#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b76 s ALA 2 N 0.00 2.49 0.05 0.00 0.00 -0.80 -4.38 121.76 119.11 1b76 s ALA 2 Ca 0.00 -0.98 -0.18 0.00 0.00 0.00 0.00 51.96 50.80 1b76 s ALA 2 Cb 0.00 -1.15 -0.08 0.00 0.00 0.00 0.00 23.12 21.89 1b76 s ALA 2 CO 0.00 0.12 1.29 0.77 0.00 0.00 0.00 175.76 177.94 1b76 h SER 3 N 6.99 -0.84 -3.81 0.00 0.02 -1.92 -3.41 113.55 110.58 1b76 h SER 3 Ca -0.28 0.09 -0.68 0.00 -0.84 0.00 0.00 61.79 60.08 1b76 h SER 3 Cb 1.21 0.31 -0.20 0.00 0.14 0.00 0.00 62.40 63.85 1b76 h SER 3 CO 0.55 -0.29 -0.74 -0.44 -1.14 0.00 0.00 176.83 174.77 1b76 s SER 4 N -3.60 4.31 0.28 3.07 0.01 -1.26 -4.74 113.70 111.77 1b76 s SER 4 Ca -0.09 -0.18 0.02 0.00 1.31 0.00 0.00 55.95 57.02 1b76 s SER 4 Cb 0.03 -0.95 0.62 0.00 0.21 0.00 0.00 66.02 65.93 1b76 s SER 4 CO 0.32 0.31 1.79 0.25 0.41 0.00 0.00 173.24 176.32 1b76 h LEU 5 N 4.92 0.75 -1.10 2.44 7.12 -1.86 0.40 115.31 127.99 1b76 h LEU 5 Ca -0.48 0.08 0.15 0.00 0.13 0.00 0.00 57.88 57.77 1b76 h LEU 5 Cb 1.16 -0.05 -0.09 0.00 -0.53 0.00 0.00 40.66 41.15 1b76 h LEU 5 CO 0.51 0.32 0.61 0.44 -0.13 0.00 0.00 178.44 180.20 1b76 h ASP 6 N 0.79 0.80 0.61 1.25 3.32 -1.98 0.15 116.42 121.37 1b76 h ASP 6 Ca 0.52 0.06 -0.02 0.00 0.02 0.00 0.00 57.03 57.61 1b76 h ASP 6 Cb 0.71 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.15 1b76 h ASP 6 CO -0.34 0.37 -0.43 -0.33 -1.72 0.00 0.00 179.24 176.79 1b76 h GLU 7 N 0.83 -0.96 -0.79 3.56 5.08 -1.33 0.16 114.58 121.12 1b76 h GLU 7 Ca 0.51 0.07 0.14 0.00 -1.00 0.00 0.00 59.36 59.08 1b76 h GLU 7 Cb 0.70 0.22 -0.09 0.00 0.50 0.00 0.00 28.75 30.08 1b76 h GLU 7 CO -0.28 -0.64 0.37 -0.07 -1.00 0.00 0.00 179.01 177.38 1b76 h LEU 8 N -1.00 0.41 -0.90 1.33 -0.00 -1.24 0.20 115.31 114.11 1b76 h LEU 8 Ca -0.07 0.10 -0.07 0.00 -0.00 0.00 0.00 57.88 57.84 1b76 h LEU 8 Cb 0.83 0.04 -0.02 0.00 -0.00 0.00 0.00 40.66 41.50 1b76 h LEU 8 CO 0.04 0.17 0.07 0.58 -0.00 0.00 0.00 178.44 179.31 1b76 h VAL 9 N 0.54 1.24 0.34 1.22 2.07 -0.37 0.98 116.25 122.27 1b76 h VAL 9 Ca 0.43 -0.95 -0.02 0.00 0.82 0.00 0.00 66.70 66.98 1b76 h VAL 9 Cb 0.61 0.74 0.00 0.00 -1.52 0.00 0.00 31.29 31.13 1b76 h VAL 9 CO -0.37 0.35 -0.16 0.00 0.02 0.00 0.00 177.57 177.40 1b76 h ALA 10 N 1.24 -0.46 -1.00 1.67 0.00 0.23 -2.88 119.26 118.06 1b76 h ALA 10 Ca 0.17 -0.18 0.11 0.00 0.00 0.00 0.00 54.91 55.01 1b76 h ALA 10 Cb 0.39 0.18 -0.08 0.00 0.00 0.00 0.00 17.79 18.28 1b76 h ALA 10 CO 0.01 -0.59 0.63 1.25 0.00 0.00 0.00 179.25 180.56 1b76 h LEU 11 N -0.80 0.94 -1.96 0.00 5.85 -0.99 0.42 115.31 118.78 1b76 h LEU 11 Ca -0.05 0.04 0.08 0.00 0.84 0.00 0.00 57.88 58.79 1b76 h LEU 11 Cb 0.52 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.38 1b76 h LEU 11 CO 0.08 0.53 0.21 0.00 -0.34 0.00 0.00 178.44 178.91 1b76 n LYS 13 N -4.46 0.70 0.18 0.00 4.81 -0.33 0.16 118.16 119.21 1b76 n LYS 13 Ca 0.04 -0.07 0.14 0.00 -0.87 0.00 0.00 58.31 57.55 1b76 n LYS 13 Cb 0.34 -1.52 0.54 0.00 0.02 0.00 0.00 35.03 34.41 1b76 n LYS 13 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1b76 h ARG 14 N 0.00 0.00 0.00 1.64 3.08 0.24 -3.10 114.38 116.24 1b76 h ARG 14 Ca -0.38 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.67 1b76 h ARG 14 Cb 1.85 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.90 1b76 h ARG 14 CO 0.02 0.00 0.00 0.54 -1.07 0.00 0.00 179.97 179.46 1b76 n ARG 15 N -2.54 0.57 -2.73 0.04 5.12 -0.36 -5.02 116.66 111.75 1b76 n ARG 15 Ca 0.02 -0.76 -0.05 0.00 -1.93 0.00 0.00 57.85 55.13 1b76 n ARG 15 Cb 0.28 -0.87 0.02 0.00 -1.16 0.00 0.00 32.46 30.72 1b76 n ARG 15 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1b76 n GLY 16 N -0.16 0.64 0.02 -0.13 0.00 -1.17 -4.59 105.19 99.79 1b76 n GLY 16 Ca 0.00 -0.48 -0.01 0.00 0.00 0.00 0.00 46.02 45.52 1b76 n GLY 16 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1b76 n PHE 17 N -3.04 0.20 -4.92 1.61 3.72 0.12 -1.92 117.46 113.23 1b76 n PHE 17 Ca 0.00 0.09 -0.26 0.00 -0.05 0.00 0.00 57.45 57.23 1b76 n PHE 17 Cb 0.51 -0.34 -0.16 0.00 -0.94 0.00 0.00 39.48 38.55 1b76 n PHE 17 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 1b76 s ILE 18 N -1.31 1.51 0.16 4.37 1.01 0.77 -0.90 121.20 126.81 1b76 s ILE 18 Ca -0.04 -0.81 0.09 0.00 0.00 0.00 0.00 60.65 59.90 1b76 s ILE 18 Cb 0.01 -1.27 -0.04 0.00 0.01 0.00 0.00 42.46 41.16 1b76 s ILE 18 CO 0.06 0.43 -0.14 -0.36 0.00 0.00 0.00 174.94 174.92 1b76 s PHE 19 N -0.33 2.55 -0.31 3.97 0.08 0.18 -3.51 117.98 120.62 1b76 s PHE 19 Ca 0.04 -0.25 -0.29 0.00 0.12 0.00 0.00 56.93 56.55 1b76 s PHE 19 Cb -0.09 -1.29 -0.01 0.00 -0.57 0.00 0.00 43.02 41.07 1b76 s PHE 19 CO 0.00 0.47 1.45 -1.14 -0.10 0.00 0.00 175.22 175.90 1b76 s GLN 20 N -2.57 3.76 0.52 0.44 2.00 -1.26 -0.98 119.66 121.58 1b76 s GLN 20 Ca 0.22 1.29 -0.21 0.00 -2.00 0.00 0.00 55.36 54.66 1b76 s GLN 20 Cb -0.09 -3.98 -0.07 0.00 0.80 0.00 0.00 33.01 29.67 1b76 s GLN 20 CO 0.13 -1.32 1.07 0.45 -0.50 0.00 0.00 175.29 175.11 1b76 n SER 21 N 8.31 1.39 -2.90 6.67 2.88 -1.22 -2.65 113.62 126.11 1b76 n SER 21 Ca 0.17 0.93 -0.15 0.00 -1.33 0.00 0.00 58.87 58.49 1b76 n SER 21 Cb 0.47 -1.42 -0.01 0.00 -0.75 0.00 0.00 64.21 62.50 1b76 n SER 21 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1b76 n SER 22 N -0.33 -3.03 -0.21 -3.46 7.64 -1.26 -3.41 113.62 109.55 1b76 n SER 22 Ca 0.11 -0.02 0.01 0.00 1.01 0.00 0.00 58.87 59.98 1b76 n SER 22 Cb 0.44 -2.59 0.12 0.00 -1.01 0.00 0.00 64.21 61.17 1b76 n SER 22 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 1b76 h GLU 23 N -0.40 0.40 -0.50 1.43 4.81 -1.75 -2.65 114.58 115.93 1b76 h GLU 23 Ca -0.29 -0.02 0.10 0.00 -0.13 0.00 0.00 59.36 59.01 1b76 h GLU 23 Cb 1.20 -0.09 -0.08 0.00 0.63 0.00 0.00 28.75 30.41 1b76 h GLU 23 CO 0.36 0.26 0.00 -0.84 -0.73 0.00 0.00 179.01 178.06 1b76 h ILE 24 N 0.41 0.61 -0.64 2.32 3.07 -1.89 -1.29 117.51 120.09 1b76 h ILE 24 Ca 0.32 -0.04 -0.38 0.00 1.55 0.00 0.00 64.86 66.31 1b76 h ILE 24 Cb 0.42 0.48 -0.15 0.00 -0.27 0.00 0.00 36.82 37.30 1b76 h ILE 24 CO -0.33 0.02 0.42 -1.22 -1.05 0.00 0.00 178.15 175.99 1b76 n TYR 25 N -5.23 1.60 0.00 0.16 4.01 -1.01 -4.90 117.16 111.80 1b76 n TYR 25 Ca 0.05 -2.00 0.00 0.00 -0.16 0.00 0.00 57.90 55.79 1b76 n TYR 25 Cb 0.27 -1.09 0.00 0.00 -0.31 0.00 0.00 39.34 38.21 1b76 n TYR 25 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1b76 n GLY 26 N 0.46 2.03 0.00 2.72 0.00 -0.49 -4.90 105.19 105.01 1b76 n GLY 26 Ca 0.36 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.87 1b76 n GLY 26 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b76 n GLY 27 N 0.00 4.38 3.56 -0.02 0.00 -1.16 -4.56 105.19 107.39 1b76 n GLY 27 Ca 0.00 -0.59 -0.41 0.00 0.00 0.00 0.00 46.02 45.02 1b76 n GLY 27 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1b76 s LEU 28 N 0.00 4.31 0.42 0.99 1.98 -1.22 -5.01 118.68 120.16 1b76 s LEU 28 Ca 0.00 0.03 -0.25 0.00 -2.89 0.00 0.00 54.13 51.02 1b76 s LEU 28 Cb 0.00 -2.59 -0.08 0.00 0.66 0.00 0.00 46.19 44.18 1b76 s LEU 28 CO 0.00 -0.46 1.24 -1.10 -1.89 0.00 0.00 176.35 174.14 1b76 s GLN 29 N 2.39 3.90 -1.08 1.98 1.11 -1.26 -3.19 119.66 123.51 1b76 s GLN 29 Ca 0.19 1.99 0.00 0.00 0.01 0.00 0.00 55.36 57.55 1b76 s GLN 29 Cb -0.15 -2.64 0.00 0.00 -1.01 0.00 0.00 33.01 29.21 1b76 s GLN 29 CO 0.13 -0.49 0.00 0.41 0.01 0.00 0.00 175.29 175.35 1b76 n GLY 30 N 0.63 1.15 2.94 3.09 0.00 -1.26 -4.80 105.19 106.94 1b76 n GLY 30 Ca 0.05 -0.49 -0.25 0.00 0.00 0.00 0.00 46.02 45.32 1b76 n GLY 30 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1b76 s VAL 31 N -2.34 1.01 0.31 1.61 1.01 -1.19 -0.35 120.40 120.46 1b76 s VAL 31 Ca 0.00 -0.33 0.08 0.00 0.00 0.00 0.00 61.98 61.73 1b76 s VAL 31 Cb 0.00 -0.99 -0.06 0.00 0.00 0.00 0.00 36.38 35.33 1b76 s VAL 31 CO 0.00 0.35 -0.08 -0.31 0.00 0.00 0.00 175.10 175.05 1b76 s TYR 32 N 1.27 2.19 -0.07 5.22 2.02 -1.26 -3.38 117.35 123.34 1b76 s TYR 32 Ca -0.03 -0.58 0.05 0.00 -0.37 0.00 0.00 57.07 56.13 1b76 s TYR 32 Cb -0.14 -1.23 -0.00 0.00 -0.40 0.00 0.00 41.96 40.18 1b76 s TYR 32 CO -0.03 0.45 -0.23 -0.51 -1.57 0.00 0.00 175.55 173.66 1b76 s ASP 33 N -3.53 2.92 -0.48 2.29 1.01 -0.15 -4.73 116.67 114.00 1b76 s ASP 33 Ca 0.31 -0.50 -0.20 0.00 0.71 0.00 0.00 52.55 52.86 1b76 s ASP 33 Cb 0.03 -1.04 0.04 0.00 1.01 0.00 0.00 42.92 42.96 1b76 s ASP 33 CO 0.14 0.19 0.66 -0.31 0.21 0.00 0.00 175.17 176.07 1b76 s TYR 34 N 0.10 3.03 1.13 4.23 1.51 -1.26 0.49 117.35 126.58 1b76 s TYR 34 Ca -0.10 -0.27 -0.18 0.00 -1.01 0.00 0.00 57.07 55.51 1b76 s TYR 34 Cb -0.15 -3.50 0.26 0.00 -0.11 0.00 0.00 41.96 38.46 1b76 s TYR 34 CO 0.06 -0.99 1.19 0.20 -1.11 0.00 0.00 175.55 174.89 1b76 s GLY 35 N 2.38 1.65 0.04 0.71 0.00 -0.08 -4.38 107.32 107.65 1b76 s GLY 35 Ca 0.20 -1.07 -0.07 0.00 0.00 0.00 0.00 44.72 43.78 1b76 s GLY 35 CO 0.16 -0.21 0.51 -1.05 0.00 0.00 0.00 173.10 172.51 1b76 n PRO 36 N -4.45 -0.10 -0.08 2.90 -0.02 -1.12 0.07 135.00 132.20 1b76 n PRO 36 Ca 0.14 0.51 -0.09 0.00 -2.02 0.00 0.00 63.50 62.04 1b76 n PRO 36 Cb 0.60 -0.75 0.06 0.00 -0.02 0.00 0.00 33.50 33.39 1b76 n PRO 36 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1b76 h LEU 37 N 0.00 0.82 -1.25 2.45 -0.00 -1.64 -3.18 115.31 112.52 1b76 h LEU 37 Ca 0.04 -0.33 -0.01 0.00 -0.00 0.00 0.00 57.88 57.58 1b76 h LEU 37 Cb 0.09 -0.23 -0.03 0.00 -0.00 0.00 0.00 40.66 40.49 1b76 h LEU 37 CO -0.21 1.06 0.40 1.23 -0.00 0.00 0.00 178.44 180.91 1b76 h GLY 38 N 0.94 0.97 0.99 0.83 0.00 -0.34 -1.26 103.07 105.20 1b76 h GLY 38 Ca 0.08 -0.40 -0.04 0.00 0.00 0.00 0.00 47.33 46.96 1b76 h GLY 38 CO 0.07 0.39 -0.42 -2.08 0.00 0.00 0.00 176.54 174.50 1b76 h VAL 39 N 0.93 0.13 -0.07 4.60 2.07 -1.09 -0.83 116.25 122.00 1b76 h VAL 39 Ca 0.24 -0.03 0.02 0.00 0.82 0.00 0.00 66.70 67.75 1b76 h VAL 39 Cb -0.03 0.14 -0.04 0.00 -1.52 0.00 0.00 31.29 29.84 1b76 h VAL 39 CO -0.04 0.00 -0.39 -0.33 0.02 0.00 0.00 177.57 176.83 1b76 h GLU 40 N -1.19 -0.42 -0.96 1.57 4.39 -1.50 0.26 114.58 116.74 1b76 h GLU 40 Ca -0.12 0.03 0.24 0.00 0.34 0.00 0.00 59.36 59.85 1b76 h GLU 40 Cb 0.89 0.10 -0.13 0.00 -0.10 0.00 0.00 28.75 29.51 1b76 h GLU 40 CO 0.20 -0.28 0.50 1.25 -1.16 0.00 0.00 179.01 179.52 1b76 h LEU 41 N -0.44 0.52 -0.17 1.33 5.85 -1.24 0.79 115.31 121.95 1b76 h LEU 41 Ca 0.02 0.15 -0.02 0.00 0.84 0.00 0.00 57.88 58.86 1b76 h LEU 41 Cb 0.50 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.60 1b76 h LEU 41 CO -0.30 0.05 0.02 0.50 -0.34 0.00 0.00 178.44 178.36 1b76 h LYS 42 N 0.49 0.29 0.05 1.25 3.64 0.19 -1.74 116.57 120.74 1b76 h LYS 42 Ca 0.61 -0.08 -0.00 0.00 -1.27 0.00 0.00 60.65 59.91 1b76 h LYS 42 Cb 1.17 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.96 1b76 h LYS 42 CO -0.50 0.47 -0.03 -0.91 -2.27 0.00 0.00 179.45 176.21 1b76 h ASN 43 N 0.06 -0.06 -0.89 4.20 -0.26 0.10 0.23 115.58 118.96 1b76 h ASN 43 Ca 0.05 -0.15 0.20 0.00 -0.56 0.00 0.00 56.30 55.84 1b76 h ASN 43 Cb 0.33 0.02 -0.12 0.00 -1.06 0.00 0.00 38.32 37.49 1b76 h ASN 43 CO 0.01 0.12 0.41 0.78 -1.06 0.00 0.00 177.43 177.68 1b76 h ASN 44 N -0.24 0.39 0.30 5.81 -0.26 -0.88 0.85 115.58 121.55 1b76 h ASN 44 Ca -0.01 0.14 -0.01 0.00 -0.56 0.00 0.00 56.30 55.86 1b76 h ASN 44 Cb 0.21 0.10 0.00 0.00 -1.06 0.00 0.00 38.32 37.57 1b76 h ASN 44 CO 0.01 0.06 -0.14 0.25 -1.06 0.00 0.00 177.43 176.55 1b76 h LEU 45 N 0.46 -0.34 -0.56 1.61 5.85 -1.08 -1.06 115.31 120.20 1b76 h LEU 45 Ca 0.54 -0.19 0.11 0.00 0.84 0.00 0.00 57.88 59.18 1b76 h LEU 45 Cb 0.97 0.09 -0.09 0.00 0.37 0.00 0.00 40.66 41.99 1b76 h LEU 45 CO -0.49 0.05 0.01 0.11 -0.34 0.00 0.00 178.44 177.79 1b76 h LYS 46 N -0.78 0.13 -0.13 1.25 1.57 0.12 -0.20 116.57 118.53 1b76 h LYS 46 Ca -0.04 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1b76 h LYS 46 Cb 0.51 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.78 1b76 h LYS 46 CO 0.07 0.08 0.07 1.96 -0.57 0.00 0.00 179.45 181.06 1b76 h GLN 47 N 0.13 0.17 -0.84 3.15 4.20 0.71 -0.23 115.11 122.40 1b76 h GLN 47 Ca 0.29 -0.02 0.10 0.00 0.06 0.00 0.00 58.65 59.08 1b76 h GLN 47 Cb 0.45 -0.04 -0.06 0.00 0.30 0.00 0.00 27.48 28.14 1b76 h GLN 47 CO -0.47 0.17 0.55 0.00 -0.67 0.00 0.00 178.83 178.41 1b76 h ALA 48 N 0.99 1.72 -0.10 3.87 0.00 -0.20 0.29 119.26 125.83 1b76 h ALA 48 Ca 0.05 -0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.79 1b76 h ALA 48 Cb 0.04 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1b76 h ALA 48 CO -0.01 0.10 -0.64 2.35 0.00 0.00 0.00 179.25 181.05 1b76 h TRP 49 N 0.78 0.47 -0.11 0.00 7.01 -0.41 -2.28 115.95 121.43 1b76 h TRP 49 Ca 0.39 -0.19 -0.07 0.00 2.11 0.00 0.00 58.89 61.13 1b76 h TRP 49 Cb 0.46 -0.08 0.00 0.00 -2.10 0.00 0.00 29.16 27.44 1b76 h TRP 49 CO -0.00 0.90 -0.20 2.35 -2.79 0.00 0.00 178.44 178.70 1b76 h TRP 50 N 0.26 0.40 0.61 2.65 2.91 0.11 -0.87 115.95 122.02 1b76 h TRP 50 Ca -0.01 -0.14 -0.02 0.00 1.13 0.00 0.00 58.89 59.84 1b76 h TRP 50 Cb 1.18 -0.08 -0.01 0.00 -0.51 0.00 0.00 29.16 29.74 1b76 h TRP 50 CO 0.03 0.81 -0.48 -0.09 -1.03 0.00 0.00 178.44 177.68 1b76 h ARG 51 N -0.12 -1.02 -0.75 2.65 2.43 -0.61 0.17 114.38 117.13 1b76 h ARG 51 Ca 0.00 0.07 0.09 0.00 -0.81 0.00 0.00 59.98 59.34 1b76 h ARG 51 Cb 0.78 0.23 -0.07 0.00 -0.42 0.00 0.00 29.97 30.49 1b76 h ARG 51 CO 0.04 -0.68 0.40 -0.09 -1.51 0.00 0.00 179.97 178.14 1b76 h ARG 52 N -1.06 0.66 -0.00 0.20 9.65 -1.46 0.11 114.38 122.48 1b76 h ARG 52 Ca -0.08 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.76 1b76 h ARG 52 Cb 0.89 -0.15 0.00 0.00 -1.39 0.00 0.00 29.97 29.32 1b76 h ARG 52 CO 0.01 0.44 -0.72 0.09 2.80 0.00 0.00 179.97 182.58 1b76 n ASN 53 N -4.81 1.10 0.03 -3.80 5.03 -0.33 -3.77 115.26 108.71 1b76 n ASN 53 Ca 0.12 -0.93 0.00 0.00 0.87 0.00 0.00 54.58 54.64 1b76 n ASN 53 Cb 0.27 0.66 0.00 0.00 -1.02 0.00 0.00 39.78 39.69 1b76 n ASN 53 CO 0.00 0.00 0.00 0.52 -1.83 0.00 0.00 177.26 175.95 1b76 n VAL 54 N -1.13 0.37 -0.12 2.41 0.31 0.56 -4.48 118.33 116.26 1b76 n VAL 54 Ca 0.06 0.12 -0.11 0.00 -0.01 0.00 0.00 64.34 64.40 1b76 n VAL 54 Cb 0.36 -1.30 0.01 0.00 -0.91 0.00 0.00 33.84 32.00 1b76 n VAL 54 CO 0.00 0.00 0.00 1.88 -1.32 0.00 0.00 176.83 177.39 1b76 h TYR 55 N 0.00 1.06 0.13 3.52 -1.99 -0.95 -3.29 116.97 115.45 1b76 h TYR 55 Ca 0.00 -0.29 -0.30 0.00 2.00 0.00 0.00 58.73 60.14 1b76 h TYR 55 Cb 0.47 -0.23 -0.00 0.00 2.00 0.00 0.00 36.73 38.97 1b76 h TYR 55 CO 0.00 1.09 -1.45 0.93 -0.00 0.00 0.00 178.16 178.73 1b76 h GLU 56 N 0.76 0.27 -7.28 4.88 5.08 -1.03 -3.46 114.58 113.81 1b76 h GLU 56 Ca 0.08 -0.47 -0.51 0.00 -1.00 0.00 0.00 59.36 57.46 1b76 h GLU 56 Cb 0.89 0.17 0.11 0.00 0.50 0.00 0.00 28.75 30.41 1b76 h GLU 56 CO 0.08 1.16 0.35 1.03 -1.00 0.00 0.00 179.01 180.63 1b76 s ARG 57 N -2.63 2.70 -0.10 2.33 1.81 -1.24 -4.96 118.95 116.87 1b76 s ARG 57 Ca -0.08 1.17 0.14 0.00 -1.72 0.00 0.00 55.73 55.24 1b76 s ARG 57 Cb 0.07 -1.95 0.28 0.00 -0.45 0.00 0.00 34.95 32.89 1b76 s ARG 57 CO 0.87 -1.30 1.18 -0.25 -0.68 0.00 0.00 175.30 175.12 1b76 n ASP 58 N -2.96 2.65 -0.16 0.23 8.00 -1.26 -4.61 116.55 118.44 1b76 n ASP 58 Ca 0.09 -2.74 0.02 0.00 0.71 0.00 0.00 54.79 52.87 1b76 n ASP 58 Cb 0.53 -0.34 0.02 0.00 -0.02 0.00 0.00 41.12 41.31 1b76 n ASP 58 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1b76 n ASP 59 N -0.86 0.72 -4.56 -2.24 5.68 -1.26 -5.08 116.55 108.95 1b76 n ASP 59 Ca 0.13 -1.80 -0.27 0.00 -0.50 0.00 0.00 54.79 52.36 1b76 n ASP 59 Cb 0.59 -0.12 -0.09 0.00 -1.14 0.00 0.00 41.12 40.35 1b76 n ASP 59 CO 0.00 0.00 0.00 -0.32 -1.33 0.00 0.00 177.20 175.55 1b76 s MET 60 N -0.62 2.03 -0.04 0.11 1.75 -1.26 -0.56 119.30 120.72 1b76 s MET 60 Ca 0.05 -1.29 0.02 0.00 -1.25 0.00 0.00 55.69 53.22 1b76 s MET 60 Cb 0.04 -2.14 0.01 0.00 2.84 0.00 0.00 34.83 35.59 1b76 s MET 60 CO 0.00 0.43 -0.08 -2.00 -0.65 0.00 0.00 175.02 172.72 1b76 s GLU 61 N -2.85 1.05 0.83 4.11 2.56 -0.59 -4.94 118.70 118.88 1b76 s GLU 61 Ca 0.25 -0.27 -0.13 0.00 0.00 0.00 0.00 54.97 54.82 1b76 s GLU 61 Cb -0.09 -0.96 0.10 0.00 2.00 0.00 0.00 34.13 35.18 1b76 s GLU 61 CO 0.15 0.05 1.20 0.20 -0.56 0.00 0.00 175.26 176.30 1b76 s GLY 62 N 0.45 1.62 0.04 -1.50 0.00 -1.26 -1.67 107.32 104.99 1b76 s GLY 62 Ca -0.07 -0.72 -0.27 0.00 0.00 0.00 0.00 44.72 43.65 1b76 s GLY 62 CO 0.01 -0.19 0.82 -2.27 0.00 0.00 0.00 173.10 171.46 1b76 s LEU 63 N -5.63 -0.42 -0.41 0.66 2.96 -0.89 -4.86 118.68 110.09 1b76 s LEU 63 Ca 0.64 -0.00 0.05 0.00 -0.22 0.00 0.00 54.13 54.60 1b76 s LEU 63 Cb -0.10 2.17 0.17 0.00 0.50 0.00 0.00 46.19 48.92 1b76 s LEU 63 CO 0.50 -0.71 0.49 -0.62 -1.32 0.00 0.00 176.35 174.69 1b76 s ASP 64 N -2.55 0.08 0.84 3.68 2.15 -1.26 -4.22 116.67 115.40 1b76 s ASP 64 Ca 0.04 -1.53 -0.11 0.00 0.43 0.00 0.00 52.55 51.39 1b76 s ASP 64 Cb -0.01 1.04 0.14 0.00 -0.30 0.00 0.00 42.92 43.79 1b76 s ASP 64 CO -0.10 -0.20 1.18 0.00 -0.17 0.00 0.00 175.17 175.88 1b76 s ALA 65 N 1.33 2.73 0.56 3.66 0.00 -1.26 -5.09 121.76 123.70 1b76 s ALA 65 Ca 0.20 -1.12 -0.04 0.00 0.00 0.00 0.00 51.96 51.01 1b76 s ALA 65 Cb -0.09 -2.66 0.01 0.00 0.00 0.00 0.00 23.12 20.39 1b76 s ALA 65 CO -0.05 -1.90 0.84 -1.54 0.00 0.00 0.00 175.76 173.10 1b76 s SER 66 N -4.73 5.56 -0.01 0.00 1.04 -1.26 -4.97 113.70 109.34 1b76 s SER 66 Ca 0.68 0.51 -0.20 0.00 0.48 0.00 0.00 55.95 57.42 1b76 s SER 66 Cb -0.07 -1.53 -0.29 0.00 0.10 0.00 0.00 66.02 64.23 1b76 s SER 66 CO 0.49 -1.02 1.00 0.58 0.98 0.00 0.00 173.24 175.28 1b76 h VAL 67 N -0.03 1.43 -3.17 5.02 2.07 -1.94 -3.45 116.25 116.18 1b76 h VAL 67 Ca -0.45 -2.39 -0.53 0.00 0.82 0.00 0.00 66.70 64.14 1b76 h VAL 67 Cb 1.26 2.92 0.01 0.00 -1.52 0.00 0.00 31.29 33.96 1b76 h VAL 67 CO 0.59 0.70 0.58 -0.76 0.02 0.00 0.00 177.57 178.69 1b76 s LEU 68 N -8.00 4.37 -0.05 2.57 1.43 -1.26 -0.93 118.68 116.81 1b76 s LEU 68 Ca -0.12 2.05 0.04 0.00 -1.03 0.00 0.00 54.13 55.06 1b76 s LEU 68 Cb 0.03 -3.58 -0.00 0.00 0.03 0.00 0.00 46.19 42.67 1b76 s LEU 68 CO 0.85 -0.49 -0.18 -0.89 0.23 0.00 0.00 176.35 175.87 1b76 s THR 69 N 1.08 1.52 0.05 5.49 2.01 -0.30 -4.93 115.64 120.55 1b76 s THR 69 Ca 0.59 -0.75 -0.30 0.00 0.31 0.00 0.00 61.69 61.54 1b76 s THR 69 Cb -0.30 -1.32 -0.08 0.00 0.01 0.00 0.00 72.50 70.81 1b76 s THR 69 CO 0.29 0.44 1.72 -2.28 -0.69 0.00 0.00 174.62 174.10 1b76 s HIS 70 N 0.14 2.13 0.15 4.92 2.46 -1.26 -1.21 115.29 122.63 1b76 s HIS 70 Ca -0.07 0.14 -0.01 0.00 0.47 0.00 0.00 55.06 55.59 1b76 s HIS 70 Cb -0.13 -4.02 0.32 0.00 -0.13 0.00 0.00 32.58 28.62 1b76 s HIS 70 CO 0.03 -4.23 0.79 -2.13 -2.47 0.00 0.00 174.74 166.74 1b76 n ARG 71 N 6.20 -0.04 -0.05 2.88 0.63 -1.25 -1.03 116.66 124.01 1b76 n ARG 71 Ca 0.17 0.77 -0.10 0.00 -0.92 0.00 0.00 57.85 57.77 1b76 n ARG 71 Cb 0.41 -1.19 -0.04 0.00 0.45 0.00 0.00 32.46 32.09 1b76 n ARG 71 CO 0.00 0.00 0.00 -0.07 -2.51 0.00 0.00 177.63 175.05 1b76 h LEU 72 N 0.00 -1.11 -0.54 6.15 3.38 -1.92 -2.59 115.31 118.68 1b76 h LEU 72 Ca 0.28 0.17 0.05 0.00 0.09 0.00 0.00 57.88 58.47 1b76 h LEU 72 Cb 0.51 0.48 -0.07 0.00 0.09 0.00 0.00 40.66 41.68 1b76 h LEU 72 CO -0.50 -0.36 -0.35 0.58 0.09 0.00 0.00 178.44 177.91 1b76 h VAL 73 N -0.36 0.00 0.00 1.22 2.07 -1.45 0.60 116.25 118.32 1b76 h VAL 73 Ca 0.12 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.64 1b76 h VAL 73 Cb 0.56 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.33 1b76 h VAL 73 CO -0.43 0.00 0.00 0.18 0.02 0.00 0.00 177.57 177.34 1b76 n LEU 74 N -4.32 0.39 0.01 2.57 4.77 -1.16 0.08 117.00 119.34 1b76 n LEU 74 Ca 0.01 0.65 -0.07 0.00 -0.03 0.00 0.00 56.01 56.56 1b76 n LEU 74 Cb 0.16 -0.66 -0.06 0.00 -2.33 0.00 0.00 43.42 40.53 1b76 n LEU 74 CO -0.08 -0.68 0.23 -0.74 -1.33 0.00 0.00 177.39 174.80 1b76 h HIS 75 N 0.00 -0.13 0.00 -1.77 -0.00 0.45 -1.04 115.15 112.66 1b76 h HIS 75 Ca 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 60.37 60.37 1b76 h HIS 75 Cb 0.11 0.04 -0.00 0.00 -0.00 0.00 0.00 27.41 27.56 1b76 h HIS 75 CO 0.00 0.25 -0.00 1.88 -0.00 0.00 0.00 177.93 180.06 1b76 h TYR 76 N -0.97 0.00 0.00 5.26 0.05 0.44 -0.38 116.97 121.37 1b76 h TYR 76 Ca -0.01 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.75 1b76 h TYR 76 Cb 0.43 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.17 1b76 h TYR 76 CO 0.09 0.00 -0.10 0.66 -1.05 0.00 0.00 178.16 177.76 1b76 h SER 77 N 0.00 0.00 0.00 3.88 4.64 -0.37 -3.45 113.55 118.25 1b76 h SER 77 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1b76 h SER 77 Cb 0.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 1b76 h SER 77 CO 0.00 0.10 0.00 0.61 -0.87 0.00 0.00 176.83 176.67 1b76 n GLY 78 N 0.29 0.74 0.08 -0.77 0.00 -0.15 -4.92 105.19 100.44 1b76 n GLY 78 Ca 0.01 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.90 1b76 n GLY 78 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1b76 h HIS 79 N 0.00 0.11 -0.70 1.61 3.86 -1.56 -3.30 115.15 115.17 1b76 h HIS 79 Ca 0.00 -0.04 0.14 0.00 -1.16 0.00 0.00 60.37 59.32 1b76 h HIS 79 Cb 0.00 -0.02 -0.10 0.00 1.06 0.00 0.00 27.41 28.35 1b76 h HIS 79 CO 0.00 0.60 0.18 1.49 0.86 0.00 0.00 177.93 181.05 1b76 h GLU 80 N -0.41 0.28 -1.00 2.45 4.81 -1.45 -2.68 114.58 116.58 1b76 h GLU 80 Ca 0.00 -0.02 0.04 0.00 -0.13 0.00 0.00 59.36 59.25 1b76 h GLU 80 Cb 0.59 -0.06 -0.06 0.00 0.63 0.00 0.00 28.75 29.85 1b76 h GLU 80 CO 0.01 0.18 0.65 0.00 -0.73 0.00 0.00 179.01 179.13 1b76 h ALA 81 N 1.56 1.32 0.00 2.92 0.00 -1.83 -2.51 119.26 120.72 1b76 h ALA 81 Ca 0.38 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.25 1b76 h ALA 81 Cb 0.62 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1b76 h ALA 81 CO -0.46 0.54 0.11 1.15 0.00 0.00 0.00 179.25 180.59 1b76 h THR 82 N 1.26 0.00 -0.16 0.00 2.02 -1.59 -1.28 112.91 113.15 1b76 h THR 82 Ca 0.40 0.00 -0.12 0.00 0.77 0.00 0.00 66.41 67.46 1b76 h THR 82 Cb 0.01 0.48 -0.09 0.00 -1.74 0.00 0.00 68.15 66.81 1b76 h THR 82 CO -0.13 0.00 -0.53 0.49 0.37 0.00 0.00 175.52 175.72 1b76 n PHE 83 N -2.30 0.59 -1.55 3.16 3.72 -0.95 -4.47 117.46 115.66 1b76 n PHE 83 Ca -0.01 -1.65 -0.25 0.00 -0.05 0.00 0.00 57.45 55.48 1b76 n PHE 83 Cb 0.14 -0.29 0.09 0.00 -0.94 0.00 0.00 39.48 38.49 1b76 n PHE 83 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1b76 n ALA 84 N -1.04 5.53 -3.64 4.37 0.00 -0.48 -4.51 120.51 120.73 1b76 n ALA 84 Ca 0.25 -3.46 -0.39 0.00 0.00 0.00 0.00 53.44 49.83 1b76 n ALA 84 Cb 0.76 -1.13 -0.09 0.00 0.00 0.00 0.00 19.45 19.00 1b76 n ALA 84 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1b76 s ASP 85 N -2.44 5.55 0.38 0.00 1.47 -1.26 -5.08 116.67 115.29 1b76 s ASP 85 Ca 0.56 -2.36 -0.28 0.00 1.18 0.00 0.00 52.55 51.66 1b76 s ASP 85 Cb 0.46 -1.94 -0.10 0.00 -0.34 0.00 0.00 42.92 41.00 1b76 s ASP 85 CO 0.02 -0.53 1.42 -2.84 0.68 0.00 0.00 175.17 173.92 1b76 s PRO 86 N 0.67 4.08 -0.31 2.11 0.02 -1.26 -4.08 135.00 136.23 1b76 s PRO 86 Ca 0.12 2.43 -0.00 0.00 0.02 0.00 0.00 61.00 63.57 1b76 s PRO 86 Cb -0.22 -2.92 0.10 0.00 0.02 0.00 0.00 34.50 31.48 1b76 s PRO 86 CO -0.03 -0.50 0.09 -1.64 -0.33 0.00 0.00 177.00 174.58 1b76 s MET 87 N -2.10 0.83 -1.19 5.54 -1.94 -0.95 -4.90 119.30 114.59 1b76 s MET 87 Ca 0.54 -1.20 -0.09 0.00 -1.71 0.00 0.00 55.69 53.23 1b76 s MET 87 Cb -0.44 -2.18 0.22 0.00 2.01 0.00 0.00 34.83 34.45 1b76 s MET 87 CO 0.59 -0.98 1.58 0.28 -0.01 0.00 0.00 175.02 176.48 1b76 n VAL 88 N 4.75 4.65 -1.63 -6.03 0.31 -1.26 -0.96 118.33 118.16 1b76 n VAL 88 Ca -0.01 -5.04 -0.45 0.00 -0.01 0.00 0.00 64.34 58.83 1b76 n VAL 88 Cb 0.42 -2.33 -0.02 0.00 -0.91 0.00 0.00 33.84 31.00 1b76 n VAL 88 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1b76 n ASP 89 N 3.29 2.06 -4.96 4.52 -0.08 -1.26 -4.54 116.55 115.57 1b76 n ASP 89 Ca 0.33 1.16 -0.23 0.00 -1.51 0.00 0.00 54.79 54.55 1b76 n ASP 89 Cb 0.37 -1.36 0.00 0.00 2.34 0.00 0.00 41.12 42.47 1b76 n ASP 89 CO 0.00 0.00 0.00 0.21 0.12 0.00 0.00 177.20 177.53 1b76 s ASN 90 N -0.12 6.01 -0.76 1.67 3.84 -1.24 -1.90 114.94 122.44 1b76 s ASN 90 Ca 0.64 0.26 -0.26 0.00 0.21 0.00 0.00 52.86 53.72 1b76 s ASN 90 Cb -0.69 -1.65 -0.00 0.00 -0.55 0.00 0.00 41.25 38.36 1b76 s ASN 90 CO 0.55 -0.52 1.65 0.00 -2.79 0.00 0.00 177.10 175.99 1b76 s ALA 91 N -2.41 2.32 0.00 1.71 0.00 -1.26 -2.69 121.76 119.43 1b76 s ALA 91 Ca 0.45 -1.26 0.00 0.00 0.00 0.00 0.00 51.96 51.15 1b76 s ALA 91 Cb -0.10 -4.37 0.00 0.00 0.00 0.00 0.00 23.12 18.65 1b76 s ALA 91 CO 0.36 -3.85 0.00 0.36 0.00 0.00 0.00 175.76 172.63 1b76 n LYS 92 N 9.14 0.00 0.00 0.00 2.85 -1.26 -4.92 118.16 123.97 1b76 n LYS 92 Ca 0.21 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.47 1b76 n LYS 92 Cb 0.50 -0.12 0.00 0.00 -0.65 0.00 0.00 35.03 34.76 1b76 n LYS 92 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1b76 n ALA 93 N -0.87 0.00 -3.00 0.58 0.00 -1.10 -5.18 120.51 110.94 1b76 n ALA 93 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1b76 n ALA 93 Cb 0.02 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.47 1b76 n ALA 93 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1b76 n ARG 94 N 0.00 0.00 0.00 0.00 5.12 -1.26 -3.99 116.66 116.52 1b76 n ARG 94 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 1b76 n ARG 94 Cb 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.30 1b76 n ARG 94 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 1b76 n TYR 95 N 0.00 0.00 -3.83 -1.55 4.02 -1.26 -3.61 117.16 110.93 1b76 n TYR 95 Ca 0.00 0.00 -0.13 0.00 -0.01 0.00 0.00 57.90 57.76 1b76 n TYR 95 Cb 0.00 0.00 -0.14 0.00 -0.02 0.00 0.00 39.34 39.18 1b76 n TYR 95 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 176.86 174.27 1b76 s TRP 159 N 0.00 -0.04 0.24 -0.72 0.52 -1.26 -4.51 118.94 113.17 1b76 s TRP 159 Ca 0.00 0.14 0.07 0.00 0.02 0.00 0.00 56.10 56.34 1b76 s TRP 159 Cb 0.00 -0.05 -0.04 0.00 -1.15 0.00 0.00 33.47 32.23 1b76 s TRP 159 CO 0.00 -0.05 0.13 0.99 0.02 0.00 0.00 176.95 178.05 1b76 s THR 160 N 0.35 4.18 0.34 2.01 2.01 -0.80 -4.91 115.64 118.82 1b76 s THR 160 Ca -0.03 -1.49 -0.29 0.00 0.31 0.00 0.00 61.69 60.19 1b76 s THR 160 Cb -0.04 -3.23 -0.12 0.00 0.01 0.00 0.00 72.50 69.12 1b76 s THR 160 CO -0.01 -0.32 1.48 -2.65 -0.69 0.00 0.00 174.62 172.43 1b76 n PRO 161 N -0.98 2.56 -1.97 4.92 -0.02 -1.26 -4.30 135.00 133.95 1b76 n PRO 161 Ca -0.08 0.90 -0.25 0.00 -2.02 0.00 0.00 63.50 62.05 1b76 n PRO 161 Cb 0.58 -2.62 -0.05 0.00 -0.02 0.00 0.00 33.50 31.39 1b76 n PRO 161 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1b76 s PRO 162 N -1.54 2.40 -0.03 0.52 0.04 -1.22 -4.58 135.00 130.59 1b76 s PRO 162 Ca 0.57 -0.10 0.04 0.00 0.04 0.00 0.00 61.00 61.55 1b76 s PRO 162 Cb -0.51 -4.98 -0.03 0.00 0.04 0.00 0.00 34.50 29.03 1b76 s PRO 162 CO 0.59 -3.51 -0.12 -0.98 0.04 0.00 0.00 177.00 173.02 1b76 s ARG 163 N 7.32 2.49 1.07 4.56 1.70 -0.14 -4.32 118.95 131.64 1b76 s ARG 163 Ca 0.74 -0.72 -0.16 0.00 -0.47 0.00 0.00 55.73 55.11 1b76 s ARG 163 Cb -0.08 -2.41 0.23 0.00 -0.57 0.00 0.00 34.95 32.12 1b76 s ARG 163 CO 0.02 0.61 1.15 0.71 -1.08 0.00 0.00 175.30 176.72 1b76 s TYR 164 N -0.84 1.30 -0.11 5.89 2.02 -1.26 -2.25 117.35 122.10 1b76 s TYR 164 Ca 0.13 0.59 0.14 0.00 -0.37 0.00 0.00 57.07 57.57 1b76 s TYR 164 Cb -0.11 -3.55 0.30 0.00 -0.40 0.00 0.00 41.96 38.21 1b76 s TYR 164 CO 0.03 -3.23 1.15 1.19 -1.57 0.00 0.00 175.55 173.12 1b76 n PHE 165 N -4.31 0.00 -0.13 2.71 3.01 -1.26 -4.90 117.46 112.58 1b76 n PHE 165 Ca 0.11 -0.91 -0.05 0.00 1.01 0.00 0.00 57.45 57.62 1b76 n PHE 165 Cb 0.59 -0.16 -0.01 0.00 -0.01 0.00 0.00 39.48 39.88 1b76 n PHE 165 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 1b76 n ASN 166 N -0.80 0.05 0.19 4.37 2.85 -1.26 -4.76 115.26 115.90 1b76 n ASN 166 Ca 0.13 0.04 0.14 0.00 -0.11 0.00 0.00 54.58 54.77 1b76 n ASN 166 Cb 0.74 -0.08 0.59 0.00 1.24 0.00 0.00 39.78 42.27 1b76 n ASN 166 CO 0.00 0.00 0.00 0.24 -2.11 0.00 0.00 177.26 175.39 1b76 h MET 167 N 0.99 0.00 -6.90 1.20 2.86 -1.96 -3.44 114.93 107.68 1b76 h MET 167 Ca -0.01 0.00 -0.47 0.00 -2.06 0.00 0.00 59.70 57.17 1b76 h MET 167 Cb 0.13 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.76 1b76 h MET 167 CO 0.12 0.00 0.24 -1.64 1.06 0.00 0.00 176.91 176.69 1b76 s MET 168 N -3.48 4.18 0.28 1.72 -1.94 -1.26 -0.31 119.30 118.50 1b76 s MET 168 Ca 0.02 0.97 -0.18 0.00 -1.71 0.00 0.00 55.69 54.79 1b76 s MET 168 Cb 0.09 -2.37 -0.09 0.00 2.01 0.00 0.00 34.83 34.48 1b76 s MET 168 CO 0.43 0.09 0.75 -0.06 -0.01 0.00 0.00 175.02 176.21 1b76 s PHE 169 N -2.02 3.51 0.28 -0.03 0.08 -1.26 -4.87 117.98 113.66 1b76 s PHE 169 Ca 0.57 1.33 0.08 0.00 0.12 0.00 0.00 56.93 59.04 1b76 s PHE 169 Cb -0.11 -2.60 -0.06 0.00 -0.57 0.00 0.00 43.02 39.68 1b76 s PHE 169 CO 0.16 0.20 -0.10 -0.65 -0.10 0.00 0.00 175.22 174.73 1b76 s GLN 170 N -2.50 1.58 -0.25 0.44 1.11 -1.26 -2.55 119.66 116.23 1b76 s GLN 170 Ca 0.49 -1.78 -0.29 0.00 0.01 0.00 0.00 55.36 53.80 1b76 s GLN 170 Cb -0.13 -1.33 0.17 0.00 -1.01 0.00 0.00 33.01 30.70 1b76 s GLN 170 CO 0.19 0.12 1.23 0.34 0.01 0.00 0.00 175.29 177.18 1b76 s ASP 171 N -3.46 -0.17 0.32 5.90 2.15 -0.64 -4.93 116.67 115.84 1b76 s ASP 171 Ca 0.29 0.22 0.08 0.00 0.43 0.00 0.00 52.55 53.57 1b76 s ASP 171 Cb 0.02 0.18 -0.04 0.00 -0.30 0.00 0.00 42.92 42.78 1b76 s ASP 171 CO 0.12 -0.14 0.11 -0.76 -0.17 0.00 0.00 175.17 174.33 1b76 s LEU 172 N -0.84 3.26 -0.91 -1.34 1.43 -1.26 0.55 118.68 119.56 1b76 s LEU 172 Ca 0.05 -0.74 -0.25 0.00 -1.03 0.00 0.00 54.13 52.17 1b76 s LEU 172 Cb -0.02 -1.74 0.04 0.00 0.03 0.00 0.00 46.19 44.51 1b76 s LEU 172 CO -0.06 -0.22 1.39 -0.60 0.23 0.00 0.00 176.35 177.09 1b76 s ARG 173 N -3.80 3.43 0.00 1.70 6.06 0.15 -4.90 118.95 121.58 1b76 s ARG 173 Ca 0.36 -0.77 0.00 0.00 -2.50 0.00 0.00 55.73 52.82 1b76 s ARG 173 Cb -0.03 -4.91 0.00 0.00 0.06 0.00 0.00 34.95 30.07 1b76 s ARG 173 CO 0.22 -2.20 0.00 0.41 -2.50 0.00 0.00 175.30 171.23 1b76 n GLY 174 N 6.32 0.83 3.16 8.12 0.00 -1.26 -4.40 105.19 117.96 1b76 n GLY 174 Ca 0.22 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1b76 n GLY 174 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1b76 n PRO 175 N 6.76 0.00 0.00 1.61 -0.02 -1.26 -4.32 135.00 137.77 1b76 n PRO 175 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1b76 n PRO 175 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 1b76 n PRO 175 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1b76 n ARG 176 N 0.00 0.00 -2.54 -0.52 1.74 -1.26 -5.06 116.66 109.02 1b76 n ARG 176 Ca 0.00 0.00 -0.02 0.00 -0.77 0.00 0.00 57.85 57.06 1b76 n ARG 176 Cb 0.00 0.00 0.11 0.00 -1.02 0.00 0.00 32.46 31.55 1b76 n ARG 176 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1b76 n GLY 177 N 5.00 1.90 3.78 -0.13 0.00 -1.26 -4.78 105.19 109.70 1b76 n GLY 177 Ca 0.00 -0.24 -0.41 0.00 0.00 0.00 0.00 46.02 45.38 1b76 n GLY 177 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1b76 s GLY 178 N -1.35 2.95 0.50 -0.02 0.00 -1.26 -4.85 107.32 103.30 1b76 s GLY 178 Ca 0.10 1.52 0.29 0.00 0.00 0.00 0.00 44.72 46.62 1b76 s GLY 178 CO -0.11 2.20 1.86 -0.09 0.00 0.00 0.00 173.10 176.96 1b76 h ARG 179 N 3.06 0.00 0.03 2.90 9.65 -2.00 0.29 114.38 128.32 1b76 h ARG 179 Ca -0.50 0.00 -0.23 0.00 -1.10 0.00 0.00 59.98 58.15 1b76 h ARG 179 Cb 1.24 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 29.81 1b76 h ARG 179 CO 0.64 0.00 -0.99 0.78 2.80 0.00 0.00 179.97 183.20 1b76 h GLY 180 N 0.00 0.31 -3.97 2.80 0.00 -2.04 -3.27 103.07 96.90 1b76 h GLY 180 Ca 0.00 -0.61 -0.58 0.00 0.00 0.00 0.00 47.33 46.14 1b76 h GLY 180 CO 0.00 0.54 0.72 1.04 0.00 0.00 0.00 176.54 178.84 1b76 n LEU 181 N -3.64 7.08 -4.77 3.11 4.77 0.10 -4.93 117.00 118.72 1b76 n LEU 181 Ca -0.06 -3.89 -0.40 0.00 -0.03 0.00 0.00 56.01 51.64 1b76 n LEU 181 Cb 0.88 -0.89 -0.06 0.00 -2.33 0.00 0.00 43.42 41.02 1b76 n LEU 181 CO 0.50 1.23 0.53 -0.22 -1.33 0.00 0.00 177.39 178.09 1b76 s LEU 182 N -3.51 4.59 0.08 2.23 2.96 -1.17 0.32 118.68 124.18 1b76 s LEU 182 Ca 0.60 1.70 0.03 0.00 -0.22 0.00 0.00 54.13 56.24 1b76 s LEU 182 Cb 0.49 -3.37 -0.03 0.00 0.50 0.00 0.00 46.19 43.78 1b76 s LEU 182 CO 0.06 0.17 -0.09 0.00 -1.32 0.00 0.00 176.35 175.17 1b76 s ALA 183 N -1.02 0.92 0.27 5.97 0.00 0.19 -3.77 121.76 124.33 1b76 s ALA 183 Ca 0.38 -1.08 0.11 0.00 0.00 0.00 0.00 51.96 51.37 1b76 s ALA 183 Cb -0.24 0.05 -0.05 0.00 0.00 0.00 0.00 23.12 22.89 1b76 s ALA 183 CO 0.27 -0.06 -0.16 0.71 0.00 0.00 0.00 175.76 176.52 1b76 s TYR 184 N -2.30 2.38 -0.22 0.00 1.51 -0.35 -1.62 117.35 116.74 1b76 s TYR 184 Ca 0.02 -0.31 -0.15 0.00 -1.01 0.00 0.00 57.07 55.62 1b76 s TYR 184 Cb -0.04 -1.04 -0.04 0.00 -0.11 0.00 0.00 41.96 40.74 1b76 s TYR 184 CO -0.01 0.69 0.35 -0.51 -1.11 0.00 0.00 175.55 174.97 1b76 s LEU 185 N -3.52 4.12 -0.24 -1.29 1.43 -1.06 -1.15 118.68 116.97 1b76 s LEU 185 Ca 0.30 0.39 -0.37 0.00 -1.03 0.00 0.00 54.13 53.42 1b76 s LEU 185 Cb -0.05 -2.43 -0.13 0.00 0.03 0.00 0.00 46.19 43.61 1b76 s LEU 185 CO 0.16 -0.08 1.90 -2.11 0.23 0.00 0.00 176.35 176.45 1b76 n ARG 186 N 4.65 1.44 0.12 1.70 1.85 -0.10 -4.42 116.66 121.91 1b76 n ARG 186 Ca -0.09 0.50 0.02 0.00 -1.00 0.00 0.00 57.85 57.28 1b76 n ARG 186 Cb 0.51 -2.35 0.38 0.00 -1.05 0.00 0.00 32.46 29.94 1b76 n ARG 186 CO 0.00 0.00 0.00 -1.00 -0.01 0.00 0.00 177.63 176.62 1b76 h PRO 187 N 9.08 0.23 -4.04 2.89 0.13 -1.92 -1.67 132.00 136.70 1b76 h PRO 187 Ca -0.42 -0.06 -0.13 0.00 -0.87 0.00 0.00 66.00 64.52 1b76 h PRO 187 Cb 1.31 -0.03 -0.16 0.00 0.13 0.00 0.00 31.00 32.24 1b76 h PRO 187 CO 0.97 0.40 -0.61 -1.83 -0.23 0.00 0.00 178.00 176.70 1b76 s GLU 188 N -4.66 0.58 0.14 0.86 -1.05 -1.26 -4.14 118.70 109.18 1b76 s GLU 188 Ca -0.05 -0.98 -0.03 0.00 -0.15 0.00 0.00 54.97 53.76 1b76 s GLU 188 Cb 0.15 0.21 -0.06 0.00 -0.44 0.00 0.00 34.13 34.00 1b76 s GLU 188 CO 0.74 -0.13 1.34 1.15 0.95 0.00 0.00 175.26 179.30 1b76 h THR 189 N 3.47 1.41 -0.88 1.83 2.02 -1.86 -3.34 112.91 115.56 1b76 h THR 189 Ca -0.33 -2.40 0.31 0.00 0.77 0.00 0.00 66.41 64.76 1b76 h THR 189 Cb 1.17 2.36 -0.16 0.00 -1.74 0.00 0.00 68.15 69.78 1b76 h THR 189 CO 0.57 0.72 0.28 0.00 0.37 0.00 0.00 175.52 177.46 1b76 n ALA 190 N -2.53 0.71 -0.05 6.16 0.00 -1.26 -1.63 120.51 121.91 1b76 n ALA 190 Ca -0.06 0.91 -0.08 0.00 0.00 0.00 0.00 53.44 54.22 1b76 n ALA 190 Cb 0.81 -0.81 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 1b76 n ALA 190 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1b76 h GLN 191 N 0.00 0.05 -0.39 0.00 1.08 -2.02 -1.44 115.11 112.39 1b76 h GLN 191 Ca 0.65 -0.00 0.11 0.00 -1.45 0.00 0.00 58.65 57.97 1b76 h GLN 191 Cb 1.60 -0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 29.01 1b76 h GLN 191 CO -0.74 0.03 0.31 0.78 -0.95 0.00 0.00 178.83 178.26 1b76 h GLY 192 N 0.05 0.00 0.48 3.46 0.00 -1.58 -1.88 103.07 103.60 1b76 h GLY 192 Ca 0.11 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.42 1b76 h GLY 192 CO -0.20 0.00 -0.15 -2.22 0.00 0.00 0.00 176.54 173.96 1b76 h ILE 193 N 0.00 0.48 -0.45 2.60 2.04 -1.37 -3.06 117.51 117.75 1b76 h ILE 193 Ca 0.19 -0.77 0.09 0.00 1.00 0.00 0.00 64.86 65.37 1b76 h ILE 193 Cb 0.79 0.76 -0.10 0.00 -0.74 0.00 0.00 36.82 37.54 1b76 h ILE 193 CO -0.00 0.11 -0.31 -0.26 0.00 0.00 0.00 178.15 177.69 1b76 h PHE 194 N -0.96 -0.84 0.00 1.37 0.04 -1.11 0.13 116.94 115.57 1b76 h PHE 194 Ca -0.04 0.06 0.00 0.00 2.80 0.00 0.00 57.97 60.79 1b76 h PHE 194 Cb 0.51 0.43 0.00 0.00 2.20 0.00 0.00 35.95 39.09 1b76 h PHE 194 CO 0.04 -0.37 0.00 -0.39 -0.60 0.00 0.00 178.31 176.99 1b76 h VAL 195 N -0.21 0.00 -0.00 -0.55 -1.51 -1.51 -1.37 116.25 111.10 1b76 h VAL 195 Ca 0.19 -0.08 0.00 0.00 -1.23 0.00 0.00 66.70 65.58 1b76 h VAL 195 Cb 0.53 0.91 0.00 0.00 -2.13 0.00 0.00 31.29 30.59 1b76 h VAL 195 CO -0.57 0.00 -0.88 0.59 -1.23 0.00 0.00 177.57 175.49 1b76 n ASN 196 N -2.76 1.12 -0.07 4.19 3.02 0.37 -4.73 115.26 116.39 1b76 n ASN 196 Ca -0.02 -1.06 -0.02 0.00 -0.03 0.00 0.00 54.58 53.46 1b76 n ASN 196 Cb 0.10 0.92 -0.02 0.00 -0.61 0.00 0.00 39.78 40.17 1b76 n ASN 196 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1b76 n PHE 197 N -1.25 -0.08 -0.21 3.10 7.35 -0.52 -0.29 117.46 125.57 1b76 n PHE 197 Ca 0.05 0.22 0.01 0.00 -0.76 0.00 0.00 57.45 56.97 1b76 n PHE 197 Cb 0.34 -0.41 0.11 0.00 0.35 0.00 0.00 39.48 39.87 1b76 n PHE 197 CO 0.00 0.00 0.00 -0.22 -0.76 0.00 0.00 176.76 175.78 1b76 h LYS 198 N 0.00 0.16 -0.18 -4.13 1.63 -1.85 0.20 116.57 112.41 1b76 h LYS 198 Ca 0.03 -0.01 -0.07 0.00 -0.85 0.00 0.00 60.65 59.75 1b76 h LYS 198 Cb 0.07 -0.04 -0.01 0.00 -0.60 0.00 0.00 32.23 31.65 1b76 h LYS 198 CO -0.16 0.10 -0.19 -0.91 -3.45 0.00 0.00 179.45 174.84 1b76 h ASN 199 N 0.16 0.30 -0.04 4.20 2.35 -0.97 0.71 115.58 122.29 1b76 h ASN 199 Ca 0.33 -0.08 -0.17 0.00 -0.55 0.00 0.00 56.30 55.83 1b76 h ASN 199 Cb 0.53 -0.08 0.01 0.00 0.05 0.00 0.00 38.32 38.83 1b76 h ASN 199 CO -0.50 0.51 -0.65 1.62 -1.65 0.00 0.00 177.43 176.77 1b76 h VAL 200 N 0.28 1.38 -0.09 2.81 3.04 0.10 -2.38 116.25 121.40 1b76 h VAL 200 Ca 0.05 -2.02 0.02 0.00 -1.01 0.00 0.00 66.70 63.74 1b76 h VAL 200 Cb 0.51 2.41 -0.02 0.00 -2.01 0.00 0.00 31.29 32.18 1b76 h VAL 200 CO 0.03 0.60 -0.02 0.25 -1.01 0.00 0.00 177.57 177.42 1b76 h LEU 201 N 0.07 -0.09 0.15 3.16 5.85 -0.13 -0.61 115.31 123.72 1b76 h LEU 201 Ca -0.07 0.03 0.02 0.00 0.84 0.00 0.00 57.88 58.70 1b76 h LEU 201 Cb 1.33 0.06 -0.04 0.00 0.37 0.00 0.00 40.66 42.37 1b76 h LEU 201 CO 0.13 -0.03 -0.39 0.44 -0.34 0.00 0.00 178.44 178.25 1b76 h ASP 202 N -0.00 -1.14 -0.27 1.25 5.19 0.42 1.04 116.42 122.91 1b76 h ASP 202 Ca 0.04 0.13 0.07 0.00 -0.62 0.00 0.00 57.03 56.65 1b76 h ASP 202 Cb 0.07 0.43 -0.01 0.00 0.18 0.00 0.00 39.33 39.99 1b76 h ASP 202 CO -0.09 -0.48 0.19 0.00 -3.12 0.00 0.00 179.24 175.74 1b76 h ALA 203 N -0.13 2.22 0.00 3.45 0.00 -0.97 -3.06 119.26 120.77 1b76 h ALA 203 Ca 0.02 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1b76 h ALA 203 Cb 0.66 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 1b76 h ALA 203 CO -0.21 -0.30 -1.62 0.25 0.00 0.00 0.00 179.25 177.37 1b76 n THR 204 N -4.46 0.03 -3.51 0.00 -2.24 -0.28 -5.01 114.28 98.81 1b76 n THR 204 Ca 0.03 -0.31 -0.22 0.00 -2.27 0.00 0.00 64.05 61.28 1b76 n THR 204 Cb 0.33 0.16 0.07 0.00 -2.10 0.00 0.00 70.33 68.80 1b76 n THR 204 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1b76 n SER 205 N -1.98 -5.93 -4.75 3.42 7.64 0.36 -4.94 113.62 107.43 1b76 n SER 205 Ca -0.03 -0.50 -0.36 0.00 1.01 0.00 0.00 58.87 58.98 1b76 n SER 205 Cb 0.37 -4.69 0.04 0.00 -1.01 0.00 0.00 64.21 58.91 1b76 n SER 205 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1b76 s ARG 206 N -6.18 2.94 0.15 1.43 1.81 -1.23 -5.04 118.95 112.82 1b76 s ARG 206 Ca 0.53 1.91 0.04 0.00 -1.72 0.00 0.00 55.73 56.48 1b76 s ARG 206 Cb -0.23 -1.96 -0.04 0.00 -0.45 0.00 0.00 34.95 32.27 1b76 s ARG 206 CO 0.67 -1.25 0.18 0.15 -0.68 0.00 0.00 175.30 174.37 1b76 s LYS 207 N -3.28 3.09 0.14 3.54 -0.14 -1.26 -5.05 119.74 116.78 1b76 s LYS 207 Ca 0.77 -0.75 -0.31 0.00 -1.36 0.00 0.00 55.97 54.33 1b76 s LYS 207 Cb -0.33 -2.77 -0.09 0.00 -1.68 0.00 0.00 37.83 32.96 1b76 s LYS 207 CO 0.35 0.51 1.52 -0.07 -0.76 0.00 0.00 175.35 176.90 1b76 h LEU 208 N 2.43 -1.89 -8.27 3.17 3.38 -1.94 -3.35 115.31 108.85 1b76 h LEU 208 Ca -0.48 0.26 -0.05 0.00 0.09 0.00 0.00 57.88 57.71 1b76 h LEU 208 Cb 1.19 0.80 -0.02 0.00 0.09 0.00 0.00 40.66 42.73 1b76 h LEU 208 CO 0.66 -0.32 0.30 0.61 0.09 0.00 0.00 178.44 179.77 1b76 n GLY 209 N -1.31 -0.22 3.60 0.83 0.00 -1.26 -4.53 105.19 102.29 1b76 n GLY 209 Ca -0.01 0.25 -0.14 0.00 0.00 0.00 0.00 46.02 46.12 1b76 n GLY 209 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1b76 s PHE 210 N 12.85 -0.66 0.46 1.61 -0.71 -1.21 -4.88 117.98 125.44 1b76 s PHE 210 Ca 0.96 1.45 0.03 0.00 -1.04 0.00 0.00 56.93 58.33 1b76 s PHE 210 Cb -0.22 0.34 -0.03 0.00 -1.21 0.00 0.00 43.02 41.90 1b76 s PHE 210 CO 0.16 -0.41 0.03 0.20 -1.34 0.00 0.00 175.22 173.86 1b76 s GLY 211 N -0.21 2.81 -0.34 1.99 0.00 0.28 -1.36 107.32 110.48 1b76 s GLY 211 Ca -0.03 -0.95 -0.01 0.00 0.00 0.00 0.00 44.72 43.74 1b76 s GLY 211 CO 0.02 -2.08 0.19 -0.42 0.00 0.00 0.00 173.10 170.81 1b76 s ILE 212 N -2.95 0.14 0.78 0.90 1.01 -1.13 -1.54 121.20 118.40 1b76 s ILE 212 Ca 0.16 -1.51 -0.11 0.00 0.00 0.00 0.00 60.65 59.19 1b76 s ILE 212 Cb 0.03 -1.12 0.06 0.00 0.01 0.00 0.00 42.46 41.44 1b76 s ILE 212 CO 0.08 -0.92 1.08 0.00 0.00 0.00 0.00 174.94 175.18 1b76 s ALA 213 N 1.30 2.27 -0.30 9.38 0.00 -0.67 -3.48 121.76 130.26 1b76 s ALA 213 Ca 0.16 0.01 -0.15 0.00 0.00 0.00 0.00 51.96 51.98 1b76 s ALA 213 Cb -0.21 -3.18 0.16 0.00 0.00 0.00 0.00 23.12 19.89 1b76 s ALA 213 CO -0.08 -1.68 0.97 -1.14 0.00 0.00 0.00 175.76 173.83 1b76 s GLN 214 N -5.03 0.32 -0.11 0.00 0.74 0.83 -2.10 119.66 114.31 1b76 s GLN 214 Ca 0.60 0.74 -0.08 0.00 0.05 0.00 0.00 55.36 56.68 1b76 s GLN 214 Cb -0.15 0.37 -0.04 0.00 1.10 0.00 0.00 33.01 34.29 1b76 s GLN 214 CO 0.55 -0.10 0.17 0.42 -0.55 0.00 0.00 175.29 175.78 1b76 s ILE 215 N 2.21 5.46 -0.01 -2.34 1.01 -1.26 -0.95 121.20 125.32 1b76 s ILE 215 Ca -0.04 0.28 -0.30 0.00 0.00 0.00 0.00 60.65 60.59 1b76 s ILE 215 Cb -0.06 -3.43 0.11 0.00 0.01 0.00 0.00 42.46 39.09 1b76 s ILE 215 CO -0.17 0.62 1.10 -0.83 0.00 0.00 0.00 174.94 175.65 1b76 s GLY 216 N -1.03 -0.35 0.64 6.18 0.00 -1.10 -4.86 107.32 106.79 1b76 s GLY 216 Ca 0.16 0.80 -0.16 0.00 0.00 0.00 0.00 44.72 45.52 1b76 s GLY 216 CO 0.05 0.22 1.12 0.54 0.00 0.00 0.00 173.10 175.03 1b76 s LYS 217 N -2.80 2.88 -0.20 2.90 -0.14 -1.26 -0.96 119.74 120.16 1b76 s LYS 217 Ca 0.11 1.47 -0.08 0.00 -1.36 0.00 0.00 55.97 56.11 1b76 s LYS 217 Cb 0.01 -1.95 0.09 0.00 -1.68 0.00 0.00 37.83 34.29 1b76 s LYS 217 CO -0.03 -1.20 0.44 0.00 -0.76 0.00 0.00 175.35 173.79 1b76 s ALA 218 N -2.18 -1.21 -0.11 5.17 0.00 0.48 -4.52 121.76 119.40 1b76 s ALA 218 Ca 0.69 1.58 -0.04 0.00 0.00 0.00 0.00 51.96 54.19 1b76 s ALA 218 Cb -0.22 -1.29 -0.04 0.00 0.00 0.00 0.00 23.12 21.58 1b76 s ALA 218 CO 0.38 -0.68 0.05 -0.06 0.00 0.00 0.00 175.76 175.46 1b76 s PHE 219 N 2.41 3.30 -0.22 0.00 0.40 -0.63 -0.88 117.98 122.36 1b76 s PHE 219 Ca -0.03 0.27 -0.04 0.00 -0.60 0.00 0.00 56.93 56.53 1b76 s PHE 219 Cb -0.11 -1.87 0.12 0.00 0.51 0.00 0.00 43.02 41.66 1b76 s PHE 219 CO -0.13 0.50 0.37 0.50 0.70 0.00 0.00 175.22 177.16 1b76 s ARG 220 N -0.76 0.32 0.00 0.44 3.52 0.46 -3.76 118.95 119.17 1b76 s ARG 220 Ca 0.12 0.63 -0.01 0.00 -0.13 0.00 0.00 55.73 56.34 1b76 s ARG 220 Cb -0.12 -0.34 -0.05 0.00 -1.56 0.00 0.00 34.95 32.88 1b76 s ARG 220 CO 0.03 -0.54 1.18 -1.71 -0.81 0.00 0.00 175.30 173.45 1b76 n ASN 221 N 5.37 1.77 -4.68 -2.12 2.85 0.58 -3.46 115.26 115.57 1b76 n ASN 221 Ca -0.05 -1.68 -0.66 0.00 -0.11 0.00 0.00 54.58 52.09 1b76 n ASN 221 Cb 0.50 -0.43 -0.09 0.00 1.24 0.00 0.00 39.78 40.99 1b76 n ASN 221 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53 1b76 n GLU 222 N 2.41 0.00 0.26 1.20 -0.58 -1.26 -4.79 120.64 117.88 1b76 n GLU 222 Ca 0.08 0.00 0.14 0.00 -0.42 0.00 0.00 57.16 56.97 1b76 n GLU 222 Cb 0.25 -1.50 0.62 0.00 -0.57 0.00 0.00 31.44 30.24 1b76 n GLU 222 CO 0.00 0.00 0.00 0.97 -0.48 0.00 0.00 177.13 177.62 1b76 h ILE 223 N 4.48 0.24 -2.66 -3.67 6.09 -1.95 -3.35 117.51 116.70 1b76 h ILE 223 Ca -0.46 -0.72 -0.59 0.00 -1.37 0.00 0.00 64.86 61.72 1b76 h ILE 223 Cb 1.38 1.58 -0.39 0.00 0.47 0.00 0.00 36.82 39.86 1b76 h ILE 223 CO 0.89 0.09 -0.84 0.42 -3.07 0.00 0.00 178.15 175.64 1b76 s THR 224 N -3.71 0.63 0.03 2.19 -4.23 -1.26 -5.09 115.64 104.19 1b76 s THR 224 Ca 0.01 -2.25 -0.30 0.00 -1.18 0.00 0.00 61.69 57.96 1b76 s THR 224 Cb 0.10 -1.45 -0.05 0.00 1.34 0.00 0.00 72.50 72.44 1b76 s THR 224 CO 0.58 -1.02 1.26 -2.84 -0.54 0.00 0.00 174.62 172.05 1b76 s PRO 225 N 0.54 4.37 -0.17 3.99 0.02 -1.26 -4.96 135.00 137.55 1b76 s PRO 225 Ca 0.22 1.81 -0.00 0.00 0.02 0.00 0.00 61.00 63.05 1b76 s PRO 225 Cb -0.16 -3.43 0.00 0.00 0.02 0.00 0.00 34.50 30.92 1b76 s PRO 225 CO -0.05 -0.38 -0.14 1.03 -0.33 0.00 0.00 177.00 177.12 1b76 s ARG 226 N 1.62 3.21 0.00 5.54 0.52 -1.21 -4.93 118.95 123.70 1b76 s ARG 226 Ca 0.60 -0.74 0.00 0.00 -0.52 0.00 0.00 55.73 55.06 1b76 s ARG 226 Cb -0.29 -2.67 0.00 0.00 0.52 0.00 0.00 34.95 32.51 1b76 s ARG 226 CO 0.27 -0.04 0.00 0.27 0.02 0.00 0.00 175.30 175.82 1b76 n ASN 227 N 4.22 -4.12 -1.07 0.23 0.23 -1.26 -3.92 115.26 109.57 1b76 n ASN 227 Ca -0.19 0.84 0.07 0.00 -0.53 0.00 0.00 54.58 54.77 1b76 n ASN 227 Cb 0.51 -1.32 -0.02 0.00 -2.08 0.00 0.00 39.78 36.88 1b76 n ASN 227 CO 0.00 0.00 0.00 0.33 -0.93 0.00 0.00 177.26 176.66 1b76 n PHE 228 N 2.18 -2.51 -0.61 -2.53 7.35 -1.26 -4.24 117.46 115.84 1b76 n PHE 228 Ca 0.00 0.62 -0.43 0.00 -0.76 0.00 0.00 57.45 56.88 1b76 n PHE 228 Cb 0.00 -0.98 -0.12 0.00 0.35 0.00 0.00 39.48 38.74 1b76 n PHE 228 CO 0.00 0.00 0.00 1.51 -0.76 0.00 0.00 176.76 177.51 1b76 n ILE 229 N -2.64 0.10 0.00 -2.13 0.13 -1.26 -4.47 119.36 109.09 1b76 n ILE 229 Ca 0.00 -0.09 0.00 0.00 -1.10 0.00 0.00 62.75 61.56 1b76 n ILE 229 Cb 0.23 -2.02 0.00 0.00 -0.84 0.00 0.00 39.64 37.01 1b76 n ILE 229 CO 0.00 0.00 0.00 0.33 2.80 0.00 0.00 176.55 179.68 1b76 n PHE 230 N 9.66 0.00 -2.96 9.51 -0.00 -1.26 -4.38 117.46 128.03 1b76 n PHE 230 Ca 0.47 0.00 -0.44 0.00 -0.00 0.00 0.00 57.45 57.48 1b76 n PHE 230 Cb 0.42 0.00 -0.00 0.00 -0.00 0.00 0.00 39.48 39.90 1b76 n PHE 230 CO 0.00 0.00 0.00 0.50 -0.00 0.00 0.00 176.76 177.26 1b76 s ARG 231 N 1.17 4.03 0.55 -4.13 3.52 -1.25 -4.87 118.95 117.97 1b76 s ARG 231 Ca 0.00 -2.51 0.06 0.00 -0.13 0.00 0.00 55.73 53.16 1b76 s ARG 231 Cb 0.00 -5.02 0.05 0.00 -1.56 0.00 0.00 34.95 28.41 1b76 s ARG 231 CO 0.00 -1.74 0.48 0.14 -0.81 0.00 0.00 175.30 173.37 1b76 s VAL 232 N 1.60 1.78 -0.18 7.11 -7.23 -1.26 -3.30 120.40 118.92 1b76 s VAL 232 Ca 0.41 -1.39 0.19 0.00 -1.81 0.00 0.00 61.98 59.38 1b76 s VAL 232 Cb -0.03 -2.17 -0.04 0.00 0.56 0.00 0.00 36.38 34.70 1b76 s VAL 232 CO -0.01 0.00 1.02 0.03 -0.31 0.00 0.00 175.10 175.83 1b76 h ARG 233 N 0.64 0.00 -4.21 4.82 3.08 -0.72 -3.41 114.38 114.58 1b76 h ARG 233 Ca -0.35 0.00 -0.56 0.00 0.07 0.00 0.00 59.98 59.14 1b76 h ARG 233 Cb 1.30 0.00 -0.38 0.00 0.08 0.00 0.00 29.97 30.97 1b76 h ARG 233 CO 0.54 0.21 -0.79 -2.00 -1.07 0.00 0.00 179.97 176.86 1b76 s GLU 234 N -3.08 1.50 0.30 0.04 2.56 -1.19 -0.41 118.70 118.43 1b76 s GLU 234 Ca -0.01 -0.54 -0.13 0.00 0.00 0.00 0.00 54.97 54.29 1b76 s GLU 234 Cb 0.09 -2.04 0.01 0.00 2.00 0.00 0.00 34.13 34.19 1b76 s GLU 234 CO 0.79 -0.43 0.58 -0.59 -0.56 0.00 0.00 175.26 175.05 1b76 s PHE 235 N 1.61 0.36 0.09 5.30 -0.71 -0.05 -4.66 117.98 119.92 1b76 s PHE 235 Ca 0.01 -0.78 0.03 0.00 -1.04 0.00 0.00 56.93 55.15 1b76 s PHE 235 Cb -0.15 0.35 -0.04 0.00 -1.21 0.00 0.00 43.02 41.97 1b76 s PHE 235 CO -0.08 -1.17 -0.10 -1.83 -1.34 0.00 0.00 175.22 170.70 1b76 s GLU 236 N -3.48 0.82 -0.16 1.99 -1.05 -1.26 0.18 118.70 115.73 1b76 s GLU 236 Ca 0.21 -1.14 -0.12 0.00 -0.15 0.00 0.00 54.97 53.77 1b76 s GLU 236 Cb -0.02 -0.48 0.05 0.00 -0.44 0.00 0.00 34.13 33.23 1b76 s GLU 236 CO 0.11 0.07 0.42 1.14 0.95 0.00 0.00 175.26 177.95 1b76 s GLN 237 N -2.78 0.45 -0.42 -4.83 -2.07 -0.13 -0.66 119.66 109.22 1b76 s GLN 237 Ca 0.05 0.68 -0.25 0.00 -1.82 0.00 0.00 55.36 54.01 1b76 s GLN 237 Cb -0.03 0.12 0.02 0.00 -1.09 0.00 0.00 33.01 32.03 1b76 s GLN 237 CO -0.00 -0.10 0.92 0.00 -1.32 0.00 0.00 175.29 174.78 1b76 s MET 238 N 0.75 3.67 0.06 9.60 0.23 -0.85 -2.70 119.30 130.07 1b76 s MET 238 Ca -0.04 0.34 0.05 0.00 -1.03 0.00 0.00 55.69 55.02 1b76 s MET 238 Cb -0.05 -3.87 -0.04 0.00 -1.53 0.00 0.00 34.83 29.34 1b76 s MET 238 CO -0.05 -1.09 -0.08 -1.21 -2.03 0.00 0.00 175.02 170.55 1b76 s GLU 239 N 3.61 2.33 -0.01 3.16 2.02 -0.13 -2.51 118.70 127.17 1b76 s GLU 239 Ca 0.37 -0.89 0.05 0.00 0.02 0.00 0.00 54.97 54.53 1b76 s GLU 239 Cb -0.11 -2.40 -0.01 0.00 0.10 0.00 0.00 34.13 31.71 1b76 s GLU 239 CO 0.23 0.55 -0.17 0.42 0.02 0.00 0.00 175.26 176.30 1b76 s ILE 240 N -1.13 1.36 -0.51 -1.63 1.01 -1.10 -0.12 121.20 119.07 1b76 s ILE 240 Ca 0.20 -0.74 0.03 0.00 0.00 0.00 0.00 60.65 60.14 1b76 s ILE 240 Cb -0.11 -1.13 0.14 0.00 0.01 0.00 0.00 42.46 41.38 1b76 s ILE 240 CO 0.11 0.38 0.31 -1.61 0.00 0.00 0.00 174.94 174.13 1b76 s GLU 241 N -0.41 1.67 -0.51 2.79 0.41 -1.23 -3.10 118.70 118.33 1b76 s GLU 241 Ca 0.07 -2.46 -0.28 0.00 -0.41 0.00 0.00 54.97 51.89 1b76 s GLU 241 Cb -0.07 -2.72 0.01 0.00 -1.78 0.00 0.00 34.13 29.58 1b76 s GLU 241 CO -0.01 -1.20 1.38 -0.47 -0.49 0.00 0.00 175.26 174.47 1b76 s TYR 242 N -0.22 2.39 -0.57 1.61 5.04 -0.47 -2.86 117.35 122.27 1b76 s TYR 242 Ca 0.21 0.56 -0.28 0.00 -2.44 0.00 0.00 57.07 55.12 1b76 s TYR 242 Cb -0.18 -4.38 0.03 0.00 0.35 0.00 0.00 41.96 37.79 1b76 s TYR 242 CO -0.05 -1.89 1.16 -0.06 -1.34 0.00 0.00 175.55 173.36 1b76 s PHE 243 N 5.65 2.65 0.09 4.97 0.08 -0.47 -1.60 117.98 129.36 1b76 s PHE 243 Ca 0.54 0.38 0.09 0.00 0.12 0.00 0.00 56.93 58.06 1b76 s PHE 243 Cb -0.11 -4.45 -0.04 0.00 -0.57 0.00 0.00 43.02 37.85 1b76 s PHE 243 CO 0.28 -1.53 -0.19 0.08 -0.10 0.00 0.00 175.22 173.76 1b76 s VAL 244 N 4.78 2.75 0.24 -0.44 1.01 0.72 -3.36 120.40 126.11 1b76 s VAL 244 Ca 0.42 -1.43 -0.31 0.00 0.00 0.00 0.00 61.98 60.66 1b76 s VAL 244 Cb -0.08 -2.23 -0.11 0.00 0.00 0.00 0.00 36.38 33.97 1b76 s VAL 244 CO 0.25 0.17 1.58 -0.60 0.00 0.00 0.00 175.10 176.51 1b76 s ARG 245 N -1.91 4.17 0.01 2.72 3.52 -1.26 0.98 118.95 127.19 1b76 s ARG 245 Ca 0.16 2.48 -0.02 0.00 -0.13 0.00 0.00 55.73 58.23 1b76 s ARG 245 Cb -0.10 -3.08 -0.00 0.00 -1.56 0.00 0.00 34.95 30.20 1b76 s ARG 245 CO 0.08 -0.60 0.09 -2.30 -0.81 0.00 0.00 175.30 171.76 1b76 n PRO 246 N 2.94 -0.02 -0.36 5.12 -0.02 -1.26 -1.13 135.00 140.26 1b76 n PRO 246 Ca 0.11 0.09 -0.03 0.00 -2.02 0.00 0.00 63.50 61.65 1b76 n PRO 246 Cb 0.38 -0.13 0.10 0.00 -0.02 0.00 0.00 33.50 33.83 1b76 n PRO 246 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1b76 h GLY 247 N 0.00 1.37 0.59 -1.23 0.00 -2.00 -3.11 103.07 98.68 1b76 h GLY 247 Ca 0.01 -0.55 0.00 0.00 0.00 0.00 0.00 47.33 46.79 1b76 h GLY 247 CO -0.05 0.53 0.00 1.18 0.00 0.00 0.00 176.54 178.21 1b76 n GLU 248 N -4.38 0.59 0.07 4.80 4.71 -0.29 -4.02 120.64 122.12 1b76 n GLU 248 Ca 0.11 0.00 -0.11 0.00 -0.01 0.00 0.00 57.16 57.14 1b76 n GLU 248 Cb 0.04 -1.30 -0.05 0.00 -1.01 0.00 0.00 31.44 29.13 1b76 n GLU 248 CO 0.00 0.00 0.00 0.38 0.09 0.00 0.00 177.13 177.60 1b76 h ASP 249 N 0.00 -0.48 -1.26 1.62 3.04 -1.66 -2.45 116.42 115.23 1b76 h ASP 249 Ca 0.00 0.07 0.37 0.00 -3.24 0.00 0.00 57.03 54.23 1b76 h ASP 249 Cb 0.00 0.19 -0.10 0.00 -1.04 0.00 0.00 39.33 38.39 1b76 h ASP 249 CO 0.00 -0.23 0.84 -0.08 -2.04 0.00 0.00 179.24 177.73 1b76 h GLU 250 N -0.29 0.16 0.12 4.15 4.57 -1.87 -0.53 114.58 120.88 1b76 h GLU 250 Ca 0.04 -0.01 -0.01 0.00 -1.18 0.00 0.00 59.36 58.21 1b76 h GLU 250 Cb 0.34 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 28.90 1b76 h GLU 250 CO -0.14 0.10 -0.06 -0.92 -1.18 0.00 0.00 179.01 176.82 1b76 h TYR 251 N 0.16 -0.15 -1.00 0.92 3.20 -1.74 -3.24 116.97 115.12 1b76 h TYR 251 Ca 0.71 -0.00 0.24 0.00 3.14 0.00 0.00 58.73 62.82 1b76 h TYR 251 Cb 2.27 0.05 -0.12 0.00 1.54 0.00 0.00 36.73 40.46 1b76 h TYR 251 CO -0.00 -0.09 0.58 -1.49 -1.64 0.00 0.00 178.16 175.52 1b76 h TRP 252 N -0.69 1.00 -0.76 -3.82 -0.00 -1.14 0.51 115.95 111.05 1b76 h TRP 252 Ca -0.02 0.04 0.00 0.00 -0.00 0.00 0.00 58.89 58.91 1b76 h TRP 252 Cb 0.12 -0.28 -0.04 0.00 -0.00 0.00 0.00 29.16 28.96 1b76 h TRP 252 CO 0.01 0.07 0.48 1.25 -0.00 0.00 0.00 178.44 180.25 1b76 h HIS 253 N 0.58 0.97 0.01 0.49 2.76 -1.26 0.44 115.15 119.15 1b76 h HIS 253 Ca 0.64 0.01 -0.24 0.00 -2.20 0.00 0.00 60.37 58.57 1b76 h HIS 253 Cb 1.19 -0.32 0.02 0.00 1.55 0.00 0.00 27.41 29.85 1b76 h HIS 253 CO -0.01 0.63 -0.96 0.07 -1.30 0.00 0.00 177.93 176.36 1b76 h ARG 254 N 1.03 0.63 -0.15 5.26 0.11 -0.82 -2.68 114.38 117.76 1b76 h ARG 254 Ca 0.27 -0.69 0.03 0.00 0.10 0.00 0.00 59.98 59.69 1b76 h ARG 254 Cb -0.08 0.20 -0.07 0.00 1.11 0.00 0.00 29.97 31.14 1b76 h ARG 254 CO -0.06 1.28 -0.54 -0.92 0.10 0.00 0.00 179.97 179.84 1b76 h TYR 255 N 0.26 -1.62 0.20 4.08 3.20 0.11 -0.63 116.97 122.57 1b76 h TYR 255 Ca -0.12 0.06 -0.01 0.00 3.14 0.00 0.00 58.73 61.80 1b76 h TYR 255 Cb 1.63 0.72 -0.00 0.00 1.54 0.00 0.00 36.73 40.63 1b76 h TYR 255 CO 0.12 -0.54 -0.11 -1.49 -1.64 0.00 0.00 178.16 174.49 1b76 h TRP 256 N -0.57 -0.28 -0.79 -3.82 4.06 -0.24 0.17 115.95 114.47 1b76 h TRP 256 Ca 0.04 -0.00 0.17 0.00 2.06 0.00 0.00 58.89 61.15 1b76 h TRP 256 Cb 0.68 0.10 -0.11 0.00 -1.00 0.00 0.00 29.16 28.83 1b76 h TRP 256 CO -0.59 -0.17 0.29 0.28 -3.56 0.00 0.00 178.44 174.68 1b76 h VAL 257 N -0.29 0.57 0.58 1.49 2.07 -1.13 0.63 116.25 120.16 1b76 h VAL 257 Ca -0.02 -0.13 -0.03 0.00 0.82 0.00 0.00 66.70 67.34 1b76 h VAL 257 Cb 0.23 0.15 0.00 0.00 -1.52 0.00 0.00 31.29 30.16 1b76 h VAL 257 CO 0.03 0.07 -0.30 -0.08 0.02 0.00 0.00 177.57 177.32 1b76 h GLU 258 N 0.38 -0.78 0.38 1.57 4.81 -0.85 -1.29 114.58 118.81 1b76 h GLU 258 Ca 0.45 0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.72 1b76 h GLU 258 Cb 0.76 0.18 0.00 0.00 0.63 0.00 0.00 28.75 30.32 1b76 h GLU 258 CO -0.47 -0.52 -0.20 1.49 -0.73 0.00 0.00 179.01 178.58 1b76 h GLU 259 N -0.81 -0.53 -0.91 1.92 4.57 0.68 0.13 114.58 119.64 1b76 h GLU 259 Ca -0.08 0.04 0.14 0.00 -1.18 0.00 0.00 59.36 58.28 1b76 h GLU 259 Cb 0.63 0.12 -0.07 0.00 -0.16 0.00 0.00 28.75 29.27 1b76 h GLU 259 CO 0.12 -0.35 0.58 0.00 -1.18 0.00 0.00 179.01 178.18 1b76 h ARG 260 N -0.55 0.72 -0.36 1.92 2.47 0.18 0.63 114.38 119.39 1b76 h ARG 260 Ca -0.05 -0.04 -0.13 0.00 -1.26 0.00 0.00 59.98 58.50 1b76 h ARG 260 Cb 0.43 -0.16 -0.01 0.00 -1.65 0.00 0.00 29.97 28.58 1b76 h ARG 260 CO 0.07 0.48 -0.29 1.25 0.56 0.00 0.00 179.97 182.04 1b76 h LEU 261 N 0.74 0.88 -0.43 3.04 5.85 -0.86 -2.43 115.31 122.09 1b76 h LEU 261 Ca 0.46 -0.45 0.06 0.00 0.84 0.00 0.00 57.88 58.79 1b76 h LEU 261 Cb 0.68 -0.25 -0.05 0.00 0.37 0.00 0.00 40.66 41.41 1b76 h LEU 261 CO -0.22 1.14 0.14 0.50 -0.34 0.00 0.00 178.44 179.66 1b76 h LYS 262 N 0.63 0.29 0.36 1.25 3.64 0.24 -3.00 116.57 119.98 1b76 h LYS 262 Ca 0.07 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.42 1b76 h LYS 262 Cb 0.86 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.61 1b76 h LYS 262 CO 0.08 0.19 -0.30 2.35 -2.27 0.00 0.00 179.45 179.50 1b76 h TRP 263 N 0.30 -0.82 -1.29 1.91 7.01 0.20 -3.00 115.95 120.26 1b76 h TRP 263 Ca 0.21 0.00 0.38 0.00 2.11 0.00 0.00 58.89 61.59 1b76 h TRP 263 Cb 0.21 0.31 -0.09 0.00 -2.10 0.00 0.00 29.16 27.49 1b76 h TRP 263 CO -0.17 -0.42 0.87 -1.49 -2.79 0.00 0.00 178.44 174.45 1b76 h TRP 264 N -0.65 0.36 -0.28 2.65 4.06 -1.31 0.75 115.95 121.53 1b76 h TRP 264 Ca -0.05 0.01 -0.15 0.00 2.06 0.00 0.00 58.89 60.76 1b76 h TRP 264 Cb 0.54 -0.10 -0.00 0.00 -1.00 0.00 0.00 29.16 28.61 1b76 h TRP 264 CO -0.12 -0.05 -0.42 1.96 -3.56 0.00 0.00 178.44 176.24 1b76 h GLN 265 N 0.14 0.78 0.00 0.49 4.20 -1.41 -2.05 115.11 117.26 1b76 h GLN 265 Ca 0.70 -0.47 -0.01 0.00 0.06 0.00 0.00 58.65 58.94 1b76 h GLN 265 Cb 2.34 0.04 -0.00 0.00 0.30 0.00 0.00 27.48 30.16 1b76 h GLN 265 CO -0.22 1.09 -0.06 1.49 -0.67 0.00 0.00 178.83 180.46 1b76 h GLU 266 N 0.53 0.00 0.00 1.46 4.81 0.61 -1.15 114.58 120.84 1b76 h GLU 266 Ca 0.03 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 1b76 h GLU 266 Cb 1.02 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.40 1b76 h GLU 266 CO 0.10 0.06 -0.01 -1.33 -0.73 0.00 0.00 179.01 177.09 1b76 n MET 267 N -3.72 0.27 0.00 1.92 2.81 -0.76 -4.92 117.12 112.73 1b76 n MET 267 Ca -0.02 0.22 0.00 0.00 -1.81 0.00 0.00 57.70 56.09 1b76 n MET 267 Cb 0.16 -1.81 0.00 0.00 -0.71 0.00 0.00 33.22 30.85 1b76 n MET 267 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1b76 n GLY 268 N 1.30 1.36 3.65 3.03 0.00 -0.44 -4.67 105.19 109.43 1b76 n GLY 268 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 1b76 n GLY 268 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1b76 s LEU 269 N 0.00 4.24 0.26 0.99 1.43 -0.83 -4.96 118.68 119.81 1b76 s LEU 269 Ca 0.00 2.10 -0.30 0.00 -1.03 0.00 0.00 54.13 54.90 1b76 s LEU 269 Cb 0.00 -3.53 -0.10 0.00 0.03 0.00 0.00 46.19 42.59 1b76 s LEU 269 CO 0.00 -0.97 1.38 -0.94 0.23 0.00 0.00 176.35 176.05 1b76 s SER 270 N 3.42 6.74 0.34 2.29 1.04 -1.26 -3.70 113.70 122.56 1b76 s SER 270 Ca 0.72 2.61 0.10 0.00 0.48 0.00 0.00 55.95 59.86 1b76 s SER 270 Cb -0.31 -2.63 0.86 0.00 0.10 0.00 0.00 66.02 64.04 1b76 s SER 270 CO 0.28 -0.62 1.79 -0.09 0.98 0.00 0.00 173.24 175.58 1b76 h ARG 271 N 4.71 0.63 -0.83 4.02 9.65 -1.93 0.29 114.38 130.92 1b76 h ARG 271 Ca -0.46 -0.04 0.15 0.00 -1.10 0.00 0.00 59.98 58.53 1b76 h ARG 271 Cb 1.22 -0.14 -0.06 0.00 -1.39 0.00 0.00 29.97 29.60 1b76 h ARG 271 CO 0.75 0.41 0.54 0.93 2.80 0.00 0.00 179.97 185.40 1b76 h GLU 272 N 0.64 0.55 -0.01 0.20 3.07 -2.02 -1.32 114.58 115.69 1b76 h GLU 272 Ca 0.56 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 59.39 1b76 h GLU 272 Cb 1.04 -0.12 0.00 0.00 -0.84 0.00 0.00 28.75 28.82 1b76 h GLU 272 CO -0.33 0.36 -0.24 0.09 -1.40 0.00 0.00 179.01 177.49 1b76 n ASN 273 N -4.52 1.00 -4.72 1.42 3.02 0.10 -4.84 115.26 106.71 1b76 n ASN 273 Ca 0.16 -0.88 -0.35 0.00 -0.03 0.00 0.00 54.58 53.48 1b76 n ASN 273 Cb 0.50 0.12 -0.08 0.00 -0.61 0.00 0.00 39.78 39.70 1b76 n ASN 273 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1b76 s LEU 274 N -2.49 4.05 0.00 3.41 1.43 -0.50 -1.83 118.68 122.76 1b76 s LEU 274 Ca 0.25 0.22 0.07 0.00 -1.03 0.00 0.00 54.13 53.63 1b76 s LEU 274 Cb 0.19 -2.02 -0.02 0.00 0.03 0.00 0.00 46.19 44.38 1b76 s LEU 274 CO 0.51 0.24 -0.20 -0.69 0.23 0.00 0.00 176.35 176.44 1b76 s VAL 275 N -0.03 1.62 -0.94 -1.59 1.01 0.72 -4.96 120.40 116.22 1b76 s VAL 275 Ca 0.08 -0.98 -0.01 0.00 0.00 0.00 0.00 61.98 61.07 1b76 s VAL 275 Cb -0.12 -1.37 0.29 0.00 0.00 0.00 0.00 36.38 35.19 1b76 s VAL 275 CO 0.00 0.37 1.25 -2.65 0.00 0.00 0.00 175.10 174.07 1b76 n PRO 276 N 2.33 3.87 -1.72 2.72 -0.02 -1.26 0.05 135.00 140.97 1b76 n PRO 276 Ca -0.16 -4.59 -0.42 0.00 -2.02 0.00 0.00 63.50 56.30 1b76 n PRO 276 Cb 0.53 -2.43 -0.01 0.00 -0.02 0.00 0.00 33.50 31.57 1b76 n PRO 276 CO 0.00 0.00 0.00 0.98 1.98 0.00 0.00 175.50 178.46 1b76 n TYR 277 N 1.18 2.52 -3.71 6.00 9.36 -0.79 -4.79 117.16 126.92 1b76 n TYR 277 Ca 0.27 0.47 -0.38 0.00 3.32 0.00 0.00 57.90 61.58 1b76 n TYR 277 Cb 0.36 -2.48 -0.11 0.00 -0.63 0.00 0.00 39.34 36.48 1b76 n TYR 277 CO 0.00 0.00 0.00 -1.14 0.22 0.00 0.00 176.86 175.94 1b76 s GLN 278 N -1.51 2.17 0.18 2.98 0.74 -1.26 -0.79 119.66 122.18 1b76 s GLN 278 Ca 0.58 -1.76 -0.32 0.00 0.05 0.00 0.00 55.36 53.91 1b76 s GLN 278 Cb -0.55 -3.67 -0.11 0.00 1.10 0.00 0.00 33.01 29.78 1b76 s GLN 278 CO 0.59 -1.08 1.73 1.14 -0.55 0.00 0.00 175.29 177.12 1b76 s GLN 279 N 1.22 4.14 0.10 1.67 -2.07 -1.06 -4.98 119.66 118.68 1b76 s GLN 279 Ca 0.07 2.57 -0.22 0.00 -1.82 0.00 0.00 55.36 55.96 1b76 s GLN 279 Cb -0.24 -3.21 -0.07 0.00 -1.09 0.00 0.00 33.01 28.40 1b76 s GLN 279 CO -0.03 -0.76 0.66 -2.14 -1.32 0.00 0.00 175.29 171.70 1b76 s PRO 280 N 1.56 4.36 0.00 9.60 0.02 -1.26 -4.55 135.00 144.73 1b76 s PRO 280 Ca 0.76 0.91 0.00 0.00 0.02 0.00 0.00 61.00 62.69 1b76 s PRO 280 Cb -0.48 -3.26 0.00 0.00 0.02 0.00 0.00 34.50 30.78 1b76 s PRO 280 CO 0.33 0.57 0.00 -0.35 -0.33 0.00 0.00 177.00 177.22 1b76 n PRO 281 N 1.82 0.00 0.13 5.54 -0.04 -1.26 0.15 135.00 141.34 1b76 n PRO 281 Ca -0.08 0.00 0.19 0.00 -0.04 0.00 0.00 63.50 63.57 1b76 n PRO 281 Cb 0.50 0.00 0.77 0.00 -0.04 0.00 0.00 33.50 34.73 1b76 n PRO 281 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1b76 h GLU 282 N 0.00 0.00 0.00 0.54 3.07 -2.02 -1.19 114.58 114.98 1b76 h GLU 282 Ca 0.00 0.00 -0.29 0.00 -0.50 0.00 0.00 59.36 58.57 1b76 h GLU 282 Cb 0.00 0.00 -0.05 0.00 -0.84 0.00 0.00 28.75 27.86 1b76 h GLU 282 CO 0.00 0.00 -2.11 0.43 -1.40 0.00 0.00 179.01 175.93 1b76 n SER 283 N -3.70 1.34 -4.44 1.42 7.64 0.41 -4.89 113.62 111.40 1b76 n SER 283 Ca 0.06 -0.02 -0.12 0.00 1.01 0.00 0.00 58.87 59.80 1b76 n SER 283 Cb 0.54 0.65 -0.10 0.00 -1.01 0.00 0.00 64.21 64.29 1b76 n SER 283 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1b76 n SER 284 N -2.69 0.36 -4.63 6.43 2.88 -0.45 -4.82 113.62 110.70 1b76 n SER 284 Ca -0.28 -1.76 -0.50 0.00 -1.33 0.00 0.00 58.87 55.00 1b76 n SER 284 Cb 0.99 -1.32 -0.05 0.00 -0.75 0.00 0.00 64.21 63.08 1b76 n SER 284 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1b76 n ALA 285 N 14.50 -0.06 0.00 -1.46 0.00 -1.26 -4.79 120.51 127.45 1b76 n ALA 285 Ca 0.37 0.47 0.00 0.00 0.00 0.00 0.00 53.44 54.28 1b76 n ALA 285 Cb 0.42 -2.20 0.00 0.00 0.00 0.00 0.00 19.45 17.67 1b76 n ALA 285 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1b76 n HIS 286 N 3.36 0.00 -0.03 0.00 -0.00 -1.26 -0.66 115.22 116.63 1b76 n HIS 286 Ca 0.19 0.00 0.23 0.00 0.46 0.00 0.00 57.72 58.61 1b76 n HIS 286 Cb 0.22 0.00 0.72 0.00 -0.12 0.00 0.00 29.99 30.81 1b76 n HIS 286 CO 0.00 0.00 0.00 0.10 0.46 0.00 0.00 176.34 176.90 1b76 h TYR 287 N 0.00 0.00 -3.45 1.57 -0.00 -1.99 -3.40 116.97 109.70 1b76 h TYR 287 Ca 0.00 0.00 -0.60 0.00 -0.00 0.00 0.00 58.73 58.13 1b76 h TYR 287 Cb 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 36.73 36.63 1b76 h TYR 287 CO 0.00 0.00 0.04 0.00 -0.00 0.00 0.00 178.16 178.20 1b76 s ALA 288 N -4.81 3.55 -0.07 0.10 0.00 0.16 -3.10 121.76 117.59 1b76 s ALA 288 Ca -0.05 -0.35 -0.26 0.00 0.00 0.00 0.00 51.96 51.30 1b76 s ALA 288 Cb 0.18 -2.90 -0.22 0.00 0.00 0.00 0.00 23.12 20.19 1b76 s ALA 288 CO 0.66 -0.52 1.04 -0.22 0.00 0.00 0.00 175.76 176.72 1b76 h LYS 289 N 7.51 -0.02 -4.45 0.00 3.64 -1.74 -3.41 116.57 118.09 1b76 h LYS 289 Ca -0.32 0.00 -0.18 0.00 -1.27 0.00 0.00 60.65 58.88 1b76 h LYS 289 Cb 1.15 0.01 -0.15 0.00 -0.41 0.00 0.00 32.23 32.82 1b76 h LYS 289 CO 0.75 0.63 -0.68 0.00 -2.27 0.00 0.00 179.45 177.88 1b76 s ALA 290 N -3.47 0.78 -0.30 5.00 0.00 -1.26 -4.96 121.76 117.56 1b76 s ALA 290 Ca -0.16 -1.31 -0.16 0.00 0.00 0.00 0.00 51.96 50.32 1b76 s ALA 290 Cb -0.00 0.31 0.16 0.00 0.00 0.00 0.00 23.12 23.59 1b76 s ALA 290 CO 0.65 -0.33 1.01 -0.08 0.00 0.00 0.00 175.76 177.02 1b76 s THR 291 N -3.81 -0.22 -0.18 0.00 -1.32 -1.26 -1.45 115.64 107.40 1b76 s THR 291 Ca 0.12 0.00 -0.07 0.00 -1.21 0.00 0.00 61.69 60.52 1b76 s THR 291 Cb 0.07 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 70.02 1b76 s THR 291 CO -0.06 0.00 0.06 -0.69 -2.21 0.00 0.00 174.62 171.72 1b76 s VAL 292 N 1.84 4.76 -0.13 5.08 1.01 -0.24 -2.57 120.40 130.15 1b76 s VAL 292 Ca -0.06 -0.04 -0.08 0.00 0.00 0.00 0.00 61.98 61.80 1b76 s VAL 292 Cb -0.04 -3.14 -0.04 0.00 0.00 0.00 0.00 36.38 33.15 1b76 s VAL 292 CO -0.16 0.46 0.14 -1.81 0.00 0.00 0.00 175.10 173.74 1b76 s ASP 293 N 0.38 6.38 -0.60 3.32 1.01 0.03 -0.34 116.67 126.84 1b76 s ASP 293 Ca 0.03 0.45 -0.16 0.00 0.71 0.00 0.00 52.55 53.58 1b76 s ASP 293 Cb -0.12 -2.08 0.15 0.00 1.01 0.00 0.00 42.92 41.88 1b76 s ASP 293 CO 0.00 0.38 0.57 -0.63 0.21 0.00 0.00 175.17 175.70 1b76 s ILE 294 N -0.85 5.27 0.40 0.77 1.01 -0.13 -1.88 121.20 125.78 1b76 s ILE 294 Ca 0.14 -1.68 -0.23 0.00 0.00 0.00 0.00 60.65 58.89 1b76 s ILE 294 Cb -0.12 -4.38 -0.11 0.00 0.01 0.00 0.00 42.46 37.87 1b76 s ILE 294 CO 0.03 -0.92 0.95 -0.76 0.00 0.00 0.00 174.94 174.24 1b76 s LEU 295 N 1.36 4.07 -0.04 2.97 1.43 0.11 -0.76 118.68 127.82 1b76 s LEU 295 Ca 0.07 1.74 0.04 0.00 -1.03 0.00 0.00 54.13 54.95 1b76 s LEU 295 Cb -0.25 -4.37 -0.00 0.00 0.03 0.00 0.00 46.19 41.59 1b76 s LEU 295 CO 0.01 -0.27 -0.16 -0.47 0.23 0.00 0.00 176.35 175.69 1b76 s TYR 296 N -2.00 1.60 -1.09 0.29 5.04 0.29 -0.20 117.35 121.28 1b76 s TYR 296 Ca 0.58 -0.43 -0.22 0.00 -2.44 0.00 0.00 57.07 54.56 1b76 s TYR 296 Cb -0.12 -1.07 -0.03 0.00 0.35 0.00 0.00 41.96 41.09 1b76 s TYR 296 CO 0.16 -0.14 1.83 1.03 -1.34 0.00 0.00 175.55 177.09 1b76 s ARG 297 N -0.01 2.95 0.80 4.97 3.00 -0.76 -0.96 118.95 128.94 1b76 s ARG 297 Ca -0.02 -1.04 -0.11 0.00 0.00 0.00 0.00 55.73 54.56 1b76 s ARG 297 Cb -0.10 -5.26 0.07 0.00 0.00 0.00 0.00 34.95 29.66 1b76 s ARG 297 CO 0.02 -3.21 1.09 -0.06 0.00 0.00 0.00 175.30 173.14 1b76 s PHE 298 N 8.58 2.78 -0.08 -0.53 0.08 -1.17 -4.87 117.98 122.77 1b76 s PHE 298 Ca 0.63 1.19 0.29 0.00 0.12 0.00 0.00 56.93 59.15 1b76 s PHE 298 Cb -0.02 -3.11 1.37 0.00 -0.57 0.00 0.00 43.02 40.70 1b76 s PHE 298 CO 0.04 -1.81 1.87 -1.35 -0.10 0.00 0.00 175.22 173.86 1b76 h PRO 299 N -1.12 0.00 -0.20 0.24 0.11 -1.85 0.12 132.00 129.30 1b76 h PRO 299 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1b76 h PRO 299 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1b76 h PRO 299 CO 0.58 0.00 0.00 -2.39 -0.21 0.00 0.00 178.00 175.98 1b76 n HIS 300 N -2.55 0.25 0.00 0.65 1.44 -1.26 -4.58 115.22 109.16 1b76 n HIS 300 Ca -0.00 -0.12 0.00 0.00 -2.01 0.00 0.00 57.72 55.59 1b76 n HIS 300 Cb 0.15 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.26 1b76 n HIS 300 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1b76 n GLY 301 N 1.34 3.80 3.55 -1.39 0.00 0.43 -5.01 105.19 107.91 1b76 n GLY 301 Ca 0.17 -1.56 -0.29 0.00 0.00 0.00 0.00 46.02 44.34 1b76 n GLY 301 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1b76 n SER 302 N 0.00 1.78 -4.54 1.61 2.88 -1.26 -3.06 113.62 111.03 1b76 n SER 302 Ca 0.00 -0.76 -0.27 0.00 -1.33 0.00 0.00 58.87 56.51 1b76 n SER 302 Cb 0.00 -1.50 -0.10 0.00 -0.75 0.00 0.00 64.21 61.86 1b76 n SER 302 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1b76 s LEU 303 N 12.18 2.45 0.27 2.46 1.43 -0.14 -4.80 118.68 132.55 1b76 s LEU 303 Ca 1.02 -1.47 -0.31 0.00 -1.03 0.00 0.00 54.13 52.34 1b76 s LEU 303 Cb -0.29 -0.62 -0.12 0.00 0.03 0.00 0.00 46.19 45.19 1b76 s LEU 303 CO 0.24 -0.64 1.64 1.21 0.23 0.00 0.00 176.35 179.04 1b76 n GLU 304 N -0.94 2.76 -0.03 1.70 2.13 -1.26 0.11 120.64 125.10 1b76 n GLU 304 Ca -0.07 0.98 -0.07 0.00 0.66 0.00 0.00 57.16 58.66 1b76 n GLU 304 Cb 0.67 -2.79 -0.02 0.00 0.27 0.00 0.00 31.44 29.56 1b76 n GLU 304 CO 0.00 0.00 0.00 -0.11 -0.41 0.00 0.00 177.13 176.61 1b76 n LEU 305 N 2.65 0.78 -4.20 4.31 0.00 0.06 -4.78 117.00 115.80 1b76 n LEU 305 Ca 0.10 0.12 -0.12 0.00 0.00 0.00 0.00 56.01 56.12 1b76 n LEU 305 Cb 0.36 -0.30 -0.10 0.00 0.00 0.00 0.00 43.42 43.39 1b76 n LEU 305 CO 0.64 -0.04 -0.30 -0.70 0.00 0.00 0.00 177.39 176.99 1b76 s GLU 306 N -2.18 1.06 -0.32 1.96 2.12 -1.16 -3.31 118.70 116.87 1b76 s GLU 306 Ca -0.11 -1.52 -0.00 0.00 0.36 0.00 0.00 54.97 53.70 1b76 s GLU 306 Cb 0.03 0.00 0.13 0.00 0.26 0.00 0.00 34.13 34.56 1b76 s GLU 306 CO 0.14 -0.22 0.26 0.20 -0.54 0.00 0.00 175.26 175.09 1b76 s GLY 307 N -3.13 0.26 -0.80 -1.50 0.00 0.33 -0.96 107.32 101.52 1b76 s GLY 307 Ca 0.26 -1.00 -0.26 0.00 0.00 0.00 0.00 44.72 43.73 1b76 s GLY 307 CO 0.04 2.41 1.53 -0.42 0.00 0.00 0.00 173.10 176.66 1b76 s ILE 308 N 1.80 3.66 0.69 0.90 1.09 0.54 -2.74 121.20 127.13 1b76 s ILE 308 Ca 0.13 -0.02 -0.02 0.00 -1.10 0.00 0.00 60.65 59.64 1b76 s ILE 308 Cb -0.17 -4.63 0.09 0.00 -1.06 0.00 0.00 42.46 36.69 1b76 s ILE 308 CO -0.20 -1.57 0.96 0.00 -0.10 0.00 0.00 174.94 174.03 1b76 s ALA 309 N 6.80 3.58 -0.38 9.38 0.00 -0.31 -1.08 121.76 139.75 1b76 s ALA 309 Ca 0.49 -1.45 0.11 0.00 0.00 0.00 0.00 51.96 51.11 1b76 s ALA 309 Cb -0.07 -2.17 0.34 0.00 0.00 0.00 0.00 23.12 21.22 1b76 s ALA 309 CO 0.08 -1.29 0.72 0.94 0.00 0.00 0.00 175.76 176.20 1b76 n GLN 310 N -2.77 1.04 -1.04 0.00 0.00 -0.53 -1.86 117.38 112.22 1b76 n GLN 310 Ca 0.12 -3.43 -0.34 0.00 -0.00 0.00 0.00 57.00 53.35 1b76 n GLN 310 Cb 0.60 -1.68 0.10 0.00 0.00 0.00 0.00 30.24 29.26 1b76 n GLN 310 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 1b76 n ARG 311 N 0.38 0.04 0.00 3.69 1.74 -1.04 -2.70 116.66 118.77 1b76 n ARG 311 Ca 0.25 0.06 0.00 0.00 -0.77 0.00 0.00 57.85 57.39 1b76 n ARG 311 Cb 0.64 -1.92 0.00 0.00 -1.02 0.00 0.00 32.46 30.15 1b76 n ARG 311 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1b76 n THR 312 N -3.02 0.00 -1.96 0.55 -2.24 -1.18 -3.20 114.28 103.23 1b76 n THR 312 Ca 0.09 0.47 0.00 0.00 -2.27 0.00 0.00 64.05 62.34 1b76 n THR 312 Cb 0.52 -1.47 0.00 0.00 -2.10 0.00 0.00 70.33 67.28 1b76 n THR 312 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1b76 n ASP 313 N -2.47 0.00 -0.00 3.42 5.68 -1.26 -2.06 116.55 119.86 1b76 n ASP 313 Ca 0.00 -1.26 -0.06 0.00 -0.50 0.00 0.00 54.79 52.97 1b76 n ASP 313 Cb 0.00 -0.05 0.12 0.00 -1.14 0.00 0.00 41.12 40.05 1b76 n ASP 313 CO 0.00 0.00 0.00 0.15 -1.33 0.00 0.00 177.20 176.02 1b76 h PHE 314 N 0.00 0.64 0.00 2.11 3.57 -1.89 -2.07 116.94 119.31 1b76 h PHE 314 Ca 0.00 -0.18 0.00 0.00 3.53 0.00 0.00 57.97 61.32 1b76 h PHE 314 Cb 1.10 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 39.70 1b76 h PHE 314 CO -0.15 0.84 0.00 -0.25 -2.23 0.00 0.00 178.31 176.52 1b76 n ASP 315 N -4.05 0.00 -0.24 0.41 8.00 -1.26 -0.60 116.55 118.81 1b76 n ASP 315 Ca -0.01 0.74 0.19 0.00 0.71 0.00 0.00 54.79 56.42 1b76 n ASP 315 Cb 0.49 -0.47 0.51 0.00 -0.02 0.00 0.00 41.12 41.63 1b76 n ASP 315 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1b76 h LEU 316 N 0.00 0.41 0.66 0.64 3.38 -1.91 -1.87 115.31 116.62 1b76 h LEU 316 Ca 0.00 0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 1b76 h LEU 316 Cb 0.00 -0.03 0.01 0.00 0.09 0.00 0.00 40.66 40.72 1b76 h LEU 316 CO 0.00 0.16 -0.32 1.23 0.09 0.00 0.00 178.44 179.60 1b76 h GLY 317 N 0.41 -0.93 1.33 0.83 0.00 -1.40 0.36 103.07 103.67 1b76 h GLY 317 Ca 0.47 0.34 0.00 0.00 0.00 0.00 0.00 47.33 48.14 1b76 h GLY 317 CO -0.18 -0.34 0.24 1.44 0.00 0.00 0.00 176.54 177.70 1b76 n SER 318 N -4.48 0.31 -0.14 0.19 7.64 0.23 -1.03 113.62 116.34 1b76 n SER 318 Ca -0.11 0.54 0.02 0.00 1.01 0.00 0.00 58.87 60.33 1b76 n SER 318 Cb 0.35 -0.52 0.02 0.00 -1.01 0.00 0.00 64.21 63.05 1b76 n SER 318 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1b76 n HIS 319 N -1.95 0.03 -3.87 1.43 -0.00 -0.55 -4.71 115.22 105.60 1b76 n HIS 319 Ca -0.01 -0.13 -0.21 0.00 -0.00 0.00 0.00 57.72 57.37 1b76 n HIS 319 Cb 0.25 -0.01 -0.02 0.00 -0.00 0.00 0.00 29.99 30.22 1b76 n HIS 319 CO 0.00 0.00 0.00 -0.08 -0.00 0.00 0.00 176.34 176.26 1b76 s THR 320 N -0.46 5.14 0.29 1.59 -1.32 0.12 -4.71 115.64 116.30 1b76 s THR 320 Ca 0.04 -0.94 -0.14 0.00 -1.21 0.00 0.00 61.69 59.44 1b76 s THR 320 Cb 0.03 -3.82 -0.09 0.00 -1.51 0.00 0.00 72.50 67.11 1b76 s THR 320 CO 0.04 -0.34 0.69 -0.75 -2.21 0.00 0.00 174.62 172.06 1b76 s LYS 321 N -4.03 3.98 -1.46 7.08 2.20 -1.22 -3.91 119.74 122.38 1b76 s LYS 321 Ca 0.35 0.60 -0.07 0.00 -0.36 0.00 0.00 55.97 56.49 1b76 s LYS 321 Cb -0.09 -2.51 0.03 0.00 -1.51 0.00 0.00 37.83 33.75 1b76 s LYS 321 CO 0.30 0.21 0.64 -0.25 -0.36 0.00 0.00 175.35 175.89 1b76 n ASP 322 N -0.24 -5.35 -0.30 1.43 8.00 -1.26 -4.66 116.55 114.17 1b76 n ASP 322 Ca 0.02 -0.37 0.11 0.00 0.71 0.00 0.00 54.79 55.27 1b76 n ASP 322 Cb 0.53 -4.33 0.34 0.00 -0.02 0.00 0.00 41.12 37.64 1b76 n ASP 322 CO 0.00 0.00 0.00 0.06 -0.39 0.00 0.00 177.20 176.87 1b76 h GLN 323 N -1.41 0.75 -0.48 -1.24 3.07 -1.88 0.37 115.11 114.30 1b76 h GLN 323 Ca -0.51 -0.05 0.06 0.00 0.09 0.00 0.00 58.65 58.24 1b76 h GLN 323 Cb 1.34 -0.17 -0.05 0.00 0.08 0.00 0.00 27.48 28.68 1b76 h GLN 323 CO 0.57 0.50 0.20 1.05 0.09 0.00 0.00 178.83 181.23 1b76 h GLU 324 N 0.78 0.38 0.00 0.06 9.09 -1.92 0.49 114.58 123.45 1b76 h GLU 324 Ca 0.48 -0.02 -0.05 0.00 0.05 0.00 0.00 59.36 59.81 1b76 h GLU 324 Cb 0.69 -0.09 -0.01 0.00 -1.65 0.00 0.00 28.75 27.70 1b76 h GLU 324 CO -0.24 0.25 -0.25 0.00 0.05 0.00 0.00 179.01 178.82 1b76 h ALA 325 N 1.30 1.47 -2.69 1.06 0.00 -0.79 -3.42 119.26 116.18 1b76 h ALA 325 Ca 0.22 -0.23 -0.52 0.00 0.00 0.00 0.00 54.91 54.38 1b76 h ALA 325 Cb 0.20 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1b76 h ALA 325 CO -0.20 0.31 0.22 -0.51 0.00 0.00 0.00 179.25 179.07 1b76 s LEU 326 N -8.13 4.55 0.00 0.00 1.43 0.17 -4.96 118.68 111.75 1b76 s LEU 326 Ca -0.03 1.66 -0.04 0.00 -1.03 0.00 0.00 54.13 54.69 1b76 s LEU 326 Cb 0.14 -3.36 -0.16 0.00 0.03 0.00 0.00 46.19 42.84 1b76 s LEU 326 CO 0.69 0.12 2.68 0.61 0.23 0.00 0.00 176.35 180.68 1b76 n GLY 327 N 1.86 2.51 3.74 -3.19 0.00 -1.26 -4.82 105.19 104.03 1b76 n GLY 327 Ca -0.03 -0.72 -0.40 0.00 0.00 0.00 0.00 46.02 44.87 1b76 n GLY 327 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1b76 n ILE 328 N 2.32 3.08 0.24 -0.61 2.08 -1.26 -4.91 119.36 120.30 1b76 n ILE 328 Ca 0.26 -0.50 0.03 0.00 0.56 0.00 0.00 62.75 63.09 1b76 n ILE 328 Cb 0.66 -1.70 -0.01 0.00 -0.75 0.00 0.00 39.64 37.84 1b76 n ILE 328 CO 0.00 0.00 0.00 0.35 0.56 0.00 0.00 176.55 177.46 1b76 n THR 329 N -0.51 0.00 -3.38 1.39 -2.24 -1.26 -5.03 114.28 103.24 1b76 n THR 329 Ca 0.07 -0.42 -0.20 0.00 -2.27 0.00 0.00 64.05 61.23 1b76 n THR 329 Cb 0.42 1.04 -0.00 0.00 -2.10 0.00 0.00 70.33 69.69 1b76 n THR 329 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1b76 s ALA 330 N -1.13 4.05 -1.24 6.98 0.00 -1.26 -4.99 121.76 124.17 1b76 s ALA 330 Ca 0.04 -1.30 -0.19 0.00 0.00 0.00 0.00 51.96 50.50 1b76 s ALA 330 Cb 0.04 -1.83 -0.00 0.00 0.00 0.00 0.00 23.12 21.33 1b76 s ALA 330 CO 0.16 -0.10 1.88 0.54 0.00 0.00 0.00 175.76 178.24 1b76 n ARG 331 N -1.75 2.50 -3.41 0.00 1.74 -1.26 -4.93 116.66 109.55 1b76 n ARG 331 Ca -0.01 -2.82 -0.38 0.00 -0.77 0.00 0.00 57.85 53.88 1b76 n ARG 331 Cb 0.58 -3.50 -0.06 0.00 -1.02 0.00 0.00 32.46 28.46 1b76 n ARG 331 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1b76 s VAL 332 N 6.33 5.05 0.30 1.55 -7.23 -1.26 -5.06 120.40 120.08 1b76 s VAL 332 Ca 0.58 0.91 -0.28 0.00 -1.81 0.00 0.00 61.98 61.38 1b76 s VAL 332 Cb 0.05 -3.77 -0.09 0.00 0.56 0.00 0.00 36.38 33.13 1b76 s VAL 332 CO 0.08 0.49 0.99 -1.48 -0.31 0.00 0.00 175.10 174.87 1b76 s LEU 333 N -0.48 4.46 -0.36 1.32 2.34 -1.26 -4.91 118.68 119.79 1b76 s LEU 333 Ca 0.25 2.00 -0.33 0.00 0.06 0.00 0.00 54.13 56.10 1b76 s LEU 333 Cb -0.16 -3.82 -0.10 0.00 -0.56 0.00 0.00 46.19 41.54 1b76 s LEU 333 CO 0.13 -0.07 2.23 -1.14 -1.06 0.00 0.00 176.35 176.43 1b76 n ARG 334 N 0.91 1.17 -2.96 1.48 3.00 -1.26 -4.83 116.66 114.16 1b76 n ARG 334 Ca 0.00 0.30 -0.44 0.00 -0.00 0.00 0.00 57.85 57.71 1b76 n ARG 334 Cb 0.48 -2.61 0.00 0.00 0.00 0.00 0.00 32.46 30.33 1b76 n ARG 334 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 1b76 n ASN 335 N 10.56 5.29 -3.55 6.15 5.15 -1.26 -4.91 115.26 132.69 1b76 n ASN 335 Ca 0.40 -3.01 -0.41 0.00 -0.60 0.00 0.00 54.58 50.97 1b76 n ASN 335 Cb 0.28 -1.52 -0.01 0.00 -0.53 0.00 0.00 39.78 37.99 1b76 n ASN 335 CO 0.00 0.00 0.00 -1.84 1.40 0.00 0.00 177.26 176.82 1b76 n GLU 336 N 4.87 3.56 0.01 1.20 0.28 -1.26 -4.29 120.64 125.01 1b76 n GLU 336 Ca 0.35 -2.72 0.00 0.00 -0.16 0.00 0.00 57.16 54.62 1b76 n GLU 336 Cb 0.41 -2.95 0.00 0.00 1.43 0.00 0.00 31.44 30.33 1b76 n GLU 336 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 1b76 n HIS 337 N 4.15 -2.26 -1.50 -1.84 8.25 -1.26 -5.15 115.22 115.61 1b76 n HIS 337 Ca 0.62 0.10 -0.39 0.00 -0.26 0.00 0.00 57.72 57.79 1b76 n HIS 337 Cb 0.30 0.65 0.03 0.00 1.12 0.00 0.00 29.99 32.09 1b76 n HIS 337 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1b76 n SER 338 N -2.49 -0.57 0.00 0.41 2.88 -1.26 -5.01 113.62 107.58 1b76 n SER 338 Ca 0.00 0.80 0.00 0.00 -1.33 0.00 0.00 58.87 58.34 1b76 n SER 338 Cb 0.00 -1.21 0.00 0.00 -0.75 0.00 0.00 64.21 62.25 1b76 n SER 338 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1b76 n THR 339 N -1.43 0.00 -0.66 2.46 -2.24 -1.26 -4.73 114.28 106.42 1b76 n THR 339 Ca 0.12 0.00 -0.31 0.00 -2.27 0.00 0.00 64.05 61.58 1b76 n THR 339 Cb 0.45 -0.14 0.18 0.00 -2.10 0.00 0.00 70.33 68.72 1b76 n THR 339 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1b76 n GLN 340 N 0.00 -1.10 -2.62 -0.78 -0.00 -1.26 -4.39 117.38 107.23 1b76 n GLN 340 Ca 0.00 -0.28 -0.43 0.00 -0.00 0.00 0.00 57.00 56.30 1b76 n GLN 340 Cb 0.00 -2.07 -0.02 0.00 -0.00 0.00 0.00 30.24 28.14 1b76 n GLN 340 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.06 177.56 1b76 s ARG 341 N -4.11 3.59 0.00 2.61 3.52 -1.26 -3.44 118.95 119.86 1b76 s ARG 341 Ca 0.63 0.34 0.00 0.00 -0.13 0.00 0.00 55.73 56.57 1b76 s ARG 341 Cb -0.21 -3.97 0.00 0.00 -1.56 0.00 0.00 34.95 29.21 1b76 s ARG 341 CO 0.64 -1.52 1.21 -0.11 -0.81 0.00 0.00 175.30 174.70 1b76 n LEU 342 N 8.07 3.24 -4.42 -0.88 7.94 -1.26 -4.83 117.00 124.86 1b76 n LEU 342 Ca 0.09 -1.46 -0.27 0.00 -1.11 0.00 0.00 56.01 53.26 1b76 n LEU 342 Cb 0.49 -0.68 -0.12 0.00 0.53 0.00 0.00 43.42 43.64 1b76 n LEU 342 CO 0.71 0.61 -0.54 0.00 -1.11 0.00 0.00 177.39 177.06 1b76 s ALA 343 N 0.76 2.52 0.70 1.96 0.00 -1.26 -4.87 121.76 121.56 1b76 s ALA 343 Ca 0.00 -1.61 -0.03 0.00 0.00 0.00 0.00 51.96 50.32 1b76 s ALA 343 Cb 0.00 -0.34 0.09 0.00 0.00 0.00 0.00 23.12 22.87 1b76 s ALA 343 CO 0.00 0.45 0.97 -0.47 0.00 0.00 0.00 175.76 176.71 1b76 s TYR 344 N -1.57 2.25 0.00 0.00 6.14 -1.19 -4.96 117.35 118.01 1b76 s TYR 344 Ca 0.20 0.03 0.00 0.00 0.64 0.00 0.00 57.07 57.94 1b76 s TYR 344 Cb -0.08 -3.09 0.00 0.00 0.42 0.00 0.00 41.96 39.21 1b76 s TYR 344 CO 0.09 -1.51 0.00 2.89 0.64 0.00 0.00 175.55 177.66 1b76 n ARG 345 N -2.82 0.00 -3.01 4.97 -4.01 -1.26 -2.31 116.66 108.22 1b76 n ARG 345 Ca 0.11 0.00 -0.44 0.00 -1.04 0.00 0.00 57.85 56.48 1b76 n ARG 345 Cb 0.60 -0.49 -0.03 0.00 -3.04 0.00 0.00 32.46 29.50 1b76 n ARG 345 CO 0.00 0.00 0.00 0.34 -3.04 0.00 0.00 177.63 174.93 1b76 s ASP 346 N -2.83 6.49 -0.40 2.89 2.15 -1.26 -3.42 116.67 120.29 1b76 s ASP 346 Ca 0.00 -1.86 -0.02 0.00 0.43 0.00 0.00 52.55 51.10 1b76 s ASP 346 Cb 0.00 -2.36 0.17 0.00 -0.30 0.00 0.00 42.92 40.43 1b76 s ASP 346 CO 0.00 -1.06 2.32 -0.81 -0.17 0.00 0.00 175.17 175.45 1b76 n PRO 347 N 6.31 2.11 -0.85 4.34 -0.04 -1.26 -4.57 135.00 141.03 1b76 n PRO 347 Ca 0.12 -2.00 0.00 0.00 -0.04 0.00 0.00 63.50 61.57 1b76 n PRO 347 Cb 0.47 -1.88 0.00 0.00 -0.04 0.00 0.00 33.50 32.05 1b76 n PRO 347 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 1b76 n GLU 348 N 0.47 0.00 0.00 0.54 0.28 -1.26 -4.85 120.64 115.81 1b76 n GLU 348 Ca 0.40 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.40 1b76 n GLU 348 Cb 0.57 -3.02 0.00 0.00 1.43 0.00 0.00 31.44 30.42 1b76 n GLU 348 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22 1b76 n THR 349 N -2.00 0.00 -1.58 3.84 -2.24 -1.26 -5.07 114.28 105.96 1b76 n THR 349 Ca 0.00 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.79 1b76 n THR 349 Cb 0.00 0.00 0.01 0.00 -2.10 0.00 0.00 70.33 68.24 1b76 n THR 349 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1b76 n GLY 350 N 3.61 -0.26 3.60 3.38 0.00 -1.26 -4.66 105.19 109.61 1b76 n GLY 350 Ca 0.00 -0.06 -0.43 0.00 0.00 0.00 0.00 46.02 45.53 1b76 n GLY 350 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1b76 s LYS 351 N -0.19 3.50 0.05 1.61 2.47 -1.22 -4.90 119.74 121.06 1b76 s LYS 351 Ca 0.02 1.25 -0.31 0.00 -1.56 0.00 0.00 55.97 55.38 1b76 s LYS 351 Cb 0.02 -4.10 -0.06 0.00 -1.46 0.00 0.00 37.83 32.23 1b76 s LYS 351 CO 0.00 -1.66 1.26 -1.58 0.16 0.00 0.00 175.35 173.54 1b76 s TRP 352 N 6.04 3.30 -0.13 4.03 0.51 -1.25 -4.38 118.94 127.07 1b76 s TRP 352 Ca 0.71 1.17 -0.09 0.00 -2.12 0.00 0.00 56.10 55.77 1b76 s TRP 352 Cb -0.19 -3.50 0.04 0.00 -0.81 0.00 0.00 33.47 29.01 1b76 s TRP 352 CO 0.33 -1.63 0.31 -0.59 -0.51 0.00 0.00 176.95 174.86 1b76 s PHE 353 N 1.35 -0.40 -0.00 -1.98 -0.71 -0.98 -4.73 117.98 110.53 1b76 s PHE 353 Ca 0.60 0.93 -0.30 0.00 -1.04 0.00 0.00 56.93 57.12 1b76 s PHE 353 Cb -0.31 0.13 -0.05 0.00 -1.21 0.00 0.00 43.02 41.59 1b76 s PHE 353 CO 0.28 -0.23 1.31 0.08 -1.34 0.00 0.00 175.22 175.32 1b76 s VAL 354 N 0.84 3.90 1.00 -2.49 1.01 -1.26 -3.20 120.40 120.20 1b76 s VAL 354 Ca -0.06 1.28 -0.12 0.00 0.00 0.00 0.00 61.98 63.09 1b76 s VAL 354 Cb -0.06 -3.83 0.19 0.00 0.00 0.00 0.00 36.38 32.68 1b76 s VAL 354 CO -0.06 0.02 1.09 -2.84 0.00 0.00 0.00 175.10 173.30 1b76 s PRO 355 N 2.11 0.41 0.47 2.72 0.02 -1.26 -4.69 135.00 134.78 1b76 s PRO 355 Ca 0.61 0.60 0.07 0.00 0.02 0.00 0.00 61.00 62.30 1b76 s PRO 355 Cb -0.29 -1.73 0.03 0.00 0.02 0.00 0.00 34.50 32.53 1b76 s PRO 355 CO 0.25 -2.76 0.65 0.71 -0.33 0.00 0.00 177.00 175.52 1b76 s TYR 356 N -2.91 2.61 -0.09 6.54 1.51 0.28 -4.45 117.35 120.84 1b76 s TYR 356 Ca 0.65 -0.36 -0.05 0.00 -1.01 0.00 0.00 57.07 56.30 1b76 s TYR 356 Cb -0.19 -2.45 0.04 0.00 -0.11 0.00 0.00 41.96 39.25 1b76 s TYR 356 CO 0.58 -0.63 0.22 0.54 -1.11 0.00 0.00 175.55 175.15 1b76 s VAL 357 N -2.49 -0.03 -0.21 0.71 0.11 -0.87 -0.20 120.40 117.42 1b76 s VAL 357 Ca 0.57 0.12 -0.07 0.00 -2.93 0.00 0.00 61.98 59.67 1b76 s VAL 357 Cb -0.09 -0.33 -0.03 0.00 -1.53 0.00 0.00 36.38 34.39 1b76 s VAL 357 CO 0.35 0.05 0.05 -0.63 -3.33 0.00 0.00 175.10 171.59 1b76 s ILE 358 N 0.99 4.41 -0.30 7.04 1.09 -0.63 -2.50 121.20 131.30 1b76 s ILE 358 Ca -0.07 -0.16 0.03 0.00 -1.10 0.00 0.00 60.65 59.35 1b76 s ILE 358 Cb -0.09 -3.01 0.08 0.00 -1.06 0.00 0.00 42.46 38.38 1b76 s ILE 358 CO -0.06 0.41 -0.02 -0.70 -0.10 0.00 0.00 174.94 174.47 1b76 s GLU 359 N 0.89 1.96 -0.55 2.79 2.12 -0.77 -1.37 118.70 123.78 1b76 s GLU 359 Ca 0.03 -1.56 -0.21 0.00 0.36 0.00 0.00 54.97 53.59 1b76 s GLU 359 Cb -0.14 -3.07 0.06 0.00 0.26 0.00 0.00 34.13 31.24 1b76 s GLU 359 CO 0.02 -0.74 0.75 -2.14 -0.54 0.00 0.00 175.26 172.61 1b76 s PRO 360 N 1.04 3.16 -0.25 4.30 0.02 -1.18 -1.16 135.00 140.93 1b76 s PRO 360 Ca -0.00 -0.80 -0.10 0.00 0.02 0.00 0.00 61.00 60.12 1b76 s PRO 360 Cb -0.20 -4.13 -0.04 0.00 0.02 0.00 0.00 34.50 30.15 1b76 s PRO 360 CO -0.06 -1.39 0.14 0.45 -0.33 0.00 0.00 177.00 175.81 1b76 s SER 361 N 2.97 5.80 -0.06 2.53 0.15 -1.11 -2.72 113.70 121.25 1b76 s SER 361 Ca 0.19 -0.01 0.02 0.00 0.70 0.00 0.00 55.95 56.85 1b76 s SER 361 Cb -0.18 -2.05 0.01 0.00 -1.71 0.00 0.00 66.02 62.09 1b76 s SER 361 CO 0.13 0.01 -0.11 0.00 1.20 0.00 0.00 173.24 174.47 1b76 s ALA 362 N 1.38 1.18 0.08 5.45 0.00 -1.04 -0.51 121.76 128.30 1b76 s ALA 362 Ca 0.07 -0.37 -0.30 0.00 0.00 0.00 0.00 51.96 51.36 1b76 s ALA 362 Cb -0.15 -0.56 -0.06 0.00 0.00 0.00 0.00 23.12 22.36 1b76 s ALA 362 CO 0.06 0.08 1.13 0.20 0.00 0.00 0.00 175.76 177.23 1b76 s GLY 363 N 0.74 2.61 0.19 0.00 0.00 -1.21 -2.00 107.32 107.66 1b76 s GLY 363 Ca -0.13 0.79 -0.05 0.00 0.00 0.00 0.00 44.72 45.32 1b76 s GLY 363 CO 0.03 1.88 1.57 -2.08 0.00 0.00 0.00 173.10 174.49 1b76 h VAL 364 N 4.34 1.28 -0.24 1.40 2.07 -1.24 -2.17 116.25 121.69 1b76 h VAL 364 Ca -0.42 -1.49 -0.14 0.00 0.82 0.00 0.00 66.70 65.47 1b76 h VAL 364 Cb 1.21 1.39 -0.00 0.00 -1.52 0.00 0.00 31.29 32.37 1b76 h VAL 364 CO 0.78 0.49 -0.39 0.44 0.02 0.00 0.00 177.57 178.91 1b76 h ASP 365 N 0.63 0.76 -0.21 0.57 3.32 -1.91 -2.42 116.42 117.16 1b76 h ASP 365 Ca 0.06 -0.52 -0.10 0.00 0.02 0.00 0.00 57.03 56.49 1b76 h ASP 365 Cb 0.87 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 40.19 1b76 h ASP 365 CO 0.08 1.14 -0.22 0.03 -1.72 0.00 0.00 179.24 178.55 1b76 h ARG 366 N 0.41 0.66 -0.84 3.56 2.47 -1.76 -1.41 114.38 117.47 1b76 h ARG 366 Ca 0.02 -0.25 0.00 0.00 -1.26 0.00 0.00 59.98 58.49 1b76 h ARG 366 Cb 0.98 -0.04 -0.04 0.00 -1.65 0.00 0.00 29.97 29.22 1b76 h ARG 366 CO 0.09 0.83 0.54 0.78 0.56 0.00 0.00 179.97 182.76 1b76 h GLY 367 N 0.99 1.20 0.96 0.04 0.00 -1.32 0.50 103.07 105.44 1b76 h GLY 367 Ca 0.09 -0.47 -0.02 0.00 0.00 0.00 0.00 47.33 46.92 1b76 h GLY 367 CO 0.05 0.46 0.20 -2.08 0.00 0.00 0.00 176.54 175.18 1b76 h VAL 368 N 1.15 1.20 -0.68 4.60 2.07 -0.93 0.88 116.25 124.54 1b76 h VAL 368 Ca 0.31 -0.59 -0.04 0.00 0.82 0.00 0.00 66.70 67.20 1b76 h VAL 368 Cb -0.10 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 30.36 1b76 h VAL 368 CO -0.06 0.22 0.28 0.25 0.02 0.00 0.00 177.57 178.28 1b76 h LEU 369 N 0.61 0.91 0.97 2.57 6.46 -0.63 0.11 115.31 126.31 1b76 h LEU 369 Ca 0.16 -0.13 -0.05 0.00 -0.12 0.00 0.00 57.88 57.75 1b76 h LEU 369 Cb 0.16 -0.24 0.01 0.00 -0.73 0.00 0.00 40.66 39.86 1b76 h LEU 369 CO -0.02 0.81 -0.46 0.00 -0.62 0.00 0.00 178.44 178.15 1b76 h ALA 370 N 1.32 -1.30 -0.72 1.25 0.00 0.11 0.17 119.26 120.08 1b76 h ALA 370 Ca 0.23 -0.28 0.09 0.00 0.00 0.00 0.00 54.91 54.94 1b76 h ALA 370 Cb 0.18 0.50 -0.07 0.00 0.00 0.00 0.00 17.79 18.40 1b76 h ALA 370 CO -0.02 -1.21 0.38 -0.07 0.00 0.00 0.00 179.25 178.33 1b76 h LEU 371 N -1.35 0.51 -0.14 0.00 3.38 -0.68 0.08 115.31 117.11 1b76 h LEU 371 Ca -0.13 0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1b76 h LEU 371 Cb 1.00 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.70 1b76 h LEU 371 CO 0.22 0.30 0.09 -0.07 0.09 0.00 0.00 178.44 179.07 1b76 h LEU 372 N 0.65 0.16 0.36 1.67 3.38 -0.64 -0.82 115.31 120.08 1b76 h LEU 372 Ca 0.35 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.29 1b76 h LEU 372 Cb 0.33 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 1b76 h LEU 372 CO -0.25 0.14 -0.28 0.00 0.09 0.00 0.00 178.44 178.14 1b76 h ALA 373 N 1.03 -0.64 -0.54 1.53 0.00 -0.10 -0.42 119.26 120.13 1b76 h ALA 373 Ca 0.05 -0.11 0.09 0.00 0.00 0.00 0.00 54.91 54.94 1b76 h ALA 373 Cb -0.00 0.38 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 1b76 h ALA 373 CO -0.01 -0.88 0.37 1.49 0.00 0.00 0.00 179.25 180.21 1b76 h GLU 374 N -0.64 0.36 0.19 0.00 4.57 -0.90 -2.12 114.58 116.03 1b76 h GLU 374 Ca -0.03 -0.02 -0.34 0.00 -1.18 0.00 0.00 59.36 57.79 1b76 h GLU 374 Cb 0.56 -0.08 0.01 0.00 -0.16 0.00 0.00 28.75 29.08 1b76 h GLU 374 CO -0.01 0.24 -1.65 0.00 -1.18 0.00 0.00 179.01 176.41 1b76 h ALA 375 N 1.72 0.11 -1.01 2.92 0.00 -0.84 -3.25 119.26 118.90 1b76 h ALA 375 Ca 0.25 -1.09 -0.70 0.00 0.00 0.00 0.00 54.91 53.37 1b76 h ALA 375 Cb 0.49 0.41 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 1b76 h ALA 375 CO -0.06 0.93 1.29 0.34 0.00 0.00 0.00 179.25 181.75 1b76 n PHE 376 N -3.67 1.64 -4.02 0.00 -0.00 -0.19 -1.92 117.46 109.30 1b76 n PHE 376 Ca -0.24 0.41 -0.14 0.00 -0.00 0.00 0.00 57.45 57.49 1b76 n PHE 376 Cb 1.05 -2.48 -0.14 0.00 -0.00 0.00 0.00 39.48 37.92 1b76 n PHE 376 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 176.76 177.71 1b76 s THR 377 N 6.22 0.23 -0.11 -2.13 -4.23 -0.11 -2.79 115.64 112.71 1b76 s THR 377 Ca 1.09 -0.23 -0.05 0.00 -1.18 0.00 0.00 61.69 61.32 1b76 s THR 377 Cb -1.01 -0.22 -0.04 0.00 1.34 0.00 0.00 72.50 72.57 1b76 s THR 377 CO 0.56 -0.01 0.08 -0.13 -0.54 0.00 0.00 174.62 174.58 1b76 s ARG 378 N -0.25 3.31 -0.04 3.99 0.52 -1.26 -0.16 118.95 125.05 1b76 s ARG 378 Ca -0.01 -0.26 0.02 0.00 -0.52 0.00 0.00 55.73 54.96 1b76 s ARG 378 Cb -0.02 -3.04 0.01 0.00 0.52 0.00 0.00 34.95 32.42 1b76 s ARG 378 CO -0.00 0.70 -0.09 -1.21 0.02 0.00 0.00 175.30 174.72 1b76 s GLU 379 N -0.84 1.15 -0.53 3.54 2.02 0.44 -4.93 118.70 119.55 1b76 s GLU 379 Ca 0.13 -0.29 -0.25 0.00 0.02 0.00 0.00 54.97 54.58 1b76 s GLU 379 Cb -0.12 -1.04 0.04 0.00 0.10 0.00 0.00 34.13 33.11 1b76 s GLU 379 CO 0.03 0.04 0.97 -1.83 0.02 0.00 0.00 175.26 174.49 1b76 s GLU 380 N 0.50 3.42 1.24 1.61 -1.05 -1.26 -0.30 118.70 122.85 1b76 s GLU 380 Ca -0.09 -0.06 -0.18 0.00 -0.15 0.00 0.00 54.97 54.49 1b76 s GLU 380 Cb -0.12 -4.01 0.30 0.00 -0.44 0.00 0.00 34.13 29.86 1b76 s GLU 380 CO 0.01 -1.43 1.03 -0.51 0.95 0.00 0.00 175.26 175.31 1b76 s LEU 381 N 4.03 0.27 0.08 1.83 1.43 -0.08 -4.95 118.68 121.28 1b76 s LEU 381 Ca 0.34 0.97 -0.14 0.00 -1.03 0.00 0.00 54.13 54.27 1b76 s LEU 381 Cb -0.11 -2.71 -0.16 0.00 0.03 0.00 0.00 46.19 43.24 1b76 s LEU 381 CO 0.22 -4.40 1.29 1.55 0.23 0.00 0.00 176.35 175.24 1b76 h PRO 382 N -2.77 0.71 0.00 1.29 0.13 -1.95 -3.18 132.00 126.22 1b76 h PRO 382 Ca -0.50 -0.57 0.00 0.00 -0.87 0.00 0.00 66.00 64.06 1b76 h PRO 382 Cb 1.32 0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.57 1b76 h PRO 382 CO 0.40 1.18 0.04 0.27 -0.23 0.00 0.00 178.00 179.66 1b76 n ASN 383 N -4.05 0.00 0.00 1.44 0.23 -1.26 -4.82 115.26 106.80 1b76 n ASN 383 Ca -0.07 0.17 0.00 0.00 -0.53 0.00 0.00 54.58 54.15 1b76 n ASN 383 Cb 0.69 -0.17 0.00 0.00 -2.08 0.00 0.00 39.78 38.21 1b76 n ASN 383 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1b76 n GLY 384 N -1.12 2.71 3.67 4.83 0.00 -1.20 -5.07 105.19 109.00 1b76 n GLY 384 Ca 0.00 -0.77 -0.34 0.00 0.00 0.00 0.00 46.02 44.91 1b76 n GLY 384 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1b76 n GLU 385 N 0.00 0.15 -3.47 1.61 4.71 -1.26 -4.34 120.64 118.03 1b76 n GLU 385 Ca 0.00 0.13 -0.19 0.00 -0.01 0.00 0.00 57.16 57.08 1b76 n GLU 385 Cb 0.00 -2.38 -0.01 0.00 -1.01 0.00 0.00 31.44 28.04 1b76 n GLU 385 CO 0.00 0.00 0.00 -1.83 0.09 0.00 0.00 177.13 175.39 1b76 s GLU 386 N -4.03 2.84 0.01 3.49 -1.05 -1.26 -0.91 118.70 117.80 1b76 s GLU 386 Ca 0.72 -1.23 0.02 0.00 -0.15 0.00 0.00 54.97 54.32 1b76 s GLU 386 Cb -0.29 -2.63 -0.01 0.00 -0.44 0.00 0.00 34.13 30.75 1b76 s GLU 386 CO 0.52 -0.05 -0.06 -0.98 0.95 0.00 0.00 175.26 175.64 1b76 s ARG 387 N -4.16 0.45 -0.44 -4.83 1.70 0.59 -4.88 118.95 107.38 1b76 s ARG 387 Ca 0.47 -0.41 -0.14 0.00 -0.47 0.00 0.00 55.73 55.17 1b76 s ARG 387 Cb -0.07 -0.34 0.06 0.00 -0.57 0.00 0.00 34.95 34.02 1b76 s ARG 387 CO 0.30 0.08 0.34 0.42 -1.08 0.00 0.00 175.30 175.36 1b76 s ILE 388 N -0.64 5.05 -0.13 4.99 1.09 -1.26 -0.42 121.20 129.88 1b76 s ILE 388 Ca -0.03 -1.01 -0.07 0.00 -1.10 0.00 0.00 60.65 58.44 1b76 s ILE 388 Cb -0.05 -3.97 -0.04 0.00 -1.06 0.00 0.00 42.46 37.34 1b76 s ILE 388 CO 0.00 -0.49 0.12 -0.69 -0.10 0.00 0.00 174.94 173.78 1b76 s VAL 389 N 1.61 5.32 -0.66 2.92 1.01 0.77 -3.66 120.40 127.72 1b76 s VAL 389 Ca 0.04 0.14 -0.17 0.00 0.00 0.00 0.00 61.98 62.00 1b76 s VAL 389 Cb -0.23 -3.33 0.14 0.00 0.00 0.00 0.00 36.38 32.96 1b76 s VAL 389 CO 0.07 0.58 0.68 -0.76 0.00 0.00 0.00 175.10 175.67 1b76 s LEU 390 N -0.71 5.98 -1.31 3.92 1.43 0.56 -0.94 118.68 127.62 1b76 s LEU 390 Ca 0.13 -1.92 -0.15 0.00 -1.03 0.00 0.00 54.13 51.16 1b76 s LEU 390 Cb -0.12 -2.26 -0.02 0.00 0.03 0.00 0.00 46.19 43.83 1b76 s LEU 390 CO 0.03 -0.89 2.23 0.29 0.23 0.00 0.00 176.35 178.24 1b76 n LYS 391 N 5.39 2.61 -2.66 1.70 5.02 -0.81 -3.98 118.16 125.44 1b76 n LYS 391 Ca -0.03 -2.36 -0.33 0.00 -2.02 0.00 0.00 58.31 53.57 1b76 n LYS 391 Cb 0.43 -3.13 -0.05 0.00 -0.02 0.00 0.00 35.03 32.26 1b76 n LYS 391 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1b76 s LEU 392 N 1.71 3.87 -0.19 -0.35 1.43 -1.26 -4.63 118.68 119.26 1b76 s LEU 392 Ca 0.51 1.81 -0.29 0.00 -1.03 0.00 0.00 54.13 55.13 1b76 s LEU 392 Cb 0.14 -4.55 -0.03 0.00 0.03 0.00 0.00 46.19 41.78 1b76 s LEU 392 CO -0.04 -0.59 1.63 -0.75 0.23 0.00 0.00 176.35 176.83 1b76 s LYS 393 N -3.25 3.85 0.19 1.70 2.36 -1.26 -4.81 119.74 118.51 1b76 s LYS 393 Ca 0.65 1.76 -0.07 0.00 -2.55 0.00 0.00 55.97 55.76 1b76 s LYS 393 Cb -0.13 -4.03 0.29 0.00 -1.05 0.00 0.00 37.83 32.92 1b76 s LYS 393 CO 0.17 -1.23 1.08 -2.30 1.55 0.00 0.00 175.35 174.63 1b76 n PRO 394 N 7.58 -0.08 0.16 4.03 -0.02 -1.26 0.12 135.00 145.53 1b76 n PRO 394 Ca 0.19 1.08 0.11 0.00 -2.02 0.00 0.00 63.50 62.86 1b76 n PRO 394 Cb 0.45 -1.61 0.58 0.00 -0.02 0.00 0.00 33.50 32.89 1b76 n PRO 394 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1b76 n GLN 395 N -5.11 0.16 0.00 -0.52 3.00 -1.26 -2.23 117.38 111.41 1b76 n GLN 395 Ca 0.10 0.59 0.04 0.00 -0.01 0.00 0.00 57.00 57.72 1b76 n GLN 395 Cb 0.34 -1.95 -0.02 0.00 0.00 0.00 0.00 30.24 28.61 1b76 n GLN 395 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 1b76 n LEU 396 N -2.27 0.77 -4.52 1.08 4.77 0.33 -5.03 117.00 112.13 1b76 n LEU 396 Ca -0.01 -0.66 -0.36 0.00 -0.03 0.00 0.00 56.01 54.95 1b76 n LEU 396 Cb 0.08 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.25 1b76 n LEU 396 CO 0.12 0.16 0.24 0.00 -1.33 0.00 0.00 177.39 176.59 1b76 n ALA 397 N -0.64 -1.05 0.17 -1.18 0.00 -0.95 -4.63 120.51 112.22 1b76 n ALA 397 Ca 0.02 -0.23 0.02 0.00 0.00 0.00 0.00 53.44 53.25 1b76 n ALA 397 Cb 0.14 -1.95 0.28 0.00 0.00 0.00 0.00 19.45 17.91 1b76 n ALA 397 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1b76 h PRO 398 N -0.37 0.00 -3.99 0.00 0.11 -1.84 -3.41 132.00 122.50 1b76 h PRO 398 Ca -0.46 0.00 -0.48 0.00 0.11 0.00 0.00 66.00 65.17 1b76 h PRO 398 Cb 1.34 0.00 -0.37 0.00 0.11 0.00 0.00 31.00 32.08 1b76 h PRO 398 CO 0.44 0.48 -0.78 0.42 -0.21 0.00 0.00 178.00 178.34 1b76 s ILE 399 N -3.70 0.70 0.11 4.15 1.01 -1.26 -4.74 121.20 117.47 1b76 s ILE 399 Ca -0.01 -0.10 -0.15 0.00 0.00 0.00 0.00 60.65 60.40 1b76 s ILE 399 Cb 0.12 -0.77 -0.06 0.00 0.01 0.00 0.00 42.46 41.76 1b76 s ILE 399 CO 0.72 0.31 1.47 0.11 0.00 0.00 0.00 174.94 177.55 1b76 h LYS 400 N 8.10 0.71 -3.30 2.79 6.56 -0.89 -3.36 116.57 127.18 1b76 h LYS 400 Ca -0.26 -0.32 -0.20 0.00 -1.06 0.00 0.00 60.65 58.81 1b76 h LYS 400 Cb 1.13 -0.02 -0.27 0.00 -0.57 0.00 0.00 32.23 32.50 1b76 h LYS 400 CO 0.35 0.93 -0.53 0.08 -2.06 0.00 0.00 179.45 178.21 1b76 s VAL 401 N -4.58 -0.01 -0.07 0.50 1.01 -1.22 -3.02 120.40 113.02 1b76 s VAL 401 Ca -0.13 0.03 0.01 0.00 0.00 0.00 0.00 61.98 61.90 1b76 s VAL 401 Cb 0.09 -0.25 -0.03 0.00 0.00 0.00 0.00 36.38 36.20 1b76 s VAL 401 CO 0.82 0.01 -0.09 0.00 0.00 0.00 0.00 175.10 175.84 1b76 s ALA 402 N 0.31 2.88 -0.22 5.51 0.00 -0.73 0.37 121.76 129.89 1b76 s ALA 402 Ca -0.02 -0.91 -0.04 0.00 0.00 0.00 0.00 51.96 50.98 1b76 s ALA 402 Cb -0.03 -1.16 -0.01 0.00 0.00 0.00 0.00 23.12 21.91 1b76 s ALA 402 CO -0.01 0.55 -0.02 0.08 0.00 0.00 0.00 175.76 176.35 1b76 s VAL 403 N -0.72 3.57 -0.19 0.00 1.01 0.37 0.17 120.40 124.62 1b76 s VAL 403 Ca 0.11 -0.43 0.00 0.00 0.00 0.00 0.00 61.98 61.66 1b76 s VAL 403 Cb -0.11 -2.63 0.02 0.00 0.00 0.00 0.00 36.38 33.66 1b76 s VAL 403 CO 0.01 0.41 -0.17 -0.63 0.00 0.00 0.00 175.10 174.72 1b76 s ILE 404 N 1.41 2.26 -0.03 2.22 1.09 -0.26 -0.58 121.20 127.31 1b76 s ILE 404 Ca 0.05 -0.91 -0.30 0.00 -1.10 0.00 0.00 60.65 58.39 1b76 s ILE 404 Cb -0.14 -1.98 -0.04 0.00 -1.06 0.00 0.00 42.46 39.23 1b76 s ILE 404 CO -0.01 0.49 1.26 -2.16 -0.10 0.00 0.00 174.94 174.42 1b76 s PRO 405 N 1.31 4.34 0.18 2.79 0.04 -1.25 -1.76 135.00 140.65 1b76 s PRO 405 Ca 0.04 1.77 -0.13 0.00 0.04 0.00 0.00 61.00 62.72 1b76 s PRO 405 Cb -0.14 -3.54 0.17 0.00 0.04 0.00 0.00 34.50 31.03 1b76 s PRO 405 CO -0.11 -0.47 1.72 1.25 0.04 0.00 0.00 177.00 179.43 1b76 h LEU 406 N 8.13 0.02 -8.27 -3.56 5.85 -0.33 -3.40 115.31 113.74 1b76 h LEU 406 Ca -0.36 0.08 -0.59 0.00 0.84 0.00 0.00 57.88 57.85 1b76 h LEU 406 Cb 1.17 0.11 -0.31 0.00 0.37 0.00 0.00 40.66 41.99 1b76 h LEU 406 CO 0.88 0.04 -0.85 -0.69 -0.34 0.00 0.00 178.44 177.48 1b76 s VAL 407 N -6.14 1.58 -0.16 1.05 1.01 -1.26 -4.83 120.40 111.64 1b76 s VAL 407 Ca -0.13 -0.79 0.28 0.00 0.00 0.00 0.00 61.98 61.34 1b76 s VAL 407 Cb 0.15 -1.35 0.36 0.00 0.00 0.00 0.00 36.38 35.54 1b76 s VAL 407 CO 0.72 0.45 1.80 0.11 0.00 0.00 0.00 175.10 178.18 1b76 h LYS 408 N 6.28 0.00 0.32 2.72 6.56 -1.94 -3.38 116.57 127.13 1b76 h LYS 408 Ca -0.32 0.00 -0.02 0.00 -1.06 0.00 0.00 60.65 59.26 1b76 h LYS 408 Cb 1.18 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.84 1b76 h LYS 408 CO 0.48 0.01 -0.15 -2.95 -2.06 0.00 0.00 179.45 174.77 1b76 h ASN 409 N 0.00 -0.36 -1.82 0.86 -1.07 -1.97 -3.43 115.58 107.78 1b76 h ASN 409 Ca -0.00 0.01 -0.59 0.00 0.07 0.00 0.00 56.30 55.80 1b76 h ASN 409 Cb 0.76 0.09 -0.00 0.00 -2.07 0.00 0.00 38.32 37.10 1b76 h ASN 409 CO 0.00 -0.15 1.51 -1.14 0.07 0.00 0.00 177.43 177.72 1b76 n ARG 410 N -3.73 1.75 0.03 4.14 3.00 -1.26 -4.83 116.66 115.76 1b76 n ARG 410 Ca -0.05 0.45 0.02 0.00 -0.00 0.00 0.00 57.85 58.26 1b76 n ARG 410 Cb 0.17 -3.16 0.37 0.00 0.00 0.00 0.00 32.46 29.83 1b76 n ARG 410 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.63 176.28 1b76 h PRO 411 N 15.25 0.45 -0.64 -0.14 0.11 -1.92 -0.62 132.00 144.50 1b76 h PRO 411 Ca -0.37 -0.07 0.16 0.00 0.11 0.00 0.00 66.00 65.82 1b76 h PRO 411 Cb 1.25 -0.08 -0.03 0.00 0.11 0.00 0.00 31.00 32.25 1b76 h PRO 411 CO 0.99 0.43 0.44 0.93 -0.21 0.00 0.00 178.00 180.59 1b76 h GLU 412 N 0.44 0.16 0.13 1.05 5.08 -1.99 -0.67 114.58 118.79 1b76 h GLU 412 Ca 0.10 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.45 1b76 h GLU 412 Cb 0.20 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.42 1b76 h GLU 412 CO -0.00 0.11 -0.06 0.82 -1.00 0.00 0.00 179.01 178.87 1b76 h ILE 413 N 0.17 0.00 -0.93 3.13 2.04 -1.48 -3.18 117.51 117.25 1b76 h ILE 413 Ca 0.31 -0.61 0.25 0.00 1.00 0.00 0.00 64.86 65.80 1b76 h ILE 413 Cb 0.98 0.00 -0.13 0.00 -0.74 0.00 0.00 36.82 36.93 1b76 h ILE 413 CO -0.05 0.00 0.43 0.71 0.00 0.00 0.00 178.15 179.24 1b76 h THR 414 N -0.79 0.41 0.34 -0.27 1.35 -1.27 0.93 112.91 113.62 1b76 h THR 414 Ca -0.02 -0.13 -0.00 0.00 -0.55 0.00 0.00 66.41 65.71 1b76 h THR 414 Cb 0.14 0.01 -0.03 0.00 -1.73 0.00 0.00 68.15 66.53 1b76 h THR 414 CO 0.03 0.07 -0.50 -0.33 -0.25 0.00 0.00 175.52 174.54 1b76 h GLU 415 N 0.37 -0.85 -0.71 4.72 4.39 -1.26 0.39 114.58 121.63 1b76 h GLU 415 Ca 0.61 0.06 0.14 0.00 0.34 0.00 0.00 59.36 60.51 1b76 h GLU 415 Cb 1.23 0.19 -0.10 0.00 -0.10 0.00 0.00 28.75 29.98 1b76 h GLU 415 CO -0.56 -0.57 0.22 -0.92 -1.16 0.00 0.00 179.01 176.02 1b76 h TYR 416 N -0.89 0.37 0.67 4.33 5.03 -0.87 0.22 116.97 125.83 1b76 h TYR 416 Ca -0.03 0.04 -0.03 0.00 2.58 0.00 0.00 58.73 61.29 1b76 h TYR 416 Cb 0.81 -0.05 -0.01 0.00 1.55 0.00 0.00 36.73 39.03 1b76 h TYR 416 CO -0.32 -0.01 -0.49 0.00 -1.32 0.00 0.00 178.16 176.02 1b76 h ALA 417 N 1.55 -1.19 -0.92 1.82 0.00 0.52 0.47 119.26 121.51 1b76 h ALA 417 Ca 0.39 -0.22 0.19 0.00 0.00 0.00 0.00 54.91 55.27 1b76 h ALA 417 Cb 0.62 0.64 -0.07 0.00 0.00 0.00 0.00 17.79 18.98 1b76 h ALA 417 CO -0.44 -1.20 0.59 0.87 0.00 0.00 0.00 179.25 179.08 1b76 h LYS 418 N -1.11 0.52 0.69 0.00 1.57 0.58 0.19 116.57 119.01 1b76 h LYS 418 Ca -0.09 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.63 1b76 h LYS 418 Cb 0.92 -0.12 0.01 0.00 0.08 0.00 0.00 32.23 33.12 1b76 h LYS 418 CO 0.04 0.34 -0.33 0.00 -0.57 0.00 0.00 179.45 178.93 1b76 h ARG 419 N 0.53 -0.89 -0.66 3.15 3.08 0.29 -2.87 114.38 117.00 1b76 h ARG 419 Ca 0.48 0.06 0.14 0.00 0.07 0.00 0.00 59.98 60.74 1b76 h ARG 419 Cb 1.02 0.20 -0.11 0.00 0.08 0.00 0.00 29.97 31.16 1b76 h ARG 419 CO -0.22 -0.56 0.03 1.25 -1.07 0.00 0.00 179.97 179.40 1b76 h LEU 420 N -1.14 -0.24 -0.37 3.04 7.12 0.11 -1.28 115.31 122.56 1b76 h LEU 420 Ca -0.09 0.16 0.08 0.00 0.13 0.00 0.00 57.88 58.15 1b76 h LEU 420 Cb 0.74 0.27 -0.09 0.00 -0.53 0.00 0.00 40.66 41.05 1b76 h LEU 420 CO 0.16 -0.11 -0.28 0.50 -0.13 0.00 0.00 178.44 178.58 1b76 h LYS 421 N 0.14 -0.21 -0.42 1.25 3.11 -0.59 -1.07 116.57 118.79 1b76 h LYS 421 Ca 0.35 0.01 0.01 0.00 -2.81 0.00 0.00 60.65 58.22 1b76 h LYS 421 Cb 0.59 0.05 -0.02 0.00 -1.00 0.00 0.00 32.23 31.84 1b76 h LYS 421 CO -0.55 -0.14 0.26 0.00 -2.81 0.00 0.00 179.45 176.21 1b76 h ALA 422 N 0.88 0.53 -0.23 5.00 0.00 -1.04 0.11 119.26 124.50 1b76 h ALA 422 Ca 0.18 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 55.13 1b76 h ALA 422 Cb 0.50 -0.15 -0.07 0.00 0.00 0.00 0.00 17.79 18.08 1b76 h ALA 422 CO -0.50 -0.04 -0.22 -0.09 0.00 0.00 0.00 179.25 178.40 1b76 h ARG 423 N 0.54 -0.22 0.00 0.00 1.12 -0.48 0.11 114.38 115.45 1b76 h ARG 423 Ca 0.16 0.01 -0.08 0.00 -1.11 0.00 0.00 59.98 58.96 1b76 h ARG 423 Cb -0.03 0.05 -0.01 0.00 -0.01 0.00 0.00 29.97 29.97 1b76 h ARG 423 CO -0.05 -0.15 -0.39 -0.07 -3.11 0.00 0.00 179.97 176.21 1b76 h LEU 424 N -0.23 0.00 -0.34 3.80 3.38 -0.72 -1.12 115.31 120.09 1b76 h LEU 424 Ca 0.13 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.09 1b76 h LEU 424 Cb 0.43 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 1b76 h LEU 424 CO -0.36 0.39 0.15 0.25 0.09 0.00 0.00 178.44 178.96 1b76 h LEU 425 N 0.00 0.45 -2.07 1.67 5.85 0.30 -1.97 115.31 119.55 1b76 h LEU 425 Ca -0.00 -0.14 0.06 0.00 0.84 0.00 0.00 57.88 58.63 1b76 h LEU 425 Cb 0.73 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.63 1b76 h LEU 425 CO 0.05 0.47 0.34 0.00 -0.34 0.00 0.00 178.44 178.96 1b76 h ALA 426 N 1.00 1.75 -0.02 1.25 0.00 0.50 0.39 119.26 124.13 1b76 h ALA 426 Ca 0.11 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.02 1b76 h ALA 426 Cb 0.15 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 1b76 h ALA 426 CO -0.01 -0.45 0.02 -0.07 0.00 0.00 0.00 179.25 178.74 1b76 h LEU 427 N 0.00 0.00 0.78 0.00 3.38 -1.21 -3.45 115.31 114.81 1b76 h LEU 427 Ca 0.10 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.95 1b76 h LEU 427 Cb 0.79 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.52 1b76 h LEU 427 CO -0.00 0.00 -0.15 0.61 0.09 0.00 0.00 178.44 178.99 1b76 n GLY 428 N -1.40 0.25 0.02 0.83 0.00 0.13 -4.89 105.19 100.12 1b76 n GLY 428 Ca -0.02 -0.65 0.11 0.00 0.00 0.00 0.00 46.02 45.46 1b76 n GLY 428 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1b76 n LEU 429 N -0.86 0.64 0.00 0.99 4.77 -1.26 -5.05 117.00 116.23 1b76 n LEU 429 Ca -0.07 -0.08 0.00 0.00 -0.03 0.00 0.00 56.01 55.83 1b76 n LEU 429 Cb 0.49 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.44 1b76 n LEU 429 CO 0.09 0.10 0.00 0.61 -1.33 0.00 0.00 177.39 176.86 1b76 n GLY 430 N 1.44 3.52 3.58 -0.72 0.00 -1.26 -4.90 105.19 106.84 1b76 n GLY 430 Ca 0.04 -1.71 -0.52 0.00 0.00 0.00 0.00 46.02 43.83 1b76 n GLY 430 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1b76 n ARG 431 N -1.88 1.38 -3.90 1.61 3.00 -1.26 -4.71 116.66 110.90 1b76 n ARG 431 Ca 0.00 0.45 -0.25 0.00 -0.00 0.00 0.00 57.85 58.05 1b76 n ARG 431 Cb 0.00 -2.42 -0.03 0.00 0.00 0.00 0.00 32.46 30.01 1b76 n ARG 431 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 1b76 s VAL 432 N 5.53 5.29 0.04 5.15 1.01 -1.26 -0.29 120.40 135.87 1b76 s VAL 432 Ca 1.02 -0.70 0.04 0.00 0.00 0.00 0.00 61.98 62.34 1b76 s VAL 432 Cb -0.87 -3.77 -0.02 0.00 0.00 0.00 0.00 36.38 31.72 1b76 s VAL 432 CO 0.54 -0.17 -0.11 -0.22 0.00 0.00 0.00 175.10 175.15 1b76 s LEU 433 N -3.44 2.18 -0.34 3.92 2.96 0.16 -4.93 118.68 119.19 1b76 s LEU 433 Ca 0.35 -0.44 -0.10 0.00 -0.22 0.00 0.00 54.13 53.72 1b76 s LEU 433 Cb -0.11 -0.42 0.01 0.00 0.50 0.00 0.00 46.19 46.17 1b76 s LEU 433 CO 0.29 -0.04 0.18 -0.47 -1.32 0.00 0.00 176.35 174.99 1b76 s TYR 434 N -0.91 3.21 -0.36 5.38 5.04 -1.26 -0.48 117.35 127.97 1b76 s TYR 434 Ca -0.02 -0.74 -0.08 0.00 -2.44 0.00 0.00 57.07 53.78 1b76 s TYR 434 Cb -0.08 -2.40 0.04 0.00 0.35 0.00 0.00 41.96 39.87 1b76 s TYR 434 CO 0.01 -0.54 0.15 -2.00 -1.34 0.00 0.00 175.55 171.83 1b76 s GLU 435 N 1.59 2.70 -0.19 4.97 2.56 0.25 -4.91 118.70 125.67 1b76 s GLU 435 Ca 0.03 -1.15 0.16 0.00 0.00 0.00 0.00 54.97 54.01 1b76 s GLU 435 Cb -0.18 -3.58 0.62 0.00 2.00 0.00 0.00 34.13 32.99 1b76 s GLU 435 CO 0.07 -0.69 1.53 -0.40 -0.56 0.00 0.00 175.26 175.20 1b76 n ASP 436 N 4.89 4.47 -4.73 -1.70 5.68 -1.26 -3.88 116.55 120.02 1b76 n ASP 436 Ca -0.12 -2.93 -0.36 0.00 -0.50 0.00 0.00 54.79 50.88 1b76 n ASP 436 Cb 0.45 -0.58 0.08 0.00 -1.14 0.00 0.00 41.12 39.93 1b76 n ASP 436 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 1b76 s THR 437 N -2.70 2.17 0.00 2.12 2.01 -1.26 -4.99 115.64 112.99 1b76 s THR 437 Ca 0.46 0.09 0.00 0.00 0.31 0.00 0.00 61.69 62.55 1b76 s THR 437 Cb 0.36 -2.89 0.00 0.00 0.01 0.00 0.00 72.50 69.98 1b76 s THR 437 CO 0.12 -0.03 0.00 0.61 -0.69 0.00 0.00 174.62 174.63 1b76 n GLY 438 N 0.69 -1.32 0.00 4.40 0.00 -1.26 -4.71 105.19 103.00 1b76 n GLY 438 Ca 0.15 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.74 1b76 n GLY 438 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1b76 n ASN 439 N 0.00 0.00 -0.22 1.61 2.85 -1.26 -4.44 115.26 113.79 1b76 n ASN 439 Ca 0.00 0.00 0.15 0.00 -0.11 0.00 0.00 54.58 54.62 1b76 n ASN 439 Cb 0.00 0.00 0.28 0.00 1.24 0.00 0.00 39.78 41.30 1b76 n ASN 439 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1b76 n ILE 440 N 0.00 -0.28 0.03 -1.44 0.13 -1.26 0.12 119.36 116.65 1b76 n ILE 440 Ca 0.00 1.40 -0.10 0.00 -1.10 0.00 0.00 62.75 62.95 1b76 n ILE 440 Cb 0.00 -2.15 -0.04 0.00 -0.84 0.00 0.00 39.64 36.61 1b76 n ILE 440 CO 0.00 0.00 0.00 1.23 2.80 0.00 0.00 176.55 180.58 1b76 h GLY 441 N 0.00 -0.14 0.45 4.50 0.00 -1.99 -1.62 103.07 104.27 1b76 h GLY 441 Ca 0.47 0.18 0.11 0.00 0.00 0.00 0.00 47.33 48.10 1b76 h GLY 441 CO -0.57 -0.15 0.53 1.70 0.00 0.00 0.00 176.54 178.05 1b76 h LYS 442 N -0.22 0.82 0.43 4.80 3.64 0.57 0.23 116.57 126.85 1b76 h LYS 442 Ca 0.07 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 1b76 h LYS 442 Cb 0.32 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 1b76 h LYS 442 CO -0.19 0.54 -0.32 0.00 -2.27 0.00 0.00 179.45 177.21 1b76 h ALA 443 N 1.50 -0.76 -0.55 5.00 0.00 -0.83 0.28 119.26 123.90 1b76 h ALA 443 Ca 0.45 -0.14 0.11 0.00 0.00 0.00 0.00 54.91 55.33 1b76 h ALA 443 Cb 0.46 0.43 -0.11 0.00 0.00 0.00 0.00 17.79 18.57 1b76 h ALA 443 CO -0.27 -0.95 -0.25 1.88 0.00 0.00 0.00 179.25 179.66 1b76 h TYR 444 N -0.75 -0.64 0.16 0.00 0.05 -0.49 -2.15 116.97 113.16 1b76 h TYR 444 Ca -0.04 0.06 0.00 0.00 0.05 0.00 0.00 58.73 58.80 1b76 h TYR 444 Cb 0.64 0.37 -0.03 0.00 1.01 0.00 0.00 36.73 38.72 1b76 h TYR 444 CO -0.14 -0.33 -0.36 0.00 -1.05 0.00 0.00 178.16 176.28 1b76 h ARG 445 N -0.11 -0.55 -0.92 4.88 3.08 -0.51 -2.21 114.38 118.03 1b76 h ARG 445 Ca 0.25 0.04 0.26 0.00 0.07 0.00 0.00 59.98 60.60 1b76 h ARG 445 Cb 0.51 0.13 -0.16 0.00 0.08 0.00 0.00 29.97 30.52 1b76 h ARG 445 CO -0.63 -0.37 0.19 -0.09 -1.07 0.00 0.00 179.97 178.01 1b76 h ARG 446 N -0.57 0.12 0.00 0.04 2.43 -0.45 0.57 114.38 116.51 1b76 h ARG 446 Ca -0.02 -0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.10 1b76 h ARG 446 Cb 0.55 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.07 1b76 h ARG 446 CO -0.15 0.08 -0.23 0.45 -1.51 0.00 0.00 179.97 178.60 1b76 h HIS 447 N 0.12 0.00 0.15 2.20 3.86 -1.00 0.23 115.15 120.71 1b76 h HIS 447 Ca 0.59 0.00 -0.25 0.00 -1.16 0.00 0.00 60.37 59.55 1b76 h HIS 447 Cb 1.25 0.00 0.03 0.00 1.06 0.00 0.00 27.41 29.75 1b76 h HIS 447 CO -0.32 0.23 -1.06 -0.44 0.86 0.00 0.00 177.93 177.20 1b76 h ASP 448 N 0.00 0.67 -0.59 2.45 3.32 0.67 0.22 116.42 123.16 1b76 h ASP 448 Ca -0.00 -0.89 -0.02 0.00 0.02 0.00 0.00 57.03 56.13 1b76 h ASP 448 Cb 0.56 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.86 1b76 h ASP 448 CO 0.03 1.51 0.30 -0.33 -1.72 0.00 0.00 179.24 179.03 1b76 h GLU 449 N -0.06 0.88 -0.26 3.56 5.08 -0.59 0.24 114.58 123.43 1b76 h GLU 449 Ca -0.18 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.07 1b76 h GLU 449 Cb 1.80 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.89 1b76 h GLU 449 CO 0.20 0.68 0.00 1.33 -1.00 0.00 0.00 179.01 180.22 1b76 n VAL 450 N -4.35 0.33 -3.60 3.13 0.24 0.75 -4.15 118.33 110.68 1b76 n VAL 450 Ca 0.06 -0.48 -0.20 0.00 -2.04 0.00 0.00 64.34 61.67 1b76 n VAL 450 Cb 0.13 0.55 0.06 0.00 -1.47 0.00 0.00 33.84 33.11 1b76 n VAL 450 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1b76 n GLY 451 N 1.24 -0.35 3.55 7.63 0.00 0.40 -4.55 105.19 113.13 1b76 n GLY 451 Ca 0.17 0.13 -0.42 0.00 0.00 0.00 0.00 46.02 45.90 1b76 n GLY 451 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1b76 s THR 452 N -3.50 4.93 0.23 2.61 -4.23 0.57 -4.50 115.64 111.75 1b76 s THR 452 Ca 0.08 0.37 0.05 0.00 -1.18 0.00 0.00 61.69 61.02 1b76 s THR 452 Cb -0.04 -4.06 0.29 0.00 1.34 0.00 0.00 72.50 70.03 1b76 s THR 452 CO 0.77 -0.34 1.12 -2.65 -0.54 0.00 0.00 174.62 172.99 1b76 n PRO 453 N 5.96 -0.05 -3.80 3.99 -0.02 -1.25 -4.64 135.00 135.19 1b76 n PRO 453 Ca -0.03 1.05 -0.13 0.00 -2.02 0.00 0.00 63.50 62.38 1b76 n PRO 453 Cb 0.48 -1.72 -0.10 0.00 -0.02 0.00 0.00 33.50 32.14 1b76 n PRO 453 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 1b76 s PHE 454 N -5.48 -0.18 -0.38 6.00 0.40 -1.17 -2.31 117.98 114.87 1b76 s PHE 454 Ca -0.09 0.37 0.03 0.00 -0.60 0.00 0.00 56.93 56.64 1b76 s PHE 454 Cb 0.22 0.06 0.11 0.00 0.51 0.00 0.00 43.02 43.92 1b76 s PHE 454 CO 0.56 -0.26 0.12 0.00 0.70 0.00 0.00 175.22 176.34 1b76 s ALA 455 N -0.70 2.61 0.30 5.36 0.00 -1.24 -1.77 121.76 126.33 1b76 s ALA 455 Ca -0.08 -2.50 -0.29 0.00 0.00 0.00 0.00 51.96 49.09 1b76 s ALA 455 Cb -0.04 -1.93 -0.10 0.00 0.00 0.00 0.00 23.12 21.06 1b76 s ALA 455 CO 0.02 -1.79 1.13 0.08 0.00 0.00 0.00 175.76 175.20 1b76 s VAL 456 N 0.77 3.38 -0.06 0.00 1.01 0.13 -2.58 120.40 123.04 1b76 s VAL 456 Ca 0.13 1.35 0.01 0.00 0.00 0.00 0.00 61.98 63.46 1b76 s VAL 456 Cb -0.21 -3.84 0.02 0.00 0.00 0.00 0.00 36.38 32.36 1b76 s VAL 456 CO -0.09 0.29 -0.06 0.28 0.00 0.00 0.00 175.10 175.52 1b76 s THR 457 N -1.22 0.70 0.20 3.92 -1.32 0.51 -1.11 115.64 117.33 1b76 s THR 457 Ca 0.47 -0.18 -0.05 0.00 -1.21 0.00 0.00 61.69 60.72 1b76 s THR 457 Cb -0.32 -0.72 -0.06 0.00 -1.51 0.00 0.00 72.50 69.89 1b76 s THR 457 CO 0.41 0.28 0.45 0.68 -2.21 0.00 0.00 174.62 174.23 1b76 s VAL 458 N 1.15 5.10 0.13 5.08 -7.23 -0.72 -2.09 120.40 121.82 1b76 s VAL 458 Ca -0.07 0.08 -0.26 0.00 -1.81 0.00 0.00 61.98 59.92 1b76 s VAL 458 Cb -0.14 -3.66 0.07 0.00 0.56 0.00 0.00 36.38 33.22 1b76 s VAL 458 CO -0.01 -0.08 1.02 1.51 -0.31 0.00 0.00 175.10 177.23 1b76 s ASP 459 N -2.65 -0.15 0.12 4.85 -4.77 -1.26 0.49 116.67 113.30 1b76 s ASP 459 Ca 0.43 -0.37 -0.03 0.00 -3.30 0.00 0.00 52.55 49.27 1b76 s ASP 459 Cb -0.11 0.44 0.19 0.00 -1.09 0.00 0.00 42.92 42.34 1b76 s ASP 459 CO 0.25 -0.81 0.65 -1.22 0.70 0.00 0.00 175.17 174.74 1b76 n TYR 460 N -0.48 0.15 0.09 2.11 4.01 -1.26 0.16 117.16 121.93 1b76 n TYR 460 Ca -0.06 0.51 -0.13 0.00 -0.16 0.00 0.00 57.90 58.06 1b76 n TYR 460 Cb 0.61 -0.74 -0.07 0.00 -0.31 0.00 0.00 39.34 38.83 1b76 n TYR 460 CO 0.00 0.00 0.00 0.38 -0.46 0.00 0.00 176.86 176.78 1b76 h ASP 461 N 0.00 -0.13 -0.65 7.72 3.04 -1.87 0.54 116.42 125.07 1b76 h ASP 461 Ca 0.20 0.01 0.14 0.00 -3.24 0.00 0.00 57.03 54.13 1b76 h ASP 461 Cb 0.30 0.04 -0.11 0.00 -1.04 0.00 0.00 39.33 38.52 1b76 h ASP 461 CO -0.43 -0.09 -0.03 0.74 -2.04 0.00 0.00 179.24 177.39 1b76 h THR 462 N -0.14 0.43 -0.07 1.15 2.02 0.14 0.51 112.91 116.95 1b76 h THR 462 Ca -0.01 -0.03 -0.00 0.00 0.77 0.00 0.00 66.41 67.14 1b76 h THR 462 Cb 0.11 0.34 -0.00 0.00 -1.74 0.00 0.00 68.15 66.86 1b76 h THR 462 CO 0.01 0.02 0.04 0.40 0.37 0.00 0.00 175.52 176.36 1b76 h ILE 463 N 0.09 1.05 0.00 3.11 2.04 -1.09 0.26 117.51 122.97 1b76 h ILE 463 Ca 0.34 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 66.05 1b76 h ILE 463 Cb 0.55 1.03 0.00 0.00 -0.74 0.00 0.00 36.82 37.66 1b76 h ILE 463 CO -0.59 0.05 0.00 0.61 0.00 0.00 0.00 178.15 178.22 1b76 n GLY 464 N -0.98 1.22 2.27 5.37 0.00 0.18 -4.76 105.19 108.49 1b76 n GLY 464 Ca -0.06 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.84 1b76 n GLY 464 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1b76 n GLN 465 N 0.00 1.55 -1.24 1.61 6.02 0.94 -4.53 117.38 121.74 1b76 n GLN 465 Ca 0.00 -0.88 -0.32 0.00 -0.01 0.00 0.00 57.00 55.80 1b76 n GLN 465 Cb 0.00 -1.99 0.10 0.00 1.02 0.00 0.00 30.24 29.37 1b76 n GLN 465 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 1b76 s SER 466 N 2.56 4.16 0.01 1.08 0.01 -1.25 -4.42 113.70 115.85 1b76 s SER 466 Ca 0.43 2.04 -0.12 0.00 1.31 0.00 0.00 55.95 59.61 1b76 s SER 466 Cb 0.18 -2.55 -0.07 0.00 0.21 0.00 0.00 66.02 63.79 1b76 s SER 466 CO -0.01 -2.27 0.96 0.50 0.41 0.00 0.00 173.24 172.83 1b76 h LYS 467 N -0.95 -0.43 -0.00 12.44 3.64 -1.92 -3.26 116.57 126.08 1b76 h LYS 467 Ca -0.45 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.96 1b76 h LYS 467 Cb 1.25 0.10 0.00 0.00 -0.41 0.00 0.00 32.23 33.17 1b76 h LYS 467 CO 0.49 -0.29 0.00 -0.40 -2.27 0.00 0.00 179.45 176.98 1b76 n ASP 468 N -3.47 0.00 -3.29 4.20 5.68 -1.26 -4.67 116.55 113.75 1b76 n ASP 468 Ca -0.06 -0.01 -0.23 0.00 -0.50 0.00 0.00 54.79 54.00 1b76 n ASP 468 Cb 0.18 -0.00 0.06 0.00 -1.14 0.00 0.00 41.12 40.21 1b76 n ASP 468 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1b76 n GLY 469 N 0.39 -0.54 3.06 6.12 0.00 -1.23 -4.98 105.19 108.02 1b76 n GLY 469 Ca 0.00 0.19 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 1b76 n GLY 469 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1b76 s THR 470 N -3.25 1.71 -0.96 2.61 2.01 -1.26 -5.02 115.64 111.48 1b76 s THR 470 Ca 0.44 -0.74 -0.00 0.00 0.31 0.00 0.00 61.69 61.70 1b76 s THR 470 Cb -0.19 -1.57 0.32 0.00 0.01 0.00 0.00 72.50 71.06 1b76 s THR 470 CO 0.54 0.48 1.61 0.41 -0.69 0.00 0.00 174.62 176.97 1b76 n THR 471 N 4.57 5.44 -0.09 -0.82 -1.04 -1.26 -4.25 114.28 116.83 1b76 n THR 471 Ca -0.18 -5.90 -0.16 0.00 -2.04 0.00 0.00 64.05 55.77 1b76 n THR 471 Cb 0.50 -1.63 -0.05 0.00 -1.82 0.00 0.00 70.33 67.33 1b76 n THR 471 CO 0.00 0.00 0.00 -1.14 -0.64 0.00 0.00 175.07 173.29 1b76 n ARG 472 N 0.15 0.47 0.00 -2.82 3.00 -1.26 -4.56 116.66 111.65 1b76 n ARG 472 Ca 0.41 0.20 0.00 0.00 -0.00 0.00 0.00 57.85 58.46 1b76 n ARG 472 Cb 0.30 -1.31 0.00 0.00 0.00 0.00 0.00 32.46 31.45 1b76 n ARG 472 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 1b76 n LEU 473 N -4.19 0.00 -4.69 6.15 4.77 -1.26 -4.76 117.00 113.02 1b76 n LEU 473 Ca -0.28 0.00 -0.44 0.00 -0.03 0.00 0.00 56.01 55.26 1b76 n LEU 473 Cb 0.62 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.69 1b76 n LEU 473 CO 0.11 0.00 1.08 1.17 -1.33 0.00 0.00 177.39 178.42 1b76 n LYS 474 N -0.95 2.21 -2.06 3.23 4.81 -1.12 -2.01 118.16 122.27 1b76 n LYS 474 Ca 0.00 0.79 -0.11 0.00 -0.87 0.00 0.00 58.31 58.12 1b76 n LYS 474 Cb 0.00 -2.48 -0.01 0.00 0.02 0.00 0.00 35.03 32.56 1b76 n LYS 474 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1b76 n ASP 475 N 2.24 -3.75 -4.10 3.14 8.00 0.90 -4.93 116.55 118.05 1b76 n ASP 475 Ca 0.11 0.04 -0.25 0.00 0.71 0.00 0.00 54.79 55.40 1b76 n ASP 475 Cb 0.33 -2.86 -0.16 0.00 -0.02 0.00 0.00 41.12 38.41 1b76 n ASP 475 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1b76 s THR 476 N -2.53 1.31 0.47 -3.53 2.01 -0.85 -2.15 115.64 110.36 1b76 s THR 476 Ca 0.00 -0.64 0.02 0.00 0.31 0.00 0.00 61.69 61.38 1b76 s THR 476 Cb 0.00 -1.13 -0.01 0.00 0.01 0.00 0.00 72.50 71.36 1b76 s THR 476 CO 0.00 0.38 0.07 0.68 -0.69 0.00 0.00 174.62 175.06 1b76 s VAL 477 N 0.13 0.83 -0.25 3.82 -7.23 0.37 -4.00 120.40 114.06 1b76 s VAL 477 Ca -0.05 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.15 1b76 s VAL 477 Cb -0.12 -2.19 0.06 0.00 0.56 0.00 0.00 36.38 34.69 1b76 s VAL 477 CO 0.02 0.00 -0.12 0.28 -0.31 0.00 0.00 175.10 174.98 1b76 s THR 478 N -3.03 2.11 -0.35 5.32 -1.32 -0.89 0.25 115.64 117.74 1b76 s THR 478 Ca 0.12 -1.53 -0.18 0.00 -1.21 0.00 0.00 61.69 58.89 1b76 s THR 478 Cb 0.01 -2.20 -0.00 0.00 -1.51 0.00 0.00 72.50 68.80 1b76 s THR 478 CO 0.08 0.03 0.52 0.68 -2.21 0.00 0.00 174.62 173.72 1b76 s VAL 479 N 1.14 5.01 -0.43 5.08 -7.23 -0.49 -0.36 120.40 123.11 1b76 s VAL 479 Ca -0.07 0.38 -0.13 0.00 -1.81 0.00 0.00 61.98 60.35 1b76 s VAL 479 Cb -0.19 -3.97 0.06 0.00 0.56 0.00 0.00 36.38 32.84 1b76 s VAL 479 CO -0.06 -0.21 0.31 -0.60 -0.31 0.00 0.00 175.10 174.23 1b76 s ARG 480 N 2.42 2.85 0.08 4.82 3.52 -1.07 -2.26 118.95 129.32 1b76 s ARG 480 Ca 0.19 -1.27 -0.31 0.00 -0.13 0.00 0.00 55.73 54.21 1b76 s ARG 480 Cb -0.15 -3.94 -0.10 0.00 -1.56 0.00 0.00 34.95 29.19 1b76 s ARG 480 CO 0.13 -0.90 1.90 -3.47 -0.81 0.00 0.00 175.30 172.15 1b76 n ASP 481 N 5.09 4.08 -0.07 -2.12 -0.08 0.22 -3.70 116.55 119.96 1b76 n ASP 481 Ca -0.11 0.95 -0.13 0.00 -1.51 0.00 0.00 54.79 53.99 1b76 n ASP 481 Cb 0.44 -1.53 -0.07 0.00 2.34 0.00 0.00 41.12 42.30 1b76 n ASP 481 CO 0.00 0.00 0.00 -0.09 0.12 0.00 0.00 177.20 177.23 1b76 h ARG 482 N 9.45 -0.43 0.00 -0.67 2.43 -1.73 0.48 114.38 123.91 1b76 h ARG 482 Ca -0.48 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.72 1b76 h ARG 482 Cb 1.23 0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.88 1b76 h ARG 482 CO 0.94 -0.29 0.00 -0.25 -1.51 0.00 0.00 179.97 178.87 1b76 n ASP 483 N -5.42 0.00 0.25 -3.80 8.00 -1.26 -3.74 116.55 110.58 1b76 n ASP 483 Ca -0.03 0.74 0.17 0.00 0.71 0.00 0.00 54.79 56.38 1b76 n ASP 483 Cb 0.36 -0.34 0.89 0.00 -0.02 0.00 0.00 41.12 42.02 1b76 n ASP 483 CO 0.00 0.00 0.00 0.71 -0.39 0.00 0.00 177.20 177.52 1b76 h THR 484 N 0.00 0.00 0.00 -3.53 1.35 -1.98 -3.45 112.91 105.30 1b76 h THR 484 Ca 0.00 -0.04 0.00 0.00 -0.55 0.00 0.00 66.41 65.82 1b76 h THR 484 Cb 0.00 0.80 0.00 0.00 -1.73 0.00 0.00 68.15 67.22 1b76 h THR 484 CO 0.00 0.00 0.00 0.23 -0.25 0.00 0.00 175.52 175.50 1b76 n MET 485 N -2.69 -0.37 -2.22 4.72 2.81 0.17 -4.94 117.12 114.60 1b76 n MET 485 Ca -0.02 0.09 -0.40 0.00 -1.81 0.00 0.00 57.70 55.57 1b76 n MET 485 Cb 0.07 -3.88 -0.02 0.00 -0.71 0.00 0.00 33.22 28.68 1b76 n MET 485 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 1b76 s GLU 486 N -0.80 4.21 -0.36 0.03 2.12 -1.25 -4.71 118.70 117.95 1b76 s GLU 486 Ca 0.00 2.02 0.01 0.00 0.36 0.00 0.00 54.97 57.35 1b76 s GLU 486 Cb 0.00 -2.89 0.10 0.00 0.26 0.00 0.00 34.13 31.60 1b76 s GLU 486 CO 0.00 -0.24 0.10 -1.14 -0.54 0.00 0.00 175.26 173.45 1b76 s GLN 487 N -2.01 1.79 -0.20 4.30 0.74 -1.26 -0.61 119.66 122.41 1b76 s GLN 487 Ca 0.53 -1.79 -0.08 0.00 0.05 0.00 0.00 55.36 54.06 1b76 s GLN 487 Cb -0.35 -3.35 -0.04 0.00 1.10 0.00 0.00 33.01 30.37 1b76 s GLN 487 CO 0.45 -0.96 0.09 0.96 -0.55 0.00 0.00 175.29 175.29 1b76 s ILE 488 N 1.03 4.88 -0.29 -2.34 -4.36 -0.96 -4.93 121.20 114.23 1b76 s ILE 488 Ca 0.08 0.00 -0.21 0.00 -0.26 0.00 0.00 60.65 60.26 1b76 s ILE 488 Cb -0.21 -3.23 -0.01 0.00 1.25 0.00 0.00 42.46 40.27 1b76 s ILE 488 CO -0.06 0.42 0.67 -0.60 0.24 0.00 0.00 174.94 175.61 1b76 s ARG 489 N 0.69 3.99 0.10 0.37 3.52 -1.26 -1.40 118.95 124.97 1b76 s ARG 489 Ca 0.05 0.47 0.02 0.00 -0.13 0.00 0.00 55.73 56.14 1b76 s ARG 489 Cb -0.13 -3.70 -0.04 0.00 -1.56 0.00 0.00 34.95 29.52 1b76 s ARG 489 CO 0.02 -0.54 -0.07 -0.48 -0.81 0.00 0.00 175.30 173.42 1b76 s LEU 490 N 2.66 2.51 0.35 -0.88 0.05 0.14 -4.93 118.68 118.58 1b76 s LEU 490 Ca 0.27 -1.00 -0.25 0.00 0.05 0.00 0.00 54.13 53.20 1b76 s LEU 490 Cb -0.15 -0.11 -0.09 0.00 -2.05 0.00 0.00 46.19 43.78 1b76 s LEU 490 CO 0.11 -0.44 1.01 -2.28 -0.55 0.00 0.00 176.35 174.19 1b76 s HIS 491 N -3.54 3.49 0.19 3.48 5.65 -1.26 -0.48 115.29 122.83 1b76 s HIS 491 Ca 0.12 1.71 -0.21 0.00 0.25 0.00 0.00 55.06 56.94 1b76 s HIS 491 Cb 0.05 -3.05 0.14 0.00 -1.18 0.00 0.00 32.58 28.53 1b76 s HIS 491 CO -0.04 -0.24 1.57 0.28 -0.65 0.00 0.00 174.74 175.67 1b76 h VAL 492 N 2.47 0.11 -0.87 0.89 2.07 -1.81 0.57 116.25 119.68 1b76 h VAL 492 Ca -0.47 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.19 1b76 h VAL 492 Cb 1.20 0.11 -0.07 0.00 -1.52 0.00 0.00 31.29 31.02 1b76 h VAL 492 CO 0.64 0.00 0.56 0.44 0.02 0.00 0.00 177.57 179.23 1b76 h ASP 493 N -0.13 0.61 -0.17 0.57 3.32 -1.93 0.23 116.42 118.93 1b76 h ASP 493 Ca 0.25 0.04 -0.11 0.00 0.02 0.00 0.00 57.03 57.23 1b76 h ASP 493 Cb 0.56 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.03 1b76 h ASP 493 CO -0.77 0.31 -0.32 -0.33 -1.72 0.00 0.00 179.24 176.41 1b76 h GLU 494 N 0.65 0.52 -1.10 3.56 5.08 -0.33 -3.15 114.58 119.80 1b76 h GLU 494 Ca 0.43 -0.33 0.30 0.00 -1.00 0.00 0.00 59.36 58.77 1b76 h GLU 494 Cb 0.74 0.04 -0.09 0.00 0.50 0.00 0.00 28.75 29.94 1b76 h GLU 494 CO -0.19 0.94 0.72 1.25 -1.00 0.00 0.00 179.01 180.73 1b76 h LEU 495 N 0.16 0.36 -0.46 1.33 5.85 0.95 0.47 115.31 123.96 1b76 h LEU 495 Ca 0.01 0.08 -0.03 0.00 0.84 0.00 0.00 57.88 58.78 1b76 h LEU 495 Cb 0.92 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.96 1b76 h LEU 495 CO 0.07 0.03 0.16 -0.08 -0.34 0.00 0.00 178.44 178.28 1b76 h GLU 496 N 0.29 0.70 -0.26 1.25 4.22 -1.39 -2.62 114.58 116.77 1b76 h GLU 496 Ca 0.63 -0.14 -0.07 0.00 0.08 0.00 0.00 59.36 59.86 1b76 h GLU 496 Cb 1.78 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.91 1b76 h GLU 496 CO -0.28 0.66 -0.12 0.78 -2.18 0.00 0.00 179.01 177.87 1b76 h GLY 497 N 0.60 0.59 -0.24 1.92 0.00 -0.21 -2.24 103.07 103.48 1b76 h GLY 497 Ca 0.15 -0.52 0.06 0.00 0.00 0.00 0.00 47.33 47.02 1b76 h GLY 497 CO -0.01 0.47 -0.43 -2.75 0.00 0.00 0.00 176.54 173.82 1b76 h PHE 498 N 0.28 -1.26 -0.51 5.60 3.04 -1.06 -0.67 116.94 122.35 1b76 h PHE 498 Ca 0.06 0.07 0.00 0.00 3.98 0.00 0.00 57.97 62.08 1b76 h PHE 498 Cb 0.62 0.60 -0.03 0.00 2.56 0.00 0.00 35.95 39.71 1b76 h PHE 498 CO 0.06 -0.45 0.33 -0.07 -2.02 0.00 0.00 178.31 176.16 1b76 h LEU 499 N -0.36 0.59 -1.13 0.59 3.38 -1.51 -1.88 115.31 114.99 1b76 h LEU 499 Ca 0.12 -0.03 0.30 0.00 0.09 0.00 0.00 57.88 58.37 1b76 h LEU 499 Cb 0.59 -0.15 -0.13 0.00 0.09 0.00 0.00 40.66 41.07 1b76 h LEU 499 CO -0.54 0.44 0.63 0.03 0.09 0.00 0.00 178.44 179.10 1b76 h ARG 500 N 0.69 0.37 0.23 1.13 2.47 -0.52 -0.30 114.38 118.45 1b76 h ARG 500 Ca 0.19 -0.02 -0.31 0.00 -1.26 0.00 0.00 59.98 58.57 1b76 h ARG 500 Cb -0.06 -0.08 0.03 0.00 -1.65 0.00 0.00 29.97 28.21 1b76 h ARG 500 CO -0.04 0.24 -1.38 1.49 0.56 0.00 0.00 179.97 180.85 1b76 h GLU 501 N 0.38 0.48 0.07 0.04 4.81 -0.51 -3.29 114.58 116.57 1b76 h GLU 501 Ca 0.69 -0.82 -0.00 0.00 -0.13 0.00 0.00 59.36 59.10 1b76 h GLU 501 Cb 1.63 0.30 0.00 0.00 0.63 0.00 0.00 28.75 31.31 1b76 h GLU 501 CO -0.48 1.39 -0.04 0.00 -0.73 0.00 0.00 179.01 179.15 1b76 h ARG 502 N 0.03 -0.10 0.00 1.92 -0.00 -0.89 -3.37 114.38 111.98 1b76 h ARG 502 Ca -0.25 0.01 0.00 0.00 -0.50 0.00 0.00 59.98 59.24 1b76 h ARG 502 Cb 2.05 0.02 0.00 0.00 0.00 0.00 0.00 29.97 32.05 1b76 h ARG 502 CO 0.24 0.42 0.00 1.28 0.00 0.00 0.00 179.97 181.91 1b76 n LEU 503 N -4.80 0.00 -4.74 3.04 4.77 -0.21 -4.83 117.00 110.22 1b76 n LEU 503 Ca -0.07 0.30 -0.41 0.00 -0.03 0.00 0.00 56.01 55.80 1b76 n LEU 503 Cb 0.27 -0.30 -0.05 0.00 -2.33 0.00 0.00 43.42 41.02 1b76 n LEU 503 CO 0.23 -0.08 0.74 0.00 -1.33 0.00 0.00 177.39 176.95 1b76 s ARG 504 N -2.59 4.68 0.00 3.23 1.70 -1.24 -4.64 118.95 120.09 1b76 s ARG 504 Ca 0.20 1.65 0.00 0.00 -0.47 0.00 0.00 55.73 57.11 1b76 s ARG 504 Cb 0.15 -3.27 0.00 0.00 -0.57 0.00 0.00 34.95 31.25 1b76 s ARG 504 CO 0.34 0.23 0.46 0.91 -1.08 0.00 0.00 175.30 176.15