#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 2.88 0.03 0.00 0.00 -1.12 -4.47 121.76 119.08 1b76 s ALA 2 Ca 0.00 -1.64 -0.11 0.00 0.00 0.00 0.00 51.96 50.22 1b76 s ALA 2 Cb 0.00 -1.99 -0.05 0.00 0.00 0.00 0.00 23.12 21.08 1b76 s ALA 2 CO 0.00 -1.12 1.16 1.03 0.00 0.00 0.00 175.76 176.83 1b76 h SER 3 N 8.09 -0.44 -3.08 0.00 0.87 -1.92 -3.41 113.55 113.66 1b76 h SER 3 Ca -0.26 0.04 -0.64 0.00 -1.23 0.00 0.00 61.79 59.70 1b76 h SER 3 Cb 1.09 0.15 -0.12 0.00 -0.44 0.00 0.00 62.40 63.08 1b76 h SER 3 CO 0.57 -0.19 -0.53 -0.94 -0.53 0.00 0.00 176.83 175.21 1b76 s SER 4 N -2.97 5.91 0.29 6.23 1.04 -1.26 -4.64 113.70 118.30 1b76 s SER 4 Ca -0.05 0.24 0.03 0.00 0.48 0.00 0.00 55.95 56.66 1b76 s SER 4 Cb 0.01 -1.94 0.64 0.00 0.10 0.00 0.00 66.02 64.84 1b76 s SER 4 CO 0.18 0.29 1.81 0.25 0.98 0.00 0.00 173.24 176.75 1b76 h LEU 5 N 5.88 0.87 -1.06 2.42 5.85 -1.90 0.67 115.31 128.03 1b76 h LEU 5 Ca -0.46 0.07 0.21 0.00 0.84 0.00 0.00 57.88 58.54 1b76 h LEU 5 Cb 1.19 -0.10 -0.11 0.00 0.37 0.00 0.00 40.66 42.01 1b76 h LEU 5 CO 0.65 0.40 0.61 0.44 -0.34 0.00 0.00 178.44 180.20 1b76 h ASP 6 N 0.90 0.71 0.48 1.25 3.32 -1.98 0.36 116.42 121.45 1b76 h ASP 6 Ca 0.53 0.11 -0.01 0.00 0.02 0.00 0.00 57.03 57.67 1b76 h ASP 6 Cb 0.66 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.18 1b76 h ASP 6 CO -0.31 0.20 -0.38 -0.33 -1.72 0.00 0.00 179.24 176.71 1b76 h GLU 7 N 0.66 -0.81 -0.54 3.56 5.08 -0.06 0.75 114.58 123.22 1b76 h GLU 7 Ca 0.60 0.06 0.10 0.00 -1.00 0.00 0.00 59.36 59.11 1b76 h GLU 7 Cb 1.07 0.18 -0.08 0.00 0.50 0.00 0.00 28.75 30.42 1b76 h GLU 7 CO -0.39 -0.54 0.08 -0.07 -1.00 0.00 0.00 179.01 177.09 1b76 h LEU 8 N -0.84 -0.06 -0.80 1.33 3.38 -0.60 -1.60 115.31 116.12 1b76 h LEU 8 Ca -0.05 0.11 0.06 0.00 0.09 0.00 0.00 57.88 58.09 1b76 h LEU 8 Cb 0.72 0.16 -0.06 0.00 0.09 0.00 0.00 40.66 41.58 1b76 h LEU 8 CO -0.00 -0.01 0.48 0.58 0.09 0.00 0.00 178.44 179.58 1b76 h VAL 9 N 0.21 1.02 0.37 1.22 2.07 0.03 -0.36 116.25 120.81 1b76 h VAL 9 Ca 0.28 -0.30 -0.02 0.00 0.82 0.00 0.00 66.70 67.48 1b76 h VAL 9 Cb 0.40 0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.24 1b76 h VAL 9 CO -0.39 0.16 -0.18 0.00 0.02 0.00 0.00 177.57 177.19 1b76 h ALA 10 N 1.38 -0.50 -0.96 1.67 0.00 0.04 -3.01 119.26 117.88 1b76 h ALA 10 Ca 0.35 -0.18 0.13 0.00 0.00 0.00 0.00 54.91 55.20 1b76 h ALA 10 Cb 0.17 0.19 -0.09 0.00 0.00 0.00 0.00 17.79 18.06 1b76 h ALA 10 CO -0.17 -0.62 0.59 1.25 0.00 0.00 0.00 179.25 180.30 1b76 h LEU 11 N -0.82 0.84 -1.67 0.00 6.46 -1.24 0.36 115.31 119.24 1b76 h LEU 11 Ca -0.05 0.06 0.06 0.00 -0.12 0.00 0.00 57.88 57.83 1b76 h LEU 11 Cb 0.53 -0.11 -0.03 0.00 -0.73 0.00 0.00 40.66 40.33 1b76 h LEU 11 CO 0.08 0.43 0.33 0.00 -0.62 0.00 0.00 178.44 178.66 1b76 n LYS 13 N -4.47 0.67 0.18 0.00 4.81 -0.53 0.40 118.16 119.23 1b76 n LYS 13 Ca 0.07 0.04 0.14 0.00 -0.87 0.00 0.00 58.31 57.68 1b76 n LYS 13 Cb 0.26 -1.59 0.52 0.00 0.02 0.00 0.00 35.03 34.24 1b76 n LYS 13 CO 0.00 0.00 0.00 -0.09 1.17 0.00 0.00 177.40 178.48 1b76 h ARG 14 N 0.00 0.00 0.00 1.64 2.43 0.03 -3.16 114.38 115.32 1b76 h ARG 14 Ca -0.40 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.77 1b76 h ARG 14 Cb 1.99 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.54 1b76 h ARG 14 CO 0.04 0.00 0.00 0.54 -1.51 0.00 0.00 179.97 179.04 1b76 n ARG 15 N -2.57 0.64 -2.56 0.20 5.12 -0.42 -5.03 116.66 112.04 1b76 n ARG 15 Ca 0.02 -0.36 -0.03 0.00 -1.93 0.00 0.00 57.85 55.56 1b76 n ARG 15 Cb 0.30 -0.85 0.01 0.00 -1.16 0.00 0.00 32.46 30.76 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 0.19 0.72 0.02 -0.13 0.00 -1.17 -4.57 105.19 100.25 1b76 n GLY 16 Ca 0.00 -0.55 -0.02 0.00 0.00 0.00 0.00 46.02 45.46 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 -2.59 0.27 -5.07 1.61 3.01 0.16 -1.27 117.46 113.58 1b76 n PHE 17 Ca -0.00 0.12 -0.29 0.00 1.01 0.00 0.00 57.45 58.29 1b76 n PHE 17 Cb 0.51 -0.39 -0.16 0.00 -0.01 0.00 0.00 39.48 39.43 1b76 n PHE 17 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 1b76 s ILE 18 N -1.41 1.75 0.15 4.37 1.09 -0.11 0.76 121.20 127.81 1b76 s ILE 18 Ca -0.05 -0.92 0.11 0.00 -1.10 0.00 0.00 60.65 58.69 1b76 s ILE 18 Cb 0.01 -1.48 -0.04 0.00 -1.06 0.00 0.00 42.46 39.89 1b76 s ILE 18 CO 0.07 0.49 -0.25 -0.36 -0.10 0.00 0.00 174.94 174.80 1b76 s PHE 19 N -0.23 2.24 -0.51 3.97 0.08 0.16 -3.48 117.98 120.21 1b76 s PHE 19 Ca 0.01 -0.38 -0.27 0.00 0.12 0.00 0.00 56.93 56.40 1b76 s PHE 19 Cb -0.11 -1.17 -0.01 0.00 -0.57 0.00 0.00 43.02 41.16 1b76 s PHE 19 CO 0.02 0.39 1.74 -1.14 -0.10 0.00 0.00 175.22 176.12 1b76 s GLN 20 N -2.31 3.01 0.32 0.44 -0.44 -1.26 -0.35 119.66 119.06 1b76 s GLN 20 Ca 0.16 0.84 -0.27 0.00 -2.50 0.00 0.00 55.36 53.59 1b76 s GLN 20 Cb -0.09 -4.27 -0.13 0.00 -1.64 0.00 0.00 33.01 26.88 1b76 s GLN 20 CO 0.07 -2.27 0.93 0.45 0.50 0.00 0.00 175.29 174.97 1b76 n SER 21 N 11.25 0.89 -3.18 6.67 2.88 -1.24 -1.99 113.62 128.91 1b76 n SER 21 Ca 0.19 1.12 -0.21 0.00 -1.33 0.00 0.00 58.87 58.64 1b76 n SER 21 Cb 0.50 -1.26 0.00 0.00 -0.75 0.00 0.00 64.21 62.70 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 1.16 -4.09 -0.34 -3.46 7.64 -1.26 -3.40 113.62 109.87 1b76 n SER 22 Ca 0.10 -0.29 0.02 0.00 1.01 0.00 0.00 58.87 59.71 1b76 n SER 22 Cb 0.34 -3.38 0.19 0.00 -1.01 0.00 0.00 64.21 60.34 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 -0.89 1.13 -0.60 1.43 4.81 -1.64 -2.60 114.58 116.23 1b76 h GLU 23 Ca -0.42 -0.07 0.09 0.00 -0.13 0.00 0.00 59.36 58.83 1b76 h GLU 23 Cb 1.29 -0.26 -0.07 0.00 0.63 0.00 0.00 28.75 30.34 1b76 h GLU 23 CO 0.51 0.75 0.21 -0.84 -0.73 0.00 0.00 179.01 178.91 1b76 h ILE 24 N 1.17 0.76 -0.76 2.32 3.07 -1.89 -1.22 117.51 120.96 1b76 h ILE 24 Ca 0.39 -0.13 -0.45 0.00 1.55 0.00 0.00 64.86 66.22 1b76 h ILE 24 Cb 0.08 0.34 -0.19 0.00 -0.27 0.00 0.00 36.82 36.78 1b76 h ILE 24 CO -0.13 0.07 0.55 -1.22 -1.05 0.00 0.00 178.15 176.36 1b76 n TYR 25 N -5.02 2.01 0.00 0.16 4.02 -0.99 -4.89 117.16 112.44 1b76 n TYR 25 Ca 0.08 -2.23 0.00 0.00 -0.01 0.00 0.00 57.90 55.74 1b76 n TYR 25 Cb 0.27 -1.15 0.00 0.00 -0.02 0.00 0.00 39.34 38.44 1b76 n TYR 25 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1b76 n GLY 26 N 0.10 1.99 0.00 2.72 0.00 -0.46 -4.91 105.19 104.63 1b76 n GLY 26 Ca 0.42 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.93 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 4.69 3.53 -0.02 0.00 -1.12 -4.55 105.19 107.72 1b76 n GLY 27 Ca 0.00 -1.03 -0.41 0.00 0.00 0.00 0.00 46.02 44.58 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 4.56 0.45 0.99 2.96 -1.22 -5.01 118.68 121.41 1b76 s LEU 28 Ca 0.00 -0.39 -0.25 0.00 -0.22 0.00 0.00 54.13 53.27 1b76 s LEU 28 Cb 0.00 -2.26 -0.08 0.00 0.50 0.00 0.00 46.19 44.36 1b76 s LEU 28 CO 0.00 -0.33 1.34 -1.58 -1.32 0.00 0.00 176.35 174.46 1b76 s GLN 29 N 1.89 3.70 -0.67 1.98 0.74 -1.26 -3.18 119.66 122.86 1b76 s GLN 29 Ca 0.09 2.22 0.00 0.00 0.05 0.00 0.00 55.36 57.72 1b76 s GLN 29 Cb -0.17 -2.59 0.00 0.00 1.10 0.00 0.00 33.01 31.35 1b76 s GLN 29 CO 0.11 -0.74 0.00 0.41 -0.55 0.00 0.00 175.29 174.52 1b76 n GLY 30 N 0.63 0.83 2.93 2.59 0.00 -1.26 -4.77 105.19 106.13 1b76 n GLY 30 Ca 0.06 -0.37 -0.21 0.00 0.00 0.00 0.00 46.02 45.51 1b76 n GLY 30 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b76 s VAL 31 N -2.06 0.67 0.34 1.61 0.11 -1.19 0.91 120.40 120.79 1b76 s VAL 31 Ca 0.00 -0.22 0.06 0.00 -2.93 0.00 0.00 61.98 58.89 1b76 s VAL 31 Cb 0.00 -0.65 -0.07 0.00 -1.53 0.00 0.00 36.38 34.13 1b76 s VAL 31 CO 0.00 0.25 -0.01 -0.31 -3.33 0.00 0.00 175.10 171.70 1b76 s TYR 32 N 0.72 2.19 -0.10 1.54 1.51 -1.26 -3.61 117.35 118.33 1b76 s TYR 32 Ca -0.11 -0.74 0.03 0.00 -1.01 0.00 0.00 57.07 55.24 1b76 s TYR 32 Cb -0.14 -1.40 0.01 0.00 -0.11 0.00 0.00 41.96 40.32 1b76 s TYR 32 CO 0.01 0.29 -0.20 -0.51 -1.11 0.00 0.00 175.55 174.02 1b76 s ASP 33 N -3.56 2.77 -0.43 2.29 1.01 0.53 -4.67 116.67 114.61 1b76 s ASP 33 Ca 0.34 -0.50 -0.24 0.00 0.71 0.00 0.00 52.55 52.86 1b76 s ASP 33 Cb 0.07 -1.27 0.02 0.00 1.01 0.00 0.00 42.92 42.76 1b76 s ASP 33 CO 0.15 0.10 0.81 -0.31 0.21 0.00 0.00 175.17 176.14 1b76 s TYR 34 N 0.58 3.01 1.12 4.23 1.51 -1.26 0.40 117.35 126.93 1b76 s TYR 34 Ca -0.14 0.30 -0.19 0.00 -1.01 0.00 0.00 57.07 56.03 1b76 s TYR 34 Cb -0.17 -3.65 0.27 0.00 -0.11 0.00 0.00 41.96 38.30 1b76 s TYR 34 CO 0.05 -0.95 1.19 0.41 -1.11 0.00 0.00 175.55 175.14 1b76 n GLY 35 N 4.86 -2.25 0.26 0.71 0.00 0.23 -4.34 105.19 104.66 1b76 n GLY 35 Ca 0.03 -1.58 -0.06 0.00 0.00 0.00 0.00 46.02 44.41 1b76 n GLY 35 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1b76 n PRO 36 N -4.41 -0.25 0.08 1.61 -0.02 -1.02 -0.03 135.00 130.96 1b76 n PRO 36 Ca 0.16 0.94 -0.08 0.00 -2.02 0.00 0.00 63.50 62.50 1b76 n PRO 36 Cb 0.58 -1.39 0.04 0.00 -0.02 0.00 0.00 33.50 32.72 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 0.32 -0.01 2.45 3.38 -1.43 -3.15 115.31 116.87 1b76 h LEU 37 Ca 0.12 -0.22 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 1b76 h LEU 37 Cb 0.28 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 1b76 h LEU 37 CO -0.59 0.96 0.01 1.23 0.09 0.00 0.00 178.44 180.13 1b76 h GLY 38 N 1.58 0.02 0.35 0.83 0.00 -0.40 -1.74 103.07 103.71 1b76 h GLY 38 Ca -0.03 -0.01 0.06 0.00 0.00 0.00 0.00 47.33 47.36 1b76 h GLY 38 CO 0.12 0.01 -0.10 -2.08 0.00 0.00 0.00 176.54 174.49 1b76 h VAL 39 N -0.06 0.65 0.45 4.60 2.07 -0.41 -1.41 116.25 122.14 1b76 h VAL 39 Ca 0.00 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 1b76 h VAL 39 Cb 0.08 0.65 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 1b76 h VAL 39 CO -0.00 0.00 -0.39 -0.33 0.02 0.00 0.00 177.57 176.87 1b76 h GLU 40 N -0.03 -0.81 -0.64 1.57 4.39 -1.49 -0.95 114.58 116.62 1b76 h GLU 40 Ca 0.15 0.05 0.12 0.00 0.34 0.00 0.00 59.36 60.03 1b76 h GLU 40 Cb 0.26 0.18 -0.12 0.00 -0.10 0.00 0.00 28.75 28.97 1b76 h GLU 40 CO -0.33 -0.54 -0.24 1.25 -1.16 0.00 0.00 179.01 177.99 1b76 h LEU 41 N -0.84 -0.86 -0.17 1.33 5.85 -1.01 0.22 115.31 119.83 1b76 h LEU 41 Ca -0.04 0.21 0.03 0.00 0.84 0.00 0.00 57.88 58.92 1b76 h LEU 41 Cb 0.73 0.49 -0.03 0.00 0.37 0.00 0.00 40.66 42.22 1b76 h LEU 41 CO -0.03 -0.26 -0.01 0.50 -0.34 0.00 0.00 178.44 178.30 1b76 h LYS 42 N -0.07 0.05 -0.30 1.25 3.64 -0.91 0.13 116.57 120.36 1b76 h LYS 42 Ca 0.29 -0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 59.56 1b76 h LYS 42 Cb 0.53 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.32 1b76 h LYS 42 CO -0.69 0.03 -0.27 -0.91 -2.27 0.00 0.00 179.45 175.34 1b76 h ASN 43 N 0.05 0.60 -0.72 4.20 -0.26 0.07 0.51 115.58 120.04 1b76 h ASN 43 Ca 0.08 -0.22 -0.03 0.00 -0.56 0.00 0.00 56.30 55.58 1b76 h ASN 43 Cb 0.10 -0.17 -0.03 0.00 -1.06 0.00 0.00 38.32 37.16 1b76 h ASN 43 CO -0.14 0.85 0.35 0.78 -1.06 0.00 0.00 177.43 178.21 1b76 h ASN 44 N 0.52 0.95 0.12 5.81 2.35 0.10 0.73 115.58 126.15 1b76 h ASN 44 Ca 0.07 -0.10 -0.01 0.00 -0.55 0.00 0.00 56.30 55.71 1b76 h ASN 44 Cb 0.73 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.86 1b76 h ASN 44 CO 0.06 0.80 -0.06 0.25 -1.65 0.00 0.00 177.43 176.83 1b76 h LEU 45 N 1.04 -0.14 -0.69 1.61 5.85 0.32 -2.27 115.31 121.04 1b76 h LEU 45 Ca 0.25 -0.38 0.11 0.00 0.84 0.00 0.00 57.88 58.70 1b76 h LEU 45 Cb 0.10 0.04 -0.08 0.00 0.37 0.00 0.00 40.66 41.09 1b76 h LEU 45 CO -0.03 0.35 0.29 0.11 -0.34 0.00 0.00 178.44 178.82 1b76 h LYS 46 N -0.68 0.46 -0.02 1.25 1.57 0.99 -1.36 116.57 118.78 1b76 h LYS 46 Ca -0.02 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1b76 h LYS 46 Cb 0.51 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.72 1b76 h LYS 46 CO 0.03 0.30 0.01 1.96 -0.57 0.00 0.00 179.45 181.18 1b76 h GLN 47 N 0.47 0.03 -1.00 3.15 4.20 0.42 -0.46 115.11 121.92 1b76 h GLN 47 Ca 0.36 -0.00 0.12 0.00 0.06 0.00 0.00 58.65 59.18 1b76 h GLN 47 Cb 0.47 -0.01 -0.08 0.00 0.30 0.00 0.00 27.48 28.16 1b76 h GLN 47 CO -0.33 0.08 0.63 0.00 -0.67 0.00 0.00 178.83 178.54 1b76 h ALA 48 N 0.95 1.52 -0.18 3.87 0.00 -0.71 0.73 119.26 125.44 1b76 h ALA 48 Ca 0.01 0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.80 1b76 h ALA 48 Cb 0.06 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1b76 h ALA 48 CO -0.00 0.24 -0.45 2.35 0.00 0.00 0.00 179.25 181.38 1b76 h TRP 49 N 1.01 0.53 -0.12 0.00 7.01 -0.96 -2.17 115.95 121.25 1b76 h TRP 49 Ca 0.49 -0.16 -0.22 0.00 2.11 0.00 0.00 58.89 61.11 1b76 h TRP 49 Cb 0.47 -0.11 0.01 0.00 -2.10 0.00 0.00 29.16 27.43 1b76 h TRP 49 CO -0.00 0.82 -0.80 2.35 -2.79 0.00 0.00 178.44 178.01 1b76 h TRP 50 N 0.35 1.03 0.16 2.65 2.91 0.13 -1.62 115.95 121.56 1b76 h TRP 50 Ca 0.02 -0.48 -0.01 0.00 1.13 0.00 0.00 58.89 59.56 1b76 h TRP 50 Cb 0.94 -0.15 0.00 0.00 -0.51 0.00 0.00 29.16 29.44 1b76 h TRP 50 CO 0.03 1.31 -0.08 -0.09 -1.03 0.00 0.00 178.44 178.58 1b76 h ARG 51 N 0.46 -0.20 -0.11 2.65 2.43 0.35 0.27 114.38 120.23 1b76 h ARG 51 Ca -0.07 0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 1b76 h ARG 51 Cb 1.44 0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 31.03 1b76 h ARG 51 CO 0.16 -0.12 0.05 -0.09 -1.51 0.00 0.00 179.97 178.46 1b76 h ARG 52 N -0.23 0.16 0.00 0.20 9.65 -1.46 0.36 114.38 123.06 1b76 h ARG 52 Ca -0.02 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.83 1b76 h ARG 52 Cb 0.18 -0.03 0.00 0.00 -1.39 0.00 0.00 29.97 28.73 1b76 h ARG 52 CO 0.04 0.25 -0.35 -0.91 2.80 0.00 0.00 179.97 181.80 1b76 h ASN 53 N 0.03 0.00 0.00 -3.80 2.35 -1.30 -3.26 115.58 109.60 1b76 h ASN 53 Ca 0.04 -0.12 -0.00 0.00 -0.55 0.00 0.00 56.30 55.67 1b76 h ASN 53 Cb 0.15 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.52 1b76 h ASN 53 CO -0.00 0.06 -0.21 0.52 -1.65 0.00 0.00 177.43 176.15 1b76 n VAL 54 N -2.20 1.09 -0.08 2.81 0.31 0.07 -4.50 118.33 115.83 1b76 n VAL 54 Ca 0.04 0.33 -0.11 0.00 -0.01 0.00 0.00 64.34 64.59 1b76 n VAL 54 Cb 0.44 -1.62 -0.04 0.00 -0.91 0.00 0.00 33.84 31.70 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 -0.06 0.45 -0.09 3.52 0.05 -1.32 -3.27 116.97 116.25 1b76 h TYR 55 Ca -0.01 -0.08 -0.21 0.00 0.05 0.00 0.00 58.73 58.49 1b76 h TYR 55 Cb 0.20 -0.12 0.00 0.00 1.01 0.00 0.00 36.73 37.83 1b76 h TYR 55 CO -0.02 0.59 -0.80 0.93 -1.05 0.00 0.00 178.16 177.80 1b76 h GLU 56 N 0.19 0.58 -7.20 4.88 5.08 -0.46 -3.45 114.58 114.20 1b76 h GLU 56 Ca 0.07 -0.50 -0.49 0.00 -1.00 0.00 0.00 59.36 57.43 1b76 h GLU 56 Cb 0.40 0.11 0.07 0.00 0.50 0.00 0.00 28.75 29.84 1b76 h GLU 56 CO 0.01 1.13 0.38 1.03 -1.00 0.00 0.00 179.01 180.56 1b76 s ARG 57 N -3.61 3.25 -0.10 2.33 0.52 -1.23 -4.97 118.95 115.14 1b76 s ARG 57 Ca -0.08 1.21 0.14 0.00 -0.52 0.00 0.00 55.73 56.48 1b76 s ARG 57 Cb 0.09 -2.02 0.39 0.00 0.52 0.00 0.00 34.95 33.93 1b76 s ARG 57 CO 0.88 -0.87 1.30 -0.25 0.02 0.00 0.00 175.30 176.38 1b76 n ASP 58 N -2.12 3.24 -0.11 0.23 8.00 -1.26 -4.60 116.55 119.93 1b76 n ASP 58 Ca 0.09 -2.62 0.01 0.00 0.71 0.00 0.00 54.79 52.98 1b76 n ASP 58 Cb 0.53 -0.39 0.01 0.00 -0.02 0.00 0.00 41.12 41.26 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 -0.30 0.68 -4.56 -2.24 5.75 -1.26 -5.08 116.55 109.54 1b76 n ASP 59 Ca 0.16 -1.64 -0.29 0.00 -0.01 0.00 0.00 54.79 53.01 1b76 n ASP 59 Cb 0.66 -0.09 -0.10 0.00 -1.03 0.00 0.00 41.12 40.57 1b76 n ASP 59 CO 0.00 0.00 0.00 -0.04 -0.11 0.00 0.00 177.20 177.05 1b76 s MET 60 N -0.51 2.06 -0.04 0.11 -1.94 -1.26 -1.48 119.30 116.24 1b76 s MET 60 Ca 0.03 -1.13 0.04 0.00 -1.71 0.00 0.00 55.69 52.92 1b76 s MET 60 Cb 0.03 -2.23 -0.00 0.00 2.01 0.00 0.00 34.83 34.64 1b76 s MET 60 CO 0.00 0.48 -0.17 -2.00 -0.01 0.00 0.00 175.02 173.32 1b76 s GLU 61 N -2.43 1.73 0.65 2.03 2.56 -0.90 -4.96 118.70 117.37 1b76 s GLU 61 Ca 0.22 -0.60 -0.07 0.00 0.00 0.00 0.00 54.97 54.52 1b76 s GLU 61 Cb -0.10 -1.52 0.03 0.00 2.00 0.00 0.00 34.13 34.54 1b76 s GLU 61 CO 0.14 0.25 0.97 0.20 -0.56 0.00 0.00 175.26 176.26 1b76 s GLY 62 N 0.00 1.64 0.12 -1.50 0.00 -1.26 -1.53 107.32 104.79 1b76 s GLY 62 Ca -0.03 -0.73 -0.21 0.00 0.00 0.00 0.00 44.72 43.75 1b76 s GLY 62 CO 0.02 -0.39 0.52 -2.27 0.00 0.00 0.00 173.10 170.97 1b76 s LEU 63 N -5.14 -0.15 -0.35 0.66 2.96 -0.57 -4.87 118.68 111.21 1b76 s LEU 63 Ca 0.57 -0.06 0.02 0.00 -0.22 0.00 0.00 54.13 54.44 1b76 s LEU 63 Cb -0.11 2.25 0.15 0.00 0.50 0.00 0.00 46.19 48.99 1b76 s LEU 63 CO 0.46 -0.88 0.35 -0.62 -1.32 0.00 0.00 176.35 174.34 1b76 s ASP 64 N -2.60 1.40 0.77 3.68 -1.08 -1.26 -4.26 116.67 113.32 1b76 s ASP 64 Ca 0.00 -1.43 -0.07 0.00 -0.52 0.00 0.00 52.55 50.54 1b76 s ASP 64 Cb 0.00 0.49 0.12 0.00 -1.46 0.00 0.00 42.92 42.07 1b76 s ASP 64 CO -0.10 -0.29 1.08 0.00 0.52 0.00 0.00 175.17 176.38 1b76 s ALA 65 N 1.62 3.15 0.51 3.66 0.00 -1.26 -5.09 121.76 124.36 1b76 s ALA 65 Ca 0.15 -1.33 -0.03 0.00 0.00 0.00 0.00 51.96 50.75 1b76 s ALA 65 Cb -0.15 -2.39 -0.00 0.00 0.00 0.00 0.00 23.12 20.57 1b76 s ALA 65 CO -0.10 -1.65 0.78 -1.54 0.00 0.00 0.00 175.76 173.25 1b76 s SER 66 N -4.70 5.78 0.02 0.00 1.04 -1.26 -4.96 113.70 109.62 1b76 s SER 66 Ca 0.66 0.54 -0.19 0.00 0.48 0.00 0.00 55.95 57.44 1b76 s SER 66 Cb -0.07 -1.69 -0.20 0.00 0.10 0.00 0.00 66.02 64.16 1b76 s SER 66 CO 0.46 -0.84 1.17 0.58 0.98 0.00 0.00 173.24 175.60 1b76 h VAL 67 N 0.14 1.40 -2.72 5.02 2.07 -1.94 -3.44 116.25 116.77 1b76 h VAL 67 Ca -0.46 -1.92 -0.55 0.00 0.82 0.00 0.00 66.70 64.59 1b76 h VAL 67 Cb 1.25 2.37 -0.02 0.00 -1.52 0.00 0.00 31.29 33.37 1b76 h VAL 67 CO 0.59 0.57 1.01 -0.76 0.02 0.00 0.00 177.57 179.00 1b76 s LEU 68 N -8.50 4.28 -0.07 2.57 1.43 -1.26 -0.51 118.68 116.63 1b76 s LEU 68 Ca -0.13 2.08 0.04 0.00 -1.03 0.00 0.00 54.13 55.09 1b76 s LEU 68 Cb 0.05 -3.54 -0.02 0.00 0.03 0.00 0.00 46.19 42.71 1b76 s LEU 68 CO 0.82 -0.86 -0.17 -0.89 0.23 0.00 0.00 176.35 175.48 1b76 s THR 69 N 3.71 2.76 0.00 5.49 2.01 0.14 -4.94 115.64 124.82 1b76 s THR 69 Ca 0.67 -0.81 -0.30 0.00 0.31 0.00 0.00 61.69 61.56 1b76 s THR 69 Cb -0.30 -2.08 -0.06 0.00 0.01 0.00 0.00 72.50 70.07 1b76 s THR 69 CO 0.25 0.57 1.57 -2.28 -0.69 0.00 0.00 174.62 174.04 1b76 s HIS 70 N -0.36 2.42 0.10 4.92 2.46 -1.26 -0.71 115.29 122.87 1b76 s HIS 70 Ca 0.03 0.45 -0.00 0.00 0.47 0.00 0.00 55.06 56.01 1b76 s HIS 70 Cb -0.12 -3.85 0.24 0.00 -0.13 0.00 0.00 32.58 28.72 1b76 s HIS 70 CO 0.02 -3.38 0.54 -2.13 -2.47 0.00 0.00 174.74 167.33 1b76 n ARG 71 N 6.03 -0.03 0.05 2.88 0.63 -1.24 -0.66 116.66 124.32 1b76 n ARG 71 Ca 0.15 0.53 -0.15 0.00 -0.92 0.00 0.00 57.85 57.46 1b76 n ARG 71 Cb 0.42 -0.82 -0.10 0.00 0.45 0.00 0.00 32.46 32.42 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 -1.61 -0.99 6.15 3.38 -1.91 -2.42 115.31 117.92 1b76 h LEU 72 Ca 0.20 0.18 0.09 0.00 0.09 0.00 0.00 57.88 58.44 1b76 h LEU 72 Cb 0.38 0.61 -0.12 0.00 0.09 0.00 0.00 40.66 41.62 1b76 h LEU 72 CO -0.33 -0.50 -0.58 0.52 0.09 0.00 0.00 178.44 177.63 1b76 n VAL 73 N -5.34 -0.67 0.46 1.22 0.31 0.16 0.13 118.33 114.60 1b76 n VAL 73 Ca -0.07 2.39 0.06 0.00 -0.01 0.00 0.00 64.34 66.71 1b76 n VAL 73 Cb 0.38 -2.95 0.28 0.00 -0.91 0.00 0.00 33.84 30.65 1b76 n VAL 73 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1b76 n LEU 74 N -5.23 0.00 -0.06 7.52 4.77 -1.12 -1.25 117.00 121.62 1b76 n LEU 74 Ca 0.02 0.49 -0.11 0.00 -0.03 0.00 0.00 56.01 56.38 1b76 n LEU 74 Cb 0.26 -0.49 -0.10 0.00 -2.33 0.00 0.00 43.42 40.75 1b76 n LEU 74 CO -0.16 -0.27 0.33 -0.74 -1.33 0.00 0.00 177.39 175.23 1b76 h HIS 75 N 0.00 -0.01 0.00 -1.77 2.76 0.16 0.23 115.15 116.52 1b76 h HIS 75 Ca 0.00 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 1b76 h HIS 75 Cb 0.22 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.19 1b76 h HIS 75 CO 0.00 0.77 0.00 1.88 -1.30 0.00 0.00 177.93 179.28 1b76 h TYR 76 N -0.97 0.00 0.00 5.26 0.05 0.25 -1.44 116.97 120.11 1b76 h TYR 76 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1b76 h TYR 76 Cb 0.78 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.52 1b76 h TYR 76 CO 0.21 0.00 -0.74 -1.13 -1.05 0.00 0.00 178.16 175.45 1b76 n SER 77 N -2.31 0.62 0.00 3.88 3.41 -0.38 -4.72 113.62 114.12 1b76 n SER 77 Ca 0.00 -0.27 0.00 0.00 -0.26 0.00 0.00 58.87 58.34 1b76 n SER 77 Cb 0.15 0.49 0.00 0.00 -0.26 0.00 0.00 64.21 64.59 1b76 n SER 77 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1b76 n GLY 78 N 1.44 3.07 0.09 5.00 0.00 -0.54 -4.93 105.19 109.31 1b76 n GLY 78 Ca 0.04 -0.87 0.02 0.00 0.00 0.00 0.00 46.02 45.21 1b76 n GLY 78 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1b76 n HIS 79 N 0.00 0.11 0.08 1.61 8.25 -1.09 0.12 115.22 124.31 1b76 n HIS 79 Ca 0.00 0.30 -0.04 0.00 -0.26 0.00 0.00 57.72 57.71 1b76 n HIS 79 Cb 0.00 -0.66 -0.02 0.00 1.12 0.00 0.00 29.99 30.43 1b76 n HIS 79 CO 0.00 0.00 0.00 1.49 0.64 0.00 0.00 176.34 178.47 1b76 h GLU 80 N 0.00 -0.24 0.01 -0.41 4.81 -0.79 -1.29 114.58 116.66 1b76 h GLU 80 Ca 0.13 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.38 1b76 h GLU 80 Cb 0.23 0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.66 1b76 h GLU 80 CO -0.24 -0.16 -0.03 0.00 -0.73 0.00 0.00 179.01 177.84 1b76 h ALA 81 N -1.62 -0.63 0.00 2.92 0.00 0.68 -3.37 119.26 117.24 1b76 h ALA 81 Ca -0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1b76 h ALA 81 Cb 0.21 0.42 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1b76 h ALA 81 CO -0.00 -0.64 -1.25 0.25 0.00 0.00 0.00 179.25 177.61 1b76 n THR 82 N -2.58 0.26 -2.15 0.00 -2.24 0.03 -4.79 114.28 102.79 1b76 n THR 82 Ca -0.01 -0.39 -0.31 0.00 -2.27 0.00 0.00 64.05 61.08 1b76 n THR 82 Cb 0.03 0.01 -0.04 0.00 -2.10 0.00 0.00 70.33 68.23 1b76 n THR 82 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1b76 s PHE 83 N -3.32 1.93 -0.15 4.78 5.36 -0.49 -4.84 117.98 121.26 1b76 s PHE 83 Ca -0.00 0.37 -0.30 0.00 -0.96 0.00 0.00 56.93 56.04 1b76 s PHE 83 Cb 0.13 -4.18 0.12 0.00 -0.34 0.00 0.00 43.02 38.75 1b76 s PHE 83 CO 0.83 -1.85 0.97 0.00 -1.46 0.00 0.00 175.22 173.71 1b76 s ALA 84 N 8.96 -1.92 -0.09 11.12 0.00 -1.26 -3.55 121.76 135.01 1b76 s ALA 84 Ca 0.65 1.56 0.00 0.00 0.00 0.00 0.00 51.96 54.17 1b76 s ALA 84 Cb -0.06 -0.64 -0.03 0.00 0.00 0.00 0.00 23.12 22.40 1b76 s ALA 84 CO 0.00 -0.32 -0.09 -0.51 0.00 0.00 0.00 175.76 174.84 1b76 s ASP 85 N -1.14 4.39 -0.08 0.00 1.11 -0.67 -4.81 116.67 115.47 1b76 s ASP 85 Ca -0.02 -0.15 -0.30 0.00 0.18 0.00 0.00 52.55 52.26 1b76 s ASP 85 Cb -0.00 -1.31 -0.05 0.00 1.07 0.00 0.00 42.92 42.63 1b76 s ASP 85 CO 0.02 0.28 1.54 -2.16 1.18 0.00 0.00 175.17 176.03 1b76 s PRO 86 N -0.32 4.20 0.43 8.23 0.04 -1.26 0.95 135.00 147.26 1b76 s PRO 86 Ca 0.04 2.05 0.03 0.00 0.04 0.00 0.00 61.00 63.16 1b76 s PRO 86 Cb -0.13 -3.90 -0.04 0.00 0.04 0.00 0.00 34.50 30.48 1b76 s PRO 86 CO 0.02 -0.79 0.06 0.00 0.04 0.00 0.00 177.00 176.33 1b76 s MET 87 N 3.78 1.97 0.27 4.56 0.23 0.15 -4.88 119.30 125.38 1b76 s MET 87 Ca 0.68 -2.19 -0.20 0.00 -1.03 0.00 0.00 55.69 52.95 1b76 s MET 87 Cb -0.30 -1.09 0.06 0.00 -1.53 0.00 0.00 34.83 31.97 1b76 s MET 87 CO 0.26 -0.33 0.88 0.14 -2.03 0.00 0.00 175.02 173.94 1b76 s VAL 88 N -3.06 0.00 0.36 5.16 -7.23 -1.26 -2.31 120.40 112.06 1b76 s VAL 88 Ca 0.22 -0.82 -0.17 0.00 -1.81 0.00 0.00 61.98 59.40 1b76 s VAL 88 Cb 0.04 -2.63 0.05 0.00 0.56 0.00 0.00 36.38 34.41 1b76 s VAL 88 CO 0.11 0.00 0.81 1.51 -0.31 0.00 0.00 175.10 177.22 1b76 s ASP 89 N -3.14 -0.02 0.00 4.85 -4.77 -1.26 -0.15 116.67 112.19 1b76 s ASP 89 Ca 0.16 -1.06 0.00 0.00 -3.30 0.00 0.00 52.55 48.36 1b76 s ASP 89 Cb -0.04 0.81 0.00 0.00 -1.09 0.00 0.00 42.92 42.60 1b76 s ASP 89 CO 0.08 -1.60 0.00 0.59 0.70 0.00 0.00 175.17 174.94 1b76 n ASN 90 N -1.31 0.00 0.00 2.11 5.03 -1.25 0.54 115.26 120.38 1b76 n ASN 90 Ca -0.08 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.37 1b76 n ASN 90 Cb 0.60 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.36 1b76 n ASN 90 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1b76 n ALA 91 N -2.02 1.54 -2.00 5.41 0.00 -1.26 -4.60 120.51 117.58 1b76 n ALA 91 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1b76 n ALA 91 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1b76 n ALA 91 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1b76 n LYS 92 N -0.56 0.00 -0.68 0.00 2.85 -1.26 -5.17 118.16 113.34 1b76 n LYS 92 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1b76 n LYS 92 Cb 0.02 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.40 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 -3.00 0.00 -2.87 0.58 0.00 -1.26 -5.13 120.51 108.83 1b76 n ALA 93 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.08 1b76 n ALA 93 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.34 1b76 n ALA 93 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1b76 s ARG 94 N 0.13 3.83 0.09 0.00 1.81 -1.26 -3.81 118.95 119.74 1b76 s ARG 94 Ca 0.00 -0.40 0.00 0.00 -1.72 0.00 0.00 55.73 53.61 1b76 s ARG 94 Cb 0.00 -3.37 0.00 0.00 -0.45 0.00 0.00 34.95 31.13 1b76 s ARG 94 CO 0.00 -0.04 0.00 0.66 -0.68 0.00 0.00 175.30 175.24 1b76 n TYR 95 N 4.51 -0.55 -3.76 -0.53 4.01 0.79 -4.85 117.16 116.78 1b76 n TYR 95 Ca -0.16 0.10 -0.30 0.00 -0.16 0.00 0.00 57.90 57.38 1b76 n TYR 95 Cb 0.52 0.23 -0.13 0.00 -0.31 0.00 0.00 39.34 39.65 1b76 n TYR 95 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 1b76 s TRP 159 N -2.00 2.23 0.81 -0.72 0.52 -1.26 -4.48 118.94 114.04 1b76 s TRP 159 Ca 0.00 -2.56 -0.15 0.00 0.02 0.00 0.00 56.10 53.41 1b76 s TRP 159 Cb 0.00 -2.08 -0.02 0.00 -1.15 0.00 0.00 33.47 30.22 1b76 s TRP 159 CO 0.00 -0.78 0.45 0.25 0.02 0.00 0.00 176.95 176.90 1b76 n THR 160 N 3.51 1.14 -2.24 2.01 -2.24 0.19 -4.92 114.28 111.72 1b76 n THR 160 Ca 0.07 -0.33 -0.34 0.00 -2.27 0.00 0.00 64.05 61.19 1b76 n THR 160 Cb 0.34 -0.68 -0.00 0.00 -2.10 0.00 0.00 70.33 67.89 1b76 n THR 160 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1b76 s PRO 161 N -3.03 3.44 0.94 -0.78 0.04 -1.26 -4.36 135.00 129.99 1b76 s PRO 161 Ca 0.62 1.38 -0.11 0.00 0.04 0.00 0.00 61.00 62.92 1b76 s PRO 161 Cb -0.30 -2.04 0.16 0.00 0.04 0.00 0.00 34.50 32.36 1b76 s PRO 161 CO 0.62 -0.73 1.10 -2.14 0.04 0.00 0.00 177.00 175.88 1b76 s PRO 162 N -3.59 0.83 -0.30 0.56 0.02 -1.26 -4.75 135.00 126.52 1b76 s PRO 162 Ca 0.67 1.14 -0.19 0.00 0.02 0.00 0.00 61.00 62.65 1b76 s PRO 162 Cb -0.18 -1.74 0.19 0.00 0.02 0.00 0.00 34.50 32.79 1b76 s PRO 162 CO 0.29 -2.63 1.24 -0.98 -0.33 0.00 0.00 177.00 174.60 1b76 s ARG 163 N -4.72 0.14 0.23 5.54 3.03 -0.98 -4.98 118.95 117.21 1b76 s ARG 163 Ca 0.65 0.21 -0.30 0.00 2.03 0.00 0.00 55.73 58.32 1b76 s ARG 163 Cb -0.21 0.04 -0.09 0.00 -1.03 0.00 0.00 34.95 33.66 1b76 s ARG 163 CO 0.59 -0.02 1.32 0.71 -1.13 0.00 0.00 175.30 176.77 1b76 s TYR 164 N 0.77 3.20 -0.23 5.89 1.51 -1.26 0.32 117.35 127.55 1b76 s TYR 164 Ca -0.03 1.23 -0.05 0.00 -1.01 0.00 0.00 57.07 57.21 1b76 s TYR 164 Cb -0.03 -3.64 -0.02 0.00 -0.11 0.00 0.00 41.96 38.16 1b76 s TYR 164 CO -0.12 -1.96 -0.00 0.12 -1.11 0.00 0.00 175.55 172.48 1b76 s PHE 165 N -0.13 3.01 0.44 2.71 5.36 0.27 -4.83 117.98 124.80 1b76 s PHE 165 Ca 0.56 -0.71 -0.24 0.00 -0.96 0.00 0.00 56.93 55.58 1b76 s PHE 165 Cb -0.38 -2.15 -0.08 0.00 -0.34 0.00 0.00 43.02 40.08 1b76 s PHE 165 CO 0.41 -0.45 1.23 1.21 -1.46 0.00 0.00 175.22 176.16 1b76 s ASN 166 N 1.46 6.21 -0.01 6.13 3.84 -1.26 -1.67 114.94 129.64 1b76 s ASN 166 Ca 0.05 2.47 0.20 0.00 0.21 0.00 0.00 52.86 55.79 1b76 s ASN 166 Cb -0.15 -2.62 -0.24 0.00 -0.55 0.00 0.00 41.25 37.70 1b76 s ASN 166 CO -0.00 -0.90 0.75 0.23 -2.79 0.00 0.00 177.10 174.39 1b76 n MET 167 N -0.21 0.52 -2.47 0.43 2.81 -1.23 -4.91 117.12 112.06 1b76 n MET 167 Ca 0.06 -0.04 -0.36 0.00 -1.81 0.00 0.00 57.70 55.55 1b76 n MET 167 Cb 0.46 -1.44 -0.03 0.00 -0.71 0.00 0.00 33.22 31.50 1b76 n MET 167 CO 0.00 0.00 0.00 -1.64 1.51 0.00 0.00 175.97 175.84 1b76 s MET 168 N -2.97 3.99 0.41 0.03 -1.94 -1.26 0.05 119.30 117.61 1b76 s MET 168 Ca 0.04 1.55 -0.18 0.00 -1.71 0.00 0.00 55.69 55.39 1b76 s MET 168 Cb 0.14 -2.42 -0.10 0.00 2.01 0.00 0.00 34.83 34.47 1b76 s MET 168 CO 0.82 -0.30 0.88 -0.06 -0.01 0.00 0.00 175.02 176.35 1b76 s PHE 169 N -1.69 3.36 0.25 -0.03 0.08 -1.26 -4.87 117.98 113.82 1b76 s PHE 169 Ca 0.61 1.43 0.06 0.00 0.12 0.00 0.00 56.93 59.16 1b76 s PHE 169 Cb -0.22 -2.72 -0.05 0.00 -0.57 0.00 0.00 43.02 39.45 1b76 s PHE 169 CO 0.28 -0.09 -0.07 -0.65 -0.10 0.00 0.00 175.22 174.58 1b76 s GLN 170 N -3.31 1.46 -0.29 0.44 1.11 -1.26 -2.72 119.66 115.08 1b76 s GLN 170 Ca 0.58 -1.71 -0.26 0.00 0.01 0.00 0.00 55.36 53.98 1b76 s GLN 170 Cb -0.10 -1.07 0.19 0.00 -1.01 0.00 0.00 33.01 31.02 1b76 s GLN 170 CO 0.18 0.06 1.42 0.34 0.01 0.00 0.00 175.29 177.31 1b76 s ASP 171 N -3.39 -0.06 0.27 5.90 2.15 -0.79 -4.93 116.67 115.82 1b76 s ASP 171 Ca 0.27 0.11 0.09 0.00 0.43 0.00 0.00 52.55 53.46 1b76 s ASP 171 Cb 0.03 0.11 -0.04 0.00 -0.30 0.00 0.00 42.92 42.72 1b76 s ASP 171 CO 0.10 -0.02 0.02 -0.76 -0.17 0.00 0.00 175.17 174.34 1b76 s LEU 172 N -0.12 3.27 -0.74 -1.34 1.02 -1.26 0.24 118.68 119.75 1b76 s LEU 172 Ca 0.07 -0.61 -0.26 0.00 0.02 0.00 0.00 54.13 53.36 1b76 s LEU 172 Cb -0.04 -1.79 0.01 0.00 0.02 0.00 0.00 46.19 44.39 1b76 s LEU 172 CO -0.14 -0.01 1.56 -0.60 0.02 0.00 0.00 176.35 177.17 1b76 s ARG 173 N -3.70 2.98 0.00 1.70 6.06 0.19 -4.93 118.95 121.26 1b76 s ARG 173 Ca 0.32 -0.04 0.00 0.00 -2.50 0.00 0.00 55.73 53.51 1b76 s ARG 173 Cb -0.06 -4.45 0.00 0.00 0.06 0.00 0.00 34.95 30.50 1b76 s ARG 173 CO 0.21 -2.46 0.00 0.41 -2.50 0.00 0.00 175.30 170.96 1b76 n GLY 174 N 5.77 0.69 2.41 8.12 0.00 -1.26 -4.41 105.19 116.50 1b76 n GLY 174 Ca 0.15 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.05 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 6.91 0.00 0.00 1.61 -0.02 -1.26 -4.37 135.00 137.86 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 -2.13 1.98 0.00 0.00 175.50 175.35 1b76 n ARG 176 N 0.00 0.00 -2.59 -0.52 0.63 -1.26 -5.07 116.66 107.84 1b76 n ARG 176 Ca 0.00 0.00 -0.02 0.00 -0.92 0.00 0.00 57.85 56.91 1b76 n ARG 176 Cb 0.00 0.00 0.12 0.00 0.45 0.00 0.00 32.46 33.03 1b76 n ARG 176 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1b76 n GLY 177 N 5.00 1.97 3.77 5.14 0.00 -1.26 -4.81 105.19 115.00 1b76 n GLY 177 Ca 0.00 -0.20 -0.40 0.00 0.00 0.00 0.00 46.02 45.42 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 -1.24 2.95 0.60 -0.02 0.00 -1.26 -4.86 107.32 103.48 1b76 s GLY 178 Ca 0.09 1.35 0.34 0.00 0.00 0.00 0.00 44.72 46.50 1b76 s GLY 178 CO -0.12 1.98 2.02 -0.09 0.00 0.00 0.00 173.10 176.89 1b76 h ARG 179 N 2.90 0.00 -0.05 2.90 9.65 -2.00 0.28 114.38 128.06 1b76 h ARG 179 Ca -0.50 0.00 -0.20 0.00 -1.10 0.00 0.00 59.98 58.18 1b76 h ARG 179 Cb 1.24 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 29.82 1b76 h ARG 179 CO 0.64 0.00 -0.80 0.78 2.80 0.00 0.00 179.97 183.38 1b76 h GLY 180 N 0.00 0.46 -3.87 2.80 0.00 -2.04 -3.22 103.07 97.20 1b76 h GLY 180 Ca 0.00 -0.70 -0.48 0.00 0.00 0.00 0.00 47.33 46.15 1b76 h GLY 180 CO 0.00 0.62 0.61 1.47 0.00 0.00 0.00 176.54 179.24 1b76 n LEU 181 N -3.81 6.50 -4.75 3.11 -0.00 0.98 -4.94 117.00 114.09 1b76 n LEU 181 Ca -0.05 -3.47 -0.40 0.00 -0.00 0.00 0.00 56.01 52.09 1b76 n LEU 181 Cb 0.75 -0.82 -0.06 0.00 -0.00 0.00 0.00 43.42 43.30 1b76 n LEU 181 CO 0.49 1.01 0.58 -0.22 -0.00 0.00 0.00 177.39 179.26 1b76 s LEU 182 N -3.08 4.58 0.06 1.47 2.96 -1.16 0.56 118.68 124.07 1b76 s LEU 182 Ca 0.53 1.77 0.03 0.00 -0.22 0.00 0.00 54.13 56.24 1b76 s LEU 182 Cb 0.45 -3.47 -0.03 0.00 0.50 0.00 0.00 46.19 43.64 1b76 s LEU 182 CO 0.10 0.11 -0.10 0.00 -1.32 0.00 0.00 176.35 175.14 1b76 s ALA 183 N -0.78 0.89 0.16 5.97 0.00 0.14 -3.70 121.76 124.43 1b76 s ALA 183 Ca 0.40 -0.94 0.10 0.00 0.00 0.00 0.00 51.96 51.52 1b76 s ALA 183 Cb -0.24 -0.00 -0.04 0.00 0.00 0.00 0.00 23.12 22.83 1b76 s ALA 183 CO 0.29 0.04 -0.19 0.71 0.00 0.00 0.00 175.76 176.61 1b76 s TYR 184 N -1.60 2.47 -0.23 0.00 2.02 0.11 -1.88 117.35 118.23 1b76 s TYR 184 Ca -0.04 -0.29 -0.19 0.00 -0.37 0.00 0.00 57.07 56.18 1b76 s TYR 184 Cb -0.08 -1.26 -0.03 0.00 -0.40 0.00 0.00 41.96 40.19 1b76 s TYR 184 CO 0.01 0.44 0.56 -0.51 -1.57 0.00 0.00 175.55 174.48 1b76 s LEU 185 N -2.46 4.10 -0.33 -1.29 1.43 -1.10 0.26 118.68 119.28 1b76 s LEU 185 Ca 0.20 0.65 -0.42 0.00 -1.03 0.00 0.00 54.13 53.53 1b76 s LEU 185 Cb -0.09 -2.75 -0.17 0.00 0.03 0.00 0.00 46.19 43.21 1b76 s LEU 185 CO 0.11 -0.27 1.71 -2.11 0.23 0.00 0.00 176.35 176.02 1b76 n ARG 186 N 5.26 0.87 0.21 1.70 1.85 0.34 -4.39 116.66 122.50 1b76 n ARG 186 Ca -0.03 0.32 0.08 0.00 -1.00 0.00 0.00 57.85 57.22 1b76 n ARG 186 Cb 0.50 -1.96 0.44 0.00 -1.05 0.00 0.00 32.46 30.39 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 6.67 0.00 -2.91 2.89 0.13 -1.91 0.33 132.00 137.20 1b76 h PRO 187 Ca -0.46 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.58 1b76 h PRO 187 Cb 1.33 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 32.28 1b76 h PRO 187 CO 0.96 0.28 -0.13 -1.83 -0.23 0.00 0.00 178.00 177.05 1b76 s GLU 188 N -3.75 0.84 0.41 0.86 -1.05 -1.26 -4.20 118.70 110.56 1b76 s GLU 188 Ca -0.00 -0.23 0.23 0.00 -0.15 0.00 0.00 54.97 54.81 1b76 s GLU 188 Cb 0.11 0.38 0.66 0.00 -0.44 0.00 0.00 34.13 34.84 1b76 s GLU 188 CO 0.66 -0.27 1.71 1.79 0.95 0.00 0.00 175.26 180.10 1b76 h THR 189 N 3.32 0.49 -1.01 1.83 1.35 -1.87 -3.33 112.91 113.71 1b76 h THR 189 Ca -0.30 -1.32 0.29 0.00 -0.55 0.00 0.00 66.41 64.53 1b76 h THR 189 Cb 1.19 1.94 -0.14 0.00 -1.73 0.00 0.00 68.15 69.41 1b76 h THR 189 CO 0.42 0.23 0.59 0.00 -0.25 0.00 0.00 175.52 176.51 1b76 h ALA 190 N 1.76 1.89 -0.32 6.62 0.00 -1.95 -2.81 119.26 124.46 1b76 h ALA 190 Ca -0.00 0.16 0.05 0.00 0.00 0.00 0.00 54.91 55.12 1b76 h ALA 190 Cb 0.92 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.75 1b76 h ALA 190 CO 0.03 -0.44 0.02 1.96 0.00 0.00 0.00 179.25 180.82 1b76 h GLN 191 N 0.44 0.11 -0.02 0.00 1.08 -2.02 -1.75 115.11 112.96 1b76 h GLN 191 Ca 0.69 -0.01 0.01 0.00 -1.45 0.00 0.00 58.65 57.89 1b76 h GLN 191 Cb 1.47 -0.02 -0.00 0.00 -0.05 0.00 0.00 27.48 28.88 1b76 h GLN 191 CO -0.54 0.07 0.07 0.78 -0.95 0.00 0.00 178.83 178.27 1b76 h GLY 192 N 0.11 0.00 0.18 3.46 0.00 -1.78 -1.25 103.07 103.80 1b76 h GLY 192 Ca 0.15 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.47 1b76 h GLY 192 CO -0.24 0.00 -0.09 -2.22 0.00 0.00 0.00 176.54 173.99 1b76 h ILE 193 N 0.00 0.00 -0.59 2.60 2.04 -1.44 -3.00 117.51 117.13 1b76 h ILE 193 Ca 0.01 -0.58 0.08 0.00 1.00 0.00 0.00 64.86 65.36 1b76 h ILE 193 Cb 0.16 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 36.14 1b76 h ILE 193 CO -0.00 0.00 -0.50 -0.26 0.00 0.00 0.00 178.15 177.39 1b76 h PHE 194 N -0.83 -1.52 0.00 1.37 0.04 -1.20 0.45 116.94 115.25 1b76 h PHE 194 Ca -0.03 0.09 0.00 0.00 2.80 0.00 0.00 57.97 60.83 1b76 h PHE 194 Cb 0.19 0.74 0.00 0.00 2.20 0.00 0.00 35.95 39.08 1b76 h PHE 194 CO 0.01 -0.44 0.06 -0.39 -0.60 0.00 0.00 178.31 176.95 1b76 h VAL 195 N -0.25 0.00 -0.01 -0.55 -1.51 -1.39 -0.27 116.25 112.27 1b76 h VAL 195 Ca 0.14 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.61 1b76 h VAL 195 Cb 0.56 0.62 0.00 0.00 -2.13 0.00 0.00 31.29 30.34 1b76 h VAL 195 CO -0.70 0.00 -0.29 0.59 -1.23 0.00 0.00 177.57 175.94 1b76 n ASN 196 N -2.52 1.91 -0.16 4.19 3.02 0.14 -4.71 115.26 117.12 1b76 n ASN 196 Ca -0.02 -1.45 -0.04 0.00 -0.03 0.00 0.00 54.58 53.04 1b76 n ASN 196 Cb 0.10 0.37 -0.04 0.00 -0.61 0.00 0.00 39.78 39.61 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 0.15 -0.17 -0.13 3.10 7.35 -0.11 -0.40 117.46 127.25 1b76 n PHE 197 Ca 0.08 0.47 -0.04 0.00 -0.76 0.00 0.00 57.45 57.21 1b76 n PHE 197 Cb 0.39 -0.48 0.04 0.00 0.35 0.00 0.00 39.48 39.77 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 0.08 -0.93 -4.13 1.63 -1.84 -0.04 116.57 111.33 1b76 h LYS 198 Ca 0.06 -0.00 0.03 0.00 -0.85 0.00 0.00 60.65 59.89 1b76 h LYS 198 Cb 0.15 -0.02 -0.05 0.00 -0.60 0.00 0.00 32.23 31.71 1b76 h LYS 198 CO -0.36 0.05 0.61 -0.91 -3.45 0.00 0.00 179.45 175.40 1b76 h ASN 199 N 0.08 1.01 -0.02 4.20 2.35 -1.04 0.27 115.58 122.44 1b76 h ASN 199 Ca 0.22 -0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.95 1b76 h ASN 199 Cb 0.32 -0.23 -0.00 0.00 0.05 0.00 0.00 38.32 38.46 1b76 h ASN 199 CO -0.38 0.70 -0.02 0.58 -1.65 0.00 0.00 177.43 176.66 1b76 h VAL 200 N 1.18 1.38 -0.61 2.81 2.07 -0.33 -2.55 116.25 120.20 1b76 h VAL 200 Ca 0.37 -1.15 0.09 0.00 0.82 0.00 0.00 66.70 66.83 1b76 h VAL 200 Cb -0.00 2.12 -0.07 0.00 -1.52 0.00 0.00 31.29 31.82 1b76 h VAL 200 CO -0.12 0.31 0.24 0.25 0.02 0.00 0.00 177.57 178.27 1b76 h LEU 201 N -0.42 0.26 0.39 2.57 5.85 -0.65 0.10 115.31 123.40 1b76 h LEU 201 Ca 0.00 0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.78 1b76 h LEU 201 Cb 0.51 0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.58 1b76 h LEU 201 CO 0.00 0.16 -0.19 0.44 -0.34 0.00 0.00 178.44 178.51 1b76 h ASP 202 N 0.44 -0.44 -0.22 1.25 5.19 -0.51 1.15 116.42 123.27 1b76 h ASP 202 Ca 0.31 -0.00 0.02 0.00 -0.62 0.00 0.00 57.03 56.73 1b76 h ASP 202 Cb 0.36 0.11 -0.01 0.00 0.18 0.00 0.00 39.33 39.98 1b76 h ASP 202 CO -0.29 -0.29 0.15 0.00 -3.12 0.00 0.00 179.24 175.68 1b76 h ALA 203 N 0.05 1.92 0.00 3.45 0.00 -0.92 -3.08 119.26 120.68 1b76 h ALA 203 Ca -0.05 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 1b76 h ALA 203 Cb 0.42 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1b76 h ALA 203 CO 0.09 0.06 -1.85 0.25 0.00 0.00 0.00 179.25 177.80 1b76 n THR 204 N -4.50 0.13 -3.73 0.00 -2.24 0.28 -5.00 114.28 99.21 1b76 n THR 204 Ca 0.01 -0.44 -0.25 0.00 -2.27 0.00 0.00 64.05 61.10 1b76 n THR 204 Cb 0.12 0.02 0.05 0.00 -2.10 0.00 0.00 70.33 68.42 1b76 n THR 204 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1b76 n SER 205 N -2.17 -4.47 -4.73 3.42 3.41 0.39 -4.94 113.62 104.54 1b76 n SER 205 Ca -0.06 -0.69 -0.36 0.00 -0.26 0.00 0.00 58.87 57.50 1b76 n SER 205 Cb 0.53 -4.42 0.07 0.00 -0.26 0.00 0.00 64.21 60.13 1b76 n SER 205 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1b76 s ARG 206 N -6.29 2.51 0.24 4.33 1.81 -1.21 -5.04 118.95 115.29 1b76 s ARG 206 Ca 0.47 1.95 0.08 0.00 -1.72 0.00 0.00 55.73 56.50 1b76 s ARG 206 Cb -0.22 -1.86 -0.04 0.00 -0.45 0.00 0.00 34.95 32.38 1b76 s ARG 206 CO 0.78 -1.60 0.10 0.15 -0.68 0.00 0.00 175.30 174.06 1b76 s LYS 207 N -3.50 2.67 0.10 3.54 3.01 -1.26 -5.06 119.74 119.23 1b76 s LYS 207 Ca 0.80 -1.15 -0.29 0.00 -1.01 0.00 0.00 55.97 54.32 1b76 s LYS 207 Cb -0.34 -2.42 -0.11 0.00 -1.01 0.00 0.00 37.83 33.94 1b76 s LYS 207 CO 0.40 0.41 1.46 -0.07 0.51 0.00 0.00 175.35 178.06 1b76 h LEU 208 N 1.87 -1.45 -8.21 3.17 -0.00 -1.96 -3.36 115.31 105.38 1b76 h LEU 208 Ca -0.47 0.17 -0.09 0.00 -0.00 0.00 0.00 57.88 57.49 1b76 h LEU 208 Cb 1.23 0.56 -0.03 0.00 -0.00 0.00 0.00 40.66 42.43 1b76 h LEU 208 CO 0.60 -0.41 0.57 0.61 -0.00 0.00 0.00 178.44 179.81 1b76 n GLY 209 N -1.37 -0.27 3.57 0.83 0.00 -1.26 -4.59 105.19 102.10 1b76 n GLY 209 Ca -0.05 0.19 -0.15 0.00 0.00 0.00 0.00 46.02 46.01 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 10.69 -0.66 0.41 1.61 -0.12 -1.19 -4.87 117.98 123.85 1b76 s PHE 210 Ca 0.97 1.36 0.03 0.00 -0.05 0.00 0.00 56.93 59.24 1b76 s PHE 210 Cb -0.30 0.36 -0.03 0.00 -0.63 0.00 0.00 43.02 42.42 1b76 s PHE 210 CO 0.21 -0.47 0.08 0.20 -0.05 0.00 0.00 175.22 175.19 1b76 s GLY 211 N -0.53 2.56 -0.30 1.99 0.00 -0.55 -0.54 107.32 109.96 1b76 s GLY 211 Ca -0.05 -1.32 -0.02 0.00 0.00 0.00 0.00 44.72 43.32 1b76 s GLY 211 CO 0.05 -1.92 0.11 -0.42 0.00 0.00 0.00 173.10 170.91 1b76 s ILE 212 N -3.13 0.52 0.49 0.90 1.01 -0.59 -2.13 121.20 118.27 1b76 s ILE 212 Ca 0.24 -1.12 -0.10 0.00 0.00 0.00 0.00 60.65 59.67 1b76 s ILE 212 Cb 0.04 -1.39 -0.05 0.00 0.01 0.00 0.00 42.46 41.07 1b76 s ILE 212 CO 0.13 -0.67 0.86 0.00 0.00 0.00 0.00 174.94 175.26 1b76 s ALA 213 N 1.80 3.27 -0.29 9.38 0.00 -0.59 -2.61 121.76 132.73 1b76 s ALA 213 Ca 0.09 -0.22 -0.16 0.00 0.00 0.00 0.00 51.96 51.67 1b76 s ALA 213 Cb -0.17 -2.81 0.12 0.00 0.00 0.00 0.00 23.12 20.27 1b76 s ALA 213 CO -0.28 -0.30 0.86 -1.14 0.00 0.00 0.00 175.76 174.90 1b76 s GLN 214 N -4.46 0.50 -0.01 0.00 0.74 0.46 -1.52 119.66 115.38 1b76 s GLN 214 Ca 0.52 0.89 -0.01 0.00 0.05 0.00 0.00 55.36 56.81 1b76 s GLN 214 Cb -0.10 0.14 -0.04 0.00 1.10 0.00 0.00 33.01 34.11 1b76 s GLN 214 CO 0.41 -0.11 0.11 0.42 -0.55 0.00 0.00 175.29 175.57 1b76 s ILE 215 N 1.55 4.95 -0.06 -2.34 1.01 -1.26 0.06 121.20 125.11 1b76 s ILE 215 Ca -0.09 -0.33 -0.32 0.00 0.00 0.00 0.00 60.65 59.91 1b76 s ILE 215 Cb -0.04 -3.28 0.13 0.00 0.01 0.00 0.00 42.46 39.28 1b76 s ILE 215 CO -0.17 0.35 1.36 -0.83 0.00 0.00 0.00 174.94 175.65 1b76 s GLY 216 N -1.79 -0.46 0.64 6.18 0.00 -1.14 -4.86 107.32 105.89 1b76 s GLY 216 Ca 0.24 0.85 -0.15 0.00 0.00 0.00 0.00 44.72 45.66 1b76 s GLY 216 CO 0.15 0.16 1.09 0.54 0.00 0.00 0.00 173.10 175.04 1b76 s LYS 217 N -2.23 2.99 -0.22 2.90 -0.14 -1.26 -0.50 119.74 121.28 1b76 s LYS 217 Ca 0.14 1.30 -0.10 0.00 -1.36 0.00 0.00 55.97 55.96 1b76 s LYS 217 Cb 0.06 -1.98 0.09 0.00 -1.68 0.00 0.00 37.83 34.32 1b76 s LYS 217 CO -0.05 -1.09 0.50 0.00 -0.76 0.00 0.00 175.35 173.95 1b76 s ALA 218 N -2.42 -1.41 -0.02 5.17 0.00 0.24 -4.39 121.76 118.94 1b76 s ALA 218 Ca 0.65 1.82 -0.00 0.00 0.00 0.00 0.00 51.96 54.43 1b76 s ALA 218 Cb -0.18 -1.31 -0.04 0.00 0.00 0.00 0.00 23.12 21.59 1b76 s ALA 218 CO 0.41 -0.58 0.04 -0.06 0.00 0.00 0.00 175.76 175.56 1b76 s PHE 219 N 2.15 3.19 -0.27 0.00 0.40 0.11 -1.77 117.98 121.79 1b76 s PHE 219 Ca -0.06 0.16 -0.02 0.00 -0.60 0.00 0.00 56.93 56.41 1b76 s PHE 219 Cb -0.10 -1.72 0.16 0.00 0.51 0.00 0.00 43.02 41.87 1b76 s PHE 219 CO -0.15 0.51 0.48 0.50 0.70 0.00 0.00 175.22 177.26 1b76 s ARG 220 N -1.51 0.45 -0.43 0.44 3.52 0.07 -3.76 118.95 117.74 1b76 s ARG 220 Ca 0.20 0.78 -0.05 0.00 -0.13 0.00 0.00 55.73 56.53 1b76 s ARG 220 Cb -0.12 0.03 -0.12 0.00 -1.56 0.00 0.00 34.95 33.19 1b76 s ARG 220 CO 0.10 -0.61 2.32 -1.71 -0.81 0.00 0.00 175.30 174.59 1b76 n ASN 221 N 5.40 4.12 -4.54 -2.12 5.15 0.11 -3.94 115.26 119.44 1b76 n ASN 221 Ca -0.03 -2.20 -0.49 0.00 -0.60 0.00 0.00 54.58 51.26 1b76 n ASN 221 Cb 0.50 -0.99 -0.04 0.00 -0.53 0.00 0.00 39.78 38.73 1b76 n ASN 221 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1b76 n GLU 222 N 3.32 0.87 0.01 1.20 4.71 -1.26 -4.85 120.64 124.63 1b76 n GLU 222 Ca 0.36 0.31 -0.11 0.00 -0.01 0.00 0.00 57.16 57.70 1b76 n GLU 222 Cb 0.38 -1.70 0.02 0.00 -1.01 0.00 0.00 31.44 29.14 1b76 n GLU 222 CO 0.00 0.00 0.00 0.82 0.09 0.00 0.00 177.13 178.04 1b76 h ILE 223 N 2.30 1.33 -3.03 -3.67 1.08 -1.96 -3.39 117.51 110.17 1b76 h ILE 223 Ca -0.41 -1.91 -0.56 0.00 -0.39 0.00 0.00 64.86 61.59 1b76 h ILE 223 Cb 1.37 1.88 -0.40 0.00 -3.07 0.00 0.00 36.82 36.60 1b76 h ILE 223 CO 0.66 0.59 -0.76 0.42 -0.69 0.00 0.00 178.15 178.36 1b76 s THR 224 N -3.87 0.55 -0.41 -0.27 -4.23 -1.26 -5.00 115.64 101.15 1b76 s THR 224 Ca -0.07 -1.17 -0.29 0.00 -1.18 0.00 0.00 61.69 58.98 1b76 s THR 224 Cb 0.11 -1.42 0.01 0.00 1.34 0.00 0.00 72.50 72.53 1b76 s THR 224 CO 0.85 -0.69 1.39 -2.84 -0.54 0.00 0.00 174.62 172.79 1b76 s PRO 225 N 1.79 3.62 1.01 3.99 0.02 -1.26 -5.02 135.00 139.14 1b76 s PRO 225 Ca 0.09 0.94 -0.15 0.00 0.02 0.00 0.00 61.00 61.91 1b76 s PRO 225 Cb -0.17 -4.00 0.20 0.00 0.02 0.00 0.00 34.50 30.55 1b76 s PRO 225 CO -0.29 -1.51 1.16 1.03 -0.33 0.00 0.00 177.00 177.06 1b76 s ARG 226 N 4.83 0.29 -0.10 5.54 0.52 -1.18 -4.88 118.95 123.97 1b76 s ARG 226 Ca 0.60 0.08 -0.09 0.00 -0.52 0.00 0.00 55.73 55.80 1b76 s ARG 226 Cb -0.14 -1.76 -0.04 0.00 0.52 0.00 0.00 34.95 33.54 1b76 s ARG 226 CO 0.32 -2.73 0.38 0.27 0.02 0.00 0.00 175.30 173.55 1b76 n ASN 227 N -4.09 0.19 0.00 0.23 0.23 -1.26 -3.68 115.26 106.87 1b76 n ASN 227 Ca 0.10 0.18 0.00 0.00 -0.53 0.00 0.00 54.58 54.32 1b76 n ASN 227 Cb 0.59 -0.18 0.00 0.00 -2.08 0.00 0.00 39.78 38.12 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 1.19 0.00 0.31 -2.53 7.35 -1.26 -2.34 117.46 120.17 1b76 n PHE 228 Ca 0.09 0.00 0.17 0.00 -0.76 0.00 0.00 57.45 56.95 1b76 n PHE 228 Cb -0.01 0.01 0.76 0.00 0.35 0.00 0.00 39.48 40.58 1b76 n PHE 228 CO 0.00 0.00 0.00 0.82 -0.76 0.00 0.00 176.76 176.82 1b76 h ILE 229 N 0.00 0.00 0.54 -2.13 1.08 -1.94 -3.35 117.51 111.71 1b76 h ILE 229 Ca 0.00 -0.32 -0.02 0.00 -0.39 0.00 0.00 64.86 64.14 1b76 h ILE 229 Cb 0.00 1.23 -0.02 0.00 -3.07 0.00 0.00 36.82 34.96 1b76 h ILE 229 CO 0.00 0.00 -0.44 0.15 -0.69 0.00 0.00 178.15 177.17 1b76 h PHE 230 N 0.00 -1.19 -3.43 1.37 3.57 -1.72 -3.39 116.94 112.14 1b76 h PHE 230 Ca 0.00 0.00 -0.67 0.00 3.53 0.00 0.00 57.97 60.83 1b76 h PHE 230 Cb 0.34 0.45 -0.38 0.00 2.79 0.00 0.00 35.95 39.15 1b76 h PHE 230 CO 0.00 -0.62 -0.43 0.50 -2.23 0.00 0.00 178.31 175.53 1b76 s ARG 231 N -5.95 2.47 0.35 1.11 3.52 -1.24 -4.91 118.95 114.30 1b76 s ARG 231 Ca -0.18 -2.74 0.08 0.00 -0.13 0.00 0.00 55.73 52.77 1b76 s ARG 231 Cb 0.04 -3.61 -0.05 0.00 -1.56 0.00 0.00 34.95 29.78 1b76 s ARG 231 CO 0.61 -1.18 0.09 0.14 -0.81 0.00 0.00 175.30 174.16 1b76 s VAL 232 N -0.44 2.77 -0.40 7.11 -7.23 -1.26 -3.11 120.40 117.83 1b76 s VAL 232 Ca 0.19 -1.81 0.23 0.00 -1.81 0.00 0.00 61.98 58.78 1b76 s VAL 232 Cb -0.19 -2.91 0.14 0.00 0.56 0.00 0.00 36.38 33.99 1b76 s VAL 232 CO -0.05 -0.17 1.33 0.03 -0.31 0.00 0.00 175.10 175.93 1b76 h ARG 233 N 1.64 0.00 -4.18 4.82 3.08 0.41 -3.43 114.38 116.72 1b76 h ARG 233 Ca -0.43 0.00 -0.51 0.00 0.07 0.00 0.00 59.98 59.11 1b76 h ARG 233 Cb 1.25 0.00 -0.37 0.00 0.08 0.00 0.00 29.97 30.94 1b76 h ARG 233 CO 0.66 0.00 -0.80 -2.00 -1.07 0.00 0.00 179.97 176.76 1b76 s GLU 234 N -3.26 1.38 0.36 0.04 2.12 -1.20 -0.75 118.70 117.38 1b76 s GLU 234 Ca 0.04 -0.21 -0.14 0.00 0.36 0.00 0.00 54.97 55.02 1b76 s GLU 234 Cb 0.09 -1.44 0.04 0.00 0.26 0.00 0.00 34.13 33.08 1b76 s GLU 234 CO 0.73 -0.23 0.71 -0.59 -0.54 0.00 0.00 175.26 175.33 1b76 s PHE 235 N 1.58 0.26 0.08 5.30 -0.12 -0.73 -4.69 117.98 119.67 1b76 s PHE 235 Ca 0.02 -0.81 0.02 0.00 -0.05 0.00 0.00 56.93 56.11 1b76 s PHE 235 Cb -0.13 0.62 -0.04 0.00 -0.63 0.00 0.00 43.02 42.84 1b76 s PHE 235 CO -0.06 -1.42 -0.07 -1.83 -0.05 0.00 0.00 175.22 171.79 1b76 s GLU 236 N -2.75 0.76 -0.19 1.99 -1.05 -1.26 0.81 118.70 117.00 1b76 s GLU 236 Ca 0.18 -1.16 -0.15 0.00 -0.15 0.00 0.00 54.97 53.70 1b76 s GLU 236 Cb -0.04 -0.28 0.06 0.00 -0.44 0.00 0.00 34.13 33.42 1b76 s GLU 236 CO 0.12 0.02 0.50 1.14 0.95 0.00 0.00 175.26 177.99 1b76 s GLN 237 N -3.07 0.54 -0.34 -4.83 -2.07 0.35 -1.77 119.66 108.47 1b76 s GLN 237 Ca 0.05 0.79 -0.25 0.00 -1.82 0.00 0.00 55.36 54.13 1b76 s GLN 237 Cb -0.00 0.17 0.01 0.00 -1.09 0.00 0.00 33.01 32.10 1b76 s GLN 237 CO -0.03 -0.11 0.89 0.00 -1.32 0.00 0.00 175.29 174.73 1b76 s MET 238 N 0.78 3.91 0.11 9.60 0.23 -0.82 -2.88 119.30 130.23 1b76 s MET 238 Ca -0.04 0.64 0.07 0.00 -1.03 0.00 0.00 55.69 55.33 1b76 s MET 238 Cb -0.05 -3.77 -0.04 0.00 -1.53 0.00 0.00 34.83 29.44 1b76 s MET 238 CO -0.06 -0.84 -0.11 -1.21 -2.03 0.00 0.00 175.02 170.77 1b76 s GLU 239 N 3.29 2.08 -0.04 3.16 2.02 0.11 -2.79 118.70 126.54 1b76 s GLU 239 Ca 0.37 -1.05 0.04 0.00 0.02 0.00 0.00 54.97 54.35 1b76 s GLU 239 Cb -0.13 -2.28 -0.00 0.00 0.10 0.00 0.00 34.13 31.82 1b76 s GLU 239 CO 0.16 0.50 -0.16 0.42 0.02 0.00 0.00 175.26 176.20 1b76 s ILE 240 N -1.21 1.33 -0.53 -1.63 1.01 -1.05 -0.41 121.20 118.71 1b76 s ILE 240 Ca 0.21 -0.67 0.04 0.00 0.00 0.00 0.00 60.65 60.22 1b76 s ILE 240 Cb -0.11 -1.14 0.14 0.00 0.01 0.00 0.00 42.46 41.36 1b76 s ILE 240 CO 0.13 0.39 0.30 -1.61 0.00 0.00 0.00 174.94 174.15 1b76 s GLU 241 N -0.02 1.91 -0.62 2.79 0.41 -1.07 -3.18 118.70 118.91 1b76 s GLU 241 Ca -0.02 -2.63 -0.28 0.00 -0.41 0.00 0.00 54.97 51.64 1b76 s GLU 241 Cb -0.10 -3.11 0.03 0.00 -1.78 0.00 0.00 34.13 29.17 1b76 s GLU 241 CO 0.01 -1.16 1.28 -0.47 -0.49 0.00 0.00 175.26 174.44 1b76 s TYR 242 N -0.37 2.42 -0.43 1.61 5.04 -0.84 -1.54 117.35 123.24 1b76 s TYR 242 Ca 0.19 0.31 -0.26 0.00 -2.44 0.00 0.00 57.07 54.86 1b76 s TYR 242 Cb -0.21 -4.51 0.02 0.00 0.35 0.00 0.00 41.96 37.61 1b76 s TYR 242 CO -0.03 -1.83 0.97 -0.06 -1.34 0.00 0.00 175.55 173.25 1b76 s PHE 243 N 5.52 2.97 0.16 4.97 0.08 0.29 -2.15 117.98 129.81 1b76 s PHE 243 Ca 0.43 0.60 0.08 0.00 0.12 0.00 0.00 56.93 58.16 1b76 s PHE 243 Cb -0.08 -3.93 -0.04 0.00 -0.57 0.00 0.00 43.02 38.40 1b76 s PHE 243 CO 0.22 -1.02 -0.17 0.54 -0.10 0.00 0.00 175.22 174.69 1b76 s VAL 244 N 3.77 1.69 0.48 -0.44 0.11 -0.32 -3.17 120.40 122.52 1b76 s VAL 244 Ca 0.39 -1.90 -0.24 0.00 -2.93 0.00 0.00 61.98 57.30 1b76 s VAL 244 Cb -0.10 -1.79 -0.07 0.00 -1.53 0.00 0.00 36.38 32.89 1b76 s VAL 244 CO 0.24 -0.37 1.42 -0.60 -3.33 0.00 0.00 175.10 172.46 1b76 s ARG 245 N -2.86 3.49 0.04 1.54 3.52 -1.26 0.33 118.95 123.74 1b76 s ARG 245 Ca 0.15 2.39 -0.07 0.00 -0.13 0.00 0.00 55.73 58.06 1b76 s ARG 245 Cb -0.05 -2.52 -0.02 0.00 -1.56 0.00 0.00 34.95 30.80 1b76 s ARG 245 CO 0.06 -0.97 0.83 -2.30 -0.81 0.00 0.00 175.30 172.11 1b76 n PRO 246 N -0.48 -0.10 -0.31 5.12 -0.02 -1.26 -2.58 135.00 135.37 1b76 n PRO 246 Ca 0.07 0.82 0.08 0.00 -2.02 0.00 0.00 63.50 62.45 1b76 n PRO 246 Cb 0.43 -1.22 0.29 0.00 -0.02 0.00 0.00 33.50 32.98 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 1.38 0.74 -1.23 0.00 -2.02 -3.11 103.07 98.84 1b76 h GLY 247 Ca 0.04 -0.37 0.00 0.00 0.00 0.00 0.00 47.33 46.99 1b76 h GLY 247 CO -0.22 0.17 0.00 1.18 0.00 0.00 0.00 176.54 177.67 1b76 n GLU 248 N -4.56 0.65 -0.05 4.80 1.02 -1.06 -4.14 120.64 117.29 1b76 n GLU 248 Ca 0.17 0.00 -0.08 0.00 -0.02 0.00 0.00 57.16 57.22 1b76 n GLU 248 Cb 0.35 -1.37 -0.02 0.00 -0.02 0.00 0.00 31.44 30.38 1b76 n GLU 248 CO 0.00 0.00 0.00 0.38 1.18 0.00 0.00 177.13 178.69 1b76 h ASP 249 N 0.00 -0.01 -1.02 1.62 3.04 -1.66 -2.09 116.42 116.30 1b76 h ASP 249 Ca 0.00 0.04 0.32 0.00 -3.24 0.00 0.00 57.03 54.15 1b76 h ASP 249 Cb 0.00 0.05 -0.14 0.00 -1.04 0.00 0.00 39.33 38.20 1b76 h ASP 249 CO 0.00 0.03 0.59 -0.33 -2.04 0.00 0.00 179.24 177.49 1b76 h GLU 250 N 0.12 0.32 0.19 4.15 4.39 -1.87 0.07 114.58 121.94 1b76 h GLU 250 Ca 0.10 -0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.78 1b76 h GLU 250 Cb 0.11 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 28.69 1b76 h GLU 250 CO -0.14 0.21 -0.09 -0.92 -1.16 0.00 0.00 179.01 176.90 1b76 h TYR 251 N 0.33 -0.23 -1.00 4.33 3.20 -1.70 -3.28 116.97 118.61 1b76 h TYR 251 Ca 0.73 -0.01 0.20 0.00 3.14 0.00 0.00 58.73 62.79 1b76 h TYR 251 Cb 1.70 0.08 -0.11 0.00 1.54 0.00 0.00 36.73 39.94 1b76 h TYR 251 CO -0.01 -0.06 0.61 -1.49 -1.64 0.00 0.00 178.16 175.57 1b76 h TRP 252 N -1.05 1.05 -0.79 -3.82 4.06 -0.69 0.38 115.95 115.09 1b76 h TRP 252 Ca -0.03 0.03 0.00 0.00 2.06 0.00 0.00 58.89 60.96 1b76 h TRP 252 Cb 0.27 -0.31 -0.04 0.00 -1.00 0.00 0.00 29.16 28.08 1b76 h TRP 252 CO 0.02 0.21 0.50 1.25 -3.56 0.00 0.00 178.44 176.85 1b76 h HIS 253 N 0.73 1.01 0.17 0.49 2.76 -1.15 0.42 115.15 119.59 1b76 h HIS 253 Ca 0.59 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.76 1b76 h HIS 253 Cb 0.97 -0.34 0.00 0.00 1.55 0.00 0.00 27.41 29.59 1b76 h HIS 253 CO -0.00 0.66 -0.08 -0.09 -1.30 0.00 0.00 177.93 177.11 1b76 h ARG 254 N 1.08 -0.22 -0.92 5.26 9.65 -0.43 -2.09 114.38 126.71 1b76 h ARG 254 Ca 0.29 0.02 0.11 0.00 -1.10 0.00 0.00 59.98 59.29 1b76 h ARG 254 Cb -0.08 0.05 -0.13 0.00 -1.39 0.00 0.00 29.97 28.42 1b76 h ARG 254 CO -0.06 0.14 -0.52 -0.92 2.80 0.00 0.00 179.97 181.41 1b76 h TYR 255 N -0.63 -1.60 -0.16 2.20 3.20 0.02 0.67 116.97 120.68 1b76 h TYR 255 Ca -0.02 0.12 -0.02 0.00 3.14 0.00 0.00 58.73 61.94 1b76 h TYR 255 Cb 0.46 0.82 -0.01 0.00 1.54 0.00 0.00 36.73 39.55 1b76 h TYR 255 CO 0.04 -0.39 0.02 -1.49 -1.64 0.00 0.00 178.16 174.70 1b76 h TRP 256 N -0.05 0.29 -0.85 -3.82 4.06 -0.96 0.31 115.95 114.94 1b76 h TRP 256 Ca 0.21 -0.04 0.10 0.00 2.06 0.00 0.00 58.89 61.21 1b76 h TRP 256 Cb 0.49 -0.08 -0.07 0.00 -1.00 0.00 0.00 29.16 28.50 1b76 h TRP 256 CO -0.94 0.45 0.49 0.28 -3.56 0.00 0.00 178.44 175.16 1b76 h VAL 257 N 0.04 0.92 0.88 1.49 2.07 -0.56 0.49 116.25 121.57 1b76 h VAL 257 Ca 0.05 -0.28 -0.04 0.00 0.82 0.00 0.00 66.70 67.24 1b76 h VAL 257 Cb 0.32 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.11 1b76 h VAL 257 CO 0.00 0.15 -0.46 -0.08 0.02 0.00 0.00 177.57 177.21 1b76 h GLU 258 N 0.82 -1.18 0.07 1.57 4.81 -0.77 -1.15 114.58 118.76 1b76 h GLU 258 Ca 0.41 0.08 0.02 0.00 -0.13 0.00 0.00 59.36 59.74 1b76 h GLU 258 Cb 0.37 0.27 -0.05 0.00 0.63 0.00 0.00 28.75 29.96 1b76 h GLU 258 CO -0.25 -0.78 -0.43 1.49 -0.73 0.00 0.00 179.01 178.31 1b76 h GLU 259 N -1.22 -0.60 -0.37 1.92 4.57 -0.04 0.27 114.58 119.11 1b76 h GLU 259 Ca -0.12 0.04 0.11 0.00 -1.18 0.00 0.00 59.36 58.21 1b76 h GLU 259 Cb 0.95 0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 29.66 1b76 h GLU 259 CO 0.17 -0.40 0.28 0.00 -1.18 0.00 0.00 179.01 177.88 1b76 h ARG 260 N -0.63 0.00 -0.12 1.92 2.47 -0.06 0.59 114.38 118.56 1b76 h ARG 260 Ca 0.03 0.00 -0.13 0.00 -1.26 0.00 0.00 59.98 58.62 1b76 h ARG 260 Cb 0.67 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.00 1b76 h ARG 260 CO -0.28 0.00 -0.44 1.25 0.56 0.00 0.00 179.97 181.06 1b76 h LEU 261 N 0.00 0.60 -0.46 3.04 7.12 0.14 -2.57 115.31 123.18 1b76 h LEU 261 Ca 0.17 -0.61 0.08 0.00 0.13 0.00 0.00 57.88 57.65 1b76 h LEU 261 Cb 0.73 -0.18 -0.07 0.00 -0.53 0.00 0.00 40.66 40.61 1b76 h LEU 261 CO -0.00 1.11 0.06 0.50 -0.13 0.00 0.00 178.44 179.98 1b76 h LYS 262 N 0.13 0.18 0.72 1.25 3.64 0.35 -2.98 116.57 119.86 1b76 h LYS 262 Ca -0.02 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.31 1b76 h LYS 262 Cb 1.07 -0.04 0.01 0.00 -0.41 0.00 0.00 32.23 32.86 1b76 h LYS 262 CO 0.09 0.12 -0.35 2.35 -2.27 0.00 0.00 179.45 179.39 1b76 h TRP 263 N 0.18 -0.90 -0.98 1.91 7.01 -0.84 -3.04 115.95 119.28 1b76 h TRP 263 Ca 0.23 -0.02 0.28 0.00 2.11 0.00 0.00 58.89 61.50 1b76 h TRP 263 Cb 0.32 0.30 -0.04 0.00 -2.10 0.00 0.00 29.16 27.64 1b76 h TRP 263 CO -0.25 -0.54 0.79 -1.49 -2.79 0.00 0.00 178.44 174.16 1b76 h TRP 264 N -1.06 0.00 -0.09 2.65 4.06 -1.31 0.85 115.95 121.05 1b76 h TRP 264 Ca -0.10 0.00 -0.05 0.00 2.06 0.00 0.00 58.89 60.80 1b76 h TRP 264 Cb 0.76 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.92 1b76 h TRP 264 CO -0.01 0.00 -0.15 1.96 -3.56 0.00 0.00 178.44 176.68 1b76 h GLN 265 N 0.00 0.25 -0.03 0.49 4.20 -1.43 -2.43 115.11 116.16 1b76 h GLN 265 Ca 0.47 -0.16 0.01 0.00 0.06 0.00 0.00 58.65 59.03 1b76 h GLN 265 Cb 2.04 0.02 -0.00 0.00 0.30 0.00 0.00 27.48 29.83 1b76 h GLN 265 CO -0.00 0.73 0.04 0.93 -0.67 0.00 0.00 178.83 179.86 1b76 h GLU 266 N -0.21 0.00 -0.00 1.46 5.08 0.78 0.28 114.58 121.98 1b76 h GLU 266 Ca 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1b76 h GLU 266 Cb 0.72 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.97 1b76 h GLU 266 CO 0.03 0.00 -0.05 -1.33 -1.00 0.00 0.00 179.01 176.66 1b76 n MET 267 N -3.55 0.11 0.00 2.33 2.81 -0.64 -4.92 117.12 113.26 1b76 n MET 267 Ca -0.02 -0.01 0.00 0.00 -1.81 0.00 0.00 57.70 55.86 1b76 n MET 267 Cb 0.13 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.14 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 1.45 0.93 3.66 3.03 0.00 1.00 -4.66 105.19 110.59 1b76 n GLY 268 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 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 4.40 0.29 0.99 1.43 -0.94 -4.94 118.68 119.91 1b76 s LEU 269 Ca 0.00 2.58 -0.29 0.00 -1.03 0.00 0.00 54.13 55.39 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 -1.04 1.22 -0.94 0.23 0.00 0.00 176.35 175.82 1b76 s SER 270 N 4.28 6.99 0.39 2.29 1.04 -1.26 -3.79 113.70 123.63 1b76 s SER 270 Ca 0.86 2.48 0.12 0.00 0.48 0.00 0.00 55.95 59.89 1b76 s SER 270 Cb -0.41 -2.64 0.93 0.00 0.10 0.00 0.00 66.02 64.00 1b76 s SER 270 CO 0.39 -0.38 1.88 -0.09 0.98 0.00 0.00 173.24 176.03 1b76 h ARG 271 N 3.82 0.55 -0.71 4.02 9.65 -1.92 0.12 114.38 129.91 1b76 h ARG 271 Ca -0.47 -0.03 0.16 0.00 -1.10 0.00 0.00 59.98 58.53 1b76 h ARG 271 Cb 1.22 -0.12 -0.04 0.00 -1.39 0.00 0.00 29.97 29.63 1b76 h ARG 271 CO 0.67 0.36 0.48 0.93 2.80 0.00 0.00 179.97 185.22 1b76 h GLU 272 N 0.57 0.25 -0.01 0.20 3.07 -2.02 -1.48 114.58 115.15 1b76 h GLU 272 Ca 0.42 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.27 1b76 h GLU 272 Cb 0.82 -0.06 0.00 0.00 -0.84 0.00 0.00 28.75 28.67 1b76 h GLU 272 CO -0.17 0.16 -0.44 0.09 -1.40 0.00 0.00 179.01 177.25 1b76 n ASN 273 N -4.43 1.49 -4.76 1.42 3.02 0.42 -4.88 115.26 107.54 1b76 n ASN 273 Ca 0.14 -1.17 -0.36 0.00 -0.03 0.00 0.00 54.58 53.15 1b76 n ASN 273 Cb 0.60 0.38 -0.07 0.00 -0.61 0.00 0.00 39.78 40.08 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 -2.56 4.26 -0.05 3.41 1.43 -0.56 -2.06 118.68 122.56 1b76 s LEU 274 Ca 0.19 0.36 0.04 0.00 -1.03 0.00 0.00 54.13 53.70 1b76 s LEU 274 Cb 0.18 -2.17 -0.00 0.00 0.03 0.00 0.00 46.19 44.23 1b76 s LEU 274 CO 0.58 0.21 -0.17 -0.69 0.23 0.00 0.00 176.35 176.51 1b76 s VAL 275 N 0.09 1.44 -1.05 -1.59 1.01 0.31 -4.95 120.40 115.65 1b76 s VAL 275 Ca 0.12 -0.71 -0.03 0.00 0.00 0.00 0.00 61.98 61.36 1b76 s VAL 275 Cb -0.12 -1.25 0.31 0.00 0.00 0.00 0.00 36.38 35.33 1b76 s VAL 275 CO 0.01 0.42 1.62 -2.65 0.00 0.00 0.00 175.10 174.49 1b76 n PRO 276 N 3.24 4.86 -1.80 2.72 -0.02 -1.26 0.70 135.00 143.44 1b76 n PRO 276 Ca -0.19 -4.61 -0.41 0.00 -2.02 0.00 0.00 63.50 56.27 1b76 n PRO 276 Cb 0.53 -2.49 -0.01 0.00 -0.02 0.00 0.00 33.50 31.50 1b76 n PRO 276 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1b76 s TYR 277 N -3.43 2.76 -0.38 6.00 5.04 -0.85 -4.78 117.35 121.72 1b76 s TYR 277 Ca 0.34 0.85 -0.07 0.00 -2.44 0.00 0.00 57.07 55.76 1b76 s TYR 277 Cb 0.11 -4.04 0.07 0.00 0.35 0.00 0.00 41.96 38.44 1b76 s TYR 277 CO 0.01 -3.44 0.17 -1.14 -1.34 0.00 0.00 175.55 169.82 1b76 s GLN 278 N -0.69 2.51 0.04 4.97 2.00 -1.26 -0.40 119.66 126.83 1b76 s GLN 278 Ca 0.62 -1.39 -0.30 0.00 -2.00 0.00 0.00 55.36 52.29 1b76 s GLN 278 Cb -0.47 -3.58 -0.08 0.00 0.80 0.00 0.00 33.01 29.68 1b76 s GLN 278 CO 0.49 -0.83 1.75 1.14 -0.50 0.00 0.00 175.29 177.34 1b76 s GLN 279 N 1.36 4.17 0.19 1.67 -2.07 -1.01 -4.98 119.66 118.99 1b76 s GLN 279 Ca 0.01 2.40 -0.29 0.00 -1.82 0.00 0.00 55.36 55.66 1b76 s GLN 279 Cb -0.21 -3.83 -0.08 0.00 -1.09 0.00 0.00 33.01 27.80 1b76 s GLN 279 CO 0.01 -0.83 0.92 -1.25 -1.32 0.00 0.00 175.29 172.82 1b76 s PRO 280 N 3.44 4.77 0.00 9.60 0.04 -1.26 -4.41 135.00 147.18 1b76 s PRO 280 Ca 0.78 1.42 0.00 0.00 0.04 0.00 0.00 61.00 63.24 1b76 s PRO 280 Cb -0.40 -3.31 0.00 0.00 0.04 0.00 0.00 34.50 30.84 1b76 s PRO 280 CO 0.34 0.43 0.00 -0.35 0.04 0.00 0.00 177.00 177.47 1b76 n PRO 281 N 1.91 0.00 0.19 0.56 -0.04 -1.26 0.21 135.00 136.57 1b76 n PRO 281 Ca -0.01 0.00 0.18 0.00 -0.04 0.00 0.00 63.50 63.63 1b76 n PRO 281 Cb 0.48 0.00 0.78 0.00 -0.04 0.00 0.00 33.50 34.72 1b76 n PRO 281 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 1b76 h GLU 282 N 0.00 0.00 0.00 0.54 9.09 -2.02 -1.35 114.58 120.84 1b76 h GLU 282 Ca 0.00 0.00 -0.20 0.00 0.05 0.00 0.00 59.36 59.21 1b76 h GLU 282 Cb 0.00 0.00 -0.04 0.00 -1.65 0.00 0.00 28.75 27.06 1b76 h GLU 282 CO 0.00 0.00 -1.74 -1.13 0.05 0.00 0.00 179.01 176.19 1b76 n SER 283 N -3.42 2.40 -4.52 3.06 3.41 0.58 -4.90 113.62 110.23 1b76 n SER 283 Ca 0.03 -0.01 -0.14 0.00 -0.26 0.00 0.00 58.87 58.50 1b76 n SER 283 Cb 0.51 0.68 -0.10 0.00 -0.26 0.00 0.00 64.21 65.03 1b76 n SER 283 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1b76 n SER 284 N -2.44 0.94 -4.62 4.04 2.88 -0.51 -4.84 113.62 109.07 1b76 n SER 284 Ca -0.18 -1.50 -0.45 0.00 -1.33 0.00 0.00 58.87 55.41 1b76 n SER 284 Cb 0.84 -1.42 -0.02 0.00 -0.75 0.00 0.00 64.21 62.86 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 15.91 0.17 0.00 -1.46 0.00 -1.26 -4.78 120.51 129.08 1b76 n ALA 285 Ca 0.47 0.41 0.00 0.00 0.00 0.00 0.00 53.44 54.32 1b76 n ALA 285 Cb 0.39 -2.11 0.00 0.00 0.00 0.00 0.00 19.45 17.73 1b76 n ALA 285 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 1b76 n HIS 286 N 0.88 0.00 0.22 0.00 1.44 -1.26 -0.42 115.22 116.08 1b76 n HIS 286 Ca 0.10 0.00 0.18 0.00 -2.01 0.00 0.00 57.72 55.99 1b76 n HIS 286 Cb 0.31 0.00 0.86 0.00 0.12 0.00 0.00 29.99 31.27 1b76 n HIS 286 CO 0.00 0.00 0.00 0.10 -2.81 0.00 0.00 176.34 173.63 1b76 h TYR 287 N 0.00 0.00 -3.50 -1.40 -0.00 -1.98 -3.40 116.97 106.69 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 -0.11 0.00 -0.00 0.00 0.00 36.73 36.62 1b76 h TYR 287 CO 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 178.16 178.15 1b76 s ALA 288 N -4.51 3.56 -0.05 0.10 0.00 0.44 -3.07 121.76 118.24 1b76 s ALA 288 Ca -0.04 -0.46 -0.26 0.00 0.00 0.00 0.00 51.96 51.19 1b76 s ALA 288 Cb 0.14 -2.86 -0.21 0.00 0.00 0.00 0.00 23.12 20.19 1b76 s ALA 288 CO 0.50 -0.57 1.14 -0.22 0.00 0.00 0.00 175.76 176.61 1b76 h LYS 289 N 7.67 -0.02 -4.21 0.00 3.64 -1.71 -3.41 116.57 118.51 1b76 h LYS 289 Ca -0.32 0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 58.94 1b76 h LYS 289 Cb 1.15 0.01 -0.16 0.00 -0.41 0.00 0.00 32.23 32.82 1b76 h LYS 289 CO 0.74 0.55 -0.68 0.00 -2.27 0.00 0.00 179.45 177.79 1b76 s ALA 290 N -3.83 0.47 -0.29 5.00 0.00 -1.26 -4.96 121.76 116.89 1b76 s ALA 290 Ca -0.16 -1.14 -0.14 0.00 0.00 0.00 0.00 51.96 50.51 1b76 s ALA 290 Cb 0.01 0.26 0.14 0.00 0.00 0.00 0.00 23.12 23.52 1b76 s ALA 290 CO 0.66 -0.35 0.86 -0.08 0.00 0.00 0.00 175.76 176.85 1b76 s THR 291 N -3.65 -0.44 -0.18 0.00 -1.32 -1.26 -1.17 115.64 107.61 1b76 s THR 291 Ca 0.05 0.00 -0.09 0.00 -1.21 0.00 0.00 61.69 60.44 1b76 s THR 291 Cb 0.06 -1.00 -0.05 0.00 -1.51 0.00 0.00 72.50 70.00 1b76 s THR 291 CO -0.09 0.00 0.12 -0.69 -2.21 0.00 0.00 174.62 171.75 1b76 s VAL 292 N 2.20 5.34 -0.10 5.08 1.01 -0.83 -2.39 120.40 130.71 1b76 s VAL 292 Ca -0.06 0.16 -0.02 0.00 0.00 0.00 0.00 61.98 62.06 1b76 s VAL 292 Cb -0.07 -3.41 -0.03 0.00 0.00 0.00 0.00 36.38 32.87 1b76 s VAL 292 CO -0.18 0.48 0.01 -1.81 0.00 0.00 0.00 175.10 173.61 1b76 s ASP 293 N 0.05 5.29 -0.48 3.32 1.01 0.46 -0.59 116.67 125.74 1b76 s ASP 293 Ca 0.09 0.14 -0.16 0.00 0.71 0.00 0.00 52.55 53.33 1b76 s ASP 293 Cb -0.11 -1.55 0.07 0.00 1.01 0.00 0.00 42.92 42.34 1b76 s ASP 293 CO -0.00 0.36 0.44 -0.63 0.21 0.00 0.00 175.17 175.54 1b76 s ILE 294 N -0.76 5.18 0.34 0.77 1.01 0.05 -2.00 121.20 125.79 1b76 s ILE 294 Ca 0.12 -0.98 -0.17 0.00 0.00 0.00 0.00 60.65 59.62 1b76 s ILE 294 Cb -0.12 -4.16 -0.09 0.00 0.01 0.00 0.00 42.46 38.10 1b76 s ILE 294 CO 0.02 -0.62 0.79 -0.76 0.00 0.00 0.00 174.94 174.37 1b76 s LEU 295 N 1.81 4.07 -0.01 2.97 2.01 0.22 -0.56 118.68 129.18 1b76 s LEU 295 Ca 0.06 1.40 0.04 0.00 0.01 0.00 0.00 54.13 55.64 1b76 s LEU 295 Cb -0.24 -4.14 -0.01 0.00 0.01 0.00 0.00 46.19 41.82 1b76 s LEU 295 CO 0.07 -0.22 -0.12 -0.47 1.01 0.00 0.00 176.35 176.63 1b76 s TYR 296 N -1.98 1.12 -1.12 0.29 5.04 0.36 -0.53 117.35 120.52 1b76 s TYR 296 Ca 0.55 -0.22 -0.23 0.00 -2.44 0.00 0.00 57.07 54.73 1b76 s TYR 296 Cb -0.11 -0.72 -0.10 0.00 0.35 0.00 0.00 41.96 41.38 1b76 s TYR 296 CO 0.17 -0.03 1.93 0.54 -1.34 0.00 0.00 175.55 176.82 1b76 n ARG 297 N 2.82 1.56 -1.72 4.97 5.12 -0.87 -1.67 116.66 126.87 1b76 n ARG 297 Ca -0.14 -2.37 -0.33 0.00 -1.93 0.00 0.00 57.85 53.08 1b76 n ARG 297 Cb 0.56 -3.61 0.05 0.00 -1.16 0.00 0.00 32.46 28.30 1b76 n ARG 297 CO 0.00 0.00 0.00 -0.06 -1.93 0.00 0.00 177.63 175.64 1b76 s PHE 298 N 10.24 2.54 0.24 -1.55 0.08 -0.89 -4.86 117.98 123.78 1b76 s PHE 298 Ca 0.67 1.56 -0.07 0.00 0.12 0.00 0.00 56.93 59.20 1b76 s PHE 298 Cb 0.02 -3.21 0.42 0.00 -0.57 0.00 0.00 43.02 39.68 1b76 s PHE 298 CO 0.14 -1.81 1.64 -1.35 -0.10 0.00 0.00 175.22 173.73 1b76 h PRO 299 N 0.01 0.10 0.00 0.24 0.11 -1.82 0.36 132.00 130.99 1b76 h PRO 299 Ca -0.47 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1b76 h PRO 299 Cb 1.25 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1b76 h PRO 299 CO 0.53 0.07 0.00 -2.39 -0.21 0.00 0.00 178.00 176.00 1b76 n HIS 300 N -5.34 0.00 0.00 0.65 1.44 -1.26 -4.89 115.22 105.81 1b76 n HIS 300 Ca 0.13 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.84 1b76 n HIS 300 Cb 0.46 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.57 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 0.36 3.76 3.55 -1.39 0.00 0.13 -5.00 105.19 106.60 1b76 n GLY 301 Ca 0.15 -1.72 -0.28 0.00 0.00 0.00 0.00 46.02 44.17 1b76 n GLY 301 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1b76 s SER 302 N 0.00 4.43 0.49 1.61 0.15 -1.26 -2.10 113.70 117.02 1b76 s SER 302 Ca 0.00 0.48 0.02 0.00 0.70 0.00 0.00 55.95 57.15 1b76 s SER 302 Cb 0.00 -2.53 -0.02 0.00 -1.71 0.00 0.00 66.02 61.76 1b76 s SER 302 CO 0.00 -3.13 0.01 -0.76 1.20 0.00 0.00 173.24 170.56 1b76 s LEU 303 N 12.45 2.41 0.25 3.45 1.43 -0.67 -4.80 118.68 133.20 1b76 s LEU 303 Ca 0.89 -1.60 -0.31 0.00 -1.03 0.00 0.00 54.13 52.09 1b76 s LEU 303 Cb -0.14 -0.77 -0.11 0.00 0.03 0.00 0.00 46.19 45.19 1b76 s LEU 303 CO 0.17 -0.78 1.64 -0.70 0.23 0.00 0.00 176.35 176.91 1b76 s GLU 304 N -3.85 4.13 -0.08 1.70 2.12 -1.26 -0.49 118.70 120.97 1b76 s GLU 304 Ca 0.11 2.58 -0.02 0.00 0.36 0.00 0.00 54.97 58.00 1b76 s GLU 304 Cb 0.03 -3.05 -0.04 0.00 0.26 0.00 0.00 34.13 31.33 1b76 s GLU 304 CO 0.06 -0.67 -0.09 -0.11 -0.54 0.00 0.00 175.26 173.91 1b76 n LEU 305 N 2.94 1.42 -4.03 2.70 7.94 0.27 -4.81 117.00 123.44 1b76 n LEU 305 Ca 0.11 0.05 -0.08 0.00 -1.11 0.00 0.00 56.01 54.98 1b76 n LEU 305 Cb 0.37 -0.24 -0.10 0.00 0.53 0.00 0.00 43.42 43.98 1b76 n LEU 305 CO 0.64 0.33 -0.31 -0.70 -1.11 0.00 0.00 177.39 176.23 1b76 s GLU 306 N -2.15 0.61 -0.27 1.96 2.12 -1.16 -3.16 118.70 116.65 1b76 s GLU 306 Ca -0.11 -1.08 -0.02 0.00 0.36 0.00 0.00 54.97 54.13 1b76 s GLU 306 Cb 0.04 0.22 0.09 0.00 0.26 0.00 0.00 34.13 34.73 1b76 s GLU 306 CO 0.15 -0.13 0.09 0.20 -0.54 0.00 0.00 175.26 175.03 1b76 s GLY 307 N -2.68 0.83 -0.77 -1.50 0.00 0.12 -0.77 107.32 102.55 1b76 s GLY 307 Ca 0.03 -1.26 -0.23 0.00 0.00 0.00 0.00 44.72 43.27 1b76 s GLY 307 CO -0.09 1.66 1.12 -0.42 0.00 0.00 0.00 173.10 175.38 1b76 s ILE 308 N 1.80 4.22 0.55 0.90 1.09 0.25 -2.08 121.20 127.92 1b76 s ILE 308 Ca 0.06 -0.48 -0.04 0.00 -1.10 0.00 0.00 60.65 59.10 1b76 s ILE 308 Cb -0.17 -4.80 0.01 0.00 -1.06 0.00 0.00 42.46 36.44 1b76 s ILE 308 CO -0.23 -1.61 0.83 0.00 -0.10 0.00 0.00 174.94 173.83 1b76 s ALA 309 N 4.28 3.44 -0.49 9.38 0.00 0.37 -1.96 121.76 136.77 1b76 s ALA 309 Ca 0.30 -0.80 0.08 0.00 0.00 0.00 0.00 51.96 51.54 1b76 s ALA 309 Cb -0.11 -2.47 0.34 0.00 0.00 0.00 0.00 23.12 20.89 1b76 s ALA 309 CO 0.05 -0.68 0.86 0.94 0.00 0.00 0.00 175.76 176.93 1b76 n GLN 310 N -2.44 2.27 -1.07 0.00 -0.06 -0.32 -0.28 117.38 115.49 1b76 n GLN 310 Ca 0.04 -4.23 -0.34 0.00 -2.00 0.00 0.00 57.00 50.46 1b76 n GLN 310 Cb 0.58 -2.01 0.10 0.00 -4.06 0.00 0.00 30.24 24.85 1b76 n GLN 310 CO 0.00 0.00 0.00 2.89 -0.20 0.00 0.00 177.06 179.75 1b76 n ARG 311 N -0.02 0.08 0.00 3.69 0.00 -1.02 -2.53 116.66 116.86 1b76 n ARG 311 Ca 0.28 0.08 0.00 0.00 -0.00 0.00 0.00 57.85 58.22 1b76 n ARG 311 Cb 0.51 -2.02 0.00 0.00 -0.00 0.00 0.00 32.46 30.94 1b76 n ARG 311 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.63 177.88 1b76 n THR 312 N -3.04 0.00 -1.90 8.89 -2.24 -1.17 -2.84 114.28 111.98 1b76 n THR 312 Ca 0.10 0.13 0.00 0.00 -2.27 0.00 0.00 64.05 62.01 1b76 n THR 312 Cb 0.51 -1.03 0.00 0.00 -2.10 0.00 0.00 70.33 67.71 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 -1.64 0.00 -0.13 3.42 5.75 -1.26 -1.07 116.55 121.62 1b76 n ASP 313 Ca 0.00 -1.39 -0.04 0.00 -0.01 0.00 0.00 54.79 53.35 1b76 n ASP 313 Cb 0.00 -0.08 0.16 0.00 -1.03 0.00 0.00 41.12 40.17 1b76 n ASP 313 CO 0.00 0.00 0.00 0.15 -0.11 0.00 0.00 177.20 177.24 1b76 h PHE 314 N 0.00 0.88 0.00 2.11 3.57 -1.89 -0.74 116.94 120.86 1b76 h PHE 314 Ca 0.00 -0.10 0.00 0.00 3.53 0.00 0.00 57.97 61.40 1b76 h PHE 314 Cb 1.16 -0.25 0.00 0.00 2.79 0.00 0.00 35.95 39.65 1b76 h PHE 314 CO -0.08 0.77 0.00 -0.25 -2.23 0.00 0.00 178.31 176.52 1b76 n ASP 315 N -4.24 0.00 -0.28 0.41 8.00 -1.26 -0.16 116.55 119.02 1b76 n ASP 315 Ca 0.03 0.82 0.23 0.00 0.71 0.00 0.00 54.79 56.58 1b76 n ASP 315 Cb 0.27 -0.48 0.54 0.00 -0.02 0.00 0.00 41.12 41.43 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 0.37 0.62 0.64 3.38 -1.90 -1.58 115.31 116.84 1b76 h LEU 316 Ca 0.00 0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 1b76 h LEU 316 Cb 0.00 -0.01 0.01 0.00 0.09 0.00 0.00 40.66 40.75 1b76 h LEU 316 CO 0.00 0.11 -0.30 1.23 0.09 0.00 0.00 178.44 179.57 1b76 h GLY 317 N 0.34 -0.86 1.24 0.83 0.00 -1.09 0.35 103.07 103.88 1b76 h GLY 317 Ca 0.53 0.32 0.00 0.00 0.00 0.00 0.00 47.33 48.18 1b76 h GLY 317 CO -0.21 -0.31 0.19 1.44 0.00 0.00 0.00 176.54 177.65 1b76 n SER 318 N -4.42 0.00 0.00 0.19 7.64 0.78 -0.31 113.62 117.51 1b76 n SER 318 Ca -0.10 0.31 0.00 0.00 1.01 0.00 0.00 58.87 60.08 1b76 n SER 318 Cb 0.33 -0.31 0.00 0.00 -1.01 0.00 0.00 64.21 63.22 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 -1.30 0.00 -4.01 1.43 -0.00 -0.96 -4.78 115.22 105.60 1b76 n HIS 319 Ca 0.00 -0.25 -0.23 0.00 -0.00 0.00 0.00 57.72 57.25 1b76 n HIS 319 Cb 0.19 -0.02 -0.03 0.00 -0.00 0.00 0.00 29.99 30.12 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 -0.49 5.02 0.31 1.59 -1.32 0.58 -4.71 115.64 116.62 1b76 s THR 320 Ca 0.00 -1.03 -0.21 0.00 -1.21 0.00 0.00 61.69 59.25 1b76 s THR 320 Cb 0.00 -3.68 -0.09 0.00 -1.51 0.00 0.00 72.50 67.22 1b76 s THR 320 CO 0.00 -0.26 0.83 -0.75 -2.21 0.00 0.00 174.62 172.22 1b76 s LYS 321 N -3.71 4.28 -1.32 7.08 2.36 -0.15 -4.28 119.74 124.01 1b76 s LYS 321 Ca 0.34 0.99 -0.07 0.00 -2.55 0.00 0.00 55.97 54.68 1b76 s LYS 321 Cb -0.09 -2.63 -0.00 0.00 -1.05 0.00 0.00 37.83 34.06 1b76 s LYS 321 CO 0.27 0.23 0.55 -0.40 1.55 0.00 0.00 175.35 177.55 1b76 n ASP 322 N 0.18 -1.85 0.22 1.43 5.68 -1.26 -4.60 116.55 116.35 1b76 n ASP 322 Ca 0.02 -1.01 0.15 0.00 -0.50 0.00 0.00 54.79 53.45 1b76 n ASP 322 Cb 0.52 -3.17 0.61 0.00 -1.14 0.00 0.00 41.12 37.93 1b76 n ASP 322 CO 0.00 0.00 0.00 1.56 -1.33 0.00 0.00 177.20 177.43 1b76 h GLN 323 N -1.88 0.00 -0.00 0.11 4.20 -1.89 -1.35 115.11 114.29 1b76 h GLN 323 Ca -0.64 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.03 1b76 h GLN 323 Cb 1.37 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.15 1b76 h GLN 323 CO 0.58 0.00 -0.15 1.05 -0.67 0.00 0.00 178.83 179.64 1b76 h GLU 324 N 0.00 0.10 0.36 1.46 9.09 -1.96 -3.25 114.58 120.39 1b76 h GLU 324 Ca 0.10 -0.11 -0.02 0.00 0.05 0.00 0.00 59.36 59.39 1b76 h GLU 324 Cb 1.26 0.03 0.00 0.00 -1.65 0.00 0.00 28.75 28.39 1b76 h GLU 324 CO -0.00 0.87 -0.17 0.00 0.05 0.00 0.00 179.01 179.75 1b76 h ALA 325 N 0.24 -0.49 -0.68 1.06 0.00 -1.62 -3.32 119.26 114.45 1b76 h ALA 325 Ca -0.02 -0.17 -0.68 0.00 0.00 0.00 0.00 54.91 54.04 1b76 h ALA 325 Cb 0.92 0.19 -0.07 0.00 0.00 0.00 0.00 17.79 18.82 1b76 h ALA 325 CO 0.03 -0.65 2.37 1.47 0.00 0.00 0.00 179.25 182.47 1b76 n LEU 326 N -5.20 5.28 -1.24 0.00 -0.00 -1.22 -4.88 117.00 109.74 1b76 n LEU 326 Ca -0.10 -3.95 -0.06 0.00 -0.00 0.00 0.00 56.01 51.90 1b76 n LEU 326 Cb 0.27 -1.73 -0.06 0.00 -0.00 0.00 0.00 43.42 41.90 1b76 n LEU 326 CO 0.32 0.30 0.58 0.61 -0.00 0.00 0.00 177.39 179.20 1b76 n GLY 327 N 5.15 -0.14 3.77 1.47 0.00 -1.25 -4.63 105.19 109.56 1b76 n GLY 327 Ca 0.50 0.01 -0.29 0.00 0.00 0.00 0.00 46.02 46.23 1b76 n GLY 327 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1b76 s ILE 328 N 0.10 2.65 0.00 -0.61 1.01 -1.22 -4.76 121.20 118.36 1b76 s ILE 328 Ca 0.36 0.21 0.00 0.00 0.00 0.00 0.00 60.65 61.22 1b76 s ILE 328 Cb -0.24 -2.89 0.00 0.00 0.01 0.00 0.00 42.46 39.34 1b76 s ILE 328 CO 0.16 -0.27 0.00 0.41 0.00 0.00 0.00 174.94 175.23 1b76 n THR 329 N -3.66 0.00 -0.95 2.92 -1.04 -1.26 -5.08 114.28 105.21 1b76 n THR 329 Ca 0.07 0.09 -0.31 0.00 -2.04 0.00 0.00 64.05 61.86 1b76 n THR 329 Cb 0.57 -0.95 0.14 0.00 -1.82 0.00 0.00 70.33 68.27 1b76 n THR 329 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1b76 s ALA 330 N -2.54 1.58 0.23 2.41 0.00 -1.26 -4.95 121.76 117.23 1b76 s ALA 330 Ca 0.00 0.33 -0.30 0.00 0.00 0.00 0.00 51.96 51.99 1b76 s ALA 330 Cb 0.00 -3.34 -0.09 0.00 0.00 0.00 0.00 23.12 19.69 1b76 s ALA 330 CO 0.00 -2.46 1.31 -0.98 0.00 0.00 0.00 175.76 173.63 1b76 s ARG 331 N -4.76 4.39 0.04 0.00 3.03 -1.26 -4.87 118.95 115.52 1b76 s ARG 331 Ca 0.64 2.08 0.01 0.00 2.03 0.00 0.00 55.73 60.50 1b76 s ARG 331 Cb -0.20 -3.17 -0.00 0.00 -1.03 0.00 0.00 34.95 30.55 1b76 s ARG 331 CO 0.58 -0.23 0.04 1.33 -1.13 0.00 0.00 175.30 175.88 1b76 n VAL 332 N 2.27 0.00 -4.29 4.99 0.24 -1.26 -4.92 118.33 115.36 1b76 n VAL 332 Ca 0.05 -0.26 -0.28 0.00 -2.04 0.00 0.00 64.34 61.80 1b76 n VAL 332 Cb 0.42 0.14 -0.10 0.00 -1.47 0.00 0.00 33.84 32.83 1b76 n VAL 332 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1b76 s LEU 333 N 0.00 2.83 -0.29 1.34 1.43 -1.26 -5.02 118.68 117.71 1b76 s LEU 333 Ca 0.04 -0.55 -0.28 0.00 -1.03 0.00 0.00 54.13 52.31 1b76 s LEU 333 Cb 0.00 -1.61 -0.06 0.00 0.03 0.00 0.00 46.19 44.56 1b76 s LEU 333 CO 0.03 0.15 2.28 -1.14 0.23 0.00 0.00 176.35 177.90 1b76 n ARG 334 N 0.52 1.71 -2.33 1.70 0.63 -1.26 -4.82 116.66 112.81 1b76 n ARG 334 Ca -0.14 0.40 -0.41 0.00 -0.92 0.00 0.00 57.85 56.78 1b76 n ARG 334 Cb 0.54 -3.27 -0.03 0.00 0.45 0.00 0.00 32.46 30.15 1b76 n ARG 334 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 1b76 s ASN 335 N 9.28 6.00 0.00 6.15 3.84 -1.26 -4.78 114.94 134.18 1b76 s ASN 335 Ca 1.01 0.33 0.27 0.00 0.21 0.00 0.00 52.86 54.67 1b76 s ASN 335 Cb -0.31 -2.54 0.83 0.00 -0.55 0.00 0.00 41.25 38.68 1b76 s ASN 335 CO 0.33 -1.80 1.62 1.21 -2.79 0.00 0.00 177.10 175.67 1b76 n GLU 336 N 8.75 1.83 0.00 0.43 4.07 -1.26 -4.56 120.64 129.90 1b76 n GLU 336 Ca 0.14 -1.21 0.00 0.00 -0.06 0.00 0.00 57.16 56.03 1b76 n GLU 336 Cb 0.49 -1.47 0.00 0.00 -0.06 0.00 0.00 31.44 30.40 1b76 n GLU 336 CO 0.00 0.00 0.00 0.72 -0.06 0.00 0.00 177.13 177.79 1b76 n HIS 337 N 0.46 0.00 -1.64 4.31 8.25 -1.26 -5.06 115.22 120.28 1b76 n HIS 337 Ca 0.18 0.00 -0.54 0.00 -0.26 0.00 0.00 57.72 57.09 1b76 n HIS 337 Cb 0.41 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.45 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 -1.71 1.92 -0.60 0.41 2.88 -1.26 -4.82 113.62 110.44 1b76 n SER 338 Ca 0.00 1.10 0.12 0.00 -1.33 0.00 0.00 58.87 58.77 1b76 n SER 338 Cb 0.39 -1.16 0.41 0.00 -0.75 0.00 0.00 64.21 63.09 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 3.36 0.11 -4.08 2.46 -2.24 -1.26 -4.58 114.28 108.05 1b76 n THR 339 Ca 0.22 -0.35 -0.14 0.00 -2.27 0.00 0.00 64.05 61.51 1b76 n THR 339 Cb 0.16 0.58 -0.13 0.00 -2.10 0.00 0.00 70.33 68.84 1b76 n THR 339 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1b76 s GLN 340 N -1.89 0.39 -0.34 -0.78 -0.21 -1.26 -5.02 119.66 110.55 1b76 s GLN 340 Ca 0.35 -0.34 -0.18 0.00 0.02 0.00 0.00 55.36 55.21 1b76 s GLN 340 Cb 0.20 -0.29 -0.01 0.00 1.00 0.00 0.00 33.01 33.91 1b76 s GLN 340 CO 0.30 0.07 0.52 -0.98 -2.12 0.00 0.00 175.29 173.08 1b76 s ARG 341 N -0.57 3.66 -1.23 2.91 1.70 -1.26 -0.97 118.95 123.18 1b76 s ARG 341 Ca -0.03 -0.11 -0.13 0.00 -0.47 0.00 0.00 55.73 54.99 1b76 s ARG 341 Cb -0.04 -3.80 0.17 0.00 -0.57 0.00 0.00 34.95 30.71 1b76 s ARG 341 CO -0.00 -0.62 1.53 1.28 -1.08 0.00 0.00 175.30 176.41 1b76 n LEU 342 N 5.74 5.49 -4.03 -1.89 4.77 -1.26 -4.83 117.00 120.99 1b76 n LEU 342 Ca -0.05 -4.48 -0.13 0.00 -0.03 0.00 0.00 56.01 51.33 1b76 n LEU 342 Cb 0.49 -1.60 -0.12 0.00 -2.33 0.00 0.00 43.42 39.86 1b76 n LEU 342 CO 0.45 0.83 -0.40 0.00 -1.33 0.00 0.00 177.39 176.94 1b76 s ALA 343 N 1.44 0.49 0.08 -1.18 0.00 -1.26 -4.76 121.76 116.57 1b76 s ALA 343 Ca 0.43 -0.63 0.02 0.00 0.00 0.00 0.00 51.96 51.77 1b76 s ALA 343 Cb -0.00 0.03 -0.04 0.00 0.00 0.00 0.00 23.12 23.10 1b76 s ALA 343 CO 0.01 -0.01 0.14 -0.47 0.00 0.00 0.00 175.76 175.43 1b76 s TYR 344 N -1.13 3.33 0.22 0.00 5.04 -0.78 -4.91 117.35 119.12 1b76 s TYR 344 Ca -0.08 0.14 0.00 0.00 -2.44 0.00 0.00 57.07 54.69 1b76 s TYR 344 Cb -0.08 -1.67 -0.05 0.00 0.35 0.00 0.00 41.96 40.51 1b76 s TYR 344 CO 0.00 0.55 0.10 -0.98 -1.34 0.00 0.00 175.55 173.87 1b76 s ARG 345 N -2.53 1.27 -0.88 4.97 1.04 -1.26 -0.42 118.95 121.13 1b76 s ARG 345 Ca 0.32 -1.67 -0.01 0.00 -1.04 0.00 0.00 55.73 53.33 1b76 s ARG 345 Cb -0.12 -0.03 0.00 0.00 -2.04 0.00 0.00 34.95 32.76 1b76 s ARG 345 CO 0.25 -0.31 0.74 -3.47 -0.04 0.00 0.00 175.30 172.47 1b76 n ASP 346 N -0.34 -2.62 -0.09 -2.89 2.03 -0.89 -4.91 116.55 106.83 1b76 n ASP 346 Ca -0.00 -0.43 -0.04 0.00 0.52 0.00 0.00 54.79 54.83 1b76 n ASP 346 Cb 0.66 -3.81 -0.03 0.00 -0.72 0.00 0.00 41.12 37.22 1b76 n ASP 346 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 1b76 h PRO 347 N -1.47 -0.05 0.00 -0.67 0.11 -1.84 -3.42 132.00 124.65 1b76 h PRO 347 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1b76 h PRO 347 Cb 1.25 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1b76 h PRO 347 CO 0.37 -0.03 0.00 -0.85 -0.21 0.00 0.00 178.00 177.27 1b76 n GLU 348 N -3.63 0.00 0.00 1.05 0.28 -1.26 -4.99 120.64 112.09 1b76 n GLU 348 Ca -0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 1b76 n GLU 348 Cb 0.09 -0.10 0.00 0.00 1.43 0.00 0.00 31.44 32.86 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 -2.25 0.00 -0.51 3.84 -2.24 -1.26 -5.00 114.28 106.86 1b76 n THR 349 Ca 0.00 0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.82 1b76 n THR 349 Cb 0.00 -0.56 0.00 0.00 -2.10 0.00 0.00 70.33 67.67 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 1.84 0.51 3.65 3.38 0.00 -1.26 -4.77 105.19 108.53 1b76 n GLY 350 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 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 0.00 0.68 0.10 1.61 2.20 -1.26 -3.23 119.74 119.84 1b76 s LYS 351 Ca 0.00 1.09 -0.11 0.00 -0.36 0.00 0.00 55.97 56.60 1b76 s LYS 351 Cb 0.00 -1.72 -0.06 0.00 -1.51 0.00 0.00 37.83 34.54 1b76 s LYS 351 CO 0.00 -2.72 0.44 -1.58 -0.36 0.00 0.00 175.35 171.13 1b76 s TRP 352 N -2.71 3.59 -0.14 4.03 0.51 -1.26 -2.08 118.94 120.86 1b76 s TRP 352 Ca 0.66 0.85 -0.13 0.00 -2.12 0.00 0.00 56.10 55.36 1b76 s TRP 352 Cb -0.21 -2.21 0.04 0.00 -0.81 0.00 0.00 33.47 30.28 1b76 s TRP 352 CO 0.59 0.49 0.38 -0.59 -0.51 0.00 0.00 176.95 177.31 1b76 s PHE 353 N -1.42 -0.42 -0.30 -1.98 -0.71 0.44 -4.61 117.98 108.97 1b76 s PHE 353 Ca 0.34 1.02 -0.26 0.00 -1.04 0.00 0.00 56.93 56.99 1b76 s PHE 353 Cb -0.14 0.14 0.01 0.00 -1.21 0.00 0.00 43.02 41.82 1b76 s PHE 353 CO 0.18 -0.20 0.93 0.08 -1.34 0.00 0.00 175.22 174.87 1b76 s VAL 354 N 0.23 4.68 0.72 -2.49 1.01 -1.26 -1.86 120.40 121.41 1b76 s VAL 354 Ca -0.00 1.50 -0.15 0.00 0.00 0.00 0.00 61.98 63.33 1b76 s VAL 354 Cb -0.03 -4.26 0.03 0.00 0.00 0.00 0.00 36.38 32.12 1b76 s VAL 354 CO 0.00 -0.32 1.21 -2.16 0.00 0.00 0.00 175.10 173.83 1b76 s PRO 355 N 3.24 2.22 0.93 2.72 0.04 -1.26 -4.81 135.00 138.07 1b76 s PRO 355 Ca 0.39 1.77 -0.14 0.00 0.04 0.00 0.00 61.00 63.06 1b76 s PRO 355 Cb -0.14 -1.84 0.18 0.00 0.04 0.00 0.00 34.50 32.75 1b76 s PRO 355 CO 0.13 -1.78 1.28 0.71 0.04 0.00 0.00 177.00 177.38 1b76 s TYR 356 N -1.93 1.73 -0.11 0.56 1.51 0.15 -4.50 117.35 114.76 1b76 s TYR 356 Ca 0.75 0.31 -0.07 0.00 -1.01 0.00 0.00 57.07 57.05 1b76 s TYR 356 Cb -0.30 -3.97 0.04 0.00 -0.11 0.00 0.00 41.96 37.62 1b76 s TYR 356 CO 0.44 -2.49 0.26 0.08 -1.11 0.00 0.00 175.55 172.73 1b76 s VAL 357 N -3.80 -0.03 -0.19 0.71 1.01 -0.23 -1.17 120.40 116.70 1b76 s VAL 357 Ca 0.72 0.09 -0.04 0.00 0.00 0.00 0.00 61.98 62.76 1b76 s VAL 357 Cb -0.05 -0.39 -0.02 0.00 0.00 0.00 0.00 36.38 35.93 1b76 s VAL 357 CO 0.52 0.04 -0.04 -0.63 0.00 0.00 0.00 175.10 174.99 1b76 s ILE 358 N 0.88 3.63 -0.27 2.22 -1.09 -0.91 -2.42 121.20 123.24 1b76 s ILE 358 Ca -0.06 -0.43 0.03 0.00 -2.23 0.00 0.00 60.65 57.96 1b76 s ILE 358 Cb -0.07 -2.62 0.07 0.00 -1.58 0.00 0.00 42.46 38.25 1b76 s ILE 358 CO -0.06 0.45 -0.08 -0.70 -1.23 0.00 0.00 174.94 173.33 1b76 s GLU 359 N 0.92 2.04 -0.54 2.79 2.12 0.62 -1.99 118.70 124.67 1b76 s GLU 359 Ca -0.00 -1.41 -0.21 0.00 0.36 0.00 0.00 54.97 53.70 1b76 s GLU 359 Cb -0.15 -2.92 0.05 0.00 0.26 0.00 0.00 34.13 31.38 1b76 s GLU 359 CO 0.01 -0.64 0.77 -2.14 -0.54 0.00 0.00 175.26 172.72 1b76 s PRO 360 N 1.09 3.20 -0.25 4.30 0.02 -1.19 -0.48 135.00 141.69 1b76 s PRO 360 Ca -0.05 -0.66 -0.07 0.00 0.02 0.00 0.00 61.00 60.24 1b76 s PRO 360 Cb -0.20 -4.09 -0.03 0.00 0.02 0.00 0.00 34.50 30.20 1b76 s PRO 360 CO -0.06 -1.37 0.06 0.45 -0.33 0.00 0.00 177.00 175.75 1b76 s SER 361 N 2.84 5.08 -0.08 2.53 0.15 -0.89 -2.54 113.70 120.80 1b76 s SER 361 Ca 0.21 -0.22 0.02 0.00 0.70 0.00 0.00 55.95 56.67 1b76 s SER 361 Cb -0.17 -1.91 0.01 0.00 -1.71 0.00 0.00 66.02 62.25 1b76 s SER 361 CO 0.14 -0.03 -0.13 0.00 1.20 0.00 0.00 173.24 174.43 1b76 s ALA 362 N 1.58 1.37 0.02 5.45 0.00 -1.12 0.16 121.76 129.22 1b76 s ALA 362 Ca 0.06 -0.50 -0.30 0.00 0.00 0.00 0.00 51.96 51.22 1b76 s ALA 362 Cb -0.15 -0.66 -0.05 0.00 0.00 0.00 0.00 23.12 22.26 1b76 s ALA 362 CO 0.03 0.03 1.28 0.20 0.00 0.00 0.00 175.76 177.30 1b76 s GLY 363 N 0.83 2.12 0.19 0.00 0.00 -1.19 -1.94 107.32 107.33 1b76 s GLY 363 Ca -0.11 0.83 -0.02 0.00 0.00 0.00 0.00 44.72 45.41 1b76 s GLY 363 CO 0.02 2.25 1.48 -2.08 0.00 0.00 0.00 173.10 174.76 1b76 h VAL 364 N 4.73 1.34 -0.45 1.40 2.07 -1.70 -2.04 116.25 121.61 1b76 h VAL 364 Ca -0.39 -1.94 -0.11 0.00 0.82 0.00 0.00 66.70 65.09 1b76 h VAL 364 Cb 1.19 1.93 -0.01 0.00 -1.52 0.00 0.00 31.29 32.87 1b76 h VAL 364 CO 0.86 0.59 -0.13 0.44 0.02 0.00 0.00 177.57 179.35 1b76 h ASP 365 N 0.35 0.90 0.31 0.57 3.32 -1.91 -2.23 116.42 117.73 1b76 h ASP 365 Ca -0.01 -0.37 -0.14 0.00 0.02 0.00 0.00 57.03 56.53 1b76 h ASP 365 Cb 1.18 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 40.48 1b76 h ASP 365 CO 0.11 1.06 -0.58 0.03 -1.72 0.00 0.00 179.24 178.15 1b76 h ARG 366 N 0.73 0.27 -0.47 3.56 3.08 -1.81 -2.07 114.38 117.66 1b76 h ARG 366 Ca 0.11 -0.18 -0.08 0.00 0.07 0.00 0.00 59.98 59.90 1b76 h ARG 366 Cb 0.68 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.73 1b76 h ARG 366 CO 0.05 0.77 -0.04 0.78 -1.07 0.00 0.00 179.97 180.46 1b76 h GLY 367 N 1.40 0.87 0.92 0.04 0.00 -1.20 0.28 103.07 105.37 1b76 h GLY 367 Ca -0.00 -0.61 -0.01 0.00 0.00 0.00 0.00 47.33 46.71 1b76 h GLY 367 CO 0.09 0.56 -0.10 -2.08 0.00 0.00 0.00 176.54 175.02 1b76 h VAL 368 N 0.75 0.84 -1.00 4.60 2.07 -1.29 0.22 116.25 122.43 1b76 h VAL 368 Ca 0.14 -0.18 0.05 0.00 0.82 0.00 0.00 66.70 67.52 1b76 h VAL 368 Cb 0.50 0.95 -0.06 0.00 -1.52 0.00 0.00 31.29 31.17 1b76 h VAL 368 CO 0.03 0.04 0.65 0.25 0.02 0.00 0.00 177.57 178.56 1b76 h LEU 369 N -0.36 1.07 0.39 2.57 6.46 -1.05 0.34 115.31 124.74 1b76 h LEU 369 Ca -0.03 -0.00 -0.02 0.00 -0.12 0.00 0.00 57.88 57.71 1b76 h LEU 369 Cb 0.27 -0.24 0.00 0.00 -0.73 0.00 0.00 40.66 39.97 1b76 h LEU 369 CO 0.04 0.72 -0.19 0.00 -0.62 0.00 0.00 178.44 178.39 1b76 h ALA 370 N 1.42 -0.52 -0.26 1.25 0.00 -0.14 0.29 119.26 121.30 1b76 h ALA 370 Ca 0.41 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 55.21 1b76 h ALA 370 Cb 0.06 0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 1b76 h ALA 370 CO -0.14 -0.75 0.07 -0.07 0.00 0.00 0.00 179.25 178.36 1b76 h LEU 371 N -0.62 0.05 -0.08 0.00 3.38 0.08 0.10 115.31 118.22 1b76 h LEU 371 Ca -0.05 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 1b76 h LEU 371 Cb 0.46 0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.24 1b76 h LEU 371 CO 0.09 0.06 0.05 -0.07 0.09 0.00 0.00 178.44 178.66 1b76 h LEU 372 N 0.18 0.10 0.31 1.67 3.38 -0.26 0.13 115.31 120.80 1b76 h LEU 372 Ca 0.12 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1b76 h LEU 372 Cb 0.10 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 1b76 h LEU 372 CO -0.14 0.12 -0.31 0.00 0.09 0.00 0.00 178.44 178.19 1b76 h ALA 373 N 0.98 -0.66 -0.56 1.53 0.00 0.07 -0.59 119.26 120.03 1b76 h ALA 373 Ca 0.03 -0.10 0.13 0.00 0.00 0.00 0.00 54.91 54.96 1b76 h ALA 373 Cb 0.04 0.46 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 1b76 h ALA 373 CO -0.01 -0.91 0.39 1.49 0.00 0.00 0.00 179.25 180.21 1b76 h GLU 374 N -0.65 0.20 0.19 0.00 4.57 -0.62 -2.79 114.58 115.48 1b76 h GLU 374 Ca -0.01 -0.01 -0.35 0.00 -1.18 0.00 0.00 59.36 57.80 1b76 h GLU 374 Cb 0.60 -0.04 0.01 0.00 -0.16 0.00 0.00 28.75 29.15 1b76 h GLU 374 CO -0.07 0.13 -1.75 0.00 -1.18 0.00 0.00 179.01 176.14 1b76 h ALA 375 N 1.72 0.15 -1.16 2.92 0.00 -0.46 -2.75 119.26 119.68 1b76 h ALA 375 Ca 0.26 -1.14 -0.71 0.00 0.00 0.00 0.00 54.91 53.33 1b76 h ALA 375 Cb 0.77 0.46 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 1b76 h ALA 375 CO -0.05 1.02 1.21 0.34 0.00 0.00 0.00 179.25 181.77 1b76 n PHE 376 N -3.60 1.75 -3.88 0.00 -0.00 -0.28 -1.85 117.46 109.60 1b76 n PHE 376 Ca -0.25 0.42 -0.11 0.00 -0.00 0.00 0.00 57.45 57.51 1b76 n PHE 376 Cb 1.07 -2.48 -0.13 0.00 -0.00 0.00 0.00 39.48 37.94 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 5.66 0.03 -0.00 -2.13 -4.23 0.03 -2.14 115.64 112.85 1b76 s THR 377 Ca 1.06 -0.24 -0.02 0.00 -1.18 0.00 0.00 61.69 61.31 1b76 s THR 377 Cb -1.01 -0.16 -0.04 0.00 1.34 0.00 0.00 72.50 72.64 1b76 s THR 377 CO 0.57 -0.13 0.14 -0.13 -0.54 0.00 0.00 174.62 174.52 1b76 s ARG 378 N -0.40 3.26 -0.05 3.99 0.52 -1.26 -0.56 118.95 124.45 1b76 s ARG 378 Ca -0.05 -0.40 -0.00 0.00 -0.52 0.00 0.00 55.73 54.76 1b76 s ARG 378 Cb -0.03 -2.98 0.03 0.00 0.52 0.00 0.00 34.95 32.48 1b76 s ARG 378 CO 0.00 0.66 -0.01 -1.21 0.02 0.00 0.00 175.30 174.76 1b76 s GLU 379 N -1.86 0.60 -0.48 3.54 2.02 -0.45 -4.96 118.70 117.11 1b76 s GLU 379 Ca 0.25 0.03 -0.28 0.00 0.02 0.00 0.00 54.97 54.99 1b76 s GLU 379 Cb -0.12 -0.80 0.01 0.00 0.10 0.00 0.00 34.13 33.31 1b76 s GLU 379 CO 0.17 -0.19 1.45 -2.00 0.02 0.00 0.00 175.26 174.71 1b76 s GLU 380 N 1.39 3.40 -0.03 1.61 -6.30 -1.26 -1.52 118.70 115.99 1b76 s GLU 380 Ca -0.04 0.75 -0.30 0.00 -2.50 0.00 0.00 54.97 52.88 1b76 s GLU 380 Cb -0.13 -4.09 -0.05 0.00 0.00 0.00 0.00 34.13 29.86 1b76 s GLU 380 CO -0.03 -1.79 1.38 -0.51 0.02 0.00 0.00 175.26 174.33 1b76 s LEU 381 N 5.94 4.30 0.50 2.70 1.43 -1.15 -4.87 118.68 127.53 1b76 s LEU 381 Ca 0.59 2.03 0.00 0.00 -1.03 0.00 0.00 54.13 55.72 1b76 s LEU 381 Cb -0.13 -3.56 0.00 0.00 0.03 0.00 0.00 46.19 42.54 1b76 s LEU 381 CO 0.29 -0.72 0.81 -0.81 0.23 0.00 0.00 176.35 176.15 1b76 n PRO 382 N 5.61 0.02 -0.03 1.29 -0.04 -1.26 0.16 135.00 140.75 1b76 n PRO 382 Ca 0.13 0.73 0.13 0.00 -0.04 0.00 0.00 63.50 64.45 1b76 n PRO 382 Cb 0.44 -2.14 0.50 0.00 -0.04 0.00 0.00 33.50 32.26 1b76 n PRO 382 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 1b76 n ASN 383 N -2.07 1.40 0.00 3.54 0.23 -1.26 -5.01 115.26 112.09 1b76 n ASN 383 Ca 0.00 -1.54 0.00 0.00 -0.53 0.00 0.00 54.58 52.51 1b76 n ASN 383 Cb 0.81 -0.04 0.00 0.00 -2.08 0.00 0.00 39.78 38.47 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 1.13 1.39 3.29 4.83 0.00 0.41 -5.07 105.19 111.17 1b76 n GLY 384 Ca 0.18 -0.83 -0.51 0.00 0.00 0.00 0.00 46.02 44.86 1b76 n GLY 384 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1b76 n GLU 385 N 0.00 0.00 -1.97 1.61 0.28 -1.26 -3.36 120.64 115.95 1b76 n GLU 385 Ca 0.00 0.00 -0.29 0.00 -0.16 0.00 0.00 57.16 56.71 1b76 n GLU 385 Cb 0.00 -1.18 0.07 0.00 1.43 0.00 0.00 31.44 31.76 1b76 n GLU 385 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 177.13 175.14 1b76 s GLU 386 N -0.50 2.34 -0.00 3.44 -1.05 -1.26 -2.92 118.70 118.74 1b76 s GLU 386 Ca 0.73 0.17 0.02 0.00 -0.15 0.00 0.00 54.97 55.74 1b76 s GLU 386 Cb -1.04 -2.02 -0.00 0.00 -0.44 0.00 0.00 34.13 30.62 1b76 s GLU 386 CO 0.54 -1.32 -0.05 -0.98 0.95 0.00 0.00 175.26 174.40 1b76 s ARG 387 N -5.43 0.40 -0.44 -4.83 1.70 -0.58 -4.86 118.95 104.92 1b76 s ARG 387 Ca 0.60 -0.17 -0.15 0.00 -0.47 0.00 0.00 55.73 55.53 1b76 s ARG 387 Cb -0.11 -0.39 0.04 0.00 -0.57 0.00 0.00 34.95 33.92 1b76 s ARG 387 CO 0.49 0.10 0.35 0.42 -1.08 0.00 0.00 175.30 175.59 1b76 s ILE 388 N -0.09 5.23 -0.14 4.99 1.01 -1.26 -1.34 121.20 129.59 1b76 s ILE 388 Ca 0.02 -0.78 -0.08 0.00 0.00 0.00 0.00 60.65 59.80 1b76 s ILE 388 Cb -0.02 -4.02 -0.04 0.00 0.01 0.00 0.00 42.46 38.38 1b76 s ILE 388 CO -0.00 -0.43 0.15 -0.69 0.00 0.00 0.00 174.94 173.96 1b76 s VAL 389 N 1.72 5.46 -0.63 2.92 1.01 0.28 -3.51 120.40 127.65 1b76 s VAL 389 Ca 0.05 0.23 -0.16 0.00 0.00 0.00 0.00 61.98 62.10 1b76 s VAL 389 Cb -0.21 -3.43 0.15 0.00 0.00 0.00 0.00 36.38 32.89 1b76 s VAL 389 CO 0.09 0.56 0.61 -0.76 0.00 0.00 0.00 175.10 175.60 1b76 s LEU 390 N -0.59 6.16 -1.47 3.92 1.43 0.06 -0.79 118.68 127.40 1b76 s LEU 390 Ca 0.13 -1.95 -0.14 0.00 -1.03 0.00 0.00 54.13 51.15 1b76 s LEU 390 Cb -0.12 -2.23 0.03 0.00 0.03 0.00 0.00 46.19 43.90 1b76 s LEU 390 CO 0.02 -0.84 2.28 0.29 0.23 0.00 0.00 176.35 178.34 1b76 n LYS 391 N 5.17 2.95 -2.70 1.70 5.02 -0.77 -3.95 118.16 125.58 1b76 n LYS 391 Ca -0.06 -2.59 -0.34 0.00 -2.02 0.00 0.00 58.31 53.30 1b76 n LYS 391 Cb 0.42 -3.24 -0.05 0.00 -0.02 0.00 0.00 35.03 32.14 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 1.96 3.96 -0.24 -0.35 1.43 -1.26 -4.60 118.68 119.57 1b76 s LEU 392 Ca 0.49 1.81 -0.29 0.00 -1.03 0.00 0.00 54.13 55.12 1b76 s LEU 392 Cb 0.14 -4.47 -0.03 0.00 0.03 0.00 0.00 46.19 41.86 1b76 s LEU 392 CO -0.09 -0.49 1.79 -0.75 0.23 0.00 0.00 176.35 177.05 1b76 s LYS 393 N -3.04 3.56 0.10 1.70 2.20 -1.26 -4.80 119.74 118.20 1b76 s LYS 393 Ca 0.62 1.70 -0.16 0.00 -0.36 0.00 0.00 55.97 57.77 1b76 s LYS 393 Cb -0.13 -4.15 0.00 0.00 -1.51 0.00 0.00 37.83 32.04 1b76 s LYS 393 CO 0.18 -1.59 0.90 -2.30 -0.36 0.00 0.00 175.35 172.18 1b76 n PRO 394 N 8.09 -0.23 0.24 4.03 -0.02 -1.26 0.14 135.00 145.99 1b76 n PRO 394 Ca 0.22 0.89 0.10 0.00 -2.02 0.00 0.00 63.50 62.69 1b76 n PRO 394 Cb 0.45 -1.30 0.55 0.00 -0.02 0.00 0.00 33.50 33.18 1b76 n PRO 394 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 1b76 h GLN 395 N 0.00 0.00 -0.01 -0.52 7.50 -1.89 0.53 115.11 120.72 1b76 h GLN 395 Ca 0.12 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.27 1b76 h GLN 395 Cb 0.27 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.80 1b76 h GLN 395 CO -0.56 0.00 -0.14 1.28 -1.50 0.00 0.00 178.83 177.92 1b76 n LEU 396 N -2.41 1.36 -4.61 1.46 4.77 0.38 -5.04 117.00 112.90 1b76 n LEU 396 Ca -0.01 -0.83 -0.36 0.00 -0.03 0.00 0.00 56.01 54.77 1b76 n LEU 396 Cb 0.35 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.52 1b76 n LEU 396 CO 0.09 0.27 0.53 0.00 -1.33 0.00 0.00 177.39 176.95 1b76 n ALA 397 N -0.03 -0.16 0.18 -1.18 0.00 0.18 -4.71 120.51 114.79 1b76 n ALA 397 Ca 0.04 -0.14 0.02 0.00 0.00 0.00 0.00 53.44 53.36 1b76 n ALA 397 Cb 0.21 -2.11 0.35 0.00 0.00 0.00 0.00 19.45 17.90 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 -0.08 0.00 -4.12 0.00 0.11 -1.85 -3.41 132.00 122.66 1b76 h PRO 398 Ca -0.48 -0.00 -0.54 0.00 0.11 0.00 0.00 66.00 65.09 1b76 h PRO 398 Cb 1.34 -0.00 -0.38 0.00 0.11 0.00 0.00 31.00 32.07 1b76 h PRO 398 CO 0.48 0.38 -0.79 0.42 -0.21 0.00 0.00 178.00 178.28 1b76 s ILE 399 N -4.18 1.04 0.06 4.15 1.01 -1.26 -4.77 121.20 117.24 1b76 s ILE 399 Ca -0.03 -0.55 -0.25 0.00 0.00 0.00 0.00 60.65 59.82 1b76 s ILE 399 Cb 0.14 -1.21 -0.17 0.00 0.01 0.00 0.00 42.46 41.23 1b76 s ILE 399 CO 0.73 0.15 1.58 0.11 0.00 0.00 0.00 174.94 177.50 1b76 h LYS 400 N 8.14 -0.15 -4.23 2.79 6.56 -0.95 -3.36 116.57 125.37 1b76 h LYS 400 Ca -0.24 0.01 -0.28 0.00 -1.06 0.00 0.00 60.65 59.08 1b76 h LYS 400 Cb 1.11 0.03 -0.26 0.00 -0.57 0.00 0.00 32.23 32.55 1b76 h LYS 400 CO 0.39 0.02 -0.74 0.08 -2.06 0.00 0.00 179.45 177.14 1b76 s VAL 401 N -5.62 0.34 -0.10 0.50 1.01 -1.23 -3.11 120.40 112.18 1b76 s VAL 401 Ca -0.14 -0.45 0.02 0.00 0.00 0.00 0.00 61.98 61.41 1b76 s VAL 401 Cb 0.04 -0.34 -0.02 0.00 0.00 0.00 0.00 36.38 36.07 1b76 s VAL 401 CO 0.64 -0.08 -0.15 0.00 0.00 0.00 0.00 175.10 175.51 1b76 s ALA 402 N -0.52 2.55 -0.29 5.51 0.00 -0.56 -0.09 121.76 128.36 1b76 s ALA 402 Ca -0.03 -0.93 -0.09 0.00 0.00 0.00 0.00 51.96 50.91 1b76 s ALA 402 Cb -0.04 -1.07 -0.01 0.00 0.00 0.00 0.00 23.12 21.99 1b76 s ALA 402 CO -0.00 0.34 0.13 0.08 0.00 0.00 0.00 175.76 176.31 1b76 s VAL 403 N 0.04 4.54 -0.19 0.00 1.01 -0.10 0.16 120.40 125.86 1b76 s VAL 403 Ca -0.06 -0.33 -0.01 0.00 0.00 0.00 0.00 61.98 61.58 1b76 s VAL 403 Cb -0.15 -3.26 0.00 0.00 0.00 0.00 0.00 36.38 32.98 1b76 s VAL 403 CO 0.05 0.15 -0.13 -0.63 0.00 0.00 0.00 175.10 174.53 1b76 s ILE 404 N 1.62 2.67 -0.09 2.22 1.01 -0.49 -1.18 121.20 126.96 1b76 s ILE 404 Ca 0.05 -0.74 -0.30 0.00 0.00 0.00 0.00 60.65 59.66 1b76 s ILE 404 Cb -0.16 -2.16 -0.02 0.00 0.01 0.00 0.00 42.46 40.12 1b76 s ILE 404 CO 0.06 0.49 1.15 -2.16 0.00 0.00 0.00 174.94 174.48 1b76 s PRO 405 N 1.22 4.35 0.24 2.79 0.04 -1.25 -1.39 135.00 141.00 1b76 s PRO 405 Ca 0.02 1.58 -0.05 0.00 0.04 0.00 0.00 61.00 62.60 1b76 s PRO 405 Cb -0.14 -3.58 0.44 0.00 0.04 0.00 0.00 34.50 31.26 1b76 s PRO 405 CO -0.06 -0.45 1.71 1.25 0.04 0.00 0.00 177.00 179.49 1b76 h LEU 406 N 8.38 0.18 -8.22 -3.56 5.85 -0.23 -3.40 115.31 114.30 1b76 h LEU 406 Ca -0.32 0.12 -0.54 0.00 0.84 0.00 0.00 57.88 57.98 1b76 h LEU 406 Cb 1.15 0.12 -0.31 0.00 0.37 0.00 0.00 40.66 41.99 1b76 h LEU 406 CO 0.89 0.05 -0.83 -0.69 -0.34 0.00 0.00 178.44 177.52 1b76 s VAL 407 N -6.04 1.34 -0.52 1.05 1.01 -1.26 -4.85 120.40 111.14 1b76 s VAL 407 Ca -0.13 -0.68 0.24 0.00 0.00 0.00 0.00 61.98 61.41 1b76 s VAL 407 Cb 0.20 -1.15 0.25 0.00 0.00 0.00 0.00 36.38 35.69 1b76 s VAL 407 CO 0.76 0.39 1.56 0.11 0.00 0.00 0.00 175.10 177.91 1b76 h LYS 408 N 6.14 0.00 0.04 2.72 6.56 -1.95 -3.39 116.57 126.69 1b76 h LYS 408 Ca -0.34 0.00 -0.00 0.00 -1.06 0.00 0.00 60.65 59.25 1b76 h LYS 408 Cb 1.17 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.83 1b76 h LYS 408 CO 0.48 0.00 -0.02 -2.95 -2.06 0.00 0.00 179.45 174.90 1b76 h ASN 409 N 0.00 -0.05 -1.02 0.86 -1.07 -1.97 -3.43 115.58 108.90 1b76 h ASN 409 Ca 0.00 0.00 -0.52 0.00 0.07 0.00 0.00 56.30 55.85 1b76 h ASN 409 Cb 0.90 0.01 -0.03 0.00 -2.07 0.00 0.00 38.32 37.14 1b76 h ASN 409 CO 0.00 -0.02 1.62 0.54 0.07 0.00 0.00 177.43 179.64 1b76 n ARG 410 N -2.19 0.76 0.27 4.14 5.12 -1.26 -4.84 116.66 118.66 1b76 n ARG 410 Ca -0.01 0.08 0.11 0.00 -1.93 0.00 0.00 57.85 56.10 1b76 n ARG 410 Cb 0.02 -2.64 0.72 0.00 -1.16 0.00 0.00 32.46 29.40 1b76 n ARG 410 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 1b76 h PRO 411 N 15.62 0.00 0.00 5.56 0.13 -1.92 -0.13 132.00 151.26 1b76 h PRO 411 Ca -0.19 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.92 1b76 h PRO 411 Cb 1.29 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.42 1b76 h PRO 411 CO 1.19 0.05 -0.08 0.93 -0.23 0.00 0.00 178.00 179.87 1b76 h GLU 412 N 0.00 0.00 0.11 0.86 3.07 -1.99 -1.12 114.58 115.51 1b76 h GLU 412 Ca -0.00 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.85 1b76 h GLU 412 Cb 0.11 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.03 1b76 h GLU 412 CO 0.01 0.08 -0.05 0.82 -1.40 0.00 0.00 179.01 178.46 1b76 h ILE 413 N 0.00 0.00 -0.87 3.13 2.04 -1.39 -3.24 117.51 117.17 1b76 h ILE 413 Ca -0.00 -0.38 0.21 0.00 1.00 0.00 0.00 64.86 65.69 1b76 h ILE 413 Cb 0.18 0.00 -0.12 0.00 -0.74 0.00 0.00 36.82 36.13 1b76 h ILE 413 CO 0.01 0.00 0.35 0.71 0.00 0.00 0.00 178.15 179.22 1b76 h THR 414 N -0.53 0.46 -0.05 -0.27 1.35 -1.32 0.33 112.91 112.88 1b76 h THR 414 Ca -0.02 -0.12 0.03 0.00 -0.55 0.00 0.00 66.41 65.75 1b76 h THR 414 Cb 0.12 0.07 -0.04 0.00 -1.73 0.00 0.00 68.15 66.56 1b76 h THR 414 CO 0.03 0.07 -0.21 -0.08 -0.25 0.00 0.00 175.52 175.07 1b76 h GLU 415 N 0.36 -0.30 -0.65 4.72 4.22 -1.36 0.36 114.58 121.93 1b76 h GLU 415 Ca 0.54 0.02 0.13 0.00 0.08 0.00 0.00 59.36 60.13 1b76 h GLU 415 Cb 1.02 0.07 -0.10 0.00 0.50 0.00 0.00 28.75 30.25 1b76 h GLU 415 CO -0.54 -0.20 0.12 -0.92 -2.18 0.00 0.00 179.01 175.29 1b76 h TYR 416 N -0.31 0.19 0.84 0.92 5.03 -0.43 0.42 116.97 123.63 1b76 h TYR 416 Ca 0.07 0.04 -0.04 0.00 2.58 0.00 0.00 58.73 61.38 1b76 h TYR 416 Cb 0.42 0.02 0.00 0.00 1.55 0.00 0.00 36.73 38.72 1b76 h TYR 416 CO -0.28 -0.07 -0.47 0.00 -1.32 0.00 0.00 178.16 176.02 1b76 h ALA 417 N 1.54 -1.30 -0.96 1.82 0.00 0.09 0.22 119.26 120.68 1b76 h ALA 417 Ca 0.35 -0.26 0.16 0.00 0.00 0.00 0.00 54.91 55.16 1b76 h ALA 417 Cb 0.56 0.56 -0.08 0.00 0.00 0.00 0.00 17.79 18.82 1b76 h ALA 417 CO -0.46 -1.23 0.61 0.87 0.00 0.00 0.00 179.25 179.03 1b76 h LYS 418 N -1.21 0.73 0.61 0.00 1.57 0.49 0.86 116.57 119.61 1b76 h LYS 418 Ca -0.11 -0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 58.59 1b76 h LYS 418 Cb 0.96 -0.16 0.01 0.00 0.08 0.00 0.00 32.23 33.11 1b76 h LYS 418 CO 0.15 0.48 -0.29 0.00 -0.57 0.00 0.00 179.45 179.21 1b76 h ARG 419 N 0.75 -0.79 -0.58 3.15 3.08 0.22 -2.77 114.38 117.44 1b76 h ARG 419 Ca 0.51 0.05 0.11 0.00 0.07 0.00 0.00 59.98 60.72 1b76 h ARG 419 Cb 0.79 0.18 -0.08 0.00 0.08 0.00 0.00 29.97 30.94 1b76 h ARG 419 CO -0.27 -0.49 0.12 1.25 -1.07 0.00 0.00 179.97 179.51 1b76 h LEU 420 N -0.90 0.01 -0.53 3.04 5.85 0.32 -1.84 115.31 121.26 1b76 h LEU 420 Ca -0.08 0.11 0.07 0.00 0.84 0.00 0.00 57.88 58.81 1b76 h LEU 420 Cb 0.66 0.14 -0.09 0.00 0.37 0.00 0.00 40.66 41.73 1b76 h LEU 420 CO 0.14 0.02 -0.51 0.50 -0.34 0.00 0.00 178.44 178.24 1b76 h LYS 421 N 0.26 -0.29 -0.43 1.25 3.64 -0.79 -0.26 116.57 119.95 1b76 h LYS 421 Ca 0.30 0.02 0.04 0.00 -1.27 0.00 0.00 60.65 59.74 1b76 h LYS 421 Cb 0.43 0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 32.28 1b76 h LYS 421 CO -0.38 -0.19 0.19 0.00 -2.27 0.00 0.00 179.45 176.79 1b76 h ALA 422 N 0.26 0.53 -0.33 5.00 0.00 -1.07 -0.13 119.26 123.52 1b76 h ALA 422 Ca 0.12 0.03 0.07 0.00 0.00 0.00 0.00 54.91 55.14 1b76 h ALA 422 Cb 0.57 -0.02 -0.08 0.00 0.00 0.00 0.00 17.79 18.26 1b76 h ALA 422 CO -0.66 -0.19 -0.24 -0.09 0.00 0.00 0.00 179.25 178.07 1b76 h ARG 423 N 0.38 -0.20 -0.21 0.00 2.43 -0.49 -0.10 114.38 116.19 1b76 h ARG 423 Ca 0.19 0.01 -0.10 0.00 -0.81 0.00 0.00 59.98 59.28 1b76 h ARG 423 Cb 0.14 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.72 1b76 h ARG 423 CO -0.16 -0.13 -0.28 -0.07 -1.51 0.00 0.00 179.97 177.81 1b76 h LEU 424 N -0.21 0.41 -0.70 3.80 3.38 -0.72 -2.58 115.31 118.69 1b76 h LEU 424 Ca 0.17 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1b76 h LEU 424 Cb 0.47 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 1b76 h LEU 424 CO -0.45 0.68 0.36 0.25 0.09 0.00 0.00 178.44 179.37 1b76 h LEU 425 N 0.36 0.90 -2.47 1.67 5.85 0.06 -1.43 115.31 120.25 1b76 h LEU 425 Ca 0.05 -0.11 0.02 0.00 0.84 0.00 0.00 57.88 58.67 1b76 h LEU 425 Cb 0.68 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 41.48 1b76 h LEU 425 CO 0.05 0.76 0.15 0.00 -0.34 0.00 0.00 178.44 179.06 1b76 h ALA 426 N 1.18 1.38 0.00 1.25 0.00 -0.64 0.27 119.26 122.70 1b76 h ALA 426 Ca 0.24 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 1b76 h ALA 426 Cb 0.08 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1b76 h ALA 426 CO -0.03 -0.18 -0.06 -0.07 0.00 0.00 0.00 179.25 178.91 1b76 h LEU 427 N 0.00 0.00 0.27 0.00 3.38 -1.24 -3.45 115.31 114.28 1b76 h LEU 427 Ca 0.03 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.74 1b76 h LEU 427 Cb 0.32 0.00 0.05 0.00 0.09 0.00 0.00 40.66 41.12 1b76 h LEU 427 CO -0.00 0.06 -0.40 0.61 0.09 0.00 0.00 178.44 178.80 1b76 n GLY 428 N -0.94 -0.08 0.00 0.83 0.00 0.96 -4.86 105.19 101.10 1b76 n GLY 428 Ca -0.02 -0.18 0.11 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.78 0.83 0.00 0.99 4.77 -1.26 -5.06 117.00 114.48 1b76 n LEU 429 Ca -0.06 -0.34 0.00 0.00 -0.03 0.00 0.00 56.01 55.57 1b76 n LEU 429 Cb 0.57 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.61 1b76 n LEU 429 CO 0.32 0.20 0.00 0.61 -1.33 0.00 0.00 177.39 177.19 1b76 n GLY 430 N 1.48 3.50 3.49 -0.72 0.00 -1.26 -4.89 105.19 106.78 1b76 n GLY 430 Ca 0.04 -1.69 -0.51 0.00 0.00 0.00 0.00 46.02 43.86 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 -1.96 1.21 -3.50 1.61 3.00 -1.26 -4.74 116.66 111.02 1b76 n ARG 431 Ca 0.00 0.35 -0.28 0.00 -0.00 0.00 0.00 57.85 57.92 1b76 n ARG 431 Cb 0.00 -2.50 -0.03 0.00 0.00 0.00 0.00 32.46 29.94 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 6.90 5.11 0.07 5.15 1.01 -1.26 -0.39 120.40 137.00 1b76 s VAL 432 Ca 1.07 -0.19 0.05 0.00 0.00 0.00 0.00 61.98 62.91 1b76 s VAL 432 Cb -0.83 -3.75 -0.03 0.00 0.00 0.00 0.00 36.38 31.77 1b76 s VAL 432 CO 0.50 -0.28 -0.13 -0.22 0.00 0.00 0.00 175.10 174.97 1b76 s LEU 433 N -3.53 2.29 -0.27 3.92 2.96 0.87 -4.92 118.68 120.01 1b76 s LEU 433 Ca 0.41 -0.63 -0.06 0.00 -0.22 0.00 0.00 54.13 53.63 1b76 s LEU 433 Cb -0.11 -0.44 0.00 0.00 0.50 0.00 0.00 46.19 46.15 1b76 s LEU 433 CO 0.30 -0.12 0.04 -0.47 -1.32 0.00 0.00 176.35 174.78 1b76 s TYR 434 N -1.44 3.09 -0.32 5.38 6.14 -1.26 -0.93 117.35 128.00 1b76 s TYR 434 Ca -0.02 -0.96 -0.05 0.00 0.64 0.00 0.00 57.07 56.68 1b76 s TYR 434 Cb -0.09 -2.20 0.04 0.00 0.42 0.00 0.00 41.96 40.13 1b76 s TYR 434 CO 0.02 -0.56 0.07 -2.00 0.64 0.00 0.00 175.55 173.72 1b76 s GLU 435 N 1.49 2.60 -0.11 4.97 2.56 -0.32 -4.92 118.70 124.97 1b76 s GLU 435 Ca 0.03 -1.18 0.16 0.00 0.00 0.00 0.00 54.97 53.98 1b76 s GLU 435 Cb -0.16 -3.37 0.57 0.00 2.00 0.00 0.00 34.13 33.17 1b76 s GLU 435 CO 0.01 -0.63 1.49 -0.40 -0.56 0.00 0.00 175.26 175.16 1b76 n ASP 436 N 4.76 4.13 -4.74 -1.70 5.68 -1.26 -3.86 116.55 119.56 1b76 n ASP 436 Ca -0.13 -2.52 -0.37 0.00 -0.50 0.00 0.00 54.79 51.27 1b76 n ASP 436 Cb 0.45 -0.49 0.06 0.00 -1.14 0.00 0.00 41.12 39.99 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 -1.96 2.09 0.00 2.12 2.01 -1.26 -4.99 115.64 113.65 1b76 s THR 437 Ca 0.42 0.06 0.00 0.00 0.31 0.00 0.00 61.69 62.48 1b76 s THR 437 Cb 0.29 -3.03 0.00 0.00 0.01 0.00 0.00 72.50 69.77 1b76 s THR 437 CO 0.18 -0.01 0.00 0.61 -0.69 0.00 0.00 174.62 174.71 1b76 n GLY 438 N 0.82 -0.64 0.00 4.40 0.00 -1.26 -4.70 105.19 103.81 1b76 n GLY 438 Ca 0.14 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.43 1.61 5.15 -1.26 -4.41 115.26 115.92 1b76 n ASN 439 Ca 0.00 0.00 0.38 0.00 -0.60 0.00 0.00 54.58 54.36 1b76 n ASN 439 Cb 0.00 0.00 0.64 0.00 -0.53 0.00 0.00 39.78 39.89 1b76 n ASN 439 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1b76 n ILE 440 N 0.00 -0.28 -0.02 -1.44 0.13 -1.26 0.13 119.36 116.62 1b76 n ILE 440 Ca 0.00 1.81 -0.11 0.00 -1.10 0.00 0.00 62.75 63.35 1b76 n ILE 440 Cb 0.00 -2.96 -0.05 0.00 -0.84 0.00 0.00 39.64 35.80 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 0.18 0.85 4.50 0.00 -1.98 -1.67 103.07 104.95 1b76 h GLY 441 Ca 0.85 -0.07 0.06 0.00 0.00 0.00 0.00 47.33 48.17 1b76 h GLY 441 CO -0.52 0.06 0.62 1.70 0.00 0.00 0.00 176.54 178.40 1b76 h LYS 442 N 0.17 1.09 0.66 4.80 3.11 0.79 -1.42 116.57 125.77 1b76 h LYS 442 Ca 0.05 -0.07 -0.03 0.00 -2.81 0.00 0.00 60.65 57.80 1b76 h LYS 442 Cb -0.01 -0.25 -0.00 0.00 -1.00 0.00 0.00 32.23 30.97 1b76 h LYS 442 CO -0.02 0.72 -0.41 0.00 -2.81 0.00 0.00 179.45 176.93 1b76 h ALA 443 N 1.48 -1.21 -0.76 5.00 0.00 -0.83 0.18 119.26 123.12 1b76 h ALA 443 Ca 0.40 -0.21 0.15 0.00 0.00 0.00 0.00 54.91 55.24 1b76 h ALA 443 Cb 0.13 0.53 -0.14 0.00 0.00 0.00 0.00 17.79 18.31 1b76 h ALA 443 CO -0.14 -1.18 -0.24 1.88 0.00 0.00 0.00 179.25 179.57 1b76 h TYR 444 N -1.00 -0.58 0.21 0.00 0.05 -0.98 -2.10 116.97 112.57 1b76 h TYR 444 Ca -0.09 0.07 -0.00 0.00 0.05 0.00 0.00 58.73 58.76 1b76 h TYR 444 Cb 0.80 0.37 -0.01 0.00 1.01 0.00 0.00 36.73 38.90 1b76 h TYR 444 CO -0.07 -0.35 -0.26 -0.09 -1.05 0.00 0.00 178.16 176.34 1b76 h ARG 445 N -0.03 -0.46 -0.91 4.88 9.65 -0.78 -2.00 114.38 124.73 1b76 h ARG 445 Ca 0.34 0.03 0.27 0.00 -1.10 0.00 0.00 59.98 59.52 1b76 h ARG 445 Cb 0.57 0.10 -0.17 0.00 -1.39 0.00 0.00 29.97 29.09 1b76 h ARG 445 CO -0.79 -0.31 0.09 -2.13 2.80 0.00 0.00 179.97 179.63 1b76 n ARG 446 N -3.92 -0.07 0.28 0.20 0.00 0.01 0.12 116.66 113.28 1b76 n ARG 446 Ca -0.06 1.34 0.17 0.00 -0.00 0.00 0.00 57.85 59.31 1b76 n ARG 446 Cb 0.23 -2.17 0.70 0.00 0.00 0.00 0.00 32.46 31.21 1b76 n ARG 446 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 1b76 h HIS 447 N 0.00 0.00 0.10 -0.14 3.86 -0.75 -0.45 115.15 117.78 1b76 h HIS 447 Ca 0.58 0.00 -0.16 0.00 -1.16 0.00 0.00 60.37 59.63 1b76 h HIS 447 Cb 1.28 0.00 0.01 0.00 1.06 0.00 0.00 27.41 29.76 1b76 h HIS 447 CO -0.39 0.01 -0.75 -0.44 0.86 0.00 0.00 177.93 177.22 1b76 h ASP 448 N 0.00 0.33 -0.26 2.45 3.32 0.15 0.26 116.42 122.67 1b76 h ASP 448 Ca -0.00 -0.93 0.02 0.00 0.02 0.00 0.00 57.03 56.14 1b76 h ASP 448 Cb 0.50 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.93 1b76 h ASP 448 CO 0.00 1.35 0.17 -0.33 -1.72 0.00 0.00 179.24 178.71 1b76 h GLU 449 N -0.53 0.25 -0.51 3.56 4.39 -0.73 0.38 114.58 121.39 1b76 h GLU 449 Ca -0.15 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.54 1b76 h GLU 449 Cb 1.51 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 30.10 1b76 h GLU 449 CO 0.09 0.16 0.00 1.33 -1.16 0.00 0.00 179.01 179.43 1b76 n VAL 450 N -4.50 0.66 -3.86 3.13 0.24 -0.21 -4.30 118.33 109.50 1b76 n VAL 450 Ca 0.02 -0.82 -0.24 0.00 -2.04 0.00 0.00 64.34 61.25 1b76 n VAL 450 Cb 0.15 0.81 -0.00 0.00 -1.47 0.00 0.00 33.84 33.32 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 1.56 -0.27 3.56 7.63 0.00 0.11 -4.51 105.19 113.28 1b76 n GLY 451 Ca 0.21 0.15 -0.42 0.00 0.00 0.00 0.00 46.02 45.96 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 -3.85 4.81 0.22 2.61 -4.23 0.70 -4.50 115.64 111.41 1b76 s THR 452 Ca 0.02 0.55 0.05 0.00 -1.18 0.00 0.00 61.69 61.13 1b76 s THR 452 Cb -0.01 -4.16 0.28 0.00 1.34 0.00 0.00 72.50 69.95 1b76 s THR 452 CO 0.86 -0.44 1.08 -0.81 -0.54 0.00 0.00 174.62 174.77 1b76 n PRO 453 N 6.26 -0.05 -3.83 3.99 -0.04 -1.25 -4.67 135.00 135.41 1b76 n PRO 453 Ca 0.00 1.01 -0.12 0.00 -0.04 0.00 0.00 63.50 64.35 1b76 n PRO 453 Cb 0.48 -1.65 -0.11 0.00 -0.04 0.00 0.00 33.50 32.18 1b76 n PRO 453 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1b76 s PHE 454 N -5.43 -0.11 -0.31 0.54 0.08 -1.18 -2.11 117.98 109.45 1b76 s PHE 454 Ca -0.08 0.26 0.02 0.00 0.12 0.00 0.00 56.93 57.25 1b76 s PHE 454 Cb 0.21 0.03 0.09 0.00 -0.57 0.00 0.00 43.02 42.78 1b76 s PHE 454 CO 0.54 -0.18 0.04 0.00 -0.10 0.00 0.00 175.22 175.52 1b76 s ALA 455 N -0.49 2.29 0.23 5.36 0.00 -1.24 -1.50 121.76 126.42 1b76 s ALA 455 Ca -0.06 -2.03 -0.30 0.00 0.00 0.00 0.00 51.96 49.57 1b76 s ALA 455 Cb -0.04 -1.75 -0.09 0.00 0.00 0.00 0.00 23.12 21.24 1b76 s ALA 455 CO 0.01 -1.58 0.98 0.08 0.00 0.00 0.00 175.76 175.25 1b76 s VAL 456 N 1.22 4.00 -0.11 0.00 1.01 0.12 -1.86 120.40 124.78 1b76 s VAL 456 Ca 0.07 1.94 0.01 0.00 0.00 0.00 0.00 61.98 64.00 1b76 s VAL 456 Cb -0.18 -4.24 0.02 0.00 0.00 0.00 0.00 36.38 31.98 1b76 s VAL 456 CO -0.13 0.43 -0.11 0.28 0.00 0.00 0.00 175.10 175.58 1b76 s THR 457 N -0.96 1.21 0.07 3.92 -1.32 -0.14 -1.40 115.64 117.02 1b76 s THR 457 Ca 0.43 -0.44 -0.13 0.00 -1.21 0.00 0.00 61.69 60.35 1b76 s THR 457 Cb -0.27 -1.17 -0.06 0.00 -1.51 0.00 0.00 72.50 69.49 1b76 s THR 457 CO 0.34 0.39 0.45 -0.69 -2.21 0.00 0.00 174.62 172.89 1b76 s VAL 458 N 1.35 5.00 0.28 5.08 1.01 -0.48 -2.63 120.40 130.01 1b76 s VAL 458 Ca -0.01 0.68 -0.17 0.00 0.00 0.00 0.00 61.98 62.49 1b76 s VAL 458 Cb -0.14 -3.70 0.01 0.00 0.00 0.00 0.00 36.38 32.56 1b76 s VAL 458 CO -0.05 0.37 0.63 1.51 0.00 0.00 0.00 175.10 177.55 1b76 s ASP 459 N -1.54 -0.11 0.24 3.32 -4.77 -1.26 0.58 116.67 113.13 1b76 s ASP 459 Ca 0.32 -0.83 0.02 0.00 -3.30 0.00 0.00 52.55 48.76 1b76 s ASP 459 Cb -0.15 0.69 0.61 0.00 -1.09 0.00 0.00 42.92 42.98 1b76 s ASP 459 CO 0.17 -1.31 1.20 -1.22 0.70 0.00 0.00 175.17 174.71 1b76 n TYR 460 N -0.45 0.51 -0.08 2.11 4.01 -1.26 0.89 117.16 122.90 1b76 n TYR 460 Ca -0.03 0.92 -0.10 0.00 -0.16 0.00 0.00 57.90 58.53 1b76 n TYR 460 Cb 0.60 -1.09 -0.03 0.00 -0.31 0.00 0.00 39.34 38.51 1b76 n TYR 460 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 1b76 h ASP 461 N 0.00 0.34 -0.70 7.72 5.19 -1.93 -1.14 116.42 125.90 1b76 h ASP 461 Ca 0.48 -0.12 0.10 0.00 -0.62 0.00 0.00 57.03 56.87 1b76 h ASP 461 Cb 1.00 -0.09 -0.07 0.00 0.18 0.00 0.00 39.33 40.35 1b76 h ASP 461 CO -0.71 0.36 0.33 0.74 -3.12 0.00 0.00 179.24 176.84 1b76 h THR 462 N 0.29 0.82 0.72 0.35 2.02 0.38 -2.59 112.91 114.91 1b76 h THR 462 Ca 0.09 -0.19 -0.03 0.00 0.77 0.00 0.00 66.41 67.05 1b76 h THR 462 Cb 0.11 0.21 -0.01 0.00 -1.74 0.00 0.00 68.15 66.72 1b76 h THR 462 CO -0.01 0.10 -0.47 0.40 0.37 0.00 0.00 175.52 175.92 1b76 h ILE 463 N 0.56 0.00 0.00 3.11 2.04 -0.84 0.36 117.51 122.74 1b76 h ILE 463 Ca 0.35 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.21 1b76 h ILE 463 Cb 0.39 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.47 1b76 h ILE 463 CO -0.28 0.00 0.00 0.61 0.00 0.00 0.00 178.15 178.48 1b76 n GLY 464 N -1.58 0.96 3.42 5.37 0.00 -0.48 -4.74 105.19 108.13 1b76 n GLY 464 Ca -0.14 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.44 1b76 n GLY 464 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1b76 s GLN 465 N 0.00 3.71 0.44 1.61 2.00 -1.12 -4.77 119.66 121.53 1b76 s GLN 465 Ca 0.00 -2.11 0.05 0.00 -2.00 0.00 0.00 55.36 51.30 1b76 s GLN 465 Cb 0.00 -4.82 0.01 0.00 0.80 0.00 0.00 33.01 29.00 1b76 s GLN 465 CO 0.00 -1.65 0.62 -1.54 -0.50 0.00 0.00 175.29 172.22 1b76 s SER 466 N 3.09 5.62 0.00 6.67 1.04 -1.26 -4.41 113.70 124.45 1b76 s SER 466 Ca 0.31 -0.23 0.00 0.00 0.48 0.00 0.00 55.95 56.51 1b76 s SER 466 Cb -0.06 -0.86 0.00 0.00 0.10 0.00 0.00 66.02 65.20 1b76 s SER 466 CO -0.08 -0.81 0.99 2.29 0.98 0.00 0.00 173.24 176.62 1b76 n LYS 467 N -1.96 0.00 0.00 4.02 0.00 -1.26 -2.24 118.16 116.72 1b76 n LYS 467 Ca 0.06 0.53 0.01 0.00 -0.00 0.00 0.00 58.31 58.91 1b76 n LYS 467 Cb 0.59 -1.49 0.03 0.00 -0.00 0.00 0.00 35.03 34.16 1b76 n LYS 467 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 1b76 n ASP 468 N -2.05 0.00 0.00 -5.58 5.75 -1.26 -4.84 116.55 108.57 1b76 n ASP 468 Ca 0.00 -0.52 0.00 0.00 -0.01 0.00 0.00 54.79 54.26 1b76 n ASP 468 Cb 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.09 1b76 n ASP 468 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1b76 n GLY 469 N -0.25 1.16 3.15 6.12 0.00 -0.95 -4.99 105.19 109.43 1b76 n GLY 469 Ca 0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 1b76 n GLY 469 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1b76 n THR 470 N 0.00 0.00 -1.50 2.61 -1.04 -1.26 -4.61 114.28 108.48 1b76 n THR 470 Ca 0.00 -0.23 -0.11 0.00 -2.04 0.00 0.00 64.05 61.67 1b76 n THR 470 Cb 0.00 -0.28 0.17 0.00 -1.82 0.00 0.00 70.33 68.40 1b76 n THR 470 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 1b76 n THR 471 N -3.54 2.71 0.19 12.58 -2.24 -1.26 -4.61 114.28 118.10 1b76 n THR 471 Ca 0.00 -2.87 -0.07 0.00 -2.27 0.00 0.00 64.05 58.84 1b76 n THR 471 Cb 0.63 -0.49 -0.04 0.00 -2.10 0.00 0.00 70.33 68.33 1b76 n THR 471 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 1b76 h ARG 472 N 1.21 -0.46 0.00 -0.78 1.12 -1.94 -3.25 114.38 110.28 1b76 h ARG 472 Ca 0.31 0.03 0.00 0.00 -1.11 0.00 0.00 59.98 59.21 1b76 h ARG 472 Cb 1.69 0.11 0.00 0.00 -0.01 0.00 0.00 29.97 31.76 1b76 h ARG 472 CO 0.60 -0.31 0.00 1.28 -3.11 0.00 0.00 179.97 178.43 1b76 n LEU 473 N -3.55 0.00 -4.59 3.80 4.77 -1.26 -4.86 117.00 111.31 1b76 n LEU 473 Ca -0.06 0.44 -0.49 0.00 -0.03 0.00 0.00 56.01 55.87 1b76 n LEU 473 Cb 0.19 -0.44 -0.05 0.00 -2.33 0.00 0.00 43.42 40.79 1b76 n LEU 473 CO 0.14 -0.00 0.81 1.17 -1.33 0.00 0.00 177.39 178.18 1b76 n LYS 474 N -1.44 1.25 -0.86 3.23 4.81 -1.12 -0.29 118.16 123.75 1b76 n LYS 474 Ca 0.09 0.45 0.00 0.00 -0.87 0.00 0.00 58.31 57.98 1b76 n LYS 474 Cb 0.31 -2.01 0.00 0.00 0.02 0.00 0.00 35.03 33.35 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 2.23 -2.58 -4.19 3.14 9.92 0.13 -4.93 116.55 120.27 1b76 n ASP 475 Ca 0.16 0.00 -0.27 0.00 -0.53 0.00 0.00 54.79 54.15 1b76 n ASP 475 Cb 0.23 -0.43 -0.16 0.00 -0.64 0.00 0.00 41.12 40.13 1b76 n ASP 475 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 1b76 s THR 476 N -2.00 1.58 0.45 -3.53 -4.23 0.61 -1.92 115.64 106.59 1b76 s THR 476 Ca 0.00 -0.83 0.03 0.00 -1.18 0.00 0.00 61.69 59.70 1b76 s THR 476 Cb 0.00 -1.33 -0.03 0.00 1.34 0.00 0.00 72.50 72.49 1b76 s THR 476 CO 0.00 0.45 0.06 0.68 -0.54 0.00 0.00 174.62 175.26 1b76 s VAL 477 N -0.29 1.02 -0.27 2.29 -7.23 0.22 -3.96 120.40 112.18 1b76 s VAL 477 Ca 0.03 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.23 1b76 s VAL 477 Cb -0.09 -2.35 0.07 0.00 0.56 0.00 0.00 36.38 34.56 1b76 s VAL 477 CO 0.01 0.00 -0.07 0.42 -0.31 0.00 0.00 175.10 175.15 1b76 s THR 478 N -3.02 2.09 -0.37 5.32 -4.23 -1.08 -0.27 115.64 114.08 1b76 s THR 478 Ca 0.17 -1.71 -0.21 0.00 -1.18 0.00 0.00 61.69 58.76 1b76 s THR 478 Cb 0.03 -2.29 0.01 0.00 1.34 0.00 0.00 72.50 71.59 1b76 s THR 478 CO 0.10 -0.15 0.68 0.54 -0.54 0.00 0.00 174.62 175.25 1b76 s VAL 479 N 1.11 4.83 -0.42 2.29 0.11 -0.86 -0.97 120.40 126.50 1b76 s VAL 479 Ca -0.05 0.64 -0.13 0.00 -2.93 0.00 0.00 61.98 59.51 1b76 s VAL 479 Cb -0.20 -4.13 0.04 0.00 -1.53 0.00 0.00 36.38 30.56 1b76 s VAL 479 CO -0.06 -0.38 0.29 -0.60 -3.33 0.00 0.00 175.10 171.02 1b76 s ARG 480 N 2.84 2.89 -0.01 1.54 3.52 -0.78 -2.54 118.95 126.41 1b76 s ARG 480 Ca 0.26 -1.16 -0.30 0.00 -0.13 0.00 0.00 55.73 54.40 1b76 s ARG 480 Cb -0.14 -3.92 -0.09 0.00 -1.56 0.00 0.00 34.95 29.24 1b76 s ARG 480 CO 0.16 -0.82 2.01 -3.47 -0.81 0.00 0.00 175.30 172.36 1b76 n ASP 481 N 5.10 3.98 -0.09 -2.12 -0.08 0.62 -3.60 116.55 120.35 1b76 n ASP 481 Ca -0.11 0.81 -0.11 0.00 -1.51 0.00 0.00 54.79 53.87 1b76 n ASP 481 Cb 0.45 -1.52 -0.07 0.00 2.34 0.00 0.00 41.12 42.32 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 11.13 -0.31 0.07 -0.67 2.43 -1.69 0.67 114.38 126.02 1b76 h ARG 482 Ca -0.48 0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 58.70 1b76 h ARG 482 Cb 1.24 0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.86 1b76 h ARG 482 CO 0.94 -0.20 -0.04 -0.44 -1.51 0.00 0.00 179.97 178.72 1b76 h ASP 483 N -0.32 -0.08 0.42 -3.80 3.32 -1.92 -3.30 116.42 110.73 1b76 h ASP 483 Ca 0.05 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.10 1b76 h ASP 483 Cb 0.45 0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.03 1b76 h ASP 483 CO -0.43 -0.06 0.00 0.35 -1.72 0.00 0.00 179.24 177.39 1b76 n THR 484 N -2.29 0.97 -1.09 0.35 -2.24 -1.20 -4.85 114.28 103.94 1b76 n THR 484 Ca -0.01 0.43 -0.03 0.00 -2.27 0.00 0.00 64.05 62.16 1b76 n THR 484 Cb 0.04 -1.38 -0.01 0.00 -2.10 0.00 0.00 70.33 66.88 1b76 n THR 484 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 1b76 n MET 485 N -2.16 -1.92 -2.39 -0.78 2.81 0.23 -4.93 117.12 107.99 1b76 n MET 485 Ca 0.01 0.61 -0.41 0.00 -1.81 0.00 0.00 57.70 56.10 1b76 n MET 485 Cb 0.14 -5.08 -0.04 0.00 -0.71 0.00 0.00 33.22 27.54 1b76 n MET 485 CO 0.00 0.00 0.00 -1.21 1.51 0.00 0.00 175.97 176.27 1b76 s GLU 486 N -2.26 4.56 -0.34 0.03 0.41 -1.24 -4.71 118.70 115.14 1b76 s GLU 486 Ca 0.00 1.90 0.03 0.00 -0.41 0.00 0.00 54.97 56.49 1b76 s GLU 486 Cb 0.00 -3.17 0.10 0.00 -1.78 0.00 0.00 34.13 29.27 1b76 s GLU 486 CO 0.00 0.08 0.06 -0.65 -0.49 0.00 0.00 175.26 174.26 1b76 s GLN 487 N -1.31 1.64 -0.11 1.61 -0.21 -1.26 -0.28 119.66 119.75 1b76 s GLN 487 Ca 0.47 -1.81 -0.05 0.00 0.02 0.00 0.00 55.36 53.99 1b76 s GLN 487 Cb -0.34 -3.24 -0.04 0.00 1.00 0.00 0.00 33.01 30.40 1b76 s GLN 487 CO 0.43 -0.92 0.07 0.96 -2.12 0.00 0.00 175.29 173.71 1b76 s ILE 488 N 0.96 4.91 -0.22 1.08 -4.36 -1.05 -4.95 121.20 117.57 1b76 s ILE 488 Ca 0.09 -0.01 -0.17 0.00 -0.26 0.00 0.00 60.65 60.29 1b76 s ILE 488 Cb -0.20 -3.12 -0.04 0.00 1.25 0.00 0.00 42.46 40.36 1b76 s ILE 488 CO -0.07 0.60 0.44 -0.60 0.24 0.00 0.00 174.94 175.55 1b76 s ARG 489 N -0.85 4.15 0.07 0.37 3.52 -1.26 -2.03 118.95 122.91 1b76 s ARG 489 Ca 0.13 0.26 0.01 0.00 -0.13 0.00 0.00 55.73 56.00 1b76 s ARG 489 Cb -0.12 -3.57 -0.04 0.00 -1.56 0.00 0.00 34.95 29.66 1b76 s ARG 489 CO 0.03 -0.14 -0.05 -0.48 -0.81 0.00 0.00 175.30 173.85 1b76 s LEU 490 N 1.61 2.48 0.30 -0.88 0.05 0.63 -4.95 118.68 117.92 1b76 s LEU 490 Ca 0.20 -0.97 -0.28 0.00 0.05 0.00 0.00 54.13 53.13 1b76 s LEU 490 Cb -0.15 0.05 -0.09 0.00 -2.05 0.00 0.00 46.19 43.94 1b76 s LEU 490 CO 0.09 -0.51 1.09 -2.28 -0.55 0.00 0.00 176.35 174.19 1b76 s HIS 491 N -3.58 3.52 0.21 3.48 5.65 -1.26 -0.61 115.29 122.69 1b76 s HIS 491 Ca 0.08 1.69 -0.18 0.00 0.25 0.00 0.00 55.06 56.90 1b76 s HIS 491 Cb 0.05 -3.26 0.20 0.00 -1.18 0.00 0.00 32.58 28.40 1b76 s HIS 491 CO -0.07 -0.57 1.58 0.28 -0.65 0.00 0.00 174.74 175.32 1b76 h VAL 492 N 2.93 0.15 -0.80 0.89 2.07 -1.76 0.25 116.25 119.99 1b76 h VAL 492 Ca -0.47 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.20 1b76 h VAL 492 Cb 1.21 0.15 -0.06 0.00 -1.52 0.00 0.00 31.29 31.08 1b76 h VAL 492 CO 0.66 0.00 0.53 0.44 0.02 0.00 0.00 177.57 179.22 1b76 h ASP 493 N -0.09 0.45 -0.14 0.57 3.32 -1.93 0.61 116.42 119.21 1b76 h ASP 493 Ca 0.29 0.03 -0.14 0.00 0.02 0.00 0.00 57.03 57.23 1b76 h ASP 493 Cb 0.56 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.06 1b76 h ASP 493 CO -0.77 0.23 -0.48 -0.33 -1.72 0.00 0.00 179.24 176.17 1b76 h GLU 494 N 0.47 0.57 -0.80 3.56 4.39 -0.94 -3.27 114.58 118.57 1b76 h GLU 494 Ca 0.40 -0.43 0.18 0.00 0.34 0.00 0.00 59.36 59.85 1b76 h GLU 494 Cb 0.85 0.08 -0.05 0.00 -0.10 0.00 0.00 28.75 29.53 1b76 h GLU 494 CO -0.14 1.05 0.54 1.25 -1.16 0.00 0.00 179.01 180.55 1b76 h LEU 495 N 0.21 0.31 -0.40 1.33 5.85 0.49 0.70 115.31 123.80 1b76 h LEU 495 Ca -0.02 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.72 1b76 h LEU 495 Cb 1.10 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 42.08 1b76 h LEU 495 CO 0.10 0.14 0.22 -0.33 -0.34 0.00 0.00 178.44 178.23 1b76 h GLU 496 N 0.32 0.56 -0.49 1.25 5.08 -1.52 -2.72 114.58 117.06 1b76 h GLU 496 Ca 0.40 -0.07 -0.08 0.00 -1.00 0.00 0.00 59.36 58.61 1b76 h GLU 496 Cb 1.09 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 30.21 1b76 h GLU 496 CO -0.11 0.46 -0.01 0.78 -1.00 0.00 0.00 179.01 179.13 1b76 h GLY 497 N 0.52 0.95 0.16 -3.84 0.00 -1.02 -1.35 103.07 98.48 1b76 h GLY 497 Ca 0.14 -0.71 0.03 0.00 0.00 0.00 0.00 47.33 46.79 1b76 h GLY 497 CO -0.02 0.65 -0.42 -2.75 0.00 0.00 0.00 176.54 174.00 1b76 h PHE 498 N 0.74 -1.20 -0.74 5.60 3.04 -1.27 -1.07 116.94 122.03 1b76 h PHE 498 Ca 0.14 0.04 0.02 0.00 3.98 0.00 0.00 57.97 62.15 1b76 h PHE 498 Cb 0.53 0.52 -0.04 0.00 2.56 0.00 0.00 35.95 39.52 1b76 h PHE 498 CO 0.04 -0.50 0.48 -0.07 -2.02 0.00 0.00 178.31 176.24 1b76 h LEU 499 N -0.59 0.80 -1.30 0.59 3.38 -1.44 -1.44 115.31 115.31 1b76 h LEU 499 Ca 0.04 -0.01 0.24 0.00 0.09 0.00 0.00 57.88 58.24 1b76 h LEU 499 Cb 0.66 -0.19 -0.09 0.00 0.09 0.00 0.00 40.66 41.13 1b76 h LEU 499 CO -0.31 0.57 0.64 0.03 0.09 0.00 0.00 178.44 179.46 1b76 h ARG 500 N 0.95 0.46 0.17 1.13 2.47 -0.23 -0.82 114.38 118.51 1b76 h ARG 500 Ca 0.29 -0.03 -0.25 0.00 -1.26 0.00 0.00 59.98 58.73 1b76 h ARG 500 Cb -0.04 -0.10 0.03 0.00 -1.65 0.00 0.00 29.97 28.21 1b76 h ARG 500 CO -0.09 0.31 -1.09 0.93 0.56 0.00 0.00 179.97 180.59 1b76 h GLU 501 N 0.48 0.45 0.03 0.04 5.08 -0.17 -3.28 114.58 117.19 1b76 h GLU 501 Ca 0.57 -0.70 -0.00 0.00 -1.00 0.00 0.00 59.36 58.23 1b76 h GLU 501 Cb 1.31 0.25 0.00 0.00 0.50 0.00 0.00 28.75 30.81 1b76 h GLU 501 CO -0.30 1.32 -0.01 0.00 -1.00 0.00 0.00 179.01 179.02 1b76 h ARG 502 N -0.07 -0.03 0.00 2.33 -0.00 -0.80 -3.37 114.38 112.44 1b76 h ARG 502 Ca -0.18 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.30 1b76 h ARG 502 Cb 1.84 0.01 0.00 0.00 0.00 0.00 0.00 29.97 31.82 1b76 h ARG 502 CO 0.21 0.60 0.00 1.28 0.00 0.00 0.00 179.97 182.06 1b76 n LEU 503 N -4.71 0.00 -4.73 3.04 4.77 -0.40 -4.82 117.00 110.14 1b76 n LEU 503 Ca -0.07 0.36 -0.41 0.00 -0.03 0.00 0.00 56.01 55.86 1b76 n LEU 503 Cb 0.32 -0.36 -0.04 0.00 -2.33 0.00 0.00 43.42 41.00 1b76 n LEU 503 CO 0.24 -0.14 0.75 -0.13 -1.33 0.00 0.00 177.39 176.78 1b76 s ARG 504 N -2.73 4.61 0.00 3.23 0.52 -1.24 -4.64 118.95 118.70 1b76 s ARG 504 Ca 0.14 1.60 0.09 0.00 -0.52 0.00 0.00 55.73 57.04 1b76 s ARG 504 Cb 0.12 -3.34 0.56 0.00 0.52 0.00 0.00 34.95 32.81 1b76 s ARG 504 CO 0.30 0.07 1.01 0.91 0.02 0.00 0.00 175.30 177.61