#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b82 s ILE -3 N 0.00 4.64 -0.00 2.52 1.09 -1.26 -5.03 121.20 123.16 1b82 s ILE -3 Ca 0.00 1.01 -0.05 0.00 -1.10 0.00 0.00 60.65 60.52 1b82 s ILE -3 Cb 0.00 -4.29 -0.04 0.00 -1.06 0.00 0.00 42.46 37.07 1b82 s ILE -3 CO 0.00 -0.52 0.23 -1.61 -0.10 0.00 0.00 174.94 172.94 1b82 s GLU -2 N 3.34 3.51 -0.40 2.79 2.02 -1.26 -5.07 118.70 123.63 1b82 s GLU -2 Ca 0.35 -0.19 0.03 0.00 0.02 0.00 0.00 54.97 55.18 1b82 s GLU -2 Cb -0.12 -3.08 0.11 0.00 0.10 0.00 0.00 34.13 31.14 1b82 s GLU -2 CO 0.19 0.66 0.13 0.21 0.02 0.00 0.00 175.26 176.47 1b82 s LYS -1 N -1.84 1.50 0.25 1.61 2.20 -1.23 -4.99 119.74 117.23 1b82 s LYS -1 Ca 0.27 -2.00 -0.31 0.00 -0.36 0.00 0.00 55.97 53.58 1b82 s LYS -1 Cb -0.13 -3.00 -0.14 0.00 -1.51 0.00 0.00 37.83 33.05 1b82 s LYS -1 CO 0.17 -1.02 1.30 -2.13 -0.36 0.00 0.00 175.35 173.32 1b82 n ARG 0 N 3.93 1.81 -3.68 4.03 0.63 -1.06 -1.33 116.66 121.00 1b82 n ARG 0 Ca 0.04 0.64 -0.10 0.00 -0.92 0.00 0.00 57.85 57.51 1b82 n ARG 0 Cb 0.38 -2.23 -0.05 0.00 0.45 0.00 0.00 32.46 31.01 1b82 n ARG 0 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1b82 s ALA 1 N -0.32 -0.80 -0.25 5.13 0.00 -0.50 -4.82 121.76 120.20 1b82 s ALA 1 Ca 0.66 -0.13 -0.08 0.00 0.00 0.00 0.00 51.96 52.41 1b82 s ALA 1 Cb -0.68 0.63 -0.04 0.00 0.00 0.00 0.00 23.12 23.03 1b82 s ALA 1 CO 0.53 -0.60 0.10 0.99 0.00 0.00 0.00 175.76 176.77 1b82 s THR 2 N -3.71 4.61 0.79 0.00 2.01 -1.26 -0.52 115.64 117.55 1b82 s THR 2 Ca 0.03 -0.07 -0.12 0.00 0.31 0.00 0.00 61.69 61.83 1b82 s THR 2 Cb 0.02 -3.15 0.07 0.00 0.01 0.00 0.00 72.50 69.45 1b82 s THR 2 CO -0.11 0.34 1.14 0.00 -0.69 0.00 0.00 174.62 175.30 1b82 h SER 4 N -0.99 0.00 0.24 0.00 4.64 -1.95 0.37 113.55 115.87 1b82 h SER 4 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1b82 h SER 4 Cb 1.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 1b82 h SER 4 CO 0.64 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 176.14 1b82 n ASN 5 N -3.79 0.00 0.00 4.97 2.04 -1.26 -4.88 115.26 112.34 1b82 n ASN 5 Ca -0.01 -0.58 0.00 0.00 -0.44 0.00 0.00 54.58 53.55 1b82 n ASN 5 Cb 0.21 -0.13 0.00 0.00 -2.53 0.00 0.00 39.78 37.33 1b82 n ASN 5 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1b82 n GLY 6 N 1.02 0.74 3.87 4.83 0.00 0.13 -5.06 105.19 110.73 1b82 n GLY 6 Ca 0.19 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.84 1b82 n GLY 6 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b82 s LYS 7 N -0.64 3.57 0.00 1.61 -0.14 -1.25 -4.79 119.74 118.10 1b82 s LYS 7 Ca 0.00 -0.02 -0.17 0.00 -1.36 0.00 0.00 55.97 54.43 1b82 s LYS 7 Cb 0.00 -3.17 -0.06 0.00 -1.68 0.00 0.00 37.83 32.93 1b82 s LYS 7 CO 0.00 0.73 0.47 0.99 -0.76 0.00 0.00 175.35 176.78 1b82 s THR 8 N -1.12 4.97 0.26 2.17 2.01 -1.26 -0.13 115.64 122.54 1b82 s THR 8 Ca 0.20 0.98 0.04 0.00 0.31 0.00 0.00 61.69 63.22 1b82 s THR 8 Cb -0.13 -3.79 -0.06 0.00 0.01 0.00 0.00 72.50 68.53 1b82 s THR 8 CO 0.09 0.53 -0.01 0.68 -0.69 0.00 0.00 174.62 175.22 1b82 s VAL 9 N -0.77 1.24 0.15 3.82 -7.23 0.32 -4.94 120.40 112.98 1b82 s VAL 9 Ca 0.26 -2.05 0.24 0.00 -1.81 0.00 0.00 61.98 58.61 1b82 s VAL 9 Cb -0.17 -2.45 0.23 0.00 0.56 0.00 0.00 36.38 34.54 1b82 s VAL 9 CO 0.15 -0.26 1.83 1.23 -0.31 0.00 0.00 175.10 177.74 1b82 h GLY 10 N 2.35 0.00 -5.40 2.32 0.00 -1.86 -1.34 103.07 99.15 1b82 h GLY 10 Ca -0.39 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 46.76 1b82 h GLY 10 CO 0.66 0.00 -0.47 -0.35 0.00 0.00 0.00 176.54 176.39 1b82 s ASP 11 N -6.20 -0.22 0.42 0.19 2.15 -1.25 -2.55 116.67 109.20 1b82 s ASP 11 Ca 0.00 0.43 0.14 0.00 0.43 0.00 0.00 52.55 53.56 1b82 s ASP 11 Cb 0.10 0.44 1.00 0.00 -0.30 0.00 0.00 42.92 44.16 1b82 s ASP 11 CO 0.64 -0.08 1.94 0.00 -0.17 0.00 0.00 175.17 177.50 1b82 h ALA 12 N 5.83 2.03 0.00 3.66 0.00 -1.49 -0.78 119.26 128.50 1b82 h ALA 12 Ca -0.26 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1b82 h ALA 12 Cb 1.19 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1b82 h ALA 12 CO 0.37 -0.20 0.00 0.66 0.00 0.00 0.00 179.25 180.08 1b82 h SER 13 N 0.46 0.00 0.91 0.00 4.64 -1.96 -2.85 113.55 114.75 1b82 h SER 13 Ca 0.34 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.60 1b82 h SER 13 Cb 0.68 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.76 1b82 h SER 13 CO -0.11 0.00 -0.28 0.00 -0.87 0.00 0.00 176.83 175.57 1b82 h ALA 16 N 1.62 1.61 0.00 0.00 0.00 -1.80 -1.76 119.26 118.93 1b82 h ALA 16 Ca 0.42 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1b82 h ALA 16 Cb 0.83 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1b82 h ALA 16 CO -0.17 0.29 0.00 -1.49 0.00 0.00 0.00 179.25 177.88 1b82 h TRP 17 N 0.05 0.00 -0.07 0.00 4.06 -1.44 -1.96 115.95 116.60 1b82 h TRP 17 Ca 0.01 0.00 -0.07 0.00 2.06 0.00 0.00 58.89 60.89 1b82 h TRP 17 Cb 0.38 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.53 1b82 h TRP 17 CO 0.00 0.00 -0.29 0.74 -3.56 0.00 0.00 178.44 175.33 1b82 h PHE 18 N 0.00 0.14 -0.08 0.49 0.04 -1.42 0.01 116.94 116.12 1b82 h PHE 18 Ca 0.00 -0.03 -0.24 0.00 2.80 0.00 0.00 57.97 60.50 1b82 h PHE 18 Cb 0.28 -0.04 0.01 0.00 2.20 0.00 0.00 35.95 38.41 1b82 h PHE 18 CO 0.00 0.41 -0.90 -0.44 -0.60 0.00 0.00 178.31 176.78 1b82 h ASP 19 N 0.11 0.89 -0.39 2.17 3.32 -1.53 -2.28 116.42 118.71 1b82 h ASP 19 Ca 0.02 -0.64 0.03 0.00 0.02 0.00 0.00 57.03 56.46 1b82 h ASP 19 Cb 0.57 -0.27 -0.04 0.00 0.22 0.00 0.00 39.33 39.82 1b82 h ASP 19 CO 0.04 1.44 0.18 0.58 -1.72 0.00 0.00 179.24 179.76 1b82 h VAL 20 N 0.45 0.95 -0.06 -1.35 2.07 -1.35 -1.97 116.25 115.01 1b82 h VAL 20 Ca -0.09 -0.13 0.04 0.00 0.82 0.00 0.00 66.70 67.34 1b82 h VAL 20 Cb 1.53 0.55 -0.05 0.00 -1.52 0.00 0.00 31.29 31.81 1b82 h VAL 20 CO 0.18 0.07 -0.23 0.25 0.02 0.00 0.00 177.57 177.86 1b82 h LEU 21 N 0.37 -0.68 -1.03 2.57 5.85 -0.96 0.19 115.31 121.62 1b82 h LEU 21 Ca 0.17 0.10 -0.04 0.00 0.84 0.00 0.00 57.88 58.96 1b82 h LEU 21 Cb 0.10 0.29 -0.03 0.00 0.37 0.00 0.00 40.66 41.39 1b82 h LEU 21 CO -0.13 -0.29 0.26 0.44 -0.34 0.00 0.00 178.44 178.39 1b82 h ASP 22 N -0.33 0.88 0.41 1.25 3.32 -1.26 -1.03 116.42 119.66 1b82 h ASP 22 Ca 0.08 -0.12 -0.02 0.00 0.02 0.00 0.00 57.03 56.99 1b82 h ASP 22 Cb 0.44 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.76 1b82 h ASP 22 CO -0.24 0.78 -0.20 -0.78 -1.72 0.00 0.00 179.24 177.08 1b82 h ASP 23 N 0.94 -0.47 0.24 6.45 3.58 -0.86 -2.80 116.42 123.50 1b82 h ASP 23 Ca 0.22 -0.10 -0.08 0.00 0.42 0.00 0.00 57.03 57.50 1b82 h ASP 23 Cb 0.18 0.12 -0.01 0.00 1.72 0.00 0.00 39.33 41.34 1b82 h ASP 23 CO -0.02 -0.16 -0.31 0.16 -2.88 0.00 0.00 179.24 176.03 1b82 h ILE 24 N -0.79 1.25 -0.53 2.25 3.07 -0.91 0.33 117.51 122.18 1b82 h ILE 24 Ca -0.06 -1.17 -0.03 0.00 1.55 0.00 0.00 64.86 65.16 1b82 h ILE 24 Cb 0.54 1.54 -0.02 0.00 -0.27 0.00 0.00 36.82 38.61 1b82 h ILE 24 CO 0.09 0.34 0.23 1.56 -1.05 0.00 0.00 178.15 179.33 1b82 h GLN 25 N 0.11 0.77 0.20 0.16 1.08 -1.20 0.23 115.11 116.46 1b82 h GLN 25 Ca 0.01 -0.13 -0.28 0.00 -1.45 0.00 0.00 58.65 56.80 1b82 h GLN 25 Cb 0.60 -0.13 0.03 0.00 -0.05 0.00 0.00 27.48 27.93 1b82 h GLN 25 CO 0.04 0.66 -1.28 -0.56 -0.95 0.00 0.00 178.83 176.74 1b82 h GLN 26 N 0.71 0.42 0.00 1.46 3.07 -1.31 0.32 115.11 119.78 1b82 h GLN 26 Ca 0.18 -0.72 0.00 0.00 0.09 0.00 0.00 58.65 58.20 1b82 h GLN 26 Cb 0.16 0.27 0.00 0.00 0.08 0.00 0.00 27.48 27.99 1b82 h GLN 26 CO -0.02 1.35 -1.06 0.09 0.09 0.00 0.00 178.83 179.27 1b82 n ASN 27 N -3.86 0.86 -0.04 0.06 3.02 0.09 -3.65 115.26 111.75 1b82 n ASN 27 Ca -0.17 -0.85 -0.06 0.00 -0.03 0.00 0.00 54.58 53.47 1b82 n ASN 27 Cb 0.99 1.12 -0.03 0.00 -0.61 0.00 0.00 39.78 41.25 1b82 n ASN 27 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 1b82 n LEU 28 N -1.56 2.32 -1.53 3.41 7.94 0.61 -4.77 117.00 123.42 1b82 n LEU 28 Ca 0.03 -0.00 0.05 0.00 -1.11 0.00 0.00 56.01 54.97 1b82 n LEU 28 Cb 0.34 -0.24 0.33 0.00 0.53 0.00 0.00 43.42 44.38 1b82 n LEU 28 CO 0.41 0.49 0.84 0.49 -1.11 0.00 0.00 177.39 178.51 1b82 n PHE 29 N -2.87 1.71 -4.00 1.96 3.72 -0.10 -4.78 117.46 113.09 1b82 n PHE 29 Ca -0.13 -0.90 -0.28 0.00 -0.05 0.00 0.00 57.45 56.08 1b82 n PHE 29 Cb 0.62 -0.48 -0.01 0.00 -0.94 0.00 0.00 39.48 38.67 1b82 n PHE 29 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 1b82 n HIS 30 N 0.01 -1.77 -0.81 1.38 8.25 -1.17 -0.80 115.22 120.32 1b82 n HIS 30 Ca 0.28 0.79 0.00 0.00 -0.26 0.00 0.00 57.72 58.53 1b82 n HIS 30 Cb 1.12 -3.61 0.00 0.00 1.12 0.00 0.00 29.99 28.62 1b82 n HIS 30 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1b82 n GLY 31 N -1.78 1.33 2.12 -1.41 0.00 0.11 -4.44 105.19 101.13 1b82 n GLY 31 Ca -0.17 -0.35 -0.07 0.00 0.00 0.00 0.00 46.02 45.43 1b82 n GLY 31 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b82 n GLY 32 N -0.96 0.46 3.91 -0.02 0.00 -0.79 -4.99 105.19 102.79 1b82 n GLY 32 Ca 0.00 -0.43 -0.28 0.00 0.00 0.00 0.00 46.02 45.31 1b82 n GLY 32 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1b82 s GLN 33 N -5.25 3.61 -0.92 1.61 -0.21 0.02 -4.77 119.66 113.75 1b82 s GLN 33 Ca 0.15 0.02 -0.01 0.00 0.02 0.00 0.00 55.36 55.55 1b82 s GLN 33 Cb -0.07 -2.58 0.34 0.00 1.00 0.00 0.00 33.01 31.70 1b82 s GLN 33 CO 0.19 0.10 1.83 0.00 -2.12 0.00 0.00 175.29 175.29 1b82 n GLY 35 N -0.26 3.74 0.14 0.00 0.00 -1.26 -4.60 105.19 102.95 1b82 n GLY 35 Ca 0.48 -1.98 -0.06 0.00 0.00 0.00 0.00 46.02 44.46 1b82 n GLY 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b82 h ALA 36 N -0.27 0.30 -0.28 4.61 0.00 -1.93 -1.44 119.26 120.25 1b82 h ALA 36 Ca 0.00 0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 1b82 h ALA 36 Cb 0.00 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1b82 h ALA 36 CO 0.00 -0.39 -0.06 0.93 0.00 0.00 0.00 179.25 179.73 1b82 h GLU 37 N 0.12 0.45 -0.14 0.00 3.07 -1.93 -0.40 114.58 115.73 1b82 h GLU 37 Ca 0.15 -0.10 -0.01 0.00 -0.50 0.00 0.00 59.36 58.90 1b82 h GLU 37 Cb 0.19 -0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 28.03 1b82 h GLU 37 CO -0.23 0.52 0.06 0.00 -1.40 0.00 0.00 179.01 177.96 1b82 h ALA 38 N 1.52 0.18 -0.29 3.43 0.00 -1.73 -1.19 119.26 121.18 1b82 h ALA 38 Ca 0.09 -0.09 0.04 0.00 0.00 0.00 0.00 54.91 54.95 1b82 h ALA 38 Cb 0.37 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 1b82 h ALA 38 CO 0.02 -0.24 0.07 0.45 0.00 0.00 0.00 179.25 179.55 1b82 h HIS 39 N 0.09 0.13 -1.00 0.00 3.86 -0.80 -1.07 115.15 116.36 1b82 h HIS 39 Ca 0.05 0.02 0.02 0.00 -1.16 0.00 0.00 60.37 59.30 1b82 h HIS 39 Cb 0.14 -0.01 -0.05 0.00 1.06 0.00 0.00 27.41 28.54 1b82 h HIS 39 CO -0.02 0.04 0.66 0.93 0.86 0.00 0.00 177.93 180.40 1b82 h GLU 40 N 0.19 1.28 -0.48 2.45 5.08 -0.97 -1.73 114.58 120.40 1b82 h GLU 40 Ca 0.13 -0.08 -0.07 0.00 -1.00 0.00 0.00 59.36 58.35 1b82 h GLU 40 Cb 0.13 -0.29 -0.02 0.00 0.50 0.00 0.00 28.75 29.07 1b82 h GLU 40 CO -0.16 0.85 0.02 0.77 -1.00 0.00 0.00 179.01 179.49 1b82 h SER 41 N 1.32 0.75 -0.26 1.42 0.02 -0.66 0.07 113.55 116.23 1b82 h SER 41 Ca 0.38 -0.17 -0.04 0.00 -0.84 0.00 0.00 61.79 61.12 1b82 h SER 41 Cb -0.09 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.24 1b82 h SER 41 CO -0.10 0.81 -0.01 0.40 -1.14 0.00 0.00 176.83 176.79 1b82 h ILE 42 N 0.74 1.26 -0.83 3.27 2.04 -0.82 -2.81 117.51 120.37 1b82 h ILE 42 Ca 0.15 -0.94 0.04 0.00 1.00 0.00 0.00 64.86 65.11 1b82 h ILE 42 Cb 0.42 1.37 -0.05 0.00 -0.74 0.00 0.00 36.82 37.81 1b82 h ILE 42 CO 0.02 0.29 0.53 -0.09 0.00 0.00 0.00 178.15 178.90 1b82 h ARG 43 N 0.23 0.98 -0.83 2.37 2.43 -0.99 -2.64 114.38 115.94 1b82 h ARG 43 Ca 0.07 -0.06 0.07 0.00 -0.81 0.00 0.00 59.98 59.26 1b82 h ARG 43 Cb 0.43 -0.22 -0.05 0.00 -0.42 0.00 0.00 29.97 29.71 1b82 h ARG 43 CO 0.01 0.65 0.54 1.25 -1.51 0.00 0.00 179.97 180.92 1b82 h LEU 44 N 1.01 0.78 -0.34 3.80 5.85 -0.77 -1.28 115.31 124.37 1b82 h LEU 44 Ca 0.34 0.01 0.06 0.00 0.84 0.00 0.00 57.88 59.12 1b82 h LEU 44 Cb 0.04 -0.16 -0.05 0.00 0.37 0.00 0.00 40.66 40.86 1b82 h LEU 44 CO -0.12 0.49 0.02 0.58 -0.34 0.00 0.00 178.44 179.07 1b82 h VAL 45 N 0.88 0.77 -0.43 1.05 2.07 -1.22 0.74 116.25 120.10 1b82 h VAL 45 Ca 0.37 -0.04 -0.13 0.00 0.82 0.00 0.00 66.70 67.72 1b82 h VAL 45 Cb 0.28 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 1b82 h VAL 45 CO -0.14 0.02 -0.24 0.15 0.02 0.00 0.00 177.57 177.39 1b82 h PHE 46 N 0.12 1.02 0.00 1.57 3.57 -1.26 -0.73 116.94 121.23 1b82 h PHE 46 Ca 0.16 -0.25 -0.08 0.00 3.53 0.00 0.00 57.97 61.34 1b82 h PHE 46 Cb 0.21 -0.24 -0.01 0.00 2.79 0.00 0.00 35.95 38.70 1b82 h PHE 46 CO -0.22 1.03 -0.37 0.45 -2.23 0.00 0.00 178.31 176.97 1b82 h HIS 47 N 0.77 0.00 0.01 0.41 3.86 -1.07 -1.20 115.15 117.94 1b82 h HIS 47 Ca 0.10 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.31 1b82 h HIS 47 Cb 0.79 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.26 1b82 h HIS 47 CO 0.05 0.37 -0.01 0.22 0.86 0.00 0.00 177.93 179.42 1b82 h ASP 48 N 0.00 -0.02 -0.01 2.45 3.58 -0.75 -3.40 116.42 118.28 1b82 h ASP 48 Ca -0.00 -0.74 -0.23 0.00 0.42 0.00 0.00 57.03 56.47 1b82 h ASP 48 Cb 0.88 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.95 1b82 h ASP 48 CO 0.05 0.76 -0.84 0.28 -2.88 0.00 0.00 179.24 176.61 1b82 h SER 49 N -0.82 0.83 0.71 2.28 0.02 -0.94 -3.31 113.55 112.32 1b82 h SER 49 Ca -0.00 -0.58 0.00 0.00 -0.84 0.00 0.00 61.79 60.37 1b82 h SER 49 Cb 0.76 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 63.05 1b82 h SER 49 CO 0.00 1.37 0.00 0.00 -1.14 0.00 0.00 176.83 177.06 1b82 n ILE 50 N -3.89 0.68 -2.07 3.27 0.13 -0.47 -4.02 119.36 112.99 1b82 n ILE 50 Ca -0.08 0.15 -0.42 0.00 -1.10 0.00 0.00 62.75 61.30 1b82 n ILE 50 Cb 0.78 -0.85 -0.00 0.00 -0.84 0.00 0.00 39.64 38.72 1b82 n ILE 50 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 1b82 n ALA 51 N -1.54 4.64 -3.45 1.51 0.00 -1.25 -4.78 120.51 115.64 1b82 n ALA 51 Ca 0.04 -3.84 -0.13 0.00 0.00 0.00 0.00 53.44 49.51 1b82 n ALA 51 Cb 0.24 -3.57 -0.09 0.00 0.00 0.00 0.00 19.45 16.03 1b82 n ALA 51 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 1b82 s ILE 52 N 3.76 -0.00 -0.32 0.00 2.07 -1.22 -2.41 121.20 123.08 1b82 s ILE 52 Ca 0.50 0.01 0.02 0.00 -1.41 0.00 0.00 60.65 59.77 1b82 s ILE 52 Cb 0.10 -0.72 0.15 0.00 0.13 0.00 0.00 42.46 42.12 1b82 s ILE 52 CO -0.01 0.00 0.37 -0.55 -1.91 0.00 0.00 174.94 172.84 1b82 s SER 53 N 0.44 1.04 0.31 4.50 0.15 -0.79 -4.19 113.70 115.16 1b82 s SER 53 Ca -0.01 -0.94 0.03 0.00 0.70 0.00 0.00 55.95 55.73 1b82 s SER 53 Cb -0.04 0.74 0.62 0.00 -1.71 0.00 0.00 66.02 65.63 1b82 s SER 53 CO -0.02 -0.33 1.87 -0.65 1.20 0.00 0.00 173.24 175.32 1b82 h PRO 54 N 7.78 0.89 -0.48 5.44 0.11 -1.90 -0.68 132.00 143.16 1b82 h PRO 54 Ca -0.05 -0.05 0.07 0.00 0.11 0.00 0.00 66.00 66.07 1b82 h PRO 54 Cb 1.08 -0.20 -0.06 0.00 0.11 0.00 0.00 31.00 31.94 1b82 h PRO 54 CO 0.26 0.59 0.16 0.00 -0.21 0.00 0.00 178.00 178.81 1b82 h ALA 55 N 1.55 0.58 -0.20 -0.75 0.00 -1.94 0.60 119.26 119.09 1b82 h ALA 55 Ca 0.45 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.40 1b82 h ALA 55 Cb 0.45 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1b82 h ALA 55 CO -0.21 -0.23 0.05 0.52 0.00 0.00 0.00 179.25 179.38 1b82 h MET 56 N 0.33 0.33 -1.00 0.00 2.86 -1.47 -2.72 114.93 113.27 1b82 h MET 56 Ca 0.23 -0.08 0.13 0.00 -2.06 0.00 0.00 59.70 57.93 1b82 h MET 56 Cb 0.25 -0.04 -0.09 0.00 0.06 0.00 0.00 31.60 31.77 1b82 h MET 56 CO -0.24 0.45 0.62 0.93 1.06 0.00 0.00 176.91 179.73 1b82 h GLU 57 N 0.14 0.91 0.00 1.72 4.39 -0.76 0.22 114.58 121.20 1b82 h GLU 57 Ca 0.06 -0.05 -0.00 0.00 0.34 0.00 0.00 59.36 59.71 1b82 h GLU 57 Cb 0.27 -0.20 -0.00 0.00 -0.10 0.00 0.00 28.75 28.72 1b82 h GLU 57 CO 0.00 0.60 -0.01 0.00 -1.16 0.00 0.00 179.01 178.44 1b82 h ALA 58 N 1.56 1.04 -0.19 3.43 0.00 -0.60 -1.94 119.26 122.56 1b82 h ALA 58 Ca 0.51 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.41 1b82 h ALA 58 Cb 0.57 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1b82 h ALA 58 CO -0.29 0.02 0.00 1.04 0.00 0.00 0.00 179.25 180.02 1b82 n GLN 59 N -3.16 2.02 -0.63 0.00 6.02 0.72 -4.93 117.38 117.42 1b82 n GLN 59 Ca -0.01 -1.52 0.00 0.00 -0.01 0.00 0.00 57.00 55.46 1b82 n GLN 59 Cb 0.18 -1.45 0.00 0.00 1.02 0.00 0.00 30.24 29.99 1b82 n GLN 59 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1b82 n GLY 60 N 1.27 0.66 3.53 1.08 0.00 -0.73 -5.06 105.19 105.95 1b82 n GLY 60 Ca 0.17 -0.22 -0.30 0.00 0.00 0.00 0.00 46.02 45.67 1b82 n GLY 60 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b82 s LYS 61 N -0.66 2.05 0.11 1.61 1.02 -0.96 -5.01 119.74 117.90 1b82 s LYS 61 Ca 0.00 -1.04 -0.31 0.00 0.02 0.00 0.00 55.97 54.64 1b82 s LYS 61 Cb 0.00 -2.24 -0.09 0.00 -0.52 0.00 0.00 37.83 34.98 1b82 s LYS 61 CO 0.00 0.51 1.61 0.12 -0.92 0.00 0.00 175.35 176.67 1b82 s PHE 62 N -1.12 2.73 -2.36 3.18 5.36 -1.26 -2.62 117.98 121.89 1b82 s PHE 62 Ca 0.19 0.47 0.21 0.00 -0.96 0.00 0.00 56.93 56.84 1b82 s PHE 62 Cb -0.11 -3.94 0.27 0.00 -0.34 0.00 0.00 43.02 38.91 1b82 s PHE 62 CO 0.11 -3.62 1.24 0.41 -1.46 0.00 0.00 175.22 171.90 1b82 n GLY 63 N 3.87 1.18 0.00 13.12 0.00 -1.26 -4.72 105.19 117.37 1b82 n GLY 63 Ca 0.15 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.54 1b82 n GLY 63 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b82 n GLY 64 N 1.23 2.51 1.28 -0.02 0.00 -1.26 -1.89 105.19 107.04 1b82 n GLY 64 Ca 0.15 -1.86 0.10 0.00 0.00 0.00 0.00 46.02 44.41 1b82 n GLY 64 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b82 n GLY 65 N 1.21 2.20 7.00 -0.02 0.00 -1.24 -4.47 105.19 109.87 1b82 n GLY 65 Ca 0.00 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.28 1b82 n GLY 65 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b82 n GLY 66 N 1.49 1.81 3.42 -0.02 0.00 -1.01 -4.19 105.19 106.68 1b82 n GLY 66 Ca 0.23 -0.50 -0.43 0.00 0.00 0.00 0.00 46.02 45.32 1b82 n GLY 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b82 n ALA 67 N 10.09 3.94 -0.23 4.61 0.00 0.88 -4.19 120.51 135.61 1b82 n ALA 67 Ca 0.00 -3.91 0.00 0.00 0.00 0.00 0.00 53.44 49.53 1b82 n ALA 67 Cb 0.00 -3.52 0.00 0.00 0.00 0.00 0.00 19.45 15.93 1b82 n ALA 67 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1b82 n ASP 68 N 7.63 1.15 -0.55 0.00 5.68 -1.26 -4.85 116.55 124.35 1b82 n ASP 68 Ca 0.48 -1.37 -0.07 0.00 -0.50 0.00 0.00 54.79 53.32 1b82 n ASP 68 Cb 0.44 0.00 -0.03 0.00 -1.14 0.00 0.00 41.12 40.39 1b82 n ASP 68 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1b82 n GLY 69 N -0.19 0.91 0.33 6.12 0.00 -1.26 -1.81 105.19 109.29 1b82 n GLY 69 Ca 0.00 -0.52 -0.02 0.00 0.00 0.00 0.00 46.02 45.48 1b82 n GLY 69 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1b82 h SER 70 N 0.00 0.88 0.03 1.61 4.64 -1.90 -1.15 113.55 117.67 1b82 h SER 70 Ca -0.15 -0.11 -0.00 0.00 -0.47 0.00 0.00 61.79 61.06 1b82 h SER 70 Cb 0.55 -0.23 -0.00 0.00 -0.31 0.00 0.00 62.40 62.41 1b82 h SER 70 CO 0.21 0.77 -0.00 -0.29 -0.87 0.00 0.00 176.83 176.65 1b82 h ILE 71 N 0.96 0.24 0.03 0.95 2.10 -1.90 0.27 117.51 120.16 1b82 h ILE 71 Ca 0.23 -0.03 -0.31 0.00 1.08 0.00 0.00 64.86 65.83 1b82 h ILE 71 Cb 0.14 1.02 -0.04 0.00 -1.09 0.00 0.00 36.82 36.85 1b82 h ILE 71 CO -0.03 0.00 -1.74 0.80 -1.08 0.00 0.00 178.15 176.11 1b82 n MET 72 N -3.42 0.61 0.10 2.19 1.56 -0.52 -3.14 117.12 114.50 1b82 n MET 72 Ca -0.03 0.43 -0.13 0.00 -0.27 0.00 0.00 57.70 57.70 1b82 n MET 72 Cb 0.09 -1.68 -0.07 0.00 2.15 0.00 0.00 33.22 33.70 1b82 n MET 72 CO 0.00 0.00 0.00 0.82 -0.73 0.00 0.00 175.97 176.06 1b82 h ILE 73 N -0.72 0.89 -1.66 1.12 2.04 -0.98 -2.84 117.51 115.35 1b82 h ILE 73 Ca -0.45 -0.06 -0.73 0.00 1.00 0.00 0.00 64.86 64.61 1b82 h ILE 73 Cb 1.55 0.93 -0.28 0.00 -0.74 0.00 0.00 36.82 38.28 1b82 h ILE 73 CO -0.19 0.02 0.93 0.49 0.00 0.00 0.00 178.15 179.40 1b82 n PHE 74 N -5.15 3.07 -0.22 1.37 3.72 0.91 -4.81 117.46 116.35 1b82 n PHE 74 Ca -0.08 -2.56 0.02 0.00 -0.05 0.00 0.00 57.45 54.78 1b82 n PHE 74 Cb 0.10 -1.22 0.27 0.00 -0.94 0.00 0.00 39.48 37.69 1b82 n PHE 74 CO 0.00 0.00 0.00 0.38 -0.05 0.00 0.00 176.76 177.09 1b82 h ASP 75 N 2.67 0.83 -0.26 4.37 2.03 -1.45 -1.10 116.42 123.51 1b82 h ASP 75 Ca 0.57 -0.01 0.00 0.00 -0.73 0.00 0.00 57.03 56.86 1b82 h ASP 75 Cb 0.31 -0.20 -0.01 0.00 -0.83 0.00 0.00 39.33 38.60 1b82 h ASP 75 CO 1.46 0.58 0.17 -2.24 -1.03 0.00 0.00 179.24 178.17 1b82 h ASP 76 N 0.96 0.30 0.00 4.15 2.03 -1.87 -1.03 116.42 120.95 1b82 h ASP 76 Ca 0.30 -0.01 0.00 0.00 -0.73 0.00 0.00 57.03 56.59 1b82 h ASP 76 Cb -0.00 -0.07 0.00 0.00 -0.83 0.00 0.00 39.33 38.42 1b82 h ASP 76 CO -0.08 0.22 -0.04 0.40 -1.03 0.00 0.00 179.24 178.71 1b82 h ILE 77 N 0.35 0.00 -0.91 4.15 2.04 -1.65 -3.39 117.51 118.10 1b82 h ILE 77 Ca 0.09 -0.43 0.01 0.00 1.00 0.00 0.00 64.86 65.54 1b82 h ILE 77 Cb -0.04 0.00 -0.05 0.00 -0.74 0.00 0.00 36.82 36.00 1b82 h ILE 77 CO -0.02 0.00 0.60 -0.33 0.00 0.00 0.00 178.15 178.40 1b82 h GLU 78 N -0.43 1.20 0.00 2.37 5.08 -1.27 -2.50 114.58 119.04 1b82 h GLU 78 Ca 0.00 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 1b82 h GLU 78 Cb 0.04 -0.27 0.00 0.00 0.50 0.00 0.00 28.75 29.02 1b82 h GLU 78 CO 0.00 0.80 0.00 0.25 -1.00 0.00 0.00 179.01 179.06 1b82 n THR 79 N -4.39 0.16 0.84 1.13 -2.24 -0.39 -1.89 114.28 107.49 1b82 n THR 79 Ca 0.10 0.04 0.11 0.00 -2.27 0.00 0.00 64.05 62.04 1b82 n THR 79 Cb 0.02 -0.71 0.10 0.00 -2.10 0.00 0.00 70.33 67.64 1b82 n THR 79 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1b82 n ALA 80 N -1.12 3.71 -1.80 6.98 0.00 -0.94 -4.52 120.51 122.83 1b82 n ALA 80 Ca 0.13 -0.41 -0.41 0.00 0.00 0.00 0.00 53.44 52.75 1b82 n ALA 80 Cb 0.11 -1.01 -0.03 0.00 0.00 0.00 0.00 19.45 18.52 1b82 n ALA 80 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1b82 s PHE 81 N -3.07 3.23 0.22 0.00 0.08 -0.79 -4.94 117.98 112.71 1b82 s PHE 81 Ca 0.08 1.48 -0.09 0.00 0.12 0.00 0.00 56.93 58.52 1b82 s PHE 81 Cb 0.16 -3.55 0.20 0.00 -0.57 0.00 0.00 43.02 39.26 1b82 s PHE 81 CO 0.77 -1.47 1.89 1.25 -0.10 0.00 0.00 175.22 177.56 1b82 h HIS 82 N 3.76 1.01 -0.07 0.36 2.76 -1.90 -1.11 115.15 119.97 1b82 h HIS 82 Ca -0.48 0.02 0.02 0.00 -2.20 0.00 0.00 60.37 57.74 1b82 h HIS 82 Cb 1.22 -0.34 -0.00 0.00 1.55 0.00 0.00 27.41 29.84 1b82 h HIS 82 CO 0.57 0.62 0.14 -1.35 -1.30 0.00 0.00 177.93 176.62 1b82 h PRO 83 N 1.08 0.00 -0.66 5.26 0.11 -1.90 -0.80 132.00 135.09 1b82 h PRO 83 Ca 0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.42 1b82 h PRO 83 Cb -0.09 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.02 1b82 h PRO 83 CO -0.08 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 177.80 1b82 n ASN 84 N -3.41 4.83 -4.58 -2.05 3.02 -0.42 -5.00 115.26 107.65 1b82 n ASN 84 Ca -0.01 -2.47 -0.46 0.00 -0.03 0.00 0.00 54.58 51.60 1b82 n ASN 84 Cb 0.23 -0.59 -0.03 0.00 -0.61 0.00 0.00 39.78 38.78 1b82 n ASN 84 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1b82 n ILE 85 N 1.12 1.56 -0.96 2.41 3.06 -0.31 -1.67 119.36 124.57 1b82 n ILE 85 Ca 0.26 -0.39 0.00 0.00 -2.50 0.00 0.00 62.75 60.12 1b82 n ILE 85 Cb 0.91 -0.90 0.00 0.00 0.54 0.00 0.00 39.64 40.19 1b82 n ILE 85 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 1b82 n GLY 86 N 1.59 0.89 0.11 4.50 0.00 -1.26 -4.90 105.19 106.12 1b82 n GLY 86 Ca 0.12 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.27 1b82 n GLY 86 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1b82 n LEU 87 N 0.00 0.61 0.17 0.99 4.77 -0.67 -3.60 117.00 119.27 1b82 n LEU 87 Ca 0.00 -0.03 0.03 0.00 -0.03 0.00 0.00 56.01 55.98 1b82 n LEU 87 Cb 0.00 -0.22 0.30 0.00 -2.33 0.00 0.00 43.42 41.17 1b82 n LEU 87 CO 0.00 0.12 0.64 -0.78 -1.33 0.00 0.00 177.39 176.04 1b82 h ASP 88 N 0.53 0.00 0.18 -1.43 3.58 -1.85 -1.61 116.42 115.81 1b82 h ASP 88 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1b82 h ASP 88 Cb 0.47 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.50 1b82 h ASP 88 CO 0.00 0.45 -0.17 -0.08 -2.88 0.00 0.00 179.24 176.56 1b82 h GLU 89 N 0.00 -0.36 -0.14 0.28 4.22 -1.79 -0.68 114.58 116.12 1b82 h GLU 89 Ca -0.00 0.02 -0.15 0.00 0.08 0.00 0.00 59.36 59.31 1b82 h GLU 89 Cb 0.91 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.23 1b82 h GLU 89 CO 0.06 -0.24 -0.54 0.97 -2.18 0.00 0.00 179.01 177.07 1b82 h ILE 90 N -0.38 1.34 -0.70 2.32 6.09 -1.72 -2.32 117.51 122.14 1b82 h ILE 90 Ca 0.00 -1.82 0.02 0.00 -1.37 0.00 0.00 64.86 61.69 1b82 h ILE 90 Cb 0.35 1.83 -0.04 0.00 0.47 0.00 0.00 36.82 39.43 1b82 h ILE 90 CO -0.04 0.55 0.45 0.58 -3.07 0.00 0.00 178.15 176.63 1b82 h VAL 91 N 0.32 1.13 -0.06 2.19 2.07 -1.00 -0.78 116.25 120.11 1b82 h VAL 91 Ca 0.01 -0.31 -0.08 0.00 0.82 0.00 0.00 66.70 67.14 1b82 h VAL 91 Cb 1.06 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.96 1b82 h VAL 91 CO 0.09 0.16 -0.33 0.11 0.02 0.00 0.00 177.57 177.62 1b82 h LYS 92 N 0.90 0.12 0.00 1.57 1.57 -0.97 0.44 116.57 120.21 1b82 h LYS 92 Ca 0.27 -0.05 -0.14 0.00 -1.87 0.00 0.00 60.65 58.87 1b82 h LYS 92 Cb -0.03 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.25 1b82 h LYS 92 CO -0.09 0.45 -0.65 -0.07 -0.57 0.00 0.00 179.45 178.52 1b82 h LEU 93 N 0.11 0.00 0.15 2.94 3.38 -0.84 -3.31 115.31 117.73 1b82 h LEU 93 Ca 0.01 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.67 1b82 h LEU 93 Cb 0.65 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.40 1b82 h LEU 93 CO 0.05 0.65 -1.50 1.56 0.09 0.00 0.00 178.44 179.29 1b82 h GLN 94 N 0.00 0.31 -0.97 1.13 4.20 -0.54 -3.40 115.11 115.84 1b82 h GLN 94 Ca -0.01 -0.53 0.17 0.00 0.06 0.00 0.00 58.65 58.34 1b82 h GLN 94 Cb 1.24 0.20 -0.17 0.00 0.30 0.00 0.00 27.48 29.05 1b82 h GLN 94 CO 0.08 1.21 -0.32 0.87 -0.67 0.00 0.00 178.83 180.00 1b82 h LYS 95 N 0.09 -0.01 -0.99 1.46 1.57 -1.02 -1.46 116.57 116.21 1b82 h LYS 95 Ca -0.24 0.00 0.09 0.00 -1.87 0.00 0.00 60.65 58.63 1b82 h LYS 95 Cb 2.04 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 34.28 1b82 h LYS 95 CO 0.19 -0.00 0.63 -1.00 -0.57 0.00 0.00 179.45 178.69 1b82 h PRO 96 N -0.01 1.05 -0.66 3.15 0.13 -1.77 -1.34 132.00 132.56 1b82 h PRO 96 Ca 0.40 -0.06 -0.04 0.00 -0.87 0.00 0.00 66.00 65.43 1b82 h PRO 96 Cb 0.65 -0.24 -0.03 0.00 0.13 0.00 0.00 31.00 31.51 1b82 h PRO 96 CO -0.99 0.69 0.27 0.74 -0.23 0.00 0.00 178.00 178.48 1b82 h PHE 97 N 1.08 0.96 0.53 1.56 0.04 -1.53 0.06 116.94 119.64 1b82 h PHE 97 Ca 0.45 -0.06 -0.03 0.00 2.80 0.00 0.00 57.97 61.14 1b82 h PHE 97 Cb 0.30 -0.29 0.01 0.00 2.20 0.00 0.00 35.95 38.16 1b82 h PHE 97 CO -0.01 0.73 -0.25 0.28 -0.60 0.00 0.00 178.31 178.46 1b82 h VAL 98 N 0.94 0.43 -0.70 -0.55 2.07 -1.18 -2.33 116.25 114.94 1b82 h VAL 98 Ca 0.22 -0.23 0.04 0.00 0.82 0.00 0.00 66.70 67.55 1b82 h VAL 98 Cb 0.17 0.53 -0.05 0.00 -1.52 0.00 0.00 31.29 30.42 1b82 h VAL 98 CO -0.02 0.04 0.43 1.56 0.02 0.00 0.00 177.57 179.59 1b82 h GLN 99 N -0.86 0.80 -0.76 1.57 4.20 -1.29 -0.96 115.11 117.80 1b82 h GLN 99 Ca -0.07 -0.05 -0.05 0.00 0.06 0.00 0.00 58.65 58.54 1b82 h GLN 99 Cb 0.60 -0.18 -0.03 0.00 0.30 0.00 0.00 27.48 28.17 1b82 h GLN 99 CO 0.12 0.53 0.27 -0.22 -0.67 0.00 0.00 178.83 178.86 1b82 h LYS 100 N 0.83 1.16 0.00 1.46 3.64 -0.99 -3.22 116.57 119.45 1b82 h LYS 100 Ca 0.29 -0.23 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 1b82 h LYS 100 Cb 0.06 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 31.70 1b82 h LYS 100 CO -0.12 0.96 -0.76 0.72 -2.27 0.00 0.00 179.45 177.98 1b82 n HIS 101 N -4.26 0.09 -2.36 1.91 8.25 -0.88 -4.99 115.22 112.98 1b82 n HIS 101 Ca 0.07 0.03 -0.12 0.00 -0.26 0.00 0.00 57.72 57.44 1b82 n HIS 101 Cb 0.21 -0.26 0.00 0.00 1.12 0.00 0.00 29.99 31.07 1b82 n HIS 101 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1b82 n GLY 102 N 1.46 -0.05 3.98 -1.41 0.00 -0.38 -5.03 105.19 103.75 1b82 n GLY 102 Ca 0.04 -0.37 -0.20 0.00 0.00 0.00 0.00 46.02 45.49 1b82 n GLY 102 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1b82 s VAL 103 N -2.67 4.44 0.53 1.61 -7.23 -1.21 -5.08 120.40 110.80 1b82 s VAL 103 Ca 0.05 -0.92 -0.17 0.00 -1.81 0.00 0.00 61.98 59.13 1b82 s VAL 103 Cb -0.02 -3.56 -0.07 0.00 0.56 0.00 0.00 36.38 33.29 1b82 s VAL 103 CO 0.07 -0.24 1.01 0.42 -0.31 0.00 0.00 175.10 176.05 1b82 s THR 104 N -2.16 4.21 0.16 5.32 -4.23 -1.26 -4.80 115.64 112.87 1b82 s THR 104 Ca 0.42 1.11 -0.14 0.00 -1.18 0.00 0.00 61.69 61.90 1b82 s THR 104 Cb -0.09 -3.57 0.05 0.00 1.34 0.00 0.00 72.50 70.22 1b82 s THR 104 CO 0.31 -0.55 1.77 -0.65 -0.54 0.00 0.00 174.62 174.96 1b82 h PRO 105 N 0.91 0.72 -0.39 3.99 0.11 -1.89 -0.75 132.00 134.70 1b82 h PRO 105 Ca -0.47 -0.09 -0.00 0.00 0.11 0.00 0.00 66.00 65.55 1b82 h PRO 105 Cb 1.20 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 32.15 1b82 h PRO 105 CO 0.60 0.56 0.24 0.78 -0.21 0.00 0.00 178.00 179.97 1b82 h GLY 106 N 0.68 0.56 1.45 -0.55 0.00 -1.82 -0.86 103.07 102.53 1b82 h GLY 106 Ca 0.18 -0.23 -0.09 0.00 0.00 0.00 0.00 47.33 47.20 1b82 h GLY 106 CO -0.03 0.22 -0.13 -0.55 0.00 0.00 0.00 176.54 176.05 1b82 h ASP 107 N 0.51 0.64 -0.59 0.19 3.32 -1.73 -2.42 116.42 116.35 1b82 h ASP 107 Ca 0.14 -0.19 -0.05 0.00 0.02 0.00 0.00 57.03 56.95 1b82 h ASP 107 Cb -0.01 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.34 1b82 h ASP 107 CO -0.03 0.79 0.16 0.15 -1.72 0.00 0.00 179.24 178.60 1b82 h PHE 108 N 0.59 0.96 -0.47 4.55 3.57 -0.73 -0.78 116.94 124.64 1b82 h PHE 108 Ca 0.10 -0.11 -0.01 0.00 3.53 0.00 0.00 57.97 61.48 1b82 h PHE 108 Cb 0.57 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 39.01 1b82 h PHE 108 CO 0.02 0.81 0.24 0.82 -2.23 0.00 0.00 178.31 177.98 1b82 h ILE 109 N 0.84 1.17 -0.75 1.41 2.04 -1.01 -0.31 117.51 120.90 1b82 h ILE 109 Ca 0.19 -0.46 -0.04 0.00 1.00 0.00 0.00 64.86 65.54 1b82 h ILE 109 Cb 0.32 0.63 -0.03 0.00 -0.74 0.00 0.00 36.82 36.99 1b82 h ILE 109 CO -0.00 0.19 0.31 0.00 0.00 0.00 0.00 178.15 178.65 1b82 h ALA 110 N 1.09 1.14 -0.17 1.87 0.00 -1.30 -1.53 119.26 120.35 1b82 h ALA 110 Ca 0.16 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1b82 h ALA 110 Cb 0.08 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1b82 h ALA 110 CO -0.02 0.63 0.03 0.35 0.00 0.00 0.00 179.25 180.23 1b82 h PHE 111 N 1.08 0.30 -0.78 0.00 3.57 -0.58 -2.28 116.94 118.26 1b82 h PHE 111 Ca 0.25 -0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.67 1b82 h PHE 111 Cb 0.18 -0.08 -0.04 0.00 2.79 0.00 0.00 35.95 38.80 1b82 h PHE 111 CO 0.02 0.45 0.34 0.00 -2.23 0.00 0.00 178.31 176.89 1b82 h ALA 112 N 0.82 1.12 -0.48 2.41 0.00 -1.00 0.62 119.26 122.74 1b82 h ALA 112 Ca 0.05 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1b82 h ALA 112 Cb 0.31 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1b82 h ALA 112 CO 0.00 0.64 0.31 0.78 0.00 0.00 0.00 179.25 180.99 1b82 h GLY 113 N 1.15 0.69 0.99 0.00 0.00 -1.24 0.30 103.07 104.97 1b82 h GLY 113 Ca 0.27 -0.27 -0.08 0.00 0.00 0.00 0.00 47.33 47.25 1b82 h GLY 113 CO -0.03 0.26 -0.04 0.00 0.00 0.00 0.00 176.54 176.74 1b82 h ALA 114 N 1.16 0.61 -0.37 3.60 0.00 -0.79 -2.08 119.26 121.40 1b82 h ALA 114 Ca 0.18 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.74 1b82 h ALA 114 Cb -0.05 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1b82 h ALA 114 CO -0.04 0.44 0.03 0.28 0.00 0.00 0.00 179.25 179.97 1b82 h VAL 115 N 0.66 1.25 -0.40 0.00 2.07 -0.73 -1.45 116.25 117.65 1b82 h VAL 115 Ca 0.12 -0.91 0.08 0.00 0.82 0.00 0.00 66.70 66.81 1b82 h VAL 115 Cb 0.55 1.12 -0.08 0.00 -1.52 0.00 0.00 31.29 31.36 1b82 h VAL 115 CO 0.03 0.31 -0.16 0.00 0.02 0.00 0.00 177.57 177.77 1b82 h ALA 116 N 0.89 0.17 -0.67 1.67 0.00 -0.33 -1.88 119.26 119.11 1b82 h ALA 116 Ca 0.11 0.15 -0.03 0.00 0.00 0.00 0.00 54.91 55.13 1b82 h ALA 116 Cb 0.41 0.40 -0.03 0.00 0.00 0.00 0.00 17.79 18.57 1b82 h ALA 116 CO 0.01 -0.51 0.28 -0.07 0.00 0.00 0.00 179.25 178.96 1b82 h LEU 117 N -0.07 0.89 -2.48 0.00 3.38 -1.13 -1.93 115.31 113.97 1b82 h LEU 117 Ca 0.20 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1b82 h LEU 117 Cb 0.38 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.89 1b82 h LEU 117 CO -0.45 0.79 0.00 0.77 0.09 0.00 0.00 178.44 179.64 1b82 h SER 118 N 0.97 0.00 1.17 -0.43 4.64 -0.45 -0.93 113.55 118.52 1b82 h SER 118 Ca 0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 1b82 h SER 118 Cb 0.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 1b82 h SER 118 CO -0.02 0.00 -0.10 0.59 -0.87 0.00 0.00 176.83 176.43 1b82 n ASN 119 N -2.99 0.48 -4.57 4.97 5.03 -0.73 -4.28 115.26 113.18 1b82 n ASN 119 Ca -0.02 0.44 -0.40 0.00 0.87 0.00 0.00 54.58 55.47 1b82 n ASN 119 Cb 0.12 -0.52 -0.09 0.00 -1.02 0.00 0.00 39.78 38.28 1b82 n ASN 119 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1b82 n PRO 121 N 5.44 1.63 0.00 0.00 -0.02 -1.25 -1.88 135.00 138.92 1b82 n PRO 121 Ca -0.08 0.58 0.00 0.00 -2.02 0.00 0.00 63.50 61.98 1b82 n PRO 121 Cb 0.50 -2.11 0.00 0.00 -0.02 0.00 0.00 33.50 31.87 1b82 n PRO 121 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1b82 n GLY 122 N 1.72 1.24 3.75 -1.23 0.00 0.72 -0.53 105.19 110.85 1b82 n GLY 122 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 1b82 n GLY 122 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b82 s ALA 123 N -2.29 2.32 0.98 4.61 0.00 -0.79 -4.80 121.76 121.79 1b82 s ALA 123 Ca 0.00 0.64 -0.11 0.00 0.00 0.00 0.00 51.96 52.48 1b82 s ALA 123 Cb 0.00 -3.37 0.18 0.00 0.00 0.00 0.00 23.12 19.93 1b82 s ALA 123 CO 0.00 -1.53 1.09 -2.14 0.00 0.00 0.00 175.76 173.17 1b82 s PRO 124 N -4.09 0.52 -0.35 0.00 0.02 -1.26 -4.73 135.00 125.12 1b82 s PRO 124 Ca 0.69 1.08 -0.29 0.00 0.02 0.00 0.00 61.00 62.50 1b82 s PRO 124 Cb -0.23 -1.70 0.01 0.00 0.02 0.00 0.00 34.50 32.59 1b82 s PRO 124 CO 0.44 -2.82 1.27 -0.65 -0.33 0.00 0.00 177.00 174.91 1b82 s GLN 125 N -4.69 3.85 0.29 5.54 -1.52 -1.26 -4.64 119.66 117.22 1b82 s GLN 125 Ca 0.66 1.08 -0.13 0.00 -1.95 0.00 0.00 55.36 55.02 1b82 s GLN 125 Cb -0.22 -3.89 -0.08 0.00 -0.22 0.00 0.00 33.01 28.60 1b82 s GLN 125 CO 0.60 -1.21 0.67 -1.64 -0.25 0.00 0.00 175.29 173.46 1b82 s MET 126 N 4.28 3.93 0.34 2.91 -1.94 -1.26 -4.99 119.30 122.56 1b82 s MET 126 Ca 0.55 0.52 0.03 0.00 -1.71 0.00 0.00 55.69 55.07 1b82 s MET 126 Cb -0.14 -2.51 -0.02 0.00 2.01 0.00 0.00 34.83 34.17 1b82 s MET 126 CO 0.25 0.21 0.52 -0.80 -0.01 0.00 0.00 175.02 175.19 1b82 s ASN 127 N -2.32 6.12 -0.24 3.03 -0.87 -1.26 -4.84 114.94 114.56 1b82 s ASN 127 Ca 0.52 0.18 -0.03 0.00 -1.57 0.00 0.00 52.86 51.96 1b82 s ASN 127 Cb -0.11 -1.70 0.13 0.00 -0.02 0.00 0.00 41.25 39.55 1b82 s ASN 127 CO 0.19 -0.37 0.38 0.12 -2.57 0.00 0.00 177.10 174.85 1b82 s PHE 128 N -2.26 -0.80 0.06 2.20 5.36 -1.26 -4.85 117.98 116.42 1b82 s PHE 128 Ca 0.42 0.87 0.05 0.00 -0.96 0.00 0.00 56.93 57.31 1b82 s PHE 128 Cb -0.10 0.03 -0.04 0.00 -0.34 0.00 0.00 43.02 42.58 1b82 s PHE 128 CO 0.34 -0.70 -0.09 -0.06 -1.46 0.00 0.00 175.22 173.25 1b82 s PHE 129 N 2.54 2.79 0.37 10.12 0.40 -1.26 -0.38 117.98 132.56 1b82 s PHE 129 Ca 0.11 -0.11 0.08 0.00 -0.60 0.00 0.00 56.93 56.41 1b82 s PHE 129 Cb -0.15 -1.51 -0.04 0.00 0.51 0.00 0.00 43.02 41.83 1b82 s PHE 129 CO -0.15 0.39 0.20 0.95 0.70 0.00 0.00 175.22 177.31 1b82 s THR 130 N -1.10 2.87 0.00 0.64 -4.23 0.23 -4.90 115.64 109.15 1b82 s THR 130 Ca 0.19 -1.60 0.00 0.00 -1.18 0.00 0.00 61.69 59.10 1b82 s THR 130 Cb -0.11 -3.01 0.00 0.00 1.34 0.00 0.00 72.50 70.72 1b82 s THR 130 CO 0.11 -0.12 0.00 0.61 -0.54 0.00 0.00 174.62 174.68 1b82 n GLY 131 N -1.25 0.31 3.58 3.99 0.00 -1.26 -1.84 105.19 108.71 1b82 n GLY 131 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 1b82 n GLY 131 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1b82 s ARG 132 N 0.00 3.71 0.62 1.61 0.52 -1.26 -4.97 118.95 119.19 1b82 s ARG 132 Ca 0.00 0.21 -0.16 0.00 -0.52 0.00 0.00 55.73 55.27 1b82 s ARG 132 Cb 0.00 -3.82 -0.02 0.00 0.52 0.00 0.00 34.95 31.64 1b82 s ARG 132 CO 0.00 -0.83 1.09 0.00 0.02 0.00 0.00 175.30 175.58 1b82 s ALA 133 N 2.98 2.59 0.28 2.13 0.00 -1.26 -4.45 121.76 124.04 1b82 s ALA 133 Ca 0.29 0.50 -0.30 0.00 0.00 0.00 0.00 51.96 52.46 1b82 s ALA 133 Cb -0.14 -3.29 -0.11 0.00 0.00 0.00 0.00 23.12 19.59 1b82 s ALA 133 CO 0.16 -1.05 1.55 -2.14 0.00 0.00 0.00 175.76 174.28 1b82 s PRO 134 N -4.03 4.16 0.59 0.00 0.02 -1.26 -4.77 135.00 129.71 1b82 s PRO 134 Ca 0.66 2.51 -0.20 0.00 0.02 0.00 0.00 61.00 63.99 1b82 s PRO 134 Cb -0.19 -3.04 -0.03 0.00 0.02 0.00 0.00 34.50 31.25 1b82 s PRO 134 CO 0.39 -0.57 1.28 0.00 -0.33 0.00 0.00 177.00 177.76 1b82 s ALA 135 N -0.04 2.59 -0.29 -1.55 0.00 -0.75 -4.95 121.76 116.76 1b82 s ALA 135 Ca 0.62 1.17 0.12 0.00 0.00 0.00 0.00 51.96 53.86 1b82 s ALA 135 Cb -0.46 -3.52 -0.15 0.00 0.00 0.00 0.00 23.12 18.99 1b82 s ALA 135 CO 0.47 -1.34 0.38 0.25 0.00 0.00 0.00 175.76 175.52 1b82 n THR 136 N -1.48 0.00 -4.11 0.00 -2.24 -1.26 -4.95 114.28 100.24 1b82 n THR 136 Ca 0.13 -0.25 -0.16 0.00 -2.27 0.00 0.00 64.05 61.50 1b82 n THR 136 Cb 0.48 0.63 -0.15 0.00 -2.10 0.00 0.00 70.33 69.19 1b82 n THR 136 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1b82 s GLN 137 N -2.44 0.40 0.72 -0.78 -0.21 -1.26 -5.15 119.66 110.94 1b82 s GLN 137 Ca 0.00 -0.14 -0.15 0.00 0.02 0.00 0.00 55.36 55.09 1b82 s GLN 137 Cb 0.08 -0.40 0.03 0.00 1.00 0.00 0.00 33.01 33.72 1b82 s GLN 137 CO 0.48 0.07 1.19 -1.25 -2.12 0.00 0.00 175.29 173.67 1b82 s PRO 138 N 0.05 2.24 0.57 2.91 0.04 -1.26 -4.75 135.00 134.80 1b82 s PRO 138 Ca -0.00 1.71 -0.17 0.00 0.04 0.00 0.00 61.00 62.58 1b82 s PRO 138 Cb -0.04 -1.85 -0.05 0.00 0.04 0.00 0.00 34.50 32.61 1b82 s PRO 138 CO -0.00 -1.75 1.07 0.00 0.04 0.00 0.00 177.00 176.36 1b82 s ALA 139 N -2.02 2.74 0.87 8.56 0.00 -1.26 -4.79 121.76 125.86 1b82 s ALA 139 Ca 0.73 0.51 -0.12 0.00 0.00 0.00 0.00 51.96 53.09 1b82 s ALA 139 Cb -0.28 -3.26 0.11 0.00 0.00 0.00 0.00 23.12 19.69 1b82 s ALA 139 CO 0.44 -0.72 1.10 -1.25 0.00 0.00 0.00 175.76 175.33 1b82 s PRO 140 N -3.77 1.46 0.69 0.00 0.04 -1.26 -4.87 135.00 127.29 1b82 s PRO 140 Ca 0.66 0.63 -0.05 0.00 0.04 0.00 0.00 61.00 62.28 1b82 s PRO 140 Cb -0.17 -1.85 0.08 0.00 0.04 0.00 0.00 34.50 32.60 1b82 s PRO 140 CO 0.32 -2.05 0.98 0.34 0.04 0.00 0.00 177.00 176.63 1b82 s ASP 141 N -3.71 4.68 0.00 6.66 -1.08 -1.26 -4.42 116.67 117.54 1b82 s ASP 141 Ca 0.63 0.18 0.00 0.00 -0.52 0.00 0.00 52.55 52.83 1b82 s ASP 141 Cb -0.16 -0.78 0.00 0.00 -1.46 0.00 0.00 42.92 40.52 1b82 s ASP 141 CO 0.55 -1.64 0.00 0.61 0.52 0.00 0.00 175.17 175.21 1b82 n GLY 142 N -2.85 0.71 0.03 2.66 0.00 -1.26 -4.93 105.19 99.56 1b82 n GLY 142 Ca 0.10 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.16 1b82 n GLY 142 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1b82 n LEU 143 N 0.00 0.00 -4.64 0.99 4.77 -1.26 -4.93 117.00 111.93 1b82 n LEU 143 Ca 0.00 0.00 -0.36 0.00 -0.03 0.00 0.00 56.01 55.62 1b82 n LEU 143 Cb 0.00 0.10 -0.10 0.00 -2.33 0.00 0.00 43.42 41.09 1b82 n LEU 143 CO 0.00 0.10 -0.19 -0.69 -1.33 0.00 0.00 177.39 175.28 1b82 s VAL 144 N -2.97 5.20 0.57 4.08 1.01 -1.26 -4.66 120.40 122.37 1b82 s VAL 144 Ca -0.07 0.12 -0.21 0.00 0.00 0.00 0.00 61.98 61.83 1b82 s VAL 144 Cb 0.09 -3.42 -0.04 0.00 0.00 0.00 0.00 36.38 33.02 1b82 s VAL 144 CO 0.69 0.36 1.36 -2.84 0.00 0.00 0.00 175.10 174.66 1b82 s PRO 145 N 1.02 3.00 0.19 2.72 0.02 -1.26 -4.77 135.00 135.92 1b82 s PRO 145 Ca 0.07 2.23 0.05 0.00 0.02 0.00 0.00 61.00 63.37 1b82 s PRO 145 Cb -0.14 -2.18 -0.04 0.00 0.02 0.00 0.00 34.50 32.17 1b82 s PRO 145 CO 0.04 -1.30 0.17 -1.21 -0.33 0.00 0.00 177.00 174.37 1b82 s GLU 146 N -3.00 2.96 0.56 5.54 0.41 -1.26 -4.89 118.70 119.01 1b82 s GLU 146 Ca 0.74 -0.90 0.33 0.00 -0.41 0.00 0.00 54.97 54.73 1b82 s GLU 146 Cb -0.41 -2.65 1.61 0.00 -1.78 0.00 0.00 34.13 30.90 1b82 s GLU 146 CO 0.47 0.46 2.10 -1.00 -0.49 0.00 0.00 175.26 176.81 1b82 h PRO 147 N 2.13 0.00 -0.34 0.39 0.13 -1.96 -1.92 132.00 130.44 1b82 h PRO 147 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1b82 h PRO 147 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1b82 h PRO 147 CO 0.63 0.07 0.00 1.97 -0.23 0.00 0.00 178.00 180.44 1b82 n PHE 148 N -3.36 0.44 -2.46 1.56 1.16 -1.26 -0.97 117.46 112.57 1b82 n PHE 148 Ca -0.01 -0.22 -0.34 0.00 -1.87 0.00 0.00 57.45 55.01 1b82 n PHE 148 Cb 0.23 0.00 -0.03 0.00 -1.61 0.00 0.00 39.48 38.07 1b82 n PHE 148 CO 0.00 0.00 0.00 -1.01 -1.87 0.00 0.00 176.76 173.88 1b82 s HIS 149 N -1.56 3.01 0.83 2.97 3.76 -0.72 -4.99 115.29 118.58 1b82 s HIS 149 Ca 0.35 1.56 -0.12 0.00 -0.15 0.00 0.00 55.06 56.71 1b82 s HIS 149 Cb 0.20 -3.05 0.09 0.00 1.11 0.00 0.00 32.58 30.93 1b82 s HIS 149 CO 0.28 -0.86 1.10 0.95 -0.85 0.00 0.00 174.74 175.36 1b82 s THR 150 N -2.08 2.87 0.18 1.30 -4.23 -1.26 -4.67 115.64 107.74 1b82 s THR 150 Ca 0.66 0.28 -0.13 0.00 -1.18 0.00 0.00 61.69 61.32 1b82 s THR 150 Cb -0.16 -2.98 0.08 0.00 1.34 0.00 0.00 72.50 70.78 1b82 s THR 150 CO 0.23 -0.37 1.84 0.58 -0.54 0.00 0.00 174.62 176.36 1b82 h VAL 151 N -1.22 1.15 -0.86 2.29 2.07 -1.95 -1.51 116.25 116.22 1b82 h VAL 151 Ca -0.48 -0.28 -0.01 0.00 0.82 0.00 0.00 66.70 66.75 1b82 h VAL 151 Cb 1.28 0.31 -0.04 0.00 -1.52 0.00 0.00 31.29 31.32 1b82 h VAL 151 CO 0.59 0.15 0.50 0.44 0.02 0.00 0.00 177.57 179.27 1b82 h ASP 152 N 0.78 1.04 -0.77 0.57 3.32 -1.99 -0.07 116.42 119.30 1b82 h ASP 152 Ca 0.21 -0.07 -0.06 0.00 0.02 0.00 0.00 57.03 57.13 1b82 h ASP 152 Cb -0.08 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.17 1b82 h ASP 152 CO -0.04 0.81 0.26 1.56 -1.72 0.00 0.00 179.24 180.11 1b82 h GLN 153 N 1.19 1.18 -0.16 3.56 4.20 -1.79 -0.92 115.11 122.37 1b82 h GLN 153 Ca 0.31 -0.24 -0.22 0.00 0.06 0.00 0.00 58.65 58.56 1b82 h GLN 153 Cb -0.03 -0.18 0.01 0.00 0.30 0.00 0.00 27.48 27.58 1b82 h GLN 153 CO -0.06 0.99 -0.74 0.82 -0.67 0.00 0.00 178.83 179.17 1b82 h ILE 154 N 1.14 1.28 -0.36 2.54 2.04 -0.79 -0.86 117.51 122.50 1b82 h ILE 154 Ca 0.25 -1.93 0.02 0.00 1.00 0.00 0.00 64.86 64.20 1b82 h ILE 154 Cb 0.28 1.96 -0.03 0.00 -0.74 0.00 0.00 36.82 38.29 1b82 h ILE 154 CO -0.01 0.61 0.19 0.40 0.00 0.00 0.00 178.15 179.34 1b82 h ILE 155 N 0.53 1.01 -0.61 -0.67 2.04 -0.93 -1.62 117.51 117.26 1b82 h ILE 155 Ca -0.05 -0.13 -0.08 0.00 1.00 0.00 0.00 64.86 65.60 1b82 h ILE 155 Cb 1.37 0.58 -0.02 0.00 -0.74 0.00 0.00 36.82 38.00 1b82 h ILE 155 CO 0.15 0.07 0.07 0.78 0.00 0.00 0.00 178.15 179.22 1b82 h ASN 156 N 0.39 0.97 -0.34 1.72 -0.26 -1.09 -1.72 115.58 115.25 1b82 h ASN 156 Ca 0.15 -0.24 -0.00 0.00 -0.56 0.00 0.00 56.30 55.65 1b82 h ASN 156 Cb 0.03 -0.26 -0.02 0.00 -1.06 0.00 0.00 38.32 37.02 1b82 h ASN 156 CO -0.09 0.98 0.21 -0.09 -1.06 0.00 0.00 177.43 177.39 1b82 h ARG 157 N 0.94 0.46 0.00 0.81 9.65 -0.81 -0.95 114.38 124.48 1b82 h ARG 157 Ca 0.18 -0.04 -0.11 0.00 -1.10 0.00 0.00 59.98 58.91 1b82 h ARG 157 Cb 0.45 -0.10 -0.02 0.00 -1.39 0.00 0.00 29.97 28.92 1b82 h ARG 157 CO 0.02 0.34 -0.53 -0.39 2.80 0.00 0.00 179.97 182.21 1b82 h VAL 158 N 0.44 1.02 -0.21 0.20 -1.51 -1.13 -1.97 116.25 113.09 1b82 h VAL 158 Ca 0.12 -2.14 -0.04 0.00 -1.23 0.00 0.00 66.70 63.41 1b82 h VAL 158 Cb -0.00 2.29 -0.01 0.00 -2.13 0.00 0.00 31.29 31.45 1b82 h VAL 158 CO -0.02 0.52 -0.03 -1.13 -1.23 0.00 0.00 177.57 175.68 1b82 h ASN 159 N 0.00 0.39 0.06 4.19 -1.24 -1.13 -2.15 115.58 115.71 1b82 h ASN 159 Ca -0.01 -0.35 0.01 0.00 0.71 0.00 0.00 56.30 56.66 1b82 h ASN 159 Cb 1.25 -0.11 -0.01 0.00 0.73 0.00 0.00 38.32 40.18 1b82 h ASN 159 CO 0.07 0.65 -0.08 -0.78 -1.29 0.00 0.00 177.43 176.00 1b82 h ASP 160 N 0.13 -0.22 -0.58 1.15 3.58 -1.10 0.20 116.42 119.58 1b82 h ASP 160 Ca 0.06 0.03 0.03 0.00 0.42 0.00 0.00 57.03 57.56 1b82 h ASP 160 Cb 0.46 0.08 -0.04 0.00 1.72 0.00 0.00 39.33 41.56 1b82 h ASP 160 CO 0.02 -0.13 0.35 0.00 -2.88 0.00 0.00 179.24 176.60 1b82 h ALA 161 N 0.75 0.76 0.00 -0.78 0.00 -1.32 -3.38 119.26 115.28 1b82 h ALA 161 Ca 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1b82 h ALA 161 Cb 0.18 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1b82 h ALA 161 CO -0.04 0.06 -0.25 0.41 0.00 0.00 0.00 179.25 179.44 1b82 n GLY 162 N -1.26 -0.17 2.37 0.00 0.00 -0.82 -4.83 105.19 100.48 1b82 n GLY 162 Ca 0.05 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.88 1b82 n GLY 162 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1b82 n GLU 163 N 0.00 -1.53 -2.77 1.61 1.02 0.70 -4.96 120.64 114.71 1b82 n GLU 163 Ca 0.00 0.93 -0.39 0.00 -0.02 0.00 0.00 57.16 57.69 1b82 n GLU 163 Cb 0.60 -5.50 -0.06 0.00 -0.02 0.00 0.00 31.44 26.46 1b82 n GLU 163 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 1b82 s PHE 164 N -2.96 3.86 0.19 -0.32 0.08 -1.17 -4.94 117.98 112.73 1b82 s PHE 164 Ca 0.00 1.85 0.01 0.00 0.12 0.00 0.00 56.93 58.91 1b82 s PHE 164 Cb 0.00 -2.95 0.04 0.00 -0.57 0.00 0.00 43.02 39.54 1b82 s PHE 164 CO 0.00 0.36 0.26 -0.40 -0.10 0.00 0.00 175.22 175.34 1b82 n ASP 165 N 1.11 0.46 0.19 1.36 5.68 -1.26 -3.40 116.55 120.69 1b82 n ASP 165 Ca -0.00 -1.37 0.06 0.00 -0.50 0.00 0.00 54.79 52.98 1b82 n ASP 165 Cb 0.48 -0.16 0.34 0.00 -1.14 0.00 0.00 41.12 40.65 1b82 n ASP 165 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 1b82 h GLU 166 N 0.00 0.00 -0.24 0.11 4.11 -1.96 -2.16 114.58 114.43 1b82 h GLU 166 Ca -0.09 0.00 -0.13 0.00 0.07 0.00 0.00 59.36 59.21 1b82 h GLU 166 Cb 0.35 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.60 1b82 h GLU 166 CO 0.10 0.34 -0.35 -0.07 0.07 0.00 0.00 179.01 179.11 1b82 h LEU 167 N 0.00 0.73 -1.17 3.06 3.38 -1.94 -2.98 115.31 116.38 1b82 h LEU 167 Ca -0.00 -0.51 -0.08 0.00 0.09 0.00 0.00 57.88 57.38 1b82 h LEU 167 Cb 0.89 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 1b82 h LEU 167 CO 0.04 1.10 -0.37 -0.33 0.09 0.00 0.00 178.44 178.98 1b82 h GLU 168 N 0.38 0.00 -0.63 1.13 5.08 -1.84 -1.43 114.58 117.27 1b82 h GLU 168 Ca 0.03 0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.42 1b82 h GLU 168 Cb 0.93 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.14 1b82 h GLU 168 CO 0.08 0.37 0.38 1.25 -1.00 0.00 0.00 179.01 180.09 1b82 h LEU 169 N 0.00 0.61 -0.62 1.33 5.85 -1.31 -1.66 115.31 119.52 1b82 h LEU 169 Ca -0.00 0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.65 1b82 h LEU 169 Cb 0.76 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.64 1b82 h LEU 169 CO 0.05 0.42 0.10 0.58 -0.34 0.00 0.00 178.44 179.25 1b82 h VAL 170 N 0.74 1.26 -0.61 1.05 2.07 -1.13 -2.95 116.25 116.68 1b82 h VAL 170 Ca 0.26 -1.01 -0.02 0.00 0.82 0.00 0.00 66.70 66.75 1b82 h VAL 170 Cb 0.04 0.71 -0.03 0.00 -1.52 0.00 0.00 31.29 30.50 1b82 h VAL 170 CO -0.11 0.37 0.32 -0.50 0.02 0.00 0.00 177.57 177.67 1b82 h TRP 171 N 0.93 0.86 0.00 1.57 6.55 -0.99 -2.51 115.95 122.36 1b82 h TRP 171 Ca 0.19 -0.03 -0.01 0.00 0.95 0.00 0.00 58.89 59.99 1b82 h TRP 171 Cb 0.43 -0.27 -0.00 0.00 -0.86 0.00 0.00 29.16 28.46 1b82 h TRP 171 CO 0.03 0.63 -0.05 0.00 -1.05 0.00 0.00 178.44 178.00 1b82 h MET 172 N 0.84 0.00 0.00 0.49 -0.00 -1.20 -2.24 114.93 112.82 1b82 h MET 172 Ca 0.21 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.91 1b82 h MET 172 Cb 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.67 1b82 h MET 172 CO -0.03 0.05 0.00 1.28 -0.00 0.00 0.00 176.91 178.21 1b82 n LEU 173 N -3.17 0.00 0.24 -0.10 4.77 -0.95 -2.74 117.00 115.05 1b82 n LEU 173 Ca 0.01 0.28 0.15 0.00 -0.03 0.00 0.00 56.01 56.41 1b82 n LEU 173 Cb 0.34 -0.28 0.82 0.00 -2.33 0.00 0.00 43.42 41.97 1b82 n LEU 173 CO 0.29 -0.07 1.13 0.28 -1.33 0.00 0.00 177.39 177.69 1b82 h SER 174 N 0.00 0.00 0.17 -1.43 0.02 -1.42 -0.41 113.55 110.47 1b82 h SER 174 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1b82 h SER 174 Cb 0.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.75 1b82 h SER 174 CO 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.69 1b82 h ALA 175 N 1.91 1.00 0.00 3.77 0.00 -1.75 -0.83 119.26 123.36 1b82 h ALA 175 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1b82 h ALA 175 Cb 0.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1b82 h ALA 175 CO -0.00 0.00 0.00 0.72 0.00 0.00 0.00 179.25 179.97 1b82 n HIS 176 N -2.83 0.00 0.36 0.00 -0.00 -0.16 -1.68 115.22 110.92 1b82 n HIS 176 Ca -0.02 0.00 0.14 0.00 -0.00 0.00 0.00 57.72 57.84 1b82 n HIS 176 Cb 0.10 -0.17 0.54 0.00 -0.00 0.00 0.00 29.99 30.46 1b82 n HIS 176 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.34 177.37 1b82 h SER 177 N 0.00 0.00 -2.11 0.41 0.87 -1.34 -3.34 113.55 108.04 1b82 h SER 177 Ca 0.00 0.00 -0.58 0.00 -1.23 0.00 0.00 61.79 59.98 1b82 h SER 177 Cb 0.10 0.00 -0.40 0.00 -0.44 0.00 0.00 62.40 61.66 1b82 h SER 177 CO 0.00 0.00 -0.85 1.33 -0.53 0.00 0.00 176.83 176.78 1b82 n VAL 178 N -2.61 0.83 -3.50 2.23 0.24 -0.67 -4.24 118.33 110.60 1b82 n VAL 178 Ca 0.02 -4.61 -0.14 0.00 -2.04 0.00 0.00 64.34 57.57 1b82 n VAL 178 Cb 0.29 -2.03 -0.04 0.00 -1.47 0.00 0.00 33.84 30.59 1b82 n VAL 178 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1b82 s ALA 179 N -1.81 -1.77 0.16 2.33 0.00 -1.25 -4.69 121.76 114.73 1b82 s ALA 179 Ca 0.37 1.12 -0.02 0.00 0.00 0.00 0.00 51.96 53.43 1b82 s ALA 179 Cb 0.16 0.15 -0.04 0.00 0.00 0.00 0.00 23.12 23.39 1b82 s ALA 179 CO -0.06 -0.50 0.11 0.00 0.00 0.00 0.00 175.76 175.31 1b82 s ALA 180 N -2.07 0.83 -0.22 0.00 0.00 -1.26 -2.23 121.76 116.80 1b82 s ALA 180 Ca -0.04 -1.46 -0.01 0.00 0.00 0.00 0.00 51.96 50.45 1b82 s ALA 180 Cb -0.00 1.03 0.02 0.00 0.00 0.00 0.00 23.12 24.16 1b82 s ALA 180 CO 0.00 -0.55 -0.10 0.08 0.00 0.00 0.00 175.76 175.20 1b82 s VAL 181 N -4.07 2.75 -0.07 0.00 1.01 0.36 -4.87 120.40 115.51 1b82 s VAL 181 Ca 0.28 -0.87 0.17 0.00 0.00 0.00 0.00 61.98 61.55 1b82 s VAL 181 Cb 0.07 -2.30 -0.26 0.00 0.00 0.00 0.00 36.38 33.89 1b82 s VAL 181 CO 0.05 0.35 0.29 0.59 0.00 0.00 0.00 175.10 176.38 1b82 n ASN 182 N 4.68 0.91 0.00 3.32 3.02 -1.26 -1.31 115.26 124.61 1b82 n ASN 182 Ca -0.18 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.37 1b82 n ASN 182 Cb 0.49 1.55 0.00 0.00 -0.61 0.00 0.00 39.78 41.21 1b82 n ASN 182 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1b82 n ASP 183 N -2.27 1.75 -0.04 6.41 8.00 -1.26 -4.53 116.55 124.61 1b82 n ASP 183 Ca -0.10 -1.76 -0.21 0.00 0.71 0.00 0.00 54.79 53.43 1b82 n ASP 183 Cb 0.64 0.00 -0.13 0.00 -0.02 0.00 0.00 41.12 41.61 1b82 n ASP 183 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 1b82 h VAL 184 N 0.04 1.06 -3.87 2.53 2.07 -1.90 -3.43 116.25 112.76 1b82 h VAL 184 Ca 0.00 -2.31 -0.64 0.00 0.82 0.00 0.00 66.70 64.57 1b82 h VAL 184 Cb 0.40 2.62 -0.17 0.00 -1.52 0.00 0.00 31.29 32.62 1b82 h VAL 184 CO 0.00 0.56 -0.46 -0.62 0.02 0.00 0.00 177.57 177.07 1b82 s ASP 185 N -6.86 6.07 0.18 0.57 -1.08 -1.26 -4.74 116.67 109.55 1b82 s ASP 185 Ca -0.23 0.05 0.24 0.00 -0.52 0.00 0.00 52.55 52.09 1b82 s ASP 185 Cb 0.04 -2.14 0.91 0.00 -1.46 0.00 0.00 42.92 40.27 1b82 s ASP 185 CO 0.69 -0.08 1.73 -0.81 0.52 0.00 0.00 175.17 177.23 1b82 n PRO 186 N 5.11 0.18 0.05 4.34 -0.04 -1.26 -2.57 135.00 140.81 1b82 n PRO 186 Ca -0.13 0.28 0.12 0.00 -0.04 0.00 0.00 63.50 63.73 1b82 n PRO 186 Cb 0.52 -1.77 0.13 0.00 -0.04 0.00 0.00 33.50 32.34 1b82 n PRO 186 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1b82 n THR 187 N -2.08 0.29 -3.71 0.52 -2.24 -1.26 -4.93 114.28 100.87 1b82 n THR 187 Ca 0.04 -0.26 -0.13 0.00 -2.27 0.00 0.00 64.05 61.43 1b82 n THR 187 Cb 0.31 -0.02 -0.10 0.00 -2.10 0.00 0.00 70.33 68.42 1b82 n THR 187 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1b82 s VAL 188 N -3.17 -0.00 0.08 2.28 0.11 -1.06 -5.04 120.40 113.58 1b82 s VAL 188 Ca 0.05 0.01 0.04 0.00 -2.93 0.00 0.00 61.98 59.16 1b82 s VAL 188 Cb 0.14 -0.65 -0.04 0.00 -1.53 0.00 0.00 36.38 34.29 1b82 s VAL 188 CO 0.75 0.01 0.02 -1.10 -3.33 0.00 0.00 175.10 171.44 1b82 s GLN 189 N 0.46 2.67 0.00 1.54 -0.21 -1.26 -4.55 119.66 118.31 1b82 s GLN 189 Ca -0.02 -0.77 0.00 0.00 0.02 0.00 0.00 55.36 54.59 1b82 s GLN 189 Cb -0.04 -2.61 0.00 0.00 1.00 0.00 0.00 33.01 31.36 1b82 s GLN 189 CO -0.02 0.56 0.00 0.41 -2.12 0.00 0.00 175.29 174.12 1b82 n GLY 190 N 0.62 0.86 3.69 3.09 0.00 -0.43 -4.59 105.19 108.44 1b82 n GLY 190 Ca -0.10 -0.43 -0.42 0.00 0.00 0.00 0.00 46.02 45.07 1b82 n GLY 190 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1b82 s LEU 191 N 0.00 4.28 0.57 0.99 1.43 -0.91 -0.32 118.68 124.72 1b82 s LEU 191 Ca 0.00 1.52 -0.16 0.00 -1.03 0.00 0.00 54.13 54.46 1b82 s LEU 191 Cb 0.00 -3.50 -0.05 0.00 0.03 0.00 0.00 46.19 42.67 1b82 s LEU 191 CO 0.00 -0.37 1.03 -2.84 0.23 0.00 0.00 176.35 174.40 1b82 s PRO 192 N 1.66 3.54 0.30 1.29 0.02 -1.25 -0.49 135.00 140.08 1b82 s PRO 192 Ca 0.48 1.08 0.16 0.00 0.02 0.00 0.00 61.00 62.74 1b82 s PRO 192 Cb -0.19 -2.07 0.22 0.00 0.02 0.00 0.00 34.50 32.49 1b82 s PRO 192 CO 0.20 -0.62 1.52 0.74 -0.33 0.00 0.00 177.00 178.51 1b82 h PHE 193 N 0.51 0.00 -4.75 6.54 0.04 -1.67 -1.76 116.94 115.85 1b82 h PHE 193 Ca -0.46 0.00 -0.38 0.00 2.80 0.00 0.00 57.97 59.92 1b82 h PHE 193 Cb 1.21 0.00 -0.14 0.00 2.20 0.00 0.00 35.95 39.22 1b82 h PHE 193 CO 0.61 0.47 -0.52 0.16 -0.60 0.00 0.00 178.31 178.43 1b82 s ASP 194 N -6.44 1.12 0.00 2.17 1.47 -1.26 -4.79 116.67 108.94 1b82 s ASP 194 Ca 0.03 -1.62 0.29 0.00 1.18 0.00 0.00 52.55 52.43 1b82 s ASP 194 Cb 0.08 0.50 1.53 0.00 -0.34 0.00 0.00 42.92 44.70 1b82 s ASP 194 CO 0.73 -1.00 2.01 -1.54 0.68 0.00 0.00 175.17 176.05 1b82 n SER 195 N -1.10 0.46 -3.24 2.11 3.41 -1.26 -4.00 113.62 109.99 1b82 n SER 195 Ca 0.05 -1.21 -0.25 0.00 -0.26 0.00 0.00 58.87 57.20 1b82 n SER 195 Cb 0.64 -0.01 -0.06 0.00 -0.26 0.00 0.00 64.21 64.52 1b82 n SER 195 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1b82 n THR 196 N -0.61 1.30 0.49 6.66 -2.24 -1.26 -4.94 114.28 113.68 1b82 n THR 196 Ca 0.21 -4.86 0.07 0.00 -2.27 0.00 0.00 64.05 57.20 1b82 n THR 196 Cb 0.18 -1.72 0.30 0.00 -2.10 0.00 0.00 70.33 66.99 1b82 n THR 196 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1b82 n PRO 197 N 0.75 0.01 -0.18 -0.78 -0.04 -1.26 -1.22 135.00 132.29 1b82 n PRO 197 Ca 0.27 0.25 0.10 0.00 -0.04 0.00 0.00 63.50 64.08 1b82 n PRO 197 Cb 0.47 -1.50 0.19 0.00 -0.04 0.00 0.00 33.50 32.62 1b82 n PRO 197 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1b82 n GLY 198 N -0.06 1.73 3.12 0.55 0.00 -1.26 -3.96 105.19 105.31 1b82 n GLY 198 Ca 0.04 -0.63 -0.29 0.00 0.00 0.00 0.00 46.02 45.14 1b82 n GLY 198 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1b82 s ILE 199 N -1.28 1.64 -0.74 -0.61 1.01 -0.36 -3.89 121.20 116.97 1b82 s ILE 199 Ca 0.34 -0.76 -0.24 0.00 0.00 0.00 0.00 60.65 59.99 1b82 s ILE 199 Cb 0.19 -1.45 0.06 0.00 0.01 0.00 0.00 42.46 41.28 1b82 s ILE 199 CO 0.27 0.47 1.11 0.12 0.00 0.00 0.00 174.94 176.91 1b82 s PHE 200 N 0.56 2.58 0.09 3.97 5.36 0.31 -4.62 117.98 126.22 1b82 s PHE 200 Ca -0.15 -0.49 0.00 0.00 -0.96 0.00 0.00 56.93 55.33 1b82 s PHE 200 Cb -0.17 -4.43 0.00 0.00 -0.34 0.00 0.00 43.02 38.08 1b82 s PHE 200 CO 0.05 -1.79 0.11 -0.40 -1.46 0.00 0.00 175.22 171.73 1b82 n ASP 201 N 8.22 -0.31 -1.71 6.13 5.68 -1.26 -4.44 116.55 128.86 1b82 n ASP 201 Ca 0.03 -1.49 0.08 0.00 -0.50 0.00 0.00 54.79 52.90 1b82 n ASP 201 Cb 0.47 0.60 0.37 0.00 -1.14 0.00 0.00 41.12 41.42 1b82 n ASP 201 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1b82 n SER 202 N -2.14 5.13 0.20 -1.12 7.64 -1.26 -4.43 113.62 117.64 1b82 n SER 202 Ca 0.01 -2.70 0.05 0.00 1.01 0.00 0.00 58.87 57.23 1b82 n SER 202 Cb 0.15 -0.63 0.48 0.00 -1.01 0.00 0.00 64.21 63.20 1b82 n SER 202 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 1b82 h GLN 203 N 3.84 0.05 -0.54 1.43 1.08 -1.93 -1.44 115.11 117.59 1b82 h GLN 203 Ca 0.00 -0.01 0.07 0.00 -1.45 0.00 0.00 58.65 57.26 1b82 h GLN 203 Cb 1.71 -0.01 -0.06 0.00 -0.05 0.00 0.00 27.48 29.07 1b82 h GLN 203 CO 0.37 0.22 0.23 0.35 -0.95 0.00 0.00 178.83 179.05 1b82 h PHE 204 N 0.05 0.41 -0.14 2.96 3.57 -1.88 0.12 116.94 122.03 1b82 h PHE 204 Ca 0.01 0.02 -0.16 0.00 3.53 0.00 0.00 57.97 61.38 1b82 h PHE 204 Cb 0.32 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.95 1b82 h PHE 204 CO 0.00 0.16 -0.58 0.74 -2.23 0.00 0.00 178.31 176.40 1b82 h PHE 205 N 0.43 0.55 0.01 0.41 0.04 -1.62 -2.15 116.94 114.61 1b82 h PHE 205 Ca 0.25 -0.20 -0.00 0.00 2.80 0.00 0.00 57.97 60.82 1b82 h PHE 205 Cb 0.24 -0.10 0.00 0.00 2.20 0.00 0.00 35.95 38.29 1b82 h PHE 205 CO -0.14 0.91 -0.00 0.28 -0.60 0.00 0.00 178.31 178.76 1b82 h VAL 206 N 0.33 1.34 0.00 -0.55 2.07 -0.88 -3.28 116.25 115.28 1b82 h VAL 206 Ca -0.00 -1.06 -0.09 0.00 0.82 0.00 0.00 66.70 66.37 1b82 h VAL 206 Cb 1.11 2.06 -0.01 0.00 -1.52 0.00 0.00 31.29 32.92 1b82 h VAL 206 CO 0.10 0.27 -0.43 -0.33 0.02 0.00 0.00 177.57 177.20 1b82 h GLU 207 N -0.46 0.00 0.00 1.57 5.08 -0.80 -1.85 114.58 118.12 1b82 h GLU 207 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1b82 h GLU 207 Cb 0.45 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.70 1b82 h GLU 207 CO 0.00 0.43 0.00 1.79 -1.00 0.00 0.00 179.01 180.24 1b82 h THR 208 N 0.00 0.00 0.00 1.13 1.35 -1.52 -2.79 112.91 111.08 1b82 h THR 208 Ca -0.00 -0.58 0.00 0.00 -0.55 0.00 0.00 66.41 65.28 1b82 h THR 208 Cb 1.04 1.52 0.00 0.00 -1.73 0.00 0.00 68.15 68.98 1b82 h THR 208 CO 0.06 0.00 -0.28 1.67 -0.25 0.00 0.00 175.52 176.72 1b82 n GLN 209 N -2.74 0.10 -1.58 4.72 -0.06 -0.70 -4.88 117.38 112.23 1b82 n GLN 209 Ca 0.03 0.05 -0.31 0.00 -2.00 0.00 0.00 57.00 54.77 1b82 n GLN 209 Cb 0.38 -1.58 0.05 0.00 -4.06 0.00 0.00 30.24 25.03 1b82 n GLN 209 CO 0.00 0.00 0.00 -0.51 -0.20 0.00 0.00 177.06 176.35 1b82 s LEU 210 N -3.47 3.17 0.20 1.69 1.43 -1.05 -0.76 118.68 119.89 1b82 s LEU 210 Ca 0.11 1.69 -0.31 0.00 -1.03 0.00 0.00 54.13 54.59 1b82 s LEU 210 Cb 0.16 -4.51 -0.09 0.00 0.03 0.00 0.00 46.19 41.78 1b82 s LEU 210 CO 0.63 -1.51 1.43 -0.60 0.23 0.00 0.00 176.35 176.53 1b82 s ARG 211 N -4.87 4.29 0.07 1.70 3.52 0.63 -4.75 118.95 119.54 1b82 s ARG 211 Ca 0.59 2.22 -0.30 0.00 -0.13 0.00 0.00 55.73 58.12 1b82 s ARG 211 Cb -0.15 -3.16 -0.05 0.00 -1.56 0.00 0.00 34.95 30.03 1b82 s ARG 211 CO 0.52 -0.43 0.99 0.20 -0.81 0.00 0.00 175.30 175.78 1b82 s GLY 212 N 0.66 2.93 0.00 8.12 0.00 -1.26 -4.26 107.32 113.50 1b82 s GLY 212 Ca 0.62 0.59 0.00 0.00 0.00 0.00 0.00 44.72 45.93 1b82 s GLY 212 CO 0.37 1.59 0.00 -1.30 0.00 0.00 0.00 173.10 173.76 1b82 n THR 213 N 3.24 0.00 -3.45 0.90 -2.24 -0.06 -4.82 114.28 107.86 1b82 n THR 213 Ca 0.04 -0.25 -0.12 0.00 -2.27 0.00 0.00 64.05 61.46 1b82 n THR 213 Cb 0.50 0.80 -0.02 0.00 -2.10 0.00 0.00 70.33 69.50 1b82 n THR 213 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1b82 s ALA 214 N -0.95 -1.66 0.13 6.98 0.00 -0.85 -4.95 121.76 120.47 1b82 s ALA 214 Ca 0.00 0.67 -0.19 0.00 0.00 0.00 0.00 51.96 52.43 1b82 s ALA 214 Cb 0.00 0.71 -0.07 0.00 0.00 0.00 0.00 23.12 23.76 1b82 s ALA 214 CO 0.00 -0.72 0.63 -0.06 0.00 0.00 0.00 175.76 175.61 1b82 s PHE 215 N -3.40 3.75 0.04 0.00 0.08 -1.26 -0.44 117.98 116.75 1b82 s PHE 215 Ca 0.01 1.31 0.20 0.00 0.12 0.00 0.00 56.93 58.57 1b82 s PHE 215 Cb -0.01 -2.54 0.62 0.00 -0.57 0.00 0.00 43.02 40.52 1b82 s PHE 215 CO -0.10 0.49 1.70 -1.00 -0.10 0.00 0.00 175.22 176.21 1b82 h PRO 216 N 4.07 0.00 0.00 0.24 0.13 -1.88 -3.45 132.00 131.11 1b82 h PRO 216 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1b82 h PRO 216 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1b82 h PRO 216 CO 0.65 0.32 0.00 0.41 -0.23 0.00 0.00 178.00 179.15 1b82 n GLY 217 N 0.49 2.48 3.90 1.56 0.00 -1.26 -4.62 105.19 107.75 1b82 n GLY 217 Ca 0.01 -0.31 -0.28 0.00 0.00 0.00 0.00 46.02 45.44 1b82 n GLY 217 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1b82 s SER 218 N 1.00 6.41 0.30 1.61 1.04 -1.26 -5.07 113.70 117.73 1b82 s SER 218 Ca 0.00 0.85 0.01 0.00 0.48 0.00 0.00 55.95 57.29 1b82 s SER 218 Cb 0.00 -2.20 -0.03 0.00 0.10 0.00 0.00 66.02 63.88 1b82 s SER 218 CO 0.00 -0.34 0.49 -0.83 0.98 0.00 0.00 173.24 173.54 1b82 s GLY 219 N -3.45 1.40 -1.01 7.32 0.00 -1.26 -4.59 107.32 105.74 1b82 s GLY 219 Ca 0.46 -0.94 0.00 0.00 0.00 0.00 0.00 44.72 44.24 1b82 s GLY 219 CO 0.34 -0.90 0.00 0.61 0.00 0.00 0.00 173.10 173.15 1b82 n GLY 220 N -1.51 1.05 3.77 0.20 0.00 -1.26 -5.01 105.19 102.43 1b82 n GLY 220 Ca -0.05 -0.59 -0.36 0.00 0.00 0.00 0.00 46.02 45.02 1b82 n GLY 220 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1b82 s ASN 221 N -2.88 5.69 0.24 1.61 0.01 -1.26 -4.91 114.94 113.44 1b82 s ASN 221 Ca 0.00 2.29 -0.31 0.00 -0.71 0.00 0.00 52.86 54.13 1b82 s ASN 221 Cb 0.00 -2.59 -0.11 0.00 0.41 0.00 0.00 41.25 38.96 1b82 s ASN 221 CO 0.00 -1.24 1.61 -1.58 -1.51 0.00 0.00 177.10 174.38 1b82 s GLN 222 N -3.13 4.15 0.00 -0.60 0.74 -1.26 -1.75 119.66 117.82 1b82 s GLN 222 Ca 0.71 2.52 0.00 0.00 0.05 0.00 0.00 55.36 58.65 1b82 s GLN 222 Cb -0.27 -3.07 0.00 0.00 1.10 0.00 0.00 33.01 30.77 1b82 s GLN 222 CO 0.31 -0.64 0.00 0.41 -0.55 0.00 0.00 175.29 174.82 1b82 n GLY 223 N 3.02 0.88 3.60 2.59 0.00 -1.26 -4.91 105.19 109.10 1b82 n GLY 223 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 1b82 n GLY 223 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1b82 s GLU 224 N -0.13 2.64 0.30 1.61 2.12 -0.71 -0.21 118.70 124.31 1b82 s GLU 224 Ca 0.00 -0.65 0.04 0.00 0.36 0.00 0.00 54.97 54.72 1b82 s GLU 224 Cb 0.00 -2.55 -0.06 0.00 0.26 0.00 0.00 34.13 31.78 1b82 s GLU 224 CO 0.00 0.63 0.03 0.14 -0.54 0.00 0.00 175.26 175.52 1b82 s VAL 225 N -0.94 1.18 0.62 3.70 -7.23 -0.65 -4.69 120.40 112.40 1b82 s VAL 225 Ca 0.16 -2.02 -0.18 0.00 -1.81 0.00 0.00 61.98 58.12 1b82 s VAL 225 Cb -0.11 -2.65 -0.02 0.00 0.56 0.00 0.00 36.38 34.16 1b82 s VAL 225 CO 0.06 -0.10 1.26 -1.61 -0.31 0.00 0.00 175.10 174.39 1b82 s GLU 226 N -3.87 2.73 0.42 4.82 2.02 -1.26 -4.15 118.70 119.41 1b82 s GLU 226 Ca 0.34 1.96 0.07 0.00 0.02 0.00 0.00 54.97 57.36 1b82 s GLU 226 Cb 0.07 -1.88 -0.05 0.00 0.10 0.00 0.00 34.13 32.37 1b82 s GLU 226 CO 0.14 -1.43 0.15 -1.54 0.02 0.00 0.00 175.26 172.59 1b82 s SER 227 N -1.48 4.31 0.00 -0.19 1.04 0.41 -4.44 113.70 113.34 1b82 s SER 227 Ca 0.80 -1.16 0.23 0.00 0.48 0.00 0.00 55.95 56.30 1b82 s SER 227 Cb -0.34 -0.41 0.17 0.00 0.10 0.00 0.00 66.02 65.54 1b82 s SER 227 CO 0.37 -0.55 1.18 -0.81 0.98 0.00 0.00 173.24 174.41 1b82 n PRO 228 N -1.20 0.02 -4.15 4.02 -0.04 -1.26 -0.88 135.00 131.52 1b82 n PRO 228 Ca -0.02 -0.02 -0.15 0.00 -0.04 0.00 0.00 63.50 63.27 1b82 n PRO 228 Cb 0.65 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.48 1b82 n PRO 228 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1b82 s LEU 229 N -2.99 2.11 0.34 1.53 1.43 -1.26 -4.82 118.68 115.02 1b82 s LEU 229 Ca 0.10 -0.29 -0.29 0.00 -1.03 0.00 0.00 54.13 52.62 1b82 s LEU 229 Cb 0.17 -0.26 -0.11 0.00 0.03 0.00 0.00 46.19 46.01 1b82 s LEU 229 CO 0.77 -0.03 1.54 -2.84 0.23 0.00 0.00 176.35 176.02 1b82 s PRO 230 N -0.73 4.11 0.00 1.29 0.02 -1.26 -2.06 135.00 136.36 1b82 s PRO 230 Ca -0.02 2.59 0.00 0.00 0.02 0.00 0.00 61.00 63.58 1b82 s PRO 230 Cb -0.05 -2.99 0.00 0.00 0.02 0.00 0.00 34.50 31.48 1b82 s PRO 230 CO 0.00 -0.58 0.00 0.41 -0.33 0.00 0.00 177.00 176.50 1b82 n GLY 231 N 1.13 2.87 3.87 0.52 0.00 -1.26 -0.83 105.19 111.50 1b82 n GLY 231 Ca 0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 1b82 n GLY 231 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1b82 s GLU 232 N -0.43 3.58 0.12 1.61 2.12 -0.87 -3.86 118.70 120.95 1b82 s GLU 232 Ca 0.00 -0.00 0.05 0.00 0.36 0.00 0.00 54.97 55.37 1b82 s GLU 232 Cb 0.00 -3.17 -0.04 0.00 0.26 0.00 0.00 34.13 31.18 1b82 s GLU 232 CO 0.00 0.73 0.06 -1.50 -0.54 0.00 0.00 175.26 174.01 1b82 s ILE 233 N -1.10 4.29 -0.03 -3.70 2.07 -0.66 -4.41 121.20 117.65 1b82 s ILE 233 Ca 0.20 -0.98 0.03 0.00 -1.41 0.00 0.00 60.65 58.48 1b82 s ILE 233 Cb -0.13 -3.10 0.00 0.00 0.13 0.00 0.00 42.46 39.36 1b82 s ILE 233 CO 0.09 0.04 -0.11 -0.60 -1.91 0.00 0.00 174.94 172.45 1b82 s ARG 234 N -2.62 1.19 0.24 3.50 3.52 -1.26 -4.47 118.95 119.06 1b82 s ARG 234 Ca 0.29 -0.37 0.05 0.00 -0.13 0.00 0.00 55.73 55.57 1b82 s ARG 234 Cb -0.11 -1.08 -0.03 0.00 -1.56 0.00 0.00 34.95 32.17 1b82 s ARG 234 CO 0.21 0.12 0.37 0.96 -0.81 0.00 0.00 175.30 176.15 1b82 s ILE 235 N 0.24 5.25 0.26 4.11 -4.36 -1.26 -1.64 121.20 123.81 1b82 s ILE 235 Ca -0.05 -0.96 -0.02 0.00 -0.26 0.00 0.00 60.65 59.36 1b82 s ILE 235 Cb -0.10 -3.86 0.13 0.00 1.25 0.00 0.00 42.46 39.88 1b82 s ILE 235 CO 0.01 -0.34 1.78 -0.61 0.24 0.00 0.00 174.94 176.03 1b82 h GLN 236 N 1.17 0.82 -0.25 0.37 4.15 -0.67 -1.98 115.11 118.73 1b82 h GLN 236 Ca -0.52 -0.20 -0.01 0.00 0.77 0.00 0.00 58.65 58.69 1b82 h GLN 236 Cb 1.23 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 28.80 1b82 h GLN 236 CO 0.61 0.79 0.10 0.66 -1.93 0.00 0.00 178.83 179.06 1b82 h SER 237 N 0.78 0.34 -0.58 -0.69 4.64 -1.31 -1.34 113.55 115.38 1b82 h SER 237 Ca 0.16 -0.16 -0.07 0.00 -0.47 0.00 0.00 61.79 61.26 1b82 h SER 237 Cb 0.39 -0.09 -0.02 0.00 -0.31 0.00 0.00 62.40 62.37 1b82 h SER 237 CO 0.01 0.40 0.09 0.44 -0.87 0.00 0.00 176.83 176.90 1b82 h ASP 238 N 0.25 0.92 -0.50 4.97 3.32 -1.83 -0.69 116.42 122.87 1b82 h ASP 238 Ca 0.08 -0.26 0.07 0.00 0.02 0.00 0.00 57.03 56.94 1b82 h ASP 238 Cb 0.16 -0.24 -0.06 0.00 0.22 0.00 0.00 39.33 39.41 1b82 h ASP 238 CO -0.01 0.95 0.19 -0.74 -1.72 0.00 0.00 179.24 177.91 1b82 h HIS 239 N 0.86 0.34 -0.00 4.55 2.76 -1.18 -1.93 115.15 120.54 1b82 h HIS 239 Ca 0.18 0.02 -0.20 0.00 -2.20 0.00 0.00 60.37 58.17 1b82 h HIS 239 Cb 0.42 -0.08 -0.01 0.00 1.55 0.00 0.00 27.41 29.30 1b82 h HIS 239 CO 0.03 0.12 -0.88 1.79 -1.30 0.00 0.00 177.93 177.69 1b82 h THR 240 N 0.38 1.46 -0.09 6.26 1.35 -0.84 -3.14 112.91 118.28 1b82 h THR 240 Ca 0.24 -2.53 -0.11 0.00 -0.55 0.00 0.00 66.41 63.46 1b82 h THR 240 Cb 0.24 2.42 -0.01 0.00 -1.73 0.00 0.00 68.15 69.07 1b82 h THR 240 CO -0.23 0.74 -0.44 0.40 -0.25 0.00 0.00 175.52 175.74 1b82 h ILE 241 N 0.15 1.32 0.00 6.82 2.04 -1.01 0.12 117.51 126.95 1b82 h ILE 241 Ca -0.05 -1.58 -0.03 0.00 1.00 0.00 0.00 64.86 64.20 1b82 h ILE 241 Cb 1.50 1.74 -0.00 0.00 -0.74 0.00 0.00 36.82 39.32 1b82 h ILE 241 CO 0.14 0.47 -0.14 0.00 0.00 0.00 0.00 178.15 178.62 1b82 h ALA 242 N 1.38 1.13 -0.00 1.87 0.00 -1.31 -3.15 119.26 119.17 1b82 h ALA 242 Ca 0.01 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1b82 h ALA 242 Cb 0.85 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1b82 h ALA 242 CO 0.07 0.17 -0.36 0.54 0.00 0.00 0.00 179.25 179.67 1b82 n ARG 243 N -3.44 2.59 -2.40 0.00 1.74 -0.72 -4.44 116.66 109.99 1b82 n ARG 243 Ca -0.01 -0.37 -0.41 0.00 -0.77 0.00 0.00 57.85 56.30 1b82 n ARG 243 Cb 0.31 -1.08 -0.04 0.00 -1.02 0.00 0.00 32.46 30.63 1b82 n ARG 243 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1b82 s ASP 244 N -1.74 7.15 0.61 0.55 -1.08 -0.05 -4.82 116.67 117.29 1b82 s ASP 244 Ca 0.07 2.31 0.33 0.00 -0.52 0.00 0.00 52.55 54.75 1b82 s ASP 244 Cb 0.09 -2.62 1.95 0.00 -1.46 0.00 0.00 42.92 40.88 1b82 s ASP 244 CO 0.36 -0.26 2.27 0.77 0.52 0.00 0.00 175.17 178.84 1b82 h SER 245 N 4.20 0.00 0.84 -0.34 4.64 -1.91 0.12 113.55 121.09 1b82 h SER 245 Ca -0.46 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 60.70 1b82 h SER 245 Cb 1.21 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.28 1b82 h SER 245 CO 0.69 0.01 -0.76 0.03 -0.87 0.00 0.00 176.83 175.93 1b82 h ARG 246 N 0.00 0.00 0.00 4.77 3.08 -1.94 -3.38 114.38 116.91 1b82 h ARG 246 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1b82 h ARG 246 Cb 0.02 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.07 1b82 h ARG 246 CO 0.00 0.76 -0.31 0.25 -1.07 0.00 0.00 179.97 179.60 1b82 n THR 247 N -3.56 0.00 -0.28 2.04 -2.24 -0.56 -4.76 114.28 104.92 1b82 n THR 247 Ca -0.00 -0.37 -0.01 0.00 -2.27 0.00 0.00 64.05 61.40 1b82 n THR 247 Cb 0.75 0.90 0.12 0.00 -2.10 0.00 0.00 70.33 70.00 1b82 n THR 247 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1b82 h ALA 248 N 0.39 1.05 -0.04 6.98 0.00 -0.93 -0.53 119.26 126.18 1b82 h ALA 248 Ca 0.00 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.76 1b82 h ALA 248 Cb 0.08 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1b82 h ALA 248 CO 0.00 0.22 -0.63 0.00 0.00 0.00 0.00 179.25 178.84 1b82 h GLU 250 N 0.12 0.49 -0.21 0.00 4.57 -1.73 -1.02 114.58 116.81 1b82 h GLU 250 Ca -0.01 -0.34 -0.00 0.00 -1.18 0.00 0.00 59.36 57.83 1b82 h GLU 250 Cb 1.13 0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 29.76 1b82 h GLU 250 CO 0.09 0.96 0.12 2.35 -1.18 0.00 0.00 179.01 181.35 1b82 h TRP 251 N 0.37 0.28 0.00 0.92 2.91 -0.97 -2.29 115.95 117.17 1b82 h TRP 251 Ca -0.01 -0.00 -0.03 0.00 1.13 0.00 0.00 58.89 59.98 1b82 h TRP 251 Cb 1.17 -0.09 -0.00 0.00 -0.51 0.00 0.00 29.16 29.72 1b82 h TRP 251 CO 0.04 0.24 -0.13 0.37 -1.03 0.00 0.00 178.44 177.94 1b82 h GLN 252 N 0.25 0.00 0.00 2.65 4.15 -1.22 -3.16 115.11 117.78 1b82 h GLN 252 Ca 0.08 0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.49 1b82 h GLN 252 Cb 0.04 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 27.73 1b82 h GLN 252 CO -0.01 0.13 -0.00 0.66 -1.93 0.00 0.00 178.83 177.67 1b82 h SER 253 N 0.00 0.00 1.63 -0.69 4.64 -0.57 -1.24 113.55 117.32 1b82 h SER 253 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1b82 h SER 253 Cb 0.57 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.66 1b82 h SER 253 CO 0.02 0.00 -0.07 -0.26 -0.87 0.00 0.00 176.83 175.65 1b82 h PHE 254 N 0.00 0.00 -2.53 4.77 0.04 -1.65 -3.41 116.94 114.16 1b82 h PHE 254 Ca -0.00 0.00 -0.54 0.00 2.80 0.00 0.00 57.97 60.23 1b82 h PHE 254 Cb 0.01 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.18 1b82 h PHE 254 CO 0.00 0.00 1.13 0.08 -0.60 0.00 0.00 178.31 178.92 1b82 s VAL 255 N -3.16 3.17 -1.51 -0.55 1.01 -0.47 -2.02 120.40 116.87 1b82 s VAL 255 Ca 0.09 0.34 -0.02 0.00 0.00 0.00 0.00 61.98 62.39 1b82 s VAL 255 Cb 0.09 -3.22 0.00 0.00 0.00 0.00 0.00 36.38 33.26 1b82 s VAL 255 CO 0.64 -0.02 0.32 -3.20 0.00 0.00 0.00 175.10 172.84 1b82 n ASN 256 N 6.85 -5.64 -3.25 3.32 5.15 -1.26 -4.93 115.26 115.50 1b82 n ASN 256 Ca 0.18 -0.16 -0.24 0.00 -0.60 0.00 0.00 54.58 53.77 1b82 n ASN 256 Cb 0.41 -4.56 -0.08 0.00 -0.53 0.00 0.00 39.78 35.02 1b82 n ASN 256 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1b82 n ASN 257 N -1.92 -0.58 -0.25 1.20 2.85 -0.85 -4.97 115.26 110.73 1b82 n ASN 257 Ca -0.16 -2.55 -0.05 0.00 -0.11 0.00 0.00 54.58 51.70 1b82 n ASN 257 Cb 0.64 -0.32 0.05 0.00 1.24 0.00 0.00 39.78 41.39 1b82 n ASN 257 CO 0.00 0.00 0.00 -0.61 -2.11 0.00 0.00 177.26 174.54 1b82 h GLN 258 N 4.97 0.93 -0.04 1.20 4.15 -1.92 -2.27 115.11 122.13 1b82 h GLN 258 Ca 0.17 -0.08 -0.07 0.00 0.77 0.00 0.00 58.65 59.44 1b82 h GLN 258 Cb 0.92 -0.20 -0.01 0.00 0.21 0.00 0.00 27.48 28.40 1b82 h GLN 258 CO 0.37 0.65 -0.29 0.66 -1.93 0.00 0.00 178.83 178.30 1b82 h SER 259 N 0.94 0.07 -0.01 -0.69 4.64 -1.96 -0.30 113.55 116.23 1b82 h SER 259 Ca 0.25 -0.02 -0.19 0.00 -0.47 0.00 0.00 61.79 61.35 1b82 h SER 259 Cb -0.04 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.03 1b82 h SER 259 CO -0.05 0.36 -0.69 0.50 -0.87 0.00 0.00 176.83 176.09 1b82 h LYS 260 N 0.06 0.64 -0.03 4.77 3.64 -1.90 -1.24 116.57 122.50 1b82 h LYS 260 Ca 0.01 -0.48 -0.00 0.00 -1.27 0.00 0.00 60.65 58.91 1b82 h LYS 260 Cb 0.55 0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.46 1b82 h LYS 260 CO 0.04 1.10 0.02 1.25 -2.27 0.00 0.00 179.45 179.59 1b82 h LEU 261 N 0.46 0.04 -0.37 5.20 5.85 -0.95 -1.04 115.31 124.49 1b82 h LEU 261 Ca -0.02 -0.07 -0.03 0.00 0.84 0.00 0.00 57.88 58.60 1b82 h LEU 261 Cb 1.28 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 42.28 1b82 h LEU 261 CO 0.13 0.10 0.12 0.58 -0.34 0.00 0.00 178.44 179.03 1b82 h VAL 262 N -0.02 1.21 -0.39 1.05 2.07 -1.01 -1.15 116.25 118.02 1b82 h VAL 262 Ca 0.01 -0.69 -0.06 0.00 0.82 0.00 0.00 66.70 66.78 1b82 h VAL 262 Cb 0.06 0.96 -0.01 0.00 -1.52 0.00 0.00 31.29 30.78 1b82 h VAL 262 CO -0.00 0.24 -0.01 0.44 0.02 0.00 0.00 177.57 178.25 1b82 h ASP 263 N 0.45 0.68 -0.41 0.57 3.32 -1.14 -1.16 116.42 118.72 1b82 h ASP 263 Ca 0.12 -0.32 -0.09 0.00 0.02 0.00 0.00 57.03 56.76 1b82 h ASP 263 Cb 0.25 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.61 1b82 h ASP 263 CO -0.00 0.83 -0.09 0.44 -1.72 0.00 0.00 179.24 178.69 1b82 h ASP 264 N 0.51 0.80 -0.13 6.45 3.32 -1.18 -2.38 116.42 123.80 1b82 h ASP 264 Ca 0.11 -0.36 -0.15 0.00 0.02 0.00 0.00 57.03 56.65 1b82 h ASP 264 Cb 0.49 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.81 1b82 h ASP 264 CO 0.02 0.97 -0.43 0.15 -1.72 0.00 0.00 179.24 178.23 1b82 h PHE 265 N 0.61 0.82 -0.35 4.55 3.57 -1.13 -1.75 116.94 123.26 1b82 h PHE 265 Ca 0.10 -0.25 0.07 0.00 3.53 0.00 0.00 57.97 61.42 1b82 h PHE 265 Cb 0.62 -0.17 -0.07 0.00 2.79 0.00 0.00 35.95 39.12 1b82 h PHE 265 CO 0.05 0.99 -0.09 0.37 -2.23 0.00 0.00 178.31 177.40 1b82 h GLN 266 N 0.55 -0.00 -0.07 1.11 4.15 -1.15 0.76 115.11 120.46 1b82 h GLN 266 Ca 0.04 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.46 1b82 h GLN 266 Cb 0.97 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.66 1b82 h GLN 266 CO 0.09 -0.00 0.04 0.35 -1.93 0.00 0.00 178.83 177.38 1b82 h PHE 267 N -0.00 0.08 0.00 3.99 3.04 -1.28 -2.71 116.94 120.06 1b82 h PHE 267 Ca 0.17 0.00 -0.13 0.00 3.98 0.00 0.00 57.97 61.99 1b82 h PHE 267 Cb 0.26 -0.03 -0.02 0.00 2.56 0.00 0.00 35.95 38.72 1b82 h PHE 267 CO -0.32 0.07 -0.64 0.97 -2.02 0.00 0.00 178.31 176.37 1b82 h ILE 268 N 0.07 1.20 -0.34 1.41 6.09 -1.06 -2.35 117.51 122.53 1b82 h ILE 268 Ca 0.02 -2.41 -0.06 0.00 -1.37 0.00 0.00 64.86 61.04 1b82 h ILE 268 Cb 0.01 2.40 -0.01 0.00 0.47 0.00 0.00 36.82 39.69 1b82 h ILE 268 CO -0.00 0.63 -0.04 0.15 -3.07 0.00 0.00 178.15 175.81 1b82 h PHE 269 N 0.00 0.70 -0.36 2.19 3.57 -0.85 0.02 116.94 122.21 1b82 h PHE 269 Ca -0.01 -0.14 -0.00 0.00 3.53 0.00 0.00 57.97 61.36 1b82 h PHE 269 Cb 1.35 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 39.90 1b82 h PHE 269 CO 0.00 0.77 0.22 1.25 -2.23 0.00 0.00 178.31 178.32 1b82 h LEU 270 N 0.42 0.43 -0.77 0.59 5.85 -1.36 -2.19 115.31 118.28 1b82 h LEU 270 Ca 0.09 -0.04 0.09 0.00 0.84 0.00 0.00 57.88 58.85 1b82 h LEU 270 Cb 0.52 -0.11 -0.07 0.00 0.37 0.00 0.00 40.66 41.37 1b82 h LEU 270 CO 0.03 0.35 0.42 0.00 -0.34 0.00 0.00 178.44 178.89 1b82 h ALA 271 N 1.10 1.07 -0.71 1.25 0.00 -1.13 -1.62 119.26 119.22 1b82 h ALA 271 Ca 0.13 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1b82 h ALA 271 Cb -0.01 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 1b82 h ALA 271 CO -0.03 0.05 0.40 -0.07 0.00 0.00 0.00 179.25 179.60 1b82 h LEU 272 N 0.72 0.89 0.00 0.00 3.38 -0.50 -2.13 115.31 117.66 1b82 h LEU 272 Ca 0.37 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.25 1b82 h LEU 272 Cb 0.33 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1b82 h LEU 272 CO -0.24 0.72 0.00 0.35 0.09 0.00 0.00 178.44 179.36 1b82 n THR 273 N -4.49 0.77 0.16 0.22 -2.24 -0.65 -2.30 114.28 105.75 1b82 n THR 273 Ca 0.06 0.19 0.08 0.00 -2.27 0.00 0.00 64.05 62.12 1b82 n THR 273 Cb 0.08 -0.93 0.16 0.00 -2.10 0.00 0.00 70.33 67.54 1b82 n THR 273 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1b82 n GLN 274 N -1.40 2.15 -1.96 -0.78 6.02 -0.81 -4.78 117.38 115.81 1b82 n GLN 274 Ca 0.05 -1.95 -0.41 0.00 -0.01 0.00 0.00 57.00 54.68 1b82 n GLN 274 Cb 0.15 -1.36 -0.02 0.00 1.02 0.00 0.00 30.24 30.03 1b82 n GLN 274 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1b82 s LEU 275 N -1.17 4.38 0.00 1.08 1.43 -0.97 -1.69 118.68 121.73 1b82 s LEU 275 Ca 0.28 2.74 0.00 0.00 -1.03 0.00 0.00 54.13 56.11 1b82 s LEU 275 Cb 0.16 -3.63 0.00 0.00 0.03 0.00 0.00 46.19 42.75 1b82 s LEU 275 CO 0.22 -0.75 0.00 0.61 0.23 0.00 0.00 176.35 176.66 1b82 n GLY 276 N 2.18 0.83 3.52 -3.19 0.00 -1.26 -0.09 105.19 107.18 1b82 n GLY 276 Ca 0.07 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.84 1b82 n GLY 276 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1b82 s GLN 277 N -0.23 1.77 -0.37 1.61 -1.52 -0.68 -4.90 119.66 115.33 1b82 s GLN 277 Ca 0.00 -1.94 -0.11 0.00 -1.95 0.00 0.00 55.36 51.36 1b82 s GLN 277 Cb 0.00 -1.45 0.02 0.00 -0.22 0.00 0.00 33.01 31.36 1b82 s GLN 277 CO 0.00 0.03 0.21 0.34 -0.25 0.00 0.00 175.29 175.62 1b82 s ASP 278 N -3.58 5.76 0.33 5.90 -1.08 -1.26 -4.97 116.67 117.78 1b82 s ASP 278 Ca 0.33 -0.88 0.06 0.00 -0.52 0.00 0.00 52.55 51.54 1b82 s ASP 278 Cb 0.05 -2.04 0.73 0.00 -1.46 0.00 0.00 42.92 40.21 1b82 s ASP 278 CO 0.16 -0.36 1.86 -0.65 0.52 0.00 0.00 175.17 176.70 1b82 h PRO 279 N 8.45 0.76 0.00 4.34 0.11 -1.96 -0.84 132.00 142.86 1b82 h PRO 279 Ca -0.27 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.79 1b82 h PRO 279 Cb 1.11 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.05 1b82 h PRO 279 CO 0.67 0.51 0.00 0.09 -0.21 0.00 0.00 178.00 179.05 1b82 n ASN 280 N -4.57 0.30 -1.16 -2.05 3.02 -1.26 -2.15 115.26 107.39 1b82 n ASN 280 Ca 0.17 0.56 0.12 0.00 -0.03 0.00 0.00 54.58 55.40 1b82 n ASN 280 Cb 0.42 -0.63 0.22 0.00 -0.61 0.00 0.00 39.78 39.18 1b82 n ASN 280 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1b82 n ALA 281 N -1.62 2.41 -2.83 5.41 0.00 -0.33 -3.94 120.51 119.61 1b82 n ALA 281 Ca 0.04 -1.02 -0.21 0.00 0.00 0.00 0.00 53.44 52.25 1b82 n ALA 281 Cb 0.25 -0.86 -0.03 0.00 0.00 0.00 0.00 19.45 18.82 1b82 n ALA 281 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1b82 s MET 282 N -1.43 3.20 -0.15 0.00 -1.94 -0.91 -4.92 119.30 113.14 1b82 s MET 282 Ca 0.39 -0.92 -0.06 0.00 -1.71 0.00 0.00 55.69 53.40 1b82 s MET 282 Cb 0.23 -2.76 -0.04 0.00 2.01 0.00 0.00 34.83 34.27 1b82 s MET 282 CO 0.31 0.35 0.04 0.99 -0.01 0.00 0.00 175.02 176.71 1b82 s THR 283 N -2.07 4.64 -0.49 2.05 2.01 -0.77 -4.92 115.64 116.09 1b82 s THR 283 Ca 0.36 -0.10 -0.24 0.00 0.31 0.00 0.00 61.69 62.02 1b82 s THR 283 Cb -0.08 -3.04 0.03 0.00 0.01 0.00 0.00 72.50 69.41 1b82 s THR 283 CO 0.28 0.52 0.86 -0.62 -0.69 0.00 0.00 174.62 174.96 1b82 s ASP 284 N -0.07 6.39 -0.31 3.53 -1.08 -1.26 -0.60 116.67 123.27 1b82 s ASP 284 Ca 0.06 -0.21 0.08 0.00 -0.52 0.00 0.00 52.55 51.95 1b82 s ASP 284 Cb -0.12 -2.41 0.53 0.00 -1.46 0.00 0.00 42.92 39.46 1b82 s ASP 284 CO 0.01 -1.05 1.53 0.00 0.52 0.00 0.00 175.17 176.18 1b82 h SER 286 N 1.04 0.00 0.41 0.00 0.02 -1.75 -2.31 113.55 110.97 1b82 h SER 286 Ca 0.28 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.23 1b82 h SER 286 Cb 1.83 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.37 1b82 h SER 286 CO 0.49 0.00 0.00 0.44 -1.14 0.00 0.00 176.83 176.62 1b82 h ASP 287 N 0.00 0.00 0.68 3.07 3.32 -1.90 -1.64 116.42 119.96 1b82 h ASP 287 Ca 0.04 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 56.92 1b82 h ASP 287 Cb 0.18 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.71 1b82 h ASP 287 CO -0.00 0.00 -0.76 0.58 -1.72 0.00 0.00 179.24 177.34 1b82 h VAL 288 N 0.00 1.52 -3.13 -1.35 2.07 -1.77 -3.45 116.25 110.13 1b82 h VAL 288 Ca 0.00 -2.52 -0.53 0.00 0.82 0.00 0.00 66.70 64.48 1b82 h VAL 288 Cb 0.20 2.36 0.04 0.00 -1.52 0.00 0.00 31.29 32.38 1b82 h VAL 288 CO 0.00 0.72 0.77 -0.63 0.02 0.00 0.00 177.57 178.46 1b82 s ILE 289 N -3.33 2.86 0.79 4.57 -1.09 -0.62 -4.97 121.20 119.41 1b82 s ILE 289 Ca -0.01 0.66 -0.14 0.00 -2.23 0.00 0.00 60.65 58.93 1b82 s ILE 289 Cb 0.11 -3.43 0.07 0.00 -1.58 0.00 0.00 42.46 37.64 1b82 s ILE 289 CO 0.79 0.08 1.22 -2.84 -1.23 0.00 0.00 174.94 172.96 1b82 s PRO 290 N 0.43 1.72 0.20 2.79 0.02 -1.26 -4.94 135.00 133.95 1b82 s PRO 290 Ca 0.63 1.82 -0.30 0.00 0.02 0.00 0.00 61.00 63.17 1b82 s PRO 290 Cb -0.41 -1.78 -0.08 0.00 0.02 0.00 0.00 34.50 32.25 1b82 s PRO 290 CO 0.36 -2.17 1.27 -0.65 -0.33 0.00 0.00 177.00 175.48 1b82 s GLN 291 N -4.03 4.43 0.52 5.54 -0.21 -1.26 -4.74 119.66 119.90 1b82 s GLN 291 Ca 0.75 1.99 -0.19 0.00 0.02 0.00 0.00 55.36 57.93 1b82 s GLN 291 Cb -0.30 -3.21 -0.07 0.00 1.00 0.00 0.00 33.01 30.43 1b82 s GLN 291 CO 0.49 -0.19 1.04 -1.12 -2.12 0.00 0.00 175.29 173.39 1b82 s SER 292 N 0.24 6.20 0.20 5.90 0.01 -1.26 -4.97 113.70 120.01 1b82 s SER 292 Ca 0.55 1.86 0.03 0.00 1.31 0.00 0.00 55.95 59.70 1b82 s SER 292 Cb -0.35 -2.55 -0.03 0.00 0.21 0.00 0.00 66.02 63.30 1b82 s SER 292 CO 0.38 -0.88 0.34 -1.59 0.41 0.00 0.00 173.24 171.90 1b82 s LYS 293 N -3.56 3.45 0.79 12.44 -2.85 -1.26 -4.97 119.74 123.78 1b82 s LYS 293 Ca 0.65 -0.61 -0.12 0.00 -1.00 0.00 0.00 55.97 54.89 1b82 s LYS 293 Cb -0.16 -2.91 0.07 0.00 -2.06 0.00 0.00 37.83 32.77 1b82 s LYS 293 CO 0.26 0.46 1.12 -1.25 0.10 0.00 0.00 175.35 176.04 1b82 s PRO 294 N -3.56 2.11 -0.03 1.78 0.04 -1.26 -0.20 135.00 133.88 1b82 s PRO 294 Ca 0.35 0.40 -0.30 0.00 0.04 0.00 0.00 61.00 61.49 1b82 s PRO 294 Cb -0.10 -1.94 -0.03 0.00 0.04 0.00 0.00 34.50 32.47 1b82 s PRO 294 CO 0.29 -1.55 1.04 0.42 0.04 0.00 0.00 177.00 177.24 1b82 s ILE 295 N -3.34 4.67 0.84 0.56 1.01 -1.26 -4.30 121.20 119.39 1b82 s ILE 295 Ca 0.61 1.93 -0.12 0.00 0.00 0.00 0.00 60.65 63.07 1b82 s ILE 295 Cb -0.13 -4.24 0.09 0.00 0.01 0.00 0.00 42.46 38.20 1b82 s ILE 295 CO 0.52 0.09 1.13 -2.16 0.00 0.00 0.00 174.94 174.52 1b82 s PRO 296 N 1.45 1.74 0.37 2.79 0.04 -1.26 -4.93 135.00 135.19 1b82 s PRO 296 Ca 0.52 0.39 0.00 0.00 0.04 0.00 0.00 61.00 61.95 1b82 s PRO 296 Cb -0.22 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.42 1b82 s PRO 296 CO 0.24 -1.80 0.00 0.41 0.04 0.00 0.00 177.00 175.89 1b82 n GLY 297 N -2.43 -2.42 0.86 0.56 0.00 -1.26 -4.71 105.19 95.79 1b82 n GLY 297 Ca 0.07 -1.66 0.05 0.00 0.00 0.00 0.00 46.02 44.49 1b82 n GLY 297 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1b82 n ASN 298 N 0.02 1.41 -4.83 1.61 6.94 -1.26 -5.06 115.26 114.09 1b82 n ASN 298 Ca 0.00 -3.05 -0.31 0.00 -0.02 0.00 0.00 54.58 51.20 1b82 n ASN 298 Cb 0.00 -0.42 0.03 0.00 -2.36 0.00 0.00 39.78 37.03 1b82 n ASN 298 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 1b82 s LEU 299 N -1.87 3.21 0.77 -4.53 1.43 -1.26 -5.02 118.68 111.40 1b82 s LEU 299 Ca 0.34 1.58 -0.13 0.00 -1.03 0.00 0.00 54.13 54.89 1b82 s LEU 299 Cb 0.35 -4.49 0.06 0.00 0.03 0.00 0.00 46.19 42.14 1b82 s LEU 299 CO -0.09 -1.23 1.15 -2.84 0.23 0.00 0.00 176.35 173.57 1b82 s PRO 300 N -4.97 2.01 0.08 1.29 0.02 -1.26 -4.94 135.00 127.24 1b82 s PRO 300 Ca 0.58 1.52 -0.21 0.00 0.02 0.00 0.00 61.00 62.90 1b82 s PRO 300 Cb -0.13 -1.84 -0.12 0.00 0.02 0.00 0.00 34.50 32.43 1b82 s PRO 300 CO 0.52 -1.88 1.62 0.35 -0.33 0.00 0.00 177.00 177.28 1b82 h PHE 301 N -0.78 0.19 -3.91 6.54 3.57 -1.99 -3.42 116.94 117.14 1b82 h PHE 301 Ca -0.46 -0.01 -0.69 0.00 3.53 0.00 0.00 57.97 60.34 1b82 h PHE 301 Cb 1.27 -0.06 -0.22 0.00 2.79 0.00 0.00 35.95 39.73 1b82 h PHE 301 CO 0.51 0.27 -0.85 -1.12 -2.23 0.00 0.00 178.31 174.89 1b82 s SER 302 N -5.50 3.45 0.21 0.41 0.01 -1.26 -4.68 113.70 106.33 1b82 s SER 302 Ca -0.14 -0.68 -0.18 0.00 1.31 0.00 0.00 55.95 56.26 1b82 s SER 302 Cb 0.06 -0.32 0.03 0.00 0.21 0.00 0.00 66.02 66.00 1b82 s SER 302 CO 0.69 0.19 0.55 0.72 0.41 0.00 0.00 173.24 175.80 1b82 s PHE 303 N -1.05 -0.13 0.07 2.43 -0.12 -1.26 -4.63 117.98 113.29 1b82 s PHE 303 Ca 0.15 -0.22 -0.19 0.00 -0.05 0.00 0.00 56.93 56.61 1b82 s PHE 303 Cb -0.10 0.43 -0.07 0.00 -0.63 0.00 0.00 43.02 42.65 1b82 s PHE 303 CO 0.07 -0.96 0.57 -0.06 -0.05 0.00 0.00 175.22 174.79 1b82 s PHE 304 N -3.88 3.80 0.87 3.49 0.08 0.42 -4.97 117.98 117.80 1b82 s PHE 304 Ca 0.10 1.27 -0.11 0.00 0.12 0.00 0.00 56.93 58.31 1b82 s PHE 304 Cb -0.02 -2.51 0.12 0.00 -0.57 0.00 0.00 43.02 40.05 1b82 s PHE 304 CO -0.02 0.58 1.15 -2.14 -0.10 0.00 0.00 175.22 174.69 1b82 s PRO 305 N -1.07 1.30 0.39 0.24 0.02 -1.26 -1.80 135.00 132.82 1b82 s PRO 305 Ca 0.29 1.55 -0.26 0.00 0.02 0.00 0.00 61.00 62.61 1b82 s PRO 305 Cb -0.19 -1.76 -0.11 0.00 0.02 0.00 0.00 34.50 32.46 1b82 s PRO 305 CO 0.19 -2.42 1.15 0.00 -0.33 0.00 0.00 177.00 175.59 1b82 n ALA 306 N -3.94 0.71 -0.93 -1.55 0.00 -1.26 -1.98 120.51 111.56 1b82 n ALA 306 Ca 0.12 0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.85 1b82 n ALA 306 Cb 0.52 -2.17 0.00 0.00 0.00 0.00 0.00 19.45 17.80 1b82 n ALA 306 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b82 n GLY 307 N 0.98 0.69 3.31 0.00 0.00 -1.26 -4.26 105.19 104.65 1b82 n GLY 307 Ca 0.08 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.82 1b82 n GLY 307 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b82 s LYS 308 N -0.07 1.54 0.36 1.61 -0.14 -0.84 -5.00 119.74 117.21 1b82 s LYS 308 Ca 0.00 -1.08 0.07 0.00 -1.36 0.00 0.00 55.97 53.59 1b82 s LYS 308 Cb 0.00 -1.75 -0.03 0.00 -1.68 0.00 0.00 37.83 34.38 1b82 s LYS 308 CO 0.00 0.44 0.25 0.95 -0.76 0.00 0.00 175.35 176.23 1b82 s THR 309 N -0.87 0.13 0.56 2.17 -4.23 -1.26 -4.72 115.64 107.43 1b82 s THR 309 Ca 0.10 -2.00 0.26 0.00 -1.18 0.00 0.00 61.69 58.87 1b82 s THR 309 Cb -0.10 -2.44 0.36 0.00 1.34 0.00 0.00 72.50 71.67 1b82 s THR 309 CO 0.03 0.00 2.06 -0.29 -0.54 0.00 0.00 174.62 175.87 1b82 h ILE 310 N 2.00 0.60 0.00 2.99 6.09 -1.95 -0.03 117.51 127.21 1b82 h ILE 310 Ca -0.27 0.00 -0.00 0.00 -1.37 0.00 0.00 64.86 63.22 1b82 h ILE 310 Cb 1.24 0.81 -0.00 0.00 0.47 0.00 0.00 36.82 39.34 1b82 h ILE 310 CO 0.40 0.00 -0.00 0.11 -3.07 0.00 0.00 178.15 175.59 1b82 h LYS 311 N 0.00 0.00 -0.01 2.19 1.57 -2.02 -2.08 116.57 116.22 1b82 h LYS 311 Ca 0.14 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 1b82 h LYS 311 Cb 0.64 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.95 1b82 h LYS 311 CO -0.00 0.00 -0.29 -0.25 -0.57 0.00 0.00 179.45 178.34 1b82 n ASP 312 N -3.11 1.05 -4.73 0.86 8.00 -0.02 -4.89 116.55 113.69 1b82 n ASP 312 Ca -0.02 -0.89 -0.41 0.00 0.71 0.00 0.00 54.79 54.19 1b82 n ASP 312 Cb 0.16 0.17 -0.05 0.00 -0.02 0.00 0.00 41.12 41.39 1b82 n ASP 312 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1b82 s VAL 313 N -2.54 4.61 -0.83 2.53 1.01 -0.78 -0.26 120.40 124.14 1b82 s VAL 313 Ca 0.23 1.91 -0.17 0.00 0.00 0.00 0.00 61.98 63.96 1b82 s VAL 313 Cb 0.19 -4.25 0.17 0.00 0.00 0.00 0.00 36.38 32.49 1b82 s VAL 313 CO 0.54 0.32 0.90 -1.61 0.00 0.00 0.00 175.10 175.25 1b82 s GLU 314 N 0.06 3.52 0.09 2.72 2.02 0.06 -4.87 118.70 122.31 1b82 s GLU 314 Ca 0.44 -2.01 -0.31 0.00 0.02 0.00 0.00 54.97 53.12 1b82 s GLU 314 Cb -0.22 -4.60 -0.10 0.00 0.10 0.00 0.00 34.13 29.31 1b82 s GLU 314 CO 0.27 -1.52 1.90 -1.14 0.02 0.00 0.00 175.26 174.79 1b82 s GLN 315 N 1.56 4.13 0.00 1.61 2.00 -1.26 -4.85 119.66 122.86 1b82 s GLN 315 Ca 0.23 2.62 0.00 0.00 -2.00 0.00 0.00 55.36 56.21 1b82 s GLN 315 Cb -0.10 -3.82 0.00 0.00 0.80 0.00 0.00 33.01 29.89 1b82 s GLN 315 CO -0.07 -0.89 0.00 0.00 -0.50 0.00 0.00 175.29 173.83 1b82 n ALA 316 N 6.41 1.47 -2.63 1.58 0.00 -1.26 -4.97 120.51 121.11 1b82 n ALA 316 Ca 0.19 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.20 1b82 n ALA 316 Cb 0.39 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.81 1b82 n ALA 316 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1b82 h ALA 318 N 8.04 1.00 0.00 0.00 0.00 -1.95 -3.34 119.26 123.01 1b82 h ALA 318 Ca -0.22 0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.48 1b82 h ALA 318 Cb 1.07 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.83 1b82 h ALA 318 CO 0.97 0.00 -1.16 0.93 0.00 0.00 0.00 179.25 179.99 1b82 h GLU 319 N 0.00 0.00 -2.82 0.00 5.08 -2.01 -3.47 114.58 111.36 1b82 h GLU 319 Ca 0.00 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.21 1b82 h GLU 319 Cb 0.90 0.00 -0.27 0.00 0.50 0.00 0.00 28.75 29.87 1b82 h GLU 319 CO 0.00 0.75 -0.37 -0.08 -1.00 0.00 0.00 179.01 178.31 1b82 s THR 320 N -2.73 -0.03 0.45 1.13 -1.32 -1.25 -5.15 115.64 106.75 1b82 s THR 320 Ca -0.00 0.10 -0.24 0.00 -1.21 0.00 0.00 61.69 60.33 1b82 s THR 320 Cb 0.09 -0.51 -0.07 0.00 -1.51 0.00 0.00 72.50 70.50 1b82 s THR 320 CO 0.81 0.04 1.23 -2.16 -2.21 0.00 0.00 174.62 172.33 1b82 s PRO 321 N 1.14 3.74 0.30 7.08 0.04 -1.26 -4.72 135.00 141.31 1b82 s PRO 321 Ca -0.08 1.95 -0.30 0.00 0.04 0.00 0.00 61.00 62.62 1b82 s PRO 321 Cb -0.08 -2.50 -0.12 0.00 0.04 0.00 0.00 34.50 31.84 1b82 s PRO 321 CO -0.09 -0.62 1.43 0.34 0.04 0.00 0.00 177.00 178.10 1b82 n PHE 322 N -0.36 2.46 -1.89 0.56 -0.00 -1.26 -4.90 117.46 112.06 1b82 n PHE 322 Ca 0.07 0.43 -0.37 0.00 -0.00 0.00 0.00 57.45 57.57 1b82 n PHE 322 Cb 0.46 -2.49 0.05 0.00 -0.00 0.00 0.00 39.48 37.50 1b82 n PHE 322 CO 0.00 0.00 0.00 -2.14 -0.00 0.00 0.00 176.76 174.62 1b82 s PRO 323 N -1.07 2.88 -0.64 -7.13 0.02 -1.26 -4.94 135.00 122.86 1b82 s PRO 323 Ca 0.62 1.98 -0.26 0.00 0.02 0.00 0.00 61.00 63.35 1b82 s PRO 323 Cb -0.57 -1.97 0.04 0.00 0.02 0.00 0.00 34.50 32.02 1b82 s PRO 323 CO 0.55 -1.32 1.14 0.95 -0.33 0.00 0.00 177.00 177.98 1b82 s THR 324 N -1.47 4.04 0.38 0.99 -4.23 -1.26 -5.01 115.64 109.08 1b82 s THR 324 Ca 0.78 0.43 0.03 0.00 -1.18 0.00 0.00 61.69 61.74 1b82 s THR 324 Cb -0.35 -4.75 -0.01 0.00 1.34 0.00 0.00 72.50 68.74 1b82 s THR 324 CO 0.38 -1.48 0.57 -0.76 -0.54 0.00 0.00 174.62 172.78 1b82 s LEU 325 N 4.88 3.85 0.52 4.79 1.43 -1.26 -5.10 118.68 127.78 1b82 s LEU 325 Ca 0.35 0.14 -0.17 0.00 -1.03 0.00 0.00 54.13 53.41 1b82 s LEU 325 Cb -0.10 -3.03 -0.07 0.00 0.03 0.00 0.00 46.19 43.02 1b82 s LEU 325 CO 0.18 -0.52 1.00 0.28 0.23 0.00 0.00 176.35 177.53 1b82 s THR 326 N -2.36 4.28 -0.17 5.49 -1.32 -1.26 -4.76 115.64 115.55 1b82 s THR 326 Ca 0.45 1.17 -0.06 0.00 -1.21 0.00 0.00 61.69 62.04 1b82 s THR 326 Cb -0.10 -3.60 -0.04 0.00 -1.51 0.00 0.00 72.50 67.25 1b82 s THR 326 CO 0.35 -0.55 0.03 -0.89 -2.21 0.00 0.00 174.62 171.34 1b82 s THR 327 N -2.46 4.48 0.59 5.08 2.01 -1.26 -0.43 115.64 123.64 1b82 s THR 327 Ca 0.61 -0.15 -0.20 0.00 0.31 0.00 0.00 61.69 62.27 1b82 s THR 327 Cb -0.12 -3.00 -0.03 0.00 0.01 0.00 0.00 72.50 69.36 1b82 s THR 327 CO 0.29 0.48 1.30 -0.76 -0.69 0.00 0.00 174.62 175.24 1b82 s LEU 328 N 0.27 3.73 0.71 4.42 1.43 -0.74 -4.94 118.68 123.56 1b82 s LEU 328 Ca 0.01 2.62 -0.11 0.00 -1.03 0.00 0.00 54.13 55.62 1b82 s LEU 328 Cb -0.13 -4.46 0.02 0.00 0.03 0.00 0.00 46.19 41.65 1b82 s LEU 328 CO 0.01 -1.70 1.08 -2.16 0.23 0.00 0.00 176.35 173.81 1b82 s PRO 329 N -3.14 2.79 0.20 1.29 0.04 -1.26 -4.03 135.00 130.89 1b82 s PRO 329 Ca 0.76 0.66 0.00 0.00 0.04 0.00 0.00 61.00 62.47 1b82 s PRO 329 Cb -0.37 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.18 1b82 s PRO 329 CO 0.41 -1.13 0.00 0.41 0.04 0.00 0.00 177.00 176.73 1b82 n GLY 330 N -2.50 -2.57 3.84 0.56 0.00 -1.26 -4.79 105.19 98.48 1b82 n GLY 330 Ca 0.07 -1.88 -0.31 0.00 0.00 0.00 0.00 46.02 43.89 1b82 n GLY 330 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1b82 s PRO 331 N -0.40 3.41 0.20 1.61 0.04 -1.26 -4.19 135.00 134.41 1b82 s PRO 331 Ca 0.00 0.91 -0.31 0.00 0.04 0.00 0.00 61.00 61.64 1b82 s PRO 331 Cb 0.00 -2.05 -0.10 0.00 0.04 0.00 0.00 34.50 32.38 1b82 s PRO 331 CO 0.00 -0.72 1.56 -2.00 0.04 0.00 0.00 177.00 175.88 1b82 s GLU 332 N -4.82 4.20 0.06 4.56 2.12 -1.26 -4.71 118.70 118.86 1b82 s GLU 332 Ca 0.58 2.41 0.07 0.00 0.36 0.00 0.00 54.97 58.39 1b82 s GLU 332 Cb -0.12 -3.12 -0.03 0.00 0.26 0.00 0.00 34.13 31.11 1b82 s GLU 332 CO 0.48 -0.59 -0.17 -0.08 -0.54 0.00 0.00 175.26 174.36 1b82 s THR 333 N 0.75 2.85 0.47 -1.70 -1.32 -1.26 -5.05 115.64 110.38 1b82 s THR 333 Ca 0.67 -1.26 -0.19 0.00 -1.21 0.00 0.00 61.69 59.70 1b82 s THR 333 Cb -0.45 -2.24 -0.09 0.00 -1.51 0.00 0.00 72.50 68.22 1b82 s THR 333 CO 0.36 0.27 0.98 -0.94 -2.21 0.00 0.00 174.62 173.08 1b82 s SER 334 N -1.65 6.70 -0.04 8.08 1.04 -1.26 -4.66 113.70 121.91 1b82 s SER 334 Ca 0.16 1.69 -0.28 0.00 0.48 0.00 0.00 55.95 58.00 1b82 s SER 334 Cb -0.11 -2.53 -0.03 0.00 0.10 0.00 0.00 66.02 63.45 1b82 s SER 334 CO 0.07 -0.53 0.91 -0.69 0.98 0.00 0.00 173.24 173.97 1b82 s VAL 335 N -2.31 4.91 0.37 5.02 1.01 -0.01 -4.97 120.40 124.41 1b82 s VAL 335 Ca 0.62 1.88 -0.26 0.00 0.00 0.00 0.00 61.98 64.23 1b82 s VAL 335 Cb -0.11 -4.24 -0.09 0.00 0.00 0.00 0.00 36.38 31.94 1b82 s VAL 335 CO 0.21 0.16 1.08 -1.10 0.00 0.00 0.00 175.10 175.45 1b82 s GLN 336 N 1.12 4.28 0.73 2.72 -0.21 -1.26 -4.46 119.66 122.59 1b82 s GLN 336 Ca 0.47 1.63 -0.11 0.00 0.02 0.00 0.00 55.36 57.37 1b82 s GLN 336 Cb -0.20 -2.74 0.03 0.00 1.00 0.00 0.00 33.01 31.10 1b82 s GLN 336 CO 0.24 -0.07 1.10 -0.98 -2.12 0.00 0.00 175.29 173.46 1b82 s ARG 337 N -2.18 2.66 -0.44 2.91 1.70 -1.26 -4.70 118.95 117.64 1b82 s ARG 337 Ca 0.54 0.51 0.00 0.00 -0.47 0.00 0.00 55.73 56.31 1b82 s ARG 337 Cb -0.26 -1.99 0.12 0.00 -0.57 0.00 0.00 34.95 32.25 1b82 s ARG 337 CO 0.33 -1.19 0.20 0.42 -1.08 0.00 0.00 175.30 173.98 1b82 s ILE 338 N -3.30 2.94 0.19 4.99 1.01 0.56 -5.02 121.20 122.56 1b82 s ILE 338 Ca 0.59 -2.48 -0.31 0.00 0.00 0.00 0.00 60.65 58.44 1b82 s ILE 338 Cb -0.12 -3.04 -0.10 0.00 0.01 0.00 0.00 42.46 39.20 1b82 s ILE 338 CO 0.52 -0.71 1.59 -2.84 0.00 0.00 0.00 174.94 173.50 1b82 s PRO 339 N 0.66 4.20 0.68 2.79 0.02 -1.26 -4.10 135.00 137.98 1b82 s PRO 339 Ca 0.12 2.42 -0.06 0.00 0.02 0.00 0.00 61.00 63.50 1b82 s PRO 339 Cb -0.22 -3.13 0.05 0.00 0.02 0.00 0.00 34.50 31.23 1b82 s PRO 339 CO -0.05 -0.62 0.98 -1.25 -0.33 0.00 0.00 177.00 175.73 1b82 s PRO 340 N 0.95 2.28 0.84 5.54 0.04 -1.26 -4.84 135.00 138.55 1b82 s PRO 340 Ca 0.70 -0.29 -0.11 0.00 0.04 0.00 0.00 61.00 61.33 1b82 s PRO 340 Cb -0.45 -2.21 0.10 0.00 0.04 0.00 0.00 34.50 31.98 1b82 s PRO 340 CO 0.33 -1.15 1.09 -2.14 0.04 0.00 0.00 177.00 175.17 1b82 s PRO 341 N -5.18 1.70 0.39 0.56 0.02 -1.26 -4.94 135.00 126.29 1b82 s PRO 341 Ca 0.59 0.98 -0.25 0.00 0.02 0.00 0.00 61.00 62.34 1b82 s PRO 341 Cb -0.11 -1.85 -0.11 0.00 0.02 0.00 0.00 34.50 32.45 1b82 s PRO 341 CO 0.44 -1.98 1.03 -2.30 -0.33 0.00 0.00 177.00 173.86 1b82 n PRO 342 N -3.73 1.41 -0.59 5.54 -0.02 -1.26 -2.96 135.00 133.39 1b82 n PRO 342 Ca 0.08 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 62.06 1b82 n PRO 342 Cb 0.54 -2.03 0.00 0.00 -0.02 0.00 0.00 33.50 31.99 1b82 n PRO 342 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1b82 n GLY 343 N 1.16 0.79 0.00 -1.23 0.00 -1.26 -4.92 105.19 99.73 1b82 n GLY 343 Ca 0.09 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.23 1b82 n GLY 343 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32