PRO 252 N 4.92 0.12 0.00 2.72 -0.01 -1.26 -1.13 135.00 140.36 3h5r n PRO 252 Ca -0.12 0.04 0.00 0.00 -0.01 0.00 0.00 63.50 63.42 3h5r n PRO 252 Cb 0.48 -1.57 0.00 0.00 -0.01 0.00 0.00 33.50 32.41 3h5r n PRO 252 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 3h5r n GLY 253 N 4.87 1.69 0.09 -1.23 0.00 -1.26 -4.73 105.19 104.62 3h5r n GLY 253 Ca 0.36 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.30 3h5r n GLY 253 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3h5r n LYS 254 N -1.93 0.67 -4.19 1.61 5.02 -0.28 -5.03 118.16 114.03 3h5r n LYS 254 Ca 0.00 0.07 -0.24 0.00 -2.02 0.00 0.00 58.31 56.12 3h5r n LYS 254 Cb 0.00 -1.60 -0.06 0.00 -0.02 0.00 0.00 35.03 33.34 3h5r n LYS 254 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 3h5r n THR 255 N -2.81 0.00 -2.04 -0.18 -2.24 -0.93 -4.98 114.28 101.10 3h5r n THR 255 Ca -0.27 -2.12 -0.28 0.00 -2.27 0.00 0.00 64.05 59.12 3h5r n THR 255 Cb 1.09 0.68 0.06 0.00 -2.10 0.00 0.00 70.33 70.07 3h5r n THR 255 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3h5r s GLY 256 N -3.28 1.62 0.44 3.38 0.00 -1.26 -4.69 107.32 103.54 3h5r s GLY 256 Ca 0.14 -0.64 0.06 0.00 0.00 0.00 0.00 44.72 44.28 3h5r s GLY 256 CO 0.10 -0.23 0.11 0.00 0.00 0.00 0.00 173.10 173.08 3h5r h TYR 258 N 1.47 0.00 -0.67 0.00 3.20 -1.95 -1.81 116.97 117.21 3h5r h TYR 258 Ca -0.43 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.44 3h5r h TYR 258 Cb 1.27 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.54 3h5r h TYR 258 CO 0.87 0.00 0.00 0.39 -1.64 0.00 0.00 178.16 177.78 3h5r n GLU 259 N -3.99 2.63 -0.08 1.82 4.71 -1.26 -4.46 120.64 120.02 3h5r n GLU 259 Ca 0.03 -2.53 -0.12 0.00 -0.01 0.00 0.00 57.16 54.53 3h5r n GLU 259 Cb 0.38 -1.55 -0.05 0.00 -1.01 0.00 0.00 31.44 29.21 3h5r n GLU 259 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3h5r s GLN 261 N -4.65 2.08 0.00 0.00 -1.52 -1.26 -4.66 119.66 109.65 3h5r s GLN 261 Ca -0.14 -1.80 0.00 0.00 -1.95 0.00 0.00 55.36 51.48 3h5r s GLN 261 Cb 0.07 -3.62 0.00 0.00 -0.22 0.00 0.00 33.01 29.24 3h5r s GLN 261 CO 0.76 -1.08 0.00 0.36 -0.25 0.00 0.00 175.29 175.08 3h5r n LYS 272 N 4.64 0.00 -0.08 2.91 0.00 -1.26 -5.14 118.16 119.23 3h5r n LYS 272 Ca -0.03 0.00 -0.23 0.00 -0.00 0.00 0.00 58.31 58.05 3h5r n LYS 272 Cb 0.41 0.00 -0.12 0.00 -0.00 0.00 0.00 35.03 35.32 3h5r n LYS 272 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 3h5r n GLU 273 N 0.00 0.65 0.17 -1.58 4.71 -1.26 -3.61 120.64 119.73 3h5r n GLU 273 Ca 0.00 0.33 0.05 0.00 -0.01 0.00 0.00 57.16 57.53 3h5r n GLU 273 Cb 0.00 -1.64 0.23 0.00 -1.01 0.00 0.00 31.44 29.02 3h5r n GLU 273 CO 0.00 0.00 0.00 -2.95 0.09 0.00 0.00 177.13 174.27 3h5r h ASN 274 N -0.47 0.00 0.08 1.62 -1.07 -2.06 -1.29 115.58 112.40 3h5r h ASN 274 Ca -0.49 0.00 -0.10 0.00 0.07 0.00 0.00 56.30 55.78 3h5r h ASN 274 Cb 1.72 0.00 -0.01 0.00 -2.07 0.00 0.00 38.32 37.95 3h5r h ASN 274 CO -0.14 0.40 -0.33 0.40 0.07 0.00 0.00 177.43 177.83 3h5r h ILE 275 N 0.00 1.28 -0.18 6.14 5.03 -2.01 -3.23 117.51 124.54 3h5r h ILE 275 Ca -0.00 -1.38 -0.21 0.00 -0.12 0.00 0.00 64.86 63.14 3h5r h ILE 275 Cb 1.08 1.52 0.01 0.00 -3.03 0.00 0.00 36.82 36.39 3h5r h ILE 275 CO 0.05 0.42 -0.72 -0.78 -0.68 0.00 0.00 178.15 176.45 3h5r h ASP 276 N 0.31 0.93 0.94 1.72 1.82 -1.32 -1.60 116.42 119.22 3h5r h ASP 276 Ca 0.04 -0.58 -0.11 0.00 -0.39 0.00 0.00 57.03 55.99 3h5r h ASP 276 Cb 0.74 -0.27 -0.02 0.00 0.68 0.00 0.00 39.33 40.46 3h5r h ASP 276 CO 0.06 1.38 -0.51 1.12 -1.61 0.00 0.00 179.24 179.67 3h5r h HIS 277 N 0.56 0.00 0.05 0.28 2.07 -1.54 -1.98 115.15 114.59 3h5r h HIS 277 Ca -0.04 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.48 3h5r h HIS 277 Cb 1.34 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.32 3h5r h HIS 277 CO 0.08 0.51 -0.02 0.87 -3.07 0.00 0.00 177.93 176.30 3h5r h LYS 278 N 0.00 -0.07 -0.28 5.12 1.57 -1.55 -1.62 116.57 119.75 3h5r h LYS 278 Ca -0.01 0.00 0.01 0.00 -1.87 0.00 0.00 60.65 58.79 3h5r h LYS 278 Cb 1.12 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 33.43 3h5r h LYS 278 CO 0.07 0.18 0.17 -0.84 -0.57 0.00 0.00 179.45 178.46 3h5r h ILE 279 N -0.31 1.05 -0.82 1.86 3.07 -1.30 -2.25 117.51 118.80 3h5r h ILE 279 Ca -0.01 -0.12 0.08 0.00 1.55 0.00 0.00 64.86 66.36 3h5r h ILE 279 Cb 0.28 0.66 -0.07 0.00 -0.27 0.00 0.00 36.82 37.42 3h5r h ILE 279 CO 0.01 0.06 0.48 0.11 -1.05 0.00 0.00 178.15 177.77 3h5r h LYS 280 N 0.35 0.82 -0.21 0.16 1.79 -1.30 -0.31 116.57 117.88 3h5r h LYS 280 Ca 0.11 -0.05 -0.02 0.00 -2.18 0.00 0.00 60.65 58.50 3h5r h LYS 280 Cb -0.02 -0.18 -0.01 0.00 -1.58 0.00 0.00 32.23 30.44 3h5r h LYS 280 CO -0.04 0.54 0.04 1.25 -1.08 0.00 0.00 179.45 180.16 3h5r h LEU 281 N 0.84 0.33 0.07 2.94 5.85 -1.19 -0.12 115.31 124.03 3h5r h LEU 281 Ca 0.38 -0.26 0.00 0.00 0.84 0.00 0.00 57.88 58.85 3h5r h LEU 281 Cb 0.28 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.22 3h5r h LEU 281 CO -0.22 0.50 -0.08 0.40 -0.34 0.00 0.00 178.44 178.71 3h5r h ILE 282 N 0.14 0.82 -0.00 4.05 2.04 -0.77 -2.47 117.51 121.32 3h5r h ILE 282 Ca 0.06 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.89 3h5r h ILE 282 Cb 0.31 0.82 -0.00 0.00 -0.74 0.00 0.00 36.82 37.21 3h5r h ILE 282 CO 0.00 0.00 -0.14 0.78 0.00 0.00 0.00 178.15 178.79 3h5r h ASN 283 N -0.17 0.00 0.22 1.72 2.35 -1.06 -0.76 115.58 117.89 3h5r h ASN 283 Ca 0.01 -0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.74 3h5r h ASN 283 Cb 0.17 -0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.54 3h5r h ASN 283 CO -0.03 0.14 -0.07 0.77 -1.65 0.00 0.00 177.43 176.60 3h5r h SER 284 N 0.00 0.00 0.21 5.81 4.64 -0.55 -2.41 113.55 121.25 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 0.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.34 3h5r h SER 284 CO 0.02 0.07 -0.24 0.54 -0.87 0.00 0.00 176.83 176.35 3h5r n ARG 285 N -3.69 0.92 -1.71 4.77 1.74 -0.30 -4.96 116.66 113.43 3h5r n ARG 285 Ca -0.02 -0.55 -0.43 0.00 -0.77 0.00 0.00 57.85 56.08 3h5r n ARG 285 Cb 0.17 -1.49 -0.03 0.00 -1.02 0.00 0.00 32.46 30.09 3h5r n ARG 285 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 3h5r n PHE 286 N -0.56 2.66 -4.69 -1.55 7.35 -0.91 -5.01 117.46 114.75 3h5r n PHE 286 Ca 0.13 0.06 -0.24 0.00 -0.76 0.00 0.00 57.45 56.64 3h5r n PHE 286 Cb 0.35 -2.66 -0.16 0.00 0.35 0.00 0.00 39.48 37.37 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 1.27 1.46 0.40 -4.13 1.02 -1.26 -5.11 119.74 113.39 3h5r s LYS 287 Ca 0.76 -0.51 -0.24 0.00 0.02 0.00 0.00 55.97 56.00 3h5r s LYS 287 Cb -0.53 -1.31 -0.09 0.00 -0.52 0.00 0.00 37.83 35.38 3h5r s LYS 287 CO 0.34 0.22 1.08 -1.25 -0.92 0.00 0.00 175.35 174.81 3h5r s PRO 288 N 0.03 4.11 -1.32 -1.68 0.04 -1.26 -4.92 135.00 129.99 3h5r s PRO 288 Ca -0.02 1.58 -0.13 0.00 0.04 0.00 0.00 61.00 62.47 3h5r s PRO 288 Cb -0.10 -2.55 -0.04 0.00 0.04 0.00 0.00 34.50 31.85 3h5r s PRO 288 CO 0.01 -0.21 2.37 0.00 0.04 0.00 0.00 177.00 179.22 3h5r n ALA 289 N -0.09 5.63 -1.74 8.56 0.00 -1.26 -4.98 120.51 126.63 3h5r n ALA 289 Ca 0.05 -3.43 -0.37 0.00 0.00 0.00 0.00 53.44 49.69 3h5r n ALA 289 Cb 0.49 -3.44 0.06 0.00 0.00 0.00 0.00 19.45 16.56 3h5r n ALA 289 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3h5r s THR 290 N 3.25 2.16 -0.29 0.00 -4.23 -1.26 -4.43 115.64 110.83 3h5r s THR 290 Ca 0.54 0.10 0.01 0.00 -1.18 0.00 0.00 61.69 61.17 3h5r s THR 290 Cb 0.15 -3.04 0.18 0.00 1.34 0.00 0.00 72.50 71.13 3h5r s THR 290 CO -0.04 -0.02 0.54 0.12 -0.54 0.00 0.00 174.62 174.69 3h5r s PHE 291 N -1.41 -1.51 0.27 3.99 5.36 -1.26 -5.07 117.98 118.36 3h5r s PHE 291 Ca 0.79 1.26 -0.05 0.00 -0.96 0.00 0.00 56.93 57.97 3h5r s PHE 291 Cb -0.37 0.34 0.53 0.00 -0.34 0.00 0.00 43.02 43.18 3h5r s PHE 291 CO 0.40 -0.93 1.59 0.00 -1.46 0.00 0.00 175.22 174.82 3h5r h ALA 292 N 8.04 0.85 -0.78 11.12 0.00 -1.95 0.12 119.26 136.66 3h5r h ALA 292 Ca -0.14 0.31 0.12 0.00 0.00 0.00 0.00 54.91 55.20 3h5r h ALA 292 Cb 1.16 0.57 -0.08 0.00 0.00 0.00 0.00 17.79 19.44 3h5r h ALA 292 CO 0.23 -0.46 0.39 -1.35 0.00 0.00 0.00 179.25 178.06 3h5r h PRO 293 N 0.04 0.59 0.38 0.00 0.11 -1.97 0.31 132.00 131.46 3h5r h PRO 293 Ca 0.48 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.54 3h5r h PRO 293 Cb 0.87 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 31.84 3h5r h PRO 293 CO -0.85 0.39 -0.22 0.28 -0.21 0.00 0.00 178.00 177.40 3h5r h VAL 294 N 0.61 0.55 -0.92 3.15 2.07 -1.18 -1.66 116.25 118.86 3h5r h VAL 294 Ca 0.40 0.00 0.26 0.00 0.82 0.00 0.00 66.70 68.18 3h5r h VAL 294 Cb 0.50 0.55 -0.16 0.00 -1.52 0.00 0.00 31.29 30.66 3h5r h VAL 294 CO -0.32 0.00 0.17 -1.13 0.02 0.00 0.00 177.57 176.31 3h5r h ASN 295 N -0.57 -0.18 0.30 0.57 -1.24 -0.69 -2.67 115.58 111.11 3h5r h ASN 295 Ca -0.04 0.23 -0.25 0.00 0.71 0.00 0.00 56.30 56.95 3h5r h ASN 295 Cb 0.46 0.36 0.01 0.00 0.73 0.00 0.00 38.32 39.87 3h5r h ASN 295 CO 0.06 -0.26 -1.04 0.78 -1.29 0.00 0.00 177.43 175.68 3h5r h ASN 296 N 0.10 0.62 0.65 1.15 4.21 0.11 -2.42 115.58 120.01 3h5r h ASN 296 Ca 0.59 -0.53 -0.03 0.00 1.21 0.00 0.00 56.30 57.54 3h5r h ASN 296 Cb 1.24 -0.19 0.01 0.00 -1.12 0.00 0.00 38.32 38.26 3h5r h ASN 296 CO -0.77 1.34 -0.31 0.58 -1.29 0.00 0.00 177.43 176.98 3h5r h VAL 297 N 0.24 0.36 -0.43 2.81 2.07 -1.12 0.64 116.25 120.82 3h5r h VAL 297 Ca -0.11 -0.01 0.09 0.00 0.82 0.00 0.00 66.70 67.49 3h5r h VAL 297 Cb 1.69 0.36 -0.08 0.00 -1.52 0.00 0.00 31.29 31.74 3h5r h VAL 297 CO 0.18 0.00 -0.13 0.00 0.02 0.00 0.00 177.57 177.65 3h5r h ALA 298 N -0.53 0.25 -0.87 1.67 0.00 -1.54 -2.16 119.26 116.09 3h5r h ALA 298 Ca -0.09 0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 3h5r h ALA 298 Cb 0.67 0.37 -0.04 0.00 0.00 0.00 0.00 17.79 18.79 3h5r h ALA 298 CO 0.15 -0.47 0.52 0.00 0.00 0.00 0.00 179.25 179.45 3h5r h ALA 299 N 1.38 1.10 -0.38 0.00 0.00 -1.33 -1.72 119.26 118.31 3h5r h ALA 299 Ca 0.21 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 3h5r h ALA 299 Cb 0.35 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3h5r h ALA 299 CO -0.46 0.56 0.12 0.00 0.00 0.00 0.00 179.25 179.47 3h5r h ALA 300 N 1.28 0.49 -0.12 0.00 0.00 -0.32 -0.57 119.26 120.02 3h5r h ALA 300 Ca 0.31 -0.16 -0.18 0.00 0.00 0.00 0.00 54.91 54.88 3h5r h ALA 300 Cb -0.05 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 3h5r h ALA 300 CO -0.06 0.13 -0.68 -0.07 0.00 0.00 0.00 179.25 178.58 3h5r h LEU 301 N 0.46 0.59 -0.02 0.00 3.38 -1.30 -1.35 115.31 117.07 3h5r h LEU 301 Ca 0.12 -0.36 0.02 0.00 0.09 0.00 0.00 57.88 57.75 3h5r h LEU 301 Cb 0.25 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 3h5r h LEU 301 CO -0.00 1.10 -0.07 0.00 0.09 0.00 0.00 178.44 179.55 3h5r h ALA 303 N 0.89 0.79 -0.51 0.00 0.00 -0.80 -0.46 119.26 119.17 3h5r h ALA 303 Ca 0.04 0.07 0.06 0.00 0.00 0.00 0.00 54.91 55.08 3h5r h ALA 303 Cb 0.16 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.92 3h5r h ALA 303 CO -0.09 -0.16 0.21 0.00 0.00 0.00 0.00 179.25 179.22 3h5r h ALA 304 N 1.40 0.64 -0.66 0.00 0.00 -1.07 -0.19 119.26 119.37 3h5r h ALA 304 Ca 0.30 0.05 -0.07 0.00 0.00 0.00 0.00 54.91 55.19 3h5r h ALA 304 Cb 0.34 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 3h5r h ALA 304 CO -0.28 -0.17 0.14 -0.44 0.00 0.00 0.00 179.25 178.50 3h5r h ASP 305 N 0.41 1.01 -0.30 0.00 5.19 -0.62 0.09 116.42 122.19 3h5r h ASP 305 Ca 0.24 -0.22 -0.00 0.00 -0.62 0.00 0.00 57.03 56.43 3h5r h ASP 305 Cb 0.22 -0.27 -0.01 0.00 0.18 0.00 0.00 39.33 39.45 3h5r h ASP 305 CO -0.22 0.98 0.18 0.58 -3.12 0.00 0.00 179.24 177.65 3h5r h VAL 306 N 1.00 1.11 -0.68 -1.35 2.07 -0.66 0.19 116.25 117.94 3h5r h VAL 306 Ca 0.21 -0.27 -0.00 0.00 0.82 0.00 0.00 66.70 67.45 3h5r h VAL 306 Cb 0.39 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 30.87 3h5r h VAL 306 CO 0.01 0.11 0.41 0.40 0.02 0.00 0.00 177.57 178.52 3h5r h ILE 307 N 0.39 1.19 -0.25 4.57 2.04 -0.78 -1.48 117.51 123.19 3h5r h ILE 307 Ca 0.11 -0.42 -0.04 0.00 1.00 0.00 0.00 64.86 65.52 3h5r h ILE 307 Cb 0.02 0.25 -0.01 0.00 -0.74 0.00 0.00 36.82 36.34 3h5r h ILE 307 CO -0.02 0.20 0.02 0.11 0.00 0.00 0.00 178.15 178.46 3h5r h LYS 308 N 0.92 0.43 -0.02 2.37 1.57 -0.76 0.16 116.57 121.25 3h5r h LYS 308 Ca 0.24 -0.13 0.03 0.00 -1.87 0.00 0.00 60.65 58.92 3h5r h LYS 308 Cb -0.04 -0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.19 3h5r h LYS 308 CO -0.05 0.58 -0.18 0.35 -0.57 0.00 0.00 179.45 179.58 3h5r h PHE 309 N 0.22 -0.48 0.00 -1.35 3.57 -0.30 0.28 116.94 118.88 3h5r h PHE 309 Ca 0.07 0.02 -0.17 0.00 3.53 0.00 0.00 57.97 61.42 3h5r h PHE 309 Cb 0.38 0.21 -0.02 0.00 2.79 0.00 0.00 35.95 39.31 3h5r h PHE 309 CO 0.03 -0.26 -0.79 -0.84 -2.23 0.00 0.00 178.31 174.22 3h5r h ILE 310 N -0.29 1.46 0.00 1.41 -0.00 -1.29 -3.25 117.51 115.55 3h5r h ILE 310 Ca 0.06 -2.79 -0.13 0.00 -0.00 0.00 0.00 64.86 62.00 3h5r h ILE 310 Cb 0.37 2.55 -0.02 0.00 -0.00 0.00 0.00 36.82 39.72 3h5r h ILE 310 CO -0.18 0.77 -0.62 1.23 -0.00 0.00 0.00 178.15 179.34 3h5r h GLY 311 N 2.75 0.00 0.00 0.16 0.00 -0.53 -3.43 103.07 102.01 3h5r h GLY 311 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.32 3h5r h GLY 311 CO 0.10 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.92 3h5r n LYS 312 N -3.43 -0.89 0.09 4.80 5.02 0.98 -4.74 118.16 120.00 3h5r n LYS 312 Ca 0.00 0.22 0.12 0.00 -2.02 0.00 0.00 58.31 56.63 3h5r n LYS 312 Cb 0.71 -3.89 0.04 0.00 -0.02 0.00 0.00 35.03 31.88 3h5r n LYS 312 CO 0.00 0.00 0.00 0.10 -0.52 0.00 0.00 177.40 176.98 3h5r h TYR 313 N 0.00 0.00 -3.19 2.13 -0.00 -1.90 -3.47 116.97 110.54 3h5r h TYR 313 Ca 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 58.73 58.66 3h5r h TYR 313 Cb 0.44 0.00 -0.15 0.00 -0.00 0.00 0.00 36.73 37.02 3h5r h TYR 313 CO 0.28 0.00 -0.10 0.45 -0.00 0.00 0.00 178.16 178.79 3h5r s SER 314 N -5.07 -0.25 -0.00 0.10 0.15 -1.26 -4.86 113.70 102.50 3h5r s SER 314 Ca 0.01 -0.14 -0.30 0.00 0.70 0.00 0.00 55.95 56.22 3h5r s SER 314 Cb 0.10 0.44 -0.04 0.00 -1.71 0.00 0.00 66.02 64.81 3h5r s SER 314 CO 0.77 -0.74 1.14 -0.70 1.20 0.00 0.00 173.24 174.92 3h5r s GLU 315 N -3.02 4.43 0.40 5.44 2.12 -1.26 -4.62 118.70 122.19 3h5r s GLU 315 Ca -0.02 1.64 -0.27 0.00 0.36 0.00 0.00 54.97 56.68 3h5r s GLU 315 Cb 0.00 -3.46 -0.10 0.00 0.26 0.00 0.00 34.13 30.83 3h5r s GLU 315 CO -0.06 -0.29 1.43 -2.30 -0.54 0.00 0.00 175.26 173.50 3h5r n PRO 316 N 4.45 2.43 -0.13 4.30 -0.02 -1.26 -4.92 135.00 139.86 3h5r n PRO 316 Ca 0.09 0.86 -0.04 0.00 -2.02 0.00 0.00 63.50 62.39 3h5r n PRO 316 Cb 0.47 -2.60 0.16 0.00 -0.02 0.00 0.00 33.50 31.51 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 2.64 0.79 -3.02 2.45 3.38 -1.94 -3.24 115.31 116.37 3h5r h LEU 317 Ca -0.50 -0.17 -0.05 0.00 0.09 0.00 0.00 57.88 57.24 3h5r h LEU 317 Cb 1.26 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.77 3h5r h LEU 317 CO 0.63 0.82 0.07 -1.54 0.09 0.00 0.00 178.44 178.50 3h5r n SER 318 N -4.23 4.48 -4.70 -0.43 3.41 -1.26 -4.78 113.62 106.11 3h5r n SER 318 Ca 0.03 -2.78 -0.42 0.00 -0.26 0.00 0.00 58.87 55.44 3h5r n SER 318 Cb 0.28 -0.66 -0.03 0.00 -0.26 0.00 0.00 64.21 63.54 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 -2.15 4.37 -0.40 1.04 1.43 -1.22 -0.71 118.68 121.03 3h5r s LEU 319 Ca 0.42 2.62 0.00 0.00 -1.03 0.00 0.00 54.13 56.14 3h5r s LEU 319 Cb 0.32 -3.58 0.00 0.00 0.03 0.00 0.00 46.19 42.97 3h5r s LEU 319 CO 0.12 -0.90 0.00 0.59 0.23 0.00 0.00 176.35 176.38 3h5r n ASN 320 N 4.98 -5.49 -3.95 2.29 3.02 -1.26 -4.93 115.26 109.93 3h5r n ASN 320 Ca 0.16 0.09 -0.13 0.00 -0.03 0.00 0.00 54.58 54.67 3h5r n ASN 320 Cb 0.39 -3.32 -0.13 0.00 -0.61 0.00 0.00 39.78 36.10 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 -2.10 0.28 -0.29 3.52 1.02 -1.02 -0.20 119.74 120.94 3h5r s LYS 321 Ca 0.00 -0.25 -0.05 0.00 0.02 0.00 0.00 55.97 55.69 3h5r s LYS 321 Cb 0.00 -0.19 0.02 0.00 -0.52 0.00 0.00 37.83 37.14 3h5r s LYS 321 CO 0.00 0.05 0.04 0.50 -0.92 0.00 0.00 175.35 175.02 3h5r s ARG 322 N -0.44 2.90 -0.21 1.68 3.52 -0.89 -2.89 118.95 122.62 3h5r s ARG 322 Ca -0.03 -0.97 -0.06 0.00 -0.13 0.00 0.00 55.73 54.54 3h5r s ARG 322 Cb -0.03 -3.27 -0.03 0.00 -1.56 0.00 0.00 34.95 30.05 3h5r s ARG 322 CO -0.00 -0.48 0.03 0.42 -0.81 0.00 0.00 175.30 174.46 3h5r s ILE 323 N 1.42 4.27 -0.10 4.11 1.01 0.77 -0.89 121.20 131.79 3h5r s ILE 323 Ca 0.01 -0.20 -0.05 0.00 0.00 0.00 0.00 60.65 60.40 3h5r s ILE 323 Cb -0.18 -2.94 -0.04 0.00 0.01 0.00 0.00 42.46 39.31 3h5r s ILE 323 CO 0.01 0.41 0.10 -0.83 0.00 0.00 0.00 174.94 174.63 3h5r s GLY 324 N 0.97 2.07 -0.15 6.18 0.00 0.67 -1.28 107.32 115.79 3h5r s GLY 324 Ca 0.03 -0.70 0.01 0.00 0.00 0.00 0.00 44.72 44.06 3h5r s GLY 324 CO 0.02 -0.46 -0.18 -0.42 0.00 0.00 0.00 173.10 172.06 3h5r s ILE 325 N -1.01 1.83 0.50 0.90 1.09 0.05 -1.34 121.20 123.23 3h5r s ILE 325 Ca 0.15 -0.82 -0.10 0.00 -1.10 0.00 0.00 60.65 58.78 3h5r s ILE 325 Cb -0.12 -1.66 -0.05 0.00 -1.06 0.00 0.00 42.46 39.57 3h5r s ILE 325 CO 0.05 0.50 0.89 0.26 -0.10 0.00 0.00 174.94 176.54 3h5r s TRP 326 N 1.12 3.54 0.00 3.97 0.51 -0.25 -0.43 118.94 127.41 3h5r s TRP 326 Ca -0.01 1.13 0.00 0.00 -2.12 0.00 0.00 56.10 55.10 3h5r s TRP 326 Cb -0.14 -2.55 0.00 0.00 -0.81 0.00 0.00 33.47 29.97 3h5r s TRP 326 CO -0.07 -0.36 0.00 -1.13 -0.51 0.00 0.00 176.95 174.88 3h5r n SER 327 N -2.01 4.77 -0.20 2.95 3.41 -1.16 -4.56 113.62 116.82 3h5r n SER 327 Ca 0.04 0.00 0.14 0.00 -0.26 0.00 0.00 58.87 58.78 3h5r n SER 327 Cb 0.54 0.87 0.49 0.00 -0.26 0.00 0.00 64.21 65.85 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 -1.52 0.80 -3.83 4.04 5.75 -1.26 -4.91 116.55 115.62 3h5r n ASP 328 Ca 0.00 -0.78 -0.10 0.00 -0.01 0.00 0.00 54.79 53.90 3h5r n ASP 328 Cb 0.09 0.04 -0.05 0.00 -1.03 0.00 0.00 41.12 40.16 3h5r n ASP 328 CO 0.00 0.00 0.00 -1.83 -0.11 0.00 0.00 177.20 175.26 3h5r s GLU 329 N -2.46 1.20 -0.66 0.11 -1.05 -1.26 -5.11 118.70 109.47 3h5r s GLU 329 Ca 0.27 -0.98 -0.26 0.00 -0.15 0.00 0.00 54.97 53.85 3h5r s GLU 329 Cb 0.20 0.44 0.04 0.00 -0.44 0.00 0.00 34.13 34.37 3h5r s GLU 329 CO 0.49 -0.47 1.14 0.42 0.95 0.00 0.00 175.26 177.79 3h5r s ILE 330 N -3.90 4.02 -0.29 1.83 1.01 -1.26 -4.54 121.20 118.06 3h5r s ILE 330 Ca 0.11 0.30 -0.13 0.00 0.00 0.00 0.00 60.65 60.93 3h5r s ILE 330 Cb 0.02 -4.77 0.13 0.00 0.01 0.00 0.00 42.46 37.85 3h5r s ILE 330 CO -0.03 -1.55 0.79 -0.75 0.00 0.00 0.00 174.94 173.40 3h5r s LYS 331 N 4.91 0.51 -0.03 2.79 2.20 -1.26 -5.04 119.74 123.82 3h5r s LYS 331 Ca 0.33 1.11 0.04 0.00 -0.36 0.00 0.00 55.97 57.08 3h5r s LYS 331 Cb -0.11 0.49 -0.03 0.00 -1.51 0.00 0.00 37.83 36.67 3h5r s LYS 331 CO 0.17 -0.15 -0.11 0.42 -0.36 0.00 0.00 175.35 175.31 3h5r s ILE 332 N 2.28 3.30 -0.05 5.43 1.01 -1.26 -1.09 121.20 130.82 3h5r s ILE 332 Ca -0.06 -0.76 -0.03 0.00 0.00 0.00 0.00 60.65 59.79 3h5r s ILE 332 Cb -0.08 -2.36 0.02 0.00 0.01 0.00 0.00 42.46 40.06 3h5r s ILE 332 CO -0.18 0.50 0.12 -2.28 0.00 0.00 0.00 174.94 173.10 3h5r s HIS 333 N -0.85 -0.12 -0.10 3.97 5.65 -0.45 -5.00 115.29 118.39 3h5r s HIS 333 Ca 0.14 0.36 -0.00 0.00 0.25 0.00 0.00 55.06 55.80 3h5r s HIS 333 Cb -0.11 -0.04 -0.03 0.00 -1.18 0.00 0.00 32.58 31.23 3h5r s HIS 333 CO 0.03 -0.11 -0.08 -1.54 -0.65 0.00 0.00 174.74 172.40 3h5r s SER 334 N 0.63 4.51 -0.07 9.88 1.04 -1.26 -0.24 113.70 128.19 3h5r s SER 334 Ca -0.05 -0.13 -0.18 0.00 0.48 0.00 0.00 55.95 56.08 3h5r s SER 334 Cb -0.06 -1.40 -0.05 0.00 0.10 0.00 0.00 66.02 64.61 3h5r s SER 334 CO -0.03 0.27 0.49 -1.10 0.98 0.00 0.00 173.24 173.85 3h5r s GLN 335 N -0.25 4.25 0.08 4.02 -0.21 -0.07 -4.93 119.66 122.54 3h5r s GLN 335 Ca 0.03 0.50 -0.32 0.00 0.02 0.00 0.00 55.36 55.59 3h5r s GLN 335 Cb -0.13 -3.37 -0.11 0.00 1.00 0.00 0.00 33.01 30.40 3h5r s GLN 335 CO 0.03 0.32 1.84 -1.71 -2.12 0.00 0.00 175.29 173.64 3h5r n ASN 336 N 3.07 3.85 -2.69 5.90 4.05 -1.26 -2.09 115.26 126.09 3h5r n ASN 336 Ca -0.08 0.98 -0.04 0.00 0.45 0.00 0.00 54.58 55.88 3h5r n ASN 336 Cb 0.52 -1.50 0.04 0.00 1.23 0.00 0.00 39.78 40.07 3h5r n ASN 336 CO 0.00 0.00 0.00 0.23 -3.05 0.00 0.00 177.26 174.44 3h5r n MET 337 N 5.84 2.06 -1.52 1.20 0.00 0.72 -4.78 117.12 120.63 3h5r n MET 337 Ca 0.19 -3.63 -0.31 0.00 0.00 0.00 0.00 57.70 53.96 3h5r n MET 337 Cb 0.35 -1.73 0.06 0.00 0.00 0.00 0.00 33.22 31.91 3h5r n MET 337 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 3h5r s GLY 338 N -3.76 1.66 0.28 3.03 0.00 -1.20 -4.14 107.32 103.19 3h5r s GLY 338 Ca 0.31 0.07 -0.30 0.00 0.00 0.00 0.00 44.72 44.81 3h5r s GLY 338 CO -0.03 0.40 1.47 -2.13 0.00 0.00 0.00 173.10 172.81 3h5r n ARG 339 N -3.23 2.34 -3.81 2.90 0.63 -1.26 -4.67 116.66 109.56 3h5r n ARG 339 Ca 0.08 0.83 -0.36 0.00 -0.92 0.00 0.00 57.85 57.48 3h5r n ARG 339 Cb 0.54 -2.53 -0.11 0.00 0.45 0.00 0.00 32.46 30.81 3h5r n ARG 339 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 3h5r s SER 340 N 0.25 5.46 0.37 6.15 0.15 -1.26 -4.97 113.70 119.84 3h5r s SER 340 Ca 0.64 -0.08 0.13 0.00 0.70 0.00 0.00 55.95 57.34 3h5r s SER 340 Cb -0.57 -1.97 0.94 0.00 -1.71 0.00 0.00 66.02 62.70 3h5r s SER 340 CO 0.52 0.03 1.82 1.55 1.20 0.00 0.00 173.24 178.36 3h5r h PRO 341 N 7.77 0.55 -0.42 5.44 0.13 -1.93 -3.11 132.00 140.43 3h5r h PRO 341 Ca -0.37 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 3h5r h PRO 341 Cb 1.18 -0.12 0.00 0.00 0.13 0.00 0.00 31.00 32.18 3h5r h PRO 341 CO 0.61 0.36 0.00 1.55 -0.23 0.00 0.00 178.00 180.29 3h5r n VAL 342 N -4.61 1.41 -1.68 1.56 3.14 -1.26 -4.88 118.33 112.01 3h5r n VAL 342 Ca 0.21 -1.22 -0.42 0.00 -2.96 0.00 0.00 64.34 59.95 3h5r n VAL 342 Cb 0.65 0.28 -0.00 0.00 -1.06 0.00 0.00 33.84 33.70 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 2.25 0.27 0.17 0.00 0.02 -1.94 -3.38 113.55 110.94 3h5r h SER 344 Ca -0.46 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.49 3h5r h SER 344 Cb 1.30 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.79 3h5r h SER 344 CO 0.61 0.20 -0.08 0.58 -1.14 0.00 0.00 176.83 177.00 3h5r h VAL 345 N 0.35 0.24 -3.50 2.27 2.07 -1.91 -3.45 116.25 112.33 3h5r h VAL 345 Ca 0.12 -0.97 -0.68 0.00 0.82 0.00 0.00 66.70 65.99 3h5r h VAL 345 Cb 0.01 0.43 -0.16 0.00 -1.52 0.00 0.00 31.29 30.04 3h5r h VAL 345 CO -0.06 0.07 -0.66 0.00 0.02 0.00 0.00 177.57 176.94