#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b81 n GLU 5 N 0.00 0.00 -0.21 1.57 1.02 -1.26 -4.78 120.64 116.98 2b81 n GLU 5 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 2b81 n GLU 5 Cb 0.00 0.00 0.11 0.00 -0.02 0.00 0.00 31.44 31.53 2b81 n GLU 5 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 2b81 h LYS 6 N 0.00 0.44 -0.15 3.49 3.64 -2.04 -2.07 116.57 119.88 2b81 h LYS 6 Ca 0.00 -0.03 -0.07 0.00 -1.27 0.00 0.00 60.65 59.29 2b81 h LYS 6 Cb 0.00 -0.10 -0.04 0.00 -0.41 0.00 0.00 32.23 31.68 2b81 h LYS 6 CO 0.00 0.29 -0.24 1.19 -2.27 0.00 0.00 179.45 178.42 2b81 n PHE 7 N -4.96 0.48 -0.32 1.91 3.01 -1.26 -4.82 117.46 111.49 2b81 n PHE 7 Ca 0.09 -1.42 0.15 0.00 1.01 0.00 0.00 57.45 57.28 2b81 n PHE 7 Cb 0.27 -0.33 0.33 0.00 -0.01 0.00 0.00 39.48 39.74 2b81 n PHE 7 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2b81 h ALA 8 N 0.93 1.56 -0.27 4.37 0.00 -1.79 -1.07 119.26 122.98 2b81 h ALA 8 Ca 0.08 0.15 -0.19 0.00 0.00 0.00 0.00 54.91 54.95 2b81 h ALA 8 Cb 1.28 0.10 -0.13 0.00 0.00 0.00 0.00 17.79 19.04 2b81 h ALA 8 CO 0.16 -0.31 -0.47 0.09 0.00 0.00 0.00 179.25 178.72 2b81 n ASN 9 N -4.99 2.79 -4.57 0.00 4.13 -1.26 -4.99 115.26 106.37 2b81 n ASN 9 Ca 0.24 -3.85 -0.41 0.00 1.68 0.00 0.00 54.58 52.24 2b81 n ASN 9 Cb 0.69 -0.51 -0.08 0.00 -1.54 0.00 0.00 39.78 38.33 2b81 n ASN 9 CO 0.00 0.00 0.00 -2.28 0.28 0.00 0.00 177.26 175.26 2b81 s HIS 10 N -3.35 3.20 0.05 3.10 2.46 -0.41 -5.00 115.29 115.35 2b81 s HIS 10 Ca 0.43 0.21 -0.33 0.00 0.47 0.00 0.00 55.06 55.84 2b81 s HIS 10 Cb 0.39 -2.83 -0.19 0.00 -0.13 0.00 0.00 32.58 29.83 2b81 s HIS 10 CO -0.03 -0.47 1.49 0.35 -2.47 0.00 0.00 174.74 173.61 2b81 h PHE 11 N 8.39 -0.97 -0.86 3.88 3.57 -1.88 -1.83 116.94 127.24 2b81 h PHE 11 Ca -0.29 -0.02 0.08 0.00 3.53 0.00 0.00 57.97 61.27 2b81 h PHE 11 Cb 1.13 0.32 -0.07 0.00 2.79 0.00 0.00 35.95 40.13 2b81 h PHE 11 CO 0.72 -0.59 0.52 0.78 -2.23 0.00 0.00 178.31 177.51 2b81 h GLY 12 N -1.12 1.33 0.76 2.40 0.00 -1.08 -2.10 103.07 103.25 2b81 h GLY 12 Ca -0.11 -0.37 -0.01 0.00 0.00 0.00 0.00 47.33 46.85 2b81 h GLY 12 CO 0.18 0.21 -0.11 -1.82 0.00 0.00 0.00 176.54 175.00 2b81 h TYR 13 N 0.92 -0.28 0.00 5.60 3.20 -1.74 -3.16 116.97 121.51 2b81 h TYR 13 Ca 0.39 -0.01 -0.06 0.00 3.14 0.00 0.00 58.73 62.20 2b81 h TYR 13 Cb 0.27 0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.62 2b81 h TYR 13 CO -0.04 0.00 -0.27 -0.91 -1.64 0.00 0.00 178.16 175.31 2b81 h ASN 14 N -0.54 0.00 0.00 -2.11 2.35 -1.22 0.21 115.58 114.27 2b81 h ASN 14 Ca -0.03 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.72 2b81 h ASN 14 Cb 0.40 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.77 2b81 h ASN 14 CO 0.05 0.27 0.00 -1.14 -1.65 0.00 0.00 177.43 174.96 2b81 n ARG 15 N -3.62 0.63 -0.76 0.81 0.63 -0.80 -4.64 116.66 108.92 2b81 n ARG 15 Ca -0.01 0.00 -0.29 0.00 -0.92 0.00 0.00 57.85 56.63 2b81 n ARG 15 Cb 0.40 -1.20 -0.04 0.00 0.45 0.00 0.00 32.46 32.07 2b81 n ARG 15 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 2b81 n PHE 17 N -0.07 0.20 -3.62 -0.14 3.01 0.73 -0.79 117.46 116.78 2b81 n PHE 17 Ca 0.00 0.54 -0.15 0.00 1.01 0.00 0.00 57.45 58.84 2b81 n PHE 17 Cb 0.10 -1.06 -0.07 0.00 -0.01 0.00 0.00 39.48 38.43 2b81 n PHE 17 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2b81 s ALA 18 N -0.12 -1.56 0.08 4.37 0.00 -1.26 -5.04 121.76 118.24 2b81 s ALA 18 Ca 0.44 1.50 -0.37 0.00 0.00 0.00 0.00 51.96 53.53 2b81 s ALA 18 Cb -0.61 -0.60 -0.17 0.00 0.00 0.00 0.00 23.12 21.73 2b81 s ALA 18 CO 0.29 -0.32 1.34 1.17 0.00 0.00 0.00 175.76 178.24 2b81 n LYS 19 N 2.02 1.12 -0.90 0.00 4.81 -1.26 -1.28 118.16 122.67 2b81 n LYS 19 Ca -0.16 0.40 0.00 0.00 -0.87 0.00 0.00 58.31 57.68 2b81 n LYS 19 Cb 0.56 -2.05 0.00 0.00 0.02 0.00 0.00 35.03 33.57 2b81 n LYS 19 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2b81 n ASP 20 N 2.52 -2.77 -4.66 3.14 8.00 -1.26 -4.98 116.55 116.54 2b81 n ASP 20 Ca 0.18 0.00 -0.32 0.00 0.71 0.00 0.00 54.79 55.37 2b81 n ASP 20 Cb 0.19 -1.77 -0.09 0.00 -0.02 0.00 0.00 41.12 39.43 2b81 n ASP 20 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 2b81 s GLN 21 N -0.84 2.62 -0.03 -1.24 -1.52 -0.41 -4.96 119.66 113.29 2b81 s GLN 21 Ca 0.00 -0.73 0.07 0.00 -1.95 0.00 0.00 55.36 52.75 2b81 s GLN 21 Cb 0.00 -2.57 -0.02 0.00 -0.22 0.00 0.00 33.01 30.20 2b81 s GLN 21 CO 0.00 0.59 -0.26 -1.17 -0.25 0.00 0.00 175.29 174.20 2b81 s LEU 22 N -1.79 2.07 0.17 2.90 0.20 -1.26 -4.27 118.68 116.70 2b81 s LEU 22 Ca 0.21 -0.48 0.08 0.00 0.69 0.00 0.00 54.13 54.63 2b81 s LEU 22 Cb -0.11 -1.35 -0.04 0.00 -0.43 0.00 0.00 46.19 44.25 2b81 s LEU 22 CO 0.12 0.30 -0.17 -0.89 -0.29 0.00 0.00 176.35 175.42 2b81 s THR 23 N -0.49 1.75 -0.02 3.68 2.01 -0.24 -4.64 115.64 117.69 2b81 s THR 23 Ca 0.06 -1.98 0.03 0.00 0.31 0.00 0.00 61.69 60.11 2b81 s THR 23 Cb -0.11 -1.87 -0.03 0.00 0.01 0.00 0.00 72.50 70.50 2b81 s THR 23 CO 0.00 -0.40 -0.08 -0.76 -0.69 0.00 0.00 174.62 172.69 2b81 s LEU 24 N -2.83 3.08 0.41 4.42 1.02 -1.26 -1.72 118.68 121.80 2b81 s LEU 24 Ca 0.17 -0.13 0.04 0.00 0.02 0.00 0.00 54.13 54.22 2b81 s LEU 24 Cb -0.04 -1.73 -0.03 0.00 0.02 0.00 0.00 46.19 44.41 2b81 s LEU 24 CO 0.06 0.31 0.11 -0.83 0.02 0.00 0.00 176.35 176.03 2b81 s GLY 25 N -1.16 2.58 0.02 -3.19 0.00 0.32 -0.92 107.32 104.97 2b81 s GLY 25 Ca 0.15 -1.27 0.03 0.00 0.00 0.00 0.00 44.72 43.64 2b81 s GLY 25 CO 0.05 -1.86 -0.10 0.54 0.00 0.00 0.00 173.10 171.72 2b81 s VAL 26 N -3.19 0.80 -0.25 1.40 0.11 -0.30 -0.95 120.40 118.02 2b81 s VAL 26 Ca 0.24 -0.71 -0.12 0.00 -2.93 0.00 0.00 61.98 58.46 2b81 s VAL 26 Cb 0.03 -0.72 -0.05 0.00 -1.53 0.00 0.00 36.38 34.11 2b81 s VAL 26 CO 0.14 0.02 0.23 -2.28 -3.33 0.00 0.00 175.10 169.88 2b81 s HIS 27 N -0.63 3.29 0.35 1.54 2.46 0.14 -1.22 115.29 121.21 2b81 s HIS 27 Ca 0.00 0.27 -0.27 0.00 0.47 0.00 0.00 55.06 55.53 2b81 s HIS 27 Cb -0.06 -2.38 -0.09 0.00 -0.13 0.00 0.00 32.58 29.92 2b81 s HIS 27 CO 0.00 -0.05 1.19 0.42 -2.47 0.00 0.00 174.74 173.84 2b81 s ILE 28 N 1.43 3.10 0.27 0.89 -1.09 -0.33 -3.55 121.20 121.92 2b81 s ILE 28 Ca 0.10 1.02 -0.29 0.00 -2.23 0.00 0.00 60.65 59.25 2b81 s ILE 28 Cb -0.15 -3.62 -0.10 0.00 -1.58 0.00 0.00 42.46 37.02 2b81 s ILE 28 CO 0.08 0.18 1.33 -2.84 -1.23 0.00 0.00 174.94 172.45 2b81 s PRO 29 N -1.95 4.36 -1.19 2.79 0.02 -1.26 -4.79 135.00 132.98 2b81 s PRO 29 Ca 0.52 2.17 -0.16 0.00 0.02 0.00 0.00 61.00 63.54 2b81 s PRO 29 Cb -0.34 -3.12 0.12 0.00 0.02 0.00 0.00 34.50 31.19 2b81 s PRO 29 CO 0.43 -0.24 1.50 0.42 -0.33 0.00 0.00 177.00 178.79 2b81 s ILE 30 N -0.51 4.60 -0.28 2.83 1.01 -1.23 -4.67 121.20 122.95 2b81 s ILE 30 Ca 0.53 -2.13 -0.23 0.00 0.00 0.00 0.00 60.65 58.83 2b81 s ILE 30 Cb -0.39 -5.00 0.12 0.00 0.01 0.00 0.00 42.46 37.20 2b81 s ILE 30 CO 0.46 -1.77 0.99 -0.70 0.00 0.00 0.00 174.94 173.92 2b81 s GLU 31 N 2.86 0.50 -0.79 2.79 2.12 -1.26 -4.80 118.70 120.11 2b81 s GLU 31 Ca 0.46 0.66 -0.05 0.00 0.36 0.00 0.00 54.97 56.40 2b81 s GLU 31 Cb -0.01 0.21 0.07 0.00 0.26 0.00 0.00 34.13 34.67 2b81 s GLU 31 CO 0.01 -0.07 2.65 0.27 -0.54 0.00 0.00 175.26 177.57 2b81 n ASN 32 N 2.66 7.08 0.26 -1.70 6.94 -1.25 -3.68 115.26 125.57 2b81 n ASN 32 Ca -0.14 -3.16 0.12 0.00 -0.02 0.00 0.00 54.58 51.39 2b81 n ASN 32 Cb 0.56 -1.29 0.70 0.00 -2.36 0.00 0.00 39.78 37.39 2b81 n ASN 32 CO 0.00 0.00 0.00 0.10 -1.03 0.00 0.00 177.26 176.33 2b81 h TYR 33 N 3.65 0.00 0.00 -2.53 -0.00 -1.78 -3.45 116.97 112.86 2b81 h TYR 33 Ca 0.51 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.24 2b81 h TYR 33 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.30 2b81 h TYR 33 CO 1.53 0.13 0.00 0.94 -0.00 0.00 0.00 178.16 180.76 2b81 n GLN 34 N -3.62 0.00 0.00 0.10 7.27 0.40 -1.74 117.38 119.79 2b81 n GLN 34 Ca -0.02 0.00 0.11 0.00 0.07 0.00 0.00 57.00 57.17 2b81 n GLN 34 Cb 0.26 0.00 0.12 0.00 2.41 0.00 0.00 30.24 33.03 2b81 n GLN 34 CO 0.00 0.00 0.00 1.19 0.07 0.00 0.00 177.06 178.32 2b81 n PHE 35 N 0.00 0.01 -3.99 3.69 3.72 -1.26 -4.82 117.46 114.81 2b81 n PHE 35 Ca 0.00 0.00 -0.23 0.00 -0.05 0.00 0.00 57.45 57.18 2b81 n PHE 35 Cb 0.00 -0.17 -0.06 0.00 -0.94 0.00 0.00 39.48 38.31 2b81 n PHE 35 CO 0.00 0.00 0.00 -1.01 -0.05 0.00 0.00 176.76 175.70 2b81 s HIS 36 N -3.00 2.73 0.27 1.38 3.76 -0.71 -4.81 115.29 114.91 2b81 s HIS 36 Ca 0.10 -0.40 -0.30 0.00 -0.15 0.00 0.00 55.06 54.31 2b81 s HIS 36 Cb 0.17 -1.77 -0.10 0.00 1.11 0.00 0.00 32.58 31.99 2b81 s HIS 36 CO 0.76 0.24 1.42 0.00 -0.85 0.00 0.00 174.74 176.31 2b81 s ALA 37 N -2.43 3.60 0.55 -1.40 0.00 -1.26 -4.62 121.76 116.21 2b81 s ALA 37 Ca 0.40 1.34 -0.20 0.00 0.00 0.00 0.00 51.96 53.50 2b81 s ALA 37 Cb -0.02 -3.55 -0.05 0.00 0.00 0.00 0.00 23.12 19.50 2b81 s ALA 37 CO 0.24 -0.75 1.19 -1.25 0.00 0.00 0.00 175.76 175.19 2b81 s PRO 38 N -0.71 3.22 0.00 0.00 0.04 -1.26 -5.00 135.00 131.28 2b81 s PRO 38 Ca 0.57 1.79 0.00 0.00 0.04 0.00 0.00 61.00 63.41 2b81 s PRO 38 Cb -0.42 -2.05 0.00 0.00 0.04 0.00 0.00 34.50 32.07 2b81 s PRO 38 CO 0.46 -1.00 0.00 0.25 0.04 0.00 0.00 177.00 176.75 2b81 n THR 39 N -1.29 0.00 0.00 1.26 -2.24 -1.26 -5.08 114.28 105.67 2b81 n THR 39 Ca 0.12 0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.90 2b81 n THR 39 Cb 0.49 -0.04 0.00 0.00 -2.10 0.00 0.00 70.33 68.68 2b81 n THR 39 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2b81 n GLU 41 N 0.00 0.00 -1.20 -0.78 1.02 -1.26 -5.13 120.64 113.30 2b81 n GLU 41 Ca 0.00 0.00 -0.07 0.00 -0.02 0.00 0.00 57.16 57.07 2b81 n GLU 41 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.39 2b81 n GLU 41 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2b81 n LYS 42 N -1.02 -1.09 -0.21 3.49 5.02 -1.26 -4.89 118.16 118.20 2b81 n LYS 42 Ca 0.00 0.65 -0.06 0.00 -2.02 0.00 0.00 58.31 56.88 2b81 n LYS 42 Cb 0.00 -4.66 0.10 0.00 -0.02 0.00 0.00 35.03 30.45 2b81 n LYS 42 CO 0.00 0.00 0.00 1.96 -0.52 0.00 0.00 177.40 178.84 2b81 h GLN 43 N 0.18 1.02 -0.19 1.97 1.08 -1.99 -1.45 115.11 115.74 2b81 h GLN 43 Ca -0.14 -0.24 -0.02 0.00 -1.45 0.00 0.00 58.65 56.80 2b81 h GLN 43 Cb 0.75 -0.14 -0.01 0.00 -0.05 0.00 0.00 27.48 28.04 2b81 h GLN 43 CO 0.20 0.92 0.05 0.28 -0.95 0.00 0.00 178.83 179.33 2b81 h VAL 44 N 0.97 1.20 0.00 -0.54 2.07 -1.99 -0.08 116.25 117.89 2b81 h VAL 44 Ca 0.20 -0.64 0.00 0.00 0.82 0.00 0.00 66.70 67.09 2b81 h VAL 44 Cb 0.36 1.27 0.00 0.00 -1.52 0.00 0.00 31.29 31.40 2b81 h VAL 44 CO 0.00 0.20 0.00 -1.84 0.02 0.00 0.00 177.57 175.95 2b81 n GLU 45 N -4.79 0.17 -0.02 1.57 0.28 -1.08 -1.36 120.64 115.41 2b81 n GLU 45 Ca -0.04 0.32 -0.13 0.00 -0.16 0.00 0.00 57.16 57.15 2b81 n GLU 45 Cb 0.16 -1.78 -0.14 0.00 1.43 0.00 0.00 31.44 31.11 2b81 n GLU 45 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 2b81 n LEU 46 N -2.10 1.44 0.04 -1.84 4.77 -0.57 -3.24 117.00 115.50 2b81 n LEU 46 Ca 0.04 0.31 -0.08 0.00 -0.03 0.00 0.00 56.01 56.24 2b81 n LEU 46 Cb 0.28 -0.25 0.07 0.00 -2.33 0.00 0.00 43.42 41.19 2b81 n LEU 46 CO 0.22 0.56 0.44 0.58 -1.33 0.00 0.00 177.39 177.86 2b81 h VAL 47 N 0.02 1.36 -0.46 4.08 2.07 -0.72 -0.04 116.25 122.55 2b81 h VAL 47 Ca -0.36 -1.94 -0.07 0.00 0.82 0.00 0.00 66.70 65.15 2b81 h VAL 47 Cb 2.03 1.94 -0.02 0.00 -1.52 0.00 0.00 31.29 33.72 2b81 h VAL 47 CO 0.07 0.59 0.01 1.56 0.02 0.00 0.00 177.57 179.82 2b81 h GLN 48 N 0.31 0.81 -0.44 1.57 4.20 -1.38 -1.09 115.11 119.09 2b81 h GLN 48 Ca -0.01 -0.25 -0.01 0.00 0.06 0.00 0.00 58.65 58.44 2b81 h GLN 48 Cb 1.16 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.84 2b81 h GLN 48 CO 0.11 0.86 0.22 0.87 -0.67 0.00 0.00 178.83 180.22 2b81 h LYS 49 N 0.66 0.62 -0.81 1.46 1.57 -1.50 -0.90 116.57 117.67 2b81 h LYS 49 Ca 0.13 -0.08 0.08 0.00 -1.87 0.00 0.00 60.65 58.91 2b81 h LYS 49 Cb 0.49 -0.12 -0.07 0.00 0.08 0.00 0.00 32.23 32.62 2b81 h LYS 49 CO 0.02 0.52 0.47 0.00 -0.57 0.00 0.00 179.45 179.89 2b81 h ALA 50 N 1.07 1.13 -0.16 3.86 0.00 -0.82 -0.29 119.26 124.05 2b81 h ALA 50 Ca 0.15 0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.11 2b81 h ALA 50 Cb 0.09 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 2b81 h ALA 50 CO -0.02 0.12 0.02 1.49 0.00 0.00 0.00 179.25 180.86 2b81 h GLU 51 N 0.81 0.08 -0.99 0.00 4.81 -0.57 -2.45 114.58 116.26 2b81 h GLU 51 Ca 0.38 -0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.62 2b81 h GLU 51 Cb 0.30 -0.02 -0.05 0.00 0.63 0.00 0.00 28.75 29.61 2b81 h GLU 51 CO -0.22 0.05 0.66 -0.56 -0.73 0.00 0.00 179.01 178.21 2b81 h GLN 52 N 0.08 1.29 0.00 1.92 3.07 -0.34 -2.38 115.11 118.76 2b81 h GLN 52 Ca 0.07 -0.08 0.00 0.00 0.09 0.00 0.00 58.65 58.74 2b81 h GLN 52 Cb 0.08 -0.29 0.00 0.00 0.08 0.00 0.00 27.48 27.34 2b81 h GLN 52 CO -0.11 0.85 0.00 0.66 0.09 0.00 0.00 178.83 180.32 2b81 n TYR 53 N -4.39 0.75 -0.10 0.06 0.53 -0.20 -4.91 117.16 108.90 2b81 n TYR 53 Ca 0.12 0.26 0.00 0.00 -1.02 0.00 0.00 57.90 57.27 2b81 n TYR 53 Cb 0.03 -0.93 0.00 0.00 -1.03 0.00 0.00 39.34 37.41 2b81 n TYR 53 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 2b81 n GLY 54 N 0.46 0.95 3.72 2.72 0.00 -0.89 -4.86 105.19 107.28 2b81 n GLY 54 Ca 0.03 -0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 2b81 n GLY 54 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2b81 n PHE 55 N -2.10 2.33 0.63 1.61 3.01 -0.95 -3.28 117.46 118.71 2b81 n PHE 55 Ca 0.00 0.50 0.09 0.00 1.01 0.00 0.00 57.45 59.05 2b81 n PHE 55 Cb 0.00 -2.41 -0.12 0.00 -0.01 0.00 0.00 39.48 36.94 2b81 n PHE 55 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 2b81 n THR 56 N -0.01 0.00 -3.78 4.37 -2.24 -0.09 -4.67 114.28 107.85 2b81 n THR 56 Ca 0.05 -0.17 -0.13 0.00 -2.27 0.00 0.00 64.05 61.54 2b81 n THR 56 Cb 0.39 0.72 -0.10 0.00 -2.10 0.00 0.00 70.33 69.24 2b81 n THR 56 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2b81 s GLY 57 N -3.22 -0.15 -0.13 3.38 0.00 -1.26 -1.67 107.32 104.27 2b81 s GLY 57 Ca 0.03 0.48 0.03 0.00 0.00 0.00 0.00 44.72 45.26 2b81 s GLY 57 CO 0.79 0.32 -0.22 0.14 0.00 0.00 0.00 173.10 174.13 2b81 s VAL 58 N -0.69 2.02 -0.07 1.40 1.01 0.12 -1.15 120.40 123.03 2b81 s VAL 58 Ca -0.08 -0.96 0.03 0.00 0.00 0.00 0.00 61.98 60.97 2b81 s VAL 58 Cb -0.04 -1.78 -0.02 0.00 0.00 0.00 0.00 36.38 34.54 2b81 s VAL 58 CO 0.02 0.54 -0.17 0.26 0.00 0.00 0.00 175.10 175.75 2b81 s TRP 59 N 0.72 2.65 0.34 5.22 0.52 -0.36 -0.81 118.94 127.22 2b81 s TRP 59 Ca -0.10 -0.47 0.09 0.00 0.02 0.00 0.00 56.10 55.65 2b81 s TRP 59 Cb -0.16 -1.68 -0.06 0.00 -1.15 0.00 0.00 33.47 30.42 2b81 s TRP 59 CO 0.01 -0.05 -0.06 -0.51 0.02 0.00 0.00 176.95 176.35 2b81 s LEU 60 N -0.25 2.81 0.30 2.99 1.02 -0.70 -1.19 118.68 123.66 2b81 s LEU 60 Ca 0.01 -1.14 0.10 0.00 0.02 0.00 0.00 54.13 53.12 2b81 s LEU 60 Cb -0.13 -1.11 -0.05 0.00 0.02 0.00 0.00 46.19 44.92 2b81 s LEU 60 CO 0.03 -0.22 -0.05 -0.13 0.02 0.00 0.00 176.35 176.00 2b81 s ARG 61 N -3.64 2.04 -0.63 1.70 0.52 -1.26 0.04 118.95 117.72 2b81 s ARG 61 Ca 0.33 -1.64 -0.03 0.00 -0.52 0.00 0.00 55.73 53.87 2b81 s ARG 61 Cb 0.02 -1.96 0.16 0.00 0.52 0.00 0.00 34.95 33.69 2b81 s ARG 61 CO 0.17 0.26 0.45 0.34 0.02 0.00 0.00 175.30 176.54 2b81 s ASP 62 N -3.65 5.25 -0.03 0.23 3.68 -1.26 -4.72 116.67 116.17 2b81 s ASP 62 Ca 0.32 -2.87 -0.01 0.00 2.13 0.00 0.00 52.55 52.13 2b81 s ASP 62 Cb -0.03 -1.86 0.03 0.00 -1.45 0.00 0.00 42.92 39.61 2b81 s ASP 62 CO 0.18 -0.37 0.03 -0.69 0.13 0.00 0.00 175.17 174.46 2b81 s VAL 63 N -0.08 -0.00 -0.14 1.11 1.01 -1.26 -4.90 120.40 116.13 2b81 s VAL 63 Ca 0.17 0.26 -0.10 0.00 0.00 0.00 0.00 61.98 62.31 2b81 s VAL 63 Cb -0.20 -0.17 -0.06 0.00 0.00 0.00 0.00 36.38 35.95 2b81 s VAL 63 CO -0.03 0.14 -0.03 -0.07 0.00 0.00 0.00 175.10 175.10 2b81 h LEU 64 N 7.73 0.00 -9.27 3.92 3.38 -1.96 -3.45 115.31 115.66 2b81 h LEU 64 Ca -0.32 -0.12 -0.68 0.00 0.09 0.00 0.00 57.88 56.85 2b81 h LEU 64 Cb 1.12 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 41.72 2b81 h LEU 64 CO 0.36 0.81 -0.65 -0.76 0.09 0.00 0.00 178.44 178.28 2b81 s LEU 65 N -8.25 3.44 -0.11 1.67 1.43 -1.26 -5.07 118.68 110.53 2b81 s LEU 65 Ca -0.13 0.04 -0.29 0.00 -1.03 0.00 0.00 54.13 52.71 2b81 s LEU 65 Cb 0.02 -1.85 -0.04 0.00 0.03 0.00 0.00 46.19 44.34 2b81 s LEU 65 CO 0.24 0.34 1.58 -1.58 0.23 0.00 0.00 176.35 177.15 2b81 s GLN 66 N -1.12 4.11 -0.26 1.70 0.74 -1.26 -4.93 119.66 118.64 2b81 s GLN 66 Ca 0.15 1.99 0.02 0.00 0.05 0.00 0.00 55.36 57.58 2b81 s GLN 66 Cb -0.11 -3.96 0.06 0.00 1.10 0.00 0.00 33.01 30.11 2b81 s GLN 66 CO 0.05 -0.91 -0.07 0.34 -0.55 0.00 0.00 175.29 174.15 2b81 s ASP 67 N 3.28 4.22 0.62 6.67 3.68 -1.26 -5.00 116.67 128.88 2b81 s ASP 67 Ca 0.70 -1.38 0.32 0.00 2.13 0.00 0.00 52.55 54.32 2b81 s ASP 67 Cb -0.30 -1.39 1.79 0.00 -1.45 0.00 0.00 42.92 41.58 2b81 s ASP 67 CO 0.27 -0.23 2.10 -0.65 0.13 0.00 0.00 175.17 176.78 2b81 h PRO 68 N 7.84 0.00 0.00 4.34 0.11 -1.98 -0.67 132.00 141.64 2b81 h PRO 68 Ca -0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.94 2b81 h PRO 68 Cb 1.05 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.16 2b81 h PRO 68 CO 0.45 0.00 0.00 -0.44 -0.21 0.00 0.00 178.00 177.80 2b81 h ASP 69 N 0.00 0.00 0.53 -2.05 3.32 -2.02 -3.38 116.42 112.82 2b81 h ASP 69 Ca 0.06 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.06 2b81 h ASP 69 Cb 0.48 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.02 2b81 h ASP 69 CO -0.00 0.00 -1.50 0.33 -1.72 0.00 0.00 179.24 176.35 2b81 n PHE 70 N -2.58 0.57 -2.66 4.55 7.35 -0.26 -4.99 117.46 119.44 2b81 n PHE 70 Ca 0.04 0.17 -0.09 0.00 -0.76 0.00 0.00 57.45 56.81 2b81 n PHE 70 Cb 0.39 -0.81 0.02 0.00 0.35 0.00 0.00 39.48 39.42 2b81 n PHE 70 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2b81 n GLY 71 N 1.27 0.24 2.76 7.13 0.00 -1.26 -5.02 105.19 110.32 2b81 n GLY 71 Ca -0.05 -0.39 -0.30 0.00 0.00 0.00 0.00 46.02 45.29 2b81 n GLY 71 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2b81 s ASP 72 N -2.95 3.79 0.28 1.61 3.68 -1.26 -4.98 116.67 116.84 2b81 s ASP 72 Ca 0.15 -2.68 0.21 0.00 2.13 0.00 0.00 52.55 52.36 2b81 s ASP 72 Cb -0.07 -1.15 1.05 0.00 -1.45 0.00 0.00 42.92 41.30 2b81 s ASP 72 CO 0.19 -0.26 1.63 -0.81 0.13 0.00 0.00 175.17 176.04 2b81 n PRO 73 N 3.49 0.14 0.06 4.34 -0.04 -1.26 -1.88 135.00 139.85 2b81 n PRO 73 Ca 0.08 0.57 0.12 0.00 -0.04 0.00 0.00 63.50 64.23 2b81 n PRO 73 Cb 0.34 -1.90 0.15 0.00 -0.04 0.00 0.00 33.50 32.05 2b81 n PRO 73 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2b81 h ALA 74 N 2.07 0.56 -6.58 0.55 0.00 -1.92 -3.35 119.26 110.58 2b81 h ALA 74 Ca 0.00 0.00 -0.52 0.00 0.00 0.00 0.00 54.91 54.39 2b81 h ALA 74 Cb 0.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2b81 h ALA 74 CO 0.00 0.00 -0.96 2.41 0.00 0.00 0.00 179.25 180.70 2b81 n THR 75 N -2.14 -3.92 0.00 0.00 -1.04 -0.79 -1.33 114.28 105.07 2b81 n THR 75 Ca 0.03 -0.72 0.00 0.00 -2.04 0.00 0.00 64.05 61.32 2b81 n THR 75 Cb 0.45 -3.08 0.00 0.00 -1.82 0.00 0.00 70.33 65.87 2b81 n THR 75 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2b81 n GLY 76 N -1.95 2.05 2.11 3.41 0.00 -1.26 -2.46 105.19 107.09 2b81 n GLY 76 Ca -0.16 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.83 2b81 n GLY 76 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b81 n GLN 77 N 0.00 0.85 0.00 1.61 0.00 -1.20 -4.58 117.38 114.06 2b81 n GLN 77 Ca 0.00 -2.33 0.00 0.00 0.00 0.00 0.00 57.00 54.67 2b81 n GLN 77 Cb 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 30.24 29.76 2b81 n GLN 77 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.06 176.17 2b81 n ILE 78 N -0.27 0.00 -1.94 -0.39 2.08 -0.44 -4.86 119.36 113.52 2b81 n ILE 78 Ca -0.01 0.00 -0.37 0.00 0.56 0.00 0.00 62.75 62.92 2b81 n ILE 78 Cb 0.92 0.00 0.03 0.00 -0.75 0.00 0.00 39.64 39.84 2b81 n ILE 78 CO 0.00 0.00 0.00 -0.31 0.56 0.00 0.00 176.55 176.80 2b81 s TYR 79 N 0.00 2.43 0.00 1.39 4.12 -1.26 -5.04 117.35 118.99 2b81 s TYR 79 Ca 0.00 1.45 0.00 0.00 0.02 0.00 0.00 57.07 58.54 2b81 s TYR 79 Cb 0.00 -3.62 0.00 0.00 -1.52 0.00 0.00 41.96 36.82 2b81 s TYR 79 CO 0.00 -2.42 0.00 -3.47 0.02 0.00 0.00 175.55 169.68 2b81 n ASP 80 N -1.10 0.00 0.00 2.29 2.03 -1.26 -4.88 116.55 113.63 2b81 n ASP 80 Ca 0.11 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.42 2b81 n ASP 80 Cb 0.47 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.87 2b81 n ASP 80 CO 0.00 0.00 0.00 -0.38 -1.92 0.00 0.00 177.20 174.90 2b81 n ILE 83 N 0.00 0.00 0.06 5.18 2.08 -1.26 -4.47 119.36 120.96 2b81 n ILE 83 Ca 0.00 0.00 -0.15 0.00 0.56 0.00 0.00 62.75 63.16 2b81 n ILE 83 Cb 0.00 0.00 -0.06 0.00 -0.75 0.00 0.00 39.64 38.83 2b81 n ILE 83 CO 0.00 0.00 0.00 0.22 0.56 0.00 0.00 176.55 177.33 2b81 h TYR 84 N 0.00 0.68 -0.34 1.39 3.20 -1.99 -1.77 116.97 118.13 2b81 h TYR 84 Ca 0.00 -0.37 0.05 0.00 3.14 0.00 0.00 58.73 61.54 2b81 h TYR 84 Cb 0.00 -0.08 -0.04 0.00 1.54 0.00 0.00 36.73 38.15 2b81 h TYR 84 CO 0.00 1.20 0.08 1.25 -1.64 0.00 0.00 178.16 179.05 2b81 h LEU 85 N 0.25 0.04 -0.33 2.82 6.46 -1.98 -1.30 115.31 121.26 2b81 h LEU 85 Ca -0.09 0.05 0.06 0.00 -0.12 0.00 0.00 57.88 57.78 2b81 h LEU 85 Cb 1.61 0.06 -0.05 0.00 -0.73 0.00 0.00 40.66 41.55 2b81 h LEU 85 CO 0.17 0.06 0.00 0.74 -0.62 0.00 0.00 178.44 178.79 2b81 h THR 86 N 0.20 0.76 0.05 1.05 2.02 -1.88 -0.17 112.91 114.94 2b81 h THR 86 Ca 0.16 -0.03 0.01 0.00 0.77 0.00 0.00 66.41 67.32 2b81 h THR 86 Cb 0.17 0.65 -0.02 0.00 -1.74 0.00 0.00 68.15 67.21 2b81 h THR 86 CO -0.20 0.02 -0.12 0.22 0.37 0.00 0.00 175.52 175.81 2b81 h TYR 87 N 0.10 -0.31 -0.46 3.16 3.20 -0.92 -1.22 116.97 120.52 2b81 h TYR 87 Ca 0.16 0.01 -0.14 0.00 3.14 0.00 0.00 58.73 61.90 2b81 h TYR 87 Cb 0.22 0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.61 2b81 h TYR 87 CO -0.24 -0.18 -0.25 -0.07 -1.64 0.00 0.00 178.16 175.78 2b81 h LEU 88 N -0.23 1.00 -1.42 2.82 3.38 -0.99 -2.51 115.31 117.35 2b81 h LEU 88 Ca 0.03 -0.39 0.01 0.00 0.09 0.00 0.00 57.88 57.62 2b81 h LEU 88 Cb 0.26 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 2b81 h LEU 88 CO -0.08 1.18 0.40 0.00 0.09 0.00 0.00 178.44 180.03 2b81 h ALA 89 N 0.88 1.60 0.00 1.53 0.00 -0.90 -1.85 119.26 120.52 2b81 h ALA 89 Ca 0.10 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2b81 h ALA 89 Cb 0.82 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.38 2b81 h ALA 89 CO 0.07 0.37 0.00 -1.13 0.00 0.00 0.00 179.25 178.56 2b81 n SER 90 N -4.45 0.10 -0.88 0.00 3.41 -0.47 -2.51 113.62 108.82 2b81 n SER 90 Ca 0.06 0.52 0.11 0.00 -0.26 0.00 0.00 58.87 59.30 2b81 n SER 90 Cb 0.06 -0.54 0.11 0.00 -0.26 0.00 0.00 64.21 63.57 2b81 n SER 90 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2b81 n LYS 91 N -1.61 2.01 -4.19 4.33 4.01 -0.70 -5.01 118.16 117.00 2b81 n LYS 91 Ca 0.04 -1.83 -0.11 0.00 -0.51 0.00 0.00 58.31 55.89 2b81 n LYS 91 Cb 0.21 -1.41 -0.10 0.00 -0.51 0.00 0.00 35.03 33.22 2b81 n LYS 91 CO 0.00 0.00 0.00 0.95 -1.11 0.00 0.00 177.40 177.24 2b81 s THR 92 N -1.68 0.41 -0.09 -0.18 -4.23 -1.04 -4.90 115.64 103.93 2b81 s THR 92 Ca 0.27 -1.94 0.12 0.00 -1.18 0.00 0.00 61.69 58.96 2b81 s THR 92 Cb 0.18 -2.02 -0.18 0.00 1.34 0.00 0.00 72.50 71.82 2b81 s THR 92 CO 0.27 -0.53 0.13 -0.62 -0.54 0.00 0.00 174.62 173.33 2b81 n GLU 93 N -0.15 1.41 0.00 3.99 -0.58 -1.26 -4.91 120.64 119.15 2b81 n GLU 93 Ca -0.07 -0.05 0.00 0.00 -0.42 0.00 0.00 57.16 56.62 2b81 n GLU 93 Cb 0.63 -1.33 0.00 0.00 -0.57 0.00 0.00 31.44 30.17 2b81 n GLU 93 CO 0.00 0.00 0.00 0.36 -0.48 0.00 0.00 177.13 177.01 2b81 n LYS 94 N -2.31 0.56 -1.67 3.49 2.85 -1.26 -5.11 118.16 114.71 2b81 n LYS 94 Ca -0.15 0.00 -0.43 0.00 -1.05 0.00 0.00 58.31 56.69 2b81 n LYS 94 Cb 0.73 -0.25 -0.00 0.00 -0.65 0.00 0.00 35.03 34.86 2b81 n LYS 94 CO 0.00 0.00 0.00 1.51 -0.05 0.00 0.00 177.40 178.86 2b81 n ILE 95 N -0.41 2.12 -2.74 0.58 3.06 -1.26 -4.91 119.36 115.81 2b81 n ILE 95 Ca 0.00 -0.50 -0.37 0.00 -2.50 0.00 0.00 62.75 59.38 2b81 n ILE 95 Cb 0.00 -1.43 -0.06 0.00 0.54 0.00 0.00 39.64 38.69 2b81 n ILE 95 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2b81 s ALA 96 N -1.12 3.19 -0.11 1.51 0.00 -0.67 -4.93 121.76 119.64 2b81 s ALA 96 Ca 0.57 0.56 -0.00 0.00 0.00 0.00 0.00 51.96 53.09 2b81 s ALA 96 Cb -0.58 -3.20 -0.02 0.00 0.00 0.00 0.00 23.12 19.31 2b81 s ALA 96 CO 0.61 0.10 -0.08 -0.06 0.00 0.00 0.00 175.76 176.33 2b81 s PHE 97 N -1.62 2.91 0.03 0.00 0.40 0.57 0.11 117.98 120.38 2b81 s PHE 97 Ca 0.51 -0.26 0.04 0.00 -0.60 0.00 0.00 56.93 56.63 2b81 s PHE 97 Cb -0.19 -1.81 -0.02 0.00 0.51 0.00 0.00 43.02 41.51 2b81 s PHE 97 CO 0.25 0.07 -0.11 0.20 0.70 0.00 0.00 175.22 176.33 2b81 s GLY 98 N -0.17 0.64 -0.21 4.36 0.00 0.00 -4.20 107.32 107.74 2b81 s GLY 98 Ca 0.02 -0.71 -0.13 0.00 0.00 0.00 0.00 44.72 43.90 2b81 s GLY 98 CO 0.03 -0.69 0.26 -0.51 0.00 0.00 0.00 173.10 172.19 2b81 s THR 99 N -0.81 5.30 -0.61 0.90 -4.23 -1.26 -1.72 115.64 113.20 2b81 s THR 99 Ca -0.00 0.42 0.05 0.00 -1.18 0.00 0.00 61.69 60.97 2b81 s THR 99 Cb -0.07 -3.60 0.19 0.00 1.34 0.00 0.00 72.50 70.36 2b81 s THR 99 CO 0.01 0.32 0.53 -0.24 -0.54 0.00 0.00 174.62 174.69 2b81 n SER 100 N 4.24 2.32 -4.11 3.99 2.88 0.11 -1.66 113.62 121.38 2b81 n SER 100 Ca -0.12 -3.07 -0.11 0.00 -1.33 0.00 0.00 58.87 54.24 2b81 n SER 100 Cb 0.52 -0.69 -0.11 0.00 -0.75 0.00 0.00 64.21 63.18 2b81 n SER 100 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2b81 s ALA 101 N -1.39 0.70 0.02 -1.46 0.00 -1.26 -4.31 121.76 114.05 2b81 s ALA 101 Ca 0.31 -1.08 -0.30 0.00 0.00 0.00 0.00 51.96 50.89 2b81 s ALA 101 Cb 0.03 0.14 -0.08 0.00 0.00 0.00 0.00 23.12 23.22 2b81 s ALA 101 CO -0.14 -0.18 1.78 0.99 0.00 0.00 0.00 175.76 178.21 2b81 s THR 102 N -2.77 3.20 -0.68 0.00 2.01 0.20 -4.08 115.64 113.50 2b81 s THR 102 Ca 0.02 0.37 -0.23 0.00 0.31 0.00 0.00 61.69 62.15 2b81 s THR 102 Cb -0.00 -3.24 0.06 0.00 0.01 0.00 0.00 72.50 69.33 2b81 s THR 102 CO -0.04 -0.02 1.04 -0.69 -0.69 0.00 0.00 174.62 174.22 2b81 s VAL 103 N 3.82 4.19 -0.78 3.82 1.01 -1.26 -1.04 120.40 130.15 2b81 s VAL 103 Ca 0.79 -0.21 0.14 0.00 0.00 0.00 0.00 61.98 62.70 2b81 s VAL 103 Cb -0.39 -4.74 0.13 0.00 0.00 0.00 0.00 36.38 31.38 2b81 s VAL 103 CO 0.35 -1.55 1.44 0.18 0.00 0.00 0.00 175.10 175.52 2b81 n LEU 104 N 8.07 0.23 -0.90 3.92 4.77 0.16 -1.56 117.00 131.69 2b81 n LEU 104 Ca -0.02 0.57 0.12 0.00 -0.03 0.00 0.00 56.01 56.66 2b81 n LEU 104 Cb 0.46 -0.56 0.15 0.00 -2.33 0.00 0.00 43.42 41.15 2b81 n LEU 104 CO 0.65 -0.46 0.66 -1.54 -1.33 0.00 0.00 177.39 175.37 2b81 n SER 105 N -1.77 2.82 0.00 -1.43 3.41 -1.26 -4.34 113.62 111.06 2b81 n SER 105 Ca 0.02 -1.94 0.00 0.00 -0.26 0.00 0.00 58.87 56.69 2b81 n SER 105 Cb 0.13 -0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.08 2b81 n SER 105 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2b81 n LEU 106 N 1.21 0.00 -4.29 1.04 4.32 -0.78 -4.97 117.00 113.54 2b81 n LEU 106 Ca 0.15 0.00 -0.33 0.00 -0.02 0.00 0.00 56.01 55.80 2b81 n LEU 106 Cb 0.57 0.00 -0.15 0.00 -1.62 0.00 0.00 43.42 42.22 2b81 n LEU 106 CO 0.15 0.00 -0.47 -0.13 -1.22 0.00 0.00 177.39 175.72 2b81 s ARG 107 N -1.74 3.26 0.34 3.23 0.52 -0.60 -5.08 118.95 118.88 2b81 s ARG 107 Ca 0.00 -0.73 -0.29 0.00 -0.52 0.00 0.00 55.73 54.19 2b81 s ARG 107 Cb 0.00 -2.64 -0.11 0.00 0.52 0.00 0.00 34.95 32.72 2b81 s ARG 107 CO 0.00 0.05 1.51 -1.58 0.02 0.00 0.00 175.30 175.30 2b81 s HIS 108 N 0.75 2.70 0.46 -0.53 5.65 -1.26 -4.64 115.29 118.42 2b81 s HIS 108 Ca -0.06 1.05 0.15 0.00 0.25 0.00 0.00 55.06 56.45 2b81 s HIS 108 Cb -0.15 -4.00 1.11 0.00 -1.18 0.00 0.00 32.58 28.35 2b81 s HIS 108 CO 0.01 -3.09 2.03 -1.00 -0.65 0.00 0.00 174.74 172.04 2b81 h PRO 109 N 3.76 0.27 -0.36 2.88 0.13 -1.87 -1.11 132.00 135.71 2b81 h PRO 109 Ca -0.49 -0.02 -0.09 0.00 -0.87 0.00 0.00 66.00 64.53 2b81 h PRO 109 Cb 1.23 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 32.29 2b81 h PRO 109 CO 0.70 0.18 -0.12 1.25 -0.23 0.00 0.00 178.00 179.78 2b81 h LEU 110 N 0.28 0.73 -1.09 1.56 5.85 -1.92 0.46 115.31 121.17 2b81 h LEU 110 Ca 0.19 -0.38 -0.06 0.00 0.84 0.00 0.00 57.88 58.47 2b81 h LEU 110 Cb 0.39 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.20 2b81 h LEU 110 CO -0.04 0.95 0.04 0.03 -0.34 0.00 0.00 178.44 179.08 2b81 h ARG 111 N 0.50 0.68 -0.05 1.25 3.08 -1.73 0.39 114.38 118.52 2b81 h ARG 111 Ca 0.09 -0.15 -0.00 0.00 0.07 0.00 0.00 59.98 59.98 2b81 h ARG 111 Cb 0.65 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.60 2b81 h ARG 111 CO 0.04 0.67 0.02 0.28 -1.07 0.00 0.00 179.97 179.91 2b81 h VAL 112 N 0.65 1.13 -0.10 2.04 2.07 -0.91 -0.52 116.25 120.61 2b81 h VAL 112 Ca 0.14 -0.40 0.02 0.00 0.82 0.00 0.00 66.70 67.28 2b81 h VAL 112 Cb 0.35 1.32 -0.02 0.00 -1.52 0.00 0.00 31.29 31.42 2b81 h VAL 112 CO 0.01 0.11 -0.01 0.00 0.02 0.00 0.00 177.57 177.70 2b81 h ALA 113 N 0.86 0.08 -0.62 1.67 0.00 -0.67 0.20 119.26 120.77 2b81 h ALA 113 Ca 0.02 0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.98 2b81 h ALA 113 Cb 0.16 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 2b81 h ALA 113 CO -0.00 -0.47 0.39 -0.22 0.00 0.00 0.00 179.25 178.95 2b81 h LYS 114 N 0.02 0.76 -0.04 0.00 1.63 -0.88 0.74 116.57 118.81 2b81 h LYS 114 Ca 0.05 -0.05 -0.26 0.00 -0.85 0.00 0.00 60.65 59.55 2b81 h LYS 114 Cb 0.06 -0.17 0.02 0.00 -0.60 0.00 0.00 32.23 31.54 2b81 h LYS 114 CO -0.09 0.51 -0.97 0.93 -3.45 0.00 0.00 179.45 176.37 2b81 h GLU 115 N 0.79 0.72 -0.22 1.90 5.08 -0.60 -1.63 114.58 120.62 2b81 h GLU 115 Ca 0.24 -0.72 -0.04 0.00 -1.00 0.00 0.00 59.36 57.84 2b81 h GLU 115 Cb -0.02 0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 2b81 h GLU 115 CO -0.08 1.31 -0.02 0.82 -1.00 0.00 0.00 179.01 180.03 2b81 h ILE 116 N 0.43 1.27 -0.81 3.13 1.08 -0.55 -1.90 117.51 120.16 2b81 h ILE 116 Ca -0.11 -0.94 0.05 0.00 -0.39 0.00 0.00 64.86 63.47 2b81 h ILE 116 Cb 1.62 1.44 -0.06 0.00 -3.07 0.00 0.00 36.82 36.76 2b81 h ILE 116 CO 0.19 0.29 0.50 0.00 -0.69 0.00 0.00 178.15 178.44 2b81 h ALA 117 N 0.78 1.10 -0.35 1.87 0.00 -0.87 0.70 119.26 122.48 2b81 h ALA 117 Ca 0.06 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.83 2b81 h ALA 117 Cb 0.44 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2b81 h ALA 117 CO 0.01 0.26 -0.31 0.00 0.00 0.00 0.00 179.25 179.22 2b81 h THR 118 N 0.94 1.28 -0.84 0.00 1.03 -1.19 -1.19 112.91 112.93 2b81 h THR 118 Ca 0.34 -1.46 0.02 0.00 -0.01 0.00 0.00 66.41 65.31 2b81 h THR 118 Cb 0.12 1.34 -0.05 0.00 -1.07 0.00 0.00 68.15 68.49 2b81 h THR 118 CO -0.15 0.48 0.55 -0.07 -0.01 0.00 0.00 175.52 176.31 2b81 h LEU 119 N 0.65 0.92 -0.99 0.00 3.38 -0.76 0.11 115.31 118.62 2b81 h LEU 119 Ca 0.07 -0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.94 2b81 h LEU 119 Cb 0.84 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 2b81 h LEU 119 CO 0.07 0.65 -0.45 -0.78 0.09 0.00 0.00 178.44 178.02 2b81 h ASP 120 N 1.09 0.00 -0.19 -0.43 3.58 -0.68 0.15 116.42 119.94 2b81 h ASP 120 Ca 0.33 0.00 -0.17 0.00 0.42 0.00 0.00 57.03 57.61 2b81 h ASP 120 Cb -0.04 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.01 2b81 h ASP 120 CO -0.10 0.45 -0.55 1.56 -2.88 0.00 0.00 179.24 177.72 2b81 h GLN 121 N 0.00 0.71 -0.05 0.28 1.08 -0.52 -2.60 115.11 114.01 2b81 h GLN 121 Ca -0.00 -0.51 -0.14 0.00 -1.45 0.00 0.00 58.65 56.55 2b81 h GLN 121 Cb 0.89 0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 28.39 2b81 h GLN 121 CO 0.06 1.13 -0.59 -0.07 -0.95 0.00 0.00 178.83 178.41 2b81 h LEU 122 N 0.41 0.18 -6.09 1.46 3.38 -0.55 -3.38 115.31 110.73 2b81 h LEU 122 Ca -0.02 -0.10 -0.57 0.00 0.09 0.00 0.00 57.88 57.28 2b81 h LEU 122 Cb 1.17 -0.05 -0.39 0.00 0.09 0.00 0.00 40.66 41.47 2b81 h LEU 122 CO 0.12 0.73 -1.00 0.49 0.09 0.00 0.00 178.44 178.87 2b81 n PHE 123 N -3.87 0.31 -1.77 1.13 3.01 0.51 -5.09 117.46 111.69 2b81 n PHE 123 Ca -0.02 -3.65 -0.42 0.00 1.01 0.00 0.00 57.45 54.38 2b81 n PHE 123 Cb 0.60 -0.33 -0.02 0.00 -0.01 0.00 0.00 39.48 39.72 2b81 n PHE 123 CO 0.00 0.00 0.00 -2.14 1.01 0.00 0.00 176.76 175.63 2b81 s PRO 124 N -1.28 4.12 -1.29 -1.08 0.02 -0.98 -2.37 135.00 132.13 2b81 s PRO 124 Ca 0.35 2.59 0.00 0.00 0.02 0.00 0.00 61.00 63.96 2b81 s PRO 124 Cb 0.15 -3.03 0.00 0.00 0.02 0.00 0.00 34.50 31.64 2b81 s PRO 124 CO -0.10 -0.66 0.00 0.39 -0.33 0.00 0.00 177.00 176.30 2b81 n GLU 125 N 2.50 -0.99 -0.04 5.54 1.02 -1.26 -4.88 120.64 122.53 2b81 n GLU 125 Ca 0.10 0.82 0.04 0.00 -0.02 0.00 0.00 57.16 58.09 2b81 n GLU 125 Cb 0.37 -4.97 0.05 0.00 -0.02 0.00 0.00 31.44 26.87 2b81 n GLU 125 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2b81 n ARG 126 N -2.46 2.16 -4.17 3.49 1.74 -1.00 -0.43 116.66 116.00 2b81 n ARG 126 Ca -0.15 -1.83 -0.28 0.00 -0.77 0.00 0.00 57.85 54.82 2b81 n ARG 126 Cb 0.52 -1.15 -0.04 0.00 -1.02 0.00 0.00 32.46 30.78 2b81 n ARG 126 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 2b81 n ILE 127 N -0.80 0.00 -3.14 0.55 2.08 -1.26 -0.32 119.36 116.47 2b81 n ILE 127 Ca 0.06 -2.13 0.03 0.00 0.56 0.00 0.00 62.75 61.28 2b81 n ILE 127 Cb 0.41 0.27 -0.00 0.00 -0.75 0.00 0.00 39.64 39.57 2b81 n ILE 127 CO 0.00 0.00 0.00 -0.22 0.56 0.00 0.00 176.55 176.89 2b81 s LEU 129 N 0.00 -1.32 -0.04 1.39 2.96 -0.11 -4.31 118.68 117.26 2b81 s LEU 129 Ca 0.10 -0.10 -0.25 0.00 -0.22 0.00 0.00 54.13 53.66 2b81 s LEU 129 Cb -0.01 1.78 -0.04 0.00 0.50 0.00 0.00 46.19 48.42 2b81 s LEU 129 CO 0.06 -0.21 0.76 -0.83 -1.32 0.00 0.00 176.35 174.81 2b81 s GLY 130 N 2.55 2.70 0.04 7.98 0.00 -0.67 -0.67 107.32 119.25 2b81 s GLY 130 Ca 0.15 0.23 0.08 0.00 0.00 0.00 0.00 44.72 45.18 2b81 s GLY 130 CO -0.20 1.27 -0.23 -1.34 0.00 0.00 0.00 173.10 172.60 2b81 s VAL 131 N 0.73 1.86 0.26 1.40 -7.23 -0.33 0.58 120.40 117.67 2b81 s VAL 131 Ca 0.41 -1.25 -0.02 0.00 -1.81 0.00 0.00 61.98 59.31 2b81 s VAL 131 Cb -0.19 -1.60 -0.02 0.00 0.56 0.00 0.00 36.38 35.13 2b81 s VAL 131 CO 0.21 0.30 0.29 -0.94 -0.31 0.00 0.00 175.10 174.64 2b81 s SER 132 N -1.13 0.55 0.01 4.85 1.04 -0.21 -1.07 113.70 117.75 2b81 s SER 132 Ca 0.09 -1.40 0.25 0.00 0.48 0.00 0.00 55.95 55.37 2b81 s SER 132 Cb -0.09 0.51 0.45 0.00 0.10 0.00 0.00 66.02 66.98 2b81 s SER 132 CO 0.02 -1.03 1.37 -1.54 0.98 0.00 0.00 173.24 173.04 2b81 n SER 133 N -0.76 0.54 0.00 7.02 3.41 -1.26 -0.66 113.62 121.90 2b81 n SER 133 Ca 0.02 -0.23 0.00 0.00 -0.26 0.00 0.00 58.87 58.40 2b81 n SER 133 Cb 0.64 0.29 0.00 0.00 -0.26 0.00 0.00 64.21 64.88 2b81 n SER 133 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2b81 n GLY 134 N 1.48 0.34 0.00 5.00 0.00 -1.26 -4.54 105.19 106.21 2b81 n GLY 134 Ca 0.05 -1.69 0.00 0.00 0.00 0.00 0.00 46.02 44.38 2b81 n GLY 134 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2b81 n ASP 135 N -0.73 0.00 -4.57 1.61 5.75 -1.26 -5.03 116.55 112.33 2b81 n ASP 135 Ca 0.00 -0.61 -0.39 0.00 -0.01 0.00 0.00 54.79 53.79 2b81 n ASP 135 Cb 0.00 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.06 2b81 n ASP 135 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 2b81 s ARG 136 N 0.00 3.46 0.35 0.11 1.81 -1.26 -4.84 118.95 118.57 2b81 s ARG 136 Ca 0.00 -1.21 0.13 0.00 -1.72 0.00 0.00 55.73 52.94 2b81 s ARG 136 Cb 0.00 -5.35 1.00 0.00 -0.45 0.00 0.00 34.95 30.15 2b81 s ARG 136 CO 0.00 -2.51 1.72 0.00 -0.68 0.00 0.00 175.30 173.83 2b81 h ARG 137 N 9.50 0.46 -0.03 3.54 3.08 -2.00 0.16 114.38 129.08 2b81 h ARG 137 Ca 0.24 -0.03 -0.08 0.00 0.07 0.00 0.00 59.98 60.18 2b81 h ARG 137 Cb 0.97 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.91 2b81 h ARG 137 CO 1.39 0.30 -0.38 0.00 -1.07 0.00 0.00 179.97 180.22 2b81 h ALA 138 N 1.72 1.33 -0.03 0.04 0.00 -1.96 -2.11 119.26 118.25 2b81 h ALA 138 Ca 0.66 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 55.20 2b81 h ALA 138 Cb 1.43 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 19.16 2b81 h ALA 138 CO -0.45 0.49 -0.02 -0.44 0.00 0.00 0.00 179.25 178.83 2b81 h ASP 139 N 0.04 0.08 -0.52 0.00 5.19 -1.06 -1.83 116.42 118.33 2b81 h ASP 139 Ca 0.00 -0.44 0.10 0.00 -0.62 0.00 0.00 57.03 56.08 2b81 h ASP 139 Cb 0.69 -0.02 -0.10 0.00 0.18 0.00 0.00 39.33 40.07 2b81 h ASP 139 CO 0.05 0.50 -0.16 -0.26 -3.12 0.00 0.00 179.24 176.25 2b81 h PHE 140 N -0.35 -0.36 -0.74 4.55 -1.00 -1.38 -1.47 116.94 116.19 2b81 h PHE 140 Ca 0.01 0.05 -0.04 0.00 2.81 0.00 0.00 57.97 60.80 2b81 h PHE 140 Cb 0.47 0.24 -0.03 0.00 3.61 0.00 0.00 35.95 40.24 2b81 h PHE 140 CO 0.08 -0.25 0.30 -0.22 -1.61 0.00 0.00 178.31 176.61 2b81 h LYS 141 N -0.03 1.10 0.00 1.51 3.64 -1.36 -0.50 116.57 120.92 2b81 h LYS 141 Ca 0.25 -0.19 -0.07 0.00 -1.27 0.00 0.00 60.65 59.37 2b81 h LYS 141 Cb 0.41 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 32.04 2b81 h LYS 141 CO -0.55 0.89 -0.33 0.00 -2.27 0.00 0.00 179.45 177.18 2b81 h ALA 142 N 1.25 0.88 -0.01 5.00 0.00 -0.77 -3.09 119.26 122.52 2b81 h ALA 142 Ca 0.25 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2b81 h ALA 142 Cb 0.19 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2b81 h ALA 142 CO -0.02 0.41 -0.70 1.28 0.00 0.00 0.00 179.25 180.22 2b81 n LEU 143 N -3.32 1.48 -1.37 0.00 4.77 -0.60 -4.98 117.00 112.98 2b81 n LEU 143 Ca 0.01 -0.60 -0.10 0.00 -0.03 0.00 0.00 56.01 55.30 2b81 n LEU 143 Cb 0.56 -0.01 0.01 0.00 -2.33 0.00 0.00 43.42 41.65 2b81 n LEU 143 CO 0.36 0.30 -0.03 0.61 -1.33 0.00 0.00 177.39 177.31 2b81 n GLY 144 N 1.46 0.11 3.60 -0.72 0.00 -0.33 -5.03 105.19 104.28 2b81 n GLY 144 Ca 0.07 -0.41 -0.33 0.00 0.00 0.00 0.00 46.02 45.35 2b81 n GLY 144 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b81 s VAL 145 N -2.73 3.77 -0.09 1.61 1.01 -0.44 -5.04 120.40 118.50 2b81 s VAL 145 Ca 0.10 -0.54 -0.30 0.00 0.00 0.00 0.00 61.98 61.25 2b81 s VAL 145 Cb -0.04 -2.58 -0.02 0.00 0.00 0.00 0.00 36.38 33.74 2b81 s VAL 145 CO 0.13 0.54 1.02 -0.55 0.00 0.00 0.00 175.10 176.23 2b81 s SER 146 N -1.01 7.25 0.20 3.32 0.15 -1.26 -4.36 113.70 117.99 2b81 s SER 146 Ca 0.14 1.57 -0.03 0.00 0.70 0.00 0.00 55.95 58.33 2b81 s SER 146 Cb -0.11 -2.56 0.15 0.00 -1.71 0.00 0.00 66.02 61.79 2b81 s SER 146 CO 0.04 -0.43 1.56 -0.74 1.20 0.00 0.00 173.24 174.86 2b81 h HIS 147 N 7.07 0.76 -0.48 3.44 2.76 -1.97 -3.29 115.15 123.44 2b81 h HIS 147 Ca -0.33 -0.23 -0.01 0.00 -2.20 0.00 0.00 60.37 57.60 2b81 h HIS 147 Cb 1.16 -0.16 -0.02 0.00 1.55 0.00 0.00 27.41 29.94 2b81 h HIS 147 CO 0.71 0.95 0.24 0.93 -1.30 0.00 0.00 177.93 179.46 2b81 h GLU 148 N 0.51 0.68 -0.86 5.26 4.39 -2.02 -2.80 114.58 119.73 2b81 h GLU 148 Ca 0.04 -0.09 -0.21 0.00 0.34 0.00 0.00 59.36 59.44 2b81 h GLU 148 Cb 0.95 -0.13 -0.13 0.00 -0.10 0.00 0.00 28.75 29.35 2b81 h GLU 148 CO 0.09 0.55 0.27 0.25 -1.16 0.00 0.00 179.01 179.01 2b81 n THR 149 N -4.65 2.35 0.23 1.13 -2.24 -1.25 -4.53 114.28 105.33 2b81 n THR 149 Ca 0.02 -1.23 0.09 0.00 -2.27 0.00 0.00 64.05 60.65 2b81 n THR 149 Cb 0.10 -0.49 0.56 0.00 -2.10 0.00 0.00 70.33 68.40 2b81 n THR 149 CO 0.00 0.00 0.00 0.08 -0.57 0.00 0.00 175.07 174.58 2b81 h ARG 150 N 1.71 0.00 -0.47 -0.78 0.11 -1.56 -2.13 114.38 111.26 2b81 h ARG 150 Ca 0.26 0.00 -0.08 0.00 0.10 0.00 0.00 59.98 60.26 2b81 h ARG 150 Cb 2.02 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 33.08 2b81 h ARG 150 CO 0.61 0.22 -0.04 0.78 0.10 0.00 0.00 179.97 181.64 2b81 h GLY 151 N 1.09 0.87 0.65 0.08 0.00 -1.84 0.19 103.07 104.11 2b81 h GLY 151 Ca -0.00 -0.61 -0.07 0.00 0.00 0.00 0.00 47.33 46.65 2b81 h GLY 151 CO 0.03 0.56 -0.22 -2.09 0.00 0.00 0.00 176.54 174.82 2b81 h GLU 152 N 0.74 0.29 -0.92 4.80 4.81 -1.83 -2.90 114.58 119.56 2b81 h GLU 152 Ca 0.14 -0.21 -0.01 0.00 -0.13 0.00 0.00 59.36 59.15 2b81 h GLU 152 Cb 0.51 0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.88 2b81 h GLU 152 CO 0.03 0.82 0.53 -0.22 -0.73 0.00 0.00 179.01 179.44 2b81 h LYS 153 N -0.20 1.27 -0.15 1.92 3.64 -1.26 -2.08 116.57 119.71 2b81 h LYS 153 Ca -0.01 -0.13 0.02 0.00 -1.27 0.00 0.00 60.65 59.27 2b81 h LYS 153 Cb 0.84 -0.26 -0.02 0.00 -0.41 0.00 0.00 32.23 32.38 2b81 h LYS 153 CO 0.05 0.91 -0.01 0.35 -2.27 0.00 0.00 179.45 178.48 2b81 h PHE 154 N 1.28 -0.02 -0.73 1.91 3.57 -0.63 0.22 116.94 122.54 2b81 h PHE 154 Ca 0.33 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.82 2b81 h PHE 154 Cb -0.01 0.03 -0.03 0.00 2.79 0.00 0.00 35.95 38.72 2b81 h PHE 154 CO 0.01 -0.03 0.37 0.00 -2.23 0.00 0.00 178.31 176.43 2b81 h ARG 155 N 0.04 1.03 -0.08 1.11 3.08 -1.24 0.45 114.38 118.77 2b81 h ARG 155 Ca 0.07 -0.14 -0.01 0.00 0.07 0.00 0.00 59.98 59.97 2b81 h ARG 155 Cb 0.09 -0.19 -0.00 0.00 0.08 0.00 0.00 29.97 29.94 2b81 h ARG 155 CO -0.12 0.79 0.01 1.49 -1.07 0.00 0.00 179.97 181.07 2b81 h GLU 156 N 1.01 0.13 -0.45 0.04 4.57 -1.07 -2.21 114.58 116.61 2b81 h GLU 156 Ca 0.25 -0.04 0.02 0.00 -1.18 0.00 0.00 59.36 58.42 2b81 h GLU 156 Cb 0.08 -0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 28.63 2b81 h GLU 156 CO -0.04 0.35 0.25 0.00 -1.18 0.00 0.00 179.01 178.40 2b81 h ALA 157 N 0.77 0.57 -0.40 2.92 0.00 -0.39 -2.35 119.26 120.38 2b81 h ALA 157 Ca 0.02 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.95 2b81 h ALA 157 Cb 0.28 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 2b81 h ALA 157 CO 0.00 -0.07 0.23 0.35 0.00 0.00 0.00 179.25 179.76 2b81 h PHE 158 N 0.51 0.43 -0.89 0.00 3.57 -0.82 0.11 116.94 119.85 2b81 h PHE 158 Ca 0.18 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.69 2b81 h PHE 158 Cb 0.04 -0.14 -0.04 0.00 2.79 0.00 0.00 35.95 38.60 2b81 h PHE 158 CO -0.08 0.25 0.51 0.00 -2.23 0.00 0.00 178.31 176.76 2b81 h ALA 159 N 1.18 1.13 -0.38 2.41 0.00 -1.32 -2.29 119.26 119.99 2b81 h ALA 159 Ca 0.16 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 2b81 h ALA 159 Cb 0.02 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.44 2b81 h ALA 159 CO -0.08 0.61 -0.08 -0.92 0.00 0.00 0.00 179.25 178.78 2b81 h TYR 160 N 1.23 0.82 -0.64 0.00 -0.00 -1.05 -2.66 116.97 114.67 2b81 h TYR 160 Ca 0.32 -0.17 0.01 0.00 -0.00 0.00 0.00 58.73 58.89 2b81 h TYR 160 Cb -0.02 -0.20 -0.03 0.00 -0.00 0.00 0.00 36.73 36.48 2b81 h TYR 160 CO 0.00 0.87 0.41 1.25 -0.00 0.00 0.00 178.16 180.69 2b81 h LEU 161 N 0.54 0.70 -0.64 2.82 5.85 -0.51 -1.26 115.31 122.81 2b81 h LEU 161 Ca 0.10 -0.01 -0.12 0.00 0.84 0.00 0.00 57.88 58.68 2b81 h LEU 161 Cb 0.59 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.44 2b81 h LEU 161 CO 0.04 0.50 -0.58 -0.33 -0.34 0.00 0.00 178.44 177.73 2b81 h GLU 162 N 0.83 0.00 0.01 1.25 5.08 -1.40 -1.62 114.58 118.73 2b81 h GLU 162 Ca 0.24 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.60 2b81 h GLU 162 Cb -0.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.19 2b81 h GLU 162 CO -0.07 0.58 -0.00 0.93 -1.00 0.00 0.00 179.01 179.45 2b81 h GLU 163 N 0.00 -0.01 -0.05 2.33 4.39 -1.06 -3.17 114.58 117.01 2b81 h GLU 163 Ca -0.01 0.00 -0.12 0.00 0.34 0.00 0.00 59.36 59.58 2b81 h GLU 163 Cb 1.15 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.79 2b81 h GLU 163 CO 0.08 0.46 -0.51 0.97 -1.16 0.00 0.00 179.01 178.84 2b81 h ILE 164 N -0.47 1.36 -0.15 3.13 6.09 -1.25 -2.52 117.51 123.70 2b81 h ILE 164 Ca -0.00 -1.75 -0.14 0.00 -1.37 0.00 0.00 64.86 61.60 2b81 h ILE 164 Cb 0.47 1.89 -0.01 0.00 0.47 0.00 0.00 36.82 39.63 2b81 h ILE 164 CO 0.00 0.51 -0.51 -0.07 -3.07 0.00 0.00 178.15 175.02 2b81 h LEU 165 N 0.11 0.45 -1.83 2.19 3.38 -1.38 -3.39 115.31 114.83 2b81 h LEU 165 Ca 0.00 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.74 2b81 h LEU 165 Cb 0.93 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.56 2b81 h LEU 165 CO 0.07 0.88 0.00 -1.22 0.09 0.00 0.00 178.44 178.27 2b81 n TYR 166 N -3.96 0.00 -4.38 1.13 0.53 -1.19 -4.56 117.16 104.74 2b81 n TYR 166 Ca -0.02 -0.22 -0.28 0.00 -1.02 0.00 0.00 57.90 56.35 2b81 n TYR 166 Cb 0.57 -0.02 -0.13 0.00 -1.03 0.00 0.00 39.34 38.72 2b81 n TYR 166 CO 0.00 0.00 0.00 0.15 -1.02 0.00 0.00 176.86 175.99 2b81 s LYS 167 N -0.44 1.37 -0.34 -0.72 1.02 -0.95 -5.08 119.74 114.60 2b81 s LYS 167 Ca 0.00 -1.33 -0.19 0.00 0.02 0.00 0.00 55.97 54.47 2b81 s LYS 167 Cb 0.00 -1.85 -0.00 0.00 -0.52 0.00 0.00 37.83 35.46 2b81 s LYS 167 CO 0.00 0.44 0.56 -0.80 -0.92 0.00 0.00 175.35 174.63 2b81 s ASN 168 N -2.05 6.38 -1.02 2.83 0.01 -1.26 -4.47 114.94 115.36 2b81 s ASN 168 Ca 0.13 0.11 -0.15 0.00 -0.71 0.00 0.00 52.86 52.25 2b81 s ASN 168 Cb -0.10 -2.29 -0.00 0.00 0.41 0.00 0.00 41.25 39.27 2b81 s ASN 168 CO 0.06 -0.50 0.73 0.49 -1.51 0.00 0.00 177.10 176.37 2b81 n PHE 169 N 5.84 -2.05 -1.66 2.20 3.01 -1.26 -4.96 117.46 118.57 2b81 n PHE 169 Ca -0.03 0.60 -0.31 0.00 1.01 0.00 0.00 57.45 58.72 2b81 n PHE 169 Cb 0.49 -3.33 0.04 0.00 -0.01 0.00 0.00 39.48 36.66 2b81 n PHE 169 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 2b81 s PRO 170 N -5.44 3.09 -0.22 -1.08 0.04 -1.26 -4.87 135.00 125.26 2b81 s PRO 170 Ca 0.31 0.87 -0.17 0.00 0.04 0.00 0.00 61.00 62.04 2b81 s PRO 170 Cb -0.12 -2.01 -0.03 0.00 0.04 0.00 0.00 34.50 32.38 2b81 s PRO 170 CO 0.86 -0.97 0.47 -1.12 0.04 0.00 0.00 177.00 176.28 2b81 s SER 171 N -3.92 6.47 -0.12 6.66 0.01 -1.26 -4.46 113.70 117.07 2b81 s SER 171 Ca 0.57 0.56 -0.01 0.00 1.31 0.00 0.00 55.95 58.38 2b81 s SER 171 Cb -0.13 -2.26 0.03 0.00 0.21 0.00 0.00 66.02 63.87 2b81 s SER 171 CO 0.55 -0.18 -0.05 -0.63 0.41 0.00 0.00 173.24 173.34 2b81 s ILE 172 N 1.74 0.90 -0.37 1.44 1.01 -0.53 -4.99 121.20 120.39 2b81 s ILE 172 Ca 0.21 -0.31 0.03 0.00 0.00 0.00 0.00 60.65 60.59 2b81 s ILE 172 Cb -0.15 -1.01 0.11 0.00 0.01 0.00 0.00 42.46 41.42 2b81 s ILE 172 CO 0.09 0.26 0.10 -1.10 0.00 0.00 0.00 174.94 174.29 2b81 s GLN 173 N 1.75 1.43 0.08 2.79 -0.21 -1.26 -1.50 119.66 122.74 2b81 s GLN 173 Ca 0.04 -1.88 0.02 0.00 0.02 0.00 0.00 55.36 53.55 2b81 s GLN 173 Cb -0.13 -3.00 -0.04 0.00 1.00 0.00 0.00 33.01 30.84 2b81 s GLN 173 CO -0.08 -0.98 -0.06 0.45 -2.12 0.00 0.00 175.29 172.50 2b81 s SER 174 N 0.80 0.98 0.50 5.90 0.15 -0.72 -5.00 113.70 116.29 2b81 s SER 174 Ca 0.12 -0.88 0.33 0.00 0.70 0.00 0.00 55.95 56.23 2b81 s SER 174 Cb -0.20 0.09 1.62 0.00 -1.71 0.00 0.00 66.02 65.82 2b81 s SER 174 CO -0.09 -0.41 2.01 0.71 1.20 0.00 0.00 173.24 176.66 2b81 h THR 175 N 3.42 0.00 0.00 6.45 1.35 -1.99 -2.60 112.91 119.54 2b81 h THR 175 Ca -0.35 -0.20 0.00 0.00 -0.55 0.00 0.00 66.41 65.31 2b81 h THR 175 Cb 1.17 1.06 0.00 0.00 -1.73 0.00 0.00 68.15 68.65 2b81 h THR 175 CO 0.58 0.00 -0.66 -0.07 -0.25 0.00 0.00 175.52 175.12 2b81 h LEU 176 N 0.00 0.00 0.00 3.87 3.38 -1.95 -3.50 115.31 117.11 2b81 h LEU 176 Ca 0.00 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.82 2b81 h LEU 176 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 2b81 h LEU 176 CO 0.00 0.07 0.00 0.61 0.09 0.00 0.00 178.44 179.21 2b81 n GLY 177 N 1.29 -1.47 2.95 0.83 0.00 -0.98 -5.07 105.19 102.74 2b81 n GLY 177 Ca 0.03 -1.53 -0.13 0.00 0.00 0.00 0.00 46.02 44.39 2b81 n GLY 177 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2b81 s GLU 178 N -1.71 0.28 -0.11 1.61 -1.05 -1.26 -1.76 118.70 114.71 2b81 s GLU 178 Ca 0.00 -0.29 -0.02 0.00 -0.15 0.00 0.00 54.97 54.51 2b81 s GLU 178 Cb 0.00 -0.16 0.04 0.00 -0.44 0.00 0.00 34.13 33.56 2b81 s GLU 178 CO 0.00 0.04 0.00 0.54 0.95 0.00 0.00 175.26 176.79 2b81 s VAL 179 N -0.52 0.49 -0.32 1.83 0.11 -0.56 -4.99 120.40 116.44 2b81 s VAL 179 Ca -0.04 -0.09 -0.02 0.00 -2.93 0.00 0.00 61.98 58.91 2b81 s VAL 179 Cb -0.04 -0.71 0.12 0.00 -1.53 0.00 0.00 36.38 34.22 2b81 s VAL 179 CO -0.00 0.16 0.19 -1.00 -3.33 0.00 0.00 175.10 171.12 2b81 s HIS 180 N 1.91 0.34 0.00 1.54 3.76 -1.26 -1.46 115.29 120.12 2b81 s HIS 180 Ca 0.04 -1.06 0.00 0.00 -0.15 0.00 0.00 55.06 53.88 2b81 s HIS 180 Cb -0.13 -0.83 0.00 0.00 1.11 0.00 0.00 32.58 32.73 2b81 s HIS 180 CO -0.06 -0.85 0.00 0.41 -0.85 0.00 0.00 174.74 173.39 2b81 n GLY 181 N 4.78 1.00 3.56 -2.22 0.00 -1.26 -5.11 105.19 105.94 2b81 n GLY 181 Ca 0.02 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.78 2b81 n GLY 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b81 s ALA 182 N -2.00 2.94 -0.01 4.61 0.00 -1.26 -5.06 121.76 120.98 2b81 s ALA 182 Ca 0.00 -2.18 -0.06 0.00 0.00 0.00 0.00 51.96 49.72 2b81 s ALA 182 Cb 0.00 0.17 0.00 0.00 0.00 0.00 0.00 23.12 23.29 2b81 s ALA 182 CO 0.00 -0.08 0.12 1.21 0.00 0.00 0.00 175.76 177.01 2b81 s ASN 183 N -3.63 -0.00 0.01 0.00 2.47 -1.26 -4.31 114.94 108.22 2b81 s ASN 183 Ca 0.34 -0.09 -0.29 0.00 0.42 0.00 0.00 52.86 53.23 2b81 s ASN 183 Cb 0.07 0.22 -0.04 0.00 -1.45 0.00 0.00 41.25 40.06 2b81 s ASN 183 CO 0.17 -0.27 0.94 -0.22 -3.72 0.00 0.00 177.10 174.00 2b81 s LEU 184 N -0.96 4.39 0.02 3.21 2.96 -1.26 -5.01 118.68 122.01 2b81 s LEU 184 Ca -0.11 1.63 0.02 0.00 -0.22 0.00 0.00 54.13 55.46 2b81 s LEU 184 Cb -0.06 -3.52 -0.01 0.00 0.50 0.00 0.00 46.19 43.10 2b81 s LEU 184 CO 0.01 -0.21 -0.08 0.68 -1.32 0.00 0.00 176.35 175.43 2b81 s VAL 185 N 0.82 0.60 0.88 1.68 -7.23 -1.26 -4.46 120.40 111.42 2b81 s VAL 185 Ca 0.50 -0.62 -0.13 0.00 -1.81 0.00 0.00 61.98 59.92 2b81 s VAL 185 Cb -0.21 -0.56 0.13 0.00 0.56 0.00 0.00 36.38 36.30 2b81 s VAL 185 CO 0.27 -0.04 1.18 -2.16 -0.31 0.00 0.00 175.10 174.04 2b81 s PRO 186 N -0.73 1.36 0.06 4.82 0.04 -1.26 -4.98 135.00 134.31 2b81 s PRO 186 Ca -0.02 0.10 0.01 0.00 0.04 0.00 0.00 61.00 61.13 2b81 s PRO 186 Cb -0.05 -1.88 -0.04 0.00 0.04 0.00 0.00 34.50 32.56 2b81 s PRO 186 CO 0.00 -2.01 0.14 0.15 0.04 0.00 0.00 177.00 175.33 2b81 s LYS 187 N -5.51 3.18 0.54 4.56 -0.14 -1.26 -4.77 119.74 116.34 2b81 s LYS 187 Ca 0.65 -0.54 -0.20 0.00 -1.36 0.00 0.00 55.97 54.52 2b81 s LYS 187 Cb -0.11 -2.90 -0.06 0.00 -1.68 0.00 0.00 37.83 33.08 2b81 s LYS 187 CO 0.51 0.60 1.16 -1.25 -0.76 0.00 0.00 175.35 175.62 2b81 s PRO 188 N -2.33 3.34 0.28 -1.68 0.04 -1.26 -4.84 135.00 128.55 2b81 s PRO 188 Ca 0.31 1.72 0.11 0.00 0.04 0.00 0.00 61.00 63.18 2b81 s PRO 188 Cb -0.13 -2.08 0.39 0.00 0.04 0.00 0.00 34.50 32.72 2b81 s PRO 188 CO 0.23 -0.89 1.63 1.03 0.04 0.00 0.00 177.00 179.05 2b81 h SER 189 N 1.31 0.00 -3.03 6.66 0.87 -1.91 -3.44 113.55 114.01 2b81 h SER 189 Ca -0.50 0.00 -0.48 0.00 -1.23 0.00 0.00 61.79 59.58 2b81 h SER 189 Cb 1.27 0.00 -0.14 0.00 -0.44 0.00 0.00 62.40 63.09 2b81 h SER 189 CO 0.57 0.60 -0.67 -0.54 -0.53 0.00 0.00 176.83 176.26 2b81 s LYS 190 N -3.64 1.54 0.33 2.24 1.02 -1.26 -5.11 119.74 114.86 2b81 s LYS 190 Ca -0.01 -1.79 -0.27 0.00 0.02 0.00 0.00 55.97 53.92 2b81 s LYS 190 Cb 0.13 -1.08 -0.13 0.00 -0.52 0.00 0.00 37.83 36.22 2b81 s LYS 190 CO 0.76 0.00 0.97 0.54 -0.92 0.00 0.00 175.35 176.70 2b81 n ARG 191 N -0.58 1.29 -3.43 1.68 5.12 -1.26 -4.97 116.66 114.51 2b81 n ARG 191 Ca -0.05 0.46 -0.39 0.00 -1.93 0.00 0.00 57.85 55.94 2b81 n ARG 191 Cb 0.64 -1.86 -0.09 0.00 -1.16 0.00 0.00 32.46 29.98 2b81 n ARG 191 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 2b81 s VAL 192 N -1.14 5.20 0.14 1.55 1.01 -1.26 -5.03 120.40 120.87 2b81 s VAL 192 Ca 0.60 0.50 -0.31 0.00 0.00 0.00 0.00 61.98 62.77 2b81 s VAL 192 Cb -0.66 -3.67 -0.10 0.00 0.00 0.00 0.00 36.38 31.95 2b81 s VAL 192 CO 0.59 0.19 1.72 -2.84 0.00 0.00 0.00 175.10 174.76 2b81 s PRO 193 N 1.93 4.16 -0.15 2.72 0.02 -1.26 -4.84 135.00 137.59 2b81 s PRO 193 Ca 0.14 2.50 0.00 0.00 0.02 0.00 0.00 61.00 63.66 2b81 s PRO 193 Cb -0.16 -3.41 0.02 0.00 0.02 0.00 0.00 34.50 30.98 2b81 s PRO 193 CO 0.10 -0.76 -0.14 0.99 -0.33 0.00 0.00 177.00 176.86 2b81 s THR 194 N 2.10 1.53 -0.09 0.99 2.01 -1.26 -0.93 115.64 119.99 2b81 s THR 194 Ca 0.76 -0.61 0.03 0.00 0.31 0.00 0.00 61.69 62.19 2b81 s THR 194 Cb -0.45 -1.44 -0.01 0.00 0.01 0.00 0.00 72.50 70.60 2b81 s THR 194 CO 0.34 0.45 -0.19 -0.36 -0.69 0.00 0.00 174.62 174.17 2b81 s PHE 195 N 1.50 2.62 -0.02 4.92 0.40 0.15 0.12 117.98 127.68 2b81 s PHE 195 Ca 0.05 -0.68 -0.30 0.00 -0.60 0.00 0.00 56.93 55.40 2b81 s PHE 195 Cb -0.13 -1.70 -0.04 0.00 0.51 0.00 0.00 43.02 41.66 2b81 s PHE 195 CO -0.10 -0.19 1.12 0.42 0.70 0.00 0.00 175.22 177.16 2b81 s ILE 196 N 0.01 4.43 -0.17 0.64 -1.09 -0.58 -1.19 121.20 123.25 2b81 s ILE 196 Ca -0.07 1.74 -0.07 0.00 -2.23 0.00 0.00 60.65 60.02 2b81 s ILE 196 Cb -0.15 -4.11 -0.04 0.00 -1.58 0.00 0.00 42.46 36.58 2b81 s ILE 196 CO 0.05 0.07 0.05 -0.89 -1.23 0.00 0.00 174.94 172.99 2b81 s THR 197 N 1.58 4.72 0.00 2.92 2.01 -0.23 -4.47 115.64 122.17 2b81 s THR 197 Ca 0.55 -0.06 0.00 0.00 0.31 0.00 0.00 61.69 62.48 2b81 s THR 197 Cb -0.24 -3.11 0.00 0.00 0.01 0.00 0.00 72.50 69.16 2b81 s THR 197 CO 0.25 0.48 0.00 0.61 -0.69 0.00 0.00 174.62 175.27 2b81 n GLY 198 N 3.33 0.72 0.13 4.40 0.00 -1.26 -3.44 105.19 109.07 2b81 n GLY 198 Ca -0.17 -0.78 0.06 0.00 0.00 0.00 0.00 46.02 45.13 2b81 n GLY 198 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2b81 h PHE 199 N 0.00 0.00 -4.98 1.61 -1.00 -1.93 -3.46 116.94 107.18 2b81 h PHE 199 Ca 0.00 0.00 -0.34 0.00 2.81 0.00 0.00 57.97 60.44 2b81 h PHE 199 Cb 0.00 0.00 -0.05 0.00 3.61 0.00 0.00 35.95 39.51 2b81 h PHE 199 CO 0.00 0.27 -0.49 0.43 -1.61 0.00 0.00 178.31 176.91 2b81 n SER 200 N -2.92 -3.90 -0.38 2.17 7.64 -1.22 -0.76 113.62 114.25 2b81 n SER 200 Ca -0.02 -0.22 -0.05 0.00 1.01 0.00 0.00 58.87 59.59 2b81 n SER 200 Cb 0.67 -3.24 -0.02 0.00 -1.01 0.00 0.00 64.21 60.61 2b81 n SER 200 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2b81 n GLN 201 N -3.51 -1.10 -3.44 1.43 1.13 -1.26 -4.63 117.38 106.00 2b81 n GLN 201 Ca -0.05 0.56 -0.19 0.00 -1.94 0.00 0.00 57.00 55.37 2b81 n GLN 201 Cb 0.56 -4.53 -0.01 0.00 0.11 0.00 0.00 30.24 26.38 2b81 n GLN 201 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 2b81 s GLN 202 N -1.95 2.87 0.00 -1.09 -1.52 0.06 -4.88 119.66 113.16 2b81 s GLN 202 Ca 0.00 -1.21 0.00 0.00 -1.95 0.00 0.00 55.36 52.20 2b81 s GLN 202 Cb 0.00 -2.66 0.00 0.00 -0.22 0.00 0.00 33.01 30.13 2b81 s GLN 202 CO 0.00 -0.06 0.00 0.27 -0.25 0.00 0.00 175.29 175.25 2b81 n ASN 203 N -1.62 0.00 0.00 5.90 2.04 -1.26 -4.88 115.26 115.43 2b81 n ASN 203 Ca 0.02 0.00 0.00 0.00 -0.44 0.00 0.00 54.58 54.16 2b81 n ASN 203 Cb 0.59 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.84 2b81 n ASN 203 CO 0.00 0.00 0.00 -0.62 -0.44 0.00 0.00 177.26 176.20 2b81 n GLU 205 N 0.00 0.00 0.05 -3.83 1.02 -1.26 -3.03 120.64 113.59 2b81 n GLU 205 Ca 0.00 0.00 -0.13 0.00 -0.02 0.00 0.00 57.16 57.01 2b81 n GLU 205 Cb 0.00 0.00 -0.09 0.00 -0.02 0.00 0.00 31.44 31.33 2b81 n GLU 205 CO 0.00 0.00 0.00 2.35 1.18 0.00 0.00 177.13 180.66 2b81 h TRP 206 N 0.00 -0.14 -0.05 -0.32 7.01 -1.97 -2.52 115.95 117.96 2b81 h TRP 206 Ca 0.00 -0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.00 2b81 h TRP 206 Cb 0.00 0.05 0.00 0.00 -2.10 0.00 0.00 29.16 27.11 2b81 h TRP 206 CO 0.00 0.23 0.00 1.97 -2.79 0.00 0.00 178.44 177.85 2b81 n PHE 207 N -4.98 0.06 0.03 2.65 1.16 -1.17 -0.84 117.46 114.37 2b81 n PHE 207 Ca -0.09 -0.03 -0.19 0.00 -1.87 0.00 0.00 57.45 55.28 2b81 n PHE 207 Cb 0.23 0.00 -0.14 0.00 -1.61 0.00 0.00 39.48 37.96 2b81 n PHE 207 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2b81 h ALA 208 N 3.28 0.37 0.00 1.98 0.00 -1.83 -3.41 119.26 119.66 2b81 h ALA 208 Ca 0.00 -1.27 -0.19 0.00 0.00 0.00 0.00 54.91 53.45 2b81 h ALA 208 Cb 0.07 0.51 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 2b81 h ALA 208 CO 0.00 1.24 -1.37 1.49 0.00 0.00 0.00 179.25 180.61 2b81 h GLU 209 N 0.07 0.00 -6.70 0.00 4.57 -0.94 -3.42 114.58 108.16 2b81 h GLU 209 Ca -0.34 0.00 -0.68 0.00 -1.18 0.00 0.00 59.36 57.16 2b81 h GLU 209 Cb 2.04 0.00 -0.20 0.00 -0.16 0.00 0.00 28.75 30.44 2b81 h GLU 209 CO 0.13 0.37 -0.80 -1.01 -1.18 0.00 0.00 179.01 176.51 2b81 s HIS 210 N -2.86 2.53 0.00 0.92 3.76 -0.02 -5.06 115.29 114.56 2b81 s HIS 210 Ca -0.02 -0.27 0.00 0.00 -0.15 0.00 0.00 55.06 54.62 2b81 s HIS 210 Cb 0.08 -1.37 0.00 0.00 1.11 0.00 0.00 32.58 32.41 2b81 s HIS 210 CO 0.81 0.35 0.00 0.41 -0.85 0.00 0.00 174.74 175.46 2b81 n GLY 211 N 0.97 -0.72 0.42 -2.22 0.00 -1.26 -4.56 105.19 97.82 2b81 n GLY 211 Ca -0.16 -1.71 0.05 0.00 0.00 0.00 0.00 46.02 44.20 2b81 n GLY 211 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2b81 n ASP 212 N -1.14 1.93 0.00 1.61 8.00 0.33 -5.00 116.55 122.27 2b81 n ASP 212 Ca 0.00 -1.47 0.00 0.00 0.71 0.00 0.00 54.79 54.03 2b81 n ASP 212 Cb 0.00 -0.02 0.00 0.00 -0.02 0.00 0.00 41.12 41.08 2b81 n ASP 212 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2b81 n GLY 213 N 0.55 -0.38 0.00 0.44 0.00 -1.24 -3.98 105.19 100.58 2b81 n GLY 213 Ca 0.06 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 44.92 2b81 n GLY 213 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 2b81 n TRP 214 N -0.65 0.00 0.00 1.61 -0.00 -0.92 -1.53 117.44 115.95 2b81 n TRP 214 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.50 2b81 n TRP 214 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.31 2b81 n TRP 214 CO 0.00 0.00 0.00 0.98 -0.00 0.00 0.00 177.69 178.67 2b81 n TYR 216 N 0.00 0.00 -1.28 5.87 9.36 -0.96 -0.98 117.16 129.17 2b81 n TYR 216 Ca 0.00 0.00 -0.31 0.00 3.32 0.00 0.00 57.90 60.91 2b81 n TYR 216 Cb 0.00 0.00 0.09 0.00 -0.63 0.00 0.00 39.34 38.80 2b81 n TYR 216 CO 0.00 0.00 0.00 0.71 0.22 0.00 0.00 176.86 177.79 2b81 s TYR 217 N -2.00 2.50 -0.09 2.98 1.51 -1.26 -4.14 117.35 116.84 2b81 s TYR 217 Ca 0.00 1.58 -0.32 0.00 -1.01 0.00 0.00 57.07 57.31 2b81 s TYR 217 Cb 0.00 -3.09 -0.10 0.00 -0.11 0.00 0.00 41.96 38.66 2b81 s TYR 217 CO 0.00 -1.88 1.98 -2.30 -1.11 0.00 0.00 175.55 172.24 2b81 n PRO 218 N -3.43 2.26 -4.17 -1.71 -0.02 -1.26 -4.86 135.00 121.81 2b81 n PRO 218 Ca 0.10 0.80 -0.13 0.00 -2.02 0.00 0.00 63.50 62.25 2b81 n PRO 218 Cb 0.53 -2.81 -0.10 0.00 -0.02 0.00 0.00 33.50 31.09 2b81 n PRO 218 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2b81 s ARG 219 N 4.66 0.84 0.67 -0.52 1.81 -1.26 -4.89 118.95 120.27 2b81 s ARG 219 Ca 0.94 -1.24 -0.17 0.00 -1.72 0.00 0.00 55.73 53.54 2b81 s ARG 219 Cb -0.59 -0.38 0.00 0.00 -0.45 0.00 0.00 34.95 33.54 2b81 s ARG 219 CO 0.47 0.03 1.27 -1.54 -0.68 0.00 0.00 175.30 174.86 2b81 s SER 220 N -2.73 4.45 0.45 0.23 1.04 -1.26 -4.73 113.70 111.15 2b81 s SER 220 Ca 0.08 2.56 0.11 0.00 0.48 0.00 0.00 55.95 59.19 2b81 s SER 220 Cb 0.01 -2.61 1.02 0.00 0.10 0.00 0.00 66.02 64.54 2b81 s SER 220 CO -0.02 -2.10 2.08 -0.65 0.98 0.00 0.00 173.24 173.53 2b81 h PRO 221 N 0.30 0.30 -0.28 4.02 0.11 -1.98 -0.03 132.00 134.44 2b81 h PRO 221 Ca -0.50 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.55 2b81 h PRO 221 Cb 1.33 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.36 2b81 h PRO 221 CO 0.52 0.21 0.04 0.28 -0.21 0.00 0.00 178.00 178.85 2b81 h VAL 222 N 0.30 1.23 -0.35 3.15 2.07 -2.00 -2.21 116.25 118.45 2b81 h VAL 222 Ca 0.08 -0.80 -0.07 0.00 0.82 0.00 0.00 66.70 66.73 2b81 h VAL 222 Cb -0.00 1.22 -0.02 0.00 -1.52 0.00 0.00 31.29 30.97 2b81 h VAL 222 CO -0.01 0.26 -0.08 -0.74 0.02 0.00 0.00 177.57 177.01 2b81 h HIS 223 N 0.28 0.63 0.00 1.57 6.17 -1.69 -3.22 115.15 118.89 2b81 h HIS 223 Ca 0.08 -0.09 -0.19 0.00 0.71 0.00 0.00 60.37 60.88 2b81 h HIS 223 Cb 0.34 -0.17 -0.03 0.00 2.52 0.00 0.00 27.41 30.07 2b81 h HIS 223 CO 0.02 0.66 -0.98 0.37 0.71 0.00 0.00 177.93 178.72 2b81 h GLN 224 N 0.55 0.00 -0.82 5.26 5.75 -0.93 -3.36 115.11 121.55 2b81 h GLN 224 Ca 0.10 0.00 0.06 0.00 -0.15 0.00 0.00 58.65 58.66 2b81 h GLN 224 Cb 0.48 0.00 -0.06 0.00 1.07 0.00 0.00 27.48 28.97 2b81 h GLN 224 CO 0.03 0.75 0.51 0.00 -2.65 0.00 0.00 178.83 177.46 2b81 h ALA 225 N 1.17 1.12 0.15 3.38 0.00 -1.40 -2.09 119.26 121.59 2b81 h ALA 225 Ca -0.05 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 2b81 h ALA 225 Cb 1.68 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 19.24 2b81 h ALA 225 CO 0.10 0.26 -0.10 0.78 0.00 0.00 0.00 179.25 180.28 2b81 h GLY 226 N 0.94 -0.25 0.94 0.00 0.00 -1.74 -1.39 103.07 101.57 2b81 h GLY 226 Ca 0.36 0.12 0.01 0.00 0.00 0.00 0.00 47.33 47.81 2b81 h GLY 226 CO -0.16 -0.11 0.13 0.00 0.00 0.00 0.00 176.54 176.40 2b81 h ALA 227 N 0.58 0.29 -0.70 3.60 0.00 -1.67 -0.13 119.26 121.24 2b81 h ALA 227 Ca -0.01 -0.00 0.08 0.00 0.00 0.00 0.00 54.91 54.98 2b81 h ALA 227 Cb 0.22 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 17.89 2b81 h ALA 227 CO 0.00 -0.26 0.37 0.82 0.00 0.00 0.00 179.25 180.18 2b81 h ILE 228 N 0.28 0.91 -0.07 0.00 2.04 -1.30 0.84 117.51 120.21 2b81 h ILE 228 Ca 0.09 -0.22 -0.00 0.00 1.00 0.00 0.00 64.86 65.73 2b81 h ILE 228 Cb 0.00 0.20 -0.00 0.00 -0.74 0.00 0.00 36.82 36.27 2b81 h ILE 228 CO -0.05 0.12 0.03 1.23 0.00 0.00 0.00 178.15 179.49 2b81 h GLY 229 N 0.65 0.10 1.49 5.37 0.00 -0.60 -0.59 103.07 109.49 2b81 h GLY 229 Ca 0.33 -0.05 -0.17 0.00 0.00 0.00 0.00 47.33 47.44 2b81 h GLY 229 CO -0.23 0.04 -0.63 1.46 0.00 0.00 0.00 176.54 177.18 2b81 h GLN 230 N 0.01 0.52 -0.13 4.80 1.08 -0.66 -1.74 115.11 118.99 2b81 h GLN 230 Ca 0.02 -0.37 0.03 0.00 -1.45 0.00 0.00 58.65 56.88 2b81 h GLN 230 Cb 0.09 0.06 -0.03 0.00 -0.05 0.00 0.00 27.48 27.55 2b81 h GLN 230 CO -0.00 0.98 -0.05 2.35 -0.95 0.00 0.00 178.83 181.17 2b81 h TRP 231 N 0.38 -0.10 -0.18 2.96 7.01 -0.86 -2.64 115.95 122.52 2b81 h TRP 231 Ca -0.01 0.01 -0.07 0.00 2.11 0.00 0.00 58.89 60.93 2b81 h TRP 231 Cb 1.19 0.07 -0.01 0.00 -2.10 0.00 0.00 29.16 28.30 2b81 h TRP 231 CO 0.05 -0.08 -0.20 0.00 -2.79 0.00 0.00 178.44 175.43 2b81 h ARG 232 N -0.02 0.31 -0.54 2.65 3.08 -0.90 -0.31 114.38 118.64 2b81 h ARG 232 Ca 0.07 -0.09 0.03 0.00 0.07 0.00 0.00 59.98 60.05 2b81 h ARG 232 Cb 0.12 -0.03 -0.04 0.00 0.08 0.00 0.00 29.97 30.10 2b81 h ARG 232 CO -0.15 0.50 0.32 0.93 -1.07 0.00 0.00 179.97 180.51 2b81 h GLU 233 N 0.29 0.62 -0.55 0.04 5.08 -1.29 0.24 114.58 119.01 2b81 h GLU 233 Ca 0.05 -0.04 -0.07 0.00 -1.00 0.00 0.00 59.36 58.30 2b81 h GLU 233 Cb 0.52 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.60 2b81 h GLU 233 CO 0.03 0.41 0.08 -0.07 -1.00 0.00 0.00 179.01 178.46 2b81 h LEU 234 N 0.64 0.89 -0.71 1.33 3.38 -1.02 -1.27 115.31 118.55 2b81 h LEU 234 Ca 0.22 -0.27 0.07 0.00 0.09 0.00 0.00 57.88 57.99 2b81 h LEU 234 Cb 0.03 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 40.48 2b81 h LEU 234 CO -0.10 0.93 0.40 0.58 0.09 0.00 0.00 178.44 180.34 2b81 h VAL 235 N 0.81 0.96 -0.75 1.22 2.07 -0.80 -1.27 116.25 118.49 2b81 h VAL 235 Ca 0.17 -0.25 -0.04 0.00 0.82 0.00 0.00 66.70 67.40 2b81 h VAL 235 Cb 0.43 0.18 -0.03 0.00 -1.52 0.00 0.00 31.29 30.34 2b81 h VAL 235 CO 0.01 0.13 0.30 -0.08 0.02 0.00 0.00 177.57 177.96 2b81 h GLU 236 N 0.72 1.11 -0.09 1.57 4.57 -0.65 0.13 114.58 121.95 2b81 h GLU 236 Ca 0.32 -0.19 -0.00 0.00 -1.18 0.00 0.00 59.36 58.31 2b81 h GLU 236 Cb 0.22 -0.19 -0.00 0.00 -0.16 0.00 0.00 28.75 28.62 2b81 h GLU 236 CO -0.20 0.90 0.05 -0.44 -1.18 0.00 0.00 179.01 178.14 2b81 h ASP 237 N 1.09 0.10 0.56 1.04 3.32 -0.57 -2.89 116.42 119.07 2b81 h ASP 237 Ca 0.25 -0.05 -0.22 0.00 0.02 0.00 0.00 57.03 57.04 2b81 h ASP 237 Cb 0.20 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 2b81 h ASP 237 CO -0.02 0.12 -0.96 1.88 -1.72 0.00 0.00 179.24 178.54 2b81 h TYR 238 N 0.08 0.38 -2.08 4.55 0.05 -1.05 -3.40 116.97 115.50 2b81 h TYR 238 Ca 0.03 -0.22 -0.53 0.00 0.05 0.00 0.00 58.73 58.06 2b81 h TYR 238 Cb 0.04 -0.04 -0.35 0.00 1.01 0.00 0.00 36.73 37.39 2b81 h TYR 238 CO -0.06 1.07 -0.95 0.72 -1.05 0.00 0.00 178.16 177.89 2b81 n HIS 239 N -3.64 -1.17 -1.71 4.88 8.25 0.45 -5.10 115.22 117.19 2b81 n HIS 239 Ca -0.05 -3.13 -0.43 0.00 -0.26 0.00 0.00 57.72 53.85 2b81 n HIS 239 Cb 0.86 0.29 -0.03 0.00 1.12 0.00 0.00 29.99 32.23 2b81 n HIS 239 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2b81 n PRO 240 N 2.49 2.52 -0.94 -0.41 -0.04 -1.09 -2.40 135.00 135.13 2b81 n PRO 240 Ca 0.26 0.90 0.00 0.00 -0.04 0.00 0.00 63.50 64.62 2b81 n PRO 240 Cb 0.50 -2.68 0.00 0.00 -0.04 0.00 0.00 33.50 31.29 2b81 n PRO 240 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2b81 n ASP 241 N 2.83 -1.13 -4.83 3.54 8.00 -1.26 -5.04 116.55 118.67 2b81 n ASP 241 Ca 0.12 0.00 -0.34 0.00 0.71 0.00 0.00 54.79 55.28 2b81 n ASP 241 Cb 0.34 -0.66 -0.06 0.00 -0.02 0.00 0.00 41.12 40.72 2b81 n ASP 241 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 2b81 s VAL 242 N -2.92 4.56 -0.18 2.53 -7.23 -1.01 -5.06 120.40 111.09 2b81 s VAL 242 Ca 0.00 1.23 -0.10 0.00 -1.81 0.00 0.00 61.98 61.30 2b81 s VAL 242 Cb 0.00 -3.75 -0.05 0.00 0.56 0.00 0.00 36.38 33.14 2b81 s VAL 242 CO 0.00 -0.00 0.16 0.12 -0.31 0.00 0.00 175.10 175.06 2b81 s PHE 243 N -1.78 3.45 -0.11 2.82 5.36 -1.26 -4.89 117.98 121.57 2b81 s PHE 243 Ca 0.50 0.41 0.02 0.00 -0.96 0.00 0.00 56.93 56.90 2b81 s PHE 243 Cb -0.14 -2.15 0.01 0.00 -0.34 0.00 0.00 43.02 40.40 2b81 s PHE 243 CO 0.19 0.36 -0.16 0.15 -1.46 0.00 0.00 175.22 174.29 2b81 s LYS 244 N 0.15 2.32 0.61 10.12 1.02 -1.26 -5.04 119.74 127.66 2b81 s LYS 244 Ca 0.10 -0.60 -0.14 0.00 0.02 0.00 0.00 55.97 55.35 2b81 s LYS 244 Cb -0.12 -1.94 -0.03 0.00 -0.52 0.00 0.00 37.83 35.22 2b81 s LYS 244 CO -0.00 -0.04 1.05 -1.25 -0.92 0.00 0.00 175.35 174.19 2b81 s PRO 245 N 0.92 3.32 -0.13 -1.68 0.04 -1.26 -4.87 135.00 131.35 2b81 s PRO 245 Ca -0.08 1.09 -0.02 0.00 0.04 0.00 0.00 61.00 62.03 2b81 s PRO 245 Cb -0.15 -2.04 -0.03 0.00 0.04 0.00 0.00 34.50 32.32 2b81 s PRO 245 CO -0.01 -0.80 -0.05 0.12 0.04 0.00 0.00 177.00 176.31 2b81 s PHE 246 N -2.65 3.01 0.06 0.56 5.36 -1.26 -2.15 117.98 120.90 2b81 s PHE 246 Ca 0.61 -0.19 0.09 0.00 -0.96 0.00 0.00 56.93 56.48 2b81 s PHE 246 Cb -0.14 -1.88 -0.03 0.00 -0.34 0.00 0.00 43.02 40.63 2b81 s PHE 246 CO 0.41 0.09 -0.24 0.42 -1.46 0.00 0.00 175.22 174.44 2b81 s ILE 247 N -0.04 1.99 -0.00 3.12 1.01 -0.15 -0.95 121.20 126.17 2b81 s ILE 247 Ca 0.01 -1.38 -0.14 0.00 0.00 0.00 0.00 60.65 59.14 2b81 s ILE 247 Cb -0.13 -1.72 0.02 0.00 0.01 0.00 0.00 42.46 40.64 2b81 s ILE 247 CO 0.03 0.26 0.29 0.00 0.00 0.00 0.00 174.94 175.52 2b81 s GLN 248 N -1.35 0.67 0.00 2.79 -2.07 -0.77 -2.27 119.66 116.66 2b81 s GLN 248 Ca 0.10 -0.28 0.00 0.00 -1.82 0.00 0.00 55.36 53.37 2b81 s GLN 248 Cb -0.10 0.29 0.00 0.00 -1.09 0.00 0.00 33.01 32.12 2b81 s GLN 248 CO 0.03 -0.19 0.00 -2.30 -1.32 0.00 0.00 175.29 171.51 2b81 n PRO 249 N 1.17 0.74 -4.98 9.60 -0.02 -1.26 -1.56 135.00 138.69 2b81 n PRO 249 Ca -0.21 0.00 -0.32 0.00 -2.02 0.00 0.00 63.50 60.94 2b81 n PRO 249 Cb 0.57 0.00 -0.15 0.00 -0.02 0.00 0.00 33.50 33.90 2b81 n PRO 249 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 2b81 s HIS 251 N -0.25 2.65 -0.06 6.00 3.76 -0.60 -4.15 115.29 122.64 2b81 s HIS 251 Ca 0.00 -0.53 0.03 0.00 -0.15 0.00 0.00 55.06 54.41 2b81 s HIS 251 Cb 0.00 -1.69 0.01 0.00 1.11 0.00 0.00 32.58 32.00 2b81 s HIS 251 CO 0.00 -0.09 -0.13 -1.17 -0.85 0.00 0.00 174.74 172.50 2b81 s LEU 252 N -0.15 1.70 -0.42 0.89 2.96 0.10 -1.98 118.68 121.77 2b81 s LEU 252 Ca -0.02 -0.30 -0.01 0.00 -0.22 0.00 0.00 54.13 53.58 2b81 s LEU 252 Cb -0.14 -0.83 0.11 0.00 0.50 0.00 0.00 46.19 45.84 2b81 s LEU 252 CO 0.04 0.05 0.20 -0.62 -1.32 0.00 0.00 176.35 174.70 2b81 s ASP 253 N 0.53 5.10 -0.32 3.68 2.15 -0.82 -3.90 116.67 123.09 2b81 s ASP 253 Ca -0.12 -2.19 -0.23 0.00 0.43 0.00 0.00 52.55 50.43 2b81 s ASP 253 Cb -0.15 -1.78 0.00 0.00 -0.30 0.00 0.00 42.92 40.70 2b81 s ASP 253 CO 0.03 -0.48 0.79 -0.22 -0.17 0.00 0.00 175.17 175.12 2b81 s LEU 254 N 0.89 4.09 0.45 -1.34 0.20 -1.26 -2.08 118.68 119.64 2b81 s LEU 254 Ca 0.10 0.58 -0.23 0.00 0.69 0.00 0.00 54.13 55.27 2b81 s LEU 254 Cb -0.22 -3.06 -0.08 0.00 -0.43 0.00 0.00 46.19 42.40 2b81 s LEU 254 CO -0.05 -0.65 1.16 -0.55 -0.29 0.00 0.00 176.35 175.98 2b81 s SER 255 N 1.68 6.26 0.25 3.68 0.15 0.98 -4.72 113.70 121.98 2b81 s SER 255 Ca 0.32 2.29 -0.06 0.00 0.70 0.00 0.00 55.95 59.21 2b81 s SER 255 Cb -0.14 -2.60 0.27 0.00 -1.71 0.00 0.00 66.02 61.84 2b81 s SER 255 CO 0.14 -0.86 1.91 -0.08 1.20 0.00 0.00 173.24 175.56 2b81 h GLU 256 N 2.16 1.28 -6.28 5.44 4.57 -1.95 -3.41 114.58 116.39 2b81 h GLU 256 Ca -0.49 -0.10 -0.57 0.00 -1.18 0.00 0.00 59.36 57.02 2b81 h GLU 256 Cb 1.24 -0.28 -0.06 0.00 -0.16 0.00 0.00 28.75 29.49 2b81 h GLU 256 CO 0.61 0.87 0.85 0.34 -1.18 0.00 0.00 179.01 180.50 2b81 s ASP 257 N -6.18 6.94 0.66 1.04 2.15 -1.26 -4.89 116.67 115.12 2b81 s ASP 257 Ca -0.13 1.12 0.39 0.00 0.43 0.00 0.00 52.55 54.37 2b81 s ASP 257 Cb 0.18 -2.54 2.17 0.00 -0.30 0.00 0.00 42.92 42.42 2b81 s ASP 257 CO 0.82 -0.87 2.25 -0.65 -0.17 0.00 0.00 175.17 176.55 2b81 h PRO 258 N 8.09 0.00 -0.01 4.34 0.11 -1.94 -2.00 132.00 140.60 2b81 h PRO 258 Ca -0.21 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.90 2b81 h PRO 258 Cb 1.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.17 2b81 h PRO 258 CO 1.03 0.00 -0.58 0.09 -0.21 0.00 0.00 178.00 178.32 2b81 n ASN 259 N -3.14 1.19 -4.70 -2.05 3.02 -1.26 -2.36 115.26 105.95 2b81 n ASN 259 Ca -0.02 -0.96 -0.44 0.00 -0.03 0.00 0.00 54.58 53.13 2b81 n ASN 259 Cb 0.16 0.50 -0.02 0.00 -0.61 0.00 0.00 39.78 39.81 2b81 n ASN 259 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 2b81 n GLU 260 N -0.90 2.34 -1.89 3.52 2.13 -0.75 -4.86 120.64 120.22 2b81 n GLU 260 Ca 0.08 0.83 -0.35 0.00 0.66 0.00 0.00 57.16 58.38 2b81 n GLU 260 Cb 0.37 -2.56 0.04 0.00 0.27 0.00 0.00 31.44 29.56 2b81 n GLU 260 CO 0.00 0.00 0.00 -0.98 -0.41 0.00 0.00 177.13 175.74 2b81 s ARG 261 N -0.18 2.83 -0.14 5.31 1.70 -1.26 -1.54 118.95 125.68 2b81 s ARG 261 Ca 0.68 1.71 -0.29 0.00 -0.47 0.00 0.00 55.73 57.36 2b81 s ARG 261 Cb -0.59 -1.92 -0.03 0.00 -0.57 0.00 0.00 34.95 31.84 2b81 s ARG 261 CO 0.47 -1.29 1.47 -1.25 -1.08 0.00 0.00 175.30 173.62 2b81 s PRO 262 N -3.57 4.14 -0.18 3.89 0.04 -1.26 -4.35 135.00 133.71 2b81 s PRO 262 Ca 0.74 1.85 0.01 0.00 0.04 0.00 0.00 61.00 63.64 2b81 s PRO 262 Cb -0.27 -3.89 0.02 0.00 0.04 0.00 0.00 34.50 30.39 2b81 s PRO 262 CO 0.36 -0.86 -0.20 0.99 0.04 0.00 0.00 177.00 177.33 2b81 s THR 263 N 3.98 2.05 -0.03 1.26 2.01 0.21 -4.98 115.64 120.14 2b81 s THR 263 Ca 0.64 -0.95 -0.34 0.00 0.31 0.00 0.00 61.69 61.35 2b81 s THR 263 Cb -0.26 -1.86 -0.12 0.00 0.01 0.00 0.00 72.50 70.26 2b81 s THR 263 CO 0.23 0.53 1.79 -0.81 -0.69 0.00 0.00 174.62 175.66 2b81 n PRO 264 N 4.62 2.12 -4.56 4.92 -0.04 -1.26 0.75 135.00 141.56 2b81 n PRO 264 Ca -0.21 0.78 -0.31 0.00 -0.04 0.00 0.00 63.50 63.72 2b81 n PRO 264 Cb 0.50 -2.59 -0.07 0.00 -0.04 0.00 0.00 33.50 31.30 2b81 n PRO 264 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 2b81 s ILE 265 N 3.16 1.39 -0.27 0.52 -4.36 -0.16 -4.81 121.20 116.67 2b81 s ILE 265 Ca 0.89 -1.89 -0.37 0.00 -0.26 0.00 0.00 60.65 59.02 2b81 s ILE 265 Cb -0.70 -2.28 -0.13 0.00 1.25 0.00 0.00 42.46 40.60 2b81 s ILE 265 CO 0.48 0.00 1.97 -1.14 0.24 0.00 0.00 174.94 176.50 2b81 n ARG 266 N -1.33 1.34 -1.60 0.37 3.00 -1.26 -2.02 116.66 115.18 2b81 n ARG 266 Ca -0.14 0.45 -0.18 0.00 -0.00 0.00 0.00 57.85 57.98 2b81 n ARG 266 Cb 0.66 -2.38 -0.07 0.00 0.00 0.00 0.00 32.46 30.68 2b81 n ARG 266 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 2b81 n LEU 267 N 7.63 -1.34 0.00 6.15 4.77 -1.26 -4.78 117.00 128.18 2b81 n LEU 267 Ca 0.32 0.39 0.00 0.00 -0.03 0.00 0.00 56.01 56.69 2b81 n LEU 267 Cb 0.21 -2.50 0.00 0.00 -2.33 0.00 0.00 43.42 38.80 2b81 n LEU 267 CO 0.77 -0.85 0.00 0.61 -1.33 0.00 0.00 177.39 176.60 2b81 n GLY 268 N -0.83 -0.82 2.92 -0.72 0.00 -0.85 -1.56 105.19 103.31 2b81 n GLY 268 Ca -0.18 -0.18 -0.13 0.00 0.00 0.00 0.00 46.02 45.52 2b81 n GLY 268 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2b81 s TYR 269 N -4.00 0.21 -0.17 1.61 1.51 -0.84 -0.99 117.35 114.68 2b81 s TYR 269 Ca 0.00 -0.09 -0.15 0.00 -1.01 0.00 0.00 57.07 55.82 2b81 s TYR 269 Cb 0.00 -0.14 -0.04 0.00 -0.11 0.00 0.00 41.96 41.67 2b81 s TYR 269 CO 0.00 -0.02 0.35 0.50 -1.11 0.00 0.00 175.55 175.27 2b81 s ARG 270 N -0.22 4.23 0.03 -0.62 3.52 0.23 -1.95 118.95 124.18 2b81 s ARG 270 Ca -0.01 0.17 -0.28 0.00 -0.13 0.00 0.00 55.73 55.48 2b81 s ARG 270 Cb -0.02 -3.47 0.09 0.00 -1.56 0.00 0.00 34.95 29.99 2b81 s ARG 270 CO -0.00 0.12 0.83 -0.08 -0.81 0.00 0.00 175.30 175.37 2b81 s THR 271 N 0.81 0.00 0.55 4.11 -1.32 -0.88 0.65 115.64 119.56 2b81 s THR 271 Ca 0.18 -0.03 -0.04 0.00 -1.21 0.00 0.00 61.69 60.59 2b81 s THR 271 Cb -0.14 -1.04 0.01 0.00 -1.51 0.00 0.00 72.50 69.82 2b81 s THR 271 CO 0.06 0.00 0.84 -0.83 -2.21 0.00 0.00 174.62 172.48 2b81 s GLY 272 N -2.55 1.60 0.45 6.08 0.00 -0.59 -0.02 107.32 112.30 2b81 s GLY 272 Ca 0.04 -0.79 0.11 0.00 0.00 0.00 0.00 44.72 44.08 2b81 s GLY 272 CO -0.09 -0.54 2.08 0.07 0.00 0.00 0.00 173.10 174.62 2b81 h ARG 273 N -0.03 0.30 -0.18 2.90 0.11 -1.78 -1.82 114.38 113.89 2b81 h ARG 273 Ca -0.46 -0.02 -0.02 0.00 0.10 0.00 0.00 59.98 59.59 2b81 h ARG 273 Cb 1.25 -0.07 -0.01 0.00 1.11 0.00 0.00 29.97 32.26 2b81 h ARG 273 CO 0.60 0.22 0.05 0.87 0.10 0.00 0.00 179.97 181.81 2b81 h LYS 274 N 0.31 0.29 -0.09 0.08 1.57 -1.82 -1.92 116.57 114.99 2b81 h LYS 274 Ca 0.08 -0.07 -0.16 0.00 -1.87 0.00 0.00 60.65 58.64 2b81 h LYS 274 Cb 0.00 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.26 2b81 h LYS 274 CO -0.01 0.41 -0.64 0.00 -0.57 0.00 0.00 179.45 178.64 2b81 h ALA 275 N 0.86 0.74 -0.63 3.86 0.00 -1.71 -2.83 119.26 119.56 2b81 h ALA 275 Ca 0.06 -0.56 0.09 0.00 0.00 0.00 0.00 54.91 54.50 2b81 h ALA 275 Cb 0.25 -0.08 -0.07 0.00 0.00 0.00 0.00 17.79 17.89 2b81 h ALA 275 CO -0.00 0.74 0.27 1.25 0.00 0.00 0.00 179.25 181.51 2b81 h LEU 276 N 0.24 0.31 -1.06 0.00 5.85 -1.15 0.27 115.31 119.78 2b81 h LEU 276 Ca -0.01 0.07 0.03 0.00 0.84 0.00 0.00 57.88 58.80 2b81 h LEU 276 Cb 1.17 0.03 -0.05 0.00 0.37 0.00 0.00 40.66 42.17 2b81 h LEU 276 CO 0.11 0.18 0.64 0.40 -0.34 0.00 0.00 178.44 179.43 2b81 h ILE 277 N 0.48 1.19 0.02 4.05 2.04 -1.19 0.12 117.51 124.22 2b81 h ILE 277 Ca 0.31 -0.43 -0.00 0.00 1.00 0.00 0.00 64.86 65.74 2b81 h ILE 277 Cb 0.35 -0.16 0.00 0.00 -0.74 0.00 0.00 36.82 36.27 2b81 h ILE 277 CO -0.28 0.23 -0.01 -0.08 0.00 0.00 0.00 178.15 178.01 2b81 h GLU 278 N 1.25 -0.03 -0.44 2.37 4.57 -1.03 -1.80 114.58 119.47 2b81 h GLU 278 Ca 0.37 0.00 0.09 0.00 -1.18 0.00 0.00 59.36 58.65 2b81 h GLU 278 Cb -0.05 0.01 -0.08 0.00 -0.16 0.00 0.00 28.75 28.47 2b81 h GLU 278 CO -0.10 0.23 -0.12 1.25 -1.18 0.00 0.00 179.01 179.09 2b81 h LEU 279 N -0.29 -0.44 -1.21 1.64 6.46 -0.00 -1.30 115.31 120.16 2b81 h LEU 279 Ca -0.00 0.14 -0.06 0.00 -0.12 0.00 0.00 57.88 57.83 2b81 h LEU 279 Cb 0.28 0.29 -0.02 0.00 -0.73 0.00 0.00 40.66 40.48 2b81 h LEU 279 CO 0.01 -0.16 -0.10 -0.07 -0.62 0.00 0.00 178.44 177.50 2b81 h LEU 280 N -0.01 0.40 -0.80 2.25 3.38 -0.66 -0.43 115.31 119.43 2b81 h LEU 280 Ca 0.21 -0.09 -0.11 0.00 0.09 0.00 0.00 57.88 57.98 2b81 h LEU 280 Cb 0.34 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 2b81 h LEU 280 CO -0.46 0.54 -0.33 0.44 0.09 0.00 0.00 178.44 178.73 2b81 h ASP 281 N 0.40 0.54 0.25 -0.43 3.32 -0.69 0.14 116.42 119.95 2b81 h ASP 281 Ca 0.08 -0.21 -0.01 0.00 0.02 0.00 0.00 57.03 56.91 2b81 h ASP 281 Cb 0.42 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.83 2b81 h ASP 281 CO 0.02 0.83 -0.12 0.40 -1.72 0.00 0.00 179.24 178.65 2b81 h ILE 282 N 0.45 0.80 -0.71 0.35 2.04 -0.49 -1.09 117.51 118.86 2b81 h ILE 282 Ca 0.05 -0.49 0.15 0.00 1.00 0.00 0.00 64.86 65.57 2b81 h ILE 282 Cb 0.78 1.08 -0.10 0.00 -0.74 0.00 0.00 36.82 37.84 2b81 h ILE 282 CO 0.06 0.11 0.17 1.88 0.00 0.00 0.00 178.15 180.37 2b81 h TYR 283 N -0.60 0.27 -0.90 1.37 0.99 -0.96 0.16 116.97 117.30 2b81 h TYR 283 Ca -0.03 0.04 0.08 0.00 2.00 0.00 0.00 58.73 60.81 2b81 h TYR 283 Cb 0.43 -0.01 -0.06 0.00 1.00 0.00 0.00 36.73 38.09 2b81 h TYR 283 CO 0.01 -0.07 0.58 -0.22 -0.00 0.00 0.00 178.16 178.46 2b81 h LYS 284 N 0.28 0.94 -0.02 4.88 3.64 -0.55 -2.04 116.57 123.70 2b81 h LYS 284 Ca 0.39 -0.06 -0.19 0.00 -1.27 0.00 0.00 60.65 59.53 2b81 h LYS 284 Cb 0.65 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 32.25 2b81 h LYS 284 CO -0.48 0.62 -0.82 0.66 -2.27 0.00 0.00 179.45 177.16 2b81 h SER 285 N 0.97 0.31 0.88 4.20 4.64 0.63 -2.86 113.55 122.31 2b81 h SER 285 Ca 0.40 -0.23 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 2b81 h SER 285 Cb 0.28 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 2b81 h SER 285 CO -0.16 1.00 0.00 2.30 -0.87 0.00 0.00 176.83 179.10 2b81 n ILE 286 N -3.72 0.14 0.00 0.95 -5.35 -0.69 -4.91 119.36 105.78 2b81 n ILE 286 Ca -0.04 0.04 0.00 0.00 -0.27 0.00 0.00 62.75 62.48 2b81 n ILE 286 Cb 0.76 -0.57 0.00 0.00 -1.74 0.00 0.00 39.64 38.09 2b81 n ILE 286 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2b81 n GLY 287 N 1.25 1.62 3.74 3.28 0.00 -1.00 -4.80 105.19 109.28 2b81 n GLY 287 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 2b81 n GLY 287 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b81 s VAL 288 N -2.00 3.48 -0.08 1.61 1.01 -0.80 -4.41 120.40 119.20 2b81 s VAL 288 Ca 0.00 1.26 0.10 0.00 0.00 0.00 0.00 61.98 63.34 2b81 s VAL 288 Cb 0.00 -3.81 -0.14 0.00 0.00 0.00 0.00 36.38 32.43 2b81 s VAL 288 CO 0.00 0.21 0.09 0.59 0.00 0.00 0.00 175.10 175.99 2b81 n ASN 289 N 2.38 2.39 -3.75 3.32 4.13 -0.13 -4.35 115.26 119.25 2b81 n ASN 289 Ca 0.04 0.00 -0.12 0.00 1.68 0.00 0.00 54.58 56.18 2b81 n ASN 289 Cb 0.44 0.94 -0.12 0.00 -1.54 0.00 0.00 39.78 39.50 2b81 n ASN 289 CO 0.00 0.00 0.00 -2.28 0.28 0.00 0.00 177.26 175.26 2b81 s HIS 290 N -2.38 -0.34 -0.04 3.10 5.04 -1.16 -1.08 115.29 118.42 2b81 s HIS 290 Ca -0.05 0.81 0.02 0.00 -1.54 0.00 0.00 55.06 54.30 2b81 s HIS 290 Cb 0.04 0.09 0.01 0.00 0.04 0.00 0.00 32.58 32.77 2b81 s HIS 290 CO 0.44 -0.21 -0.08 -1.17 -2.34 0.00 0.00 174.74 171.39 2b81 s LEU 291 N 0.80 1.56 -0.04 8.88 0.20 -0.70 -1.85 118.68 127.53 2b81 s LEU 291 Ca -0.05 -0.18 0.07 0.00 0.69 0.00 0.00 54.13 54.65 2b81 s LEU 291 Cb -0.07 -0.56 -0.01 0.00 -0.43 0.00 0.00 46.19 45.12 2b81 s LEU 291 CO -0.05 0.00 -0.24 0.72 -0.29 0.00 0.00 176.35 176.49 2b81 s PHE 292 N 0.62 2.25 -0.21 5.38 -0.12 -0.60 -0.52 117.98 124.78 2b81 s PHE 292 Ca -0.10 -0.54 -0.12 0.00 -0.05 0.00 0.00 56.93 56.13 2b81 s PHE 292 Cb -0.13 -1.47 -0.05 0.00 -0.63 0.00 0.00 43.02 40.75 2b81 s PHE 292 CO 0.01 -0.12 0.21 -0.51 -0.05 0.00 0.00 175.22 174.77 2b81 s LEU 293 N -0.37 4.18 -0.24 -1.99 1.43 -0.12 -4.35 118.68 117.21 2b81 s LEU 293 Ca 0.03 0.29 -0.09 0.00 -1.03 0.00 0.00 54.13 53.33 2b81 s LEU 293 Cb -0.11 -2.22 -0.04 0.00 0.03 0.00 0.00 46.19 43.85 2b81 s LEU 293 CO 0.01 0.09 0.13 0.00 0.23 0.00 0.00 176.35 176.80 2b81 s ALA 294 N 0.75 3.44 -0.79 4.21 0.00 -1.26 -0.69 121.76 127.43 2b81 s ALA 294 Ca 0.11 -0.97 0.16 0.00 0.00 0.00 0.00 51.96 51.26 2b81 s ALA 294 Cb -0.13 -2.22 0.60 0.00 0.00 0.00 0.00 23.12 21.37 2b81 s ALA 294 CO 0.03 -0.28 1.52 1.28 0.00 0.00 0.00 175.76 178.30 2b81 n LEU 295 N 4.49 4.27 -0.18 0.00 4.77 -1.26 -0.72 117.00 128.36 2b81 n LEU 295 Ca -0.15 -2.54 -0.01 0.00 -0.03 0.00 0.00 56.01 53.28 2b81 n LEU 295 Cb 0.52 -0.51 0.22 0.00 -2.33 0.00 0.00 43.42 41.32 2b81 n LEU 295 CO 0.34 0.75 1.13 -0.26 -1.33 0.00 0.00 177.39 178.01 2b81 h PHE 296 N 3.11 0.92 -0.11 -1.77 0.05 -1.83 -2.87 116.94 114.44 2b81 h PHE 296 Ca 0.00 -0.02 0.00 0.00 3.82 0.00 0.00 57.97 61.77 2b81 h PHE 296 Cb 1.35 -0.29 0.00 0.00 2.00 0.00 0.00 35.95 39.01 2b81 h PHE 296 CO 0.62 0.65 0.00 -0.25 -0.18 0.00 0.00 178.31 179.15 2b81 n ASP 297 N -4.36 2.98 -4.74 2.17 8.00 -1.26 -0.45 116.55 118.88 2b81 n ASP 297 Ca 0.06 -1.96 -0.37 0.00 0.71 0.00 0.00 54.79 53.23 2b81 n ASP 297 Cb 0.11 -0.05 0.06 0.00 -0.02 0.00 0.00 41.12 41.22 2b81 n ASP 297 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2b81 s GLY 298 N -1.89 2.86 0.10 0.44 0.00 -1.08 -4.86 107.32 102.88 2b81 s GLY 298 Ca 0.31 1.22 -0.13 0.00 0.00 0.00 0.00 44.72 46.12 2b81 s GLY 298 CO 0.31 1.66 1.31 -1.61 0.00 0.00 0.00 173.10 174.76 2b81 h GLN 299 N 0.78 0.80 -6.48 2.90 -0.00 -1.90 -3.46 115.11 107.74 2b81 h GLN 299 Ca -0.51 -0.65 -0.53 0.00 -0.00 0.00 0.00 58.65 56.96 2b81 h GLN 299 Cb 1.33 0.14 -0.03 0.00 0.00 0.00 0.00 27.48 28.91 2b81 h GLN 299 CO 0.54 1.26 -0.04 1.03 0.00 0.00 0.00 178.83 181.62 2b81 s ARG 300 N -3.75 3.93 0.53 1.69 0.52 -1.26 -5.05 118.95 115.56 2b81 s ARG 300 Ca -0.10 0.47 -0.20 0.00 -0.52 0.00 0.00 55.73 55.37 2b81 s ARG 300 Cb 0.09 -2.69 -0.08 0.00 0.52 0.00 0.00 34.95 32.79 2b81 s ARG 300 CO 0.91 0.33 0.84 -2.30 0.02 0.00 0.00 175.30 175.09 2b81 n PRO 301 N 0.12 0.91 0.14 3.54 -0.02 -1.26 -4.75 135.00 133.68 2b81 n PRO 301 Ca -0.01 0.34 0.03 0.00 -2.02 0.00 0.00 63.50 61.84 2b81 n PRO 301 Cb 0.52 -1.97 0.39 0.00 -0.02 0.00 0.00 33.50 32.43 2b81 n PRO 301 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2b81 h ALA 302 N 0.75 1.50 -0.27 3.55 0.00 -1.89 -2.94 119.26 119.97 2b81 h ALA 302 Ca -0.46 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.22 2b81 h ALA 302 Cb 1.37 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 2b81 h ALA 302 CO 0.52 0.36 0.16 0.38 0.00 0.00 0.00 179.25 180.66 2b81 h ASP 303 N 0.17 0.32 0.12 0.00 3.04 -1.89 0.21 116.42 118.38 2b81 h ASP 303 Ca 0.03 -0.06 -0.12 0.00 -3.24 0.00 0.00 57.03 53.64 2b81 h ASP 303 Cb 0.42 -0.08 -0.01 0.00 -1.04 0.00 0.00 39.33 38.62 2b81 h ASP 303 CO 0.03 0.29 -0.43 1.05 -2.04 0.00 0.00 179.24 178.13 2b81 h GLU 304 N 0.33 0.39 -0.49 4.15 4.11 -1.92 -1.73 114.58 119.42 2b81 h GLU 304 Ca 0.09 -0.20 -0.10 0.00 0.07 0.00 0.00 59.36 59.22 2b81 h GLU 304 Cb 0.03 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 2b81 h GLU 304 CO -0.02 0.76 -0.08 0.28 0.07 0.00 0.00 179.01 180.02 2b81 h VAL 305 N 0.32 1.27 -0.76 -1.06 2.07 -1.29 -1.69 116.25 115.12 2b81 h VAL 305 Ca 0.02 -1.20 -0.02 0.00 0.82 0.00 0.00 66.70 66.32 2b81 h VAL 305 Cb 0.90 1.04 -0.03 0.00 -1.52 0.00 0.00 31.29 31.67 2b81 h VAL 305 CO 0.08 0.42 0.38 0.25 0.02 0.00 0.00 177.57 178.71 2b81 h LEU 306 N 0.78 0.98 0.10 2.57 5.85 -0.38 -0.91 115.31 124.30 2b81 h LEU 306 Ca 0.13 -0.13 -0.00 0.00 0.84 0.00 0.00 57.88 58.72 2b81 h LEU 306 Cb 0.62 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 41.40 2b81 h LEU 306 CO 0.04 0.83 -0.05 0.44 -0.34 0.00 0.00 178.44 179.36 2b81 h ASP 307 N 1.06 -0.11 -0.70 1.25 3.32 -1.09 -0.31 116.42 119.83 2b81 h ASP 307 Ca 0.26 0.00 0.05 0.00 0.02 0.00 0.00 57.03 57.37 2b81 h ASP 307 Cb 0.10 0.03 -0.05 0.00 0.22 0.00 0.00 39.33 39.62 2b81 h ASP 307 CO -0.04 -0.08 0.41 -0.08 -1.72 0.00 0.00 179.24 177.73 2b81 h GLU 308 N -0.14 0.74 -0.67 3.56 4.81 -1.11 0.83 114.58 122.59 2b81 h GLU 308 Ca -0.01 -0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.14 2b81 h GLU 308 Cb 0.11 -0.17 -0.03 0.00 0.63 0.00 0.00 28.75 29.29 2b81 h GLU 308 CO 0.02 0.49 0.28 -0.07 -0.73 0.00 0.00 179.01 179.00 2b81 h LEU 309 N 0.76 0.92 -0.31 1.64 3.38 -0.97 0.80 115.31 121.53 2b81 h LEU 309 Ca 0.30 -0.16 -0.15 0.00 0.09 0.00 0.00 57.88 57.96 2b81 h LEU 309 Cb 0.15 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.65 2b81 h LEU 309 CO -0.16 0.83 -0.39 1.23 0.09 0.00 0.00 178.44 180.03 2b81 h GLY 310 N 0.95 0.89 0.84 0.83 0.00 -0.39 0.25 103.07 106.44 2b81 h GLY 310 Ca 0.23 -0.96 -0.13 0.00 0.00 0.00 0.00 47.33 46.47 2b81 h GLY 310 CO -0.02 0.86 -0.46 0.83 0.00 0.00 0.00 176.54 177.75 2b81 h GLU 311 N 0.58 0.49 0.00 4.80 5.08 -0.80 -3.38 114.58 121.35 2b81 h GLU 311 Ca 0.04 -0.39 -0.12 0.00 -1.00 0.00 0.00 59.36 57.89 2b81 h GLU 311 Cb 0.99 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 30.29 2b81 h GLU 311 CO 0.09 1.02 -1.86 0.39 -1.00 0.00 0.00 179.01 177.66 2b81 n GLU 312 N -4.27 0.96 -0.07 2.33 -0.58 0.27 -4.74 120.64 114.53 2b81 n GLU 312 Ca -0.08 -0.09 -0.15 0.00 -0.42 0.00 0.00 57.16 56.43 2b81 n GLU 312 Cb 0.58 -1.38 -0.06 0.00 -0.57 0.00 0.00 31.44 30.01 2b81 n GLU 312 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 2b81 n VAL 313 N -2.27 0.82 -0.34 2.62 0.31 -0.16 -4.67 118.33 114.64 2b81 n VAL 313 Ca -0.12 -0.23 0.13 0.00 -0.01 0.00 0.00 64.34 64.11 2b81 n VAL 313 Cb 0.66 -1.56 0.34 0.00 -0.91 0.00 0.00 33.84 32.37 2b81 n VAL 313 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2b81 h LEU 314 N -0.43 0.75 -2.11 7.52 -0.00 -1.22 -0.42 115.31 119.39 2b81 h LEU 314 Ca -0.37 0.08 0.08 0.00 -0.00 0.00 0.00 57.88 57.67 2b81 h LEU 314 Cb 1.36 -0.06 -0.01 0.00 -0.00 0.00 0.00 40.66 41.95 2b81 h LEU 314 CO -0.20 0.29 0.30 -0.65 -0.00 0.00 0.00 178.44 178.19 2b81 h PRO 315 N 0.74 0.00 0.00 1.13 0.11 -1.83 0.11 132.00 132.26 2b81 h PRO 315 Ca 0.55 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.66 2b81 h PRO 315 Cb 0.88 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.99 2b81 h PRO 315 CO -0.33 0.00 -0.26 0.72 -0.21 0.00 0.00 178.00 177.92 2b81 n HIS 316 N -3.78 0.37 -3.18 0.65 8.25 -0.17 -4.24 115.22 113.13 2b81 n HIS 316 Ca 0.04 0.11 -0.21 0.00 -0.26 0.00 0.00 57.72 57.40 2b81 n HIS 316 Cb 0.45 -0.60 -0.05 0.00 1.12 0.00 0.00 29.99 30.91 2b81 n HIS 316 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 2b81 n PHE 317 N -1.84 -0.22 -2.00 4.41 3.01 0.32 -5.06 117.46 116.08 2b81 n PHE 317 Ca 0.05 -3.63 -0.32 0.00 1.01 0.00 0.00 57.45 54.57 2b81 n PHE 317 Cb 0.39 -0.34 0.01 0.00 -0.01 0.00 0.00 39.48 39.53 2b81 n PHE 317 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 2b81 s PRO 318 N -1.63 3.42 0.30 -1.08 0.04 -0.83 -4.25 135.00 130.97 2b81 s PRO 318 Ca 0.37 1.02 -0.28 0.00 0.04 0.00 0.00 61.00 62.15 2b81 s PRO 318 Cb 0.24 -2.05 -0.14 0.00 0.04 0.00 0.00 34.50 32.59 2b81 s PRO 318 CO -0.10 -0.71 1.05 0.00 0.04 0.00 0.00 177.00 177.28 2b81 n ALA 319 N -2.28 0.03 1.71 8.56 0.00 -1.21 -4.83 120.51 122.51 2b81 n ALA 319 Ca 0.08 0.38 0.15 0.00 0.00 0.00 0.00 53.44 54.04 2b81 n ALA 319 Cb 0.53 -2.06 0.70 0.00 0.00 0.00 0.00 19.45 18.63 2b81 n ALA 319 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78