#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u7g s VAL 4 N 0.00 1.68 0.31 0.00 1.01 -1.26 -4.72 120.40 117.42 1u7g s VAL 4 Ca 0.00 -1.20 -0.27 0.00 0.00 0.00 0.00 61.98 60.51 1u7g s VAL 4 Cb 0.00 -1.46 -0.09 0.00 0.00 0.00 0.00 36.38 34.83 1u7g s VAL 4 CO 0.00 0.21 1.01 0.00 0.00 0.00 0.00 175.10 176.32 1u7g s ALA 5 N -0.80 3.26 -0.28 5.51 0.00 -1.26 -4.76 121.76 123.43 1u7g s ALA 5 Ca 0.08 0.69 -0.15 0.00 0.00 0.00 0.00 51.96 52.57 1u7g s ALA 5 Cb -0.09 -3.25 -0.03 0.00 0.00 0.00 0.00 23.12 19.75 1u7g s ALA 5 CO 0.02 0.00 0.38 0.34 0.00 0.00 0.00 175.76 176.50 1u7g s ASP 6 N -1.31 6.25 0.44 0.00 3.68 0.24 -4.96 116.67 121.01 1u7g s ASP 6 Ca 0.48 0.23 0.13 0.00 2.13 0.00 0.00 52.55 55.53 1u7g s ASP 6 Cb -0.25 -2.21 0.97 0.00 -1.45 0.00 0.00 42.92 39.98 1u7g s ASP 6 CO 0.31 -0.21 1.99 0.11 0.13 0.00 0.00 175.17 177.49 1u7g h LYS 7 N 8.21 0.06 -0.62 4.34 1.57 -1.95 0.16 116.57 128.34 1u7g h LYS 7 Ca -0.31 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.46 1u7g h LYS 7 Cb 1.16 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 33.43 1u7g h LYS 7 CO 0.65 0.22 0.39 0.00 -0.57 0.00 0.00 179.45 180.14 1u7g h ALA 8 N 1.79 0.79 -0.38 3.86 0.00 -1.94 0.12 119.26 123.50 1u7g h ALA 8 Ca 0.01 -0.06 -0.16 0.00 0.00 0.00 0.00 54.91 54.70 1u7g h ALA 8 Cb 0.31 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1u7g h ALA 8 CO 0.02 0.25 -0.40 -0.44 0.00 0.00 0.00 179.25 178.68 1u7g h ASP 9 N 0.84 1.00 -0.36 0.00 3.32 -1.58 0.48 116.42 120.13 1u7g h ASP 9 Ca 0.23 -0.46 0.05 0.00 0.02 0.00 0.00 57.03 56.87 1u7g h ASP 9 Cb -0.06 -0.28 -0.05 0.00 0.22 0.00 0.00 39.33 39.16 1u7g h ASP 9 CO -0.05 1.26 0.06 0.78 -1.72 0.00 0.00 179.24 179.58 1u7g h ASN 10 N 0.76 -0.00 0.20 6.45 2.35 -0.35 -2.84 115.58 122.14 1u7g h ASN 10 Ca 0.06 0.06 -0.01 0.00 -0.55 0.00 0.00 56.30 55.86 1u7g h ASN 10 Cb 0.99 0.09 0.00 0.00 0.05 0.00 0.00 38.32 39.45 1u7g h ASN 10 CO 0.10 0.03 -0.10 0.00 -1.65 0.00 0.00 177.43 175.82 1u7g h ALA 11 N 1.27 -0.27 0.00 -0.83 0.00 -0.58 -3.41 119.26 115.44 1u7g h ALA 11 Ca 0.17 -0.06 -0.21 0.00 0.00 0.00 0.00 54.91 54.81 1u7g h ALA 11 Cb 0.20 0.10 0.05 0.00 0.00 0.00 0.00 17.79 18.15 1u7g h ALA 11 CO -0.23 -0.65 0.83 0.34 0.00 0.00 0.00 179.25 179.54 1u7g n PHE 12 N -5.20 0.00 0.00 0.00 7.35 0.14 -4.57 117.46 115.18 1u7g n PHE 12 Ca -0.09 -0.28 0.00 0.00 -0.76 0.00 0.00 57.45 56.32 1u7g n PHE 12 Cb 0.13 -0.54 0.00 0.00 0.35 0.00 0.00 39.48 39.42 1u7g n PHE 12 CO 0.00 0.00 0.00 -0.89 -0.76 0.00 0.00 176.76 175.11 1u7g n ILE 15 N 4.89 0.00 -0.22 -2.13 5.41 -1.26 -4.57 119.36 121.48 1u7g n ILE 15 Ca 0.17 0.00 -0.02 0.00 1.00 0.00 0.00 62.75 63.90 1u7g n ILE 15 Cb 0.22 0.00 0.17 0.00 -0.71 0.00 0.00 39.64 39.32 1u7g n ILE 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1u7g h THR 17 N 1.02 1.25 -0.81 0.00 2.02 -1.87 0.80 112.91 115.31 1u7g h THR 17 Ca 0.25 -0.87 0.04 0.00 0.77 0.00 0.00 66.41 66.60 1u7g h THR 17 Cb 0.10 0.68 -0.05 0.00 -1.74 0.00 0.00 68.15 67.14 1u7g h THR 17 CO -0.03 0.33 0.52 0.00 0.37 0.00 0.00 175.52 176.70 1u7g h ALA 18 N 1.05 1.07 -0.79 6.16 0.00 -1.76 0.12 119.26 125.11 1u7g h ALA 18 Ca 0.19 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 1u7g h ALA 18 Cb 0.32 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 1u7g h ALA 18 CO -0.00 0.32 0.35 -0.07 0.00 0.00 0.00 179.25 179.85 1u7g h LEU 19 N 0.99 1.06 -0.50 0.00 3.38 -0.51 -0.36 115.31 119.36 1u7g h LEU 19 Ca 0.33 -0.15 -0.13 0.00 0.09 0.00 0.00 57.88 58.02 1u7g h LEU 19 Cb 0.04 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 1u7g h LEU 19 CO -0.12 0.91 -0.18 0.58 0.09 0.00 0.00 178.44 179.72 1u7g h VAL 20 N 1.13 1.27 -0.76 1.22 2.07 0.18 -2.63 116.25 118.73 1u7g h VAL 20 Ca 0.27 -1.34 0.02 0.00 0.82 0.00 0.00 66.70 66.46 1u7g h VAL 20 Cb 0.16 1.07 -0.04 0.00 -1.52 0.00 0.00 31.29 30.96 1u7g h VAL 20 CO -0.03 0.47 0.50 -0.07 0.02 0.00 0.00 177.57 178.46 1u7g h LEU 21 N 0.87 0.85 -4.25 2.57 3.38 -0.41 -3.23 115.31 115.10 1u7g h LEU 21 Ca 0.12 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.07 1u7g h LEU 21 Cb 0.76 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.30 1u7g h LEU 21 CO 0.06 0.60 0.13 0.33 0.09 0.00 0.00 178.44 179.65 1u7g n PHE 22 N -4.43 0.00 0.00 1.13 7.35 -0.18 -0.79 117.46 120.53 1u7g n PHE 22 Ca 0.09 -0.01 0.00 0.00 -0.76 0.00 0.00 57.45 56.77 1u7g n PHE 22 Cb 0.06 -0.30 0.00 0.00 0.35 0.00 0.00 39.48 39.60 1u7g n PHE 22 CO 0.00 0.00 0.00 2.41 -0.76 0.00 0.00 176.76 178.41 1u7g n THR 24 N 2.26 0.00 -3.71 -2.13 -1.04 -1.22 -1.35 114.28 107.08 1u7g n THR 24 Ca 0.00 0.00 -0.37 0.00 -2.04 0.00 0.00 64.05 61.64 1u7g n THR 24 Cb 0.01 0.00 -0.10 0.00 -1.82 0.00 0.00 70.33 68.42 1u7g n THR 24 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1u7g s ILE 25 N 0.00 3.71 -0.68 12.58 -1.09 0.03 -3.04 121.20 132.71 1u7g s ILE 25 Ca 0.00 -2.80 0.10 0.00 -2.23 0.00 0.00 60.65 55.72 1u7g s ILE 25 Cb 0.00 -3.43 0.28 0.00 -1.58 0.00 0.00 42.46 37.72 1u7g s ILE 25 CO 0.00 -0.85 1.23 -0.81 -1.23 0.00 0.00 174.94 173.27 1u7g n PRO 26 N 3.68 2.87 -0.05 2.79 -0.04 -1.07 -4.99 135.00 138.19 1u7g n PRO 26 Ca 0.06 -2.05 -0.13 0.00 -0.04 0.00 0.00 63.50 61.34 1u7g n PRO 26 Cb 0.39 -1.28 -0.09 0.00 -0.04 0.00 0.00 33.50 32.47 1u7g n PRO 26 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1u7g h GLY 27 N 1.61 -1.13 2.00 0.55 0.00 -1.13 0.25 103.07 105.23 1u7g h GLY 27 Ca 0.00 0.70 -0.10 0.00 0.00 0.00 0.00 47.33 47.93 1u7g h GLY 27 CO 0.02 -0.21 -0.47 1.19 0.00 0.00 0.00 176.54 177.07 1u7g h ILE 28 N -0.47 1.03 -0.39 2.60 6.09 -1.81 -0.56 117.51 124.01 1u7g h ILE 28 Ca 0.04 -1.81 -0.11 0.00 -1.37 0.00 0.00 64.86 61.61 1u7g h ILE 28 Cb 0.59 2.07 -0.01 0.00 0.47 0.00 0.00 36.82 39.94 1u7g h ILE 28 CO -0.45 0.46 -0.18 0.00 -3.07 0.00 0.00 178.15 174.91 1u7g h ALA 29 N 1.53 0.54 -0.53 0.18 0.00 -1.38 -0.93 119.26 118.68 1u7g h ALA 29 Ca -0.00 -0.36 -0.12 0.00 0.00 0.00 0.00 54.91 54.43 1u7g h ALA 29 Cb 1.03 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.67 1u7g h ALA 29 CO 0.06 0.48 -0.14 -0.07 0.00 0.00 0.00 179.25 179.58 1u7g h LEU 30 N 0.60 1.03 0.08 0.00 3.38 -0.58 0.21 115.31 120.04 1u7g h LEU 30 Ca 0.09 -0.36 0.02 0.00 0.09 0.00 0.00 57.88 57.72 1u7g h LEU 30 Cb 0.73 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.17 1u7g h LEU 30 CO 0.05 1.16 -0.19 0.15 0.09 0.00 0.00 178.44 179.71 1u7g h PHE 31 N 0.90 -0.49 0.00 1.13 3.57 -0.89 -1.68 116.94 119.49 1u7g h PHE 31 Ca 0.13 0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.56 1u7g h PHE 31 Cb 0.71 0.21 -0.01 0.00 2.79 0.00 0.00 35.95 39.65 1u7g h PHE 31 CO 0.05 -0.27 -0.41 1.88 -2.23 0.00 0.00 178.31 177.33 1u7g h TYR 32 N -0.34 0.00 -0.43 0.41 0.05 -1.16 -2.82 116.97 112.68 1u7g h TYR 32 Ca 0.03 0.00 0.07 0.00 0.05 0.00 0.00 58.73 58.88 1u7g h TYR 32 Cb 0.38 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.09 1u7g h TYR 32 CO -0.20 0.41 0.29 0.78 -1.05 0.00 0.00 178.16 178.39 1u7g h GLY 33 N 2.30 0.38 1.82 3.88 0.00 0.21 0.76 103.07 112.41 1u7g h GLY 33 Ca -0.00 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.21 1u7g h GLY 33 CO 0.05 0.09 -0.03 0.61 0.00 0.00 0.00 176.54 177.26 1u7g n GLY 34 N -1.53 -1.42 0.00 4.60 0.00 -0.71 -3.73 105.19 102.41 1u7g n GLY 34 Ca 0.06 -0.13 0.07 0.00 0.00 0.00 0.00 46.02 46.02 1u7g n GLY 34 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1u7g n LEU 35 N -1.44 0.29 -4.80 0.99 4.77 0.15 -4.27 117.00 112.69 1u7g n LEU 35 Ca 0.09 -0.22 -0.22 0.00 -0.03 0.00 0.00 56.01 55.62 1u7g n LEU 35 Cb 0.32 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.36 1u7g n LEU 35 CO 0.27 0.07 -0.12 0.27 -1.33 0.00 0.00 177.39 176.54 1u7g s ILE 36 N -2.68 3.22 0.46 -0.08 -4.36 -0.55 -4.46 121.20 112.75 1u7g s ILE 36 Ca -0.01 -1.51 -0.24 0.00 -0.26 0.00 0.00 60.65 58.64 1u7g s ILE 36 Cb 0.10 -3.08 -0.07 0.00 1.25 0.00 0.00 42.46 40.65 1u7g s ILE 36 CO 0.58 -0.16 1.23 0.00 0.24 0.00 0.00 174.94 176.83 1u7g s ARG 37 N -3.94 3.71 0.30 0.37 3.03 -1.26 -4.89 118.95 116.26 1u7g s ARG 37 Ca 0.40 1.95 0.04 0.00 2.03 0.00 0.00 55.73 60.15 1u7g s ARG 37 Cb -0.04 -2.48 0.77 0.00 -1.03 0.00 0.00 34.95 32.17 1u7g s ARG 37 CO 0.25 -0.64 1.67 0.78 -1.13 0.00 0.00 175.30 176.23 1u7g h GLY 38 N 2.12 1.52 2.00 3.88 0.00 -1.99 -0.94 103.07 109.67 1u7g h GLY 38 Ca -0.50 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 46.72 1u7g h GLY 38 CO 0.60 -0.35 0.00 0.07 0.00 0.00 0.00 176.54 176.87 1u7g h LYS 39 N 0.29 0.00 -0.01 4.80 2.10 -2.01 -2.33 116.57 119.41 1u7g h LYS 39 Ca 0.58 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.23 1u7g h LYS 39 Cb 1.17 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.50 1u7g h LYS 39 CO -0.60 0.00 -0.03 0.09 -2.00 0.00 0.00 179.45 176.91 1u7g n ASN 40 N -2.30 1.69 -0.15 7.07 3.02 -0.37 -4.66 115.26 119.56 1u7g n ASN 40 Ca 0.01 -1.34 -0.11 0.00 -0.03 0.00 0.00 54.58 53.10 1u7g n ASN 40 Cb 0.18 0.08 -0.01 0.00 -0.61 0.00 0.00 39.78 39.43 1u7g n ASN 40 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 1u7g h VAL 41 N 1.73 1.27 -0.37 2.41 2.07 -1.29 -2.98 116.25 119.09 1u7g h VAL 41 Ca 0.00 -1.31 0.05 0.00 0.82 0.00 0.00 66.70 66.26 1u7g h VAL 41 Cb 0.38 1.17 -0.05 0.00 -1.52 0.00 0.00 31.29 31.28 1u7g h VAL 41 CO 0.00 0.45 0.10 -0.07 0.02 0.00 0.00 177.57 178.06 1u7g h LEU 42 N 0.74 0.07 -1.31 2.57 3.38 -1.83 0.88 115.31 119.81 1u7g h LEU 42 Ca 0.11 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1u7g h LEU 42 Cb 0.73 0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.53 1u7g h LEU 42 CO 0.06 0.07 0.00 -1.20 0.09 0.00 0.00 178.44 177.46 1u7g n SER 43 N -5.06 0.03 0.00 -0.43 7.64 -1.13 -1.11 113.62 113.56 1u7g n SER 43 Ca 0.02 -0.03 0.00 0.00 1.01 0.00 0.00 58.87 59.87 1u7g n SER 43 Cb 0.15 -0.01 0.00 0.00 -1.01 0.00 0.00 64.21 63.34 1u7g n SER 43 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1u7g n LEU 45 N 0.65 0.00 -0.14 -3.43 4.77 0.30 -0.84 117.00 118.31 1u7g n LEU 45 Ca 0.00 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.89 1u7g n LEU 45 Cb 0.01 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.09 1u7g n LEU 45 CO 0.00 0.00 0.89 0.74 -1.33 0.00 0.00 177.39 177.69 1u7g h THR 46 N 0.00 1.22 -0.47 -5.08 2.02 -1.36 -0.96 112.91 108.28 1u7g h THR 46 Ca 0.00 -0.72 -0.10 0.00 0.77 0.00 0.00 66.41 66.36 1u7g h THR 46 Cb 0.00 0.91 -0.02 0.00 -1.74 0.00 0.00 68.15 67.30 1u7g h THR 46 CO 0.00 0.26 -0.11 1.56 0.37 0.00 0.00 175.52 177.60 1u7g h GLN 47 N 0.53 0.86 -0.54 6.66 4.20 -1.25 0.85 115.11 126.41 1u7g h GLN 47 Ca 0.13 -0.30 -0.07 0.00 0.06 0.00 0.00 58.65 58.48 1u7g h GLN 47 Cb 0.27 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 27.96 1u7g h GLN 47 CO -0.00 0.93 0.06 0.28 -0.67 0.00 0.00 178.83 179.42 1u7g h VAL 48 N 0.78 1.26 -0.24 -0.54 2.07 -1.75 0.77 116.25 118.58 1u7g h VAL 48 Ca 0.13 -1.01 -0.12 0.00 0.82 0.00 0.00 66.70 66.52 1u7g h VAL 48 Cb 0.61 0.85 -0.00 0.00 -1.52 0.00 0.00 31.29 31.23 1u7g h VAL 48 CO 0.04 0.36 -0.32 0.74 0.02 0.00 0.00 177.57 178.41 1u7g h THR 49 N 0.80 1.31 -0.18 2.57 2.02 -0.84 -0.32 112.91 118.27 1u7g h THR 49 Ca 0.16 -1.51 -0.21 0.00 0.77 0.00 0.00 66.41 65.62 1u7g h THR 49 Cb 0.45 1.71 0.01 0.00 -1.74 0.00 0.00 68.15 68.58 1u7g h THR 49 CO 0.02 0.47 -0.72 0.58 0.37 0.00 0.00 175.52 176.24 1u7g h VAL 50 N 0.35 1.28 0.00 3.16 2.07 -0.78 -1.61 116.25 120.73 1u7g h VAL 50 Ca 0.03 -1.92 -0.10 0.00 0.82 0.00 0.00 66.70 65.52 1u7g h VAL 50 Cb 0.90 1.90 -0.01 0.00 -1.52 0.00 0.00 31.29 32.56 1u7g h VAL 50 CO 0.08 0.61 -0.48 0.71 0.02 0.00 0.00 177.57 178.50 1u7g h THR 51 N 0.56 1.33 -0.35 2.57 1.35 -0.83 0.02 112.91 117.56 1u7g h THR 51 Ca -0.04 -1.67 0.04 0.00 -0.55 0.00 0.00 66.41 64.19 1u7g h THR 51 Cb 1.35 1.91 -0.04 0.00 -1.73 0.00 0.00 68.15 69.63 1u7g h THR 51 CO 0.15 0.47 0.12 0.15 -0.25 0.00 0.00 175.52 176.16 1u7g h PHE 52 N 0.00 0.21 -0.47 4.73 3.57 -0.86 0.13 116.94 124.25 1u7g h PHE 52 Ca -0.00 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.49 1u7g h PHE 52 Cb 0.87 -0.04 -0.02 0.00 2.79 0.00 0.00 35.95 39.54 1u7g h PHE 52 CO 0.00 0.08 0.20 0.00 -2.23 0.00 0.00 178.31 176.37 1u7g h ALA 53 N 1.23 0.60 -0.45 2.41 0.00 -0.71 -0.26 119.26 122.09 1u7g h ALA 53 Ca 0.16 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 54.96 1u7g h ALA 53 Cb 0.14 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 1u7g h ALA 53 CO -0.17 0.19 0.24 1.25 0.00 0.00 0.00 179.25 180.77 1u7g h LEU 54 N 0.61 0.36 -0.66 0.00 5.85 -0.58 -1.22 115.31 119.67 1u7g h LEU 54 Ca 0.16 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.89 1u7g h LEU 54 Cb 0.16 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.10 1u7g h LEU 54 CO -0.02 0.26 0.40 0.58 -0.34 0.00 0.00 178.44 179.32 1u7g h VAL 55 N 0.48 1.19 -0.71 1.05 2.07 -0.29 0.11 116.25 120.15 1u7g h VAL 55 Ca 0.19 -0.43 0.07 0.00 0.82 0.00 0.00 66.70 67.34 1u7g h VAL 55 Cb 0.07 0.29 -0.06 0.00 -1.52 0.00 0.00 31.29 30.07 1u7g h VAL 55 CO -0.12 0.20 0.40 0.00 0.02 0.00 0.00 177.57 178.07 1u7g h ILE 57 N 0.72 1.52 -0.36 0.00 1.08 -0.83 -2.88 117.51 116.77 1u7g h ILE 57 Ca 0.32 -1.74 -0.00 0.00 -0.39 0.00 0.00 64.86 63.05 1u7g h ILE 57 Cb 0.22 2.61 -0.02 0.00 -3.07 0.00 0.00 36.82 36.56 1u7g h ILE 57 CO -0.19 0.47 0.22 -0.07 -0.69 0.00 0.00 178.15 177.89 1u7g h LEU 58 N -0.51 0.42 -0.25 1.44 3.38 -0.53 0.11 115.31 119.37 1u7g h LEU 58 Ca -0.01 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1u7g h LEU 58 Cb 0.84 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.48 1u7g h LEU 58 CO 0.03 0.32 0.15 -0.25 0.09 0.00 0.00 178.44 178.79 1u7g h TRP 59 N 0.50 0.32 -0.02 1.13 2.91 -0.63 0.13 115.95 120.29 1u7g h TRP 59 Ca 0.13 0.00 -0.18 0.00 1.13 0.00 0.00 58.89 59.97 1u7g h TRP 59 Cb -0.03 -0.11 -0.01 0.00 -0.51 0.00 0.00 29.16 28.51 1u7g h TRP 59 CO 0.00 0.23 -0.80 0.28 -1.03 0.00 0.00 178.44 177.12 1u7g h VAL 60 N 0.32 1.46 0.09 2.65 2.07 -1.18 0.26 116.25 121.91 1u7g h VAL 60 Ca 0.09 -2.43 -0.00 0.00 0.82 0.00 0.00 66.70 65.18 1u7g h VAL 60 Cb -0.00 2.33 0.00 0.00 -1.52 0.00 0.00 31.29 32.09 1u7g h VAL 60 CO -0.02 0.71 -0.04 0.58 0.02 0.00 0.00 177.57 178.82 1u7g h VAL 61 N 0.13 1.05 0.00 2.57 2.07 -0.43 -3.29 116.25 118.35 1u7g h VAL 61 Ca -0.03 -0.49 0.00 0.00 0.82 0.00 0.00 66.70 67.00 1u7g h VAL 61 Cb 1.39 1.36 0.00 0.00 -1.52 0.00 0.00 31.29 32.52 1u7g h VAL 61 CO 0.12 0.12 0.00 0.00 0.02 0.00 0.00 177.57 177.83 1u7g n TYR 62 N -5.04 0.00 -0.16 1.57 0.18 -0.07 -4.23 117.16 109.42 1u7g n TYR 62 Ca -0.08 0.00 -0.10 0.00 1.88 0.00 0.00 57.90 59.60 1u7g n TYR 62 Cb 0.16 0.00 -0.00 0.00 -0.38 0.00 0.00 39.34 39.12 1u7g n TYR 62 CO 0.00 0.00 0.00 0.78 -2.08 0.00 0.00 176.86 175.56 1u7g h GLY 63 N 0.00 0.89 0.87 -7.48 0.00 0.25 -0.94 103.07 96.66 1u7g h GLY 63 Ca 0.00 -0.66 0.02 0.00 0.00 0.00 0.00 47.33 46.70 1u7g h GLY 63 CO 0.00 0.60 0.28 -1.82 0.00 0.00 0.00 176.54 175.60 1u7g h TYR 64 N 0.68 0.52 -0.79 5.60 3.20 -0.78 0.42 116.97 125.82 1u7g h TYR 64 Ca 0.13 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.97 1u7g h TYR 64 Cb 0.50 -0.17 -0.03 0.00 1.54 0.00 0.00 36.73 38.57 1u7g h TYR 64 CO 0.04 0.30 0.31 1.03 -1.64 0.00 0.00 178.16 178.19 1u7g h SER 65 N 0.56 1.09 1.56 -2.11 0.87 -1.68 0.11 113.55 113.96 1u7g h SER 65 Ca 0.19 -0.17 -0.09 0.00 -1.23 0.00 0.00 61.79 60.49 1u7g h SER 65 Cb 0.03 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 61.69 1u7g h SER 65 CO -0.09 0.97 -0.42 -0.07 -0.53 0.00 0.00 176.83 176.69 1u7g h LEU 66 N 1.15 0.00 0.15 2.23 3.38 -0.78 0.93 115.31 122.38 1u7g h LEU 66 Ca 0.26 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.93 1u7g h LEU 66 Cb 0.22 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.98 1u7g h LEU 66 CO -0.02 0.42 -1.49 0.00 0.09 0.00 0.00 178.44 177.44 1u7g h ALA 67 N 1.58 0.12 0.00 1.53 0.00 0.06 0.43 119.26 122.98 1u7g h ALA 67 Ca -0.00 -1.06 0.00 0.00 0.00 0.00 0.00 54.91 53.85 1u7g h ALA 67 Cb 1.32 0.42 0.00 0.00 0.00 0.00 0.00 17.79 19.53 1u7g h ALA 67 CO 0.05 0.85 -1.10 0.43 0.00 0.00 0.00 179.25 179.48 1u7g n SER 68 N -3.81 1.19 -4.78 0.00 7.64 0.37 -3.73 113.62 110.51 1u7g n SER 68 Ca -0.23 -0.43 -0.32 0.00 1.01 0.00 0.00 58.87 58.89 1u7g n SER 68 Cb 0.97 1.30 0.06 0.00 -1.01 0.00 0.00 64.21 65.53 1u7g n SER 68 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1u7g s GLY 69 N -2.89 1.92 0.19 0.23 0.00 0.27 -4.93 107.32 102.12 1u7g s GLY 69 Ca 0.00 0.38 -0.30 0.00 0.00 0.00 0.00 44.72 44.81 1u7g s GLY 69 CO 0.56 0.73 0.97 -1.83 0.00 0.00 0.00 173.10 173.53 1u7g s GLU 70 N -4.49 4.77 0.00 2.90 -1.05 -1.26 -4.00 118.70 115.57 1u7g s GLU 70 Ca 0.64 1.51 0.00 0.00 -0.15 0.00 0.00 54.97 56.96 1u7g s GLU 70 Cb -0.18 -3.31 0.00 0.00 -0.44 0.00 0.00 34.13 30.20 1u7g s GLU 70 CO 0.48 0.37 0.00 0.41 0.95 0.00 0.00 175.26 177.47 1u7g n GLY 71 N 1.79 -0.24 0.00 -3.83 0.00 -1.26 -3.94 105.19 97.72 1u7g n GLY 71 Ca -0.00 0.49 0.00 0.00 0.00 0.00 0.00 46.02 46.51 1u7g n GLY 71 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1u7g n ASN 72 N 0.00 0.81 0.25 1.61 6.94 0.12 -4.98 115.26 120.02 1u7g n ASN 72 Ca 0.00 -0.06 0.16 0.00 -0.02 0.00 0.00 54.58 54.67 1u7g n ASN 72 Cb 0.00 0.00 0.66 0.00 -2.36 0.00 0.00 39.78 38.08 1u7g n ASN 72 CO 0.00 0.00 0.00 0.78 -1.03 0.00 0.00 177.26 177.01 1u7g h ASN 73 N 0.00 0.00 0.00 0.53 2.35 -1.93 -3.34 115.58 113.19 1u7g h ASN 73 Ca 0.00 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.69 1u7g h ASN 73 Cb 0.00 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.36 1u7g h ASN 73 CO 0.00 0.00 -1.28 0.49 -1.65 0.00 0.00 177.43 174.99 1u7g n PHE 74 N -2.91 0.00 -3.89 1.19 3.01 -1.26 -0.66 117.46 112.95 1u7g n PHE 74 Ca 0.01 0.00 -0.09 0.00 1.01 0.00 0.00 57.45 58.37 1u7g n PHE 74 Cb 0.28 -0.19 -0.06 0.00 -0.01 0.00 0.00 39.48 39.51 1u7g n PHE 74 CO 0.00 0.00 0.00 -0.59 1.01 0.00 0.00 176.76 177.18 1u7g s PHE 75 N -2.15 0.21 0.00 1.38 -0.71 -1.25 -4.16 117.98 111.30 1u7g s PHE 75 Ca -0.02 -0.57 0.00 0.00 -1.04 0.00 0.00 56.93 55.30 1u7g s PHE 75 Cb 0.02 0.13 0.00 0.00 -1.21 0.00 0.00 43.02 41.95 1u7g s PHE 75 CO 0.18 -0.82 0.00 0.41 -1.34 0.00 0.00 175.22 173.65 1u7g n GLY 76 N -0.28 0.74 1.81 1.99 0.00 0.15 0.15 105.19 109.75 1u7g n GLY 76 Ca -0.08 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.86 1u7g n GLY 76 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1u7g n ASN 77 N 0.00 -0.74 -0.78 1.61 6.94 -0.91 -4.12 115.26 117.26 1u7g n ASN 77 Ca 0.00 -2.02 0.03 0.00 -0.02 0.00 0.00 54.58 52.57 1u7g n ASN 77 Cb 0.00 1.38 0.20 0.00 -2.36 0.00 0.00 39.78 38.99 1u7g n ASN 77 CO 0.00 0.00 0.00 2.30 -1.03 0.00 0.00 177.26 178.53 1u7g n ILE 78 N -0.31 2.29 0.73 1.53 -5.35 -1.26 -2.93 119.36 114.06 1u7g n ILE 78 Ca 0.00 -3.21 0.13 0.00 -0.27 0.00 0.00 62.75 59.40 1u7g n ILE 78 Cb 0.32 -0.30 0.38 0.00 -1.74 0.00 0.00 39.64 38.30 1u7g n ILE 78 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1u7g n ASN 79 N -1.10 0.58 -1.53 7.28 5.03 -1.26 -3.60 115.26 120.66 1u7g n ASN 79 Ca 0.23 0.38 -0.13 0.00 0.87 0.00 0.00 54.58 55.92 1u7g n ASN 79 Cb 0.77 -0.42 0.13 0.00 -1.02 0.00 0.00 39.78 39.24 1u7g n ASN 79 CO 0.00 0.00 0.00 0.79 -1.83 0.00 0.00 177.26 176.22 1u7g n TRP 80 N -1.99 1.77 -0.15 3.10 8.01 -1.26 -4.53 117.44 122.39 1u7g n TRP 80 Ca 0.05 -1.98 -0.02 0.00 -1.31 0.00 0.00 57.50 54.24 1u7g n TRP 80 Cb 0.40 -0.54 -0.02 0.00 -2.01 0.00 0.00 31.31 29.14 1u7g n TRP 80 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.69 177.96 1u7g n LEU 81 N -0.97 0.80 -0.69 -0.99 4.77 -1.24 -3.89 117.00 114.80 1u7g n LEU 81 Ca 0.39 -0.95 0.00 0.00 -0.03 0.00 0.00 56.01 55.42 1u7g n LEU 81 Cb 0.93 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.77 1u7g n LEU 81 CO 0.31 -0.26 0.00 0.18 -1.33 0.00 0.00 177.39 176.29 1u7g n LEU 83 N 3.15 0.00 -4.74 2.23 4.77 -1.24 -4.88 117.00 116.30 1u7g n LEU 83 Ca 0.07 0.00 -0.36 0.00 -0.03 0.00 0.00 56.01 55.69 1u7g n LEU 83 Cb 0.12 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.27 1u7g n LEU 83 CO 0.27 0.00 0.86 -1.59 -1.33 0.00 0.00 177.39 175.60 1u7g s LYS 84 N -0.25 2.57 0.00 3.23 -2.85 -1.25 -1.86 119.74 119.34 1u7g s LYS 84 Ca 0.00 1.93 0.00 0.00 -1.00 0.00 0.00 55.97 56.90 1u7g s LYS 84 Cb 0.00 -1.87 0.00 0.00 -2.06 0.00 0.00 37.83 33.90 1u7g s LYS 84 CO 0.00 -1.54 0.00 0.09 0.10 0.00 0.00 175.35 174.00 1u7g n ASN 85 N -2.00 -1.69 -4.46 0.03 3.02 -1.26 -4.27 115.26 104.63 1u7g n ASN 85 Ca 0.15 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.28 1u7g n ASN 85 Cb 0.49 -1.12 -0.10 0.00 -0.61 0.00 0.00 39.78 38.44 1u7g n ASN 85 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1u7g s ILE 86 N -2.44 5.13 0.47 2.41 1.01 -0.78 -5.06 121.20 121.95 1u7g s ILE 86 Ca 0.00 -0.62 -0.24 0.00 0.00 0.00 0.00 60.65 59.79 1u7g s ILE 86 Cb 0.00 -3.82 -0.07 0.00 0.01 0.00 0.00 42.46 38.58 1u7g s ILE 86 CO 0.00 -0.24 1.30 -1.61 0.00 0.00 0.00 174.94 174.38 1u7g s GLU 87 N 1.66 3.60 0.52 2.79 0.41 -1.26 -4.88 118.70 121.54 1u7g s GLU 87 Ca 0.05 2.10 0.22 0.00 -0.41 0.00 0.00 54.97 56.93 1u7g s GLU 87 Cb -0.19 -2.48 1.40 0.00 -1.78 0.00 0.00 34.13 31.08 1u7g s GLU 87 CO 0.09 -0.78 2.12 -0.07 -0.49 0.00 0.00 175.26 176.13 1u7g h LEU 88 N 2.05 0.00 -1.39 1.80 3.38 -1.98 -0.55 115.31 118.62 1u7g h LEU 88 Ca -0.50 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.47 1u7g h LEU 88 Cb 1.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.02 1u7g h LEU 88 CO 0.60 0.08 0.00 0.35 0.09 0.00 0.00 178.44 179.56 1u7g n THR 89 N -4.05 0.43 -1.75 0.22 -2.24 -1.26 -4.75 114.28 100.88 1u7g n THR 89 Ca -0.03 -0.48 -0.41 0.00 -2.27 0.00 0.00 64.05 60.86 1u7g n THR 89 Cb 0.17 0.34 0.00 0.00 -2.10 0.00 0.00 70.33 68.74 1u7g n THR 89 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1u7g n ALA 90 N 0.60 2.02 -3.67 6.98 0.00 -0.22 -4.87 120.51 121.35 1u7g n ALA 90 Ca 0.15 0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.91 1u7g n ALA 90 Cb 0.35 -2.37 0.00 0.00 0.00 0.00 0.00 19.45 17.43 1u7g n ALA 90 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1u7g n VAL 91 N 0.28 0.00 0.00 0.00 0.31 -1.26 0.10 118.33 117.75 1u7g n VAL 91 Ca 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.36 1u7g n VAL 91 Cb 0.39 -0.29 0.00 0.00 -0.91 0.00 0.00 33.84 33.02 1u7g n VAL 91 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1u7g n GLY 93 N 5.00 0.00 0.13 2.92 0.00 -1.26 -4.74 105.19 107.24 1u7g n GLY 93 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.11 1u7g n GLY 93 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1u7g n SER 94 N 0.00 2.10 -4.33 1.61 3.41 -1.26 -4.82 113.62 110.34 1u7g n SER 94 Ca 0.00 -3.00 -0.17 0.00 -0.26 0.00 0.00 58.87 55.43 1u7g n SER 94 Cb 0.00 -0.41 -0.10 0.00 -0.26 0.00 0.00 64.21 63.44 1u7g n SER 94 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 1u7g s ILE 95 N -2.60 1.41 0.31 -1.33 -4.36 -1.26 -0.59 121.20 112.78 1u7g s ILE 95 Ca 0.29 -2.12 -0.30 0.00 -0.26 0.00 0.00 60.65 58.27 1u7g s ILE 95 Cb 0.26 -2.12 -0.12 0.00 1.25 0.00 0.00 42.46 41.73 1u7g s ILE 95 CO 0.02 -0.53 1.49 -1.22 0.24 0.00 0.00 174.94 174.94 1u7g n TYR 96 N -0.37 2.65 -0.18 1.37 4.01 -1.26 -4.37 117.16 119.01 1u7g n TYR 96 Ca -0.08 0.38 0.12 0.00 -0.16 0.00 0.00 57.90 58.16 1u7g n TYR 96 Cb 0.62 -2.53 0.44 0.00 -0.31 0.00 0.00 39.34 37.56 1u7g n TYR 96 CO 0.00 0.00 0.00 0.37 -0.46 0.00 0.00 176.86 176.77 1u7g h GLN 97 N 3.94 0.55 -0.36 -0.72 4.15 -0.63 0.30 115.11 122.33 1u7g h GLN 97 Ca -0.47 -0.03 0.06 0.00 0.77 0.00 0.00 58.65 58.97 1u7g h GLN 97 Cb 1.25 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 28.80 1u7g h GLN 97 CO 0.73 0.36 0.25 1.88 -1.93 0.00 0.00 178.83 180.12 1u7g h TYR 98 N 0.57 0.24 -0.19 3.99 -1.99 -1.85 0.44 116.97 118.18 1u7g h TYR 98 Ca 0.36 0.01 -0.18 0.00 2.00 0.00 0.00 58.73 60.91 1u7g h TYR 98 Cb 0.61 -0.08 -0.00 0.00 2.00 0.00 0.00 36.73 39.26 1u7g h TYR 98 CO -0.00 0.13 -0.61 0.82 -0.00 0.00 0.00 178.16 178.50 1u7g h ILE 99 N 0.24 1.31 -0.73 -2.88 2.04 -1.30 -1.97 117.51 114.23 1u7g h ILE 99 Ca 0.16 -1.86 0.02 0.00 1.00 0.00 0.00 64.86 64.18 1u7g h ILE 99 Cb 0.33 1.82 -0.04 0.00 -0.74 0.00 0.00 36.82 38.19 1u7g h ILE 99 CO -0.03 0.58 0.48 -0.74 0.00 0.00 0.00 178.15 178.44 1u7g h HIS 100 N 0.47 0.90 -0.31 1.37 2.76 -0.94 0.25 115.15 119.65 1u7g h HIS 100 Ca -0.00 0.02 0.06 0.00 -2.20 0.00 0.00 60.37 58.24 1u7g h HIS 100 Cb 1.18 -0.30 -0.05 0.00 1.55 0.00 0.00 27.41 29.79 1u7g h HIS 100 CO 0.06 0.55 -0.02 0.28 -1.30 0.00 0.00 177.93 177.49 1u7g h VAL 101 N 0.96 0.75 -0.30 5.26 2.07 -0.73 -0.63 116.25 123.63 1u7g h VAL 101 Ca 0.28 -0.02 -0.08 0.00 0.82 0.00 0.00 66.70 67.70 1u7g h VAL 101 Cb -0.06 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 1u7g h VAL 101 CO -0.08 0.01 -0.13 0.00 0.02 0.00 0.00 177.57 177.40 1u7g h ALA 102 N 1.28 0.42 -0.25 1.67 0.00 -0.56 0.72 119.26 122.54 1u7g h ALA 102 Ca 0.15 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 1u7g h ALA 102 Cb 0.21 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1u7g h ALA 102 CO -0.27 0.30 0.15 0.35 0.00 0.00 0.00 179.25 179.77 1u7g h PHE 103 N 0.37 0.33 -0.43 0.00 3.57 -0.40 -0.45 116.94 119.93 1u7g h PHE 103 Ca 0.07 -0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.51 1u7g h PHE 103 Cb 0.64 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 39.25 1u7g h PHE 103 CO 0.06 0.26 0.04 1.96 -2.23 0.00 0.00 178.31 178.39 1u7g h GLN 104 N 0.30 0.67 -0.28 1.11 4.20 -1.00 -1.98 115.11 118.13 1u7g h GLN 104 Ca 0.09 -0.15 -0.05 0.00 0.06 0.00 0.00 58.65 58.60 1u7g h GLN 104 Cb 0.03 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 27.70 1u7g h GLN 104 CO -0.02 0.67 -0.04 0.78 -0.67 0.00 0.00 178.83 179.55 1u7g h GLY 105 N 0.91 0.47 2.00 3.46 0.00 -0.19 -2.09 103.07 107.63 1u7g h GLY 105 Ca 0.14 -0.28 -0.05 0.00 0.00 0.00 0.00 47.33 47.13 1u7g h GLY 105 CO 0.01 0.27 -0.24 1.48 0.00 0.00 0.00 176.54 178.05 1u7g h SER 106 N 0.42 0.00 -0.28 0.19 4.64 -0.32 -1.13 113.55 117.07 1u7g h SER 106 Ca 0.09 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.22 1u7g h SER 106 Cb 0.35 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.44 1u7g h SER 106 CO 0.01 0.24 -0.55 -0.26 -0.87 0.00 0.00 176.83 175.41 1u7g h PHE 107 N 0.00 1.10 -0.90 4.77 -1.00 -1.23 -1.69 116.94 117.99 1u7g h PHE 107 Ca -0.00 -0.40 0.05 0.00 2.81 0.00 0.00 57.97 60.44 1u7g h PHE 107 Cb 0.46 -0.20 -0.06 0.00 3.61 0.00 0.00 35.95 39.76 1u7g h PHE 107 CO 0.00 1.23 0.58 0.00 -1.61 0.00 0.00 178.31 178.51 1u7g h ALA 108 N 0.67 1.49 -0.19 2.45 0.00 -0.94 -1.59 119.26 121.15 1u7g h ALA 108 Ca 0.01 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 1u7g h ALA 108 Cb 1.16 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 1u7g h ALA 108 CO 0.12 0.39 -0.04 0.00 0.00 0.00 0.00 179.25 179.72 1u7g h ILE 110 N 0.08 1.36 -0.24 0.00 6.09 -1.11 0.23 117.51 123.92 1u7g h ILE 110 Ca 0.05 -1.74 -0.01 0.00 -1.37 0.00 0.00 64.86 61.79 1u7g h ILE 110 Cb 0.48 1.89 -0.01 0.00 0.47 0.00 0.00 36.82 39.65 1u7g h ILE 110 CO 0.02 0.51 0.11 0.74 -3.07 0.00 0.00 178.15 176.46 1u7g h THR 111 N 0.09 1.14 -0.53 2.19 2.02 -1.10 -0.30 112.91 116.42 1u7g h THR 111 Ca 0.00 -0.41 -0.10 0.00 0.77 0.00 0.00 66.41 66.66 1u7g h THR 111 Cb 0.92 0.98 -0.02 0.00 -1.74 0.00 0.00 68.15 68.30 1u7g h THR 111 CO 0.07 0.14 -0.08 0.58 0.37 0.00 0.00 175.52 176.60 1u7g h VAL 112 N 0.25 1.26 -0.56 3.16 2.07 -1.04 -2.78 116.25 118.61 1u7g h VAL 112 Ca 0.08 -1.21 0.03 0.00 0.82 0.00 0.00 66.70 66.43 1u7g h VAL 112 Cb 0.12 0.94 -0.03 0.00 -1.52 0.00 0.00 31.29 30.80 1u7g h VAL 112 CO -0.01 0.43 0.37 1.23 0.02 0.00 0.00 177.57 179.61 1u7g h GLY 113 N 0.97 0.73 1.24 2.17 0.00 -0.06 0.11 103.07 108.22 1u7g h GLY 113 Ca 0.14 -0.25 -0.03 0.00 0.00 0.00 0.00 47.33 47.19 1u7g h GLY 113 CO 0.04 0.22 0.32 1.41 0.00 0.00 0.00 176.54 178.53 1u7g h LEU 114 N 0.64 0.89 0.02 3.11 3.38 -0.78 0.43 115.31 123.00 1u7g h LEU 114 Ca 0.23 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 1u7g h LEU 114 Cb 0.10 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.63 1u7g h LEU 114 CO -0.06 0.76 -0.01 0.40 0.09 0.00 0.00 178.44 179.62 1u7g h ILE 115 N 0.98 1.45 -0.40 1.22 2.04 -1.18 -3.31 117.51 118.29 1u7g h ILE 115 Ca 0.24 -1.67 -0.13 0.00 1.00 0.00 0.00 64.86 64.29 1u7g h ILE 115 Cb 0.11 2.53 -0.01 0.00 -0.74 0.00 0.00 36.82 38.72 1u7g h ILE 115 CO -0.03 0.41 -0.28 0.58 0.00 0.00 0.00 178.15 178.83 1u7g h VAL 116 N -0.79 1.27 -0.80 1.67 2.07 -0.69 -2.23 116.25 116.76 1u7g h VAL 116 Ca -0.00 -1.44 0.04 0.00 0.82 0.00 0.00 66.70 66.12 1u7g h VAL 116 Cb 0.70 1.26 -0.05 0.00 -1.52 0.00 0.00 31.29 31.69 1u7g h VAL 116 CO 0.01 0.48 0.52 1.23 0.02 0.00 0.00 177.57 179.83 1u7g h GLY 117 N 0.90 1.12 0.82 2.17 0.00 -1.05 0.26 103.07 107.28 1u7g h GLY 117 Ca 0.09 -0.38 -0.14 0.00 0.00 0.00 0.00 47.33 46.89 1u7g h GLY 117 CO 0.07 0.32 -0.53 0.00 0.00 0.00 0.00 176.54 176.40 1u7g h ALA 118 N 1.54 0.14 0.00 3.60 0.00 -1.57 -3.37 119.26 119.60 1u7g h ALA 118 Ca 0.32 -0.53 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1u7g h ALA 118 Cb 0.08 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1u7g h ALA 118 CO -0.10 0.35 -1.15 1.28 0.00 0.00 0.00 179.25 179.63 1u7g n LEU 119 N -4.24 0.58 -0.34 0.00 4.77 -0.87 -4.39 117.00 112.50 1u7g n LEU 119 Ca -0.09 -0.05 0.20 0.00 -0.03 0.00 0.00 56.01 56.04 1u7g n LEU 119 Cb 0.62 -0.07 0.42 0.00 -2.33 0.00 0.00 43.42 42.06 1u7g n LEU 119 CO 0.46 0.05 1.15 0.00 -1.33 0.00 0.00 177.39 177.72 1u7g h ALA 120 N 2.49 1.88 0.00 -1.18 0.00 -0.66 1.00 119.26 122.79 1u7g h ALA 120 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1u7g h ALA 120 Cb 0.75 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1u7g h ALA 120 CO 0.00 -0.39 0.00 -0.85 0.00 0.00 0.00 179.25 178.01 1u7g n GLU 121 N -4.92 0.18 -0.02 0.00 0.28 -1.26 -2.29 120.64 112.61 1u7g n GLU 121 Ca 0.29 0.43 0.04 0.00 -0.16 0.00 0.00 57.16 57.75 1u7g n GLU 121 Cb 0.84 -1.86 0.04 0.00 1.43 0.00 0.00 31.44 31.88 1u7g n GLU 121 CO 0.00 0.00 0.00 2.89 -0.16 0.00 0.00 177.13 179.86 1u7g n ARG 122 N -2.21 0.47 -5.27 3.44 1.85 0.32 -4.91 116.66 110.35 1u7g n ARG 122 Ca 0.02 -1.08 -0.31 0.00 -1.00 0.00 0.00 57.85 55.48 1u7g n ARG 122 Cb 0.22 -1.14 -0.16 0.00 -1.05 0.00 0.00 32.46 30.32 1u7g n ARG 122 CO 0.00 0.00 0.00 -1.50 -0.01 0.00 0.00 177.63 176.12 1u7g s ILE 123 N -0.66 2.02 0.59 8.89 2.07 -0.97 -2.56 121.20 130.58 1u7g s ILE 123 Ca 0.09 -1.07 -0.19 0.00 -1.41 0.00 0.00 60.65 58.07 1u7g s ILE 123 Cb 0.06 -1.69 -0.03 0.00 0.13 0.00 0.00 42.46 40.93 1u7g s ILE 123 CO 0.09 0.57 1.26 -0.13 -1.91 0.00 0.00 174.94 174.82 1u7g s ARG 124 N -0.40 2.93 0.09 3.50 0.52 0.10 -4.74 118.95 120.95 1u7g s ARG 124 Ca 0.04 1.98 -0.32 0.00 -0.52 0.00 0.00 55.73 56.91 1u7g s ARG 124 Cb -0.12 -2.00 -0.15 0.00 0.52 0.00 0.00 34.95 33.21 1u7g s ARG 124 CO 0.01 -1.28 1.61 0.35 0.02 0.00 0.00 175.30 176.01 1u7g h PHE 125 N 0.98 -0.97 -0.36 -0.53 3.04 -1.92 -0.53 116.94 116.64 1u7g h PHE 125 Ca -0.51 0.00 0.06 0.00 3.98 0.00 0.00 57.97 61.50 1u7g h PHE 125 Cb 1.31 0.37 -0.02 0.00 2.56 0.00 0.00 35.95 40.17 1u7g h PHE 125 CO 0.45 -0.52 0.25 -1.00 -2.02 0.00 0.00 178.31 175.47 1u7g h PRO 126 N -0.80 0.23 -0.44 6.41 0.13 -1.94 -1.74 132.00 133.85 1u7g h PRO 126 Ca -0.04 -0.01 -0.12 0.00 -0.87 0.00 0.00 66.00 64.96 1u7g h PRO 126 Cb 0.69 -0.05 -0.01 0.00 0.13 0.00 0.00 31.00 31.75 1u7g h PRO 126 CO -0.02 0.15 -0.19 0.00 -0.23 0.00 0.00 178.00 177.71 1u7g h ALA 127 N 1.81 0.82 -0.23 -0.56 0.00 -1.58 -1.88 119.26 117.63 1u7g h ALA 127 Ca 0.16 -0.37 -0.09 0.00 0.00 0.00 0.00 54.91 54.61 1u7g h ALA 127 Cb 0.34 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1u7g h ALA 127 CO -0.03 0.65 -0.25 -0.24 0.00 0.00 0.00 179.25 179.38 1u7g h VAL 128 N 0.77 1.26 -0.21 0.00 3.04 -0.23 0.39 116.25 121.27 1u7g h VAL 128 Ca 0.11 -1.24 -0.01 0.00 -1.01 0.00 0.00 66.70 64.54 1u7g h VAL 128 Cb 0.73 1.36 -0.01 0.00 -2.01 0.00 0.00 31.29 31.36 1u7g h VAL 128 CO 0.06 0.39 0.09 -0.07 -1.01 0.00 0.00 177.57 177.03 1u7g h LEU 129 N 0.39 0.29 -0.46 3.16 3.38 -1.14 0.16 115.31 121.09 1u7g h LEU 129 Ca 0.06 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 1u7g h LEU 129 Cb 0.65 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.30 1u7g h LEU 129 CO 0.05 0.36 0.27 0.40 0.09 0.00 0.00 178.44 179.61 1u7g h ILE 130 N 0.19 1.15 -0.36 1.22 2.04 -1.08 -1.58 117.51 119.09 1u7g h ILE 130 Ca 0.07 -0.35 0.05 0.00 1.00 0.00 0.00 64.86 65.63 1u7g h ILE 130 Cb 0.16 0.54 -0.04 0.00 -0.74 0.00 0.00 36.82 36.74 1u7g h ILE 130 CO -0.01 0.15 0.09 0.15 0.00 0.00 0.00 178.15 178.54 1u7g h PHE 131 N 0.62 0.16 -0.71 1.37 3.57 -0.61 -0.87 116.94 120.46 1u7g h PHE 131 Ca 0.17 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.65 1u7g h PHE 131 Cb 0.01 -0.02 -0.03 0.00 2.79 0.00 0.00 35.95 38.70 1u7g h PHE 131 CO -0.03 0.05 0.30 0.28 -2.23 0.00 0.00 178.31 176.68 1u7g h VAL 132 N 0.22 1.24 -0.49 1.41 2.07 -0.33 0.50 116.25 120.88 1u7g h VAL 132 Ca 0.17 -0.74 0.03 0.00 0.82 0.00 0.00 66.70 66.97 1u7g h VAL 132 Cb 0.17 0.40 -0.04 0.00 -1.52 0.00 0.00 31.29 30.31 1u7g h VAL 132 CO -0.20 0.30 0.28 0.58 0.02 0.00 0.00 177.57 178.55 1u7g h VAL 133 N 1.01 1.02 -0.11 2.57 2.07 -0.83 0.52 116.25 122.50 1u7g h VAL 133 Ca 0.24 -0.19 -0.02 0.00 0.82 0.00 0.00 66.70 67.55 1u7g h VAL 133 Cb 0.18 0.43 -0.00 0.00 -1.52 0.00 0.00 31.29 30.37 1u7g h VAL 133 CO -0.02 0.10 -0.02 0.58 0.02 0.00 0.00 177.57 178.23 1u7g h VAL 134 N 0.55 1.28 0.00 2.57 2.07 -0.56 -1.92 116.25 120.25 1u7g h VAL 134 Ca 0.20 -0.93 -0.22 0.00 0.82 0.00 0.00 66.70 66.57 1u7g h VAL 134 Cb 0.05 1.69 -0.00 0.00 -1.52 0.00 0.00 31.29 31.51 1u7g h VAL 134 CO -0.11 0.27 -0.93 -0.25 0.02 0.00 0.00 177.57 176.57 1u7g h TRP 135 N -0.11 0.54 -0.65 1.57 7.01 0.20 -0.49 115.95 124.02 1u7g h TRP 135 Ca 0.03 -0.30 0.01 0.00 2.11 0.00 0.00 58.89 60.74 1u7g h TRP 135 Cb 0.42 -0.06 -0.03 0.00 -2.10 0.00 0.00 29.16 27.39 1u7g h TRP 135 CO 0.05 1.11 0.42 1.25 -2.79 0.00 0.00 178.44 178.49 1u7g h LEU 136 N 0.20 0.73 -0.21 0.65 5.85 0.00 0.16 115.31 122.69 1u7g h LEU 136 Ca -0.07 -0.02 -0.19 0.00 0.84 0.00 0.00 57.88 58.45 1u7g h LEU 136 Cb 1.56 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 42.42 1u7g h LEU 136 CO 0.16 0.52 -0.59 0.74 -0.34 0.00 0.00 178.44 178.93 1u7g h THR 137 N 0.86 1.29 0.00 1.05 2.02 -1.21 -0.05 112.91 116.87 1u7g h THR 137 Ca 0.24 -1.80 0.00 0.00 0.77 0.00 0.00 66.41 65.62 1u7g h THR 137 Cb -0.08 1.84 0.00 0.00 -1.74 0.00 0.00 68.15 68.17 1u7g h THR 137 CO -0.06 0.57 -1.00 0.18 0.37 0.00 0.00 175.52 175.58 1u7g n LEU 138 N -4.05 0.40 -0.02 2.58 4.77 -0.21 -4.29 117.00 116.19 1u7g n LEU 138 Ca -0.06 -0.32 -0.06 0.00 -0.03 0.00 0.00 56.01 55.55 1u7g n LEU 138 Cb 0.65 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.72 1u7g n LEU 138 CO 0.50 0.10 -0.48 -0.24 -1.33 0.00 0.00 177.39 175.95 1u7g n SER 139 N -1.56 1.05 0.25 -1.43 2.88 0.47 -4.53 113.62 110.74 1u7g n SER 139 Ca 0.01 0.16 -0.16 0.00 -1.33 0.00 0.00 58.87 57.55 1u7g n SER 139 Cb 0.26 -0.38 -0.08 0.00 -0.75 0.00 0.00 64.21 63.26 1u7g n SER 139 CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 1u7g h TYR 140 N -0.32 -0.53 0.09 0.66 5.03 -1.11 -0.30 116.97 120.48 1u7g h TYR 140 Ca -0.10 -0.01 -0.00 0.00 2.58 0.00 0.00 58.73 61.19 1u7g h TYR 140 Cb 0.70 0.17 0.00 0.00 1.55 0.00 0.00 36.73 39.16 1u7g h TYR 140 CO -0.09 -0.31 -0.04 0.82 -1.32 0.00 0.00 178.16 177.22 1u7g h ILE 141 N -0.59 0.96 -0.85 1.81 2.04 -1.19 0.33 117.51 120.02 1u7g h ILE 141 Ca -0.06 -0.14 -0.01 0.00 1.00 0.00 0.00 64.86 65.65 1u7g h ILE 141 Cb 0.45 1.05 -0.04 0.00 -0.74 0.00 0.00 36.82 37.54 1u7g h ILE 141 CO 0.10 0.04 0.49 -0.65 0.00 0.00 0.00 178.15 178.12 1u7g h PRO 142 N -0.18 1.16 -0.48 2.37 0.11 -1.71 0.12 132.00 133.39 1u7g h PRO 142 Ca -0.01 -0.12 -0.10 0.00 0.11 0.00 0.00 66.00 65.88 1u7g h PRO 142 Cb 0.15 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 31.00 1u7g h PRO 142 CO 0.02 0.83 -0.10 0.82 -0.21 0.00 0.00 178.00 179.36 1u7g h ILE 143 N 1.17 1.27 -0.86 4.15 2.04 -0.68 -2.19 117.51 122.41 1u7g h ILE 143 Ca 0.30 -1.23 0.02 0.00 1.00 0.00 0.00 64.86 64.95 1u7g h ILE 143 Cb -0.01 1.08 -0.05 0.00 -0.74 0.00 0.00 36.82 37.10 1u7g h ILE 143 CO -0.05 0.42 0.57 0.00 0.00 0.00 0.00 178.15 179.09 1u7g h ALA 144 N 0.89 1.43 0.00 1.87 0.00 -0.05 -0.25 119.26 123.15 1u7g h ALA 144 Ca 0.12 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1u7g h ALA 144 Cb 0.65 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1u7g h ALA 144 CO 0.04 0.51 0.00 1.58 0.00 0.00 0.00 179.25 181.38 1u7g n HIS 145 N -4.43 0.00 0.00 0.00 -0.00 0.38 0.08 115.22 111.25 1u7g n HIS 145 Ca 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.82 1u7g n HIS 145 Cb 0.07 -0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.05 1u7g n HIS 145 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.34 176.62 1u7g n VAL 147 N 0.48 0.00 0.19 3.57 0.31 -0.10 -0.80 118.33 121.96 1u7g n VAL 147 Ca 0.00 0.00 0.02 0.00 -0.01 0.00 0.00 64.34 64.35 1u7g n VAL 147 Cb 0.00 0.00 -0.01 0.00 -0.91 0.00 0.00 33.84 32.92 1u7g n VAL 147 CO 0.00 0.00 0.00 0.79 -1.32 0.00 0.00 176.83 176.30 1u7g n TRP 148 N -0.42 0.00 -1.09 3.52 8.01 0.11 -4.34 117.44 123.24 1u7g n TRP 148 Ca 0.00 0.00 0.03 0.00 -1.31 0.00 0.00 57.50 56.22 1u7g n TRP 148 Cb 0.00 0.00 0.26 0.00 -2.01 0.00 0.00 31.31 29.56 1u7g n TRP 148 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1u7g n GLY 149 N 0.79 4.09 1.76 6.99 0.00 0.02 -4.95 105.19 113.89 1u7g n GLY 149 Ca 0.01 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 44.97 1u7g n GLY 149 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u7g n GLY 150 N -0.51 0.53 0.00 -0.02 0.00 -1.04 -4.86 105.19 99.29 1u7g n GLY 150 Ca 0.28 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1u7g n GLY 150 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u7g n GLY 151 N -2.88 0.31 0.24 -0.02 0.00 -0.44 -4.57 105.19 97.83 1u7g n GLY 151 Ca 0.00 -1.69 -0.01 0.00 0.00 0.00 0.00 46.02 44.32 1u7g n GLY 151 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1u7g h LEU 152 N 0.00 0.40 0.13 0.99 5.85 -1.15 0.11 115.31 121.65 1u7g h LEU 152 Ca 0.00 0.05 -0.29 0.00 0.84 0.00 0.00 57.88 58.48 1u7g h LEU 152 Cb 0.00 -0.02 0.03 0.00 0.37 0.00 0.00 40.66 41.04 1u7g h LEU 152 CO 0.00 0.26 -1.23 -0.07 -0.34 0.00 0.00 178.44 177.06 1u7g h LEU 153 N 0.55 0.85 -1.18 2.25 3.38 -1.90 -1.50 115.31 117.76 1u7g h LEU 153 Ca 0.29 -0.84 0.07 0.00 0.09 0.00 0.00 57.88 57.49 1u7g h LEU 153 Cb 0.26 -0.27 -0.06 0.00 0.09 0.00 0.00 40.66 40.68 1u7g h LEU 153 CO -0.22 1.60 0.57 0.00 0.09 0.00 0.00 178.44 180.48 1u7g h ALA 154 N 0.26 1.54 -0.02 1.53 0.00 -1.66 -1.57 119.26 119.34 1u7g h ALA 154 Ca -0.19 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.61 1u7g h ALA 154 Cb 1.91 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 19.43 1u7g h ALA 154 CO 0.23 0.32 -0.39 0.66 0.00 0.00 0.00 179.25 180.07 1u7g h SER 155 N 0.99 0.04 0.51 0.00 4.64 -0.46 -0.81 113.55 118.45 1u7g h SER 155 Ca 0.38 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.69 1u7g h SER 155 Cb 0.21 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 1u7g h SER 155 CO -0.14 0.43 -0.07 1.41 -0.87 0.00 0.00 176.83 177.59 1u7g n HIS 156 N -4.06 0.00 -0.71 4.77 -0.00 -0.59 -4.94 115.22 109.68 1u7g n HIS 156 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.70 1u7g n HIS 156 Cb 0.43 -0.26 0.00 0.00 -0.00 0.00 0.00 29.99 30.17 1u7g n HIS 156 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1u7g n GLY 157 N 1.31 0.56 3.71 -1.41 0.00 -0.31 -4.97 105.19 104.07 1u7g n GLY 157 Ca 0.13 -0.78 -0.43 0.00 0.00 0.00 0.00 46.02 44.94 1u7g n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u7g n ALA 158 N 0.14 1.74 -2.65 4.61 0.00 -0.69 -4.96 120.51 118.71 1u7g n ALA 158 Ca 0.00 0.38 -0.37 0.00 0.00 0.00 0.00 53.44 53.45 1u7g n ALA 158 Cb 0.00 -2.35 -0.09 0.00 0.00 0.00 0.00 19.45 17.01 1u7g n ALA 158 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1u7g s LEU 159 N -0.52 4.10 -0.41 0.00 1.43 -1.26 -4.76 118.68 117.26 1u7g s LEU 159 Ca 0.63 0.19 0.07 0.00 -1.03 0.00 0.00 54.13 53.99 1u7g s LEU 159 Cb -0.57 -2.21 0.18 0.00 0.03 0.00 0.00 46.19 43.62 1u7g s LEU 159 CO 0.53 0.00 0.61 -0.62 0.23 0.00 0.00 176.35 177.10 1u7g s ASP 160 N 1.21 -1.22 0.08 2.29 -1.08 -1.26 -4.91 116.67 111.79 1u7g s ASP 160 Ca 0.10 -0.96 -0.23 0.00 -0.52 0.00 0.00 52.55 50.94 1u7g s ASP 160 Cb -0.14 1.80 -0.14 0.00 -1.46 0.00 0.00 42.92 42.97 1u7g s ASP 160 CO 0.07 -0.17 1.70 0.15 0.52 0.00 0.00 175.17 177.44 1u7g h PHE 161 N 6.83 0.04 0.00 -5.34 3.57 -0.35 -3.36 116.94 118.33 1u7g h PHE 161 Ca 0.05 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.55 1u7g h PHE 161 Cb 1.16 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.88 1u7g h PHE 161 CO 0.17 0.07 0.00 0.00 -2.23 0.00 0.00 178.31 176.32 1u7g n ALA 162 N -2.12 1.67 0.00 2.41 0.00 -0.61 -4.88 120.51 116.98 1u7g n ALA 162 Ca -0.07 -0.74 0.00 0.00 0.00 0.00 0.00 53.44 52.63 1u7g n ALA 162 Cb 0.05 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.50 1u7g n ALA 162 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1u7g n GLY 163 N -0.27 1.21 0.36 0.00 0.00 -1.26 -4.84 105.19 100.38 1u7g n GLY 163 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.13 1u7g n GLY 163 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1u7g h GLY 164 N 0.00 0.76 0.00 -0.02 0.00 -1.88 -0.89 103.07 101.05 1u7g h GLY 164 Ca 0.00 -0.22 -0.08 0.00 0.00 0.00 0.00 47.33 47.03 1u7g h GLY 164 CO 0.00 0.13 -0.80 -1.30 0.00 0.00 0.00 176.54 174.57 1u7g n THR 165 N -4.48 1.46 -0.21 4.70 -2.24 -1.26 -0.76 114.28 111.49 1u7g n THR 165 Ca 0.11 0.13 0.01 0.00 -2.27 0.00 0.00 64.05 62.03 1u7g n THR 165 Cb 0.37 -2.28 0.25 0.00 -2.10 0.00 0.00 70.33 66.57 1u7g n THR 165 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 1u7g h VAL 166 N -1.00 1.19 0.00 2.28 2.07 -1.90 -1.28 116.25 117.61 1u7g h VAL 166 Ca -0.12 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 67.06 1u7g h VAL 166 Cb 0.79 0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.66 1u7g h VAL 166 CO -0.07 0.18 -0.87 0.52 0.02 0.00 0.00 177.57 177.35 1u7g n VAL 167 N -4.42 1.31 -0.06 2.57 0.31 -0.42 -4.49 118.33 113.12 1u7g n VAL 167 Ca 0.08 0.19 -0.14 0.00 -0.01 0.00 0.00 64.34 64.46 1u7g n VAL 167 Cb 0.04 -2.24 -0.12 0.00 -0.91 0.00 0.00 33.84 30.61 1u7g n VAL 167 CO 0.00 0.00 0.00 0.45 -1.32 0.00 0.00 176.83 175.96 1u7g h HIS 168 N -0.87 -0.00 -0.54 3.52 3.86 -1.35 -0.90 115.15 118.87 1u7g h HIS 168 Ca 0.00 -0.00 -0.10 0.00 -1.16 0.00 0.00 60.37 59.11 1u7g h HIS 168 Cb 0.87 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.32 1u7g h HIS 168 CO -0.37 0.94 -0.06 0.82 0.86 0.00 0.00 177.93 180.11 1u7g h ILE 169 N -0.96 1.26 -0.18 2.45 2.04 -0.95 0.53 117.51 121.70 1u7g h ILE 169 Ca -0.00 -1.19 0.05 0.00 1.00 0.00 0.00 64.86 64.72 1u7g h ILE 169 Cb 0.94 0.91 -0.05 0.00 -0.74 0.00 0.00 36.82 37.88 1u7g h ILE 169 CO 0.00 0.42 -0.11 -1.13 0.00 0.00 0.00 178.15 177.33 1u7g h ASN 170 N 0.89 -0.36 -0.28 1.72 -1.24 -1.27 -0.78 115.58 114.25 1u7g h ASN 170 Ca 0.15 0.08 -0.17 0.00 0.71 0.00 0.00 56.30 57.08 1u7g h ASN 170 Cb 0.60 0.19 -0.00 0.00 0.73 0.00 0.00 38.32 39.84 1u7g h ASN 170 CO 0.04 -0.15 -0.46 0.00 -1.29 0.00 0.00 177.43 175.58 1u7g h ALA 171 N 1.04 0.58 -0.79 1.57 0.00 -1.05 -2.28 119.26 118.32 1u7g h ALA 171 Ca 0.11 -0.48 0.01 0.00 0.00 0.00 0.00 54.91 54.54 1u7g h ALA 171 Cb 0.26 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.91 1u7g h ALA 171 CO -0.25 0.68 0.52 0.00 0.00 0.00 0.00 179.25 180.20 1u7g h ALA 172 N 0.80 1.00 -0.27 0.00 0.00 -0.45 0.25 119.26 120.59 1u7g h ALA 172 Ca 0.04 -0.06 -0.13 0.00 0.00 0.00 0.00 54.91 54.76 1u7g h ALA 172 Cb 1.04 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 1u7g h ALA 172 CO 0.10 0.42 -0.33 0.82 0.00 0.00 0.00 179.25 180.26 1u7g h ILE 173 N 1.07 1.30 -0.94 0.00 1.08 -1.11 0.32 117.51 119.23 1u7g h ILE 173 Ca 0.29 -1.51 0.02 0.00 -0.39 0.00 0.00 64.86 63.27 1u7g h ILE 173 Cb -0.12 1.64 -0.05 0.00 -3.07 0.00 0.00 36.82 35.22 1u7g h ILE 173 CO -0.06 0.48 0.62 0.00 -0.69 0.00 0.00 178.15 178.50 1u7g h ALA 174 N 0.68 1.36 -0.32 1.87 0.00 -0.98 0.13 119.26 122.00 1u7g h ALA 174 Ca 0.04 -0.06 -0.17 0.00 0.00 0.00 0.00 54.91 54.72 1u7g h ALA 174 Cb 0.91 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 1u7g h ALA 174 CO 0.08 0.57 -0.48 0.78 0.00 0.00 0.00 179.25 180.20 1u7g h GLY 175 N 1.23 0.96 1.65 0.00 0.00 -0.12 -1.79 103.07 105.01 1u7g h GLY 175 Ca 0.36 -1.06 -0.12 0.00 0.00 0.00 0.00 47.33 46.51 1u7g h GLY 175 CO -0.09 0.95 -0.42 1.41 0.00 0.00 0.00 176.54 178.39 1u7g h LEU 176 N 0.69 0.41 -0.60 3.11 3.38 0.11 -0.06 115.31 122.36 1u7g h LEU 176 Ca 0.03 -0.18 -0.03 0.00 0.09 0.00 0.00 57.88 57.80 1u7g h LEU 176 Cb 1.08 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.68 1u7g h LEU 176 CO 0.11 0.79 0.27 0.58 0.09 0.00 0.00 178.44 180.28 1u7g h VAL 177 N 0.32 1.22 -0.56 1.22 2.07 -0.65 -0.57 116.25 119.29 1u7g h VAL 177 Ca 0.03 -0.63 0.04 0.00 0.82 0.00 0.00 66.70 66.96 1u7g h VAL 177 Cb 0.88 0.53 -0.04 0.00 -1.52 0.00 0.00 31.29 31.13 1u7g h VAL 177 CO 0.07 0.25 0.32 1.23 0.02 0.00 0.00 177.57 179.46 1u7g h GLY 178 N 0.82 0.80 1.47 2.17 0.00 -0.89 0.33 103.07 107.77 1u7g h GLY 178 Ca 0.20 -0.23 -0.02 0.00 0.00 0.00 0.00 47.33 47.28 1u7g h GLY 178 CO -0.02 0.17 0.22 0.00 0.00 0.00 0.00 176.54 176.91 1u7g h ALA 179 N 1.28 1.47 -0.08 3.60 0.00 -0.69 0.11 119.26 124.94 1u7g h ALA 179 Ca 0.24 -0.11 -0.20 0.00 0.00 0.00 0.00 54.91 54.84 1u7g h ALA 179 Cb 0.09 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 1u7g h ALA 179 CO -0.13 0.42 -0.76 -0.92 0.00 0.00 0.00 179.25 177.85 1u7g h TYR 180 N 0.69 0.67 0.00 0.00 3.20 -0.32 -3.28 116.97 117.93 1u7g h TYR 180 Ca 0.17 -0.30 -0.09 0.00 3.14 0.00 0.00 58.73 61.65 1u7g h TYR 180 Cb 0.10 -0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.25 1u7g h TYR 180 CO 0.01 1.08 -1.01 -0.07 -1.64 0.00 0.00 178.16 176.52 1u7g h LEU 181 N 0.33 0.00 -8.05 2.82 3.38 -0.46 -3.44 115.31 109.89 1u7g h LEU 181 Ca -0.04 0.00 -0.67 0.00 0.09 0.00 0.00 57.88 57.25 1u7g h LEU 181 Cb 1.36 0.00 -0.34 0.00 0.09 0.00 0.00 40.66 41.77 1u7g h LEU 181 CO 0.14 0.34 -0.75 -0.63 0.09 0.00 0.00 178.44 177.62 1u7g s ILE 182 N -3.09 2.69 0.80 1.22 1.01 0.34 -5.08 121.20 119.10 1u7g s ILE 182 Ca -0.00 -1.26 -0.12 0.00 0.00 0.00 0.00 60.65 59.27 1u7g s ILE 182 Cb 0.08 -2.45 0.07 0.00 0.01 0.00 0.00 42.46 40.18 1u7g s ILE 182 CO 0.78 0.08 1.12 -0.83 0.00 0.00 0.00 174.94 176.10 1u7g s GLY 183 N 1.25 1.61 -0.10 6.18 0.00 -1.26 -4.71 107.32 110.29 1u7g s GLY 183 Ca -0.03 -0.39 -0.04 0.00 0.00 0.00 0.00 44.72 44.26 1u7g s GLY 183 CO -0.04 0.07 0.21 1.25 0.00 0.00 0.00 173.10 174.58 1u7g s LYS 184 N -5.31 0.12 -0.12 2.90 2.20 -1.26 -4.95 119.74 113.32 1u7g s LYS 184 Ca 0.61 0.58 -0.30 0.00 -0.36 0.00 0.00 55.97 56.51 1u7g s LYS 184 Cb -0.13 -0.14 -0.01 0.00 -1.51 0.00 0.00 37.83 36.03 1u7g s LYS 184 CO 0.52 -0.24 1.07 0.50 -0.36 0.00 0.00 175.35 176.84 1u7g s ARG 185 N 1.88 4.37 -0.33 4.03 3.52 -1.26 -5.01 118.95 126.15 1u7g s ARG 185 Ca -0.03 1.46 -0.19 0.00 -0.13 0.00 0.00 55.73 56.85 1u7g s ARG 185 Cb -0.12 -3.57 -0.01 0.00 -1.56 0.00 0.00 34.95 29.69 1u7g s ARG 185 CO -0.07 -0.42 0.56 0.08 -0.81 0.00 0.00 175.30 174.64 1u7g s VAL 186 N 2.34 4.98 0.73 7.11 1.01 -1.26 -5.04 120.40 130.27 1u7g s VAL 186 Ca 0.50 0.57 -0.15 0.00 0.00 0.00 0.00 61.98 62.90 1u7g s VAL 186 Cb -0.19 -3.97 0.04 0.00 0.00 0.00 0.00 36.38 32.25 1u7g s VAL 186 CO 0.17 -0.18 1.20 -0.83 0.00 0.00 0.00 175.10 175.46 1u7g s GLY 187 N 1.72 2.32 0.18 4.51 0.00 -1.26 -4.90 107.32 109.89 1u7g s GLY 187 Ca 0.22 0.86 -0.32 0.00 0.00 0.00 0.00 44.72 45.47 1u7g s GLY 187 CO 0.13 1.26 1.71 -1.36 0.00 0.00 0.00 173.10 174.84 1u7g s PHE 188 N -2.02 2.79 0.00 1.90 0.08 -1.26 -1.47 117.98 118.00 1u7g s PHE 188 Ca 0.74 0.33 0.00 0.00 0.12 0.00 0.00 56.93 58.12 1u7g s PHE 188 Cb -0.29 -4.10 0.00 0.00 -0.57 0.00 0.00 43.02 38.06 1u7g s PHE 188 CO 0.46 -4.24 0.00 0.41 -0.10 0.00 0.00 175.22 171.75 1u7g n GLY 189 N 3.98 0.89 1.15 4.36 0.00 -1.26 -4.89 105.19 109.42 1u7g n GLY 189 Ca 0.16 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.14 1u7g n GLY 189 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1u7g n LYS 190 N -2.00 1.88 0.03 1.61 4.76 -0.54 -4.66 118.16 119.24 1u7g n LYS 190 Ca 0.00 -3.18 0.14 0.00 -2.87 0.00 0.00 58.31 52.40 1u7g n LYS 190 Cb 0.00 -1.82 0.52 0.00 -1.84 0.00 0.00 35.03 31.90 1u7g n LYS 190 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 1u7g n GLU 191 N -1.10 0.09 -4.21 1.97 4.71 -1.26 -4.76 120.64 116.08 1u7g n GLU 191 Ca 0.33 0.07 -0.16 0.00 -0.01 0.00 0.00 57.16 57.38 1u7g n GLU 191 Cb 1.03 -1.60 -0.11 0.00 -1.01 0.00 0.00 31.44 29.75 1u7g n GLU 191 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1u7g s ALA 192 N -3.04 1.30 0.42 0.62 0.00 -1.26 -1.17 121.76 118.64 1u7g s ALA 192 Ca 0.13 -1.23 -0.26 0.00 0.00 0.00 0.00 51.96 50.60 1u7g s ALA 192 Cb 0.17 -0.03 -0.09 0.00 0.00 0.00 0.00 23.12 23.16 1u7g s ALA 192 CO 0.56 0.04 1.46 -0.06 0.00 0.00 0.00 175.76 177.77 1u7g s PHE 193 N -2.22 2.48 -0.21 0.00 2.99 -1.26 -4.90 117.98 114.86 1u7g s PHE 193 Ca 0.07 1.21 -0.29 0.00 0.00 0.00 0.00 56.93 57.92 1u7g s PHE 193 Cb -0.04 -3.98 0.00 0.00 0.00 0.00 0.00 43.02 39.00 1u7g s PHE 193 CO 0.02 -3.03 1.12 0.21 -0.00 0.00 0.00 175.22 173.54 1u7g s LYS 194 N -2.33 4.24 0.35 0.44 2.20 -1.26 -4.90 119.74 118.48 1u7g s LYS 194 Ca 0.58 1.45 0.05 0.00 -0.36 0.00 0.00 55.97 57.69 1u7g s LYS 194 Cb -0.45 -3.69 0.72 0.00 -1.51 0.00 0.00 37.83 32.90 1u7g s LYS 194 CO 0.60 -0.68 1.95 -1.35 -0.36 0.00 0.00 175.35 175.51 1u7g h PRO 195 N 7.76 0.76 -0.70 4.03 0.11 -1.95 -1.94 132.00 140.07 1u7g h PRO 195 Ca -0.22 -0.05 0.18 0.00 0.11 0.00 0.00 66.00 66.03 1u7g h PRO 195 Cb 1.07 -0.17 -0.03 0.00 0.11 0.00 0.00 31.00 31.98 1u7g h PRO 195 CO 0.98 0.50 0.49 1.25 -0.21 0.00 0.00 178.00 181.01 1u7g h HIS 196 N 0.78 0.15 -0.01 0.65 2.76 -1.97 -1.14 115.15 116.38 1u7g h HIS 196 Ca 0.33 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.50 1u7g h HIS 196 Cb 0.27 -0.05 0.00 0.00 1.55 0.00 0.00 27.41 29.18 1u7g h HIS 196 CO -0.00 0.05 -0.46 0.09 -1.30 0.00 0.00 177.93 176.31 1u7g n ASN 197 N -4.39 1.04 0.23 3.26 5.03 -0.73 -4.37 115.26 115.33 1u7g n ASN 197 Ca 0.14 -0.82 0.09 0.00 0.87 0.00 0.00 54.58 54.85 1u7g n ASN 197 Cb 0.68 0.34 0.58 0.00 -1.02 0.00 0.00 39.78 40.36 1u7g n ASN 197 CO 0.00 0.00 0.00 -0.07 -1.83 0.00 0.00 177.26 175.36 1u7g h LEU 198 N 0.90 0.00 -3.53 3.41 3.38 -1.20 -3.22 115.31 115.05 1u7g h LEU 198 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1u7g h LEU 198 Cb 0.54 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1u7g h LEU 198 CO 0.00 0.20 0.00 -2.65 0.09 0.00 0.00 178.44 176.08 1u7g n PRO 199 N -3.86 0.00 0.00 1.13 -0.02 -1.26 -1.17 135.00 129.83 1u7g n PRO 199 Ca -0.02 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.46 1u7g n PRO 199 Cb 0.29 -1.30 0.00 0.00 -0.02 0.00 0.00 33.50 32.47 1u7g n PRO 199 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1u7g n VAL 201 N 1.50 0.00 -0.05 -1.45 0.31 -1.21 -0.70 118.33 116.73 1u7g n VAL 201 Ca 0.00 0.00 -0.09 0.00 -0.01 0.00 0.00 64.34 64.24 1u7g n VAL 201 Cb 0.00 0.00 -0.02 0.00 -0.91 0.00 0.00 33.84 32.91 1u7g n VAL 201 CO 0.00 0.00 0.00 0.15 -1.32 0.00 0.00 176.83 175.66 1u7g h PHE 202 N 0.00 0.04 -0.65 3.52 3.57 -1.47 0.22 116.94 122.18 1u7g h PHE 202 Ca 0.00 0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.43 1u7g h PHE 202 Cb 0.00 0.01 -0.03 0.00 2.79 0.00 0.00 35.95 38.73 1u7g h PHE 202 CO 0.00 0.00 0.10 1.79 -2.23 0.00 0.00 178.31 177.97 1u7g h THR 203 N 0.11 1.26 -0.74 4.41 1.35 -1.18 0.98 112.91 119.10 1u7g h THR 203 Ca 0.10 -1.04 -0.04 0.00 -0.55 0.00 0.00 66.41 64.87 1u7g h THR 203 Cb 0.10 0.67 -0.03 0.00 -1.73 0.00 0.00 68.15 67.16 1u7g h THR 203 CO -0.14 0.39 0.31 1.23 -0.25 0.00 0.00 175.52 177.06 1u7g h GLY 204 N 1.00 1.18 0.94 5.82 0.00 -1.73 -1.21 103.07 109.07 1u7g h GLY 204 Ca 0.20 -0.63 0.02 0.00 0.00 0.00 0.00 47.33 46.91 1u7g h GLY 204 CO 0.01 0.60 0.51 -0.84 0.00 0.00 0.00 176.54 176.83 1u7g h THR 205 N 1.06 1.16 -0.53 4.70 2.02 0.00 0.60 112.91 121.92 1u7g h THR 205 Ca 0.25 -0.35 -0.03 0.00 0.77 0.00 0.00 66.41 67.04 1u7g h THR 205 Cb 0.19 0.04 -0.02 0.00 -1.74 0.00 0.00 68.15 66.62 1u7g h THR 205 CO -0.02 0.19 0.19 0.00 0.37 0.00 0.00 175.52 176.25 1u7g h ALA 206 N 1.31 0.69 -0.45 6.16 0.00 -0.32 0.23 119.26 126.89 1u7g h ALA 206 Ca 0.30 -0.17 -0.12 0.00 0.00 0.00 0.00 54.91 54.93 1u7g h ALA 206 Cb -0.06 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 1u7g h ALA 206 CO -0.09 0.32 -0.18 0.82 0.00 0.00 0.00 179.25 180.12 1u7g h ILE 207 N 0.72 1.27 -0.61 0.00 2.04 -0.89 -0.39 117.51 119.65 1u7g h ILE 207 Ca 0.17 -1.33 0.05 0.00 1.00 0.00 0.00 64.86 64.75 1u7g h ILE 207 Cb 0.23 1.19 -0.05 0.00 -0.74 0.00 0.00 36.82 37.44 1u7g h ILE 207 CO -0.01 0.45 0.34 -0.07 0.00 0.00 0.00 178.15 178.86 1u7g h LEU 208 N 0.75 0.51 -0.09 1.44 3.38 -0.53 0.76 115.31 121.53 1u7g h LEU 208 Ca 0.10 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 1u7g h LEU 208 Cb 0.75 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.42 1u7g h LEU 208 CO 0.06 0.34 0.04 0.22 0.09 0.00 0.00 178.44 179.19 1u7g h TYR 209 N 0.64 0.13 -0.47 1.13 3.20 -0.06 0.76 116.97 122.30 1u7g h TYR 209 Ca 0.27 -0.01 -0.11 0.00 3.14 0.00 0.00 58.73 62.02 1u7g h TYR 209 Cb 0.14 -0.04 -0.02 0.00 1.54 0.00 0.00 36.73 38.36 1u7g h TYR 209 CO -0.08 0.21 -0.14 0.82 -1.64 0.00 0.00 178.16 177.33 1u7g h ILE 210 N 0.01 1.27 0.00 1.81 1.08 -0.88 -1.58 117.51 119.22 1u7g h ILE 210 Ca 0.03 -1.26 -0.05 0.00 -0.39 0.00 0.00 64.86 63.19 1u7g h ILE 210 Cb 0.13 1.06 -0.01 0.00 -3.07 0.00 0.00 36.82 34.93 1u7g h ILE 210 CO -0.00 0.44 -0.24 1.23 -0.69 0.00 0.00 178.15 178.88 1u7g h GLY 211 N 0.96 0.00 2.00 5.37 0.00 -0.71 -2.27 103.07 108.41 1u7g h GLY 211 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.45 1u7g h GLY 211 CO 0.05 0.00 0.00 -0.25 0.00 0.00 0.00 176.54 176.34 1u7g h TRP 212 N 0.00 0.00 -0.51 5.60 2.91 0.20 0.17 115.95 124.33 1u7g h TRP 212 Ca -0.00 0.00 -0.08 0.00 1.13 0.00 0.00 58.89 59.94 1u7g h TRP 212 Cb 0.54 0.00 -0.02 0.00 -0.51 0.00 0.00 29.16 29.17 1u7g h TRP 212 CO 0.00 0.00 0.01 0.74 -1.03 0.00 0.00 178.44 178.16 1u7g h PHE 213 N 0.00 0.90 -0.53 2.65 0.04 -1.35 0.27 116.94 118.91 1u7g h PHE 213 Ca 0.00 -0.13 -0.10 0.00 2.80 0.00 0.00 57.97 60.54 1u7g h PHE 213 Cb 0.34 -0.25 -0.02 0.00 2.20 0.00 0.00 35.95 38.23 1u7g h PHE 213 CO 0.00 0.82 -0.05 0.78 -0.60 0.00 0.00 178.31 179.26 1u7g h GLY 214 N 0.98 1.02 0.73 -1.45 0.00 -0.81 0.17 103.07 103.71 1u7g h GLY 214 Ca 0.15 -0.76 -0.01 0.00 0.00 0.00 0.00 47.33 46.71 1u7g h GLY 214 CO 0.02 0.70 -0.10 -2.75 0.00 0.00 0.00 176.54 174.41 1u7g h PHE 215 N 0.86 -0.26 0.00 5.60 3.57 -1.01 -0.42 116.94 125.29 1u7g h PHE 215 Ca 0.15 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.64 1u7g h PHE 215 Cb 0.58 0.09 0.00 0.00 2.79 0.00 0.00 35.95 39.41 1u7g h PHE 215 CO 0.04 0.03 -0.00 -0.91 -2.23 0.00 0.00 178.31 175.23 1u7g h ASN 216 N -0.55 -0.01 -0.27 0.41 2.35 -0.49 -3.07 115.58 113.95 1u7g h ASN 216 Ca -0.03 -0.67 -0.12 0.00 -0.55 0.00 0.00 56.30 54.94 1u7g h ASN 216 Cb 0.41 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.77 1u7g h ASN 216 CO 0.05 0.82 -0.25 0.00 -1.65 0.00 0.00 177.43 176.40 1u7g h ALA 217 N -0.32 0.86 0.00 -0.83 0.00 -1.09 -2.27 119.26 115.61 1u7g h ALA 217 Ca -0.00 -0.38 -0.02 0.00 0.00 0.00 0.00 54.91 54.51 1u7g h ALA 217 Cb 0.67 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 1u7g h ALA 217 CO 0.00 0.63 -0.08 0.78 0.00 0.00 0.00 179.25 180.59 1u7g h GLY 218 N 0.96 0.00 2.00 0.00 0.00 -1.09 -1.65 103.07 103.29 1u7g h GLY 218 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.42 1u7g h GLY 218 CO 0.06 0.00 0.00 1.44 0.00 0.00 0.00 176.54 178.04 1u7g n SER 219 N -3.95 0.19 0.22 0.19 7.64 -0.85 -0.76 113.62 116.31 1u7g n SER 219 Ca -0.02 0.56 0.09 0.00 1.01 0.00 0.00 58.87 60.51 1u7g n SER 219 Cb 0.17 -0.60 0.52 0.00 -1.01 0.00 0.00 64.21 63.29 1u7g n SER 219 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1u7g h ALA 220 N 2.26 1.18 0.00 -0.43 0.00 -1.43 -3.47 119.26 117.37 1u7g h ALA 220 Ca 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1u7g h ALA 220 Cb 0.18 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1u7g h ALA 220 CO 0.00 0.30 0.00 0.41 0.00 0.00 0.00 179.25 179.96 1u7g n GLY 221 N -0.26 0.55 3.56 0.00 0.00 0.07 -4.94 105.19 104.16 1u7g n GLY 221 Ca -0.01 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.90 1u7g n GLY 221 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1u7g s THR 222 N -2.29 0.00 -1.32 2.61 -1.32 -1.26 -4.59 115.64 107.47 1u7g s THR 222 Ca 0.00 0.00 -0.10 0.00 -1.21 0.00 0.00 61.69 60.38 1u7g s THR 222 Cb 0.00 -1.00 0.14 0.00 -1.51 0.00 0.00 72.50 70.13 1u7g s THR 222 CO 0.00 0.00 1.96 0.00 -2.21 0.00 0.00 174.62 174.37 1u7g n ALA 223 N 0.62 5.45 -2.82 11.08 0.00 -1.26 -4.38 120.51 129.20 1u7g n ALA 223 Ca -0.11 -4.23 0.00 0.00 0.00 0.00 0.00 53.44 49.10 1u7g n ALA 223 Cb 0.58 -3.08 0.00 0.00 0.00 0.00 0.00 19.45 16.95 1u7g n ALA 223 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1u7g n ASN 224 N 4.22 1.48 0.23 0.00 2.04 -1.26 -4.98 115.26 117.00 1u7g n ASN 224 Ca 0.43 0.00 0.14 0.00 -0.44 0.00 0.00 54.58 54.70 1u7g n ASN 224 Cb 0.36 0.00 0.34 0.00 -2.53 0.00 0.00 39.78 37.95 1u7g n ASN 224 CO 0.00 0.00 0.00 1.05 -0.44 0.00 0.00 177.26 177.87 1u7g h GLU 225 N 0.00 0.00 -0.01 -3.83 9.09 -1.99 -0.81 114.58 117.03 1u7g h GLU 225 Ca 0.00 0.00 -0.19 0.00 0.05 0.00 0.00 59.36 59.22 1u7g h GLU 225 Cb 0.00 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 27.11 1u7g h GLU 225 CO 0.00 0.00 -0.75 0.82 0.05 0.00 0.00 179.01 179.13 1u7g h ILE 226 N 0.00 1.37 -0.64 -1.06 1.08 -1.95 0.17 117.51 116.48 1u7g h ILE 226 Ca 0.00 -2.11 0.09 0.00 -0.39 0.00 0.00 64.86 62.45 1u7g h ILE 226 Cb 0.84 2.47 -0.07 0.00 -3.07 0.00 0.00 36.82 36.99 1u7g h ILE 226 CO 0.00 0.63 0.28 0.00 -0.69 0.00 0.00 178.15 178.37 1u7g h ALA 227 N 0.37 0.85 -0.55 1.87 0.00 -1.69 0.12 119.26 120.23 1u7g h ALA 227 Ca -0.09 0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.79 1u7g h ALA 227 Cb 1.44 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.21 1u7g h ALA 227 CO 0.15 -0.13 -0.03 0.00 0.00 0.00 0.00 179.25 179.24 1u7g h ALA 228 N 1.41 0.75 -0.40 0.00 0.00 -0.98 0.14 119.26 120.18 1u7g h ALA 228 Ca 0.32 -0.32 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 1u7g h ALA 228 Cb 0.36 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1u7g h ALA 228 CO -0.28 0.60 0.18 1.25 0.00 0.00 0.00 179.25 181.00 1u7g h LEU 229 N 0.87 0.53 -1.00 0.00 5.85 -0.56 -0.72 115.31 120.29 1u7g h LEU 229 Ca 0.15 -0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 1u7g h LEU 229 Cb 0.58 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 41.43 1u7g h LEU 229 CO 0.03 0.52 0.52 0.00 -0.34 0.00 0.00 178.44 179.18 1u7g h ALA 230 N 1.03 1.24 0.46 1.25 0.00 -0.31 0.12 119.26 123.06 1u7g h ALA 230 Ca 0.14 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1u7g h ALA 230 Cb 0.14 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.57 1u7g h ALA 230 CO -0.02 0.64 -0.22 0.35 0.00 0.00 0.00 179.25 180.00 1u7g h PHE 231 N 1.24 -0.58 -0.73 0.00 3.04 -0.34 -0.04 116.94 119.53 1u7g h PHE 231 Ca 0.32 -0.01 0.00 0.00 3.98 0.00 0.00 57.97 62.26 1u7g h PHE 231 Cb -0.03 0.19 -0.04 0.00 2.56 0.00 0.00 35.95 38.63 1u7g h PHE 231 CO 0.01 -0.31 0.46 0.28 -2.02 0.00 0.00 178.31 176.73 1u7g h VAL 232 N -0.72 1.20 0.00 1.41 2.07 -0.67 -1.80 116.25 117.74 1u7g h VAL 232 Ca -0.06 -0.39 -0.05 0.00 0.82 0.00 0.00 66.70 67.01 1u7g h VAL 232 Cb 0.52 0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 30.44 1u7g h VAL 232 CO 0.10 0.20 -0.24 0.78 0.02 0.00 0.00 177.57 178.44 1u7g h ASN 233 N 0.99 0.00 -0.32 0.57 2.35 -0.63 0.09 115.58 118.63 1u7g h ASN 233 Ca 0.26 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.92 1u7g h ASN 233 Cb -0.08 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.29 1u7g h ASN 233 CO -0.05 0.24 -0.16 0.74 -1.65 0.00 0.00 177.43 176.54 1u7g h THR 234 N 0.00 1.29 -0.04 2.81 2.02 -0.22 0.81 112.91 119.58 1u7g h THR 234 Ca -0.00 -1.28 0.01 0.00 0.77 0.00 0.00 66.41 65.92 1u7g h THR 234 Cb 0.49 1.43 -0.01 0.00 -1.74 0.00 0.00 68.15 68.31 1u7g h THR 234 CO 0.03 0.41 -0.04 0.58 0.37 0.00 0.00 175.52 176.87 1u7g h VAL 235 N 0.44 0.88 -0.17 3.16 2.07 -0.61 -1.74 116.25 120.27 1u7g h VAL 235 Ca 0.07 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.52 1u7g h VAL 235 Cb 0.70 0.88 -0.00 0.00 -1.52 0.00 0.00 31.29 31.34 1u7g h VAL 235 CO 0.05 0.00 -0.18 0.58 0.02 0.00 0.00 177.57 178.04 1u7g h VAL 236 N -0.05 1.34 -0.48 2.57 2.07 -0.92 -2.05 116.25 118.73 1u7g h VAL 236 Ca 0.03 -1.35 -0.09 0.00 0.82 0.00 0.00 66.70 66.11 1u7g h VAL 236 Cb 0.10 1.83 -0.02 0.00 -1.52 0.00 0.00 31.29 31.68 1u7g h VAL 236 CO -0.08 0.40 -0.08 0.00 0.02 0.00 0.00 177.57 177.84 1u7g h ALA 237 N 0.62 0.95 -0.44 1.67 0.00 -0.85 0.12 119.26 121.34 1u7g h ALA 237 Ca 0.03 -0.32 -0.04 0.00 0.00 0.00 0.00 54.91 54.58 1u7g h ALA 237 Cb 0.73 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 1u7g h ALA 237 CO 0.04 0.62 0.12 1.15 0.00 0.00 0.00 179.25 181.19 1u7g h THR 238 N 0.77 1.23 -0.54 0.00 2.02 -1.26 -0.15 112.91 114.99 1u7g h THR 238 Ca 0.13 -0.77 -0.04 0.00 0.77 0.00 0.00 66.41 66.50 1u7g h THR 238 Cb 0.59 0.89 -0.02 0.00 -1.74 0.00 0.00 68.15 67.87 1u7g h THR 238 CO 0.04 0.27 0.18 0.00 0.37 0.00 0.00 175.52 176.38 1u7g h ALA 239 N 0.98 0.71 -0.34 6.16 0.00 -1.05 -0.02 119.26 125.70 1u7g h ALA 239 Ca 0.14 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 1u7g h ALA 239 Cb 0.29 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1u7g h ALA 239 CO -0.00 0.36 -0.08 0.00 0.00 0.00 0.00 179.25 179.53 1u7g h ALA 240 N 1.04 1.22 0.02 0.00 0.00 -0.57 -1.60 119.26 119.36 1u7g h ALA 240 Ca 0.17 -0.26 -0.22 0.00 0.00 0.00 0.00 54.91 54.61 1u7g h ALA 240 Cb 0.27 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 1u7g h ALA 240 CO -0.01 0.51 -0.94 0.00 0.00 0.00 0.00 179.25 178.80 1u7g h ALA 241 N 1.39 0.41 -0.27 0.00 0.00 -0.53 0.38 119.26 120.63 1u7g h ALA 241 Ca 0.10 -0.74 0.03 0.00 0.00 0.00 0.00 54.91 54.30 1u7g h ALA 241 Cb 0.46 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 1u7g h ALA 241 CO 0.02 0.89 0.09 0.82 0.00 0.00 0.00 179.25 181.08 1u7g h ILE 242 N 0.15 0.93 -0.46 0.00 2.04 -0.79 0.12 117.51 119.50 1u7g h ILE 242 Ca -0.07 -0.07 -0.10 0.00 1.00 0.00 0.00 64.86 65.62 1u7g h ILE 242 Cb 1.59 0.70 -0.01 0.00 -0.74 0.00 0.00 36.82 38.36 1u7g h ILE 242 CO 0.15 0.04 -0.12 -0.07 0.00 0.00 0.00 178.15 178.15 1u7g h LEU 243 N 0.21 0.89 -0.40 1.44 3.38 -1.13 -0.32 115.31 119.38 1u7g h LEU 243 Ca 0.12 -0.36 -0.02 0.00 0.09 0.00 0.00 57.88 57.70 1u7g h LEU 243 Cb 0.09 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 1u7g h LEU 243 CO -0.12 1.05 0.17 1.23 0.09 0.00 0.00 178.44 180.86 1u7g h GLY 244 N 0.72 0.63 0.92 0.83 0.00 -0.00 0.16 103.07 106.34 1u7g h GLY 244 Ca 0.11 -0.34 -0.02 0.00 0.00 0.00 0.00 47.33 47.09 1u7g h GLY 244 CO 0.05 0.32 -0.17 -0.25 0.00 0.00 0.00 176.54 176.48 1u7g h TRP 245 N 0.50 -0.45 -0.30 5.60 2.91 -0.67 -0.32 115.95 123.23 1u7g h TRP 245 Ca 0.13 -0.01 -0.01 0.00 1.13 0.00 0.00 58.89 60.14 1u7g h TRP 245 Cb 0.17 0.15 -0.02 0.00 -0.51 0.00 0.00 29.16 28.95 1u7g h TRP 245 CO -0.00 -0.23 0.15 0.82 -1.03 0.00 0.00 178.44 178.15 1u7g h ILE 246 N -0.57 1.10 -0.19 2.65 1.08 -0.95 0.21 117.51 120.84 1u7g h ILE 246 Ca -0.05 -0.27 -0.02 0.00 -0.39 0.00 0.00 64.86 64.13 1u7g h ILE 246 Cb 0.43 0.71 -0.01 0.00 -3.07 0.00 0.00 36.82 34.88 1u7g h ILE 246 CO 0.08 0.11 0.03 0.15 -0.69 0.00 0.00 178.15 177.84 1u7g h PHE 247 N 0.41 0.33 -0.61 1.37 3.57 -0.77 0.23 116.94 121.47 1u7g h PHE 247 Ca 0.11 -0.05 -0.04 0.00 3.53 0.00 0.00 57.97 61.52 1u7g h PHE 247 Cb 0.03 -0.09 -0.03 0.00 2.79 0.00 0.00 35.95 38.65 1u7g h PHE 247 CO 0.00 0.46 0.24 0.78 -2.23 0.00 0.00 178.31 177.56 1u7g h GLY 248 N 0.11 0.99 1.00 2.40 0.00 -0.35 -0.72 103.07 106.50 1u7g h GLY 248 Ca 0.06 -0.54 -0.05 0.00 0.00 0.00 0.00 47.33 46.79 1u7g h GLY 248 CO 0.00 0.51 0.15 -2.09 0.00 0.00 0.00 176.54 175.11 1u7g h GLU 249 N 0.85 0.89 -0.33 4.80 4.81 -0.50 0.27 114.58 125.37 1u7g h GLU 249 Ca 0.20 -0.21 -0.04 0.00 -0.13 0.00 0.00 59.36 59.18 1u7g h GLU 249 Cb 0.22 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.46 1u7g h GLU 249 CO -0.02 0.82 0.02 2.35 -0.73 0.00 0.00 179.01 181.46 1u7g h TRP 250 N 0.79 0.52 -0.05 0.92 2.91 -0.16 0.56 115.95 121.44 1u7g h TRP 250 Ca 0.18 -0.04 -0.23 0.00 1.13 0.00 0.00 58.89 59.92 1u7g h TRP 250 Cb 0.32 -0.15 0.01 0.00 -0.51 0.00 0.00 29.16 28.83 1u7g h TRP 250 CO 0.02 0.50 -0.91 0.00 -1.03 0.00 0.00 178.44 177.02 1u7g h ALA 251 N 1.54 0.32 0.19 2.65 0.00 -0.73 0.91 119.26 124.14 1u7g h ALA 251 Ca 0.11 -0.67 -0.29 0.00 0.00 0.00 0.00 54.91 54.06 1u7g h ALA 251 Cb 0.29 -0.00 0.03 0.00 0.00 0.00 0.00 17.79 18.11 1u7g h ALA 251 CO 0.01 0.74 -1.27 1.25 0.00 0.00 0.00 179.25 179.98 1u7g h LEU 252 N 0.36 0.79 0.00 0.00 5.85 0.34 -3.39 115.31 119.26 1u7g h LEU 252 Ca -0.08 -0.89 0.00 0.00 0.84 0.00 0.00 57.88 57.75 1u7g h LEU 252 Cb 1.54 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 42.31 1u7g h LEU 252 CO 0.17 1.62 -0.80 0.54 -0.34 0.00 0.00 178.44 179.63 1u7g n ARG 253 N -3.83 2.62 -0.42 1.25 5.12 0.19 -5.01 116.66 116.57 1u7g n ARG 253 Ca -0.15 -0.03 0.00 0.00 -1.93 0.00 0.00 57.85 55.74 1u7g n ARG 253 Cb 1.01 -1.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.31 1u7g n ARG 253 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1u7g n GLY 254 N 1.58 0.83 3.58 -0.13 0.00 0.31 -4.99 105.19 106.37 1u7g n GLY 254 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 1u7g n GLY 254 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1u7g s LEU 255 N 0.00 -0.59 0.77 0.99 0.05 -1.24 -4.95 118.68 113.71 1u7g s LEU 255 Ca 0.00 0.86 -0.11 0.00 0.05 0.00 0.00 54.13 54.93 1u7g s LEU 255 Cb 0.00 2.27 0.05 0.00 -2.05 0.00 0.00 46.19 46.46 1u7g s LEU 255 CO 0.00 -0.38 1.08 -2.16 -0.55 0.00 0.00 176.35 174.34 1u7g s PRO 256 N -0.53 2.32 0.14 1.48 0.04 -1.26 -4.15 135.00 133.04 1u7g s PRO 256 Ca -0.04 0.89 0.02 0.00 0.04 0.00 0.00 61.00 61.91 1u7g s PRO 256 Cb -0.02 -1.93 -0.04 0.00 0.04 0.00 0.00 34.50 32.55 1u7g s PRO 256 CO 0.03 -1.52 -0.04 -1.54 0.04 0.00 0.00 177.00 173.97 1u7g s SER 257 N -3.69 1.30 0.16 6.66 1.04 -1.26 -5.02 113.70 112.89 1u7g s SER 257 Ca 0.60 -1.08 -0.15 0.00 0.48 0.00 0.00 55.95 55.80 1u7g s SER 257 Cb -0.15 0.08 0.03 0.00 0.10 0.00 0.00 66.02 66.09 1u7g s SER 257 CO 0.55 -0.48 1.78 0.25 0.98 0.00 0.00 173.24 176.32 1u7g h LEU 258 N 2.81 0.58 -1.37 2.42 5.85 -1.99 0.10 115.31 123.71 1u7g h LEU 258 Ca -0.36 -0.07 -0.04 0.00 0.84 0.00 0.00 57.88 58.24 1u7g h LEU 258 Cb 1.19 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 42.06 1u7g h LEU 258 CO 0.64 0.48 -0.02 -0.07 -0.34 0.00 0.00 178.44 179.13 1u7g h LEU 259 N 0.63 0.36 -0.53 2.25 3.38 -1.96 -0.20 115.31 119.24 1u7g h LEU 259 Ca 0.17 -0.06 -0.06 0.00 0.09 0.00 0.00 57.88 58.02 1u7g h LEU 259 Cb 0.02 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 1u7g h LEU 259 CO -0.03 0.44 0.09 1.23 0.09 0.00 0.00 178.44 180.26 1u7g h GLY 260 N 0.73 0.94 0.90 0.83 0.00 -1.70 0.14 103.07 104.92 1u7g h GLY 260 Ca 0.08 -0.63 -0.02 0.00 0.00 0.00 0.00 47.33 46.77 1u7g h GLY 260 CO 0.01 0.58 0.09 0.00 0.00 0.00 0.00 176.54 177.23 1u7g h ALA 261 N 0.99 0.34 -0.66 3.60 0.00 -0.16 0.15 119.26 123.51 1u7g h ALA 261 Ca 0.16 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 1u7g h ALA 261 Cb 0.40 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 1u7g h ALA 261 CO 0.01 -0.05 0.16 0.00 0.00 0.00 0.00 179.25 179.36 1u7g h SER 263 N 0.99 0.82 -0.80 0.00 0.02 -0.45 -1.13 113.55 113.01 1u7g h SER 263 Ca 0.21 -0.16 -0.05 0.00 -0.84 0.00 0.00 61.79 60.95 1u7g h SER 263 Cb 0.37 -0.22 -0.04 0.00 0.14 0.00 0.00 62.40 62.66 1u7g h SER 263 CO 0.00 0.82 0.31 1.23 -1.14 0.00 0.00 176.83 178.06 1u7g h GLY 264 N 0.99 1.29 0.85 -3.77 0.00 -0.40 0.26 103.07 102.30 1u7g h GLY 264 Ca 0.18 -0.71 0.02 0.00 0.00 0.00 0.00 47.33 46.82 1u7g h GLY 264 CO 0.00 0.67 -0.00 0.00 0.00 0.00 0.00 176.54 177.21 1u7g h ALA 265 N 1.17 0.08 -0.88 3.60 0.00 -0.54 -0.81 119.26 121.88 1u7g h ALA 265 Ca 0.27 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.18 1u7g h ALA 265 Cb 0.23 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 1u7g h ALA 265 CO -0.02 -0.46 0.47 0.82 0.00 0.00 0.00 179.25 180.06 1u7g h ILE 266 N 0.03 1.26 -0.25 0.00 1.08 -0.72 -0.62 117.51 118.29 1u7g h ILE 266 Ca 0.04 -0.65 0.00 0.00 -0.39 0.00 0.00 64.86 63.87 1u7g h ILE 266 Cb 0.05 0.07 -0.01 0.00 -3.07 0.00 0.00 36.82 33.86 1u7g h ILE 266 CO -0.08 0.29 0.16 0.00 -0.69 0.00 0.00 178.15 177.83 1u7g h ALA 267 N 1.28 0.32 -0.28 1.87 0.00 0.16 0.34 119.26 122.94 1u7g h ALA 267 Ca 0.31 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 55.07 1u7g h ALA 267 Cb 0.04 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1u7g h ALA 267 CO -0.05 -0.20 -0.32 0.78 0.00 0.00 0.00 179.25 179.47 1u7g h GLY 268 N 0.32 0.64 0.97 0.00 0.00 -0.61 0.12 103.07 104.52 1u7g h GLY 268 Ca 0.09 -0.58 -0.03 0.00 0.00 0.00 0.00 47.33 46.81 1u7g h GLY 268 CO -0.02 0.53 0.21 1.41 0.00 0.00 0.00 176.54 178.67 1u7g h LEU 269 N 0.50 0.68 -0.17 3.11 3.38 -0.69 0.58 115.31 122.72 1u7g h LEU 269 Ca 0.06 -0.16 -0.04 0.00 0.09 0.00 0.00 57.88 57.83 1u7g h LEU 269 Cb 0.80 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 1u7g h LEU 269 CO 0.07 0.66 -0.04 0.58 0.09 0.00 0.00 178.44 179.80 1u7g h VAL 270 N 0.67 1.28 -0.50 1.22 2.07 -0.19 -2.15 116.25 118.65 1u7g h VAL 270 Ca 0.17 -0.99 -0.03 0.00 0.82 0.00 0.00 66.70 66.67 1u7g h VAL 270 Cb 0.18 1.59 -0.02 0.00 -1.52 0.00 0.00 31.29 31.52 1u7g h VAL 270 CO -0.01 0.29 0.17 1.23 0.02 0.00 0.00 177.57 179.27 1u7g h GLY 271 N 0.04 0.77 1.44 2.17 0.00 -0.47 -2.10 103.07 104.93 1u7g h GLY 271 Ca 0.04 -0.40 0.00 0.00 0.00 0.00 0.00 47.33 46.98 1u7g h GLY 271 CO 0.02 0.37 -0.32 1.55 0.00 0.00 0.00 176.54 178.16 1u7g n VAL 272 N -4.33 0.13 0.02 4.60 3.14 0.17 -4.17 118.33 117.88 1u7g n VAL 272 Ca 0.04 -0.08 -0.10 0.00 -2.96 0.00 0.00 64.34 61.24 1u7g n VAL 272 Cb 0.17 -0.14 -0.03 0.00 -1.06 0.00 0.00 33.84 32.78 1u7g n VAL 272 CO 0.00 0.00 0.00 0.74 -6.46 0.00 0.00 176.83 171.11 1u7g h THR 273 N 0.00 0.50 0.00 1.55 2.02 -0.68 0.38 112.91 116.67 1u7g h THR 273 Ca 0.00 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.14 1u7g h THR 273 Cb 0.57 0.50 -0.01 0.00 -1.74 0.00 0.00 68.15 67.47 1u7g h THR 273 CO 0.00 0.00 -0.21 1.55 0.37 0.00 0.00 175.52 177.23 1u7g h PRO 274 N -0.28 0.00 0.00 6.66 0.13 -1.74 -1.61 132.00 135.16 1u7g h PRO 274 Ca 0.09 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.22 1u7g h PRO 274 Cb 0.40 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.53 1u7g h PRO 274 CO -0.25 0.21 -1.69 0.00 -0.23 0.00 0.00 178.00 176.04 1u7g n ALA 275 N -2.26 2.71 0.03 -0.56 0.00 -0.36 0.24 120.51 120.31 1u7g n ALA 275 Ca -0.01 -0.43 0.02 0.00 0.00 0.00 0.00 53.44 53.02 1u7g n ALA 275 Cb 0.37 -0.86 0.38 0.00 0.00 0.00 0.00 19.45 19.34 1u7g n ALA 275 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1u7g n GLY 277 N -1.16 -0.46 0.05 0.00 0.00 -1.26 -3.80 105.19 98.56 1u7g n GLY 277 Ca 0.02 -0.37 0.02 0.00 0.00 0.00 0.00 46.02 45.69 1u7g n GLY 277 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1u7g n TYR 278 N -0.39 0.00 -4.43 1.61 4.01 0.37 -4.85 117.16 113.48 1u7g n TYR 278 Ca 0.17 0.00 -0.26 0.00 -0.16 0.00 0.00 57.90 57.66 1u7g n TYR 278 Cb 0.30 0.00 -0.09 0.00 -0.31 0.00 0.00 39.34 39.24 1u7g n TYR 278 CO 0.00 0.00 0.00 0.96 -0.46 0.00 0.00 176.86 177.36 1u7g s ILE 279 N -1.14 2.36 0.67 -0.72 -4.36 -0.99 -0.35 121.20 116.67 1u7g s ILE 279 Ca 0.02 -2.01 -0.01 0.00 -0.26 0.00 0.00 60.65 58.40 1u7g s ILE 279 Cb 0.03 -2.82 0.09 0.00 1.25 0.00 0.00 42.46 41.02 1u7g s ILE 279 CO 0.14 -0.14 0.93 -0.83 0.24 0.00 0.00 174.94 175.28 1u7g s GLY 280 N -3.71 1.78 0.32 6.27 0.00 -1.09 -4.79 107.32 106.09 1u7g s GLY 280 Ca 0.35 -1.56 0.08 0.00 0.00 0.00 0.00 44.72 43.59 1u7g s GLY 280 CO 0.19 -1.08 1.75 -2.08 0.00 0.00 0.00 173.10 171.87 1u7g h VAL 281 N -0.35 1.29 -0.66 1.40 2.07 -1.91 0.56 116.25 118.65 1u7g h VAL 281 Ca -0.39 -1.40 -0.04 0.00 0.82 0.00 0.00 66.70 65.69 1u7g h VAL 281 Cb 1.28 1.63 -0.03 0.00 -1.52 0.00 0.00 31.29 32.65 1u7g h VAL 281 CO 0.45 0.42 0.25 1.23 0.02 0.00 0.00 177.57 179.93 1u7g h GLY 282 N 1.16 1.04 1.41 2.17 0.00 -1.94 -0.70 103.07 106.21 1u7g h GLY 282 Ca 0.02 -0.56 -0.12 0.00 0.00 0.00 0.00 47.33 46.68 1u7g h GLY 282 CO 0.06 0.52 -0.27 -1.33 0.00 0.00 0.00 176.54 175.53 1u7g h GLY 283 N 1.04 0.73 1.09 4.60 0.00 -1.43 -1.09 103.07 108.02 1u7g h GLY 283 Ca 0.22 -0.64 -0.04 0.00 0.00 0.00 0.00 47.33 46.87 1u7g h GLY 283 CO -0.02 0.58 0.34 0.00 0.00 0.00 0.00 176.54 177.45 1u7g h ALA 284 N 1.12 1.11 -0.10 3.60 0.00 -0.32 0.28 119.26 124.94 1u7g h ALA 284 Ca 0.08 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 1u7g h ALA 284 Cb 0.76 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 1u7g h ALA 284 CO 0.06 0.65 0.05 1.25 0.00 0.00 0.00 179.25 181.26 1u7g h LEU 285 N 1.14 0.14 -0.43 0.00 6.46 -0.76 0.13 115.31 121.98 1u7g h LEU 285 Ca 0.27 -0.11 -0.08 0.00 -0.12 0.00 0.00 57.88 57.83 1u7g h LEU 285 Cb 0.18 -0.03 -0.01 0.00 -0.73 0.00 0.00 40.66 40.06 1u7g h LEU 285 CO -0.03 0.21 -0.05 0.40 -0.62 0.00 0.00 178.44 178.35 1u7g h ILE 286 N 0.05 1.27 -0.91 4.05 2.04 -0.83 -0.25 117.51 122.93 1u7g h ILE 286 Ca 0.04 -1.12 -0.01 0.00 1.00 0.00 0.00 64.86 64.77 1u7g h ILE 286 Cb 0.11 1.12 -0.04 0.00 -0.74 0.00 0.00 36.82 37.26 1u7g h ILE 286 CO -0.00 0.38 0.54 0.40 0.00 0.00 0.00 178.15 179.47 1u7g h ILE 287 N 0.63 1.25 -0.30 -0.67 2.04 -0.36 -0.86 117.51 119.25 1u7g h ILE 287 Ca 0.12 -0.56 -0.03 0.00 1.00 0.00 0.00 64.86 65.39 1u7g h ILE 287 Cb 0.56 -0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 36.61 1u7g h ILE 287 CO 0.03 0.27 0.07 1.23 0.00 0.00 0.00 178.15 179.74 1u7g h GLY 288 N 1.26 0.52 0.96 5.37 0.00 -0.28 0.34 103.07 111.24 1u7g h GLY 288 Ca 0.33 -0.33 0.01 0.00 0.00 0.00 0.00 47.33 47.33 1u7g h GLY 288 CO -0.06 0.31 0.18 -2.08 0.00 0.00 0.00 176.54 174.89 1u7g h VAL 289 N 0.31 1.05 -0.71 4.60 2.07 -0.80 0.18 116.25 122.95 1u7g h VAL 289 Ca 0.09 -0.13 -0.03 0.00 0.82 0.00 0.00 66.70 67.45 1u7g h VAL 289 Cb 0.31 0.64 -0.03 0.00 -1.52 0.00 0.00 31.29 30.68 1u7g h VAL 289 CO 0.00 0.07 0.31 0.58 0.02 0.00 0.00 177.57 178.55 1u7g h VAL 290 N 0.38 1.24 -0.59 2.57 2.07 -0.97 -1.24 116.25 119.70 1u7g h VAL 290 Ca 0.11 -0.72 -0.06 0.00 0.82 0.00 0.00 66.70 66.85 1u7g h VAL 290 Cb -0.02 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.12 1u7g h VAL 290 CO -0.04 0.29 0.12 0.00 0.02 0.00 0.00 177.57 177.96 1u7g h ALA 291 N 1.15 0.79 -0.53 1.67 0.00 0.11 0.35 119.26 122.79 1u7g h ALA 291 Ca 0.24 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1u7g h ALA 291 Cb 0.17 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1u7g h ALA 291 CO -0.02 0.52 0.24 0.78 0.00 0.00 0.00 179.25 180.76 1u7g h GLY 292 N 0.87 0.84 1.30 0.00 0.00 -0.25 0.15 103.07 105.99 1u7g h GLY 292 Ca 0.18 -0.43 -0.12 0.00 0.00 0.00 0.00 47.33 46.96 1u7g h GLY 292 CO 0.01 0.41 -0.22 1.41 0.00 0.00 0.00 176.54 178.15 1u7g h LEU 293 N 0.72 0.82 -0.76 3.11 3.38 -0.94 -1.61 115.31 120.03 1u7g h LEU 293 Ca 0.18 -0.30 -0.09 0.00 0.09 0.00 0.00 57.88 57.76 1u7g h LEU 293 Cb 0.15 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 1u7g h LEU 293 CO -0.02 1.01 -0.06 0.00 0.09 0.00 0.00 178.44 179.46 1u7g h ALA 294 N 1.05 0.95 -0.46 1.53 0.00 -0.11 0.16 119.26 122.38 1u7g h ALA 294 Ca 0.10 -0.31 -0.06 0.00 0.00 0.00 0.00 54.91 54.64 1u7g h ALA 294 Cb 0.74 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 1u7g h ALA 294 CO 0.06 0.62 0.07 0.78 0.00 0.00 0.00 179.25 180.78 1u7g h GLY 295 N 0.98 0.83 1.00 0.00 0.00 -0.54 0.19 103.07 105.53 1u7g h GLY 295 Ca 0.14 -0.56 0.00 0.00 0.00 0.00 0.00 47.33 46.92 1u7g h GLY 295 CO 0.03 0.51 0.36 -2.00 0.00 0.00 0.00 176.54 175.44 1u7g h LEU 296 N 0.64 0.65 -0.58 3.11 5.85 -1.01 -0.00 115.31 123.96 1u7g h LEU 296 Ca 0.14 -0.04 0.05 0.00 0.84 0.00 0.00 57.88 58.88 1u7g h LEU 296 Cb 0.39 -0.16 -0.05 0.00 0.37 0.00 0.00 40.66 41.21 1u7g h LEU 296 CO 0.01 0.49 0.30 -0.25 -0.34 0.00 0.00 178.44 178.66 1u7g h TRP 297 N 0.75 0.55 -0.59 1.25 7.01 -0.70 -1.18 115.95 123.05 1u7g h TRP 297 Ca 0.20 0.02 -0.06 0.00 2.11 0.00 0.00 58.89 61.17 1u7g h TRP 297 Cb -0.06 -0.16 -0.02 0.00 -2.10 0.00 0.00 29.16 26.82 1u7g h TRP 297 CO -0.03 0.26 0.14 0.78 -2.79 0.00 0.00 178.44 176.80 1u7g h GLY 298 N 0.57 1.02 2.00 2.65 0.00 0.16 -2.21 103.07 107.26 1u7g h GLY 298 Ca 0.26 -0.64 -0.09 0.00 0.00 0.00 0.00 47.33 46.86 1u7g h GLY 298 CO -0.18 0.60 -0.42 -0.39 0.00 0.00 0.00 176.54 176.15 1u7g h VAL 299 N 0.85 0.86 0.00 4.60 -1.51 -0.86 0.96 116.25 121.15 1u7g h VAL 299 Ca 0.18 -1.76 0.00 0.00 -1.23 0.00 0.00 66.70 63.90 1u7g h VAL 299 Cb 0.35 2.10 0.00 0.00 -2.13 0.00 0.00 31.29 31.61 1u7g h VAL 299 CO 0.00 0.41 0.00 0.41 -1.23 0.00 0.00 177.57 177.16 1u7g n THR 300 N -3.41 0.16 0.00 7.19 -1.04 -0.46 -0.73 114.28 115.99 1u7g n THR 300 Ca 0.01 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.02 1u7g n THR 300 Cb 0.59 -0.40 0.00 0.00 -1.82 0.00 0.00 70.33 68.70 1u7g n THR 300 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1u7g n LEU 302 N 0.53 0.00 0.03 -4.42 4.77 0.33 -2.33 117.00 115.90 1u7g n LEU 302 Ca 0.00 0.00 0.05 0.00 -0.03 0.00 0.00 56.01 56.03 1u7g n LEU 302 Cb 0.13 0.00 0.46 0.00 -2.33 0.00 0.00 43.42 41.69 1u7g n LEU 302 CO 0.00 0.00 1.15 0.50 -1.33 0.00 0.00 177.39 177.71 1u7g h LYS 303 N 0.00 0.45 -0.13 3.23 1.63 -1.19 0.39 116.57 120.95 1u7g h LYS 303 Ca 0.00 -0.03 -0.09 0.00 -0.85 0.00 0.00 60.65 59.68 1u7g h LYS 303 Cb 0.00 -0.10 -0.01 0.00 -0.60 0.00 0.00 32.23 31.52 1u7g h LYS 303 CO 0.00 0.30 -0.34 0.00 -3.45 0.00 0.00 179.45 175.95 1u7g h ARG 304 N 0.46 0.26 0.04 1.90 3.08 -1.73 1.04 114.38 119.43 1u7g h ARG 304 Ca 0.14 -0.11 -0.13 0.00 0.07 0.00 0.00 59.98 59.96 1u7g h ARG 304 Cb 0.01 -0.01 0.01 0.00 0.08 0.00 0.00 29.97 30.06 1u7g h ARG 304 CO -0.03 0.58 -0.53 -0.07 -1.07 0.00 0.00 179.97 178.85 1u7g h LEU 305 N 0.23 0.39 0.05 3.04 3.38 -1.56 -3.39 115.31 117.46 1u7g h LEU 305 Ca 0.03 -0.84 -0.34 0.00 0.09 0.00 0.00 57.88 56.82 1u7g h LEU 305 Cb 0.72 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.30 1u7g h LEU 305 CO 0.05 1.19 -2.00 -0.11 0.09 0.00 0.00 178.44 177.66 1u7g n LEU 306 N -4.30 1.80 0.00 1.67 7.94 0.13 -4.97 117.00 119.28 1u7g n LEU 306 Ca -0.11 0.22 0.00 0.00 -1.11 0.00 0.00 56.01 55.00 1u7g n LEU 306 Cb 0.66 -0.48 0.00 0.00 0.53 0.00 0.00 43.42 44.12 1u7g n LEU 306 CO 0.44 0.67 0.00 -1.14 -1.11 0.00 0.00 177.39 176.25 1u7g n ARG 307 N -3.23 -0.94 -4.33 1.96 0.00 0.36 -4.94 116.66 105.54 1u7g n ARG 307 Ca -0.29 0.23 -0.17 0.00 -0.00 0.00 0.00 57.85 57.62 1u7g n ARG 307 Cb 1.05 -4.54 -0.10 0.00 0.00 0.00 0.00 32.46 28.88 1u7g n ARG 307 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 1u7g s VAL 308 N -1.22 1.33 0.24 5.15 0.11 -1.26 -5.04 120.40 119.71 1u7g s VAL 308 Ca 0.00 -2.09 -0.30 0.00 -2.93 0.00 0.00 61.98 56.66 1u7g s VAL 308 Cb 0.00 -2.17 -0.09 0.00 -1.53 0.00 0.00 36.38 32.59 1u7g s VAL 308 CO 0.00 -0.49 1.14 -1.81 -3.33 0.00 0.00 175.10 170.61 1u7g s ASP 309 N -3.30 7.18 -0.06 3.54 1.01 -0.32 -4.84 116.67 119.89 1u7g s ASP 309 Ca 0.24 2.26 -0.10 0.00 0.71 0.00 0.00 52.55 55.66 1u7g s ASP 309 Cb 0.03 -2.62 0.02 0.00 1.01 0.00 0.00 42.92 41.36 1u7g s ASP 309 CO 0.07 -0.25 0.25 -0.62 0.21 0.00 0.00 175.17 174.82 1u7g s ASP 310 N -0.44 -0.19 0.58 0.27 -1.08 -1.26 -4.76 116.67 109.79 1u7g s ASP 310 Ca 0.48 0.26 0.28 0.00 -0.52 0.00 0.00 52.55 53.05 1u7g s ASP 310 Cb -0.32 0.41 1.76 0.00 -1.46 0.00 0.00 42.92 43.30 1u7g s ASP 310 CO 0.40 -0.24 2.24 1.55 0.52 0.00 0.00 175.17 179.64 1u7g h PRO 311 N 4.98 0.00 0.00 4.34 0.13 -1.87 0.41 132.00 139.99 1u7g h PRO 311 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1u7g h PRO 311 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1u7g h PRO 311 CO 0.37 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.14 1u7g h ASP 313 N 0.00 0.00 -0.94 0.00 3.45 -1.31 -1.25 116.42 116.37 1u7g h ASP 313 Ca 0.00 0.00 0.18 0.00 0.43 0.00 0.00 57.03 57.64 1u7g h ASP 313 Cb 0.12 0.00 -0.08 0.00 -0.56 0.00 0.00 39.33 38.81 1u7g h ASP 313 CO 0.00 0.00 0.60 0.58 -1.57 0.00 0.00 179.24 178.85 1u7g h VAL 314 N 0.00 0.74 0.00 -1.35 2.07 -1.37 0.22 116.25 116.56 1u7g h VAL 314 Ca 0.09 -0.21 -0.02 0.00 0.82 0.00 0.00 66.70 67.38 1u7g h VAL 314 Cb 0.41 0.07 -0.00 0.00 -1.52 0.00 0.00 31.29 30.25 1u7g h VAL 314 CO -0.00 0.11 -0.12 -0.26 0.02 0.00 0.00 177.57 177.32 1u7g h PHE 315 N 0.61 0.00 -0.23 1.57 0.05 -1.43 -0.45 116.94 117.06 1u7g h PHE 315 Ca 0.50 0.00 -0.10 0.00 3.82 0.00 0.00 57.97 62.19 1u7g h PHE 315 Cb 0.94 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 38.88 1u7g h PHE 315 CO -0.00 0.12 -0.29 0.78 -0.18 0.00 0.00 178.31 178.74 1u7g h GLY 316 N 1.46 0.50 0.36 -1.45 0.00 -0.66 0.29 103.07 103.56 1u7g h GLY 316 Ca -0.00 -0.42 -0.00 0.00 0.00 0.00 0.00 47.33 46.90 1u7g h GLY 316 CO 0.02 0.38 -0.01 -2.08 0.00 0.00 0.00 176.54 174.85 1u7g h VAL 317 N 0.40 1.52 -0.93 4.60 2.07 -1.10 0.45 116.25 123.26 1u7g h VAL 317 Ca 0.05 -1.54 0.00 0.00 0.82 0.00 0.00 66.70 66.04 1u7g h VAL 317 Cb 0.71 2.56 -0.05 0.00 -1.52 0.00 0.00 31.29 32.99 1u7g h VAL 317 CO 0.05 0.40 0.60 0.45 0.02 0.00 0.00 177.57 179.10 1u7g h HIS 318 N -0.63 1.19 0.13 1.57 -0.00 -1.17 0.72 115.15 116.96 1u7g h HIS 318 Ca -0.00 0.02 -0.01 0.00 -0.00 0.00 0.00 60.37 60.38 1u7g h HIS 318 Cb 0.66 -0.40 0.00 0.00 -0.00 0.00 0.00 27.41 27.67 1u7g h HIS 318 CO 0.15 0.77 -0.06 0.78 -0.00 0.00 0.00 177.93 179.57 1u7g h GLY 319 N 1.27 -0.18 0.83 2.45 0.00 -0.44 0.89 103.07 107.90 1u7g h GLY 319 Ca 0.34 0.07 -0.03 0.00 0.00 0.00 0.00 47.33 47.71 1u7g h GLY 319 CO -0.07 -0.07 0.02 -2.08 0.00 0.00 0.00 176.54 174.35 1u7g h VAL 320 N -0.86 1.23 0.00 4.60 2.07 -0.91 -0.86 116.25 121.53 1u7g h VAL 320 Ca -0.02 -0.78 -0.11 0.00 0.82 0.00 0.00 66.70 66.61 1u7g h VAL 320 Cb 0.54 1.36 -0.02 0.00 -1.52 0.00 0.00 31.29 31.66 1u7g h VAL 320 CO 0.03 0.24 -0.53 0.00 0.02 0.00 0.00 177.57 177.33 1u7g h GLY 322 N 1.92 0.85 0.88 0.00 0.00 -0.61 0.11 103.07 106.23 1u7g h GLY 322 Ca -0.01 -0.62 -0.02 0.00 0.00 0.00 0.00 47.33 46.68 1u7g h GLY 322 CO 0.07 0.58 0.07 -2.22 0.00 0.00 0.00 176.54 175.04 1u7g h ILE 323 N 0.64 1.19 -0.48 2.60 2.04 -0.74 -0.09 117.51 122.67 1u7g h ILE 323 Ca 0.13 -0.61 0.01 0.00 1.00 0.00 0.00 64.86 65.39 1u7g h ILE 323 Cb 0.49 1.15 -0.03 0.00 -0.74 0.00 0.00 36.82 37.69 1u7g h ILE 323 CO 0.02 0.20 0.30 0.58 0.00 0.00 0.00 178.15 179.25 1u7g h VAL 324 N 0.22 1.08 -0.25 1.67 2.07 -0.90 0.43 116.25 120.58 1u7g h VAL 324 Ca 0.08 -0.21 -0.14 0.00 0.82 0.00 0.00 66.70 67.25 1u7g h VAL 324 Cb 0.24 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.42 1u7g h VAL 324 CO -0.00 0.11 -0.41 1.23 0.02 0.00 0.00 177.57 178.52 1u7g h GLY 325 N 0.61 0.64 0.98 2.17 0.00 -0.65 -2.94 103.07 103.88 1u7g h GLY 325 Ca 0.18 -0.64 -0.06 0.00 0.00 0.00 0.00 47.33 46.81 1u7g h GLY 325 CO -0.06 0.58 0.05 0.00 0.00 0.00 0.00 176.54 177.11 1u7g n ILE 327 N -4.40 0.17 0.00 0.00 5.41 0.11 -3.41 119.36 117.24 1u7g n ILE 327 Ca 0.01 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.76 1u7g n ILE 327 Cb 0.27 -0.45 0.00 0.00 -0.71 0.00 0.00 39.64 38.75 1u7g n ILE 327 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 176.55 176.96 1u7g n THR 329 N 0.69 0.00 0.30 1.39 -1.04 -0.10 -3.44 114.28 112.08 1u7g n THR 329 Ca 0.00 0.00 0.17 0.00 -2.04 0.00 0.00 64.05 62.18 1u7g n THR 329 Cb 0.11 0.00 0.77 0.00 -1.82 0.00 0.00 70.33 69.39 1u7g n THR 329 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 1u7g h GLY 330 N 0.00 0.00 0.00 3.41 0.00 -1.83 -1.25 103.07 103.40 1u7g h GLY 330 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.25 1u7g h GLY 330 CO 0.00 0.00 -0.95 1.39 0.00 0.00 0.00 176.54 176.98 1u7g n ILE 331 N -2.92 1.47 1.51 2.60 5.41 -1.22 -4.50 119.36 121.70 1u7g n ILE 331 Ca -0.00 0.10 0.15 0.00 1.00 0.00 0.00 62.75 64.00 1u7g n ILE 331 Cb 0.23 -2.29 0.75 0.00 -0.71 0.00 0.00 39.64 37.62 1u7g n ILE 331 CO 0.00 0.00 0.00 0.49 0.00 0.00 0.00 176.55 177.04 1u7g n PHE 332 N -4.51 0.00 0.31 1.39 3.72 -1.19 -1.63 117.46 115.56 1u7g n PHE 332 Ca -0.17 0.00 0.16 0.00 -0.05 0.00 0.00 57.45 57.39 1u7g n PHE 332 Cb 0.46 -0.21 0.69 0.00 -0.94 0.00 0.00 39.48 39.47 1u7g n PHE 332 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1u7g h ALA 333 N 3.57 1.00 -2.83 4.37 0.00 -1.40 -3.26 119.26 120.70 1u7g h ALA 333 Ca 0.00 0.00 -0.55 0.00 0.00 0.00 0.00 54.91 54.36 1u7g h ALA 333 Cb 0.26 0.00 0.12 0.00 0.00 0.00 0.00 17.79 18.17 1u7g h ALA 333 CO 0.00 0.00 0.61 0.00 0.00 0.00 0.00 179.25 179.86 1u7g n ALA 334 N -2.00 1.74 0.19 0.00 0.00 -0.65 0.23 120.51 120.02 1u7g n ALA 334 Ca 0.01 0.27 0.03 0.00 0.00 0.00 0.00 53.44 53.75 1u7g n ALA 334 Cb 0.25 -2.34 0.36 0.00 0.00 0.00 0.00 19.45 17.72 1u7g n ALA 334 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1u7g h SER 335 N 2.31 0.00 0.42 0.00 4.64 -1.87 0.19 113.55 119.23 1u7g h SER 335 Ca -0.49 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.82 1u7g h SER 335 Cb 1.28 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.37 1u7g h SER 335 CO 0.61 0.39 -0.03 0.77 -0.87 0.00 0.00 176.83 177.69 1u7g h SER 336 N 0.00 0.00 -0.45 4.97 4.64 -1.89 0.55 113.55 121.38 1u7g h SER 336 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1u7g h SER 336 Cb 0.73 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.82 1u7g h SER 336 CO 0.05 0.03 0.00 0.18 -0.87 0.00 0.00 176.83 176.22 1u7g n LEU 337 N -3.26 4.40 0.00 5.97 4.77 -0.42 -4.93 117.00 123.53 1u7g n LEU 337 Ca -0.02 -2.70 0.00 0.00 -0.03 0.00 0.00 56.01 53.26 1u7g n LEU 337 Cb 0.19 -0.54 0.00 0.00 -2.33 0.00 0.00 43.42 40.74 1u7g n LEU 337 CO 0.25 0.71 0.00 0.61 -1.33 0.00 0.00 177.39 177.63 1u7g n GLY 338 N 0.32 0.74 0.00 -0.72 0.00 0.19 -4.41 105.19 101.30 1u7g n GLY 338 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.25 1u7g n GLY 338 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u7g n GLY 339 N -2.49 0.57 0.21 -0.02 0.00 0.52 -2.68 105.19 101.30 1u7g n GLY 339 Ca 0.00 -1.91 0.10 0.00 0.00 0.00 0.00 46.02 44.21 1u7g n GLY 339 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1u7g h VAL 340 N -0.38 0.15 0.00 1.61 3.04 -0.09 -3.35 116.25 117.23 1u7g h VAL 340 Ca 0.00 -1.20 0.00 0.00 -1.01 0.00 0.00 66.70 64.49 1u7g h VAL 340 Cb 0.00 2.06 0.00 0.00 -2.01 0.00 0.00 31.29 31.34 1u7g h VAL 340 CO 0.00 0.08 0.00 0.61 -1.01 0.00 0.00 177.57 177.25 1u7g n GLY 341 N 1.10 3.80 3.97 3.17 0.00 0.13 -4.83 105.19 112.54 1u7g n GLY 341 Ca 0.04 -0.55 -0.21 0.00 0.00 0.00 0.00 46.02 45.29 1u7g n GLY 341 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1u7g s PHE 342 N 0.00 3.08 1.12 1.61 0.08 -1.26 -4.76 117.98 117.85 1u7g s PHE 342 Ca 0.00 0.02 -0.17 0.00 0.12 0.00 0.00 56.93 56.89 1u7g s PHE 342 Cb 0.00 -2.34 0.25 0.00 -0.57 0.00 0.00 43.02 40.36 1u7g s PHE 342 CO 0.00 -0.39 1.13 0.00 -0.10 0.00 0.00 175.22 175.86 1u7g s ALA 343 N -2.49 0.93 0.25 5.36 0.00 -1.26 -4.84 121.76 119.72 1u7g s ALA 343 Ca 0.50 -0.86 -0.31 0.00 0.00 0.00 0.00 51.96 51.29 1u7g s ALA 343 Cb -0.10 -2.92 -0.12 0.00 0.00 0.00 0.00 23.12 19.98 1u7g s ALA 343 CO 0.36 -3.24 1.58 0.39 0.00 0.00 0.00 175.76 174.85 1u7g n GLU 344 N -4.48 2.53 -0.27 0.00 -0.58 -1.26 -1.23 120.64 115.36 1u7g n GLU 344 Ca 0.12 0.91 0.00 0.00 -0.42 0.00 0.00 57.16 57.76 1u7g n GLU 344 Cb 0.59 -2.67 0.00 0.00 -0.57 0.00 0.00 31.44 28.79 1u7g n GLU 344 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1u7g n GLY 345 N 2.61 2.34 3.77 0.62 0.00 -1.26 -4.98 105.19 108.29 1u7g n GLY 345 Ca 0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 1u7g n GLY 345 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1u7g s VAL 346 N -3.23 5.07 0.00 1.61 1.01 -0.36 -5.09 120.40 119.41 1u7g s VAL 346 Ca 0.00 0.97 0.00 0.00 0.00 0.00 0.00 61.98 62.95 1u7g s VAL 346 Cb 0.00 -3.80 0.00 0.00 0.00 0.00 0.00 36.38 32.58 1u7g s VAL 346 CO 0.00 0.44 0.00 0.35 0.00 0.00 0.00 175.10 175.89 1u7g n THR 347 N 2.82 0.00 0.00 3.92 -2.24 -1.26 -4.74 114.28 112.78 1u7g n THR 347 Ca -0.10 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 1u7g n THR 347 Cb 0.52 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.75 1u7g n THR 347 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1u7g n GLY 349 N 5.00 0.00 0.12 3.38 0.00 -1.26 -0.67 105.19 111.75 1u7g n GLY 349 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 1u7g n GLY 349 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 1u7g h HIS 350 N 0.00 0.29 -0.87 1.61 6.17 -1.97 -1.60 115.15 118.78 1u7g h HIS 350 Ca 0.00 -0.02 -0.01 0.00 0.71 0.00 0.00 60.37 61.05 1u7g h HIS 350 Cb 0.00 -0.09 -0.04 0.00 2.52 0.00 0.00 27.41 29.80 1u7g h HIS 350 CO 0.00 0.33 0.51 0.37 0.71 0.00 0.00 177.93 179.84 1u7g h GLN 351 N 0.17 1.19 -0.81 5.26 5.75 -1.23 -0.87 115.11 124.57 1u7g h GLN 351 Ca 0.07 -0.12 0.01 0.00 -0.15 0.00 0.00 58.65 58.45 1u7g h GLN 351 Cb 0.15 -0.24 -0.04 0.00 1.07 0.00 0.00 27.48 28.42 1u7g h GLN 351 CO -0.01 0.85 0.53 -0.07 -2.65 0.00 0.00 178.83 177.48 1u7g h LEU 352 N 1.20 0.95 -1.06 -2.39 3.38 -1.74 0.20 115.31 115.85 1u7g h LEU 352 Ca 0.31 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.23 1u7g h LEU 352 Cb -0.02 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.45 1u7g h LEU 352 CO -0.06 0.70 0.47 -0.07 0.09 0.00 0.00 178.44 179.57 1u7g h LEU 353 N 1.11 1.00 -0.66 1.67 3.38 -0.51 0.59 115.31 121.89 1u7g h LEU 353 Ca 0.30 -0.07 -0.10 0.00 0.09 0.00 0.00 57.88 58.10 1u7g h LEU 353 Cb -0.11 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.37 1u7g h LEU 353 CO -0.06 0.79 -0.03 0.58 0.09 0.00 0.00 178.44 179.81 1u7g h VAL 354 N 1.14 1.26 -0.52 1.22 2.07 -0.46 0.30 116.25 121.26 1u7g h VAL 354 Ca 0.29 -1.17 -0.01 0.00 0.82 0.00 0.00 66.70 66.63 1u7g h VAL 354 Cb -0.01 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 30.59 1u7g h VAL 354 CO -0.05 0.42 0.29 1.56 0.02 0.00 0.00 177.57 179.80 1u7g h GLN 355 N 0.93 0.73 -0.85 1.57 1.08 -0.01 0.69 115.11 119.24 1u7g h GLN 355 Ca 0.16 -0.09 -0.02 0.00 -1.45 0.00 0.00 58.65 57.25 1u7g h GLN 355 Cb 0.58 -0.14 -0.04 0.00 -0.05 0.00 0.00 27.48 27.82 1u7g h GLN 355 CO 0.03 0.57 0.45 -0.07 -0.95 0.00 0.00 178.83 178.86 1u7g h LEU 356 N 0.70 1.08 -0.68 1.46 3.38 -0.40 -0.40 115.31 120.45 1u7g h LEU 356 Ca 0.18 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 1u7g h LEU 356 Cb 0.05 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.49 1u7g h LEU 356 CO -0.03 0.89 0.43 -0.33 0.09 0.00 0.00 178.44 179.48 1u7g h GLU 357 N 1.19 0.92 -0.79 1.13 5.08 0.04 0.33 114.58 122.48 1u7g h GLU 357 Ca 0.30 -0.07 -0.04 0.00 -1.00 0.00 0.00 59.36 58.55 1u7g h GLU 357 Cb 0.06 -0.20 -0.04 0.00 0.50 0.00 0.00 28.75 29.08 1u7g h GLU 357 CO -0.04 0.64 0.35 0.77 -1.00 0.00 0.00 179.01 179.73 1u7g h SER 358 N 0.93 1.05 0.08 1.42 0.02 -0.17 0.10 113.55 116.98 1u7g h SER 358 Ca 0.25 -0.15 -0.00 0.00 -0.84 0.00 0.00 61.79 61.04 1u7g h SER 358 Cb -0.06 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 62.21 1u7g h SER 358 CO -0.05 0.91 -0.04 0.40 -1.14 0.00 0.00 176.83 176.91 1u7g h ILE 359 N 1.12 0.95 -0.67 3.27 2.04 -0.69 -0.18 117.51 123.35 1u7g h ILE 359 Ca 0.27 -0.12 -0.02 0.00 1.00 0.00 0.00 64.86 65.99 1u7g h ILE 359 Cb 0.16 1.03 -0.03 0.00 -0.74 0.00 0.00 36.82 37.24 1u7g h ILE 359 CO -0.03 0.03 0.33 0.00 0.00 0.00 0.00 178.15 178.48 1u7g h ALA 360 N 0.75 0.86 -0.71 1.87 0.00 -0.61 0.55 119.26 121.98 1u7g h ALA 360 Ca -0.01 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.69 1u7g h ALA 360 Cb 0.13 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 1u7g h ALA 360 CO 0.02 0.42 0.15 0.82 0.00 0.00 0.00 179.25 180.66 1u7g h ILE 361 N 0.93 1.26 -0.50 0.00 2.04 -0.64 -0.86 117.51 119.75 1u7g h ILE 361 Ca 0.23 -1.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.05 1u7g h ILE 361 Cb 0.10 0.55 -0.02 0.00 -0.74 0.00 0.00 36.82 36.71 1u7g h ILE 361 CO -0.03 0.38 0.14 0.74 0.00 0.00 0.00 178.15 179.38 1u7g h THR 362 N 1.08 1.23 -0.30 -0.27 2.02 -0.34 0.76 112.91 117.10 1u7g h THR 362 Ca 0.22 -0.81 -0.01 0.00 0.77 0.00 0.00 66.41 66.58 1u7g h THR 362 Cb 0.40 0.81 -0.01 0.00 -1.74 0.00 0.00 68.15 67.61 1u7g h THR 362 CO 0.01 0.29 0.14 0.40 0.37 0.00 0.00 175.52 176.72 1u7g h ILE 363 N 0.68 1.16 -0.30 3.11 2.04 -0.65 0.16 117.51 123.71 1u7g h ILE 363 Ca 0.16 -0.47 -0.12 0.00 1.00 0.00 0.00 64.86 65.43 1u7g h ILE 363 Cb 0.30 0.93 -0.01 0.00 -0.74 0.00 0.00 36.82 37.30 1u7g h ILE 363 CO -0.00 0.17 -0.28 0.58 0.00 0.00 0.00 178.15 178.61 1u7g h VAL 364 N 0.34 1.30 0.32 1.67 2.07 -0.95 -0.89 116.25 120.10 1u7g h VAL 364 Ca 0.10 -1.45 -0.01 0.00 0.82 0.00 0.00 66.70 66.16 1u7g h VAL 364 Cb 0.14 1.54 -0.00 0.00 -1.52 0.00 0.00 31.29 31.45 1u7g h VAL 364 CO -0.01 0.47 -0.18 -0.25 0.02 0.00 0.00 177.57 177.62 1u7g h TRP 365 N 0.48 -0.46 -0.69 1.57 2.91 -0.74 0.96 115.95 119.98 1u7g h TRP 365 Ca 0.05 -0.01 -0.02 0.00 1.13 0.00 0.00 58.89 60.05 1u7g h TRP 365 Cb 0.85 0.16 -0.03 0.00 -0.51 0.00 0.00 29.16 29.63 1u7g h TRP 365 CO 0.07 -0.28 0.36 1.03 -1.03 0.00 0.00 178.44 178.59 1u7g h SER 366 N -0.47 0.87 -0.33 2.65 0.87 -0.97 -0.36 113.55 115.82 1u7g h SER 366 Ca -0.04 -0.11 -0.03 0.00 -1.23 0.00 0.00 61.79 60.38 1u7g h SER 366 Cb 0.38 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 62.10 1u7g h SER 366 CO 0.05 0.73 0.07 1.23 -0.53 0.00 0.00 176.83 178.38 1u7g h GLY 367 N 0.95 0.57 0.96 5.77 0.00 -0.97 0.32 103.07 110.67 1u7g h GLY 367 Ca 0.24 -0.37 -0.00 0.00 0.00 0.00 0.00 47.33 47.20 1u7g h GLY 367 CO -0.04 0.34 0.08 -2.08 0.00 0.00 0.00 176.54 174.85 1u7g h VAL 368 N 0.37 1.08 -0.58 4.60 2.07 -0.69 -0.60 116.25 122.50 1u7g h VAL 368 Ca 0.10 -0.20 -0.08 0.00 0.82 0.00 0.00 66.70 67.34 1u7g h VAL 368 Cb 0.32 0.96 -0.02 0.00 -1.52 0.00 0.00 31.29 31.03 1u7g h VAL 368 CO 0.00 0.07 0.04 0.58 0.02 0.00 0.00 177.57 178.29 1u7g h VAL 369 N 0.14 1.26 -0.40 2.57 2.07 -0.89 -0.62 116.25 120.38 1u7g h VAL 369 Ca 0.05 -1.07 0.04 0.00 0.82 0.00 0.00 66.70 66.54 1u7g h VAL 369 Cb 0.04 0.82 -0.04 0.00 -1.52 0.00 0.00 31.29 30.59 1u7g h VAL 369 CO -0.01 0.39 0.16 0.00 0.02 0.00 0.00 177.57 178.13 1u7g h ALA 370 N 0.99 0.48 -0.35 1.67 0.00 -0.26 0.41 119.26 122.20 1u7g h ALA 370 Ca 0.17 0.04 0.04 0.00 0.00 0.00 0.00 54.91 55.15 1u7g h ALA 370 Cb 0.49 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.24 1u7g h ALA 370 CO 0.02 -0.22 0.13 0.35 0.00 0.00 0.00 179.25 179.53 1u7g h PHE 371 N 0.34 0.23 -0.83 0.00 3.57 -0.80 0.23 116.94 119.68 1u7g h PHE 371 Ca 0.18 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.69 1u7g h PHE 371 Cb 0.13 -0.05 -0.04 0.00 2.79 0.00 0.00 35.95 38.78 1u7g h PHE 371 CO -0.13 0.10 0.48 0.82 -2.23 0.00 0.00 178.31 177.35 1u7g h ILE 372 N 0.28 1.23 -0.20 1.41 2.04 -0.40 0.11 117.51 121.98 1u7g h ILE 372 Ca 0.16 -0.54 -0.21 0.00 1.00 0.00 0.00 64.86 65.27 1u7g h ILE 372 Cb 0.13 0.08 0.01 0.00 -0.74 0.00 0.00 36.82 36.29 1u7g h ILE 372 CO -0.16 0.25 -0.71 1.23 0.00 0.00 0.00 178.15 178.77 1u7g h GLY 373 N 1.17 0.91 1.06 5.37 0.00 0.97 0.10 103.07 112.65 1u7g h GLY 373 Ca 0.30 -1.21 -0.03 0.00 0.00 0.00 0.00 47.33 46.38 1u7g h GLY 373 CO -0.05 1.08 0.39 -0.97 0.00 0.00 0.00 176.54 176.98 1u7g h TYR 374 N 0.59 1.21 -0.44 5.60 0.05 -0.27 -1.49 116.97 122.22 1u7g h TYR 374 Ca -0.03 -0.06 -0.11 0.00 0.05 0.00 0.00 58.73 58.58 1u7g h TYR 374 Cb 1.33 -0.37 -0.01 0.00 1.01 0.00 0.00 36.73 38.69 1u7g h TYR 374 CO 0.08 0.88 -0.15 0.87 -1.05 0.00 0.00 178.16 178.79 1u7g h LYS 375 N 1.19 0.87 -0.43 4.88 1.79 -0.73 0.21 116.57 124.36 1u7g h LYS 375 Ca 0.28 -0.35 -0.01 0.00 -2.18 0.00 0.00 60.65 58.39 1u7g h LYS 375 Cb 0.13 -0.04 -0.02 0.00 -1.58 0.00 0.00 32.23 30.73 1u7g h LYS 375 CO -0.03 1.00 0.21 1.25 -1.08 0.00 0.00 179.45 180.79 1u7g h LEU 376 N 0.70 0.56 -0.35 2.94 5.85 -0.63 0.32 115.31 124.70 1u7g h LEU 376 Ca 0.11 -0.12 0.04 0.00 0.84 0.00 0.00 57.88 58.74 1u7g h LEU 376 Cb 0.70 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 41.55 1u7g h LEU 376 CO 0.05 0.52 0.14 0.00 -0.34 0.00 0.00 178.44 178.82 1u7g h ALA 377 N 1.06 0.42 -0.36 1.25 0.00 -0.96 -0.86 119.26 119.80 1u7g h ALA 377 Ca 0.15 0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.12 1u7g h ALA 377 Cb 0.11 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 1u7g h ALA 377 CO -0.02 -0.24 0.17 0.22 0.00 0.00 0.00 179.25 179.38 1u7g h ASP 378 N 0.30 0.25 0.59 0.00 -0.00 -0.03 0.15 116.42 117.68 1u7g h ASP 378 Ca 0.16 0.02 -0.05 0.00 -0.00 0.00 0.00 57.03 57.16 1u7g h ASP 378 Cb 0.11 -0.02 -0.01 0.00 -0.00 0.00 0.00 39.33 39.41 1u7g h ASP 378 CO -0.14 0.18 -0.24 -0.07 -0.00 0.00 0.00 179.24 178.97 1u7g h LEU 379 N 0.36 0.00 0.00 2.28 3.38 0.17 -1.71 115.31 119.79 1u7g h LEU 379 Ca 0.15 0.00 -0.40 0.00 0.09 0.00 0.00 57.88 57.73 1u7g h LEU 379 Cb 0.07 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.76 1u7g h LEU 379 CO -0.12 0.24 -2.43 0.35 0.09 0.00 0.00 178.44 176.58 1u7g n THR 380 N -3.64 1.42 0.00 0.22 -2.24 -0.38 -4.76 114.28 104.91 1u7g n THR 380 Ca -0.01 -0.48 0.00 0.00 -2.27 0.00 0.00 64.05 61.29 1u7g n THR 380 Cb 0.37 -1.55 0.00 0.00 -2.10 0.00 0.00 70.33 67.05 1u7g n THR 380 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 1u7g n VAL 381 N -3.57 0.00 -0.06 2.28 0.24 0.41 -5.10 118.33 112.53 1u7g n VAL 381 Ca -0.47 -0.28 0.00 0.00 -2.04 0.00 0.00 64.34 61.56 1u7g n VAL 381 Cb 0.93 0.79 0.00 0.00 -1.47 0.00 0.00 33.84 34.09 1u7g n VAL 381 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1u7g n GLY 382 N 1.42 0.15 0.09 7.63 0.00 -0.56 -4.95 105.19 108.97 1u7g n GLY 382 Ca 0.00 -1.19 -0.16 0.00 0.00 0.00 0.00 46.02 44.68 1u7g n GLY 382 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1u7g h LEU 383 N 0.00 0.20 -9.45 0.99 3.38 -1.77 -3.42 115.31 105.25 1u7g h LEU 383 Ca 0.00 -0.85 -0.55 0.00 0.09 0.00 0.00 57.88 56.58 1u7g h LEU 383 Cb 0.00 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 40.65 1u7g h LEU 383 CO 0.00 1.03 0.18 -0.60 0.09 0.00 0.00 178.44 179.13 1u7g s ARG 384 N -2.84 4.49 0.00 1.13 3.00 -1.26 0.02 118.95 123.49 1u7g s ARG 384 Ca -0.16 1.07 0.00 0.00 -1.00 0.00 0.00 55.73 55.64 1u7g s ARG 384 Cb -0.00 -3.41 0.00 0.00 0.00 0.00 0.00 34.95 31.54 1u7g s ARG 384 CO 0.74 0.14 0.34 0.28 0.00 0.00 0.00 175.30 176.80