#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r98 s SER 6 N 0.00 5.76 0.19 -2.24 1.04 -1.26 -4.91 113.70 112.28 2r98 s SER 6 Ca 0.00 1.88 -0.20 0.00 0.48 0.00 0.00 55.95 58.11 2r98 s SER 6 Cb 0.00 -2.54 0.13 0.00 0.10 0.00 0.00 66.02 63.71 2r98 s SER 6 CO 0.00 -1.18 1.59 0.15 0.98 0.00 0.00 173.24 174.78 2r98 h PHE 7 N 0.58 -0.85 -0.97 5.02 3.57 -2.05 -1.17 116.94 121.07 2r98 h PHE 7 Ca -0.47 0.07 0.04 0.00 3.53 0.00 0.00 57.97 61.14 2r98 h PHE 7 Cb 1.23 0.46 -0.06 0.00 2.79 0.00 0.00 35.95 40.37 2r98 h PHE 7 CO 0.57 -0.37 0.63 0.28 -2.23 0.00 0.00 178.31 177.19 2r98 h VAL 8 N -0.16 1.15 -0.31 1.41 2.07 -1.98 0.10 116.25 118.53 2r98 h VAL 8 Ca 0.23 -0.41 -0.08 0.00 0.82 0.00 0.00 66.70 67.26 2r98 h VAL 8 Cb 0.54 -0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 30.15 2r98 h VAL 8 CO -0.66 0.22 -0.12 0.00 0.02 0.00 0.00 177.57 177.03 2r98 h ALA 9 N 1.45 0.43 0.31 1.67 0.00 -1.85 0.54 119.26 121.80 2r98 h ALA 9 Ca 0.39 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 2r98 h ALA 9 Cb 0.05 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2r98 h ALA 9 CO -0.13 0.30 -0.23 0.45 0.00 0.00 0.00 179.25 179.64 2r98 h HIS 10 N 0.38 -0.61 -0.78 0.00 -0.00 -0.49 -1.90 115.15 111.75 2r98 h HIS 10 Ca 0.07 -0.00 0.08 0.00 -0.00 0.00 0.00 60.37 60.52 2r98 h HIS 10 Cb 0.63 0.23 -0.07 0.00 -0.00 0.00 0.00 27.41 28.20 2r98 h HIS 10 CO 0.06 -0.35 0.45 0.35 -0.00 0.00 0.00 177.93 178.43 2r98 h PHE 11 N -0.54 0.82 0.00 2.45 -0.00 -0.83 -0.75 116.94 118.08 2r98 h PHE 11 Ca -0.02 0.03 -0.02 0.00 -0.00 0.00 0.00 57.97 57.95 2r98 h PHE 11 Cb 0.47 -0.25 -0.00 0.00 -0.00 0.00 0.00 35.95 36.17 2r98 h PHE 11 CO -0.12 0.36 -0.10 0.00 -0.00 0.00 0.00 178.31 178.44 2r98 h ARG 12 N 0.78 0.00 0.14 1.11 3.08 -0.85 -1.95 114.38 116.69 2r98 h ARG 12 Ca 0.37 0.00 -0.23 0.00 0.07 0.00 0.00 59.98 60.19 2r98 h ARG 12 Cb 0.29 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.35 2r98 h ARG 12 CO -0.22 0.10 -1.06 1.49 -1.07 0.00 0.00 179.97 179.21 2r98 h GLU 13 N 0.00 0.31 -0.57 0.04 4.81 -0.95 -3.11 114.58 115.11 2r98 h GLU 13 Ca -0.00 -0.52 0.16 0.00 -0.13 0.00 0.00 59.36 58.87 2r98 h GLU 13 Cb 0.42 0.19 -0.02 0.00 0.63 0.00 0.00 28.75 29.97 2r98 h GLU 13 CO 0.01 1.25 0.43 0.00 -0.73 0.00 0.00 179.01 179.97 2r98 h ALA 14 N 0.05 2.49 -0.17 2.92 0.00 -0.94 -3.37 119.26 120.23 2r98 h ALA 14 Ca -0.20 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 54.73 2r98 h ALA 14 Cb 1.73 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 19.52 2r98 h ALA 14 CO 0.14 -0.72 -0.12 0.00 0.00 0.00 0.00 179.25 178.55 2r98 h ALA 15 N 1.67 0.02 0.00 0.00 0.00 -1.28 0.66 119.26 120.33 2r98 h ALA 15 Ca 0.27 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.23 2r98 h ALA 15 Cb 1.12 0.26 -0.00 0.00 0.00 0.00 0.00 17.79 19.18 2r98 h ALA 15 CO -0.00 -0.55 -0.06 -1.00 0.00 0.00 0.00 179.25 177.63 2r98 h PRO 16 N -0.12 0.00 0.00 0.00 0.13 -1.77 -1.96 132.00 128.28 2r98 h PRO 16 Ca 0.10 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 65.05 2r98 h PRO 16 Cb 0.27 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.37 2r98 h PRO 16 CO -0.25 0.06 -1.05 1.88 -0.23 0.00 0.00 178.00 178.42 2r98 h TYR 17 N 0.00 0.00 -0.71 1.56 -1.99 -1.48 -2.39 116.97 111.97 2r98 h TYR 17 Ca -0.00 0.00 -0.05 0.00 2.00 0.00 0.00 58.73 60.68 2r98 h TYR 17 Cb 0.28 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 38.98 2r98 h TYR 17 CO 0.00 0.77 0.26 0.82 -0.00 0.00 0.00 178.16 180.00 2r98 h ILE 18 N 0.00 1.25 -0.59 -2.88 2.04 -0.66 -3.00 117.51 113.67 2r98 h ILE 18 Ca -0.08 -0.80 -0.08 0.00 1.00 0.00 0.00 64.86 64.89 2r98 h ILE 18 Cb 1.66 0.43 -0.02 0.00 -0.74 0.00 0.00 36.82 38.14 2r98 h ILE 18 CO 0.09 0.32 0.06 -0.09 0.00 0.00 0.00 178.15 178.53 2r98 h ARG 19 N 1.03 0.99 -1.15 2.37 2.43 -1.31 -2.65 114.38 116.09 2r98 h ARG 19 Ca 0.23 -0.29 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 2r98 h ARG 19 Cb 0.23 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.68 2r98 h ARG 19 CO -0.02 0.96 0.00 1.04 -1.51 0.00 0.00 179.97 180.44 2r98 n GLN 20 N -4.28 0.21 -1.81 0.20 6.02 -0.91 -4.93 117.38 111.88 2r98 n GLN 20 Ca 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.02 2r98 n GLN 20 Cb 0.30 -1.28 0.00 0.00 1.02 0.00 0.00 30.24 30.28 2r98 n GLN 20 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 177.06 173.92 2r98 n ARG 22 N 0.69 -3.77 -0.88 -1.09 0.63 -1.00 -4.74 116.66 106.50 2r98 n ARG 22 Ca 0.00 2.72 0.00 0.00 -0.92 0.00 0.00 57.85 59.65 2r98 n ARG 22 Cb 0.08 -3.15 0.00 0.00 0.45 0.00 0.00 32.46 29.85 2r98 n ARG 22 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2r98 n GLY 23 N 0.59 0.27 3.88 5.14 0.00 0.17 -4.99 105.19 110.24 2r98 n GLY 23 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 2r98 n GLY 23 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2r98 s THR 24 N -1.68 4.85 -0.17 2.61 2.01 -1.26 -4.84 115.64 117.16 2r98 s THR 24 Ca 0.00 0.52 -0.07 0.00 0.31 0.00 0.00 61.69 62.45 2r98 s THR 24 Cb 0.00 -3.69 -0.04 0.00 0.01 0.00 0.00 72.50 68.78 2r98 s THR 24 CO 0.00 -0.33 0.06 -0.89 -0.69 0.00 0.00 174.62 172.76 2r98 s THR 25 N -2.13 4.74 -0.12 -0.82 2.01 -1.26 -0.88 115.64 117.17 2r98 s THR 25 Ca 0.49 -0.05 0.01 0.00 0.31 0.00 0.00 61.69 62.45 2r98 s THR 25 Cb -0.11 -3.12 0.02 0.00 0.01 0.00 0.00 72.50 69.30 2r98 s THR 25 CO 0.27 0.48 -0.14 -0.22 -0.69 0.00 0.00 174.62 174.32 2r98 s LEU 26 N 0.21 1.66 -0.21 4.42 0.20 0.67 -2.44 118.68 123.19 2r98 s LEU 26 Ca 0.04 -0.44 -0.15 0.00 0.69 0.00 0.00 54.13 54.27 2r98 s LEU 26 Cb -0.12 -1.10 -0.04 0.00 -0.43 0.00 0.00 46.19 44.50 2r98 s LEU 26 CO 0.01 -0.02 0.36 -0.69 -0.29 0.00 0.00 176.35 175.72 2r98 s VAL 27 N 1.23 5.22 -0.30 1.68 1.01 -0.30 -1.86 120.40 127.08 2r98 s VAL 27 Ca -0.01 0.62 -0.06 0.00 0.00 0.00 0.00 61.98 62.53 2r98 s VAL 27 Cb -0.14 -3.70 0.02 0.00 0.00 0.00 0.00 36.38 32.56 2r98 s VAL 27 CO -0.06 0.25 0.08 0.00 0.00 0.00 0.00 175.10 175.37 2r98 s ALA 28 N 1.36 3.04 -0.42 5.51 0.00 0.12 -0.15 121.76 131.21 2r98 s ALA 28 Ca 0.17 -1.53 -0.25 0.00 0.00 0.00 0.00 51.96 50.36 2r98 s ALA 28 Cb -0.15 -2.15 0.02 0.00 0.00 0.00 0.00 23.12 20.84 2r98 s ALA 28 CO 0.08 -1.02 0.88 0.20 0.00 0.00 0.00 175.76 175.89 2r98 s GLY 29 N 1.46 1.55 -0.20 0.00 0.00 0.28 -0.83 107.32 109.58 2r98 s GLY 29 Ca 0.01 -0.72 -0.06 0.00 0.00 0.00 0.00 44.72 43.95 2r98 s GLY 29 CO 0.02 1.94 0.03 -0.42 0.00 0.00 0.00 173.10 174.67 2r98 s ILE 30 N 3.50 4.29 0.30 0.90 1.01 0.37 -1.51 121.20 130.07 2r98 s ILE 30 Ca 0.35 -0.20 -0.29 0.00 0.00 0.00 0.00 60.65 60.51 2r98 s ILE 30 Cb -0.11 -2.95 -0.11 0.00 0.01 0.00 0.00 42.46 39.30 2r98 s ILE 30 CO 0.22 0.42 1.50 -0.62 0.00 0.00 0.00 174.94 176.47 2r98 s ASP 31 N 0.89 6.47 0.00 3.58 3.68 -0.93 -1.68 116.67 128.68 2r98 s ASP 31 Ca 0.02 2.88 0.28 0.00 2.13 0.00 0.00 52.55 57.85 2r98 s ASP 31 Cb -0.14 -2.64 1.19 0.00 -1.45 0.00 0.00 42.92 39.88 2r98 s ASP 31 CO 0.02 -0.82 1.89 0.61 0.13 0.00 0.00 175.17 177.00 2r98 n GLY 32 N 1.66 -1.44 0.30 2.66 0.00 -1.25 -2.50 105.19 104.62 2r98 n GLY 32 Ca 0.05 -0.10 0.19 0.00 0.00 0.00 0.00 46.02 46.16 2r98 n GLY 32 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2r98 h ARG 33 N 0.00 0.00 0.00 1.61 -0.00 -1.90 -2.43 114.38 111.65 2r98 h ARG 33 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.48 2r98 h ARG 33 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.43 2r98 h ARG 33 CO 0.00 0.03 -0.11 1.28 0.00 0.00 0.00 179.97 181.17 2r98 n LEU 34 N -3.25 0.55 -1.66 3.04 4.77 -1.04 -3.90 117.00 115.50 2r98 n LEU 34 Ca -0.02 0.48 -0.13 0.00 -0.03 0.00 0.00 56.01 56.31 2r98 n LEU 34 Cb 0.18 -0.35 0.08 0.00 -2.33 0.00 0.00 43.42 40.99 2r98 n LEU 34 CO 0.25 -0.10 0.96 0.18 -1.33 0.00 0.00 177.39 177.35 2r98 n LEU 35 N -1.98 5.19 0.00 2.23 4.77 -0.92 -3.03 117.00 123.25 2r98 n LEU 35 Ca 0.06 -2.70 0.00 0.00 -0.03 0.00 0.00 56.01 53.34 2r98 n LEU 35 Cb 0.40 -0.75 0.00 0.00 -2.33 0.00 0.00 43.42 40.74 2r98 n LEU 35 CO 0.30 0.87 0.00 -0.62 -1.33 0.00 0.00 177.39 176.61 2r98 n GLU 36 N -0.15 0.00 0.00 3.23 1.02 -1.25 -4.94 120.64 118.54 2r98 n GLU 36 Ca 0.29 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.43 2r98 n GLU 36 Cb 0.96 -0.43 0.00 0.00 -0.02 0.00 0.00 31.44 31.95 2r98 n GLU 36 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2r98 n GLY 37 N 0.65 1.43 0.00 0.62 0.00 -1.26 -4.84 105.19 101.79 2r98 n GLY 37 Ca 0.00 -1.65 0.06 0.00 0.00 0.00 0.00 46.02 44.44 2r98 n GLY 37 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2r98 n GLY 38 N 5.00 -0.96 0.18 -0.02 0.00 -1.26 -3.76 105.19 104.37 2r98 n GLY 38 Ca 0.00 -0.08 0.13 0.00 0.00 0.00 0.00 46.02 46.07 2r98 n GLY 38 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2r98 h THR 39 N 0.00 0.00 0.04 2.61 1.35 -1.89 -3.23 112.91 111.80 2r98 h THR 39 Ca 0.00 -0.76 -0.12 0.00 -0.55 0.00 0.00 66.41 64.98 2r98 h THR 39 Cb 0.00 1.75 0.01 0.00 -1.73 0.00 0.00 68.15 68.18 2r98 h THR 39 CO 0.00 0.00 -0.51 0.25 -0.25 0.00 0.00 175.52 175.01 2r98 h LEU 40 N 0.00 0.37 -0.30 3.87 6.46 -1.63 -2.63 115.31 121.46 2r98 h LEU 40 Ca 0.00 -0.85 -0.12 0.00 -0.12 0.00 0.00 57.88 56.80 2r98 h LEU 40 Cb 0.86 -0.12 -0.01 0.00 -0.73 0.00 0.00 40.66 40.67 2r98 h LEU 40 CO 0.00 1.18 -0.27 0.78 -0.62 0.00 0.00 178.44 179.51 2r98 h ASN 41 N -0.39 0.75 -0.58 1.25 2.35 -1.79 0.75 115.58 117.93 2r98 h ASN 41 Ca -0.08 -0.46 0.10 0.00 -0.55 0.00 0.00 56.30 55.32 2r98 h ASN 41 Cb 1.30 -0.21 -0.08 0.00 0.05 0.00 0.00 38.32 39.37 2r98 h ASN 41 CO 0.10 1.06 0.13 0.50 -1.65 0.00 0.00 177.43 177.56 2r98 h LYS 42 N 0.45 0.26 -0.00 0.81 1.63 -1.68 -1.68 116.57 116.36 2r98 h LYS 42 Ca 0.05 -0.02 -0.00 0.00 -0.85 0.00 0.00 60.65 59.83 2r98 h LYS 42 Cb 0.83 -0.06 -0.00 0.00 -0.60 0.00 0.00 32.23 32.40 2r98 h LYS 42 CO 0.07 0.17 -0.00 1.25 -3.45 0.00 0.00 179.45 177.49 2r98 h LEU 43 N 0.27 0.00 -0.26 5.20 6.46 -1.15 -2.14 115.31 123.70 2r98 h LEU 43 Ca 0.30 -0.54 0.06 0.00 -0.12 0.00 0.00 57.88 57.59 2r98 h LEU 43 Cb 0.43 -0.00 -0.07 0.00 -0.73 0.00 0.00 40.66 40.29 2r98 h LEU 43 CO -0.38 0.54 -0.25 0.00 -0.62 0.00 0.00 178.44 177.73 2r98 h ALA 44 N 0.46 -0.13 -0.57 1.25 0.00 -0.91 0.70 119.26 120.07 2r98 h ALA 44 Ca 0.00 0.08 0.11 0.00 0.00 0.00 0.00 54.91 55.10 2r98 h ALA 44 Cb 0.54 0.52 -0.11 0.00 0.00 0.00 0.00 17.79 18.73 2r98 h ALA 44 CO 0.00 -0.67 -0.25 0.00 0.00 0.00 0.00 179.25 178.33 2r98 h ALA 45 N 0.80 0.16 -0.38 0.00 0.00 -1.29 0.20 119.26 118.74 2r98 h ALA 45 Ca 0.14 0.19 -0.12 0.00 0.00 0.00 0.00 54.91 55.12 2r98 h ALA 45 Cb 0.47 0.62 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 2r98 h ALA 45 CO -0.40 -0.56 -0.27 -0.44 0.00 0.00 0.00 179.25 177.58 2r98 h ASP 46 N -0.10 0.81 -0.63 0.00 3.32 -1.06 -2.45 116.42 116.31 2r98 h ASP 46 Ca 0.25 -0.31 -0.08 0.00 0.02 0.00 0.00 57.03 56.92 2r98 h ASP 46 Cb 0.51 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.81 2r98 h ASP 46 CO -0.63 1.03 0.10 0.40 -1.72 0.00 0.00 179.24 178.41 2r98 h ILE 47 N 0.67 1.26 -0.72 0.35 2.04 -0.40 -1.13 117.51 119.58 2r98 h ILE 47 Ca 0.08 -1.02 0.08 0.00 1.00 0.00 0.00 64.86 65.00 2r98 h ILE 47 Cb 0.79 0.65 -0.05 0.00 -0.74 0.00 0.00 36.82 37.48 2r98 h ILE 47 CO 0.07 0.38 0.47 1.23 0.00 0.00 0.00 178.15 180.30 2r98 h GLY 48 N 1.04 0.92 0.61 5.37 0.00 -0.20 -0.89 103.07 109.92 2r98 h GLY 48 Ca 0.20 -0.28 -0.08 0.00 0.00 0.00 0.00 47.33 47.16 2r98 h GLY 48 CO 0.01 0.19 -0.30 -2.00 0.00 0.00 0.00 176.54 174.45 2r98 h LEU 49 N 0.69 0.33 -0.80 3.11 6.46 -0.89 -2.40 115.31 121.81 2r98 h LEU 49 Ca 0.32 -0.68 0.13 0.00 -0.12 0.00 0.00 57.88 57.52 2r98 h LEU 49 Cb 0.34 -0.10 -0.09 0.00 -0.73 0.00 0.00 40.66 40.09 2r98 h LEU 49 CO -0.11 0.97 0.40 -0.07 -0.62 0.00 0.00 178.44 179.00 2r98 h LEU 50 N -0.28 0.49 -0.43 2.25 3.38 -1.03 0.15 115.31 119.84 2r98 h LEU 50 Ca -0.03 0.08 0.09 0.00 0.09 0.00 0.00 57.88 58.11 2r98 h LEU 50 Cb 0.97 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.64 2r98 h LEU 50 CO 0.06 0.23 -0.15 -1.28 0.09 0.00 0.00 178.44 177.39 2r98 h SER 51 N 0.61 -0.52 0.51 -0.43 0.87 -1.13 -2.36 113.55 111.10 2r98 h SER 51 Ca 0.42 0.14 0.00 0.00 -1.23 0.00 0.00 61.79 61.12 2r98 h SER 51 Cb 0.54 0.31 0.00 0.00 -0.44 0.00 0.00 62.40 62.82 2r98 h SER 51 CO -0.33 -0.18 0.00 0.00 -0.53 0.00 0.00 176.83 175.78 2r98 n GLN 52 N -5.35 0.19 -0.26 2.24 1.13 0.40 -0.27 117.38 115.45 2r98 n GLN 52 Ca 0.03 0.50 0.11 0.00 -1.94 0.00 0.00 57.00 55.70 2r98 n GLN 52 Cb 0.26 -1.92 0.27 0.00 0.11 0.00 0.00 30.24 28.96 2r98 n GLN 52 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 2r98 n LEU 53 N -2.29 3.29 -0.24 1.08 4.77 -0.41 -4.96 117.00 118.25 2r98 n LEU 53 Ca 0.01 -1.56 -0.03 0.00 -0.03 0.00 0.00 56.01 54.40 2r98 n LEU 53 Cb 0.17 -0.35 -0.01 0.00 -2.33 0.00 0.00 43.42 40.91 2r98 n LEU 53 CO 0.17 0.78 -0.03 0.61 -1.33 0.00 0.00 177.39 177.59 2r98 n GLY 54 N 1.48 0.42 3.67 -0.72 0.00 0.62 -4.59 105.19 106.08 2r98 n GLY 54 Ca 0.20 -0.88 -0.39 0.00 0.00 0.00 0.00 46.02 44.96 2r98 n GLY 54 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2r98 s ILE 55 N -2.11 5.14 -0.06 -0.61 1.01 -0.93 0.42 121.20 124.06 2r98 s ILE 55 Ca 0.00 0.88 -0.30 0.00 0.00 0.00 0.00 60.65 61.23 2r98 s ILE 55 Cb 0.00 -3.81 -0.04 0.00 0.01 0.00 0.00 42.46 38.62 2r98 s ILE 55 CO 0.00 0.21 1.35 -0.13 0.00 0.00 0.00 174.94 176.37 2r98 s ARG 56 N 1.46 4.28 -0.13 2.79 0.52 -0.06 -4.39 118.95 123.42 2r98 s ARG 56 Ca 0.23 1.84 0.02 0.00 -0.52 0.00 0.00 55.73 57.30 2r98 s ARG 56 Cb -0.15 -3.66 0.00 0.00 0.52 0.00 0.00 34.95 31.66 2r98 s ARG 56 CO 0.09 -0.61 -0.20 -0.51 0.02 0.00 0.00 175.30 174.09 2r98 s LEU 57 N 2.81 2.25 -0.17 2.53 1.43 -1.26 -0.24 118.68 126.04 2r98 s LEU 57 Ca 0.61 -0.53 0.01 0.00 -1.03 0.00 0.00 54.13 53.19 2r98 s LEU 57 Cb -0.28 -1.48 0.02 0.00 0.03 0.00 0.00 46.19 44.49 2r98 s LEU 57 CO 0.23 0.12 -0.18 -0.69 0.23 0.00 0.00 176.35 176.06 2r98 s VAL 58 N 0.57 1.92 -0.13 -1.59 1.01 -0.78 -1.15 120.40 120.26 2r98 s VAL 58 Ca -0.12 -0.86 -0.01 0.00 0.00 0.00 0.00 61.98 61.00 2r98 s VAL 58 Cb -0.16 -1.75 -0.02 0.00 0.00 0.00 0.00 36.38 34.44 2r98 s VAL 58 CO 0.04 0.52 -0.09 -0.76 0.00 0.00 0.00 175.10 174.80 2r98 s LEU 59 N 1.32 2.96 -0.05 3.92 1.43 0.12 0.10 118.68 128.48 2r98 s LEU 59 Ca 0.04 -0.22 0.04 0.00 -1.03 0.00 0.00 54.13 52.97 2r98 s LEU 59 Cb -0.13 -1.68 -0.00 0.00 0.03 0.00 0.00 46.19 44.41 2r98 s LEU 59 CO -0.12 0.20 -0.18 -0.63 0.23 0.00 0.00 176.35 175.85 2r98 s ILE 60 N 0.17 1.48 0.24 -0.59 1.01 -0.01 -4.30 121.20 119.21 2r98 s ILE 60 Ca -0.05 -0.74 0.10 0.00 0.00 0.00 0.00 60.65 59.96 2r98 s ILE 60 Cb -0.14 -1.28 -0.04 0.00 0.01 0.00 0.00 42.46 41.00 2r98 s ILE 60 CO 0.04 0.43 -0.09 -1.38 0.00 0.00 0.00 174.94 173.94 2r98 s HIS 61 N 0.06 2.57 0.42 3.97 -3.43 -1.26 0.14 115.29 117.75 2r98 s HIS 61 Ca -0.05 -0.25 0.02 0.00 -0.80 0.00 0.00 55.06 53.99 2r98 s HIS 61 Cb -0.12 -1.17 -0.00 0.00 -1.43 0.00 0.00 32.58 29.85 2r98 s HIS 61 CO 0.03 0.60 0.61 0.20 -2.00 0.00 0.00 174.74 174.18 2r98 s GLY 62 N -3.34 1.59 0.00 -1.38 0.00 -0.67 -3.30 107.32 100.21 2r98 s GLY 62 Ca 0.29 -1.20 0.00 0.00 0.00 0.00 0.00 44.72 43.80 2r98 s GLY 62 CO 0.17 -1.06 0.51 0.00 0.00 0.00 0.00 173.10 172.72 2r98 n ALA 63 N -1.95 1.47 -0.10 3.20 0.00 -1.26 -3.89 120.51 117.98 2r98 n ALA 63 Ca 0.01 -0.51 -0.10 0.00 0.00 0.00 0.00 53.44 52.84 2r98 n ALA 63 Cb 0.58 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.00 2r98 n ALA 63 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 2r98 h TYR 64 N 0.00 0.50 -0.08 0.00 0.05 -1.97 -1.01 116.97 114.45 2r98 h TYR 64 Ca 0.00 -0.06 -0.10 0.00 0.05 0.00 0.00 58.73 58.62 2r98 h TYR 64 Cb 0.46 -0.14 -0.01 0.00 1.01 0.00 0.00 36.73 38.04 2r98 h TYR 64 CO 0.00 0.53 -0.43 0.45 -1.05 0.00 0.00 178.16 177.66 2r98 h HIS 65 N 0.32 0.21 -0.11 4.88 3.86 -1.99 -1.48 115.15 120.85 2r98 h HIS 65 Ca 0.09 -0.06 -0.11 0.00 -1.16 0.00 0.00 60.37 59.14 2r98 h HIS 65 Cb 0.28 -0.05 -0.01 0.00 1.06 0.00 0.00 27.41 28.69 2r98 h HIS 65 CO 0.01 0.58 -0.43 0.35 0.86 0.00 0.00 177.93 179.30 2r98 h PHE 66 N 0.15 0.29 -0.11 2.45 3.57 -1.74 -1.74 116.94 119.81 2r98 h PHE 66 Ca 0.01 -0.08 -0.19 0.00 3.53 0.00 0.00 57.97 61.25 2r98 h PHE 66 Cb 0.82 -0.06 -0.00 0.00 2.79 0.00 0.00 35.95 39.49 2r98 h PHE 66 CO 0.01 0.64 -0.70 -0.07 -2.23 0.00 0.00 178.31 175.95 2r98 h LEU 67 N 0.20 0.58 -0.19 0.59 3.38 -0.74 -2.75 115.31 116.39 2r98 h LEU 67 Ca 0.02 -0.37 -0.22 0.00 0.09 0.00 0.00 57.88 57.40 2r98 h LEU 67 Cb 0.84 -0.17 0.01 0.00 0.09 0.00 0.00 40.66 41.43 2r98 h LEU 67 CO 0.07 1.11 -0.77 0.44 0.09 0.00 0.00 178.44 179.38 2r98 h ASP 68 N 0.35 0.89 -0.57 -0.43 3.32 -1.17 0.95 116.42 119.75 2r98 h ASP 68 Ca -0.03 -0.58 0.04 0.00 0.02 0.00 0.00 57.03 56.48 2r98 h ASP 68 Cb 1.28 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 40.53 2r98 h ASP 68 CO 0.13 1.38 0.38 -0.09 -1.72 0.00 0.00 179.24 179.31 2r98 h ARG 69 N 0.51 0.63 -0.03 3.56 2.43 -1.30 0.42 114.38 120.60 2r98 h ARG 69 Ca -0.05 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.06 2r98 h ARG 69 Cb 1.40 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 30.80 2r98 h ARG 69 CO 0.16 0.41 -0.07 -0.07 -1.51 0.00 0.00 179.97 178.89 2r98 h LEU 70 N 0.65 0.11 -0.64 3.80 3.38 -1.40 -3.01 115.31 118.20 2r98 h LEU 70 Ca 0.23 -0.58 0.00 0.00 0.09 0.00 0.00 57.88 57.62 2r98 h LEU 70 Cb 0.12 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.83 2r98 h LEU 70 CO -0.06 0.67 0.00 0.00 0.09 0.00 0.00 178.44 179.14 2r98 n ALA 71 N -2.41 1.07 -0.04 1.53 0.00 0.32 -0.91 120.51 120.07 2r98 n ALA 71 Ca -0.08 0.09 0.03 0.00 0.00 0.00 0.00 53.44 53.47 2r98 n ALA 71 Cb 0.33 -1.16 -0.15 0.00 0.00 0.00 0.00 19.45 18.48 2r98 n ALA 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2r98 n ALA 72 N -1.63 2.30 1.00 0.00 0.00 0.14 -3.51 120.51 118.81 2r98 n ALA 72 Ca -0.00 -0.72 0.10 0.00 0.00 0.00 0.00 53.44 52.82 2r98 n ALA 72 Cb 0.03 -0.47 -0.04 0.00 0.00 0.00 0.00 19.45 18.97 2r98 n ALA 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2r98 n ALA 73 N -2.34 4.51 0.87 0.00 0.00 -0.93 -4.15 120.51 118.46 2r98 n ALA 73 Ca -0.13 -0.55 0.09 0.00 0.00 0.00 0.00 53.44 52.86 2r98 n ALA 73 Cb 0.71 -0.85 -0.09 0.00 0.00 0.00 0.00 19.45 19.23 2r98 n ALA 73 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 2r98 n GLN 74 N -1.50 0.98 0.00 0.00 7.27 -0.09 -5.00 117.38 119.04 2r98 n GLN 74 Ca 0.04 -0.17 0.00 0.00 0.07 0.00 0.00 57.00 56.94 2r98 n GLN 74 Cb 0.33 -1.38 0.00 0.00 2.41 0.00 0.00 30.24 31.60 2r98 n GLN 74 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2r98 n GLY 75 N 1.41 3.17 3.36 1.69 0.00 -1.26 -5.07 105.19 108.50 2r98 n GLY 75 Ca 0.04 -0.89 -0.33 0.00 0.00 0.00 0.00 46.02 44.84 2r98 n GLY 75 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2r98 n ARG 76 N 0.00 -0.61 -4.37 1.61 1.85 -1.23 -4.88 116.66 109.03 2r98 n ARG 76 Ca 0.00 -0.15 -0.19 0.00 -1.00 0.00 0.00 57.85 56.52 2r98 n ARG 76 Cb 0.00 -1.78 -0.14 0.00 -1.05 0.00 0.00 32.46 29.49 2r98 n ARG 76 CO 0.00 0.00 0.00 0.95 -0.01 0.00 0.00 177.63 178.57 2r98 s THR 77 N -2.34 0.80 0.34 8.89 -4.23 -1.24 -4.07 115.64 113.79 2r98 s THR 77 Ca 0.56 -0.55 -0.28 0.00 -1.18 0.00 0.00 61.69 60.23 2r98 s THR 77 Cb -0.18 -0.69 -0.10 0.00 1.34 0.00 0.00 72.50 72.86 2r98 s THR 77 CO 0.68 0.14 1.32 -2.16 -0.54 0.00 0.00 174.62 174.06 2r98 s PRO 78 N -0.47 4.30 -0.02 3.99 0.04 -1.26 -5.07 135.00 136.50 2r98 s PRO 78 Ca 0.02 2.25 0.07 0.00 0.04 0.00 0.00 61.00 63.38 2r98 s PRO 78 Cb -0.05 -3.03 -0.02 0.00 0.04 0.00 0.00 34.50 31.44 2r98 s PRO 78 CO -0.00 -0.25 -0.22 -1.01 0.04 0.00 0.00 177.00 175.56 2r98 s HIS 79 N -1.15 2.04 -0.01 0.56 3.76 -1.26 -5.10 115.29 114.12 2r98 s HIS 79 Ca 0.50 -0.42 0.04 0.00 -0.15 0.00 0.00 55.06 55.03 2r98 s HIS 79 Cb -0.40 -1.32 -0.01 0.00 1.11 0.00 0.00 32.58 31.96 2r98 s HIS 79 CO 0.54 -0.06 -0.15 0.71 -0.85 0.00 0.00 174.74 174.93 2r98 s TYR 80 N -0.46 1.33 -0.40 1.40 1.51 -1.26 -2.04 117.35 117.43 2r98 s TYR 80 Ca 0.07 -0.27 0.01 0.00 -1.01 0.00 0.00 57.07 55.87 2r98 s TYR 80 Cb -0.09 -0.86 0.13 0.00 -0.11 0.00 0.00 41.96 41.03 2r98 s TYR 80 CO -0.00 -0.04 0.22 0.00 -1.11 0.00 0.00 175.55 174.62 2r98 n ARG 82 N 3.79 0.00 0.00 0.00 3.00 -1.26 -3.59 116.66 118.60 2r98 n ARG 82 Ca 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.94 2r98 n ARG 82 Cb 0.36 -2.04 0.00 0.00 0.00 0.00 0.00 32.46 30.78 2r98 n ARG 82 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2r98 n GLY 83 N -2.00 1.39 3.74 5.14 0.00 -1.26 -5.04 105.19 107.16 2r98 n GLY 83 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 2r98 n GLY 83 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2r98 s LEU 84 N 0.00 3.78 -0.23 0.99 1.43 -1.24 -5.00 118.68 118.43 2r98 s LEU 84 Ca 0.00 2.76 -0.07 0.00 -1.03 0.00 0.00 54.13 55.79 2r98 s LEU 84 Cb 0.00 -4.35 -0.03 0.00 0.03 0.00 0.00 46.19 41.84 2r98 s LEU 84 CO 0.00 -1.69 0.05 -0.60 0.23 0.00 0.00 176.35 174.34 2r98 s ARG 85 N -3.02 3.71 -0.21 1.70 3.52 -1.26 0.63 118.95 124.02 2r98 s ARG 85 Ca 0.74 -0.46 -0.37 0.00 -0.13 0.00 0.00 55.73 55.51 2r98 s ARG 85 Cb -0.40 -3.25 -0.13 0.00 -1.56 0.00 0.00 34.95 29.60 2r98 s ARG 85 CO 0.47 -0.06 1.87 0.28 -0.81 0.00 0.00 175.30 177.04 2r98 n VAL 86 N 4.52 0.42 -4.45 7.11 0.31 -0.86 -4.47 118.33 120.91 2r98 n VAL 86 Ca -0.16 -0.11 -0.30 0.00 -0.01 0.00 0.00 64.34 63.76 2r98 n VAL 86 Cb 0.52 -1.58 -0.17 0.00 -0.91 0.00 0.00 33.84 31.70 2r98 n VAL 86 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 2r98 s THR 87 N 4.31 1.64 0.52 2.52 -4.23 -1.26 -4.67 115.64 114.47 2r98 s THR 87 Ca 0.97 -0.72 0.05 0.00 -1.18 0.00 0.00 61.69 60.81 2r98 s THR 87 Cb -0.87 -1.49 0.04 0.00 1.34 0.00 0.00 72.50 71.52 2r98 s THR 87 CO 0.57 0.47 0.72 1.51 -0.54 0.00 0.00 174.62 177.36 2r98 s ASP 88 N 1.01 5.29 0.20 3.99 3.84 -1.26 -1.63 116.67 128.12 2r98 s ASP 88 Ca -0.05 -0.32 -0.06 0.00 -0.00 0.00 0.00 52.55 52.11 2r98 s ASP 88 Cb -0.15 -0.53 0.33 0.00 -1.38 0.00 0.00 42.92 41.20 2r98 s ASP 88 CO -0.03 -1.11 1.14 1.21 -0.00 0.00 0.00 175.17 176.38 2r98 n GLU 89 N -2.20 -0.07 -0.03 2.11 2.13 -1.26 -0.93 120.64 120.39 2r98 n GLU 89 Ca 0.10 1.14 -0.12 0.00 0.66 0.00 0.00 57.16 58.94 2r98 n GLU 89 Cb 0.60 -1.70 -0.06 0.00 0.27 0.00 0.00 31.44 30.54 2r98 n GLU 89 CO 0.00 0.00 0.00 1.15 -0.41 0.00 0.00 177.13 177.87 2r98 h THR 90 N 0.00 1.19 -0.26 6.31 2.02 -2.00 -1.86 112.91 118.31 2r98 h THR 90 Ca 0.35 -0.60 -0.16 0.00 0.77 0.00 0.00 66.41 66.78 2r98 h THR 90 Cb 0.53 1.38 -0.01 0.00 -1.74 0.00 0.00 68.15 68.32 2r98 h THR 90 CO -0.75 0.17 -0.48 0.77 0.37 0.00 0.00 175.52 175.60 2r98 h SER 91 N -0.02 0.75 -0.78 4.18 4.64 -1.69 -2.01 113.55 118.62 2r98 h SER 91 Ca 0.04 -0.37 0.16 0.00 -0.47 0.00 0.00 61.79 61.15 2r98 h SER 91 Cb 0.25 -0.21 -0.15 0.00 -0.31 0.00 0.00 62.40 61.98 2r98 h SER 91 CO 0.00 1.10 -0.15 0.25 -0.87 0.00 0.00 176.83 177.17 2r98 h LEU 92 N 0.55 -0.64 -0.43 5.97 7.12 -1.06 -0.42 115.31 126.39 2r98 h LEU 92 Ca 0.03 0.23 -0.15 0.00 0.13 0.00 0.00 57.88 58.12 2r98 h LEU 92 Cb 1.03 0.45 -0.01 0.00 -0.53 0.00 0.00 40.66 41.60 2r98 h LEU 92 CO 0.10 -0.25 -0.31 1.23 -0.13 0.00 0.00 178.44 179.09 2r98 h GLY 93 N 0.02 1.05 2.00 3.75 0.00 -0.82 -1.45 103.07 107.63 2r98 h GLY 93 Ca 0.39 -1.01 -0.04 0.00 0.00 0.00 0.00 47.33 46.67 2r98 h GLY 93 CO -0.78 0.91 -0.17 1.46 0.00 0.00 0.00 176.54 177.97 2r98 h GLN 94 N 0.81 0.00 0.01 4.80 4.20 -1.25 -1.92 115.11 121.76 2r98 h GLN 94 Ca 0.08 0.00 -0.22 0.00 0.06 0.00 0.00 58.65 58.57 2r98 h GLN 94 Cb 0.90 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.65 2r98 h GLN 94 CO 0.08 0.17 -1.09 0.00 -0.67 0.00 0.00 178.83 177.32 2r98 h ALA 95 N 1.83 0.38 -0.55 3.87 0.00 -0.17 -0.70 119.26 123.92 2r98 h ALA 95 Ca -0.00 -0.97 -0.05 0.00 0.00 0.00 0.00 54.91 53.90 2r98 h ALA 95 Cb 0.36 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 2r98 h ALA 95 CO 0.02 1.27 0.17 1.96 0.00 0.00 0.00 179.25 182.67 2r98 h GLN 96 N 0.00 0.86 0.10 0.00 4.20 -1.12 -1.67 115.11 117.49 2r98 h GLN 96 Ca -0.05 -0.19 -0.01 0.00 0.06 0.00 0.00 58.65 58.47 2r98 h GLN 96 Cb 1.81 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 29.47 2r98 h GLN 96 CO 0.13 0.79 -0.05 1.96 -0.67 0.00 0.00 178.83 180.98 2r98 h GLN 97 N 0.77 -0.13 -0.18 1.46 4.20 -1.23 -2.91 115.11 117.08 2r98 h GLN 97 Ca 0.18 0.01 0.05 0.00 0.06 0.00 0.00 58.65 58.95 2r98 h GLN 97 Cb 0.29 0.03 -0.07 0.00 0.30 0.00 0.00 27.48 28.04 2r98 h GLN 97 CO -0.00 0.00 -0.27 0.35 -0.67 0.00 0.00 178.83 178.24 2r98 h PHE 98 N -0.25 -0.74 -0.92 2.96 3.57 -1.14 -1.75 116.94 118.67 2r98 h PHE 98 Ca -0.01 0.04 0.19 0.00 3.53 0.00 0.00 57.97 61.71 2r98 h PHE 98 Cb 0.20 0.35 -0.17 0.00 2.79 0.00 0.00 35.95 39.12 2r98 h PHE 98 CO -0.04 -0.35 -0.21 0.00 -2.23 0.00 0.00 178.31 175.48 2r98 h ALA 99 N 0.63 0.65 -0.40 2.41 0.00 -1.34 0.16 119.26 121.36 2r98 h ALA 99 Ca 0.12 0.36 -0.12 0.00 0.00 0.00 0.00 54.91 55.26 2r98 h ALA 99 Cb 0.49 0.69 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 2r98 h ALA 99 CO -0.36 -0.40 -0.25 0.78 0.00 0.00 0.00 179.25 179.02 2r98 h GLY 100 N 0.00 0.89 0.86 0.00 0.00 -1.24 -0.60 103.07 102.98 2r98 h GLY 100 Ca 0.45 -0.79 -0.10 0.00 0.00 0.00 0.00 47.33 46.89 2r98 h GLY 100 CO -0.94 0.72 -0.28 0.00 0.00 0.00 0.00 176.54 176.04 2r98 h THR 101 N 0.71 1.34 -0.02 4.70 1.03 -0.47 -2.67 112.91 117.53 2r98 h THR 101 Ca 0.09 -1.49 -0.16 0.00 -0.01 0.00 0.00 66.41 64.84 2r98 h THR 101 Cb 0.78 1.84 -0.02 0.00 -1.07 0.00 0.00 68.15 69.69 2r98 h THR 101 CO 0.06 0.46 -0.72 0.58 -0.01 0.00 0.00 175.52 175.89 2r98 h VAL 102 N 0.20 1.47 -0.41 0.00 2.07 -0.71 -1.21 116.25 117.66 2r98 h VAL 102 Ca 0.02 -2.35 -0.08 0.00 0.82 0.00 0.00 66.70 65.11 2r98 h VAL 102 Cb 0.86 2.26 -0.01 0.00 -1.52 0.00 0.00 31.29 32.88 2r98 h VAL 102 CO 0.07 0.68 -0.05 -0.09 0.02 0.00 0.00 177.57 178.20 2r98 h ARG 103 N 0.08 0.75 -0.40 1.57 2.43 -1.17 -0.70 114.38 116.93 2r98 h ARG 103 Ca -0.02 -0.26 -0.15 0.00 -0.81 0.00 0.00 59.98 58.74 2r98 h ARG 103 Cb 1.28 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.76 2r98 h ARG 103 CO 0.10 0.86 -0.33 1.03 -1.51 0.00 0.00 179.97 180.12 2r98 h SER 104 N 0.57 0.97 -0.25 -3.80 0.87 -1.40 -2.03 113.55 108.48 2r98 h SER 104 Ca 0.11 -0.42 -0.12 0.00 -1.23 0.00 0.00 61.79 60.14 2r98 h SER 104 Cb 0.55 -0.27 -0.00 0.00 -0.44 0.00 0.00 62.40 62.24 2r98 h SER 104 CO 0.03 1.20 -0.30 0.03 -0.53 0.00 0.00 176.83 177.26 2r98 h ARG 105 N 0.76 0.65 -0.26 2.24 3.08 -1.23 -1.43 114.38 118.19 2r98 h ARG 105 Ca 0.08 -0.36 0.01 0.00 0.07 0.00 0.00 59.98 59.78 2r98 h ARG 105 Cb 0.91 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.97 2r98 h ARG 105 CO 0.08 0.97 0.17 0.35 -1.07 0.00 0.00 179.97 180.47 2r98 h PHE 106 N 0.36 0.29 0.01 3.04 3.57 -1.09 -0.83 116.94 122.29 2r98 h PHE 106 Ca 0.03 0.01 -0.24 0.00 3.53 0.00 0.00 57.97 61.30 2r98 h PHE 106 Cb 0.87 -0.10 0.01 0.00 2.79 0.00 0.00 35.95 39.52 2r98 h PHE 106 CO 0.08 0.18 -1.00 1.49 -2.23 0.00 0.00 178.31 176.83 2r98 h GLU 107 N 0.31 0.49 -0.43 1.11 4.81 -1.07 0.95 114.58 120.76 2r98 h GLU 107 Ca 0.10 -0.55 -0.14 0.00 -0.13 0.00 0.00 59.36 58.64 2r98 h GLU 107 Cb 0.02 0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.55 2r98 h GLU 107 CO -0.02 1.18 -0.29 0.00 -0.73 0.00 0.00 179.01 179.15 2r98 h ALA 108 N 0.62 0.61 -0.10 2.92 0.00 -1.10 0.35 119.26 122.56 2r98 h ALA 108 Ca -0.10 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.39 2r98 h ALA 108 Cb 1.65 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.29 2r98 h ALA 108 CO 0.18 0.65 0.07 0.00 0.00 0.00 0.00 179.25 180.15 2r98 h ALA 109 N 0.82 0.13 -0.24 0.00 0.00 -0.91 0.23 119.26 119.29 2r98 h ALA 109 Ca 0.09 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 2r98 h ALA 109 Cb 0.88 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 2r98 h ALA 109 CO 0.08 -0.37 0.03 1.25 0.00 0.00 0.00 179.25 180.24 2r98 h LEU 110 N 0.13 0.39 -1.35 0.00 6.46 -0.57 -2.99 115.31 117.38 2r98 h LEU 110 Ca 0.04 -0.27 -0.02 0.00 -0.12 0.00 0.00 57.88 57.50 2r98 h LEU 110 Cb -0.00 -0.10 -0.00 0.00 -0.73 0.00 0.00 40.66 39.82 2r98 h LEU 110 CO -0.01 0.56 -0.11 0.00 -0.62 0.00 0.00 178.44 178.26 2r98 n GLY 112 N 0.03 5.33 0.00 0.00 0.00 0.78 -4.66 105.19 106.67 2r98 n GLY 112 Ca 0.00 -2.74 0.00 0.00 0.00 0.00 0.00 46.02 43.28 2r98 n GLY 112 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2r98 n SER 113 N 0.40 0.00 0.00 1.61 7.64 -1.25 -4.79 113.62 117.22 2r98 n SER 113 Ca 0.32 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.20 2r98 n SER 113 Cb 0.37 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.57 2r98 n SER 113 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2r98 n SER 122 N 0.00 0.00 -1.36 6.43 2.88 -1.26 -4.97 113.62 115.34 2r98 n SER 122 Ca 0.00 0.00 -0.19 0.00 -1.33 0.00 0.00 58.87 57.35 2r98 n SER 122 Cb 0.00 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.43 2r98 n SER 122 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 2r98 n VAL 123 N 0.00 0.00 -2.61 2.46 0.31 -1.26 -4.97 118.33 112.26 2r98 n VAL 123 Ca 0.00 0.00 -0.43 0.00 -0.01 0.00 0.00 64.34 63.90 2r98 n VAL 123 Cb 0.00 -0.09 -0.02 0.00 -0.91 0.00 0.00 33.84 32.82 2r98 n VAL 123 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 2r98 s PRO 124 N 0.55 4.17 -0.10 5.55 0.04 -1.26 -4.98 135.00 138.98 2r98 s PRO 124 Ca 0.29 1.29 0.01 0.00 0.04 0.00 0.00 61.00 62.64 2r98 s PRO 124 Cb -0.41 -3.70 0.02 0.00 0.04 0.00 0.00 34.50 30.44 2r98 s PRO 124 CO 0.21 -0.76 -0.11 -1.17 0.04 0.00 0.00 177.00 175.21 2r98 s LEU 125 N 3.47 1.51 0.10 -3.56 2.96 -1.26 -0.43 118.68 121.47 2r98 s LEU 125 Ca 0.47 -0.34 0.05 0.00 -0.22 0.00 0.00 54.13 54.08 2r98 s LEU 125 Cb -0.15 -0.91 -0.04 0.00 0.50 0.00 0.00 46.19 45.60 2r98 s LEU 125 CO 0.11 -0.03 -0.12 -0.69 -1.32 0.00 0.00 176.35 174.31 2r98 s VAL 126 N 1.13 1.08 -0.21 1.68 1.01 0.83 -4.95 120.40 120.97 2r98 s VAL 126 Ca -0.05 -1.60 -0.23 0.00 0.00 0.00 0.00 61.98 60.10 2r98 s VAL 126 Cb -0.14 -1.35 0.06 0.00 0.00 0.00 0.00 36.38 34.95 2r98 s VAL 126 CO -0.02 -0.46 0.63 -0.55 0.00 0.00 0.00 175.10 174.70 2r98 s SER 127 N -2.32 -0.65 0.23 3.32 0.15 -1.26 -0.64 113.70 112.53 2r98 s SER 127 Ca 0.05 1.18 -0.19 0.00 0.70 0.00 0.00 55.95 57.69 2r98 s SER 127 Cb -0.05 1.18 0.03 0.00 -1.71 0.00 0.00 66.02 65.46 2r98 s SER 127 CO 0.01 -0.28 0.61 -0.83 1.20 0.00 0.00 173.24 173.95 2r98 s GLY 128 N 0.08 -0.08 -1.38 9.45 0.00 -1.26 -5.04 107.32 109.10 2r98 s GLY 128 Ca -0.02 -0.25 -0.11 0.00 0.00 0.00 0.00 44.72 44.33 2r98 s GLY 128 CO 0.02 -0.18 2.10 1.16 0.00 0.00 0.00 173.10 176.20 2r98 n ASN 129 N -0.40 4.74 0.17 1.64 6.94 -1.26 -4.69 115.26 122.40 2r98 n ASN 129 Ca -0.07 -2.97 0.12 0.00 -0.02 0.00 0.00 54.58 51.64 2r98 n ASN 129 Cb 0.61 -1.56 0.25 0.00 -2.36 0.00 0.00 39.78 36.72 2r98 n ASN 129 CO 0.00 0.00 0.00 -0.26 -1.03 0.00 0.00 177.26 175.97 2r98 h PHE 130 N 5.79 0.00 -3.28 -2.53 -1.00 -1.96 -3.46 116.94 110.50 2r98 h PHE 130 Ca 0.50 0.00 -0.67 0.00 2.81 0.00 0.00 57.97 60.62 2r98 h PHE 130 Cb 0.61 0.00 -0.31 0.00 3.61 0.00 0.00 35.95 39.86 2r98 h PHE 130 CO 1.38 0.00 -0.81 -0.51 -1.61 0.00 0.00 178.31 176.76 2r98 s LEU 131 N -5.52 2.43 -0.16 1.54 1.43 -1.26 -0.34 118.68 116.81 2r98 s LEU 131 Ca 0.08 -0.48 -0.05 0.00 -1.03 0.00 0.00 54.13 52.65 2r98 s LEU 131 Cb 0.08 -1.54 -0.03 0.00 0.03 0.00 0.00 46.19 44.72 2r98 s LEU 131 CO 0.65 0.10 0.01 0.42 0.23 0.00 0.00 176.35 177.76 2r98 s THR 132 N 0.72 4.37 0.50 5.49 -4.23 0.12 -3.26 115.64 119.35 2r98 s THR 132 Ca -0.07 -0.19 0.08 0.00 -1.18 0.00 0.00 61.69 60.33 2r98 s THR 132 Cb -0.16 -2.93 0.04 0.00 1.34 0.00 0.00 72.50 70.79 2r98 s THR 132 CO 0.01 0.50 0.57 0.00 -0.54 0.00 0.00 174.62 175.16 2r98 s ALA 133 N 0.17 4.47 -0.07 3.99 0.00 0.15 0.00 121.76 130.48 2r98 s ALA 133 Ca 0.02 -1.80 -0.24 0.00 0.00 0.00 0.00 51.96 49.93 2r98 s ALA 133 Cb -0.13 -1.22 0.05 0.00 0.00 0.00 0.00 23.12 21.82 2r98 s ALA 133 CO 0.02 -0.52 0.55 -0.98 0.00 0.00 0.00 175.76 174.83 2r98 s ARG 134 N -4.40 0.88 0.27 0.00 1.70 -0.80 -4.01 118.95 112.59 2r98 s ARG 134 Ca 0.51 0.21 -0.30 0.00 -0.47 0.00 0.00 55.73 55.68 2r98 s ARG 134 Cb -0.05 0.41 -0.11 0.00 -0.57 0.00 0.00 34.95 34.63 2r98 s ARG 134 CO 0.31 -0.25 1.53 -1.25 -1.08 0.00 0.00 175.30 174.56 2r98 s PRO 135 N -0.99 4.19 0.45 3.89 0.04 -1.26 -0.83 135.00 140.48 2r98 s PRO 135 Ca -0.10 2.45 0.22 0.00 0.04 0.00 0.00 61.00 63.61 2r98 s PRO 135 Cb -0.02 -3.06 1.20 0.00 0.04 0.00 0.00 34.50 32.65 2r98 s PRO 135 CO 0.07 -0.54 1.85 0.82 0.04 0.00 0.00 177.00 179.24 2r98 h ILE 136 N 3.47 0.62 0.00 0.56 2.04 -0.69 -3.45 117.51 120.05 2r98 h ILE 136 Ca -0.46 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 65.29 2r98 h ILE 136 Cb 1.22 0.30 0.00 0.00 -0.74 0.00 0.00 36.82 37.60 2r98 h ILE 136 CO 0.79 0.05 0.00 0.61 0.00 0.00 0.00 178.15 179.60 2r98 n GLY 137 N -1.56 0.98 3.11 5.37 0.00 -1.26 -4.85 105.19 106.98 2r98 n GLY 137 Ca 0.20 -1.37 -0.32 0.00 0.00 0.00 0.00 46.02 44.53 2r98 n GLY 137 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2r98 s VAL 138 N 0.00 1.91 -0.24 1.61 1.01 -1.26 -4.24 120.40 119.19 2r98 s VAL 138 Ca 0.00 -0.87 -0.05 0.00 0.00 0.00 0.00 61.98 61.06 2r98 s VAL 138 Cb 0.00 -1.73 -0.01 0.00 0.00 0.00 0.00 36.38 34.65 2r98 s VAL 138 CO 0.00 0.52 0.00 -0.63 0.00 0.00 0.00 175.10 174.99 2r98 s ILE 139 N 1.11 3.63 -1.18 2.22 1.01 0.18 -4.63 121.20 123.54 2r98 s ILE 139 Ca -0.01 -0.52 -0.06 0.00 0.00 0.00 0.00 60.65 60.07 2r98 s ILE 139 Cb -0.14 -2.73 0.01 0.00 0.01 0.00 0.00 42.46 39.61 2r98 s ILE 139 CO -0.07 0.32 0.76 0.47 0.00 0.00 0.00 174.94 176.41 2r98 n ASP 140 N 4.82 -5.46 0.00 3.58 10.43 -1.26 -1.24 116.55 127.43 2r98 n ASP 140 Ca -0.17 -0.35 0.00 0.00 2.57 0.00 0.00 54.79 56.84 2r98 n ASP 140 Cb 0.50 -4.17 0.00 0.00 1.84 0.00 0.00 41.12 39.29 2r98 n ASP 140 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2r98 n GLY 141 N -1.58 1.72 3.54 0.44 0.00 -1.26 -5.04 105.19 103.00 2r98 n GLY 141 Ca -0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.63 2r98 n GLY 141 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2r98 s THR 142 N -2.42 4.63 0.21 2.61 2.01 -0.37 -5.09 115.64 117.21 2r98 s THR 142 Ca 0.00 -0.07 -0.03 0.00 0.31 0.00 0.00 61.69 61.89 2r98 s THR 142 Cb 0.00 -3.14 0.05 0.00 0.01 0.00 0.00 72.50 69.42 2r98 s THR 142 CO 0.00 0.38 0.24 -0.67 -0.69 0.00 0.00 174.62 173.88 2r98 n ASP 143 N 4.38 -0.38 0.00 3.53 4.64 -1.26 -0.65 116.55 126.81 2r98 n ASP 143 Ca -0.16 -0.94 0.00 0.00 -1.38 0.00 0.00 54.79 52.31 2r98 n ASP 143 Cb 0.52 -0.20 0.00 0.00 -1.04 0.00 0.00 41.12 40.40 2r98 n ASP 143 CO 0.00 0.00 0.00 -0.62 -0.82 0.00 0.00 177.20 175.76 2r98 n GLU 145 N -1.74 0.00 -0.06 -0.67 1.02 -1.26 -4.90 120.64 113.03 2r98 n GLU 145 Ca 0.03 0.00 0.02 0.00 -0.02 0.00 0.00 57.16 57.19 2r98 n GLU 145 Cb 0.11 0.00 0.06 0.00 -0.02 0.00 0.00 31.44 31.59 2r98 n GLU 145 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2r98 n TYR 146 N 0.00 0.15 -2.05 -0.32 4.02 -0.64 -4.72 117.16 113.60 2r98 n TYR 146 Ca 0.00 -0.08 -0.42 0.00 -0.01 0.00 0.00 57.90 57.39 2r98 n TYR 146 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.29 2r98 n TYR 146 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2r98 s ALA 147 N -1.85 3.68 0.43 -0.72 0.00 -1.26 -1.98 121.76 120.07 2r98 s ALA 147 Ca 0.08 1.24 0.06 0.00 0.00 0.00 0.00 51.96 53.34 2r98 s ALA 147 Cb 0.04 -3.58 -0.06 0.00 0.00 0.00 0.00 23.12 19.52 2r98 s ALA 147 CO 0.06 -0.71 0.08 0.20 0.00 0.00 0.00 175.76 175.39 2r98 s GLY 148 N 1.16 2.52 -0.03 0.00 0.00 -0.08 0.01 107.32 110.90 2r98 s GLY 148 Ca 0.67 -1.93 -0.03 0.00 0.00 0.00 0.00 44.72 43.44 2r98 s GLY 148 CO 0.31 -2.05 0.08 0.54 0.00 0.00 0.00 173.10 171.98 2r98 s VAL 149 N -2.70 -0.01 0.09 1.40 0.11 -0.01 -4.23 120.40 115.05 2r98 s VAL 149 Ca 0.33 0.03 -0.34 0.00 -2.93 0.00 0.00 61.98 59.07 2r98 s VAL 149 Cb 0.06 -0.13 -0.14 0.00 -1.53 0.00 0.00 36.38 34.65 2r98 s VAL 149 CO 0.18 0.01 1.64 -0.38 -3.33 0.00 0.00 175.10 173.22 2r98 n ILE 150 N 3.25 0.15 -0.11 7.04 5.41 -1.26 -1.91 119.36 131.92 2r98 n ILE 150 Ca -0.15 -0.03 -0.19 0.00 1.00 0.00 0.00 62.75 63.38 2r98 n ILE 150 Cb 0.58 -1.57 -0.12 0.00 -0.71 0.00 0.00 39.64 37.82 2r98 n ILE 150 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 176.55 175.41 2r98 n ARG 151 N 4.18 0.66 -3.73 0.38 0.00 0.10 -4.91 116.66 113.33 2r98 n ARG 151 Ca 0.19 0.17 -0.12 0.00 -0.00 0.00 0.00 57.85 58.09 2r98 n ARG 151 Cb 0.28 -1.55 -0.11 0.00 0.00 0.00 0.00 32.46 31.08 2r98 n ARG 151 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 2r98 s LYS 152 N -2.52 0.37 -0.17 -0.14 1.02 -0.89 -4.99 119.74 112.42 2r98 s LYS 152 Ca -0.33 0.57 0.01 0.00 0.02 0.00 0.00 55.97 56.23 2r98 s LYS 152 Cb 0.09 0.09 0.01 0.00 -0.52 0.00 0.00 37.83 37.49 2r98 s LYS 152 CO 0.62 -0.10 -0.17 -0.08 -0.92 0.00 0.00 175.35 174.70 2r98 s THR 153 N 0.69 2.39 -0.93 2.17 -1.32 -1.26 0.12 115.64 117.50 2r98 s THR 153 Ca -0.04 -0.85 -0.24 0.00 -1.21 0.00 0.00 61.69 59.35 2r98 s THR 153 Cb -0.05 -2.01 -0.07 0.00 -1.51 0.00 0.00 72.50 68.86 2r98 s THR 153 CO -0.05 0.52 2.00 -0.62 -2.21 0.00 0.00 174.62 174.27 2r98 s ASP 154 N 1.07 4.94 0.35 8.08 -1.08 0.53 -4.75 116.67 125.81 2r98 s ASP 154 Ca -0.01 -0.74 0.19 0.00 -0.52 0.00 0.00 52.55 51.47 2r98 s ASP 154 Cb -0.14 -2.56 0.34 0.00 -1.46 0.00 0.00 42.92 39.09 2r98 s ASP 154 CO -0.06 -2.97 1.57 0.74 0.52 0.00 0.00 175.17 174.98 2r98 h THR 155 N 7.15 0.64 0.00 1.71 2.02 -1.95 -2.69 112.91 119.78 2r98 h THR 155 Ca 0.10 -1.72 -0.00 0.00 0.77 0.00 0.00 66.41 65.55 2r98 h THR 155 Cb 0.99 2.18 -0.00 0.00 -1.74 0.00 0.00 68.15 69.58 2r98 h THR 155 CO 1.18 0.34 -0.01 0.00 0.37 0.00 0.00 175.52 177.40 2r98 h ALA 156 N 1.65 0.00 -0.99 6.16 0.00 -1.99 -2.12 119.26 121.97 2r98 h ALA 156 Ca -0.00 -0.49 0.30 0.00 0.00 0.00 0.00 54.91 54.72 2r98 h ALA 156 Cb 1.15 0.01 -0.14 0.00 0.00 0.00 0.00 17.79 18.80 2r98 h ALA 156 CO 0.04 0.01 0.55 0.00 0.00 0.00 0.00 179.25 179.85 2r98 h ALA 157 N -0.03 1.88 0.10 0.00 0.00 -1.97 -1.03 119.26 118.20 2r98 h ALA 157 Ca -0.00 0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 2r98 h ALA 157 Cb 0.97 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.90 2r98 h ALA 157 CO -0.00 -0.51 -0.05 -0.07 0.00 0.00 0.00 179.25 178.62 2r98 h LEU 158 N 0.36 -0.12 -0.54 0.00 3.38 -1.37 -2.73 115.31 114.29 2r98 h LEU 158 Ca 0.71 -0.40 0.08 0.00 0.09 0.00 0.00 57.88 58.36 2r98 h LEU 158 Cb 1.56 0.03 -0.07 0.00 0.09 0.00 0.00 40.66 42.27 2r98 h LEU 158 CO -0.59 0.37 0.17 0.03 0.09 0.00 0.00 178.44 178.52 2r98 h ARG 159 N -0.65 0.33 -0.67 1.13 3.08 -1.33 -0.35 114.38 115.92 2r98 h ARG 159 Ca -0.01 -0.02 0.14 0.00 0.07 0.00 0.00 59.98 60.16 2r98 h ARG 159 Cb 0.51 -0.07 -0.12 0.00 0.08 0.00 0.00 29.97 30.36 2r98 h ARG 159 CO 0.02 0.22 -0.07 0.35 -1.07 0.00 0.00 179.97 179.42 2r98 h PHE 160 N 0.34 -0.18 -0.17 3.04 3.57 -1.22 0.95 116.94 123.27 2r98 h PHE 160 Ca 0.27 0.05 -0.11 0.00 3.53 0.00 0.00 57.97 61.71 2r98 h PHE 160 Cb 0.33 0.19 0.00 0.00 2.79 0.00 0.00 35.95 39.26 2r98 h PHE 160 CO -0.18 -0.24 -0.34 1.96 -2.23 0.00 0.00 178.31 177.27 2r98 h GLN 161 N 0.06 0.53 -0.83 1.11 1.08 -0.87 -2.93 115.11 113.25 2r98 h GLN 161 Ca 0.34 -0.34 -0.02 0.00 -1.45 0.00 0.00 58.65 57.18 2r98 h GLN 161 Cb 0.56 0.04 -0.04 0.00 -0.05 0.00 0.00 27.48 27.99 2r98 h GLN 161 CO -0.63 0.95 0.46 -0.07 -0.95 0.00 0.00 178.83 178.59 2r98 h LEU 162 N 0.17 1.04 -0.66 1.46 3.38 -1.00 -0.93 115.31 118.76 2r98 h LEU 162 Ca 0.00 -0.09 0.08 0.00 0.09 0.00 0.00 57.88 57.97 2r98 h LEU 162 Cb 0.94 -0.26 -0.07 0.00 0.09 0.00 0.00 40.66 41.36 2r98 h LEU 162 CO 0.08 0.84 0.32 0.44 0.09 0.00 0.00 178.44 180.21 2r98 h ASP 163 N 1.17 0.43 0.27 -0.43 3.32 0.97 -2.44 116.42 119.69 2r98 h ASP 163 Ca 0.29 0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.40 2r98 h ASP 163 Cb 0.03 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.56 2r98 h ASP 163 CO -0.05 0.26 0.00 0.00 -1.72 0.00 0.00 179.24 177.73 2r98 n ALA 164 N -2.40 2.06 -0.33 3.45 0.00 -1.05 -4.86 120.51 117.37 2r98 n ALA 164 Ca 0.09 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2r98 n ALA 164 Cb 0.24 -1.31 0.00 0.00 0.00 0.00 0.00 19.45 18.38 2r98 n ALA 164 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2r98 n GLY 165 N 0.29 0.80 3.78 0.00 0.00 -0.92 -5.05 105.19 104.08 2r98 n GLY 165 Ca 0.10 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 2r98 n GLY 165 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2r98 s ASN 166 N -2.21 7.37 -0.05 1.61 0.02 -0.38 -4.74 114.94 116.57 2r98 s ASN 166 Ca 0.00 1.79 -0.26 0.00 -1.02 0.00 0.00 52.86 53.37 2r98 s ASN 166 Cb 0.00 -2.56 -0.03 0.00 0.02 0.00 0.00 41.25 38.68 2r98 s ASN 166 CO 0.00 0.02 0.81 -0.63 0.02 0.00 0.00 177.10 177.32 2r98 s ILE 167 N -1.47 4.97 -0.24 0.60 1.01 0.43 -4.21 121.20 122.28 2r98 s ILE 167 Ca 0.46 1.68 -0.18 0.00 0.00 0.00 0.00 60.65 62.61 2r98 s ILE 167 Cb -0.20 -4.15 -0.03 0.00 0.01 0.00 0.00 42.46 38.09 2r98 s ILE 167 CO 0.25 0.20 0.53 -0.69 0.00 0.00 0.00 174.94 175.23 2r98 s VAL 168 N 1.01 5.07 0.57 2.92 1.01 -0.30 -0.12 120.40 130.56 2r98 s VAL 168 Ca 0.43 0.95 0.08 0.00 0.00 0.00 0.00 61.98 63.44 2r98 s VAL 168 Cb -0.19 -3.85 0.07 0.00 0.00 0.00 0.00 36.38 32.42 2r98 s VAL 168 CO 0.21 0.11 0.68 0.86 0.00 0.00 0.00 175.10 176.96 2r98 s TRP 169 N 2.09 1.44 0.32 5.22 -0.11 0.19 0.14 118.94 128.23 2r98 s TRP 169 Ca 0.23 -0.77 0.08 0.00 1.22 0.00 0.00 56.10 56.86 2r98 s TRP 169 Cb -0.16 -2.11 -0.06 0.00 -1.50 0.00 0.00 33.47 29.64 2r98 s TRP 169 CO 0.09 -0.96 -0.08 -1.25 -4.62 0.00 0.00 176.95 170.13 2r98 s PRO 171 N -4.56 1.72 -1.52 5.86 0.04 -1.26 -4.47 135.00 130.81 2r98 s PRO 171 Ca 0.53 -1.89 -0.09 0.00 0.04 0.00 0.00 61.00 59.60 2r98 s PRO 171 Cb -0.05 -1.48 -0.05 0.00 0.04 0.00 0.00 34.50 32.97 2r98 s PRO 171 CO 0.34 0.09 2.85 -0.35 0.04 0.00 0.00 177.00 179.97 2r98 n PRO 172 N -0.72 3.86 -3.83 0.56 -0.04 -1.21 -4.82 135.00 128.81 2r98 n PRO 172 Ca -0.05 -2.45 -0.13 0.00 -0.04 0.00 0.00 63.50 60.83 2r98 n PRO 172 Cb 0.64 -2.74 -0.14 0.00 -0.04 0.00 0.00 33.50 31.21 2r98 n PRO 172 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2r98 s LEU 173 N -0.35 1.55 0.10 1.53 1.43 -1.26 -0.86 118.68 120.81 2r98 s LEU 173 Ca 0.66 0.11 0.02 0.00 -1.03 0.00 0.00 54.13 53.90 2r98 s LEU 173 Cb 0.19 0.15 -0.04 0.00 0.03 0.00 0.00 46.19 46.52 2r98 s LEU 173 CO -0.07 -0.05 -0.08 -0.83 0.23 0.00 0.00 176.35 175.55 2r98 s GLY 174 N 0.35 0.78 0.29 -3.19 0.00 -0.83 -4.90 107.32 99.82 2r98 s GLY 174 Ca -0.03 -1.26 0.08 0.00 0.00 0.00 0.00 44.72 43.51 2r98 s GLY 174 CO -0.01 -1.36 0.14 0.30 0.00 0.00 0.00 173.10 172.17 2r98 s HIS 175 N -3.09 2.85 0.29 1.90 3.76 -1.20 -1.49 115.29 118.30 2r98 s HIS 175 Ca 0.08 -0.24 0.10 0.00 -0.15 0.00 0.00 55.06 54.85 2r98 s HIS 175 Cb 0.02 -1.46 -0.05 0.00 1.11 0.00 0.00 32.58 32.20 2r98 s HIS 175 CO -0.03 0.45 -0.03 -1.54 -0.85 0.00 0.00 174.74 172.75 2r98 s SER 176 N -3.82 4.30 0.00 1.40 1.04 -0.62 0.33 113.70 116.34 2r98 s SER 176 Ca 0.35 -0.79 0.01 0.00 0.48 0.00 0.00 55.95 55.99 2r98 s SER 176 Cb -0.06 -0.67 0.04 0.00 0.10 0.00 0.00 66.02 65.43 2r98 s SER 176 CO 0.23 -0.05 0.35 -1.22 0.98 0.00 0.00 173.24 173.53 2r98 n TYR 177 N -0.87 0.00 0.95 5.02 0.53 -1.26 -1.46 117.16 120.07 2r98 n TYR 177 Ca -0.06 0.00 0.11 0.00 -1.02 0.00 0.00 57.90 56.93 2r98 n TYR 177 Cb 0.60 0.00 0.05 0.00 -1.03 0.00 0.00 39.34 38.96 2r98 n TYR 177 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 2r98 n GLY 178 N -0.21 0.47 1.94 2.72 0.00 -1.26 -4.95 105.19 103.90 2r98 n GLY 178 Ca 0.01 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.39 2r98 n GLY 178 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2r98 n GLY 179 N 1.33 0.41 3.82 -0.02 0.00 -0.54 -5.07 105.19 105.12 2r98 n GLY 179 Ca 0.11 -0.96 -0.25 0.00 0.00 0.00 0.00 46.02 44.92 2r98 n GLY 179 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2r98 s LYS 180 N -2.95 2.96 0.03 1.61 -0.14 -1.25 -4.95 119.74 115.04 2r98 s LYS 180 Ca 0.00 -0.91 0.03 0.00 -1.36 0.00 0.00 55.97 53.74 2r98 s LYS 180 Cb 0.00 -2.65 -0.04 0.00 -1.68 0.00 0.00 37.83 33.47 2r98 s LYS 180 CO 0.00 0.46 -0.04 0.99 -0.76 0.00 0.00 175.35 176.00 2r98 s THR 181 N -1.88 3.84 0.05 2.17 2.01 -1.26 -1.58 115.64 118.99 2r98 s THR 181 Ca 0.32 -0.82 0.02 0.00 0.31 0.00 0.00 61.69 61.52 2r98 s THR 181 Cb -0.09 -2.73 -0.03 0.00 0.01 0.00 0.00 72.50 69.66 2r98 s THR 181 CO 0.24 0.31 -0.07 -0.36 -0.69 0.00 0.00 174.62 174.05 2r98 s PHE 182 N -1.11 0.68 -0.34 4.92 0.40 -0.56 -4.95 117.98 117.03 2r98 s PHE 182 Ca 0.20 -0.57 -0.16 0.00 -0.60 0.00 0.00 56.93 55.80 2r98 s PHE 182 Cb -0.11 -0.41 -0.01 0.00 0.51 0.00 0.00 43.02 43.00 2r98 s PHE 182 CO 0.11 -0.10 0.40 1.21 0.70 0.00 0.00 175.22 177.53 2r98 s ASN 183 N -1.82 6.21 0.39 1.36 2.47 -0.84 -1.96 114.94 120.77 2r98 s ASN 183 Ca -0.07 -0.14 -0.11 0.00 0.42 0.00 0.00 52.86 52.96 2r98 s ASN 183 Cb -0.07 -2.21 -0.07 0.00 -1.45 0.00 0.00 41.25 37.45 2r98 s ASN 183 CO -0.01 -0.36 0.76 -0.76 -3.72 0.00 0.00 177.10 173.02 2r98 s LEU 184 N 2.10 3.86 0.00 3.21 1.43 -0.04 -0.90 118.68 128.34 2r98 s LEU 184 Ca 0.13 1.14 0.00 0.00 -1.03 0.00 0.00 54.13 54.37 2r98 s LEU 184 Cb -0.16 -4.01 0.00 0.00 0.03 0.00 0.00 46.19 42.05 2r98 s LEU 184 CO 0.12 -0.38 0.00 -0.67 0.23 0.00 0.00 176.35 175.65 2r98 n ASP 185 N -1.20 0.00 0.00 2.29 4.64 -1.26 -4.85 116.55 116.17 2r98 n ASP 185 Ca 0.02 -0.33 0.00 0.00 -1.38 0.00 0.00 54.79 53.11 2r98 n ASP 185 Cb 0.54 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.62 2r98 n ASP 185 CO 0.00 0.00 0.00 0.52 -0.82 0.00 0.00 177.20 176.90 2r98 n VAL 187 N -0.52 0.00 0.11 5.18 0.31 -1.26 -0.66 118.33 121.49 2r98 n VAL 187 Ca 0.00 0.00 0.10 0.00 -0.01 0.00 0.00 64.34 64.43 2r98 n VAL 187 Cb 0.00 0.00 0.01 0.00 -0.91 0.00 0.00 33.84 32.94 2r98 n VAL 187 CO 0.00 0.00 0.00 0.06 -1.32 0.00 0.00 176.83 175.57 2r98 h GLN 188 N 0.00 0.00 -0.46 5.55 3.07 -1.98 -3.19 115.11 118.10 2r98 h GLN 188 Ca 0.00 0.00 -0.08 0.00 0.09 0.00 0.00 58.65 58.66 2r98 h GLN 188 Cb 0.00 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 27.54 2r98 h GLN 188 CO 0.00 0.05 -0.04 0.00 0.09 0.00 0.00 178.83 178.93 2r98 h ALA 189 N 1.91 1.07 -0.25 0.06 0.00 -1.29 -1.86 119.26 118.89 2r98 h ALA 189 Ca -0.02 -0.28 -0.10 0.00 0.00 0.00 0.00 54.91 54.50 2r98 h ALA 189 Cb 1.09 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 2r98 h ALA 189 CO 0.01 0.58 -0.29 0.00 0.00 0.00 0.00 179.25 179.55 2r98 h ALA 190 N 1.23 1.04 0.00 0.00 0.00 -1.81 0.10 119.26 119.83 2r98 h ALA 190 Ca 0.13 -0.37 -0.22 0.00 0.00 0.00 0.00 54.91 54.46 2r98 h ALA 190 Cb 0.50 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 2r98 h ALA 190 CO 0.03 0.58 -1.06 0.00 0.00 0.00 0.00 179.25 178.80 2r98 h ALA 191 N 1.26 0.38 0.31 0.00 0.00 -1.50 -1.57 119.26 118.14 2r98 h ALA 191 Ca 0.06 -0.95 -0.02 0.00 0.00 0.00 0.00 54.91 54.00 2r98 h ALA 191 Cb 0.72 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2r98 h ALA 191 CO 0.06 1.27 -0.15 1.03 0.00 0.00 0.00 179.25 181.46 2r98 h SER 192 N 0.00 -0.35 -0.67 0.00 0.87 -0.91 -2.72 113.55 109.77 2r98 h SER 192 Ca -0.03 -0.18 0.14 0.00 -1.23 0.00 0.00 61.79 60.49 2r98 h SER 192 Cb 1.79 0.09 -0.10 0.00 -0.44 0.00 0.00 62.40 63.74 2r98 h SER 192 CO 0.13 0.02 0.12 0.58 -0.53 0.00 0.00 176.83 177.15 2r98 h VAL 193 N -0.77 0.55 -0.83 2.23 2.07 -1.06 -0.73 116.25 117.71 2r98 h VAL 193 Ca -0.04 -0.08 0.06 0.00 0.82 0.00 0.00 66.70 67.45 2r98 h VAL 193 Cb 0.51 0.29 -0.05 0.00 -1.52 0.00 0.00 31.29 30.52 2r98 h VAL 193 CO 0.07 0.04 0.54 0.00 0.02 0.00 0.00 177.57 178.25 2r98 h ALA 194 N 1.56 1.56 -0.07 1.67 0.00 -1.32 -1.04 119.26 121.62 2r98 h ALA 194 Ca 0.36 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.19 2r98 h ALA 194 Cb 0.59 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2r98 h ALA 194 CO -0.48 0.32 -0.18 0.28 0.00 0.00 0.00 179.25 179.19 2r98 h VAL 195 N 0.94 1.42 -0.59 0.00 2.07 -1.05 0.13 116.25 119.18 2r98 h VAL 195 Ca 0.35 -1.53 0.10 0.00 0.82 0.00 0.00 66.70 66.44 2r98 h VAL 195 Cb 0.17 2.24 -0.07 0.00 -1.52 0.00 0.00 31.29 32.11 2r98 h VAL 195 CO -0.12 0.43 0.19 0.28 0.02 0.00 0.00 177.57 178.37 2r98 h SER 196 N -0.24 0.15 1.21 0.57 0.02 -0.62 -1.89 113.55 112.74 2r98 h SER 196 Ca -0.00 0.09 0.00 0.00 -0.84 0.00 0.00 61.79 61.03 2r98 h SER 196 Cb 0.79 0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.42 2r98 h SER 196 CO 0.04 0.09 0.00 -0.07 -1.14 0.00 0.00 176.83 175.75 2r98 h LEU 197 N 0.35 0.00 -1.71 5.07 3.38 -1.17 -3.48 115.31 117.76 2r98 h LEU 197 Ca 0.30 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.74 2r98 h LEU 197 Cb 0.39 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 41.03 2r98 h LEU 197 CO -0.33 0.00 -0.88 0.00 0.09 0.00 0.00 178.44 177.32 2r98 n GLN 198 N -2.65 -2.97 -1.69 1.13 1.13 -0.11 -4.88 117.38 107.33 2r98 n GLN 198 Ca 0.03 0.36 -0.44 0.00 -1.94 0.00 0.00 57.00 55.01 2r98 n GLN 198 Cb 0.35 -4.57 -0.03 0.00 0.11 0.00 0.00 30.24 26.11 2r98 n GLN 198 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2r98 n ALA 199 N -4.42 1.63 0.20 -1.58 0.00 0.28 -4.88 120.51 111.74 2r98 n ALA 199 Ca -0.21 0.41 0.06 0.00 0.00 0.00 0.00 53.44 53.69 2r98 n ALA 199 Cb 0.63 -2.35 0.52 0.00 0.00 0.00 0.00 19.45 18.26 2r98 n ALA 199 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2r98 h GLU 200 N 4.77 0.08 -3.46 0.00 3.07 -1.85 -3.33 114.58 113.85 2r98 h GLU 200 Ca -0.45 -0.01 -0.30 0.00 -0.50 0.00 0.00 59.36 58.09 2r98 h GLU 200 Cb 1.25 -0.01 -0.34 0.00 -0.84 0.00 0.00 28.75 28.81 2r98 h GLU 200 CO 0.80 0.17 -0.71 0.21 -1.40 0.00 0.00 179.01 178.07 2r98 s LYS 201 N -4.85 -0.03 -0.17 2.33 2.20 -1.02 -2.27 119.74 115.93 2r98 s LYS 201 Ca -0.05 0.24 -0.05 0.00 -0.36 0.00 0.00 55.97 55.75 2r98 s LYS 201 Cb 0.16 -0.27 -0.03 0.00 -1.51 0.00 0.00 37.83 36.18 2r98 s LYS 201 CO 0.70 -0.19 -0.01 -1.17 -0.36 0.00 0.00 175.35 174.32 2r98 s LEU 202 N 1.23 3.32 -0.12 5.43 2.96 -0.45 -1.14 118.68 129.90 2r98 s LEU 202 Ca -0.07 -0.13 0.02 0.00 -0.22 0.00 0.00 54.13 53.73 2r98 s LEU 202 Cb -0.13 -1.82 0.01 0.00 0.50 0.00 0.00 46.19 44.76 2r98 s LEU 202 CO -0.03 0.13 -0.17 -0.69 -1.32 0.00 0.00 176.35 174.27 2r98 s VAL 203 N 0.58 1.66 -0.31 1.68 1.01 0.79 -0.50 120.40 125.31 2r98 s VAL 203 Ca -0.01 -0.74 -0.10 0.00 0.00 0.00 0.00 61.98 61.13 2r98 s VAL 203 Cb -0.14 -1.49 -0.01 0.00 0.00 0.00 0.00 36.38 34.73 2r98 s VAL 203 CO 0.02 0.47 0.15 -0.31 0.00 0.00 0.00 175.10 175.44 2r98 s TYR 204 N 0.91 3.18 -0.40 5.22 2.02 0.24 -0.56 117.35 127.95 2r98 s TYR 204 Ca -0.07 -0.52 -0.16 0.00 -0.37 0.00 0.00 57.07 55.95 2r98 s TYR 204 Cb -0.15 -2.35 0.02 0.00 -0.40 0.00 0.00 41.96 39.07 2r98 s TYR 204 CO -0.01 -0.43 0.36 -0.51 -1.57 0.00 0.00 175.55 173.38 2r98 s LEU 205 N 1.62 4.92 0.00 -1.29 1.43 -0.57 -1.39 118.68 123.41 2r98 s LEU 205 Ca 0.05 -0.73 0.00 0.00 -1.03 0.00 0.00 54.13 52.42 2r98 s LEU 205 Cb -0.17 -2.26 0.00 0.00 0.03 0.00 0.00 46.19 43.79 2r98 s LEU 205 CO 0.06 -0.48 0.01 0.35 0.23 0.00 0.00 176.35 176.53 2r98 n THR 206 N 5.27 0.00 -0.40 5.49 -2.24 0.37 -2.19 114.28 120.58 2r98 n THR 206 Ca -0.09 -1.13 0.11 0.00 -2.27 0.00 0.00 64.05 60.67 2r98 n THR 206 Cb 0.47 0.20 0.33 0.00 -2.10 0.00 0.00 70.33 69.23 2r98 n THR 206 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2r98 n LEU 207 N 0.00 4.06 -4.21 3.22 4.32 -1.26 0.15 117.00 123.28 2r98 n LEU 207 Ca -0.09 -2.06 -0.19 0.00 -0.02 0.00 0.00 56.01 53.64 2r98 n LEU 207 Cb 0.30 -0.50 -0.12 0.00 -1.62 0.00 0.00 43.42 41.49 2r98 n LEU 207 CO 0.16 0.97 -0.47 -0.94 -1.22 0.00 0.00 177.39 175.89 2r98 s SER 208 N -0.99 1.94 -1.21 -1.43 1.04 -1.26 -4.96 113.70 106.83 2r98 s SER 208 Ca 0.49 -0.69 -0.20 0.00 0.48 0.00 0.00 55.95 56.03 2r98 s SER 208 Cb 0.26 -0.07 0.02 0.00 0.10 0.00 0.00 66.02 66.33 2r98 s SER 208 CO 0.32 -0.07 1.76 -1.81 0.98 0.00 0.00 173.24 174.42 2r98 s ASP 209 N -1.98 6.28 0.66 7.02 1.01 -1.26 -2.65 116.67 125.75 2r98 s ASP 209 Ca 0.03 -2.04 0.00 0.00 0.71 0.00 0.00 52.55 51.25 2r98 s ASP 209 Cb -0.09 -2.58 0.00 0.00 1.01 0.00 0.00 42.92 41.26 2r98 s ASP 209 CO 0.03 -1.75 0.00 0.61 0.21 0.00 0.00 175.17 174.27 2r98 n GLY 210 N 5.77 0.85 3.06 0.21 0.00 -1.23 -4.71 105.19 109.14 2r98 n GLY 210 Ca 0.45 -0.73 -0.28 0.00 0.00 0.00 0.00 46.02 45.46 2r98 n GLY 210 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2r98 s ILE 211 N 0.00 1.50 0.34 -0.61 1.01 -1.26 -4.93 121.20 117.25 2r98 s ILE 211 Ca 0.00 -0.65 -0.24 0.00 0.00 0.00 0.00 60.65 59.76 2r98 s ILE 211 Cb 0.00 -1.37 -0.10 0.00 0.01 0.00 0.00 42.46 41.00 2r98 s ILE 211 CO 0.00 0.44 0.93 -0.44 0.00 0.00 0.00 174.94 175.87 2r98 s SER 212 N 0.94 7.20 0.76 3.58 0.01 -1.26 -0.40 113.70 124.53 2r98 s SER 212 Ca -0.08 1.76 -0.11 0.00 1.31 0.00 0.00 55.95 58.84 2r98 s SER 212 Cb -0.15 -2.55 0.06 0.00 0.21 0.00 0.00 66.02 63.59 2r98 s SER 212 CO -0.01 -0.14 1.12 -0.13 0.41 0.00 0.00 173.24 174.49 2r98 s ARG 213 N -2.37 2.21 0.30 12.44 0.52 0.40 -4.77 118.95 127.68 2r98 s ARG 213 Ca 0.53 0.10 0.03 0.00 -0.52 0.00 0.00 55.73 55.87 2r98 s ARG 213 Cb -0.16 -2.02 0.76 0.00 0.52 0.00 0.00 34.95 34.05 2r98 s ARG 213 CO 0.21 -1.39 1.61 -1.35 0.02 0.00 0.00 175.30 174.40 2r98 h PRO 214 N -0.86 0.11 -2.03 3.54 0.11 -1.96 0.18 132.00 131.09 2r98 h PRO 214 Ca -0.45 -0.01 -0.77 0.00 0.11 0.00 0.00 66.00 64.87 2r98 h PRO 214 Cb 1.31 -0.02 -0.27 0.00 0.11 0.00 0.00 31.00 32.13 2r98 h PRO 214 CO 0.64 0.07 1.07 -0.25 -0.21 0.00 0.00 178.00 179.32 2r98 n ASP 215 N -5.33 7.52 0.00 -2.05 8.00 -1.26 -4.89 116.55 118.54 2r98 n ASP 215 Ca 0.23 -3.82 0.00 0.00 0.71 0.00 0.00 54.79 51.90 2r98 n ASP 215 Cb 0.74 -1.08 0.00 0.00 -0.02 0.00 0.00 41.12 40.76 2r98 n ASP 215 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2r98 n GLY 216 N -0.48 1.09 3.72 0.44 0.00 0.63 -4.98 105.19 105.61 2r98 n GLY 216 Ca 0.53 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 46.14 2r98 n GLY 216 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2r98 s THR 217 N -2.70 3.89 -0.00 2.61 -1.32 -1.26 -4.73 115.64 112.13 2r98 s THR 217 Ca 0.00 1.46 -0.30 0.00 -1.21 0.00 0.00 61.69 61.64 2r98 s THR 217 Cb 0.00 -3.94 -0.06 0.00 -1.51 0.00 0.00 72.50 66.99 2r98 s THR 217 CO 0.00 0.17 1.58 -0.22 -2.21 0.00 0.00 174.62 173.95 2r98 s LEU 218 N 0.42 4.33 -1.00 9.08 0.20 -1.26 0.15 118.68 130.60 2r98 s LEU 218 Ca 0.55 2.27 -0.23 0.00 0.69 0.00 0.00 54.13 57.41 2r98 s LEU 218 Cb -0.30 -3.55 -0.14 0.00 -0.43 0.00 0.00 46.19 41.77 2r98 s LEU 218 CO 0.32 -0.86 1.93 0.00 -0.29 0.00 0.00 176.35 177.45 2r98 n ALA 219 N 6.21 2.08 -0.17 5.97 0.00 0.46 -4.84 120.51 130.22 2r98 n ALA 219 Ca 0.16 -3.03 -0.01 0.00 0.00 0.00 0.00 53.44 50.56 2r98 n ALA 219 Cb 0.42 -3.53 0.02 0.00 0.00 0.00 0.00 19.45 16.36 2r98 n ALA 219 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2r98 n GLU 220 N 7.88 -0.11 -3.71 0.00 4.07 -1.26 -4.21 120.64 123.31 2r98 n GLU 220 Ca 0.46 0.69 -0.12 0.00 -0.06 0.00 0.00 57.16 58.13 2r98 n GLU 220 Cb 0.45 -1.03 -0.13 0.00 -0.06 0.00 0.00 31.44 30.67 2r98 n GLU 220 CO 0.00 0.00 0.00 -0.08 -0.06 0.00 0.00 177.13 176.99 2r98 s THR 221 N -5.42 -0.13 0.01 6.31 -1.32 -1.26 -1.38 115.64 112.45 2r98 s THR 221 Ca -0.06 0.17 0.04 0.00 -1.21 0.00 0.00 61.69 60.62 2r98 s THR 221 Cb 0.09 -0.43 -0.01 0.00 -1.51 0.00 0.00 72.50 70.64 2r98 s THR 221 CO 0.32 0.07 -0.11 -0.76 -2.21 0.00 0.00 174.62 171.93 2r98 s LEU 222 N 1.54 2.10 0.89 9.08 1.43 0.68 -4.94 118.68 129.47 2r98 s LEU 222 Ca -0.07 -0.32 -0.12 0.00 -1.03 0.00 0.00 54.13 52.59 2r98 s LEU 222 Cb -0.10 -0.52 0.12 0.00 0.03 0.00 0.00 46.19 45.72 2r98 s LEU 222 CO -0.09 0.06 1.10 -0.94 0.23 0.00 0.00 176.35 176.71 2r98 s SER 223 N -0.69 3.63 0.43 2.29 1.04 -1.26 -2.02 113.70 117.12 2r98 s SER 223 Ca 0.02 1.31 0.16 0.00 0.48 0.00 0.00 55.95 57.92 2r98 s SER 223 Cb -0.06 -1.99 0.96 0.00 0.10 0.00 0.00 66.02 65.03 2r98 s SER 223 CO 0.00 -2.51 1.94 0.00 0.98 0.00 0.00 173.24 173.65 2r98 h ALA 224 N -1.46 1.51 0.38 5.32 0.00 -1.48 -1.43 119.26 122.10 2r98 h ALA 224 Ca -0.50 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.17 2r98 h ALA 224 Cb 1.29 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2r98 h ALA 224 CO 0.57 0.31 -0.18 0.37 0.00 0.00 0.00 179.25 180.32 2r98 h GLN 225 N 0.00 -0.49 -0.06 0.00 4.15 -1.92 -0.64 115.11 116.15 2r98 h GLN 225 Ca -0.00 0.03 -0.01 0.00 0.77 0.00 0.00 58.65 59.44 2r98 h GLN 225 Cb 0.45 0.11 -0.00 0.00 0.21 0.00 0.00 27.48 28.25 2r98 h GLN 225 CO 0.03 -0.26 -0.03 0.93 -1.93 0.00 0.00 178.83 177.57 2r98 h GLU 226 N -0.62 0.08 0.26 1.69 5.08 -1.89 -0.18 114.58 119.00 2r98 h GLU 226 Ca -0.05 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 2r98 h GLU 226 Cb 0.46 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.69 2r98 h GLU 226 CO 0.09 0.12 -0.13 0.00 -1.00 0.00 0.00 179.01 178.09 2r98 h ALA 227 N 1.89 -0.35 -0.84 3.43 0.00 -1.09 -2.16 119.26 120.13 2r98 h ALA 227 Ca 0.02 -0.16 0.15 0.00 0.00 0.00 0.00 54.91 54.92 2r98 h ALA 227 Cb 0.12 0.14 -0.15 0.00 0.00 0.00 0.00 17.79 17.89 2r98 h ALA 227 CO 0.01 -0.56 -0.28 0.37 0.00 0.00 0.00 179.25 178.78 2r98 h GLN 228 N -0.62 -0.03 0.00 0.00 5.75 -0.49 -2.54 115.11 117.17 2r98 h GLN 228 Ca -0.04 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.47 2r98 h GLN 228 Cb 0.44 0.01 0.00 0.00 1.07 0.00 0.00 27.48 29.00 2r98 h GLN 228 CO 0.06 -0.02 0.00 -1.13 -2.65 0.00 0.00 178.83 175.09 2r98 n SER 229 N -5.51 0.05 0.11 -0.69 3.41 -0.14 -2.56 113.62 108.28 2r98 n SER 229 Ca 0.10 0.51 -0.04 0.00 -0.26 0.00 0.00 58.87 59.18 2r98 n SER 229 Cb 0.41 -0.52 0.08 0.00 -0.26 0.00 0.00 64.21 63.93 2r98 n SER 229 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2r98 h LEU 230 N 0.00 0.07 -1.15 1.04 3.38 -0.96 -3.32 115.31 114.37 2r98 h LEU 230 Ca 0.00 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 2r98 h LEU 230 Cb 0.48 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.20 2r98 h LEU 230 CO 0.00 0.77 -0.08 0.00 0.09 0.00 0.00 178.44 179.22 2r98 h ALA 231 N 1.23 1.00 -0.97 1.53 0.00 -1.38 -2.97 119.26 117.70 2r98 h ALA 231 Ca -0.01 -0.07 0.13 0.00 0.00 0.00 0.00 54.91 54.95 2r98 h ALA 231 Cb 1.28 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.98 2r98 h ALA 231 CO 0.10 0.10 0.61 0.93 0.00 0.00 0.00 179.25 180.99 2r98 h GLU 232 N 0.00 0.87 -0.20 0.00 5.08 -1.69 -1.78 114.58 116.86 2r98 h GLU 232 Ca -0.00 -0.05 -0.10 0.00 -1.00 0.00 0.00 59.36 58.21 2r98 h GLU 232 Cb 0.66 -0.20 -0.06 0.00 0.50 0.00 0.00 28.75 29.66 2r98 h GLU 232 CO 0.01 0.57 -0.27 0.72 -1.00 0.00 0.00 179.01 179.04 2r98 n HIS 233 N -4.60 0.60 -4.06 4.33 8.25 -1.13 -5.04 115.22 113.57 2r98 n HIS 233 Ca 0.19 -1.57 -0.27 0.00 -0.26 0.00 0.00 57.72 55.81 2r98 n HIS 233 Cb 0.40 -0.39 -0.05 0.00 1.12 0.00 0.00 29.99 31.07 2r98 n HIS 233 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2r98 s ALA 234 N -3.25 3.61 0.88 -1.41 0.00 -0.67 -5.07 121.76 115.86 2r98 s ALA 234 Ca 0.42 -1.17 -0.12 0.00 0.00 0.00 0.00 51.96 51.09 2r98 s ALA 234 Cb 0.39 -1.42 0.07 0.00 0.00 0.00 0.00 23.12 22.17 2r98 s ALA 234 CO -0.03 0.54 0.84 0.00 0.00 0.00 0.00 175.76 177.11 2r98 n ALA 235 N -0.27 -1.31 -0.00 0.00 0.00 -1.26 -4.78 120.51 112.89 2r98 n ALA 235 Ca -0.08 -0.49 -0.10 0.00 0.00 0.00 0.00 53.44 52.78 2r98 n ALA 235 Cb 0.54 -2.04 0.05 0.00 0.00 0.00 0.00 19.45 18.01 2r98 n ALA 235 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2r98 h SER 236 N -1.38 0.64 0.41 0.00 4.64 -1.99 -1.40 113.55 114.46 2r98 h SER 236 Ca -0.44 -0.34 -0.01 0.00 -0.47 0.00 0.00 61.79 60.53 2r98 h SER 236 Cb 1.29 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 63.18 2r98 h SER 236 CO 0.40 1.05 -0.34 -0.08 -0.87 0.00 0.00 176.83 176.99 2r98 h GLU 237 N 0.45 -0.72 0.00 4.77 4.81 -2.00 -1.00 114.58 120.90 2r98 h GLU 237 Ca 0.01 0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.29 2r98 h GLU 237 Cb 1.07 0.16 -0.00 0.00 0.63 0.00 0.00 28.75 30.62 2r98 h GLU 237 CO 0.10 -0.48 -0.00 0.00 -0.73 0.00 0.00 179.01 177.90 2r98 h THR 238 N -0.75 0.02 0.02 0.32 1.03 -1.90 -0.25 112.91 111.40 2r98 h THR 238 Ca -0.04 -0.14 -0.21 0.00 -0.01 0.00 0.00 66.41 66.01 2r98 h THR 238 Cb 0.65 1.14 -0.01 0.00 -1.07 0.00 0.00 68.15 68.86 2r98 h THR 238 CO -0.02 0.00 -0.93 -0.09 -0.01 0.00 0.00 175.52 174.47 2r98 h ARG 239 N 0.00 0.22 -0.14 0.00 9.65 -0.09 -2.14 114.38 121.88 2r98 h ARG 239 Ca -0.00 -0.26 -0.20 0.00 -1.10 0.00 0.00 59.98 58.42 2r98 h ARG 239 Cb 0.14 0.08 0.01 0.00 -1.39 0.00 0.00 29.97 28.80 2r98 h ARG 239 CO 0.00 1.00 -0.70 0.00 2.80 0.00 0.00 179.97 183.07 2r98 h ARG 240 N 0.11 0.72 -0.44 0.20 3.08 -0.06 -0.05 114.38 117.94 2r98 h ARG 240 Ca -0.06 -0.59 0.09 0.00 0.07 0.00 0.00 59.98 59.49 2r98 h ARG 240 Cb 1.58 0.12 -0.10 0.00 0.08 0.00 0.00 29.97 31.65 2r98 h ARG 240 CO 0.14 1.20 -0.28 -0.07 -1.07 0.00 0.00 179.97 179.90 2r98 h LEU 241 N 0.42 -0.95 -0.79 3.04 3.38 -1.15 -0.61 115.31 118.66 2r98 h LEU 241 Ca -0.05 0.19 -0.11 0.00 0.09 0.00 0.00 57.88 58.00 2r98 h LEU 241 Cb 1.34 0.47 -0.01 0.00 0.09 0.00 0.00 40.66 42.54 2r98 h LEU 241 CO 0.15 -0.29 -0.25 0.40 0.09 0.00 0.00 178.44 178.54 2r98 h ILE 242 N -0.19 1.27 -0.01 1.22 2.04 -0.69 0.29 117.51 121.43 2r98 h ILE 242 Ca 0.20 -1.32 -0.00 0.00 1.00 0.00 0.00 64.86 64.73 2r98 h ILE 242 Cb 0.51 1.29 -0.00 0.00 -0.74 0.00 0.00 36.82 37.88 2r98 h ILE 242 CO -0.55 0.43 -0.00 -1.28 0.00 0.00 0.00 178.15 176.75 2r98 h SER 243 N 0.56 0.02 -0.50 1.72 0.87 -0.66 0.72 113.55 116.28 2r98 h SER 243 Ca 0.08 -0.37 -0.00 0.00 -1.23 0.00 0.00 61.79 60.26 2r98 h SER 243 Cb 0.72 -0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 62.65 2r98 h SER 243 CO 0.06 0.39 0.30 0.28 -0.53 0.00 0.00 176.83 177.33 2r98 h SER 244 N -0.35 0.60 -0.22 6.23 0.02 -0.79 -2.16 113.55 116.88 2r98 h SER 244 Ca 0.00 -0.06 -0.01 0.00 -0.84 0.00 0.00 61.79 60.89 2r98 h SER 244 Cb 0.38 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.76 2r98 h SER 244 CO 0.00 0.48 0.13 0.00 -1.14 0.00 0.00 176.83 176.30 2r98 h ALA 245 N 1.15 1.75 -0.15 3.77 0.00 -0.68 -0.66 119.26 124.44 2r98 h ALA 245 Ca 0.18 -0.05 -0.15 0.00 0.00 0.00 0.00 54.91 54.88 2r98 h ALA 245 Cb -0.01 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 17.68 2r98 h ALA 245 CO -0.03 0.21 -0.51 0.28 0.00 0.00 0.00 179.25 179.19 2r98 h VAL 246 N 0.34 1.34 -0.14 0.00 2.07 -0.70 -2.27 116.25 116.89 2r98 h VAL 246 Ca 0.09 -1.78 -0.09 0.00 0.82 0.00 0.00 66.70 65.74 2r98 h VAL 246 Cb 0.03 2.04 -0.01 0.00 -1.52 0.00 0.00 31.29 31.83 2r98 h VAL 246 CO -0.01 0.55 -0.31 0.00 0.02 0.00 0.00 177.57 177.82 2r98 h ALA 247 N 0.53 1.22 0.50 1.67 0.00 -0.86 -0.35 119.26 121.98 2r98 h ALA 247 Ca -0.02 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.52 2r98 h ALA 247 Cb 1.14 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.84 2r98 h ALA 247 CO 0.11 0.52 -0.24 0.00 0.00 0.00 0.00 179.25 179.64 2r98 h ALA 248 N 1.44 -0.68 -0.30 0.00 0.00 -0.97 0.13 119.26 118.88 2r98 h ALA 248 Ca 0.03 -0.18 0.06 0.00 0.00 0.00 0.00 54.91 54.82 2r98 h ALA 248 Cb 0.67 0.26 -0.08 0.00 0.00 0.00 0.00 17.79 18.64 2r98 h ALA 248 CO 0.05 -0.80 -0.39 -0.07 0.00 0.00 0.00 179.25 178.04 2r98 h LEU 249 N -0.84 -1.27 -1.19 0.00 3.38 -1.38 -0.40 115.31 113.61 2r98 h LEU 249 Ca -0.07 0.19 0.22 0.00 0.09 0.00 0.00 57.88 58.31 2r98 h LEU 249 Cb 0.59 0.55 -0.10 0.00 0.09 0.00 0.00 40.66 41.79 2r98 h LEU 249 CO 0.11 -0.37 0.62 -0.33 0.09 0.00 0.00 178.44 178.57 2r98 h GLU 250 N -0.36 0.56 -0.04 1.13 5.08 -0.90 0.11 114.58 120.16 2r98 h GLU 250 Ca 0.12 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 2r98 h GLU 250 Cb 0.58 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.70 2r98 h GLU 250 CO -0.49 0.37 0.00 0.41 -1.00 0.00 0.00 179.01 178.30 2r98 n GLY 251 N -1.40 -0.38 0.00 -3.84 0.00 0.44 -4.88 105.19 95.14 2r98 n GLY 251 Ca 0.24 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.94 2r98 n GLY 251 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2r98 n GLY 252 N 1.05 1.57 3.77 -0.02 0.00 0.38 -4.89 105.19 107.04 2r98 n GLY 252 Ca 0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.82 2r98 n GLY 252 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2r98 s VAL 253 N -1.65 3.34 -0.09 1.61 1.01 -0.90 -4.91 120.40 118.80 2r98 s VAL 253 Ca 0.00 1.20 0.05 0.00 0.00 0.00 0.00 61.98 63.24 2r98 s VAL 253 Cb 0.00 -3.71 -0.24 0.00 0.00 0.00 0.00 36.38 32.43 2r98 s VAL 253 CO 0.00 0.18 0.48 1.41 0.00 0.00 0.00 175.10 177.17 2r98 n HIS 254 N 0.52 1.00 -3.67 5.22 -0.00 -1.19 -4.06 115.22 113.05 2r98 n HIS 254 Ca 0.02 0.29 -0.09 0.00 -0.00 0.00 0.00 57.72 57.95 2r98 n HIS 254 Cb 0.46 -1.16 -0.10 0.00 -0.00 0.00 0.00 29.99 29.19 2r98 n HIS 254 CO 0.00 0.00 0.00 0.50 -0.00 0.00 0.00 176.34 176.84 2r98 s ARG 255 N -2.57 0.39 -0.08 -0.41 6.06 -0.96 -4.57 118.95 116.80 2r98 s ARG 255 Ca -0.13 0.98 -0.01 0.00 -2.50 0.00 0.00 55.73 54.07 2r98 s ARG 255 Cb 0.07 0.21 -0.03 0.00 0.06 0.00 0.00 34.95 35.27 2r98 s ARG 255 CO 0.80 -0.21 -0.02 0.14 -2.50 0.00 0.00 175.30 173.51 2r98 s VAL 256 N 2.11 4.09 -0.03 7.11 -7.23 -0.89 -1.34 120.40 124.22 2r98 s VAL 256 Ca -0.05 -0.33 0.06 0.00 -1.81 0.00 0.00 61.98 59.85 2r98 s VAL 256 Cb -0.10 -2.71 -0.01 0.00 0.56 0.00 0.00 36.38 34.12 2r98 s VAL 256 CO -0.14 0.60 -0.22 -1.10 -0.31 0.00 0.00 175.10 173.93 2r98 s GLN 257 N -0.79 1.95 -0.21 4.82 -0.21 0.34 -1.09 119.66 124.48 2r98 s GLN 257 Ca 0.12 -0.79 -0.03 0.00 0.02 0.00 0.00 55.36 54.68 2r98 s GLN 257 Cb -0.11 -1.80 -0.00 0.00 1.00 0.00 0.00 33.01 32.09 2r98 s GLN 257 CO 0.02 0.43 -0.08 0.42 -2.12 0.00 0.00 175.29 173.96 2r98 s ILE 258 N -0.37 3.10 0.34 1.08 -1.09 0.56 0.79 121.20 125.60 2r98 s ILE 258 Ca 0.04 -0.59 0.03 0.00 -2.23 0.00 0.00 60.65 57.91 2r98 s ILE 258 Cb -0.10 -2.39 -0.04 0.00 -1.58 0.00 0.00 42.46 38.35 2r98 s ILE 258 CO 0.00 0.45 0.11 -0.76 -1.23 0.00 0.00 174.94 173.52 2r98 s LEU 259 N 1.35 1.93 -0.51 2.97 1.43 -0.49 -1.55 118.68 123.81 2r98 s LEU 259 Ca 0.04 -1.51 -0.17 0.00 -1.03 0.00 0.00 54.13 51.47 2r98 s LEU 259 Cb -0.14 -0.12 0.09 0.00 0.03 0.00 0.00 46.19 46.05 2r98 s LEU 259 CO -0.04 -0.79 0.49 0.21 0.23 0.00 0.00 176.35 176.45 2r98 s ASN 260 N -3.48 6.17 0.33 2.29 3.84 -1.08 -0.48 114.94 122.54 2r98 s ASN 260 Ca 0.32 -1.38 0.26 0.00 0.21 0.00 0.00 52.86 52.28 2r98 s ASN 260 Cb 0.06 -2.22 1.12 0.00 -0.55 0.00 0.00 41.25 39.66 2r98 s ASN 260 CO 0.15 -0.79 1.78 1.23 -2.79 0.00 0.00 177.10 176.68 2r98 h GLY 261 N 9.08 0.00 1.77 1.21 0.00 0.12 -2.23 103.07 113.02 2r98 h GLY 261 Ca -0.29 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.04 2r98 h GLY 261 CO 0.96 0.00 -0.13 0.00 0.00 0.00 0.00 176.54 177.37 2r98 n ALA 262 N -1.84 2.58 -2.66 3.60 0.00 -1.24 -4.82 120.51 116.12 2r98 n ALA 262 Ca 0.01 -0.14 -0.38 0.00 0.00 0.00 0.00 53.44 52.93 2r98 n ALA 262 Cb 0.22 -1.39 -0.08 0.00 0.00 0.00 0.00 19.45 18.20 2r98 n ALA 262 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2r98 s ALA 263 N -3.03 3.58 -0.14 0.00 0.00 -0.84 -4.99 121.76 116.34 2r98 s ALA 263 Ca 0.12 -0.68 -0.29 0.00 0.00 0.00 0.00 51.96 51.12 2r98 s ALA 263 Cb 0.17 -2.54 -0.06 0.00 0.00 0.00 0.00 23.12 20.70 2r98 s ALA 263 CO 0.58 -0.30 2.00 0.34 0.00 0.00 0.00 175.76 178.38 2r98 s ASP 264 N 1.11 5.98 0.00 0.00 3.68 -1.26 -2.01 116.67 124.17 2r98 s ASP 264 Ca 0.15 2.07 0.00 0.00 2.13 0.00 0.00 52.55 56.90 2r98 s ASP 264 Cb -0.14 -2.52 0.00 0.00 -1.45 0.00 0.00 42.92 38.80 2r98 s ASP 264 CO 0.07 -1.52 0.00 0.61 0.13 0.00 0.00 175.17 174.46 2r98 n GLY 265 N 5.13 0.76 0.22 2.66 0.00 -1.26 -4.99 105.19 107.70 2r98 n GLY 265 Ca 0.24 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.25 2r98 n GLY 265 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2r98 h SER 266 N 0.00 -0.12 -0.96 1.61 4.64 -1.69 -1.25 113.55 115.78 2r98 h SER 266 Ca 0.00 0.12 0.23 0.00 -0.47 0.00 0.00 61.79 61.67 2r98 h SER 266 Cb 0.00 0.19 -0.07 0.00 -0.31 0.00 0.00 62.40 62.21 2r98 h SER 266 CO 0.00 -0.04 0.63 0.25 -0.87 0.00 0.00 176.83 176.80 2r98 h LEU 267 N 0.18 0.38 0.21 5.97 6.46 -1.88 0.15 115.31 126.77 2r98 h LEU 267 Ca 0.29 0.05 -0.31 0.00 -0.12 0.00 0.00 57.88 57.78 2r98 h LEU 267 Cb 0.43 -0.02 0.02 0.00 -0.73 0.00 0.00 40.66 40.37 2r98 h LEU 267 CO -0.42 0.12 -1.43 -0.07 -0.62 0.00 0.00 178.44 176.02 2r98 h LEU 268 N 0.36 0.68 -0.95 2.25 4.07 -1.66 -2.71 115.31 117.35 2r98 h LEU 268 Ca 0.51 -0.92 -0.08 0.00 0.08 0.00 0.00 57.88 57.46 2r98 h LEU 268 Cb 1.35 -0.22 -0.02 0.00 1.08 0.00 0.00 40.66 42.86 2r98 h LEU 268 CO -0.19 1.67 -0.15 1.56 -1.08 0.00 0.00 178.44 180.25 2r98 h GLN 269 N 0.00 0.60 0.00 1.13 4.20 -1.16 -1.60 115.11 118.29 2r98 h GLN 269 Ca -0.27 -0.19 0.00 0.00 0.06 0.00 0.00 58.65 58.25 2r98 h GLN 269 Cb 2.02 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 29.75 2r98 h GLN 269 CO 0.21 0.73 0.00 0.39 -0.67 0.00 0.00 178.83 179.49 2r98 n GLU 270 N -4.17 0.00 0.13 1.46 -0.58 0.51 -3.30 120.64 114.70 2r98 n GLU 270 Ca 0.01 0.66 0.03 0.00 -0.42 0.00 0.00 57.16 57.44 2r98 n GLU 270 Cb 0.36 -1.38 0.42 0.00 -0.57 0.00 0.00 31.44 30.27 2r98 n GLU 270 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 2r98 h LEU 271 N 0.00 0.19 -2.71 -4.62 3.38 -1.33 -3.35 115.31 106.88 2r98 h LEU 271 Ca 0.00 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2r98 h LEU 271 Cb 0.00 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.70 2r98 h LEU 271 CO 0.00 0.33 -0.02 0.49 0.09 0.00 0.00 178.44 179.32 2r98 n PHE 272 N -4.31 0.00 -4.32 1.13 3.72 -0.62 -4.83 117.46 108.23 2r98 n PHE 272 Ca -0.01 -0.53 -0.24 0.00 -0.05 0.00 0.00 57.45 56.62 2r98 n PHE 272 Cb 0.24 -0.07 -0.12 0.00 -0.94 0.00 0.00 39.48 38.59 2r98 n PHE 272 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 2r98 s THR 273 N -1.24 1.87 0.24 4.37 -4.23 -1.21 -3.82 115.64 111.61 2r98 s THR 273 Ca 0.07 -1.69 -0.05 0.00 -1.18 0.00 0.00 61.69 58.84 2r98 s THR 273 Cb 0.06 -1.73 0.20 0.00 1.34 0.00 0.00 72.50 72.38 2r98 s THR 273 CO 0.01 -0.09 1.81 -0.09 -0.54 0.00 0.00 174.62 175.71 2r98 h ARG 274 N 3.82 0.74 0.00 3.99 2.43 -1.89 -3.40 114.38 120.07 2r98 h ARG 274 Ca -0.46 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.66 2r98 h ARG 274 Cb 1.19 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 30.57 2r98 h ARG 274 CO 0.42 0.49 0.00 0.09 -1.51 0.00 0.00 179.97 179.46 2r98 n ASN 275 N -4.76 0.00 0.00 -3.80 5.03 -1.26 -5.08 115.26 105.39 2r98 n ASN 275 Ca 0.13 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.58 2r98 n ASN 275 Cb 0.27 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.03 2r98 n ASN 275 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2r98 n GLY 276 N 3.28 0.56 0.00 7.41 0.00 -1.23 -4.89 105.19 110.32 2r98 n GLY 276 Ca 0.00 -2.15 0.00 0.00 0.00 0.00 0.00 46.02 43.87 2r98 n GLY 276 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2r98 n ILE 277 N 3.17 0.00 0.00 -0.61 -6.64 -1.26 -4.78 119.36 109.24 2r98 n ILE 277 Ca 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 62.75 60.98 2r98 n ILE 277 Cb 0.00 0.31 0.00 0.00 -1.44 0.00 0.00 39.64 38.51 2r98 n ILE 277 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 2r98 n GLY 278 N 0.00 2.76 3.11 3.28 0.00 -1.26 -4.61 105.19 108.47 2r98 n GLY 278 Ca 0.00 -0.36 -0.23 0.00 0.00 0.00 0.00 46.02 45.43 2r98 n GLY 278 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2r98 s THR 279 N 4.00 1.17 -0.06 2.61 2.01 -0.60 -4.21 115.64 120.55 2r98 s THR 279 Ca 0.00 -0.62 0.02 0.00 0.31 0.00 0.00 61.69 61.41 2r98 s THR 279 Cb 0.00 -0.98 0.01 0.00 0.01 0.00 0.00 72.50 71.54 2r98 s THR 279 CO 0.00 0.33 -0.12 -0.55 -0.69 0.00 0.00 174.62 173.59 2r98 s SER 280 N -0.23 1.80 -0.02 3.53 0.15 -0.48 -0.32 113.70 118.12 2r98 s SER 280 Ca 0.03 -0.30 0.06 0.00 0.70 0.00 0.00 55.95 56.44 2r98 s SER 280 Cb -0.07 -0.82 -0.01 0.00 -1.71 0.00 0.00 66.02 63.40 2r98 s SER 280 CO -0.00 0.04 -0.20 -0.63 1.20 0.00 0.00 173.24 173.65 2r98 s ILE 281 N 0.64 1.56 0.07 6.45 1.01 -0.25 -0.23 121.20 130.45 2r98 s ILE 281 Ca -0.14 -0.83 -0.08 0.00 0.00 0.00 0.00 60.65 59.59 2r98 s ILE 281 Cb -0.16 -1.31 -0.00 0.00 0.01 0.00 0.00 42.46 41.00 2r98 s ILE 281 CO 0.04 0.44 0.17 0.00 0.00 0.00 0.00 174.94 175.59 2r98 s ALA 282 N -0.35 -0.18 -0.32 9.38 0.00 -0.85 -2.09 121.76 127.35 2r98 s ALA 282 Ca 0.05 -0.59 0.03 0.00 0.00 0.00 0.00 51.96 51.45 2r98 s ALA 282 Cb -0.09 0.41 0.08 0.00 0.00 0.00 0.00 23.12 23.52 2r98 s ALA 282 CO 0.00 -0.45 0.00 0.21 0.00 0.00 0.00 175.76 175.52 2r98 s LYS 283 N -3.50 1.83 0.00 0.00 2.20 -1.26 -1.06 119.74 117.94 2r98 s LYS 283 Ca 0.02 -1.66 0.00 0.00 -0.36 0.00 0.00 55.97 53.97 2r98 s LYS 283 Cb 0.03 -3.13 0.00 0.00 -1.51 0.00 0.00 37.83 33.23 2r98 s LYS 283 CO -0.09 -0.81 0.00 -0.85 -0.36 0.00 0.00 175.35 173.24 2r98 n GLU 284 N 4.36 0.00 -1.31 4.03 0.00 -1.26 -5.01 120.64 121.45 2r98 n GLU 284 Ca -0.03 0.00 -0.33 0.00 0.00 0.00 0.00 57.16 56.80 2r98 n GLU 284 Cb 0.42 0.00 0.10 0.00 0.00 0.00 0.00 31.44 31.96 2r98 n GLU 284 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2r98 s ALA 285 N 0.00 2.05 0.16 -1.84 0.00 -1.26 -4.95 121.76 115.92 2r98 s ALA 285 Ca 0.00 0.71 -0.31 0.00 0.00 0.00 0.00 51.96 52.36 2r98 s ALA 285 Cb 0.00 -3.42 -0.08 0.00 0.00 0.00 0.00 23.12 19.61 2r98 s ALA 285 CO 0.00 -1.96 1.35 -0.59 0.00 0.00 0.00 175.76 174.56 2r98 s PHE 286 N -2.27 3.24 -0.37 0.00 -0.12 -1.26 -5.00 117.98 112.20 2r98 s PHE 286 Ca 0.70 1.08 0.05 0.00 -0.05 0.00 0.00 56.93 58.71 2r98 s PHE 286 Cb -0.25 -3.65 0.17 0.00 -0.63 0.00 0.00 43.02 38.65 2r98 s PHE 286 CO 0.48 -2.15 0.47 0.08 -0.05 0.00 0.00 175.22 174.05 2r98 s VAL 287 N 0.60 -0.62 -0.92 -2.49 1.01 -1.26 -5.08 120.40 111.63 2r98 s VAL 287 Ca 0.61 -0.51 -0.24 0.00 0.00 0.00 0.00 61.98 61.83 2r98 s VAL 287 Cb -0.37 -0.53 -0.23 0.00 0.00 0.00 0.00 36.38 35.25 2r98 s VAL 287 CO 0.34 -0.32 2.51 -0.24 0.00 0.00 0.00 175.10 177.39 2r98 n SER 288 N 4.55 0.18 -4.39 3.32 2.88 -1.26 -4.95 113.62 113.95 2r98 n SER 288 Ca 0.09 -0.20 -0.34 0.00 -1.33 0.00 0.00 58.87 57.09 2r98 n SER 288 Cb 0.50 -0.95 -0.13 0.00 -0.75 0.00 0.00 64.21 62.88 2r98 n SER 288 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 2r98 s ILE 289 N 7.45 3.56 0.13 2.46 1.01 -1.26 -1.96 121.20 132.59 2r98 s ILE 289 Ca 1.28 -0.45 -0.00 0.00 0.00 0.00 0.00 60.65 61.47 2r98 s ILE 289 Cb -0.95 -2.59 -0.04 0.00 0.01 0.00 0.00 42.46 38.89 2r98 s ILE 289 CO 0.46 0.46 0.02 0.00 0.00 0.00 0.00 174.94 175.88 2r98 s ARG 290 N 0.94 0.91 -0.36 2.79 1.70 -0.70 -4.99 118.95 119.24 2r98 s ARG 290 Ca -0.00 -1.42 -0.42 0.00 -0.47 0.00 0.00 55.73 53.42 2r98 s ARG 290 Cb -0.15 0.10 -0.17 0.00 -0.57 0.00 0.00 34.95 34.17 2r98 s ARG 290 CO 0.01 -0.20 1.78 1.04 -1.08 0.00 0.00 175.30 176.85 2r98 n GLN 291 N -0.09 0.75 -1.64 3.89 1.13 -1.26 -1.04 117.38 119.12 2r98 n GLN 291 Ca -0.07 0.27 -0.47 0.00 -1.94 0.00 0.00 57.00 54.78 2r98 n GLN 291 Cb 0.63 -1.93 -0.04 0.00 0.11 0.00 0.00 30.24 29.01 2r98 n GLN 291 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2r98 n ALA 292 N 5.59 0.46 -3.72 -1.58 0.00 -0.71 -4.85 120.51 115.69 2r98 n ALA 292 Ca 0.31 0.45 -0.16 0.00 0.00 0.00 0.00 53.44 54.04 2r98 n ALA 292 Cb 0.07 -2.21 0.00 0.00 0.00 0.00 0.00 19.45 17.31 2r98 n ALA 292 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 2r98 n HIS 293 N 2.30 -0.97 1.08 0.00 1.44 -1.26 -4.54 115.22 113.27 2r98 n HIS 293 Ca 0.15 -1.29 0.13 0.00 -2.01 0.00 0.00 57.72 54.70 2r98 n HIS 293 Cb 0.27 -0.25 0.63 0.00 0.12 0.00 0.00 29.99 30.76 2r98 n HIS 293 CO 0.00 0.00 0.00 -1.13 -2.81 0.00 0.00 176.34 172.40 2r98 n SER 294 N -1.90 0.00 0.12 4.39 3.41 -1.26 -2.57 113.62 115.81 2r98 n SER 294 Ca -0.01 0.28 0.12 0.00 -0.26 0.00 0.00 58.87 58.99 2r98 n SER 294 Cb 0.35 -0.42 0.47 0.00 -0.26 0.00 0.00 64.21 64.35 2r98 n SER 294 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2r98 n GLY 295 N 1.24 -1.37 0.17 5.00 0.00 -1.26 -3.32 105.19 105.65 2r98 n GLY 295 Ca 0.09 0.06 0.09 0.00 0.00 0.00 0.00 46.02 46.26 2r98 n GLY 295 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2r98 h ASP 296 N 0.00 0.00 -0.38 1.61 3.32 -1.92 -3.41 116.42 115.64 2r98 h ASP 296 Ca 0.00 0.00 0.04 0.00 0.02 0.00 0.00 57.03 57.09 2r98 h ASP 296 Cb 0.44 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.95 2r98 h ASP 296 CO 0.00 0.13 0.14 0.40 -1.72 0.00 0.00 179.24 178.19 2r98 h ILE 297 N 0.00 0.90 -0.84 0.35 2.04 -1.73 0.40 117.51 118.63 2r98 h ILE 297 Ca -0.01 -0.10 0.03 0.00 1.00 0.00 0.00 64.86 65.77 2r98 h ILE 297 Cb 1.11 0.57 -0.05 0.00 -0.74 0.00 0.00 36.82 37.72 2r98 h ILE 297 CO 0.01 0.06 0.55 -0.65 0.00 0.00 0.00 178.15 178.12 2r98 h PRO 298 N 0.30 1.02 -0.15 2.37 0.11 -1.83 0.31 132.00 134.13 2r98 h PRO 298 Ca 0.17 -0.06 0.02 0.00 0.11 0.00 0.00 66.00 66.24 2r98 h PRO 298 Cb 0.14 -0.23 -0.02 0.00 0.11 0.00 0.00 31.00 31.00 2r98 h PRO 298 CO -0.17 0.67 0.01 0.45 -0.21 0.00 0.00 178.00 178.75 2r98 h HIS 299 N 1.05 0.01 0.79 0.65 3.86 -1.43 -1.77 115.15 118.31 2r98 h HIS 299 Ca 0.33 0.01 -0.04 0.00 -1.16 0.00 0.00 60.37 59.51 2r98 h HIS 299 Cb 0.02 0.02 0.01 0.00 1.06 0.00 0.00 27.41 28.51 2r98 h HIS 299 CO -0.00 -0.01 -0.38 0.82 0.86 0.00 0.00 177.93 179.22 2r98 h ILE 300 N 0.06 0.16 -0.96 2.45 2.04 0.11 -2.83 117.51 118.54 2r98 h ILE 300 Ca 0.07 -0.11 0.22 0.00 1.00 0.00 0.00 64.86 66.04 2r98 h ILE 300 Cb 0.08 0.18 -0.18 0.00 -0.74 0.00 0.00 36.82 36.15 2r98 h ILE 300 CO -0.11 0.01 -0.15 0.00 0.00 0.00 0.00 178.15 177.90 2r98 n ALA 301 N -2.61 0.32 0.12 1.87 0.00 0.11 -1.31 120.51 119.01 2r98 n ALA 301 Ca -0.14 1.05 -0.03 0.00 0.00 0.00 0.00 53.44 54.32 2r98 n ALA 301 Cb 0.43 -0.67 0.10 0.00 0.00 0.00 0.00 19.45 19.30 2r98 n ALA 301 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2r98 h ALA 302 N 1.92 0.82 -0.55 0.00 0.00 -1.14 -0.55 119.26 119.76 2r98 h ALA 302 Ca 0.50 -0.65 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 2r98 h ALA 302 Cb 0.87 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 2r98 h ALA 302 CO -0.96 0.89 0.19 1.25 0.00 0.00 0.00 179.25 180.63 2r98 h LEU 303 N 0.00 0.78 0.06 0.00 5.85 -1.21 -3.36 115.31 117.43 2r98 h LEU 303 Ca -0.01 -0.19 -0.32 0.00 0.84 0.00 0.00 57.88 58.21 2r98 h LEU 303 Cb 1.26 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 42.06 2r98 h LEU 303 CO 0.09 0.76 -1.76 0.40 -0.34 0.00 0.00 178.44 177.59 2r98 h ILE 304 N 0.75 0.84 0.03 4.05 5.03 -1.00 -3.40 117.51 123.82 2r98 h ILE 304 Ca 0.18 -2.62 0.02 0.00 -0.12 0.00 0.00 64.86 62.32 2r98 h ILE 304 Cb 0.24 2.51 -0.05 0.00 -3.03 0.00 0.00 36.82 36.49 2r98 h ILE 304 CO -0.01 0.69 -0.53 0.03 -0.68 0.00 0.00 178.15 177.65 2r98 h ARG 305 N 0.03 -0.66 0.00 2.37 3.08 -1.25 -0.84 114.38 117.12 2r98 h ARG 305 Ca -0.32 0.04 -0.00 0.00 0.07 0.00 0.00 59.98 59.77 2r98 h ARG 305 Cb 2.01 0.15 -0.00 0.00 0.08 0.00 0.00 29.97 32.21 2r98 h ARG 305 CO 0.10 -0.44 -0.02 -1.00 -1.07 0.00 0.00 179.97 177.54 2r98 h PRO 306 N -0.68 0.00 -0.39 0.04 0.13 -1.77 -0.63 132.00 128.69 2r98 h PRO 306 Ca 0.01 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 65.02 2r98 h PRO 306 Cb 0.72 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.84 2r98 h PRO 306 CO -0.34 0.02 -0.23 -0.07 -0.23 0.00 0.00 178.00 177.16 2r98 h LEU 307 N 0.00 0.88 -0.34 1.56 3.38 -1.39 -1.89 115.31 117.51 2r98 h LEU 307 Ca -0.00 -0.42 0.03 0.00 0.09 0.00 0.00 57.88 57.58 2r98 h LEU 307 Cb 0.04 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.52 2r98 h LEU 307 CO 0.00 1.11 0.16 -0.33 0.09 0.00 0.00 178.44 179.47 2r98 h GLU 308 N 0.66 0.32 -0.74 1.13 5.08 -0.78 -1.13 114.58 119.12 2r98 h GLU 308 Ca 0.08 -0.02 0.20 0.00 -1.00 0.00 0.00 59.36 58.63 2r98 h GLU 308 Cb 0.79 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.93 2r98 h GLU 308 CO 0.06 0.21 0.52 0.93 -1.00 0.00 0.00 179.01 179.74 2r98 h GLU 309 N 0.33 0.08 -0.00 2.33 5.08 -0.96 0.73 114.58 122.18 2r98 h GLU 309 Ca 0.14 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 2r98 h GLU 309 Cb 0.07 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.30 2r98 h GLU 309 CO -0.11 0.05 -0.54 1.04 -1.00 0.00 0.00 179.01 178.45 2r98 n GLN 310 N -4.36 0.14 -0.42 2.33 6.02 -0.73 -4.95 117.38 115.41 2r98 n GLN 310 Ca 0.15 -0.09 0.00 0.00 -0.01 0.00 0.00 57.00 57.05 2r98 n GLN 310 Cb 0.76 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.52 2r98 n GLN 310 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2r98 n GLY 311 N 1.48 0.75 0.12 1.08 0.00 0.25 -4.96 105.19 103.91 2r98 n GLY 311 Ca 0.06 -0.31 -0.15 0.00 0.00 0.00 0.00 46.02 45.62 2r98 n GLY 311 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2r98 n ILE 312 N -2.42 1.48 -5.05 -0.61 5.41 -0.50 -4.88 119.36 112.78 2r98 n ILE 312 Ca 0.00 -0.67 -0.29 0.00 1.00 0.00 0.00 62.75 62.79 2r98 n ILE 312 Cb 0.00 -1.11 -0.16 0.00 -0.71 0.00 0.00 39.64 37.65 2r98 n ILE 312 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 2r98 s LEU 313 N -6.20 1.99 -0.16 1.39 1.43 -1.17 -4.54 118.68 111.42 2r98 s LEU 313 Ca -0.25 -0.43 -0.40 0.00 -1.03 0.00 0.00 54.13 52.02 2r98 s LEU 313 Cb 0.08 -1.17 -0.17 0.00 0.03 0.00 0.00 46.19 44.96 2r98 s LEU 313 CO 0.69 0.20 1.56 -0.11 0.23 0.00 0.00 176.35 178.92 2r98 n LEU 314 N 3.04 1.91 -3.37 1.79 0.00 -1.26 -3.87 117.00 115.25 2r98 n LEU 314 Ca -0.18 1.10 -0.48 0.00 0.00 0.00 0.00 56.01 56.46 2r98 n LEU 314 Cb 0.52 -1.12 -0.08 0.00 0.00 0.00 0.00 43.42 42.74 2r98 n LEU 314 CO 0.25 -0.75 1.10 1.57 0.00 0.00 0.00 177.39 179.55 2r98 n HIS 315 N 4.09 1.08 -3.88 1.96 -0.00 -1.26 -4.92 115.22 112.29 2r98 n HIS 315 Ca 0.24 0.71 -0.13 0.00 -0.00 0.00 0.00 57.72 58.54 2r98 n HIS 315 Cb 0.13 -1.70 -0.01 0.00 -0.00 0.00 0.00 29.99 28.41 2r98 n HIS 315 CO 0.00 0.00 0.00 2.89 -0.00 0.00 0.00 176.34 179.23 2r98 n ARG 316 N 4.40 1.23 -3.98 1.57 1.85 -1.26 -5.16 116.66 115.31 2r98 n ARG 316 Ca 0.33 -1.58 -0.09 0.00 -1.00 0.00 0.00 57.85 55.51 2r98 n ARG 316 Cb -0.04 0.25 -0.11 0.00 -1.05 0.00 0.00 32.46 31.52 2r98 n ARG 316 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 2r98 s SER 317 N -2.38 0.28 0.37 2.89 0.15 -1.26 -5.06 113.70 108.70 2r98 s SER 317 Ca 0.09 -0.50 0.12 0.00 0.70 0.00 0.00 55.95 56.37 2r98 s SER 317 Cb -0.01 0.09 0.73 0.00 -1.71 0.00 0.00 66.02 65.13 2r98 s SER 317 CO 0.06 -0.29 1.85 -0.09 1.20 0.00 0.00 173.24 175.97 2r98 h ARG 318 N 4.66 0.07 -0.01 5.44 2.43 -2.01 -2.99 114.38 121.97 2r98 h ARG 318 Ca -0.32 -0.02 -0.16 0.00 -0.81 0.00 0.00 59.98 58.66 2r98 h ARG 318 Cb 1.21 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.73 2r98 h ARG 318 CO 0.41 0.38 -0.75 0.93 -1.51 0.00 0.00 179.97 179.43 2r98 h GLU 319 N 0.06 0.05 0.02 0.20 3.07 -1.99 -1.75 114.58 114.24 2r98 h GLU 319 Ca 0.01 -0.05 0.03 0.00 -0.50 0.00 0.00 59.36 58.85 2r98 h GLU 319 Cb 0.59 0.01 -0.05 0.00 -0.84 0.00 0.00 28.75 28.46 2r98 h GLU 319 CO 0.04 0.78 -0.35 1.88 -1.40 0.00 0.00 179.01 179.96 2r98 h TYR 320 N 0.03 -0.96 -0.55 4.33 0.99 -1.96 -1.90 116.97 116.95 2r98 h TYR 320 Ca -0.01 0.03 0.06 0.00 2.00 0.00 0.00 58.73 60.81 2r98 h TYR 320 Cb 1.32 0.42 -0.05 0.00 1.00 0.00 0.00 36.73 39.42 2r98 h TYR 320 CO 0.01 -0.44 0.25 -0.07 -0.00 0.00 0.00 178.16 177.91 2r98 h LEU 321 N -0.52 0.33 -1.44 3.88 3.38 -1.35 -0.98 115.31 118.63 2r98 h LEU 321 Ca 0.05 0.04 0.01 0.00 0.09 0.00 0.00 57.88 58.08 2r98 h LEU 321 Cb 0.59 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.30 2r98 h LEU 321 CO -0.27 0.22 0.39 -0.33 0.09 0.00 0.00 178.44 178.54 2r98 h GLU 322 N 0.48 0.75 -0.03 1.13 5.08 -1.32 -0.09 114.58 120.58 2r98 h GLU 322 Ca 0.26 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 2r98 h GLU 322 Cb 0.22 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.30 2r98 h GLU 322 CO -0.21 0.50 0.00 0.09 -1.00 0.00 0.00 179.01 178.39 2r98 n ASN 323 N -4.45 2.54 -0.23 1.42 3.02 -0.72 -4.13 115.26 112.72 2r98 n ASN 323 Ca 0.06 -1.85 0.04 0.00 -0.03 0.00 0.00 54.58 52.81 2r98 n ASN 323 Cb 0.06 -0.00 0.06 0.00 -0.61 0.00 0.00 39.78 39.28 2r98 n ASN 323 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 2r98 n HIS 324 N 0.99 0.00 0.28 3.10 8.25 -0.41 -4.84 115.22 122.58 2r98 n HIS 324 Ca 0.16 -0.49 0.17 0.00 -0.26 0.00 0.00 57.72 57.30 2r98 n HIS 324 Cb 0.52 -0.09 0.71 0.00 1.12 0.00 0.00 29.99 32.26 2r98 n HIS 324 CO 0.00 0.00 0.00 0.97 0.64 0.00 0.00 176.34 177.95 2r98 h ILE 325 N 2.99 0.11 0.00 1.59 6.09 -1.17 -2.17 117.51 124.94 2r98 h ILE 325 Ca 0.00 -0.54 0.00 0.00 -1.37 0.00 0.00 64.86 62.95 2r98 h ILE 325 Cb 1.11 1.48 0.00 0.00 0.47 0.00 0.00 36.82 39.89 2r98 h ILE 325 CO 0.00 0.04 0.00 0.77 -3.07 0.00 0.00 178.15 175.89 2r98 h SER 326 N 0.00 0.00 0.15 2.19 4.64 -1.85 -2.32 113.55 116.36 2r98 h SER 326 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2r98 h SER 326 Cb 0.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.57 2r98 h SER 326 CO 0.00 0.00 -0.46 -1.84 -0.87 0.00 0.00 176.83 173.67 2r98 n GLU 327 N -2.69 0.75 -3.34 4.77 0.28 -0.82 -4.89 120.64 114.71 2r98 n GLU 327 Ca 0.02 -0.54 -0.36 0.00 -0.16 0.00 0.00 57.16 56.12 2r98 n GLU 327 Cb 0.29 -1.49 -0.06 0.00 1.43 0.00 0.00 31.44 31.62 2r98 n GLU 327 CO 0.00 0.00 0.00 -0.06 -0.16 0.00 0.00 177.13 176.91 2r98 s PHE 328 N -2.62 3.63 0.08 -1.84 0.40 -0.87 -0.77 117.98 115.99 2r98 s PHE 328 Ca 0.19 1.10 0.09 0.00 -0.60 0.00 0.00 56.93 57.71 2r98 s PHE 328 Cb 0.18 -2.40 -0.03 0.00 0.51 0.00 0.00 43.02 41.28 2r98 s PHE 328 CO 0.61 0.45 -0.25 -1.12 0.70 0.00 0.00 175.22 175.61 2r98 s SER 329 N -1.63 2.97 0.13 1.36 0.01 -0.17 -1.74 113.70 114.63 2r98 s SER 329 Ca 0.37 -0.64 0.08 0.00 1.31 0.00 0.00 55.95 57.07 2r98 s SER 329 Cb -0.16 -0.23 -0.04 0.00 0.21 0.00 0.00 66.02 65.81 2r98 s SER 329 CO 0.19 0.18 -0.19 0.27 0.41 0.00 0.00 173.24 174.11 2r98 s ILE 330 N -0.93 1.70 -0.08 1.44 -4.36 -0.20 -1.56 121.20 117.21 2r98 s ILE 330 Ca 0.11 -1.73 0.04 0.00 -0.26 0.00 0.00 60.65 58.80 2r98 s ILE 330 Cb -0.10 -1.67 -0.01 0.00 1.25 0.00 0.00 42.46 41.93 2r98 s ILE 330 CO 0.03 -0.23 -0.20 -0.22 0.24 0.00 0.00 174.94 174.57 2r98 s LEU 331 N -2.32 2.37 0.00 0.37 0.20 -0.75 -1.72 118.68 116.83 2r98 s LEU 331 Ca 0.11 -0.41 0.03 0.00 0.69 0.00 0.00 54.13 54.55 2r98 s LEU 331 Cb -0.07 -1.47 -0.01 0.00 -0.43 0.00 0.00 46.19 44.20 2r98 s LEU 331 CO 0.05 0.24 0.23 -1.84 -0.29 0.00 0.00 176.35 174.74 2r98 n GLU 332 N 3.00 0.34 0.00 1.98 0.28 -0.83 -0.70 120.64 124.71 2r98 n GLU 332 Ca -0.18 -2.08 0.00 0.00 -0.16 0.00 0.00 57.16 54.74 2r98 n GLU 332 Cb 0.52 1.80 0.00 0.00 1.43 0.00 0.00 31.44 35.19 2r98 n GLU 332 CO 0.00 0.00 0.00 1.58 -0.16 0.00 0.00 177.13 178.55 2r98 n HIS 333 N -0.41 0.00 -2.51 -1.84 -0.00 -0.75 -4.14 115.22 105.58 2r98 n HIS 333 Ca 0.04 0.00 -0.07 0.00 0.46 0.00 0.00 57.72 58.15 2r98 n HIS 333 Cb 0.40 0.00 -0.00 0.00 -0.12 0.00 0.00 29.99 30.26 2r98 n HIS 333 CO 0.00 0.00 0.00 -0.25 0.46 0.00 0.00 176.34 176.55 2r98 n ASP 334 N 0.00 -2.42 0.00 0.26 10.43 -1.26 -0.74 116.55 122.82 2r98 n ASP 334 Ca 0.00 0.32 0.00 0.00 2.57 0.00 0.00 54.79 57.68 2r98 n ASP 334 Cb 0.00 -2.13 0.00 0.00 1.84 0.00 0.00 41.12 40.83 2r98 n ASP 334 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2r98 n GLY 335 N -0.66 2.34 3.90 0.44 0.00 -1.26 -5.01 105.19 104.94 2r98 n GLY 335 Ca -0.07 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.67 2r98 n GLY 335 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2r98 s ASN 336 N -3.67 6.16 -0.18 1.61 0.01 0.08 -5.08 114.94 113.87 2r98 s ASN 336 Ca 0.00 0.99 -0.00 0.00 -0.71 0.00 0.00 52.86 53.14 2r98 s ASN 336 Cb 0.00 -2.21 0.01 0.00 0.41 0.00 0.00 41.25 39.46 2r98 s ASN 336 CO 0.00 -0.70 -0.16 -0.22 -1.51 0.00 0.00 177.10 174.51 2r98 s LEU 337 N -4.86 2.35 -0.00 0.60 1.98 -1.26 -1.80 118.68 115.69 2r98 s LEU 337 Ca 0.50 -0.57 0.00 0.00 -2.89 0.00 0.00 54.13 51.17 2r98 s LEU 337 Cb -0.10 -1.55 -0.00 0.00 0.66 0.00 0.00 46.19 45.20 2r98 s LEU 337 CO 0.47 0.01 0.01 -1.22 -1.89 0.00 0.00 176.35 173.72 2r98 n TYR 338 N 4.56 0.00 -3.69 5.38 4.02 0.12 -4.83 117.16 122.72 2r98 n TYR 338 Ca -0.20 0.00 -0.11 0.00 -0.01 0.00 0.00 57.90 57.58 2r98 n TYR 338 Cb 0.50 -0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 39.76 2r98 n TYR 338 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 2r98 s GLY 339 N -1.66 -0.20 0.08 2.72 0.00 -1.11 0.09 107.32 107.24 2r98 s GLY 339 Ca -0.00 -0.03 -0.04 0.00 0.00 0.00 0.00 44.72 44.65 2r98 s GLY 339 CO 0.01 -0.27 0.08 0.00 0.00 0.00 0.00 173.10 172.92 2r98 s ALA 341 N -3.92 -1.85 0.07 0.00 0.00 -0.60 -2.30 121.76 113.16 2r98 s ALA 341 Ca 0.10 1.95 0.06 0.00 0.00 0.00 0.00 51.96 54.06 2r98 s ALA 341 Cb 0.06 -1.22 -0.04 0.00 0.00 0.00 0.00 23.12 21.93 2r98 s ALA 341 CO -0.08 -0.30 -0.09 0.00 0.00 0.00 0.00 175.76 175.29 2r98 s ALA 342 N 0.25 2.96 -0.30 0.00 0.00 0.12 -1.00 121.76 123.79 2r98 s ALA 342 Ca 0.01 -1.17 -0.06 0.00 0.00 0.00 0.00 51.96 50.74 2r98 s ALA 342 Cb -0.05 -0.96 0.02 0.00 0.00 0.00 0.00 23.12 22.13 2r98 s ALA 342 CO -0.01 0.63 0.06 -1.17 0.00 0.00 0.00 175.76 175.27 2r98 s LEU 343 N -1.92 3.87 0.11 0.00 2.96 0.05 -1.48 118.68 122.27 2r98 s LEU 343 Ca 0.20 -0.86 -0.17 0.00 -0.22 0.00 0.00 54.13 53.07 2r98 s LEU 343 Cb -0.11 -1.84 -0.07 0.00 0.50 0.00 0.00 46.19 44.67 2r98 s LEU 343 CO 0.11 -0.22 0.56 -0.54 -1.32 0.00 0.00 176.35 174.95 2r98 s LYS 344 N 1.44 4.11 0.31 1.98 -0.14 -0.05 -4.73 119.74 122.67 2r98 s LYS 344 Ca 0.01 0.64 0.10 0.00 -1.36 0.00 0.00 55.97 55.36 2r98 s LYS 344 Cb -0.18 -3.10 -0.05 0.00 -1.68 0.00 0.00 37.83 32.82 2r98 s LYS 344 CO 0.01 0.57 -0.07 0.95 -0.76 0.00 0.00 175.35 176.05 2r98 s THR 345 N -1.26 2.62 0.28 2.17 -4.23 -1.26 -0.89 115.64 113.06 2r98 s THR 345 Ca 0.33 -2.14 0.02 0.00 -1.18 0.00 0.00 61.69 58.72 2r98 s THR 345 Cb -0.18 -2.63 -0.04 0.00 1.34 0.00 0.00 72.50 70.99 2r98 s THR 345 CO 0.19 -0.28 0.15 -0.36 -0.54 0.00 0.00 174.62 173.78 2r98 s PHE 346 N -2.51 1.53 0.21 3.99 0.08 -1.26 -5.02 117.98 114.99 2r98 s PHE 346 Ca 0.32 -1.35 -0.10 0.00 0.12 0.00 0.00 56.93 55.92 2r98 s PHE 346 Cb -0.02 -0.81 0.15 0.00 -0.57 0.00 0.00 43.02 41.77 2r98 s PHE 346 CO 0.18 -0.52 1.84 0.00 -0.10 0.00 0.00 175.22 176.62 2r98 h ALA 347 N 2.30 0.96 -1.85 5.36 0.00 -2.00 -3.38 119.26 120.65 2r98 h ALA 347 Ca -0.34 -0.09 -0.55 0.00 0.00 0.00 0.00 54.91 53.92 2r98 h ALA 347 Cb 1.25 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 2r98 h ALA 347 CO 0.53 0.44 1.49 -1.21 0.00 0.00 0.00 179.25 180.50 2r98 s GLU 348 N -5.95 2.88 0.62 0.00 8.01 -1.26 -4.91 118.70 118.09 2r98 s GLU 348 Ca -0.13 1.73 0.32 0.00 0.01 0.00 0.00 54.97 56.90 2r98 s GLU 348 Cb 0.15 -4.40 1.72 0.00 -4.31 0.00 0.00 34.13 27.29 2r98 s GLU 348 CO 0.79 -2.39 1.96 0.00 0.01 0.00 0.00 175.26 175.63 2r98 h ALA 349 N 15.86 1.22 -0.02 5.21 0.00 -1.98 -2.21 119.26 137.34 2r98 h ALA 349 Ca -0.35 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.56 2r98 h ALA 349 Cb 1.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2r98 h ALA 349 CO 1.03 -0.22 -0.15 -0.40 0.00 0.00 0.00 179.25 179.51 2r98 n ASP 350 N -2.82 1.71 -4.49 0.00 3.85 -1.26 -4.05 116.55 109.49 2r98 n ASP 350 Ca -0.02 -1.41 -0.32 0.00 -0.71 0.00 0.00 54.79 52.33 2r98 n ASP 350 Cb 0.28 0.11 -0.13 0.00 -1.35 0.00 0.00 41.12 40.04 2r98 n ASP 350 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2r98 s GLY 352 N -0.99 1.40 -0.02 0.00 0.00 0.23 -4.04 107.32 103.90 2r98 s GLY 352 Ca 0.13 -1.68 0.01 0.00 0.00 0.00 0.00 44.72 43.17 2r98 s GLY 352 CO 0.03 -1.43 -0.01 1.85 0.00 0.00 0.00 173.10 173.54 2r98 s GLU 353 N -4.11 0.29 -0.13 2.90 2.12 -0.07 -0.49 118.70 119.21 2r98 s GLU 353 Ca 0.36 0.02 -0.20 0.00 0.36 0.00 0.00 54.97 55.51 2r98 s GLU 353 Cb 0.07 -0.41 -0.04 0.00 0.26 0.00 0.00 34.13 34.01 2r98 s GLU 353 CO 0.10 -0.07 0.55 -1.50 -0.54 0.00 0.00 175.26 173.80 2r98 s ILE 354 N 0.68 5.12 0.14 -3.70 2.07 -0.35 -0.87 121.20 124.29 2r98 s ILE 354 Ca -0.07 1.09 0.03 0.00 -1.41 0.00 0.00 60.65 60.30 2r98 s ILE 354 Cb -0.10 -3.89 -0.04 0.00 0.13 0.00 0.00 42.46 38.56 2r98 s ILE 354 CO -0.01 0.25 -0.07 0.00 -1.91 0.00 0.00 174.94 173.21 2r98 s ALA 355 N 1.03 1.33 -1.48 1.50 0.00 -0.55 -4.49 121.76 119.10 2r98 s ALA 355 Ca 0.29 -1.49 -0.06 0.00 0.00 0.00 0.00 51.96 50.69 2r98 s ALA 355 Cb -0.16 0.20 0.02 0.00 0.00 0.00 0.00 23.12 23.19 2r98 s ALA 355 CO 0.12 -0.19 0.62 0.00 0.00 0.00 0.00 175.76 176.31 2r98 s LEU 357 N -6.69 4.30 -0.28 0.00 2.96 -1.26 -3.76 118.68 113.95 2r98 s LEU 357 Ca 0.35 1.92 -0.14 0.00 -0.22 0.00 0.00 54.13 56.05 2r98 s LEU 357 Cb -0.17 -3.56 0.09 0.00 0.50 0.00 0.00 46.19 43.06 2r98 s LEU 357 CO 0.44 -0.59 0.66 0.00 -1.32 0.00 0.00 176.35 175.53 2r98 s ALA 358 N 2.03 -1.89 -0.10 5.97 0.00 -0.97 -5.01 121.76 121.78 2r98 s ALA 358 Ca 0.58 2.36 0.03 0.00 0.00 0.00 0.00 51.96 54.93 2r98 s ALA 358 Cb -0.27 -1.51 0.00 0.00 0.00 0.00 0.00 23.12 21.34 2r98 s ALA 358 CO 0.24 -0.54 -0.22 0.08 0.00 0.00 0.00 175.76 175.32 2r98 s VAL 359 N 2.02 1.95 -0.26 0.00 1.01 -1.26 -1.63 120.40 122.24 2r98 s VAL 359 Ca -0.09 -0.95 -0.43 0.00 0.00 0.00 0.00 61.98 60.52 2r98 s VAL 359 Cb -0.07 -1.70 -0.19 0.00 0.00 0.00 0.00 36.38 34.41 2r98 s VAL 359 CO -0.19 0.53 1.43 -0.24 0.00 0.00 0.00 175.10 176.63 2r98 n SER 360 N 3.68 1.03 -0.20 3.32 2.88 0.11 -4.81 113.62 119.64 2r98 n SER 360 Ca -0.20 1.16 0.10 0.00 -1.33 0.00 0.00 58.87 58.60 2r98 n SER 360 Cb 0.53 -0.96 0.40 0.00 -0.75 0.00 0.00 64.21 63.42 2r98 n SER 360 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 2r98 h PRO 361 N 4.64 0.64 0.00 -1.46 0.11 -1.98 0.55 132.00 134.49 2r98 h PRO 361 Ca -0.47 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 65.56 2r98 h PRO 361 Cb 1.38 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 2r98 h PRO 361 CO 0.85 0.42 -0.19 -0.56 -0.21 0.00 0.00 178.00 178.31 2r98 h GLN 362 N 0.66 0.00 -0.51 1.05 3.07 -1.99 -2.94 115.11 114.44 2r98 h GLN 362 Ca 0.36 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.10 2r98 h GLN 362 Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.07 2r98 h GLN 362 CO -0.13 0.19 0.00 0.00 0.09 0.00 0.00 178.83 178.98 2r98 n ALA 363 N -2.31 2.29 -1.23 0.06 0.00 0.12 -5.00 120.51 114.43 2r98 n ALA 363 Ca -0.01 -1.19 -0.30 0.00 0.00 0.00 0.00 53.44 51.94 2r98 n ALA 363 Cb 0.31 -0.68 0.14 0.00 0.00 0.00 0.00 19.45 19.22 2r98 n ALA 363 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2r98 s GLN 364 N -1.03 1.28 -0.77 0.00 -0.21 -0.77 -4.01 119.66 114.15 2r98 s GLN 364 Ca 0.35 0.79 0.00 0.00 0.02 0.00 0.00 55.36 56.52 2r98 s GLN 364 Cb 0.19 -1.81 0.00 0.00 1.00 0.00 0.00 33.01 32.38 2r98 s GLN 364 CO 0.24 -2.22 0.00 -0.25 -2.12 0.00 0.00 175.29 170.95 2r98 n ASP 365 N -3.86 -5.06 -1.01 5.90 8.00 -1.26 -4.84 116.55 114.41 2r98 n ASP 365 Ca 0.07 0.18 0.08 0.00 0.71 0.00 0.00 54.79 55.83 2r98 n ASP 365 Cb 0.55 -3.20 0.24 0.00 -0.02 0.00 0.00 41.12 38.70 2r98 n ASP 365 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2r98 n GLY 366 N -0.52 2.80 0.93 0.44 0.00 -1.26 -4.98 105.19 102.60 2r98 n GLY 366 Ca -0.07 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.32 2r98 n GLY 366 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2r98 n GLY 367 N 0.85 0.68 0.24 -0.02 0.00 -1.26 -4.96 105.19 100.72 2r98 n GLY 367 Ca 0.18 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.09 2r98 n GLY 367 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2r98 h TYR 368 N 0.00 -0.52 -0.10 1.61 0.99 -1.94 -1.81 116.97 115.21 2r98 h TYR 368 Ca 0.00 0.02 0.01 0.00 2.00 0.00 0.00 58.73 60.76 2r98 h TYR 368 Cb 0.00 0.23 -0.01 0.00 1.00 0.00 0.00 36.73 37.95 2r98 h TYR 368 CO 0.00 -0.28 -0.06 0.41 -0.00 0.00 0.00 178.16 178.23 2r98 n GLY 369 N -1.33 -2.92 0.35 3.88 0.00 -1.26 -0.31 105.19 103.59 2r98 n GLY 369 Ca -0.05 0.62 0.33 0.00 0.00 0.00 0.00 46.02 46.92 2r98 n GLY 369 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2r98 n GLU 370 N -3.18 -0.05 0.05 1.61 4.07 -1.22 -1.20 120.64 120.73 2r98 n GLU 370 Ca 0.00 1.33 -0.11 0.00 -0.06 0.00 0.00 57.16 58.32 2r98 n GLU 370 Cb 0.03 -2.43 0.00 0.00 -0.06 0.00 0.00 31.44 28.98 2r98 n GLU 370 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2r98 h ARG 371 N 0.00 0.42 -0.03 5.31 3.08 0.24 -0.14 114.38 123.26 2r98 h ARG 371 Ca 0.84 -0.37 -0.02 0.00 0.07 0.00 0.00 59.98 60.50 2r98 h ARG 371 Cb 2.33 0.09 0.00 0.00 0.08 0.00 0.00 29.97 32.47 2r98 h ARG 371 CO -0.69 1.02 -0.07 -0.07 -1.07 0.00 0.00 179.97 179.09 2r98 h LEU 372 N 0.27 0.12 -0.48 3.04 3.38 -0.75 -2.47 115.31 118.42 2r98 h LEU 372 Ca -0.04 -0.57 0.10 0.00 0.09 0.00 0.00 57.88 57.46 2r98 h LEU 372 Cb 1.38 -0.03 -0.09 0.00 0.09 0.00 0.00 40.66 42.00 2r98 h LEU 372 CO 0.14 0.66 -0.13 0.25 0.09 0.00 0.00 178.44 179.45 2r98 h LEU 373 N -0.42 -0.47 -1.43 1.67 5.85 -1.13 0.12 115.31 119.50 2r98 h LEU 373 Ca 0.00 0.15 0.08 0.00 0.84 0.00 0.00 57.88 58.95 2r98 h LEU 373 Cb 0.64 0.30 -0.05 0.00 0.37 0.00 0.00 40.66 41.93 2r98 h LEU 373 CO 0.01 -0.17 0.47 0.00 -0.34 0.00 0.00 178.44 178.42 2r98 h ALA 374 N 1.45 1.80 0.07 1.25 0.00 -1.01 -1.38 119.26 121.43 2r98 h ALA 374 Ca 0.23 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 55.02 2r98 h ALA 374 Cb 0.36 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 18.00 2r98 h ALA 374 CO -0.50 0.06 -0.47 1.25 0.00 0.00 0.00 179.25 179.60 2r98 h HIS 375 N 0.66 0.34 -0.94 0.00 -0.00 -0.67 -1.28 115.15 113.26 2r98 h HIS 375 Ca 0.32 -0.24 0.21 0.00 -0.00 0.00 0.00 60.37 60.66 2r98 h HIS 375 Cb 0.39 -0.02 -0.08 0.00 -0.00 0.00 0.00 27.41 27.70 2r98 h HIS 375 CO -0.00 1.15 0.61 -0.84 -0.00 0.00 0.00 177.93 178.85 2r98 h ILE 376 N -0.56 0.67 -0.29 6.26 -0.00 -1.01 0.61 117.51 123.19 2r98 h ILE 376 Ca -0.08 -0.17 -0.13 0.00 -0.00 0.00 0.00 64.86 64.48 2r98 h ILE 376 Cb 1.33 0.14 -0.00 0.00 -0.00 0.00 0.00 36.82 38.29 2r98 h ILE 376 CO 0.09 0.09 -0.32 0.16 -0.00 0.00 0.00 178.15 178.17 2r98 h ILE 377 N 0.49 1.30 -0.39 0.16 -0.00 -0.91 0.07 117.51 118.23 2r98 h ILE 377 Ca 0.51 -1.50 0.04 0.00 -0.00 0.00 0.00 64.86 63.91 2r98 h ILE 377 Cb 1.14 1.59 -0.04 0.00 -0.00 0.00 0.00 36.82 39.51 2r98 h ILE 377 CO -0.23 0.48 0.16 0.44 -0.00 0.00 0.00 178.15 179.00 2r98 h ASP 378 N 0.48 0.21 0.13 2.16 3.32 -0.82 0.16 116.42 122.06 2r98 h ASP 378 Ca 0.04 0.03 0.01 0.00 0.02 0.00 0.00 57.03 57.14 2r98 h ASP 378 Cb 0.90 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.41 2r98 h ASP 378 CO 0.08 0.16 -0.53 0.50 -1.72 0.00 0.00 179.24 177.73 2r98 h LYS 379 N 0.34 -0.73 -0.72 3.56 3.64 -0.84 -1.54 116.57 120.27 2r98 h LYS 379 Ca 0.18 0.05 0.16 0.00 -1.27 0.00 0.00 60.65 59.76 2r98 h LYS 379 Cb 0.13 0.17 -0.13 0.00 -0.41 0.00 0.00 32.23 31.98 2r98 h LYS 379 CO -0.16 -0.49 -0.08 0.00 -2.27 0.00 0.00 179.45 176.45 2r98 h ALA 380 N -0.53 0.62 -0.48 5.00 0.00 -0.86 -1.53 119.26 121.49 2r98 h ALA 380 Ca -0.01 0.26 -0.06 0.00 0.00 0.00 0.00 54.91 55.09 2r98 h ALA 380 Cb 0.76 0.47 -0.02 0.00 0.00 0.00 0.00 17.79 19.00 2r98 h ALA 380 CO -0.29 -0.42 0.03 -0.09 0.00 0.00 0.00 179.25 178.49 2r98 h ARG 381 N 0.05 0.77 0.00 0.00 2.43 -0.46 -2.39 114.38 114.78 2r98 h ARG 381 Ca 0.37 -0.19 0.00 0.00 -0.81 0.00 0.00 59.98 59.35 2r98 h ARG 381 Cb 0.62 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.07 2r98 h ARG 381 CO -0.69 0.76 0.00 0.78 -1.51 0.00 0.00 179.97 179.31 2r98 h GLY 382 N 0.96 0.00 -2.58 2.80 0.00 -0.23 -1.13 103.07 102.89 2r98 h GLY 382 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.48 2r98 h GLY 382 CO 0.01 0.00 0.00 0.29 0.00 0.00 0.00 176.54 176.84 2r98 n ILE 383 N -2.57 1.11 -0.43 2.60 -5.35 -1.06 -5.00 119.36 108.66 2r98 n ILE 383 Ca 0.02 -1.03 0.00 0.00 -0.27 0.00 0.00 62.75 61.47 2r98 n ILE 383 Cb 0.29 0.45 0.00 0.00 -1.74 0.00 0.00 39.64 38.64 2r98 n ILE 383 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2r98 n GLY 384 N 1.45 0.75 3.70 3.28 0.00 -0.43 -5.03 105.19 108.91 2r98 n GLY 384 Ca 0.23 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.83 2r98 n GLY 384 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2r98 s ILE 385 N -2.38 2.88 -0.17 -0.61 1.01 -0.93 -4.67 121.20 116.34 2r98 s ILE 385 Ca 0.00 0.41 0.03 0.00 0.00 0.00 0.00 60.65 61.09 2r98 s ILE 385 Cb 0.00 -3.27 -0.02 0.00 0.01 0.00 0.00 42.46 39.19 2r98 s ILE 385 CO 0.00 0.01 0.20 -1.54 0.00 0.00 0.00 174.94 173.61 2r98 n SER 386 N 5.28 0.34 -3.82 3.58 3.41 -0.65 -4.25 113.62 117.51 2r98 n SER 386 Ca 0.16 -0.67 -0.29 0.00 -0.26 0.00 0.00 58.87 57.81 2r98 n SER 386 Cb 0.40 0.81 -0.16 0.00 -0.26 0.00 0.00 64.21 64.99 2r98 n SER 386 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2r98 s ARG 387 N -1.04 1.05 -0.31 4.33 0.52 -0.56 0.11 118.95 123.05 2r98 s ARG 387 Ca 0.01 -0.68 -0.12 0.00 -0.52 0.00 0.00 55.73 54.43 2r98 s ARG 387 Cb 0.02 -2.31 -0.03 0.00 0.52 0.00 0.00 34.95 33.16 2r98 s ARG 387 CO 0.09 -0.64 0.20 -1.17 0.02 0.00 0.00 175.30 173.81 2r98 s LEU 388 N 1.66 4.24 0.22 2.53 0.20 0.38 -0.60 118.68 127.32 2r98 s LEU 388 Ca -0.03 -0.29 -0.11 0.00 0.69 0.00 0.00 54.13 54.40 2r98 s LEU 388 Cb -0.18 -2.10 -0.07 0.00 -0.43 0.00 0.00 46.19 43.41 2r98 s LEU 388 CO -0.08 -0.16 0.56 -0.36 -0.29 0.00 0.00 176.35 176.02 2r98 s PHE 389 N 1.72 3.45 -0.03 5.38 0.08 0.36 -0.06 117.98 128.87 2r98 s PHE 389 Ca 0.06 0.93 0.00 0.00 0.12 0.00 0.00 56.93 58.04 2r98 s PHE 389 Cb -0.17 -2.29 0.03 0.00 -0.57 0.00 0.00 43.02 40.01 2r98 s PHE 389 CO 0.10 0.29 0.01 0.00 -0.10 0.00 0.00 175.22 175.51 2r98 s ALA 390 N -1.77 0.31 -0.21 5.36 0.00 0.11 -1.22 121.76 124.35 2r98 s ALA 390 Ca 0.46 0.17 -0.02 0.00 0.00 0.00 0.00 51.96 52.56 2r98 s ALA 390 Cb -0.12 -0.34 0.00 0.00 0.00 0.00 0.00 23.12 22.66 2r98 s ALA 390 CO 0.21 -0.11 -0.09 -0.51 0.00 0.00 0.00 175.76 175.25 2r98 s LEU 391 N 1.11 2.66 -0.04 0.00 1.02 -1.26 -1.47 118.68 120.70 2r98 s LEU 391 Ca -0.09 -0.49 -0.02 0.00 0.02 0.00 0.00 54.13 53.56 2r98 s LEU 391 Cb -0.13 -1.65 0.03 0.00 0.02 0.00 0.00 46.19 44.45 2r98 s LEU 391 CO -0.02 -0.02 0.09 -0.55 0.02 0.00 0.00 176.35 175.87 2r98 s SER 392 N 1.41 -0.03 0.12 2.29 0.15 -0.39 -4.89 113.70 112.36 2r98 s SER 392 Ca 0.05 0.18 -0.01 0.00 0.70 0.00 0.00 55.95 56.87 2r98 s SER 392 Cb -0.14 0.08 -0.15 0.00 -1.71 0.00 0.00 66.02 64.10 2r98 s SER 392 CO -0.06 -0.12 1.27 0.00 1.20 0.00 0.00 173.24 175.52 2r98 h THR 393 N 6.02 1.51 0.00 6.45 1.03 -1.85 0.56 112.91 126.62 2r98 h THR 393 Ca -0.42 -2.85 0.00 0.00 -0.01 0.00 0.00 66.41 63.14 2r98 h THR 393 Cb 1.14 2.68 0.00 0.00 -1.07 0.00 0.00 68.15 70.90 2r98 h THR 393 CO 0.45 0.83 0.00 0.59 -0.01 0.00 0.00 175.52 177.38 2r98 n ASN 394 N -3.59 0.26 0.00 0.00 3.02 -1.26 -4.78 115.26 108.90 2r98 n ASN 394 Ca -0.06 -1.01 0.00 0.00 -0.03 0.00 0.00 54.58 53.48 2r98 n ASN 394 Cb 0.91 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 40.08 2r98 n ASN 394 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 2r98 n THR 395 N -0.00 0.07 -0.33 3.41 -1.04 -1.26 -4.92 114.28 110.20 2r98 n THR 395 Ca 0.00 -0.10 0.20 0.00 -2.04 0.00 0.00 64.05 62.11 2r98 n THR 395 Cb 0.20 1.39 0.45 0.00 -1.82 0.00 0.00 70.33 70.54 2r98 n THR 395 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 2r98 h GLY 396 N 0.00 1.48 1.54 3.41 0.00 -1.88 -2.51 103.07 105.11 2r98 h GLY 396 Ca 0.00 -0.25 -0.10 0.00 0.00 0.00 0.00 47.33 46.98 2r98 h GLY 396 CO 0.00 -0.16 -0.25 0.83 0.00 0.00 0.00 176.54 176.96 2r98 h GLU 397 N 0.49 0.53 -0.93 4.80 3.07 -1.97 0.69 114.58 121.25 2r98 h GLU 397 Ca 0.61 -0.20 0.24 0.00 -0.50 0.00 0.00 59.36 59.51 2r98 h GLU 397 Cb 1.35 -0.03 -0.13 0.00 -0.84 0.00 0.00 28.75 29.10 2r98 h GLU 397 CO -0.36 0.74 0.44 2.35 -1.40 0.00 0.00 179.01 180.78 2r98 h TRP 398 N 0.47 0.73 0.13 4.33 7.01 -1.86 0.23 115.95 127.00 2r98 h TRP 398 Ca 0.07 0.04 -0.31 0.00 2.11 0.00 0.00 58.89 60.80 2r98 h TRP 398 Cb 0.68 -0.18 -0.00 0.00 -2.10 0.00 0.00 29.16 27.57 2r98 h TRP 398 CO 0.02 -0.06 -1.49 0.74 -2.79 0.00 0.00 178.44 174.86 2r98 h PHE 399 N 0.40 0.52 -0.90 2.65 -1.00 -1.38 -2.97 116.94 114.25 2r98 h PHE 399 Ca 0.60 -0.38 0.08 0.00 2.81 0.00 0.00 57.97 61.09 2r98 h PHE 399 Cb 1.20 -0.02 -0.06 0.00 3.61 0.00 0.00 35.95 40.67 2r98 h PHE 399 CO -0.11 1.39 0.58 0.00 -1.61 0.00 0.00 178.31 178.57 2r98 h ALA 400 N 0.46 1.58 -0.00 2.45 0.00 -0.39 0.13 119.26 123.49 2r98 h ALA 400 Ca -0.23 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2r98 h ALA 400 Cb 2.02 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 19.58 2r98 h ALA 400 CO 0.18 0.26 -0.03 0.39 0.00 0.00 0.00 179.25 180.04 2r98 n GLU 401 N -4.52 0.31 -1.11 0.00 1.02 0.77 -3.46 120.64 113.65 2r98 n GLU 401 Ca 0.15 -0.03 -0.01 0.00 -0.02 0.00 0.00 57.16 57.25 2r98 n GLU 401 Cb 0.26 -1.50 0.14 0.00 -0.02 0.00 0.00 31.44 30.33 2r98 n GLU 401 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2r98 n ARG 402 N -1.32 1.89 0.00 3.49 1.74 0.31 -4.93 116.66 117.83 2r98 n ARG 402 Ca 0.12 -3.37 0.00 0.00 -0.77 0.00 0.00 57.85 53.82 2r98 n ARG 402 Cb 0.28 -1.60 0.00 0.00 -1.02 0.00 0.00 32.46 30.12 2r98 n ARG 402 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2r98 n GLY 403 N -0.83 0.68 3.70 -0.13 0.00 -0.89 -4.98 105.19 102.75 2r98 n GLY 403 Ca 0.23 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.86 2r98 n GLY 403 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2r98 s PHE 404 N -2.00 3.50 0.22 1.61 0.08 -0.32 -4.42 117.98 116.64 2r98 s PHE 404 Ca 0.00 1.03 -0.01 0.00 0.12 0.00 0.00 56.93 58.07 2r98 s PHE 404 Cb 0.00 -2.71 -0.04 0.00 -0.57 0.00 0.00 43.02 39.70 2r98 s PHE 404 CO 0.00 0.05 0.42 -0.65 -0.10 0.00 0.00 175.22 174.94 2r98 s GLN 405 N 1.03 3.54 0.36 0.44 1.11 0.19 -3.96 119.66 122.37 2r98 s GLN 405 Ca 0.31 -0.28 -0.28 0.00 0.01 0.00 0.00 55.36 55.13 2r98 s GLN 405 Cb -0.16 -2.80 -0.10 0.00 -1.01 0.00 0.00 33.01 28.94 2r98 s GLN 405 CO 0.13 0.36 1.33 -0.08 0.01 0.00 0.00 175.29 177.05 2r98 s THR 406 N -1.91 2.59 0.14 -0.19 -1.32 -1.26 -0.61 115.64 113.07 2r98 s THR 406 Ca 0.39 0.57 0.03 0.00 -1.21 0.00 0.00 61.69 61.48 2r98 s THR 406 Cb -0.11 -3.36 -0.01 0.00 -1.51 0.00 0.00 72.50 67.51 2r98 s THR 406 CO 0.29 0.12 0.10 0.00 -2.21 0.00 0.00 174.62 172.92 2r98 n ALA 407 N 0.53 0.28 -2.53 11.08 0.00 0.89 -4.82 120.51 125.93 2r98 n ALA 407 Ca 0.01 -0.78 -0.26 0.00 0.00 0.00 0.00 53.44 52.41 2r98 n ALA 407 Cb 0.42 0.61 -0.09 0.00 0.00 0.00 0.00 19.45 20.39 2r98 n ALA 407 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2r98 s SER 408 N -1.94 4.15 0.38 0.00 0.15 -1.26 -4.54 113.70 110.63 2r98 s SER 408 Ca 0.14 -1.14 0.14 0.00 0.70 0.00 0.00 55.95 55.80 2r98 s SER 408 Cb 0.01 -0.46 0.77 0.00 -1.71 0.00 0.00 66.02 64.62 2r98 s SER 408 CO 0.10 -0.40 1.83 -0.33 1.20 0.00 0.00 173.24 175.64 2r98 h GLU 409 N 1.68 0.00 0.00 5.44 5.08 -1.99 -2.43 114.58 122.37 2r98 h GLU 409 Ca -0.43 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.93 2r98 h GLU 409 Cb 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 2r98 h GLU 409 CO 0.72 0.36 0.00 -0.25 -1.00 0.00 0.00 179.01 178.84 2r98 n ASP 410 N -3.99 0.00 0.00 1.42 8.00 -1.26 -1.78 116.55 118.94 2r98 n ASP 410 Ca -0.02 -0.07 0.11 0.00 0.71 0.00 0.00 54.79 55.52 2r98 n ASP 410 Cb 0.41 -0.26 -0.07 0.00 -0.02 0.00 0.00 41.12 41.18 2r98 n ASP 410 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2r98 n GLU 411 N -1.26 0.19 -1.78 -1.24 1.02 -0.91 -4.98 120.64 111.68 2r98 n GLU 411 Ca 0.10 -0.04 -0.32 0.00 -0.02 0.00 0.00 57.16 56.88 2r98 n GLU 411 Cb 0.15 -1.52 0.04 0.00 -0.02 0.00 0.00 31.44 30.09 2r98 n GLU 411 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2r98 s LEU 412 N -3.50 3.35 0.34 -4.62 1.43 -0.73 -4.95 118.68 110.00 2r98 s LEU 412 Ca 0.04 1.85 -0.27 0.00 -1.03 0.00 0.00 54.13 54.72 2r98 s LEU 412 Cb 0.15 -4.53 -0.13 0.00 0.03 0.00 0.00 46.19 41.71 2r98 s LEU 412 CO 0.85 -1.48 1.06 -2.65 0.23 0.00 0.00 176.35 174.37 2r98 n PRO 413 N -2.51 1.52 -0.24 1.29 -0.02 -1.26 -4.62 135.00 129.16 2r98 n PRO 413 Ca 0.09 0.53 0.04 0.00 -2.02 0.00 0.00 63.50 62.15 2r98 n PRO 413 Cb 0.53 -2.00 0.15 0.00 -0.02 0.00 0.00 33.50 32.16 2r98 n PRO 413 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2r98 h GLU 414 N 1.98 0.15 0.00 -0.52 4.81 -1.94 0.33 114.58 119.38 2r98 h GLU 414 Ca -0.42 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 58.74 2r98 h GLU 414 Cb 1.33 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.67 2r98 h GLU 414 CO 0.60 0.10 -0.27 1.79 -0.73 0.00 0.00 179.01 180.49 2r98 h THR 415 N 0.15 0.69 -0.15 0.32 1.35 -2.00 -2.58 112.91 110.70 2r98 h THR 415 Ca 0.38 -1.21 -0.21 0.00 -0.55 0.00 0.00 66.41 64.82 2r98 h THR 415 Cb 0.66 1.78 0.01 0.00 -1.73 0.00 0.00 68.15 68.87 2r98 h THR 415 CO -0.58 0.27 -0.76 -0.09 -0.25 0.00 0.00 175.52 174.12 2r98 h ARG 416 N 0.00 0.73 -0.91 4.72 9.65 -1.49 -1.43 114.38 125.65 2r98 h ARG 416 Ca -0.00 -0.58 0.11 0.00 -1.10 0.00 0.00 59.98 58.40 2r98 h ARG 416 Cb 0.76 0.12 -0.07 0.00 -1.39 0.00 0.00 29.97 29.39 2r98 h ARG 416 CO 0.04 1.20 0.59 -0.09 2.80 0.00 0.00 179.97 184.50 2r98 h ARG 417 N 0.50 0.85 0.41 0.20 2.43 -0.86 0.16 114.38 118.07 2r98 h ARG 417 Ca -0.04 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.05 2r98 h ARG 417 Cb 1.37 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 30.74 2r98 h ARG 417 CO 0.15 0.56 -0.20 0.87 -1.51 0.00 0.00 179.97 179.85 2r98 h LYS 418 N 0.88 -0.53 -0.78 0.20 1.79 -1.25 -1.80 116.57 115.08 2r98 h LYS 418 Ca 0.43 0.04 0.18 0.00 -2.18 0.00 0.00 60.65 59.11 2r98 h LYS 418 Cb 0.46 0.12 -0.14 0.00 -1.58 0.00 0.00 32.23 31.09 2r98 h LYS 418 CO -0.19 -0.35 -0.03 -0.44 -1.08 0.00 0.00 179.45 177.35 2r98 h ASP 419 N -0.60 -0.43 -0.22 0.86 3.45 -1.16 -1.62 116.42 116.70 2r98 h ASP 419 Ca -0.06 0.21 0.05 0.00 0.43 0.00 0.00 57.03 57.66 2r98 h ASP 419 Cb 0.42 0.38 -0.05 0.00 -0.56 0.00 0.00 39.33 39.53 2r98 h ASP 419 CO 0.09 -0.21 -0.08 0.22 -1.57 0.00 0.00 179.24 177.70 2r98 h TYR 420 N 0.08 -0.18 -0.58 4.55 3.20 -0.67 0.16 116.97 123.53 2r98 h TYR 420 Ca 0.42 0.02 0.05 0.00 3.14 0.00 0.00 58.73 62.37 2r98 h TYR 420 Cb 0.74 0.11 -0.03 0.00 1.54 0.00 0.00 36.73 39.09 2r98 h TYR 420 CO -0.47 -0.13 0.39 0.00 -1.64 0.00 0.00 178.16 176.31 2r98 h ARG 421 N -0.04 0.56 0.00 1.82 3.08 -0.66 -2.95 114.38 116.19 2r98 h ARG 421 Ca 0.11 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.13 2r98 h ARG 421 Cb 0.21 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.13 2r98 h ARG 421 CO -0.25 0.37 -1.16 -1.13 -1.07 0.00 0.00 179.97 176.73 2r98 n SER 422 N -4.47 0.62 0.08 7.04 3.41 -0.67 -3.96 113.62 115.67 2r98 n SER 422 Ca 0.08 -0.42 -0.05 0.00 -0.26 0.00 0.00 58.87 58.22 2r98 n SER 422 Cb 0.22 1.04 -0.04 0.00 -0.26 0.00 0.00 64.21 65.17 2r98 n SER 422 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 2r98 h ASN 423 N 0.00 0.00 0.00 4.04 -0.26 -0.79 -3.47 115.58 115.10 2r98 h ASN 423 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 2r98 h ASN 423 Cb 0.70 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.96 2r98 h ASN 423 CO 0.00 0.88 0.00 0.61 -1.06 0.00 0.00 177.43 177.86 2r98 n GLY 424 N 1.04 0.84 0.15 2.83 0.00 -1.19 -4.89 105.19 103.98 2r98 n GLY 424 Ca -0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.05 2r98 n GLY 424 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2r98 h ARG 425 N 2.85 0.00 -2.20 1.61 3.08 -1.92 -3.47 114.38 114.32 2r98 h ARG 425 Ca 0.00 0.00 -0.35 0.00 0.07 0.00 0.00 59.98 59.70 2r98 h ARG 425 Cb 0.00 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.01 2r98 h ARG 425 CO 0.00 0.50 -0.43 -1.71 -1.07 0.00 0.00 179.97 177.26 2r98 n ASN 426 N -3.40 -5.09 -4.41 7.04 5.15 -1.26 -4.95 115.26 108.34 2r98 n ASN 426 Ca 0.01 0.06 -0.28 0.00 -0.60 0.00 0.00 54.58 53.76 2r98 n ASN 426 Cb 0.65 -4.17 0.25 0.00 -0.53 0.00 0.00 39.78 35.97 2r98 n ASN 426 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 2r98 s SER 427 N -2.32 0.89 -0.08 1.20 1.04 -1.26 -4.97 113.70 108.20 2r98 s SER 427 Ca 0.00 1.36 -0.17 0.00 0.48 0.00 0.00 55.95 57.62 2r98 s SER 427 Cb 0.00 -2.11 -0.05 0.00 0.10 0.00 0.00 66.02 63.96 2r98 s SER 427 CO 0.00 -4.24 0.46 -1.00 0.98 0.00 0.00 173.24 169.45 2r98 s HIS 428 N -2.52 3.57 -0.11 5.02 3.76 0.19 -4.83 115.29 120.37 2r98 s HIS 428 Ca 0.68 0.93 -0.05 0.00 -0.15 0.00 0.00 55.06 56.47 2r98 s HIS 428 Cb -0.23 -2.49 -0.04 0.00 1.11 0.00 0.00 32.58 30.93 2r98 s HIS 428 CO 0.63 0.29 0.08 -1.50 -0.85 0.00 0.00 174.74 173.40 2r98 s ILE 429 N 0.17 5.01 -0.03 0.60 1.10 -1.26 -1.26 121.20 125.52 2r98 s ILE 429 Ca 0.25 0.02 -0.13 0.00 -0.51 0.00 0.00 60.65 60.29 2r98 s ILE 429 Cb -0.16 -3.17 0.02 0.00 0.15 0.00 0.00 42.46 39.31 2r98 s ILE 429 CO 0.11 0.60 0.28 -0.76 -2.11 0.00 0.00 174.94 173.06 2r98 s LEU 430 N -0.84 0.96 0.08 8.50 1.02 -0.54 -0.08 118.68 127.79 2r98 s LEU 430 Ca 0.13 0.16 0.03 0.00 0.02 0.00 0.00 54.13 54.47 2r98 s LEU 430 Cb -0.12 1.12 -0.03 0.00 0.02 0.00 0.00 46.19 47.18 2r98 s LEU 430 CO 0.03 -0.36 -0.09 -0.69 0.02 0.00 0.00 176.35 175.26 2r98 s VAL 431 N -0.99 0.83 -0.03 -1.59 1.01 0.21 0.09 120.40 119.93 2r98 s VAL 431 Ca -0.11 -1.53 0.05 0.00 0.00 0.00 0.00 61.98 60.39 2r98 s VAL 431 Cb -0.05 -1.21 -0.01 0.00 0.00 0.00 0.00 36.38 35.11 2r98 s VAL 431 CO 0.03 -0.54 -0.17 -0.60 0.00 0.00 0.00 175.10 173.82 2r98 s ARG 432 N -2.58 1.68 0.24 2.72 3.52 0.92 0.57 118.95 126.00 2r98 s ARG 432 Ca 0.02 -0.62 -0.27 0.00 -0.13 0.00 0.00 55.73 54.73 2r98 s ARG 432 Cb -0.04 -1.51 -0.09 0.00 -1.56 0.00 0.00 34.95 31.75 2r98 s ARG 432 CO -0.00 0.29 0.87 1.03 -0.81 0.00 0.00 175.30 176.68 2r98 s ARG 433 N -0.12 4.65 -0.07 5.12 0.52 -1.26 -0.47 118.95 127.32 2r98 s ARG 433 Ca -0.00 1.29 0.05 0.00 -0.52 0.00 0.00 55.73 56.55 2r98 s ARG 433 Cb -0.10 -3.11 -0.00 0.00 0.52 0.00 0.00 34.95 32.25 2r98 s ARG 433 CO 0.01 0.46 -0.22 -0.51 0.02 0.00 0.00 175.30 175.06 2r98 s LEU 434 N -1.47 2.01 0.32 2.53 1.43 0.31 -4.95 118.68 118.86 2r98 s LEU 434 Ca 0.42 -0.47 -0.04 0.00 -1.03 0.00 0.00 54.13 53.01 2r98 s LEU 434 Cb -0.22 -1.25 -0.05 0.00 0.03 0.00 0.00 46.19 44.70 2r98 s LEU 434 CO 0.27 0.18 0.58 -1.00 0.23 0.00 0.00 176.35 176.61 2r98 s HIS 435 N 0.08 3.49 -2.00 0.29 3.76 -1.26 -4.53 115.29 115.12 2r98 s HIS 435 Ca -0.09 0.60 0.07 0.00 -0.15 0.00 0.00 55.06 55.49 2r98 s HIS 435 Cb -0.15 -2.08 0.40 0.00 1.11 0.00 0.00 32.58 31.86 2r98 s HIS 435 CO 0.05 0.11 0.86 2.89 -0.85 0.00 0.00 174.74 177.80