#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jt9 s ARG 2 N 0.00 2.24 -0.14 2.12 0.52 -0.57 -5.02 118.95 118.09 1jt9 s ARG 2 Ca 0.00 -0.93 -0.01 0.00 -0.52 0.00 0.00 55.73 54.27 1jt9 s ARG 2 Cb 0.00 -2.34 0.04 0.00 0.52 0.00 0.00 34.95 33.17 1jt9 s ARG 2 CO 0.00 0.54 -0.04 -1.17 0.02 0.00 0.00 175.30 174.65 1jt9 s LEU 3 N -1.82 1.30 -0.50 2.53 2.96 -1.26 -1.00 118.68 120.90 1jt9 s LEU 3 Ca 0.19 -0.50 -0.15 0.00 -0.22 0.00 0.00 54.13 53.45 1jt9 s LEU 3 Cb -0.11 -0.79 0.10 0.00 0.50 0.00 0.00 46.19 45.89 1jt9 s LEU 3 CO 0.10 -0.18 0.43 -0.63 -1.32 0.00 0.00 176.35 174.76 1jt9 s ILE 4 N 1.73 5.17 -0.42 6.68 -1.09 0.29 -4.83 121.20 128.73 1jt9 s ILE 4 Ca 0.02 -1.27 -0.24 0.00 -2.23 0.00 0.00 60.65 56.93 1jt9 s ILE 4 Cb -0.14 -4.19 0.02 0.00 -1.58 0.00 0.00 42.46 36.57 1jt9 s ILE 4 CO -0.07 -0.70 0.83 -2.84 -1.23 0.00 0.00 174.94 170.93 1jt9 s PRO 5 N 1.61 3.57 0.45 2.79 0.02 -1.26 -1.83 135.00 140.35 1jt9 s PRO 5 Ca 0.04 0.14 0.05 0.00 0.02 0.00 0.00 61.00 61.24 1jt9 s PRO 5 Cb -0.27 -3.89 -0.05 0.00 0.02 0.00 0.00 34.50 30.31 1jt9 s PRO 5 CO 0.05 -1.06 0.01 -0.51 -0.33 0.00 0.00 177.00 175.16 1jt9 s LEU 6 N 3.38 2.65 -0.19 -5.54 1.43 -0.27 -4.99 118.68 115.15 1jt9 s LEU 6 Ca 0.33 -1.48 -0.19 0.00 -1.03 0.00 0.00 54.13 51.76 1jt9 s LEU 6 Cb -0.12 -0.84 -0.15 0.00 0.03 0.00 0.00 46.19 45.10 1jt9 s LEU 6 CO 0.22 -0.62 0.12 0.74 0.23 0.00 0.00 176.35 177.04 1jt9 h THR 7 N 1.59 0.70 -2.01 5.49 2.02 -1.90 -1.78 112.91 117.02 1jt9 h THR 7 Ca -0.44 -1.91 -0.56 0.00 0.77 0.00 0.00 66.41 64.27 1jt9 h THR 7 Cb 1.27 1.71 -0.09 0.00 -1.74 0.00 0.00 68.15 69.29 1jt9 h THR 7 CO 0.78 0.24 -0.60 0.42 0.37 0.00 0.00 175.52 176.73 1jt9 s THR 8 N -2.33 3.06 0.27 3.16 -4.23 -1.26 -1.63 115.64 112.68 1jt9 s THR 8 Ca -0.26 -1.86 -0.05 0.00 -1.18 0.00 0.00 61.69 58.35 1jt9 s THR 8 Cb 0.05 -2.87 0.26 0.00 1.34 0.00 0.00 72.50 71.28 1jt9 s THR 8 CO 0.51 -0.26 1.94 0.00 -0.54 0.00 0.00 174.62 176.27 1jt9 h ALA 9 N 1.75 1.32 -0.12 3.99 0.00 -1.95 -1.60 119.26 122.66 1jt9 h ALA 9 Ca -0.44 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.33 1jt9 h ALA 9 Cb 1.25 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 1jt9 h ALA 9 CO 0.63 0.62 -0.26 1.49 0.00 0.00 0.00 179.25 181.74 1jt9 h GLU 10 N 1.27 0.21 -0.20 0.00 4.57 -1.95 -1.39 114.58 117.08 1jt9 h GLU 10 Ca 0.34 -0.07 -0.19 0.00 -1.18 0.00 0.00 59.36 58.27 1jt9 h GLU 10 Cb -0.14 -0.02 0.01 0.00 -0.16 0.00 0.00 28.75 28.44 1jt9 h GLU 10 CO -0.07 0.45 -0.62 1.96 -1.18 0.00 0.00 179.01 179.55 1jt9 h GLN 11 N 0.19 0.78 -0.26 1.92 4.20 -1.79 -2.41 115.11 117.74 1jt9 h GLN 11 Ca 0.03 -0.56 0.02 0.00 0.06 0.00 0.00 58.65 58.19 1jt9 h GLN 11 Cb 0.56 0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.41 1jt9 h GLN 11 CO 0.04 1.18 0.13 0.28 -0.67 0.00 0.00 178.83 179.79 1jt9 h VAL 12 N 0.51 1.00 -0.81 -0.54 2.07 -0.97 0.82 116.25 118.32 1jt9 h VAL 12 Ca -0.02 -0.09 0.01 0.00 0.82 0.00 0.00 66.70 67.41 1jt9 h VAL 12 Cb 1.24 0.70 -0.04 0.00 -1.52 0.00 0.00 31.29 31.67 1jt9 h VAL 12 CO 0.13 0.05 0.53 1.23 0.02 0.00 0.00 177.57 179.54 1jt9 h GLY 13 N 0.27 1.15 1.26 2.17 0.00 -1.27 0.98 103.07 107.64 1jt9 h GLY 13 Ca 0.10 -0.43 -0.10 0.00 0.00 0.00 0.00 47.33 46.90 1jt9 h GLY 13 CO -0.07 0.43 -0.11 0.50 0.00 0.00 0.00 176.54 177.29 1jt9 h LYS 14 N 1.10 0.87 -0.14 4.80 1.57 -1.03 0.16 116.57 123.90 1jt9 h LYS 14 Ca 0.30 -0.30 -0.04 0.00 -1.87 0.00 0.00 60.65 58.73 1jt9 h LYS 14 Cb -0.12 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.12 1jt9 h LYS 14 CO -0.06 0.93 -0.09 2.35 -0.57 0.00 0.00 179.45 182.01 1jt9 h TRP 15 N 0.78 0.35 -0.52 -1.35 7.01 -0.34 -2.08 115.95 119.80 1jt9 h TRP 15 Ca 0.13 -0.09 -0.01 0.00 2.11 0.00 0.00 58.89 61.02 1jt9 h TRP 15 Cb 0.62 -0.08 -0.02 0.00 -2.10 0.00 0.00 29.16 27.58 1jt9 h TRP 15 CO 0.04 0.66 0.28 0.00 -2.79 0.00 0.00 178.44 176.63 1jt9 h ALA 16 N 0.64 0.67 -0.21 2.65 0.00 -0.75 -1.46 119.26 120.80 1jt9 h ALA 16 Ca 0.03 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1jt9 h ALA 16 Cb 0.58 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1jt9 h ALA 16 CO 0.02 0.19 0.13 0.00 0.00 0.00 0.00 179.25 179.60 1jt9 h ALA 17 N 1.12 0.26 -0.82 0.00 0.00 -0.96 -1.74 119.26 117.11 1jt9 h ALA 17 Ca 0.18 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1jt9 h ALA 17 Cb 0.05 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 1jt9 h ALA 17 CO -0.03 -0.25 0.52 -0.09 0.00 0.00 0.00 179.25 179.40 1jt9 h ARG 18 N 0.27 1.10 -0.61 0.00 2.43 -1.22 -0.41 114.38 115.94 1jt9 h ARG 18 Ca 0.08 -0.08 -0.04 0.00 -0.81 0.00 0.00 59.98 59.12 1jt9 h ARG 18 Cb -0.01 -0.24 -0.03 0.00 -0.42 0.00 0.00 29.97 29.27 1jt9 h ARG 18 CO -0.02 0.76 0.21 1.25 -1.51 0.00 0.00 179.97 180.66 1jt9 h HIS 19 N 1.13 0.96 -0.33 2.20 2.76 -0.87 0.15 115.15 121.14 1jt9 h HIS 19 Ca 0.30 -0.09 -0.03 0.00 -2.20 0.00 0.00 60.37 58.36 1jt9 h HIS 19 Cb -0.08 -0.28 -0.01 0.00 1.55 0.00 0.00 27.41 28.58 1jt9 h HIS 19 CO 0.00 0.78 0.11 0.82 -1.30 0.00 0.00 177.93 178.34 1jt9 h ILE 20 N 0.86 1.20 -0.41 6.26 2.04 -0.79 -1.34 117.51 125.34 1jt9 h ILE 20 Ca 0.20 -0.65 0.01 0.00 1.00 0.00 0.00 64.86 65.42 1jt9 h ILE 20 Cb 0.26 1.02 -0.03 0.00 -0.74 0.00 0.00 36.82 37.33 1jt9 h ILE 20 CO -0.01 0.22 0.25 0.58 0.00 0.00 0.00 178.15 179.19 1jt9 h VAL 21 N 0.38 1.05 -0.67 1.67 2.07 -0.81 -0.86 116.25 119.08 1jt9 h VAL 21 Ca 0.11 -0.17 -0.04 0.00 0.82 0.00 0.00 66.70 67.42 1jt9 h VAL 21 Cb 0.24 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 30.50 1jt9 h VAL 21 CO -0.00 0.09 0.26 0.78 0.02 0.00 0.00 177.57 178.72 1jt9 h ASN 22 N 0.50 0.92 -0.74 0.57 -0.26 -0.86 0.45 115.58 116.16 1jt9 h ASN 22 Ca 0.16 -0.17 -0.04 0.00 -0.56 0.00 0.00 56.30 55.69 1jt9 h ASN 22 Cb -0.01 -0.24 -0.03 0.00 -1.06 0.00 0.00 38.32 36.98 1jt9 h ASN 22 CO -0.07 0.84 0.31 0.03 -1.06 0.00 0.00 177.43 177.49 1jt9 h ARG 23 N 0.94 1.10 0.39 0.81 2.47 -0.89 -1.15 114.38 118.04 1jt9 h ARG 23 Ca 0.22 -0.19 -0.02 0.00 -1.26 0.00 0.00 59.98 58.73 1jt9 h ARG 23 Cb 0.21 -0.18 0.00 0.00 -1.65 0.00 0.00 29.97 28.35 1jt9 h ARG 23 CO -0.02 0.89 -0.19 0.82 0.56 0.00 0.00 179.97 182.03 1jt9 h ILE 24 N 1.06 0.57 -0.02 2.04 2.04 -0.78 -1.68 117.51 120.74 1jt9 h ILE 24 Ca 0.25 -0.45 0.01 0.00 1.00 0.00 0.00 64.86 65.66 1jt9 h ILE 24 Cb 0.19 0.78 -0.00 0.00 -0.74 0.00 0.00 36.82 37.05 1jt9 h ILE 24 CO -0.02 0.08 0.02 0.78 0.00 0.00 0.00 178.15 179.01 1jt9 h ASN 25 N -0.81 0.00 0.79 1.72 2.35 -0.86 0.46 115.58 119.23 1jt9 h ASN 25 Ca -0.05 0.00 -0.25 0.00 -0.55 0.00 0.00 56.30 55.45 1jt9 h ASN 25 Cb 0.53 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.87 1jt9 h ASN 25 CO 0.09 0.00 -1.25 0.00 -1.65 0.00 0.00 177.43 174.62 1jt9 h ALA 26 N 1.97 0.43 -0.07 -0.83 0.00 -1.14 -3.29 119.26 116.33 1jt9 h ALA 26 Ca 0.01 -1.07 -0.18 0.00 0.00 0.00 0.00 54.91 53.67 1jt9 h ALA 26 Cb 0.06 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1jt9 h ALA 26 CO -0.00 1.30 -0.73 0.35 0.00 0.00 0.00 179.25 180.17 1jt9 h PHE 27 N 0.01 0.53 -5.74 0.00 3.57 -0.20 -3.49 116.94 111.64 1jt9 h PHE 27 Ca -0.11 -0.24 -0.13 0.00 3.53 0.00 0.00 57.97 61.02 1jt9 h PHE 27 Cb 1.87 -0.08 0.00 0.00 2.79 0.00 0.00 35.95 40.53 1jt9 h PHE 27 CO 0.01 0.99 -0.34 1.63 -2.23 0.00 0.00 178.31 178.38 1jt9 n LYS 28 N -3.83 -1.46 -2.28 1.11 5.02 0.01 -4.94 118.16 111.78 1jt9 n LYS 28 Ca -0.04 1.35 -0.35 0.00 -2.02 0.00 0.00 58.31 57.25 1jt9 n LYS 28 Cb 0.71 -4.80 -0.00 0.00 -0.02 0.00 0.00 35.03 30.92 1jt9 n LYS 28 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1jt9 s PRO 29 N -3.45 3.47 0.30 1.97 0.04 -1.26 -5.04 135.00 131.03 1jt9 s PRO 29 Ca 0.03 1.63 0.03 0.00 0.04 0.00 0.00 61.00 62.72 1jt9 s PRO 29 Cb -0.01 -2.09 -0.04 0.00 0.04 0.00 0.00 34.50 32.40 1jt9 s PRO 29 CO 0.79 -0.75 0.15 0.95 0.04 0.00 0.00 177.00 178.18 1jt9 s THR 30 N -1.74 0.37 0.30 1.26 -4.23 -0.16 -4.84 115.64 106.59 1jt9 s THR 30 Ca 0.70 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 59.23 1jt9 s THR 30 Cb -0.24 -2.53 0.29 0.00 1.34 0.00 0.00 72.50 71.35 1jt9 s THR 30 CO 0.28 0.00 1.87 0.00 -0.54 0.00 0.00 174.62 176.23 1jt9 h ALA 31 N 2.24 1.54 0.00 3.99 0.00 -1.94 -1.86 119.26 123.23 1jt9 h ALA 31 Ca -0.34 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.55 1jt9 h ALA 31 Cb 1.25 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.80 1jt9 h ALA 31 CO 0.53 0.27 -0.34 -0.44 0.00 0.00 0.00 179.25 179.27 1jt9 h ASP 32 N 1.00 0.00 -2.63 0.00 3.32 -1.99 -3.40 116.42 112.72 1jt9 h ASP 32 Ca 0.44 0.00 -0.59 0.00 0.02 0.00 0.00 57.03 56.90 1jt9 h ASP 32 Cb 0.37 0.00 -0.39 0.00 0.22 0.00 0.00 39.33 39.53 1jt9 h ASP 32 CO -0.20 0.04 -0.87 -0.60 -1.72 0.00 0.00 179.24 175.89 1jt9 s ARG 33 N -3.23 1.00 0.52 3.56 3.52 -0.73 -5.13 118.95 118.46 1jt9 s ARG 33 Ca 0.04 -2.00 -0.12 0.00 -0.13 0.00 0.00 55.73 53.53 1jt9 s ARG 33 Cb 0.06 -1.69 -0.06 0.00 -1.56 0.00 0.00 34.95 31.71 1jt9 s ARG 33 CO 0.71 -1.30 0.92 -1.25 -0.81 0.00 0.00 175.30 173.57 1jt9 s PRO 34 N 0.23 3.76 -0.19 5.12 0.04 -1.02 -0.99 135.00 141.95 1jt9 s PRO 34 Ca 0.26 0.69 -0.21 0.00 0.04 0.00 0.00 61.00 61.78 1jt9 s PRO 34 Cb -0.08 -2.21 -0.02 0.00 0.04 0.00 0.00 34.50 32.23 1jt9 s PRO 34 CO -0.11 -0.30 0.65 0.12 0.04 0.00 0.00 177.00 177.39 1jt9 s PHE 35 N -2.75 3.38 -0.31 0.56 5.36 -0.76 -4.90 117.98 118.57 1jt9 s PHE 35 Ca 0.55 0.96 -0.14 0.00 -0.96 0.00 0.00 56.93 57.34 1jt9 s PHE 35 Cb -0.10 -2.81 -0.03 0.00 -0.34 0.00 0.00 43.02 39.73 1jt9 s PHE 35 CO 0.40 -0.17 0.31 0.08 -1.46 0.00 0.00 175.22 174.38 1jt9 s VAL 36 N 1.89 5.22 -0.16 3.12 1.01 -1.26 -1.01 120.40 129.21 1jt9 s VAL 36 Ca 0.30 0.21 -0.01 0.00 0.00 0.00 0.00 61.98 62.47 1jt9 s VAL 36 Cb -0.16 -3.70 -0.01 0.00 0.00 0.00 0.00 36.38 32.51 1jt9 s VAL 36 CO 0.11 0.07 -0.11 -0.22 0.00 0.00 0.00 175.10 174.95 1jt9 s LEU 37 N 1.94 2.68 -0.02 3.92 2.96 0.12 -0.73 118.68 129.55 1jt9 s LEU 37 Ca 0.11 -0.40 -0.16 0.00 -0.22 0.00 0.00 54.13 53.46 1jt9 s LEU 37 Cb -0.16 -1.63 -0.05 0.00 0.50 0.00 0.00 46.19 44.84 1jt9 s LEU 37 CO 0.11 0.08 0.45 -0.83 -1.32 0.00 0.00 176.35 174.84 1jt9 s GLY 38 N 0.84 2.49 0.04 7.98 0.00 0.78 -1.21 107.32 118.25 1jt9 s GLY 38 Ca -0.04 -0.17 0.02 0.00 0.00 0.00 0.00 44.72 44.54 1jt9 s GLY 38 CO 0.00 0.37 -0.08 1.08 0.00 0.00 0.00 173.10 174.47 1jt9 s LEU 39 N -0.62 2.25 0.47 0.66 1.43 0.35 -1.17 118.68 122.05 1jt9 s LEU 39 Ca 0.25 -0.54 0.06 0.00 -1.03 0.00 0.00 54.13 52.87 1jt9 s LEU 39 Cb -0.17 -0.20 -0.01 0.00 0.03 0.00 0.00 46.19 45.84 1jt9 s LEU 39 CO 0.13 -0.18 0.30 -2.16 0.23 0.00 0.00 176.35 174.67 1jt9 s PRO 40 N -1.55 2.31 0.34 1.29 0.04 -1.23 -1.40 135.00 134.79 1jt9 s PRO 40 Ca -0.09 -1.87 0.03 0.00 0.04 0.00 0.00 61.00 59.12 1jt9 s PRO 40 Cb -0.10 -2.09 -0.01 0.00 0.04 0.00 0.00 34.50 32.34 1jt9 s PRO 40 CO 0.01 -0.33 0.11 0.25 0.04 0.00 0.00 177.00 177.08 1jt9 n THR 41 N -1.50 0.00 0.00 1.26 -2.24 -1.26 -4.93 114.28 105.61 1jt9 n THR 41 Ca -0.01 -1.95 0.00 0.00 -2.27 0.00 0.00 64.05 59.82 1jt9 n THR 41 Cb 0.64 0.69 0.00 0.00 -2.10 0.00 0.00 70.33 69.56 1jt9 n THR 41 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1jt9 n GLY 42 N -0.23 -2.97 0.28 3.38 0.00 -1.26 -4.59 105.19 99.80 1jt9 n GLY 42 Ca -0.05 -2.12 -0.04 0.00 0.00 0.00 0.00 46.02 43.81 1jt9 n GLY 42 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1jt9 h GLY 43 N 0.00 0.77 0.34 -0.02 0.00 -2.02 -3.31 103.07 98.83 1jt9 h GLY 43 Ca 0.00 -0.54 0.04 0.00 0.00 0.00 0.00 47.33 46.84 1jt9 h GLY 43 CO 0.00 0.50 -0.23 -0.84 0.00 0.00 0.00 176.54 175.96 1jt9 h THR 44 N 0.66 0.44 -0.01 4.70 2.02 -1.99 -2.42 112.91 116.31 1jt9 h THR 44 Ca 0.12 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.30 1jt9 h THR 44 Cb 0.50 0.44 0.00 0.00 -1.74 0.00 0.00 68.15 67.35 1jt9 h THR 44 CO 0.03 0.00 0.00 -0.81 0.37 0.00 0.00 175.52 175.11 1jt9 n PRO 45 N -5.36 1.05 -0.04 6.66 -0.04 -1.25 -4.34 135.00 131.67 1jt9 n PRO 45 Ca -0.03 -0.07 -0.10 0.00 -0.04 0.00 0.00 63.50 63.26 1jt9 n PRO 45 Cb 0.27 -1.24 -0.03 0.00 -0.04 0.00 0.00 33.50 32.47 1jt9 n PRO 45 CO 0.00 0.00 0.00 0.52 -0.04 0.00 0.00 175.50 175.98 1jt9 h MET 46 N 0.13 -0.33 0.00 0.54 2.86 -1.54 -1.06 114.93 115.54 1jt9 h MET 46 Ca 0.00 0.02 -0.02 0.00 -2.06 0.00 0.00 59.70 57.64 1jt9 h MET 46 Cb 0.03 0.08 -0.00 0.00 0.06 0.00 0.00 31.60 31.76 1jt9 h MET 46 CO 0.00 -0.22 -0.11 1.79 1.06 0.00 0.00 176.91 179.43 1jt9 h THR 47 N -0.34 0.48 -0.12 2.22 1.35 -1.81 -2.11 112.91 112.58 1jt9 h THR 47 Ca 0.12 -0.55 -0.12 0.00 -0.55 0.00 0.00 66.41 65.31 1jt9 h THR 47 Cb 0.54 1.38 0.00 0.00 -1.73 0.00 0.00 68.15 68.34 1jt9 h THR 47 CO -0.42 0.11 -0.40 0.74 -0.25 0.00 0.00 175.52 175.29 1jt9 h THR 48 N 0.00 1.37 -0.60 6.82 2.02 -1.43 -1.92 112.91 119.17 1jt9 h THR 48 Ca -0.00 -1.71 -0.04 0.00 0.77 0.00 0.00 66.41 65.43 1jt9 h THR 48 Cb 0.37 2.11 -0.03 0.00 -1.74 0.00 0.00 68.15 68.86 1jt9 h THR 48 CO 0.01 0.51 0.22 1.88 0.37 0.00 0.00 175.52 178.51 1jt9 h TYR 49 N 0.09 0.94 -0.60 3.16 0.05 -1.12 0.88 116.97 120.37 1jt9 h TYR 49 Ca -0.02 -0.08 0.06 0.00 0.05 0.00 0.00 58.73 58.74 1jt9 h TYR 49 Cb 1.03 -0.28 -0.05 0.00 1.01 0.00 0.00 36.73 38.44 1jt9 h TYR 49 CO 0.11 0.77 0.32 -0.22 -1.05 0.00 0.00 178.16 178.09 1jt9 h LYS 50 N 0.85 0.58 -0.44 4.88 3.64 -1.38 -0.17 116.57 124.53 1jt9 h LYS 50 Ca 0.20 -0.04 -0.13 0.00 -1.27 0.00 0.00 60.65 59.41 1jt9 h LYS 50 Cb 0.25 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.92 1jt9 h LYS 50 CO -0.01 0.39 -0.24 0.00 -2.27 0.00 0.00 179.45 177.31 1jt9 h ALA 51 N 1.32 0.73 -0.80 5.00 0.00 -0.93 -2.23 119.26 122.35 1jt9 h ALA 51 Ca 0.27 -0.40 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 1jt9 h ALA 51 Cb 0.18 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.77 1jt9 h ALA 51 CO -0.18 0.67 0.39 -0.07 0.00 0.00 0.00 179.25 180.05 1jt9 h LEU 52 N 0.79 1.05 -0.31 0.00 3.38 -0.23 -1.53 115.31 118.46 1jt9 h LEU 52 Ca 0.10 -0.13 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 1jt9 h LEU 52 Cb 0.81 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 1jt9 h LEU 52 CO 0.07 0.89 0.04 0.58 0.09 0.00 0.00 178.44 180.10 1jt9 h VAL 53 N 1.13 1.24 -0.55 1.22 2.07 -0.94 -1.37 116.25 119.06 1jt9 h VAL 53 Ca 0.28 -0.84 0.02 0.00 0.82 0.00 0.00 66.70 66.98 1jt9 h VAL 53 Cb 0.11 1.19 -0.03 0.00 -1.52 0.00 0.00 31.29 31.04 1jt9 h VAL 53 CO -0.04 0.27 0.34 -0.33 0.02 0.00 0.00 177.57 177.84 1jt9 h GLU 54 N 0.33 0.66 -0.73 1.57 5.08 -1.20 0.16 114.58 120.45 1jt9 h GLU 54 Ca 0.09 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.39 1jt9 h GLU 54 Cb 0.37 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.43 1jt9 h GLU 54 CO 0.01 0.43 0.35 0.52 -1.00 0.00 0.00 179.01 179.32 1jt9 h MET 55 N 0.68 1.04 -0.29 2.33 2.86 -1.11 -0.97 114.93 119.47 1jt9 h MET 55 Ca 0.22 -0.15 -0.05 0.00 -2.06 0.00 0.00 59.70 57.67 1jt9 h MET 55 Cb -0.00 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 31.46 1jt9 h MET 55 CO -0.08 0.81 0.00 1.25 1.06 0.00 0.00 176.91 179.94 1jt9 h HIS 56 N 1.03 0.55 0.00 -0.22 -0.00 -0.58 -0.29 115.15 115.64 1jt9 h HIS 56 Ca 0.25 -0.09 -0.01 0.00 -0.00 0.00 0.00 60.37 60.52 1jt9 h HIS 56 Cb 0.11 -0.14 -0.00 0.00 -0.00 0.00 0.00 27.41 27.38 1jt9 h HIS 56 CO 0.01 0.65 -0.04 0.87 -0.00 0.00 0.00 177.93 179.42 1jt9 h LYS 57 N 0.29 0.00 -0.03 5.26 1.57 -0.50 -0.40 116.57 122.75 1jt9 h LYS 57 Ca 0.08 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 1jt9 h LYS 57 Cb 0.43 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.74 1jt9 h LYS 57 CO 0.01 0.04 0.00 0.00 -0.57 0.00 0.00 179.45 178.93 1jt9 n ALA 58 N -2.16 2.57 -0.96 3.86 0.00 -0.41 -4.92 120.51 118.49 1jt9 n ALA 58 Ca -0.02 -0.45 0.00 0.00 0.00 0.00 0.00 53.44 52.98 1jt9 n ALA 58 Cb 0.19 -1.17 0.00 0.00 0.00 0.00 0.00 19.45 18.47 1jt9 n ALA 58 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1jt9 n GLY 59 N 1.16 0.43 0.11 0.00 0.00 -0.16 -4.95 105.19 101.78 1jt9 n GLY 59 Ca 0.19 -0.83 0.12 0.00 0.00 0.00 0.00 46.02 45.50 1jt9 n GLY 59 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1jt9 h GLN 60 N 0.24 0.00 -2.50 1.61 4.20 -1.22 -3.47 115.11 113.96 1jt9 h GLN 60 Ca 0.00 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.65 1jt9 h GLN 60 Cb 0.00 0.00 -0.17 0.00 0.30 0.00 0.00 27.48 27.61 1jt9 h GLN 60 CO 0.00 0.00 0.11 0.54 -0.67 0.00 0.00 178.83 178.81 1jt9 s VAL 61 N -3.18 0.01 -0.01 -0.54 0.11 -1.25 -4.98 120.40 110.57 1jt9 s VAL 61 Ca 0.07 -0.12 0.05 0.00 -2.93 0.00 0.00 61.98 59.05 1jt9 s VAL 61 Cb 0.11 -0.97 -0.01 0.00 -1.53 0.00 0.00 36.38 33.98 1jt9 s VAL 61 CO 0.68 -0.07 -0.17 -0.55 -3.33 0.00 0.00 175.10 171.67 1jt9 s SER 62 N -1.72 1.98 -0.12 3.54 0.15 -1.26 -4.53 113.70 111.74 1jt9 s SER 62 Ca -0.07 -0.31 0.16 0.00 0.70 0.00 0.00 55.95 56.43 1jt9 s SER 62 Cb -0.01 -0.22 0.58 0.00 -1.71 0.00 0.00 66.02 64.67 1jt9 s SER 62 CO 0.02 0.20 1.50 0.49 1.20 0.00 0.00 173.24 176.65 1jt9 n PHE 63 N 2.65 1.15 -0.24 3.44 3.72 -1.26 -4.60 117.46 122.31 1jt9 n PHE 63 Ca -0.15 -0.68 0.10 0.00 -0.05 0.00 0.00 57.45 56.67 1jt9 n PHE 63 Cb 0.54 -0.24 0.37 0.00 -0.94 0.00 0.00 39.48 39.21 1jt9 n PHE 63 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 1jt9 h LYS 64 N 2.92 0.70 -0.47 -1.08 3.64 -1.96 -2.41 116.57 117.93 1jt9 h LYS 64 Ca 0.00 -0.04 -0.34 0.00 -1.27 0.00 0.00 60.65 59.00 1jt9 h LYS 64 Cb 1.34 -0.16 -0.27 0.00 -0.41 0.00 0.00 32.23 32.73 1jt9 h LYS 64 CO 0.20 0.47 -0.70 0.72 -2.27 0.00 0.00 179.45 177.86 1jt9 n HIS 65 N -4.52 1.71 -4.53 1.91 8.25 -1.26 -4.62 115.22 112.16 1jt9 n HIS 65 Ca 0.15 -1.94 -0.33 0.00 -0.26 0.00 0.00 57.72 55.33 1jt9 n HIS 65 Cb 0.38 -0.30 -0.13 0.00 1.12 0.00 0.00 29.99 31.05 1jt9 n HIS 65 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1jt9 s VAL 66 N -4.07 3.64 -0.13 1.59 1.01 -0.91 -1.83 120.40 119.70 1jt9 s VAL 66 Ca 0.46 -0.45 -0.03 0.00 0.00 0.00 0.00 61.98 61.96 1jt9 s VAL 66 Cb 0.39 -2.57 -0.03 0.00 0.00 0.00 0.00 36.38 34.17 1jt9 s VAL 66 CO -0.00 0.51 -0.04 -0.69 0.00 0.00 0.00 175.10 174.88 1jt9 s VAL 67 N 0.29 3.90 0.13 2.92 1.01 -0.18 -4.83 120.40 123.64 1jt9 s VAL 67 Ca -0.05 -0.37 0.09 0.00 0.00 0.00 0.00 61.98 61.65 1jt9 s VAL 67 Cb -0.15 -2.68 -0.04 0.00 0.00 0.00 0.00 36.38 33.51 1jt9 s VAL 67 CO 0.04 0.53 -0.16 0.42 0.00 0.00 0.00 175.10 175.92 1jt9 s THR 68 N 0.01 2.92 -0.08 3.92 -4.23 -0.26 0.12 115.64 118.04 1jt9 s THR 68 Ca 0.01 -1.54 -0.00 0.00 -1.18 0.00 0.00 61.69 58.98 1jt9 s THR 68 Cb -0.13 -2.36 0.02 0.00 1.34 0.00 0.00 72.50 71.37 1jt9 s THR 68 CO 0.03 0.05 -0.05 -0.36 -0.54 0.00 0.00 174.62 173.75 1jt9 s PHE 69 N -1.27 1.06 0.27 3.99 0.40 -0.35 -1.62 117.98 120.46 1jt9 s PHE 69 Ca 0.20 -0.42 -0.05 0.00 -0.60 0.00 0.00 56.93 56.06 1jt9 s PHE 69 Cb -0.10 -0.95 -0.05 0.00 0.51 0.00 0.00 43.02 42.42 1jt9 s PHE 69 CO 0.11 -0.36 0.53 -0.80 0.70 0.00 0.00 175.22 175.40 1jt9 s ASN 70 N 1.51 6.46 0.19 1.36 -0.87 -0.78 -0.50 114.94 122.32 1jt9 s ASN 70 Ca -0.01 0.70 -0.06 0.00 -1.57 0.00 0.00 52.86 51.92 1jt9 s ASN 70 Cb -0.13 -2.14 0.10 0.00 -0.02 0.00 0.00 41.25 39.06 1jt9 s ASN 70 CO -0.04 -0.16 1.57 0.24 -2.57 0.00 0.00 177.10 176.14 1jt9 h MET 71 N 1.85 0.83 0.00 -0.60 2.86 -1.60 -3.44 114.93 114.83 1jt9 h MET 71 Ca -0.47 -0.37 -0.13 0.00 -2.06 0.00 0.00 59.70 56.67 1jt9 h MET 71 Cb 1.19 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.81 1jt9 h MET 71 CO 0.67 1.00 0.12 -0.40 1.06 0.00 0.00 176.91 179.36 1jt9 n ASP 72 N -4.09 -1.98 -3.55 1.22 5.68 -1.26 -0.84 116.55 111.74 1jt9 n ASP 72 Ca -0.01 -2.74 -0.13 0.00 -0.50 0.00 0.00 54.79 51.41 1jt9 n ASP 72 Cb 0.48 3.40 -0.05 0.00 -1.14 0.00 0.00 41.12 43.80 1jt9 n ASP 72 CO 0.00 0.00 0.00 -0.70 -1.33 0.00 0.00 177.20 175.17 1jt9 s GLU 73 N -2.37 0.80 0.40 0.11 2.56 -0.86 -4.68 118.70 114.66 1jt9 s GLU 73 Ca 0.21 0.14 -0.23 0.00 0.00 0.00 0.00 54.97 55.09 1jt9 s GLU 73 Cb -0.03 0.38 -0.10 0.00 2.00 0.00 0.00 34.13 36.38 1jt9 s GLU 73 CO 0.16 -0.26 0.99 0.71 -0.56 0.00 0.00 175.26 176.29 1jt9 s TYR 74 N -1.35 3.37 0.08 5.30 2.02 -1.26 -0.61 117.35 124.90 1jt9 s TYR 74 Ca -0.05 1.67 -0.19 0.00 -0.37 0.00 0.00 57.07 58.13 1jt9 s TYR 74 Cb -0.00 -2.98 -0.07 0.00 -0.40 0.00 0.00 41.96 38.51 1jt9 s TYR 74 CO 0.04 -0.25 0.57 0.08 -1.57 0.00 0.00 175.55 174.42 1jt9 s VAL 75 N -1.84 4.74 0.00 0.71 1.01 -0.55 -4.10 120.40 120.37 1jt9 s VAL 75 Ca 0.58 1.20 0.00 0.00 0.00 0.00 0.00 61.98 63.76 1jt9 s VAL 75 Cb -0.16 -3.89 0.00 0.00 0.00 0.00 0.00 36.38 32.32 1jt9 s VAL 75 CO 0.21 0.54 0.00 0.61 0.00 0.00 0.00 175.10 176.46 1jt9 n GLY 76 N 1.66 0.41 3.71 4.51 0.00 0.13 -4.71 105.19 110.90 1jt9 n GLY 76 Ca -0.10 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.54 1jt9 n GLY 76 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1jt9 s LEU 77 N 0.00 4.25 -0.01 0.99 1.98 -1.26 -5.01 118.68 119.62 1jt9 s LEU 77 Ca 0.00 0.82 -0.35 0.00 -2.89 0.00 0.00 54.13 51.71 1jt9 s LEU 77 Cb 0.00 -2.74 -0.13 0.00 0.66 0.00 0.00 46.19 43.98 1jt9 s LEU 77 CO 0.00 -0.06 1.74 -2.65 -1.89 0.00 0.00 176.35 173.50 1jt9 n PRO 78 N 3.97 2.05 -0.32 0.98 -0.02 -1.26 -4.78 135.00 135.63 1jt9 n PRO 78 Ca -0.06 0.75 0.18 0.00 -2.02 0.00 0.00 63.50 62.35 1jt9 n PRO 78 Cb 0.51 -2.55 0.36 0.00 -0.02 0.00 0.00 33.50 31.81 1jt9 n PRO 78 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1jt9 h LYS 79 N 7.76 0.17 -0.01 -0.52 3.64 -1.97 0.38 116.57 126.02 1jt9 h LYS 79 Ca -0.47 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 1jt9 h LYS 79 Cb 1.27 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.05 1jt9 h LYS 79 CO 0.92 0.11 0.00 0.39 -2.27 0.00 0.00 179.45 178.60 1jt9 n GLU 80 N -5.23 1.14 -1.79 1.90 4.71 -1.26 -4.22 120.64 115.89 1jt9 n GLU 80 Ca 0.26 -0.20 -0.41 0.00 -0.01 0.00 0.00 57.16 56.80 1jt9 n GLU 80 Cb 0.83 -1.46 0.00 0.00 -1.01 0.00 0.00 31.44 29.80 1jt9 n GLU 80 CO 0.00 0.00 0.00 -1.58 0.09 0.00 0.00 177.13 175.64 1jt9 s HIS 81 N -1.99 2.54 0.39 -0.32 2.46 0.13 -4.87 115.29 113.64 1jt9 s HIS 81 Ca 0.43 1.17 0.38 0.00 0.47 0.00 0.00 55.06 57.51 1jt9 s HIS 81 Cb 0.20 -4.03 2.04 0.00 -0.13 0.00 0.00 32.58 30.67 1jt9 s HIS 81 CO 0.34 -3.05 2.16 -1.00 -2.47 0.00 0.00 174.74 170.72 1jt9 h PRO 82 N 2.89 0.00 -0.21 2.88 0.13 -1.88 -2.57 132.00 133.23 1jt9 h PRO 82 Ca -0.51 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 1jt9 h PRO 82 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1jt9 h PRO 82 CO 0.64 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.80 1jt9 n GLU 83 N -2.84 2.38 -1.53 0.86 -0.58 -1.26 -4.60 120.64 113.07 1jt9 n GLU 83 Ca -0.02 -2.09 -0.30 0.00 -0.42 0.00 0.00 57.16 54.32 1jt9 n GLU 83 Cb 0.07 -1.48 0.08 0.00 -0.57 0.00 0.00 31.44 29.53 1jt9 n GLU 83 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 1jt9 s SER 84 N -1.71 4.81 0.25 1.62 1.04 -0.97 -4.92 113.70 113.82 1jt9 s SER 84 Ca 0.33 1.47 0.03 0.00 0.48 0.00 0.00 55.95 58.26 1jt9 s SER 84 Cb 0.21 -2.26 0.30 0.00 0.10 0.00 0.00 66.02 64.37 1jt9 s SER 84 CO 0.30 -1.79 1.61 1.88 0.98 0.00 0.00 173.24 176.22 1jt9 h TYR 85 N -0.96 0.42 0.03 5.02 0.05 -1.90 -2.28 116.97 117.34 1jt9 h TYR 85 Ca -0.46 -0.13 0.01 0.00 0.05 0.00 0.00 58.73 58.21 1jt9 h TYR 85 Cb 1.24 -0.09 -0.02 0.00 1.01 0.00 0.00 36.73 38.88 1jt9 h TYR 85 CO 0.53 0.77 -0.11 -0.92 -1.05 0.00 0.00 178.16 177.38 1jt9 h TYR 86 N 0.28 -0.27 -0.77 4.88 3.20 -1.90 0.04 116.97 122.42 1jt9 h TYR 86 Ca 0.01 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.87 1jt9 h TYR 86 Cb 0.96 0.12 -0.04 0.00 1.54 0.00 0.00 36.73 39.31 1jt9 h TYR 86 CO 0.02 -0.16 0.38 0.77 -1.64 0.00 0.00 178.16 177.53 1jt9 h SER 87 N -0.20 1.00 -0.13 -2.11 0.02 -1.69 -1.92 113.55 108.53 1jt9 h SER 87 Ca 0.03 -0.13 -0.00 0.00 -0.84 0.00 0.00 61.79 60.85 1jt9 h SER 87 Cb 0.23 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.51 1jt9 h SER 87 CO -0.09 0.85 0.07 0.15 -1.14 0.00 0.00 176.83 176.67 1jt9 h PHE 88 N 1.08 0.17 -0.75 3.45 3.04 -1.13 -1.16 116.94 121.65 1jt9 h PHE 88 Ca 0.27 -0.00 -0.04 0.00 3.98 0.00 0.00 57.97 62.18 1jt9 h PHE 88 Cb 0.10 -0.06 -0.03 0.00 2.56 0.00 0.00 35.95 38.53 1jt9 h PHE 88 CO 0.01 0.17 0.32 0.52 -2.02 0.00 0.00 178.31 177.31 1jt9 h MET 89 N 0.13 1.10 -0.09 1.11 2.86 -0.69 -0.89 114.93 118.46 1jt9 h MET 89 Ca 0.05 -0.19 -0.03 0.00 -2.06 0.00 0.00 59.70 57.46 1jt9 h MET 89 Cb 0.05 -0.19 -0.00 0.00 0.06 0.00 0.00 31.60 31.52 1jt9 h MET 89 CO -0.01 0.89 -0.07 0.45 1.06 0.00 0.00 176.91 179.23 1jt9 h HIS 90 N 1.07 0.25 -0.88 -0.22 3.86 -1.32 -0.43 115.15 117.48 1jt9 h HIS 90 Ca 0.25 -0.07 0.03 0.00 -1.16 0.00 0.00 60.37 59.42 1jt9 h HIS 90 Cb 0.18 -0.05 -0.05 0.00 1.06 0.00 0.00 27.41 28.55 1jt9 h HIS 90 CO 0.01 0.62 0.58 -0.09 0.86 0.00 0.00 177.93 179.91 1jt9 h ARG 91 N -0.19 1.10 0.00 2.45 2.43 -1.12 0.17 114.38 119.23 1jt9 h ARG 91 Ca 0.02 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 1jt9 h ARG 91 Cb 0.57 -0.25 0.00 0.00 -0.42 0.00 0.00 29.97 29.87 1jt9 h ARG 91 CO 0.02 0.73 -1.13 0.09 -1.51 0.00 0.00 179.97 178.17 1jt9 n ASN 92 N -4.43 0.66 0.09 -3.80 3.02 -0.35 -4.81 115.26 105.66 1jt9 n ASN 92 Ca 0.11 -0.50 0.00 0.00 -0.03 0.00 0.00 54.58 54.16 1jt9 n ASN 92 Cb 0.07 1.02 0.00 0.00 -0.61 0.00 0.00 39.78 40.27 1jt9 n ASN 92 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1jt9 n PHE 93 N -1.78 -1.92 -0.24 3.10 7.35 -0.29 -4.64 117.46 119.03 1jt9 n PHE 93 Ca 0.02 0.39 0.08 0.00 -0.76 0.00 0.00 57.45 57.18 1jt9 n PHE 93 Cb 0.41 0.95 0.34 0.00 0.35 0.00 0.00 39.48 41.52 1jt9 n PHE 93 CO 0.00 0.00 0.00 0.74 -0.76 0.00 0.00 176.76 176.74 1jt9 h PHE 94 N 0.00 0.85 0.00 -5.13 0.04 -1.18 -1.36 116.94 110.16 1jt9 h PHE 94 Ca 0.00 0.02 -0.00 0.00 2.80 0.00 0.00 57.97 60.79 1jt9 h PHE 94 Cb 0.00 -0.27 -0.00 0.00 2.20 0.00 0.00 35.95 37.87 1jt9 h PHE 94 CO 0.00 0.40 -0.01 -0.44 -0.60 0.00 0.00 178.31 177.66 1jt9 h ASP 95 N 0.79 0.00 -0.03 2.17 3.32 -0.89 -3.05 116.42 118.72 1jt9 h ASP 95 Ca 0.38 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.43 1jt9 h ASP 95 Cb 0.43 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.98 1jt9 h ASP 95 CO -0.15 0.01 0.00 1.41 -1.72 0.00 0.00 179.24 178.79 1jt9 n HIS 96 N -3.24 0.02 -4.49 4.55 8.25 -0.52 -5.03 115.22 114.76 1jt9 n HIS 96 Ca -0.02 -0.02 -0.24 0.00 -0.26 0.00 0.00 57.72 57.18 1jt9 n HIS 96 Cb 0.12 -0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.13 1jt9 n HIS 96 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 1jt9 s VAL 97 N -1.23 1.02 -0.35 1.59 -7.23 -1.15 -4.89 120.40 108.16 1jt9 s VAL 97 Ca 0.18 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.35 1jt9 s VAL 97 Cb 0.12 -2.62 0.31 0.00 0.56 0.00 0.00 36.38 34.76 1jt9 s VAL 97 CO 0.19 0.00 1.85 -0.90 -0.31 0.00 0.00 175.10 175.92 1jt9 n ASP 98 N -0.92 5.54 -4.76 4.85 5.75 -1.26 -4.95 116.55 120.80 1jt9 n ASP 98 Ca -0.05 -3.13 -0.40 0.00 -0.01 0.00 0.00 54.79 51.21 1jt9 n ASP 98 Cb 0.66 -0.92 -0.05 0.00 -1.03 0.00 0.00 41.12 39.78 1jt9 n ASP 98 CO 0.00 0.00 0.00 -0.51 -0.11 0.00 0.00 177.20 176.58 1jt9 s ILE 99 N -2.52 4.66 0.37 2.12 2.07 -1.26 -3.56 121.20 123.08 1jt9 s ILE 99 Ca 0.37 1.57 -0.21 0.00 -1.41 0.00 0.00 60.65 60.97 1jt9 s ILE 99 Cb 0.29 -4.08 -0.10 0.00 0.13 0.00 0.00 42.46 38.70 1jt9 s ILE 99 CO 0.02 0.42 0.89 -2.16 -1.91 0.00 0.00 174.94 172.20 1jt9 s PRO 100 N -0.42 4.27 0.35 3.50 0.04 -1.26 -4.96 135.00 136.52 1jt9 s PRO 100 Ca 0.36 1.06 0.10 0.00 0.04 0.00 0.00 61.00 62.56 1jt9 s PRO 100 Cb -0.21 -2.44 0.85 0.00 0.04 0.00 0.00 34.50 32.74 1jt9 s PRO 100 CO 0.23 0.12 1.82 0.00 0.04 0.00 0.00 177.00 179.21 1jt9 h ALA 101 N 2.41 1.86 0.00 8.56 0.00 -1.96 0.38 119.26 130.50 1jt9 h ALA 101 Ca -0.48 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1jt9 h ALA 101 Cb 1.18 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1jt9 h ALA 101 CO 0.63 -0.17 0.00 -0.85 0.00 0.00 0.00 179.25 178.86 1jt9 n GLU 102 N -4.63 0.19 0.00 0.00 0.28 -1.26 -2.04 120.64 113.18 1jt9 n GLU 102 Ca 0.21 0.46 0.13 0.00 -0.16 0.00 0.00 57.16 57.80 1jt9 n GLU 102 Cb 0.58 -1.89 0.35 0.00 1.43 0.00 0.00 31.44 31.91 1jt9 n GLU 102 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 1jt9 n ASN 103 N -2.25 1.30 -4.70 -1.84 4.13 0.12 -4.87 115.26 107.15 1jt9 n ASN 103 Ca 0.01 -1.12 -0.37 0.00 1.68 0.00 0.00 54.58 54.79 1jt9 n ASN 103 Cb 0.20 0.14 -0.08 0.00 -1.54 0.00 0.00 39.78 38.50 1jt9 n ASN 103 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1jt9 s ILE 104 N -2.38 5.32 -0.16 2.41 1.01 -0.87 -1.11 121.20 125.42 1jt9 s ILE 104 Ca 0.26 0.41 0.01 0.00 0.00 0.00 0.00 60.65 61.33 1jt9 s ILE 104 Cb 0.19 -3.58 0.02 0.00 0.01 0.00 0.00 42.46 39.10 1jt9 s ILE 104 CO 0.48 0.36 -0.15 0.20 0.00 0.00 0.00 174.94 175.83 1jt9 s ASN 105 N 0.75 2.85 0.00 3.58 0.01 -0.64 -4.97 114.94 116.52 1jt9 s ASN 105 Ca 0.13 -0.56 0.03 0.00 -0.71 0.00 0.00 52.86 51.74 1jt9 s ASN 105 Cb -0.13 -1.25 -0.01 0.00 0.41 0.00 0.00 41.25 40.27 1jt9 s ASN 105 CO 0.04 -0.05 -0.09 -0.76 -1.51 0.00 0.00 177.10 174.73 1jt9 s LEU 106 N 1.44 2.05 0.28 0.60 1.43 -1.26 -1.86 118.68 121.35 1jt9 s LEU 106 Ca 0.04 -0.21 -0.29 0.00 -1.03 0.00 0.00 54.13 52.64 1jt9 s LEU 106 Cb -0.13 -0.41 -0.10 0.00 0.03 0.00 0.00 46.19 45.58 1jt9 s LEU 106 CO -0.11 0.07 1.34 -0.76 0.23 0.00 0.00 176.35 177.12 1jt9 s LEU 107 N -0.39 4.42 -0.71 1.79 1.43 -1.26 -4.95 118.68 119.01 1jt9 s LEU 107 Ca 0.02 2.61 -0.20 0.00 -1.03 0.00 0.00 54.13 55.53 1jt9 s LEU 107 Cb -0.04 -3.63 0.10 0.00 0.03 0.00 0.00 46.19 42.64 1jt9 s LEU 107 CO -0.00 -0.57 0.92 0.21 0.23 0.00 0.00 176.35 177.15 1jt9 s ASN 108 N -0.10 6.30 0.00 2.29 2.47 -1.26 -4.76 114.94 119.88 1jt9 s ASN 108 Ca 0.53 -1.41 0.11 0.00 0.42 0.00 0.00 52.86 52.51 1jt9 s ASN 108 Cb -0.39 -2.38 0.63 0.00 -1.45 0.00 0.00 41.25 37.66 1jt9 s ASN 108 CO 0.47 -1.24 1.14 0.61 -3.72 0.00 0.00 177.10 174.36 1jt9 n GLY 109 N 5.32 -0.42 0.40 1.21 0.00 -1.26 -1.82 105.19 108.62 1jt9 n GLY 109 Ca 0.02 -0.06 0.04 0.00 0.00 0.00 0.00 46.02 46.02 1jt9 n GLY 109 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1jt9 n ASN 110 N -1.08 2.68 -4.77 1.61 3.02 -1.26 0.18 115.26 115.64 1jt9 n ASN 110 Ca 0.07 -2.22 -0.41 0.00 -0.03 0.00 0.00 54.58 52.00 1jt9 n ASN 110 Cb 0.05 -0.21 -0.01 0.00 -0.61 0.00 0.00 39.78 39.00 1jt9 n ASN 110 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1jt9 s ALA 111 N -1.39 3.51 0.20 5.41 0.00 -0.76 -4.92 121.76 123.81 1jt9 s ALA 111 Ca 0.18 1.43 -0.08 0.00 0.00 0.00 0.00 51.96 53.49 1jt9 s ALA 111 Cb 0.12 -3.55 0.12 0.00 0.00 0.00 0.00 23.12 19.81 1jt9 s ALA 111 CO 0.08 -0.90 1.72 -1.00 0.00 0.00 0.00 175.76 175.67 1jt9 h PRO 112 N 3.08 1.15 -3.81 0.00 0.13 -1.95 -3.35 132.00 127.24 1jt9 h PRO 112 Ca -0.50 -0.27 -0.72 0.00 -0.87 0.00 0.00 66.00 63.65 1jt9 h PRO 112 Cb 1.24 -0.16 -0.33 0.00 0.13 0.00 0.00 31.00 31.88 1jt9 h PRO 112 CO 0.64 1.00 -0.31 0.34 -0.23 0.00 0.00 178.00 179.44 1jt9 s ASP 113 N -6.44 5.56 0.15 1.44 -1.08 -1.26 -4.97 116.67 110.07 1jt9 s ASP 113 Ca -0.12 -2.62 -0.25 0.00 -0.52 0.00 0.00 52.55 49.04 1jt9 s ASP 113 Cb 0.15 -1.93 0.02 0.00 -1.46 0.00 0.00 42.92 39.70 1jt9 s ASP 113 CO 0.85 -0.46 1.59 0.40 0.52 0.00 0.00 175.17 178.07 1jt9 h ILE 114 N 5.41 0.21 -0.66 4.11 1.08 -1.97 -0.41 117.51 125.29 1jt9 h ILE 114 Ca -0.03 0.00 0.07 0.00 -0.39 0.00 0.00 64.86 64.50 1jt9 h ILE 114 Cb 0.99 0.21 -0.04 0.00 -3.07 0.00 0.00 36.82 34.91 1jt9 h ILE 114 CO 0.74 0.00 0.43 0.44 -0.69 0.00 0.00 178.15 179.07 1jt9 h ASP 115 N -0.32 0.57 -0.31 1.72 5.19 -1.96 -1.69 116.42 119.63 1jt9 h ASP 115 Ca 0.14 0.00 -0.13 0.00 -0.62 0.00 0.00 57.03 56.42 1jt9 h ASP 115 Cb 0.56 -0.12 -0.00 0.00 0.18 0.00 0.00 39.33 39.94 1jt9 h ASP 115 CO -0.49 0.37 -0.31 0.00 -3.12 0.00 0.00 179.24 175.68 1jt9 h ALA 116 N 1.64 0.45 -0.01 3.45 0.00 -1.71 -1.98 119.26 121.11 1jt9 h ALA 116 Ca 0.29 -0.42 0.02 0.00 0.00 0.00 0.00 54.91 54.80 1jt9 h ALA 116 Cb 0.29 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 1jt9 h ALA 116 CO -0.09 0.49 -0.12 1.49 0.00 0.00 0.00 179.25 181.02 1jt9 h GLU 117 N 0.51 -0.20 -0.78 0.00 4.57 -0.26 0.03 114.58 118.45 1jt9 h GLU 117 Ca 0.05 0.01 -0.01 0.00 -1.18 0.00 0.00 59.36 58.23 1jt9 h GLU 117 Cb 0.89 0.04 -0.04 0.00 -0.16 0.00 0.00 28.75 29.49 1jt9 h GLU 117 CO 0.08 -0.13 0.44 0.00 -1.18 0.00 0.00 179.01 178.21 1jt9 h ARG 119 N 1.08 0.57 -0.23 0.00 2.43 -0.98 -2.51 114.38 114.74 1jt9 h ARG 119 Ca 0.28 -0.04 -0.07 0.00 -0.81 0.00 0.00 59.98 59.34 1jt9 h ARG 119 Cb 0.02 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.43 1jt9 h ARG 119 CO -0.05 0.39 -0.15 1.96 -1.51 0.00 0.00 179.97 180.61 1jt9 h GLN 120 N 0.57 0.38 -0.21 0.20 4.20 -0.65 -1.62 115.11 117.98 1jt9 h GLN 120 Ca 0.15 -0.11 -0.00 0.00 0.06 0.00 0.00 58.65 58.76 1jt9 h GLN 120 Cb -0.05 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.68 1jt9 h GLN 120 CO -0.03 0.53 0.13 -0.92 -0.67 0.00 0.00 178.83 177.87 1jt9 h TYR 121 N 0.36 0.27 -0.70 2.96 3.20 -0.88 0.34 116.97 122.52 1jt9 h TYR 121 Ca 0.07 0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.90 1jt9 h TYR 121 Cb 0.48 -0.09 -0.03 0.00 1.54 0.00 0.00 36.73 38.63 1jt9 h TYR 121 CO 0.01 0.20 0.29 0.93 -1.64 0.00 0.00 178.16 177.96 1jt9 h GLU 122 N 0.26 1.01 -0.19 1.82 4.39 -1.21 -2.37 114.58 118.29 1jt9 h GLU 122 Ca 0.08 -0.16 0.00 0.00 0.34 0.00 0.00 59.36 59.62 1jt9 h GLU 122 Cb 0.01 -0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 28.47 1jt9 h GLU 122 CO -0.01 0.81 0.12 0.93 -1.16 0.00 0.00 179.01 179.70 1jt9 h GLU 123 N 1.00 0.26 -0.69 2.33 3.07 -0.42 -2.35 114.58 117.78 1jt9 h GLU 123 Ca 0.24 -0.02 0.07 0.00 -0.50 0.00 0.00 59.36 59.15 1jt9 h GLU 123 Cb 0.17 -0.06 -0.06 0.00 -0.84 0.00 0.00 28.75 27.96 1jt9 h GLU 123 CO -0.02 0.19 0.37 -0.22 -1.40 0.00 0.00 179.01 177.93 1jt9 h LYS 124 N 0.25 0.65 -0.38 2.33 3.11 0.11 0.26 116.57 122.90 1jt9 h LYS 124 Ca 0.07 -0.04 -0.01 0.00 -2.81 0.00 0.00 60.65 57.86 1jt9 h LYS 124 Cb -0.01 -0.15 -0.02 0.00 -1.00 0.00 0.00 32.23 31.06 1jt9 h LYS 124 CO -0.01 0.43 0.20 0.82 -2.81 0.00 0.00 179.45 178.08 1jt9 h ILE 125 N 0.67 1.15 -0.16 2.00 2.04 -1.19 -2.51 117.51 119.51 1jt9 h ILE 125 Ca 0.32 -0.40 -0.07 0.00 1.00 0.00 0.00 64.86 65.71 1jt9 h ILE 125 Cb 0.24 0.73 -0.01 0.00 -0.74 0.00 0.00 36.82 37.04 1jt9 h ILE 125 CO -0.21 0.16 -0.20 0.03 0.00 0.00 0.00 178.15 177.93 1jt9 h ARG 126 N 0.48 0.27 -0.40 2.37 3.08 -0.88 -0.63 114.38 118.67 1jt9 h ARG 126 Ca 0.13 -0.08 0.02 0.00 0.07 0.00 0.00 59.98 60.12 1jt9 h ARG 126 Cb 0.07 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.07 1jt9 h ARG 126 CO -0.02 0.47 0.26 0.66 -1.07 0.00 0.00 179.97 180.27 1jt9 h SER 127 N 0.25 0.39 1.16 7.04 4.64 -0.52 0.10 113.55 126.61 1jt9 h SER 127 Ca 0.04 -0.01 -0.13 0.00 -0.47 0.00 0.00 61.79 61.23 1jt9 h SER 127 Cb 0.50 -0.09 -0.02 0.00 -0.31 0.00 0.00 62.40 62.48 1jt9 h SER 127 CO 0.03 0.28 -0.88 1.88 -0.87 0.00 0.00 176.83 177.27 1jt9 h TYR 128 N 0.46 0.00 0.00 4.77 0.05 -1.18 -3.49 116.97 117.58 1jt9 h TYR 128 Ca 0.16 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.94 1jt9 h TYR 128 Cb 0.06 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.80 1jt9 h TYR 128 CO -0.00 0.54 0.00 0.41 -1.05 0.00 0.00 178.16 178.06 1jt9 n GLY 129 N 1.30 2.16 3.42 3.88 0.00 0.35 -5.02 105.19 111.27 1jt9 n GLY 129 Ca -0.03 -0.75 -0.14 0.00 0.00 0.00 0.00 46.02 45.11 1jt9 n GLY 129 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jt9 s LYS 130 N 0.00 1.14 -0.13 1.61 -2.85 -1.25 -4.58 119.74 113.68 1jt9 s LYS 130 Ca 0.00 -0.27 -0.26 0.00 -1.00 0.00 0.00 55.97 54.43 1jt9 s LYS 130 Cb 0.00 0.52 -0.02 0.00 -2.06 0.00 0.00 37.83 36.28 1jt9 s LYS 130 CO 0.00 -0.44 0.86 0.42 0.10 0.00 0.00 175.35 176.29 1jt9 s ILE 131 N -2.84 4.88 0.14 3.79 1.01 -1.26 -4.66 121.20 122.26 1jt9 s ILE 131 Ca -0.03 1.73 0.00 0.00 0.00 0.00 0.00 60.65 62.35 1jt9 s ILE 131 Cb -0.00 -4.17 -0.18 0.00 0.01 0.00 0.00 42.46 38.11 1jt9 s ILE 131 CO -0.05 0.07 1.33 0.45 0.00 0.00 0.00 174.94 176.73 1jt9 h HIS 132 N 7.15 0.36 -2.66 3.97 3.86 -1.29 0.68 115.15 127.22 1jt9 h HIS 132 Ca -0.32 -0.21 -0.13 0.00 -1.16 0.00 0.00 60.37 58.54 1jt9 h HIS 132 Cb 1.15 -0.04 -0.28 0.00 1.06 0.00 0.00 27.41 29.30 1jt9 h HIS 132 CO 0.70 1.05 -0.38 -1.17 0.86 0.00 0.00 177.93 178.99 1jt9 s LEU 133 N -7.41 -0.32 -0.23 2.43 2.96 -1.11 -2.72 118.68 112.29 1jt9 s LEU 133 Ca -0.03 0.85 -0.01 0.00 -0.22 0.00 0.00 54.13 54.72 1jt9 s LEU 133 Cb 0.09 1.18 0.02 0.00 0.50 0.00 0.00 46.19 47.99 1jt9 s LEU 133 CO 0.84 -0.22 -0.09 0.12 -1.32 0.00 0.00 176.35 175.69 1jt9 s PHE 134 N 2.07 3.01 -0.11 5.38 2.19 0.05 -0.15 117.98 130.43 1jt9 s PHE 134 Ca -0.04 -1.55 -0.09 0.00 0.33 0.00 0.00 56.93 55.57 1jt9 s PHE 134 Cb -0.11 -2.03 -0.04 0.00 -1.31 0.00 0.00 43.02 39.53 1jt9 s PHE 134 CO -0.12 -0.73 0.20 1.41 1.83 0.00 0.00 175.22 177.81 1jt9 s MET 135 N 1.32 3.67 0.24 10.12 -2.45 -0.31 -1.11 119.30 130.78 1jt9 s MET 135 Ca 0.01 -0.02 -0.03 0.00 -1.25 0.00 0.00 55.69 54.40 1jt9 s MET 135 Cb -0.16 -3.24 0.01 0.00 1.25 0.00 0.00 34.83 32.69 1jt9 s MET 135 CO -0.06 0.67 0.36 0.41 1.05 0.00 0.00 175.02 177.45 1jt9 n GLY 136 N 2.23 2.26 0.00 2.11 0.00 -0.29 -3.50 105.19 107.99 1jt9 n GLY 136 Ca -0.18 -1.48 0.00 0.00 0.00 0.00 0.00 46.02 44.36 1jt9 n GLY 136 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jt9 n GLY 137 N -0.39 4.13 3.03 -0.02 0.00 -1.26 -0.86 105.19 109.82 1jt9 n GLY 137 Ca -0.01 -2.20 -0.12 0.00 0.00 0.00 0.00 46.02 43.69 1jt9 n GLY 137 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jt9 s VAL 138 N -0.81 0.00 0.79 1.61 0.11 -1.26 -4.73 120.40 116.11 1jt9 s VAL 138 Ca 0.00 -0.01 -0.11 0.00 -2.93 0.00 0.00 61.98 58.93 1jt9 s VAL 138 Cb 0.00 -0.22 0.06 0.00 -1.53 0.00 0.00 36.38 34.69 1jt9 s VAL 138 CO 0.00 -0.01 1.09 -0.83 -3.33 0.00 0.00 175.10 172.02 1jt9 s GLY 139 N 0.06 1.64 0.54 6.54 0.00 0.30 -4.88 107.32 111.51 1jt9 s GLY 139 Ca -0.00 -0.05 0.21 0.00 0.00 0.00 0.00 44.72 44.88 1jt9 s GLY 139 CO 0.00 0.35 2.16 3.43 0.00 0.00 0.00 173.10 179.04 1jt9 h ASN 140 N -1.08 0.00 -0.58 1.64 4.21 -1.90 0.68 115.58 118.55 1jt9 h ASN 140 Ca -0.46 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.05 1jt9 h ASN 140 Cb 1.25 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.45 1jt9 h ASN 140 CO 0.57 0.00 0.00 -0.90 -1.29 0.00 0.00 177.43 175.81 1jt9 n ASP 141 N -4.31 4.72 0.00 5.81 3.85 -1.26 -4.25 116.55 121.11 1jt9 n ASP 141 Ca -0.02 -2.55 0.00 0.00 -0.71 0.00 0.00 54.79 51.51 1jt9 n ASP 141 Cb 0.15 -0.59 0.00 0.00 -1.35 0.00 0.00 41.12 39.32 1jt9 n ASP 141 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1jt9 n GLY 142 N 0.92 0.93 3.80 6.12 0.00 0.23 -4.58 105.19 112.60 1jt9 n GLY 142 Ca 0.24 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.96 1jt9 n GLY 142 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1jt9 s HIS 143 N -3.70 2.77 -0.08 1.61 -3.43 -1.26 -1.25 115.29 109.95 1jt9 s HIS 143 Ca 0.00 1.14 0.04 0.00 -0.80 0.00 0.00 55.06 55.44 1jt9 s HIS 143 Cb 0.00 -3.14 -0.01 0.00 -1.43 0.00 0.00 32.58 28.00 1jt9 s HIS 143 CO 0.00 -1.85 -0.21 0.42 -2.00 0.00 0.00 174.74 171.10 1jt9 s ILE 144 N -3.15 2.39 0.00 -5.38 -1.09 -1.26 -0.54 121.20 112.17 1jt9 s ILE 144 Ca 0.61 -0.93 0.00 0.00 -2.23 0.00 0.00 60.65 58.10 1jt9 s ILE 144 Cb -0.15 -1.92 0.00 0.00 -1.58 0.00 0.00 42.46 38.82 1jt9 s ILE 144 CO 0.54 0.56 0.00 0.00 -1.23 0.00 0.00 174.94 174.81 1jt9 n ALA 145 N 3.11 0.00 -0.60 9.38 0.00 -1.26 -0.78 120.51 130.36 1jt9 n ALA 145 Ca -0.18 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.36 1jt9 n ALA 145 Cb 0.52 0.00 0.35 0.00 0.00 0.00 0.00 19.45 20.33 1jt9 n ALA 145 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1jt9 n PHE 146 N 14.00 1.42 -2.39 0.00 3.72 -1.26 -4.96 117.46 127.99 1jt9 n PHE 146 Ca 0.00 -0.60 -0.41 0.00 -0.05 0.00 0.00 57.45 56.39 1jt9 n PHE 146 Cb 0.00 -0.22 -0.04 0.00 -0.94 0.00 0.00 39.48 38.28 1jt9 n PHE 146 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 1jt9 s ASN 147 N -0.94 7.14 0.64 4.37 0.01 0.04 -4.98 114.94 121.22 1jt9 s ASN 147 Ca 0.51 2.32 -0.12 0.00 -0.71 0.00 0.00 52.86 54.86 1jt9 s ASN 147 Cb 0.32 -2.62 -0.02 0.00 0.41 0.00 0.00 41.25 39.33 1jt9 s ASN 147 CO 0.25 -0.27 1.04 -1.83 -1.51 0.00 0.00 177.10 174.78 1jt9 s GLU 148 N -1.09 3.36 0.63 -0.60 1.03 -1.26 -4.18 118.70 116.59 1jt9 s GLU 148 Ca 0.48 0.87 -0.17 0.00 0.03 0.00 0.00 54.97 56.18 1jt9 s GLU 148 Cb -0.33 -2.05 -0.01 0.00 -0.80 0.00 0.00 34.13 30.94 1jt9 s GLU 148 CO 0.41 -0.76 1.19 -2.14 -1.33 0.00 0.00 175.26 172.63 1jt9 s PRO 149 N -4.97 2.78 -1.01 -4.83 0.02 -1.26 -1.93 135.00 123.80 1jt9 s PRO 149 Ca 0.57 1.74 0.00 0.00 0.02 0.00 0.00 61.00 63.33 1jt9 s PRO 149 Cb -0.12 -1.91 0.00 0.00 0.02 0.00 0.00 34.50 32.48 1jt9 s PRO 149 CO 0.52 -1.34 0.00 0.00 -0.33 0.00 0.00 177.00 175.85 1jt9 n ALA 150 N -1.95 -0.14 -1.63 -1.55 0.00 -0.01 -4.98 120.51 110.25 1jt9 n ALA 150 Ca 0.13 0.15 -0.34 0.00 0.00 0.00 0.00 53.44 53.38 1jt9 n ALA 150 Cb 0.50 -1.22 0.03 0.00 0.00 0.00 0.00 19.45 18.76 1jt9 n ALA 150 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1jt9 s SER 151 N -2.86 5.37 0.41 0.00 0.01 -0.81 -4.97 113.70 110.85 1jt9 s SER 151 Ca 0.00 2.09 -0.25 0.00 1.31 0.00 0.00 55.95 59.09 1jt9 s SER 151 Cb 0.00 -2.57 -0.08 0.00 0.21 0.00 0.00 66.02 63.58 1jt9 s SER 151 CO 0.00 -1.46 1.25 -0.55 0.41 0.00 0.00 173.24 172.89 1jt9 s SER 152 N -2.21 6.32 0.00 2.44 0.15 -1.26 -4.88 113.70 114.25 1jt9 s SER 152 Ca 0.70 2.54 0.19 0.00 0.70 0.00 0.00 55.95 60.07 1jt9 s SER 152 Cb -0.22 -2.63 0.90 0.00 -1.71 0.00 0.00 66.02 62.36 1jt9 s SER 152 CO 0.35 -0.83 1.59 0.18 1.20 0.00 0.00 173.24 175.73 1jt9 n LEU 153 N 0.02 0.00 -0.67 3.45 4.32 -1.26 -2.15 117.00 120.70 1jt9 n LEU 153 Ca 0.04 0.38 0.06 0.00 -0.02 0.00 0.00 56.01 56.47 1jt9 n LEU 153 Cb 0.45 -0.38 0.17 0.00 -1.62 0.00 0.00 43.42 42.05 1jt9 n LEU 153 CO 0.53 -0.14 0.64 0.00 -1.22 0.00 0.00 177.39 177.21 1jt9 n ALA 154 N -1.38 2.38 -1.49 -1.18 0.00 -1.26 -2.43 120.51 115.16 1jt9 n ALA 154 Ca 0.07 -1.46 -0.36 0.00 0.00 0.00 0.00 53.44 51.70 1jt9 n ALA 154 Cb 0.18 -0.49 0.09 0.00 0.00 0.00 0.00 19.45 19.23 1jt9 n ALA 154 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1jt9 n SER 155 N 0.18 1.46 -4.59 0.00 3.41 -0.92 -4.47 113.62 108.69 1jt9 n SER 155 Ca 0.14 0.73 -0.30 0.00 -0.26 0.00 0.00 58.87 59.18 1jt9 n SER 155 Cb 0.54 -1.51 -0.09 0.00 -0.26 0.00 0.00 64.21 62.90 1jt9 n SER 155 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1jt9 s ARG 156 N -3.53 2.07 0.19 4.33 1.81 -1.26 -0.87 118.95 121.68 1jt9 s ARG 156 Ca 0.78 -2.28 -0.33 0.00 -1.72 0.00 0.00 55.73 52.19 1jt9 s ARG 156 Cb -0.35 -1.33 -0.14 0.00 -0.45 0.00 0.00 34.95 32.68 1jt9 s ARG 156 CO 0.45 -0.32 1.48 2.41 -0.68 0.00 0.00 175.30 178.64 1jt9 n THR 157 N -1.11 0.43 -3.81 0.02 -1.04 -1.26 -3.59 114.28 103.92 1jt9 n THR 157 Ca -0.13 -0.11 -0.05 0.00 -2.04 0.00 0.00 64.05 61.73 1jt9 n THR 157 Cb 0.67 -1.45 -0.00 0.00 -1.82 0.00 0.00 70.33 67.73 1jt9 n THR 157 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1jt9 s ARG 158 N 0.29 1.48 0.25 -2.82 1.70 -0.67 -4.72 118.95 114.44 1jt9 s ARG 158 Ca 0.74 -0.87 -0.16 0.00 -0.47 0.00 0.00 55.73 54.97 1jt9 s ARG 158 Cb -0.69 0.47 -0.08 0.00 -0.57 0.00 0.00 34.95 34.08 1jt9 s ARG 158 CO 0.44 -0.68 0.68 -1.50 -1.08 0.00 0.00 175.30 173.15 1jt9 s ILE 159 N -3.01 4.70 0.02 4.99 2.07 -1.26 -1.16 121.20 127.55 1jt9 s ILE 159 Ca 0.15 0.98 0.02 0.00 -1.41 0.00 0.00 60.65 60.39 1jt9 s ILE 159 Cb -0.03 -3.72 -0.01 0.00 0.13 0.00 0.00 42.46 38.83 1jt9 s ILE 159 CO 0.05 0.03 -0.05 -0.54 -1.91 0.00 0.00 174.94 172.52 1jt9 s LYS 160 N -2.45 0.41 -0.25 3.50 -0.14 0.89 -4.94 119.74 116.75 1jt9 s LYS 160 Ca 0.47 -0.44 -0.21 0.00 -1.36 0.00 0.00 55.97 54.43 1jt9 s LYS 160 Cb -0.13 -0.27 -0.02 0.00 -1.68 0.00 0.00 37.83 35.73 1jt9 s LYS 160 CO 0.19 0.06 0.65 0.99 -0.76 0.00 0.00 175.35 176.48 1jt9 s THR 161 N -0.74 4.98 0.00 2.17 2.01 -1.26 -1.61 115.64 121.18 1jt9 s THR 161 Ca -0.05 1.18 0.00 0.00 0.31 0.00 0.00 61.69 63.13 1jt9 s THR 161 Cb -0.06 -3.95 0.00 0.00 0.01 0.00 0.00 72.50 68.50 1jt9 s THR 161 CO -0.00 0.03 0.00 0.18 -0.69 0.00 0.00 174.62 174.14 1jt9 n LEU 162 N 5.65 0.00 -0.05 4.42 4.77 -1.26 -5.01 117.00 125.53 1jt9 n LEU 162 Ca -0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1jt9 n LEU 162 Cb 0.49 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 1jt9 n LEU 162 CO 0.43 0.00 0.00 -2.65 -1.33 0.00 0.00 177.39 173.84 1jt9 n PRO 182 N 0.00 0.00 -0.10 3.23 -0.02 -1.26 -5.02 135.00 131.83 1jt9 n PRO 182 Ca 0.00 0.00 -0.11 0.00 -2.02 0.00 0.00 63.50 61.37 1jt9 n PRO 182 Cb 0.00 -0.05 -0.14 0.00 -0.02 0.00 0.00 33.50 33.29 1jt9 n PRO 182 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1jt9 n LYS 183 N -0.20 0.83 -4.44 -0.52 3.00 -1.26 -5.03 118.16 110.53 1jt9 n LYS 183 Ca 0.00 0.03 -0.21 0.00 -0.00 0.00 0.00 58.31 58.12 1jt9 n LYS 183 Cb 0.06 -1.49 -0.11 0.00 0.00 0.00 0.00 35.03 33.50 1jt9 n LYS 183 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.40 178.11 1jt9 s TYR 184 N -2.46 1.96 0.02 5.64 1.51 -1.26 -4.65 117.35 118.11 1jt9 s TYR 184 Ca -0.15 -0.85 -0.13 0.00 -1.01 0.00 0.00 57.07 54.93 1jt9 s TYR 184 Cb 0.06 -1.23 0.02 0.00 -0.11 0.00 0.00 41.96 40.70 1jt9 s TYR 184 CO 0.72 0.12 0.27 0.00 -1.11 0.00 0.00 175.55 175.55 1jt9 s ALA 185 N -3.18 -0.63 -0.17 3.71 0.00 -0.64 -1.48 121.76 119.37 1jt9 s ALA 185 Ca 0.33 0.05 -0.09 0.00 0.00 0.00 0.00 51.96 52.25 1jt9 s ALA 185 Cb 0.07 0.22 -0.05 0.00 0.00 0.00 0.00 23.12 23.36 1jt9 s ALA 185 CO 0.14 -0.34 0.13 -0.51 0.00 0.00 0.00 175.76 175.18 1jt9 s LEU 186 N -1.78 4.25 -0.00 0.00 1.02 0.22 -0.08 118.68 122.30 1jt9 s LEU 186 Ca -0.08 0.31 -0.01 0.00 0.02 0.00 0.00 54.13 54.36 1jt9 s LEU 186 Cb -0.03 -2.07 -0.00 0.00 0.02 0.00 0.00 46.19 44.11 1jt9 s LEU 186 CO -0.01 0.26 0.03 0.28 0.02 0.00 0.00 176.35 176.94 1jt9 s THR 187 N -0.15 0.03 0.74 5.49 -1.32 -0.31 -2.03 115.64 118.08 1jt9 s THR 187 Ca 0.10 -0.24 -0.13 0.00 -1.21 0.00 0.00 61.69 60.21 1jt9 s THR 187 Cb -0.11 -0.13 0.04 0.00 -1.51 0.00 0.00 72.50 70.79 1jt9 s THR 187 CO 0.00 -0.13 1.13 0.68 -2.21 0.00 0.00 174.62 174.09 1jt9 s VAL 188 N -0.39 2.92 0.67 5.08 -7.23 -0.02 -1.68 120.40 119.76 1jt9 s VAL 188 Ca -0.04 0.38 -0.01 0.00 -1.81 0.00 0.00 61.98 60.50 1jt9 s VAL 188 Cb -0.03 -2.84 0.10 0.00 0.56 0.00 0.00 36.38 34.17 1jt9 s VAL 188 CO -0.00 -0.32 0.94 -0.83 -0.31 0.00 0.00 175.10 174.58 1jt9 s GLY 189 N -2.71 1.77 0.27 2.32 0.00 -1.24 -4.73 107.32 103.02 1jt9 s GLY 189 Ca 0.67 -1.54 -0.00 0.00 0.00 0.00 0.00 44.72 43.85 1jt9 s GLY 189 CO 0.48 -1.06 1.75 -2.08 0.00 0.00 0.00 173.10 172.19 1jt9 h VAL 190 N -0.38 1.24 -0.67 1.40 2.07 -1.78 -2.21 116.25 115.93 1jt9 h VAL 190 Ca -0.39 -1.06 -0.08 0.00 0.82 0.00 0.00 66.70 65.99 1jt9 h VAL 190 Cb 1.28 1.03 -0.03 0.00 -1.52 0.00 0.00 31.29 32.05 1jt9 h VAL 190 CO 0.45 0.36 0.09 1.23 0.02 0.00 0.00 177.57 179.73 1jt9 h GLY 191 N 0.96 1.20 0.64 2.17 0.00 -0.66 0.97 103.07 108.36 1jt9 h GLY 191 Ca 0.11 -0.81 0.05 0.00 0.00 0.00 0.00 47.33 46.69 1jt9 h GLY 191 CO 0.03 0.75 0.22 -0.84 0.00 0.00 0.00 176.54 176.70 1jt9 h THR 192 N 1.04 0.90 -0.09 4.70 2.02 -1.45 -0.39 112.91 119.63 1jt9 h THR 192 Ca 0.20 -0.15 -0.02 0.00 0.77 0.00 0.00 66.41 67.21 1jt9 h THR 192 Cb 0.46 0.43 -0.00 0.00 -1.74 0.00 0.00 68.15 67.30 1jt9 h THR 192 CO 0.02 0.08 -0.01 0.25 0.37 0.00 0.00 175.52 176.22 1jt9 h LEU 193 N 0.43 0.17 -2.04 2.58 7.12 -1.02 -3.16 115.31 119.39 1jt9 h LEU 193 Ca 0.23 -0.34 -0.02 0.00 0.13 0.00 0.00 57.88 57.88 1jt9 h LEU 193 Cb 0.19 -0.05 -0.00 0.00 -0.53 0.00 0.00 40.66 40.27 1jt9 h LEU 193 CO -0.19 0.48 -0.08 -0.07 -0.13 0.00 0.00 178.44 178.44 1jt9 h LEU 194 N -0.13 0.00 -0.13 2.25 3.38 -0.50 -1.71 115.31 118.47 1jt9 h LEU 194 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1jt9 h LEU 194 Cb 0.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1jt9 h LEU 194 CO 0.01 0.08 0.00 0.47 0.09 0.00 0.00 178.44 179.09 1jt9 n ASP 195 N -3.99 0.14 -4.77 -0.43 8.00 -0.18 -4.77 116.55 110.55 1jt9 n ASP 195 Ca -0.02 0.53 -0.36 0.00 0.71 0.00 0.00 54.79 55.65 1jt9 n ASP 195 Cb 0.17 -0.56 0.01 0.00 -0.02 0.00 0.00 41.12 40.72 1jt9 n ASP 195 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1jt9 s ALA 196 N -3.06 2.75 0.32 2.24 0.00 -0.65 -4.62 121.76 118.74 1jt9 s ALA 196 Ca 0.07 0.94 0.05 0.00 0.00 0.00 0.00 51.96 53.01 1jt9 s ALA 196 Cb 0.10 -3.40 0.55 0.00 0.00 0.00 0.00 23.12 20.37 1jt9 s ALA 196 CO 0.31 -0.87 1.81 1.49 0.00 0.00 0.00 175.76 178.50 1jt9 h GLU 197 N 1.40 0.44 -3.30 0.00 4.81 -1.00 -3.43 114.58 113.50 1jt9 h GLU 197 Ca -0.50 -0.13 -0.19 0.00 -0.13 0.00 0.00 59.36 58.42 1jt9 h GLU 197 Cb 1.27 -0.05 -0.27 0.00 0.63 0.00 0.00 28.75 30.33 1jt9 h GLU 197 CO 0.57 0.58 -0.52 -2.00 -0.73 0.00 0.00 179.01 176.92 1jt9 s GLU 198 N -4.70 0.20 -0.12 1.92 2.12 -1.10 -4.35 118.70 112.67 1jt9 s GLU 198 Ca -0.07 0.26 0.03 0.00 0.36 0.00 0.00 54.97 55.55 1jt9 s GLU 198 Cb 0.15 0.07 0.01 0.00 0.26 0.00 0.00 34.13 34.62 1jt9 s GLU 198 CO 0.77 -0.04 -0.20 0.08 -0.54 0.00 0.00 175.26 175.33 1jt9 s VAL 199 N 0.21 1.83 -0.19 3.70 1.01 -0.42 -0.77 120.40 125.77 1jt9 s VAL 199 Ca -0.01 -0.85 0.01 0.00 0.00 0.00 0.00 61.98 61.13 1jt9 s VAL 199 Cb -0.02 -1.62 0.04 0.00 0.00 0.00 0.00 36.38 34.77 1jt9 s VAL 199 CO -0.01 0.51 -0.13 -0.32 0.00 0.00 0.00 175.10 175.15 1jt9 s MET 200 N 0.75 2.27 -0.19 2.72 0.00 -0.27 -0.54 119.30 124.04 1jt9 s MET 200 Ca -0.10 -0.81 -0.06 0.00 0.00 0.00 0.00 55.69 54.71 1jt9 s MET 200 Cb -0.16 -2.41 -0.03 0.00 0.00 0.00 0.00 34.83 32.23 1jt9 s MET 200 CO 0.01 -0.36 0.03 0.42 0.00 0.00 0.00 175.02 175.12 1jt9 s ILE 201 N 1.38 4.36 -0.16 10.11 -1.09 0.34 -1.14 121.20 134.99 1jt9 s ILE 201 Ca 0.01 -0.18 -0.22 0.00 -2.23 0.00 0.00 60.65 58.02 1jt9 s ILE 201 Cb -0.15 -2.97 -0.03 0.00 -1.58 0.00 0.00 42.46 37.74 1jt9 s ILE 201 CO -0.09 0.44 0.69 -0.76 -1.23 0.00 0.00 174.94 173.98 1jt9 s LEU 202 N 0.70 4.19 -0.23 2.97 1.43 -0.04 -0.94 118.68 126.76 1jt9 s LEU 202 Ca 0.02 0.99 0.02 0.00 -1.03 0.00 0.00 54.13 54.13 1jt9 s LEU 202 Cb -0.14 -3.01 0.05 0.00 0.03 0.00 0.00 46.19 43.13 1jt9 s LEU 202 CO 0.02 -0.26 -0.11 -0.69 0.23 0.00 0.00 176.35 175.55 1jt9 s VAL 203 N 1.67 1.92 -0.04 -1.59 1.01 0.57 -4.18 120.40 119.76 1jt9 s VAL 203 Ca 0.33 -1.36 0.03 0.00 0.00 0.00 0.00 61.98 60.98 1jt9 s VAL 203 Cb -0.16 -2.03 0.00 0.00 0.00 0.00 0.00 36.38 34.19 1jt9 s VAL 203 CO 0.12 0.05 -0.12 -0.76 0.00 0.00 0.00 175.10 174.39 1jt9 s LEU 204 N 1.24 1.78 0.00 3.92 1.43 -1.26 -2.07 118.68 123.71 1jt9 s LEU 204 Ca -0.05 -0.26 0.00 0.00 -1.03 0.00 0.00 54.13 52.79 1jt9 s LEU 204 Cb -0.18 -0.74 0.00 0.00 0.03 0.00 0.00 46.19 45.30 1jt9 s LEU 204 CO -0.07 0.08 0.00 0.61 0.23 0.00 0.00 176.35 177.21 1jt9 n GLY 205 N 3.38 1.46 0.31 -3.19 0.00 -1.26 -4.53 105.19 101.36 1jt9 n GLY 205 Ca -0.19 -1.63 0.19 0.00 0.00 0.00 0.00 46.02 44.39 1jt9 n GLY 205 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1jt9 h SER 206 N 0.00 0.00 -0.91 1.61 4.64 -1.92 -1.56 113.55 115.42 1jt9 h SER 206 Ca 0.00 0.00 0.21 0.00 -0.47 0.00 0.00 61.79 61.53 1jt9 h SER 206 Cb 0.00 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.03 1jt9 h SER 206 CO 0.00 0.02 0.61 0.06 -0.87 0.00 0.00 176.83 176.65 1jt9 h GLN 207 N 0.00 0.35 -0.30 4.77 3.07 -1.86 -1.63 115.11 119.50 1jt9 h GLN 207 Ca -0.00 -0.02 0.00 0.00 0.09 0.00 0.00 58.65 58.72 1jt9 h GLN 207 Cb 0.23 -0.08 0.00 0.00 0.08 0.00 0.00 27.48 27.71 1jt9 h GLN 207 CO 0.00 0.23 0.00 1.63 0.09 0.00 0.00 178.83 180.78 1jt9 n LYS 208 N -4.49 2.32 -0.16 0.06 4.76 -0.59 -4.61 118.16 115.46 1jt9 n LYS 208 Ca 0.20 -2.12 -0.05 0.00 -2.87 0.00 0.00 58.31 53.46 1jt9 n LYS 208 Cb 0.74 -1.46 0.04 0.00 -1.84 0.00 0.00 35.03 32.51 1jt9 n LYS 208 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1jt9 h ALA 209 N 4.11 0.61 -0.43 7.82 0.00 -1.37 -0.36 119.26 129.64 1jt9 h ALA 209 Ca 0.00 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 1jt9 h ALA 209 Cb 0.92 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 1jt9 h ALA 209 CO 0.00 -0.08 -0.02 -0.07 0.00 0.00 0.00 179.25 179.07 1jt9 h LEU 210 N 0.51 0.68 -0.58 0.00 3.38 -1.81 -1.68 115.31 115.80 1jt9 h LEU 210 Ca 0.20 -0.16 -0.11 0.00 0.09 0.00 0.00 57.88 57.90 1jt9 h LEU 210 Cb 0.08 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 1jt9 h LEU 210 CO -0.13 0.77 -0.09 0.00 0.09 0.00 0.00 178.44 179.08 1jt9 h ALA 211 N 1.31 0.78 -0.53 1.53 0.00 -1.61 -1.27 119.26 119.47 1jt9 h ALA 211 Ca 0.13 -0.35 -0.04 0.00 0.00 0.00 0.00 54.91 54.65 1jt9 h ALA 211 Cb 0.45 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1jt9 h ALA 211 CO 0.02 0.67 0.17 1.25 0.00 0.00 0.00 179.25 181.36 1jt9 h LEU 212 N 0.93 0.77 -0.48 0.00 5.85 -0.83 -1.09 115.31 120.46 1jt9 h LEU 212 Ca 0.15 -0.20 0.02 0.00 0.84 0.00 0.00 57.88 58.68 1jt9 h LEU 212 Cb 0.66 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.46 1jt9 h LEU 212 CO 0.05 0.77 0.30 -0.61 -0.34 0.00 0.00 178.44 178.61 1jt9 h GLN 213 N 0.73 0.59 -0.64 1.25 -0.00 -1.15 -0.26 115.11 115.62 1jt9 h GLN 213 Ca 0.17 -0.04 -0.05 0.00 -0.00 0.00 0.00 58.65 58.74 1jt9 h GLN 213 Cb 0.27 -0.13 -0.03 0.00 0.00 0.00 0.00 27.48 27.59 1jt9 h GLN 213 CO -0.01 0.39 0.21 0.00 0.00 0.00 0.00 178.83 179.43 1jt9 h ALA 214 N 1.20 1.17 -0.29 3.38 0.00 -1.01 0.12 119.26 123.84 1jt9 h ALA 214 Ca 0.19 -0.19 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 1jt9 h ALA 214 Cb -0.02 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.51 1jt9 h ALA 214 CO -0.07 0.58 -0.26 0.00 0.00 0.00 0.00 179.25 179.50 1jt9 h ALA 215 N 1.30 0.42 0.02 0.00 0.00 -0.69 -3.15 119.26 117.15 1jt9 h ALA 215 Ca 0.21 -0.39 -0.31 0.00 0.00 0.00 0.00 54.91 54.43 1jt9 h ALA 215 Cb 0.25 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.91 1jt9 h ALA 215 CO -0.01 0.41 -1.68 0.28 0.00 0.00 0.00 179.25 178.25 1jt9 n VAL 216 N -4.29 1.57 -0.03 0.00 0.31 -0.16 -4.70 118.33 111.03 1jt9 n VAL 216 Ca -0.04 -0.21 0.02 0.00 -0.01 0.00 0.00 64.34 64.10 1jt9 n VAL 216 Cb 0.45 -1.94 -0.15 0.00 -0.91 0.00 0.00 33.84 31.30 1jt9 n VAL 216 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1jt9 n GLU 217 N -4.20 0.66 -1.66 5.55 1.02 0.31 -5.01 120.64 117.31 1jt9 n GLU 217 Ca -0.37 -0.07 -0.30 0.00 -0.02 0.00 0.00 57.16 56.40 1jt9 n GLU 217 Cb 0.79 -1.56 0.20 0.00 -0.02 0.00 0.00 31.44 30.85 1jt9 n GLU 217 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1jt9 s GLY 218 N -4.89 1.72 0.38 0.62 0.00 -0.63 -5.01 107.32 99.51 1jt9 s GLY 218 Ca -0.08 -1.12 0.01 0.00 0.00 0.00 0.00 44.72 43.54 1jt9 s GLY 218 CO 0.87 -0.31 0.57 0.00 0.00 0.00 0.00 173.10 174.23 1jt9 s VAL 220 N -2.37 2.71 -0.27 0.00 1.01 -1.26 -4.93 120.40 115.29 1jt9 s VAL 220 Ca 0.43 0.48 -0.25 0.00 0.00 0.00 0.00 61.98 62.64 1jt9 s VAL 220 Cb -0.10 -3.31 0.09 0.00 0.00 0.00 0.00 36.38 33.06 1jt9 s VAL 220 CO 0.36 0.03 0.83 0.54 0.00 0.00 0.00 175.10 176.86 1jt9 s ASN 221 N 1.28 -0.64 0.12 3.32 2.20 -1.26 -5.05 114.94 114.91 1jt9 s ASN 221 Ca 0.70 1.24 0.18 0.00 -0.94 0.00 0.00 52.86 54.05 1jt9 s ASN 221 Cb -0.43 1.26 0.78 0.00 -2.00 0.00 0.00 41.25 40.86 1jt9 s ASN 221 CO 0.31 -0.21 1.57 0.00 -2.94 0.00 0.00 177.10 175.83 1jt9 n HIS 222 N 2.54 0.38 0.06 1.54 1.44 -1.26 -2.92 115.22 116.99 1jt9 n HIS 222 Ca -0.14 0.15 -0.06 0.00 -2.01 0.00 0.00 57.72 55.66 1jt9 n HIS 222 Cb 0.55 -0.74 0.10 0.00 0.12 0.00 0.00 29.99 30.02 1jt9 n HIS 222 CO 0.00 0.00 0.00 0.52 -2.81 0.00 0.00 176.34 174.05 1jt9 h MET 223 N 0.00 0.34 -3.55 -1.40 2.86 -1.94 0.02 114.93 111.26 1jt9 h MET 223 Ca 0.00 -0.23 -0.71 0.00 -2.06 0.00 0.00 59.70 56.70 1jt9 h MET 223 Cb 0.29 0.03 -0.34 0.00 0.06 0.00 0.00 31.60 31.65 1jt9 h MET 223 CO 0.00 0.83 -0.22 -1.58 1.06 0.00 0.00 176.91 177.00 1jt9 s TRP 224 N -3.84 3.57 0.31 -0.22 0.52 -1.15 -4.21 118.94 113.92 1jt9 s TRP 224 Ca -0.05 -2.67 0.08 0.00 0.02 0.00 0.00 56.10 53.47 1jt9 s TRP 224 Cb 0.12 -3.31 0.81 0.00 -1.15 0.00 0.00 33.47 29.93 1jt9 s TRP 224 CO 0.81 -0.84 1.76 1.15 0.02 0.00 0.00 176.95 179.84 1jt9 h THR 225 N 4.91 0.63 -0.46 2.01 2.02 -1.67 0.39 112.91 120.74 1jt9 h THR 225 Ca 0.04 -0.23 0.13 0.00 0.77 0.00 0.00 66.41 67.13 1jt9 h THR 225 Cb 0.94 -0.11 -0.02 0.00 -1.74 0.00 0.00 68.15 67.22 1jt9 h THR 225 CO 0.75 0.12 0.35 -0.29 0.37 0.00 0.00 175.52 176.83 1jt9 h ILE 226 N 0.68 0.69 0.00 3.11 6.09 -1.51 -0.35 117.51 126.22 1jt9 h ILE 226 Ca 0.61 0.00 -0.01 0.00 -1.37 0.00 0.00 64.86 64.09 1jt9 h ILE 226 Cb 1.05 0.75 -0.00 0.00 0.47 0.00 0.00 36.82 39.09 1jt9 h ILE 226 CO -0.42 0.00 -0.07 0.77 -3.07 0.00 0.00 178.15 175.36 1jt9 h SER 227 N 0.00 0.00 0.47 2.19 4.64 -1.15 -2.00 113.55 117.69 1jt9 h SER 227 Ca 0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 1jt9 h SER 227 Cb 0.92 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.01 1jt9 h SER 227 CO -0.00 0.07 0.00 0.00 -0.87 0.00 0.00 176.83 176.02 1jt9 n LEU 229 N -1.34 0.52 0.28 0.00 4.77 -0.75 -1.81 117.00 118.68 1jt9 n LEU 229 Ca 0.09 0.64 0.15 0.00 -0.03 0.00 0.00 56.01 56.86 1jt9 n LEU 229 Cb 0.18 -0.58 0.85 0.00 -2.33 0.00 0.00 43.42 41.54 1jt9 n LEU 229 CO 0.17 -0.53 1.05 1.56 -1.33 0.00 0.00 177.39 178.30 1jt9 h GLN 230 N 0.00 0.00 -0.00 3.23 4.20 -1.65 -1.69 115.11 119.20 1jt9 h GLN 230 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1jt9 h GLN 230 Cb 0.31 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.09 1jt9 h GLN 230 CO 0.00 0.06 -0.62 1.28 -0.67 0.00 0.00 178.83 178.89 1jt9 n LEU 231 N -3.56 0.78 -4.76 1.46 4.77 -0.75 -4.91 117.00 110.03 1jt9 n LEU 231 Ca -0.02 -0.21 -0.40 0.00 -0.03 0.00 0.00 56.01 55.35 1jt9 n LEU 231 Cb 0.18 -0.15 -0.05 0.00 -2.33 0.00 0.00 43.42 41.07 1jt9 n LEU 231 CO 0.28 0.18 0.75 -2.28 -1.33 0.00 0.00 177.39 174.99 1jt9 s HIS 232 N -2.92 3.70 0.54 -1.77 2.46 -0.64 -4.96 115.29 111.71 1jt9 s HIS 232 Ca 0.12 1.76 0.23 0.00 0.47 0.00 0.00 55.06 57.64 1jt9 s HIS 232 Cb 0.17 -3.20 1.51 0.00 -0.13 0.00 0.00 32.58 30.94 1jt9 s HIS 232 CO 0.72 -0.26 2.18 -1.00 -2.47 0.00 0.00 174.74 173.92 1jt9 h PRO 233 N 3.93 0.00 -1.67 2.88 0.13 -1.90 -3.38 132.00 131.99 1jt9 h PRO 233 Ca -0.46 0.00 -0.33 0.00 -0.87 0.00 0.00 66.00 64.34 1jt9 h PRO 233 Cb 1.21 0.00 -0.27 0.00 0.13 0.00 0.00 31.00 32.07 1jt9 h PRO 233 CO 0.67 0.02 -0.68 0.21 -0.23 0.00 0.00 178.00 177.99 1jt9 s LYS 234 N -4.80 0.86 -0.05 0.86 2.20 -1.26 -4.93 119.74 112.61 1jt9 s LYS 234 Ca -0.05 -1.18 0.03 0.00 -0.36 0.00 0.00 55.97 54.41 1jt9 s LYS 234 Cb 0.16 -0.61 -0.03 0.00 -1.51 0.00 0.00 37.83 35.84 1jt9 s LYS 234 CO 0.61 -1.29 -0.12 0.00 -0.36 0.00 0.00 175.35 174.20 1jt9 s ALA 235 N 0.95 2.76 -0.03 3.13 0.00 -1.26 -1.30 121.76 126.01 1jt9 s ALA 235 Ca 0.25 -0.97 0.02 0.00 0.00 0.00 0.00 51.96 51.26 1jt9 s ALA 235 Cb -0.05 -1.03 0.01 0.00 0.00 0.00 0.00 23.12 22.05 1jt9 s ALA 235 CO -0.08 0.56 -0.08 0.42 0.00 0.00 0.00 175.76 176.59 1jt9 s ILE 236 N -0.78 0.72 -0.15 0.00 1.01 0.30 -1.52 121.20 120.79 1jt9 s ILE 236 Ca 0.12 -0.30 -0.01 0.00 0.00 0.00 0.00 60.65 60.46 1jt9 s ILE 236 Cb -0.11 -0.66 -0.02 0.00 0.01 0.00 0.00 42.46 41.69 1jt9 s ILE 236 CO 0.01 0.24 -0.10 -0.04 0.00 0.00 0.00 174.94 175.05 1jt9 s MET 237 N 0.37 3.45 -0.24 2.79 -1.94 -0.17 -0.51 119.30 123.05 1jt9 s MET 237 Ca -0.06 -0.64 -0.00 0.00 -1.71 0.00 0.00 55.69 53.28 1jt9 s MET 237 Cb -0.10 -2.75 0.03 0.00 2.01 0.00 0.00 34.83 34.02 1jt9 s MET 237 CO 0.01 0.16 -0.09 0.08 -0.01 0.00 0.00 175.02 175.17 1jt9 s VAL 238 N 0.51 2.61 0.25 -6.03 1.01 -0.11 -0.54 120.40 118.10 1jt9 s VAL 238 Ca -0.07 -1.15 0.03 0.00 0.00 0.00 0.00 61.98 60.80 1jt9 s VAL 238 Cb -0.15 -2.34 -0.05 0.00 0.00 0.00 0.00 36.38 33.84 1jt9 s VAL 238 CO 0.04 0.20 0.03 0.00 0.00 0.00 0.00 175.10 175.36 1jt9 s ASP 240 N -3.34 5.15 0.09 0.00 -4.77 -0.88 -1.11 116.67 111.81 1jt9 s ASP 240 Ca 0.32 -0.81 -0.20 0.00 -3.30 0.00 0.00 52.55 48.56 1jt9 s ASP 240 Cb 0.07 0.14 -0.09 0.00 -1.09 0.00 0.00 42.92 41.95 1jt9 s ASP 240 CO 0.11 -1.22 1.62 -0.08 0.70 0.00 0.00 175.17 176.30 1jt9 h GLU 241 N 0.31 0.30 -0.14 2.11 4.57 -0.37 -3.05 114.58 118.32 1jt9 h GLU 241 Ca -0.32 -0.06 0.04 0.00 -1.18 0.00 0.00 59.36 57.84 1jt9 h GLU 241 Cb 1.29 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 29.82 1jt9 h GLU 241 CO 0.43 0.38 0.15 -1.35 -1.18 0.00 0.00 179.01 177.44 1jt9 h PRO 242 N 0.16 0.00 0.00 0.92 0.11 -1.90 -2.07 132.00 129.22 1jt9 h PRO 242 Ca 0.07 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.18 1jt9 h PRO 242 Cb 0.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.31 1jt9 h PRO 242 CO -0.00 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 176.66 1jt9 n SER 243 N -3.93 0.03 -0.57 -2.05 3.41 -1.15 -3.46 113.62 105.90 1jt9 n SER 243 Ca 0.01 0.50 0.10 0.00 -0.26 0.00 0.00 58.87 59.22 1jt9 n SER 243 Cb 0.26 -0.51 0.36 0.00 -0.26 0.00 0.00 64.21 64.06 1jt9 n SER 243 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1jt9 n THR 244 N -1.53 0.23 -0.22 6.66 -2.24 -0.78 -3.96 114.28 112.44 1jt9 n THR 244 Ca 0.06 -0.36 0.24 0.00 -2.27 0.00 0.00 64.05 61.72 1jt9 n THR 244 Cb 0.30 0.37 0.61 0.00 -2.10 0.00 0.00 70.33 69.52 1jt9 n THR 244 CO 0.00 0.00 0.00 0.24 -0.57 0.00 0.00 175.07 174.74 1jt9 h MET 245 N 2.25 0.20 -0.02 -0.78 2.86 -1.74 -2.07 114.93 115.63 1jt9 h MET 245 Ca 0.00 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1jt9 h MET 245 Cb 0.49 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.11 1jt9 h MET 245 CO 0.00 0.13 -0.04 0.39 1.06 0.00 0.00 176.91 178.46 1jt9 n GLU 246 N -4.41 1.92 -2.49 1.72 -0.58 -1.26 -4.94 120.64 110.61 1jt9 n GLU 246 Ca 0.20 -1.41 -0.31 0.00 -0.42 0.00 0.00 57.16 55.21 1jt9 n GLU 246 Cb 0.85 -1.47 -0.02 0.00 -0.57 0.00 0.00 31.44 30.22 1jt9 n GLU 246 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1jt9 s LEU 247 N -2.05 3.63 0.39 -4.62 1.43 -0.78 -4.88 118.68 111.80 1jt9 s LEU 247 Ca 0.31 1.33 -0.24 0.00 -1.03 0.00 0.00 54.13 54.50 1jt9 s LEU 247 Cb 0.20 -4.27 -0.09 0.00 0.03 0.00 0.00 46.19 42.06 1jt9 s LEU 247 CO 0.34 -0.57 1.05 -0.54 0.23 0.00 0.00 176.35 176.86 1jt9 s LYS 248 N -4.25 4.21 0.26 1.70 1.02 -1.26 -4.93 119.74 116.49 1jt9 s LYS 248 Ca 0.54 1.53 -0.01 0.00 0.02 0.00 0.00 55.97 58.05 1jt9 s LYS 248 Cb -0.10 -2.59 0.54 0.00 -0.52 0.00 0.00 37.83 35.15 1jt9 s LYS 248 CO 0.36 -0.11 1.74 0.28 -0.92 0.00 0.00 175.35 176.71 1jt9 h VAL 249 N 2.27 0.66 0.00 3.17 2.07 -1.96 -0.46 116.25 122.00 1jt9 h VAL 249 Ca -0.48 -0.18 -0.05 0.00 0.82 0.00 0.00 66.70 66.81 1jt9 h VAL 249 Cb 1.21 0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 31.07 1jt9 h VAL 249 CO 0.63 0.09 -0.25 0.07 0.02 0.00 0.00 177.57 178.13 1jt9 h LYS 250 N 0.52 0.00 -0.07 1.57 2.10 -1.99 -1.10 116.57 117.60 1jt9 h LYS 250 Ca 0.46 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 59.09 1jt9 h LYS 250 Cb 0.71 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.04 1jt9 h LYS 250 CO -0.41 0.25 -0.02 1.15 -2.00 0.00 0.00 179.45 178.43 1jt9 h THR 251 N 0.00 1.30 -0.63 0.07 2.02 -1.46 -0.68 112.91 113.53 1jt9 h THR 251 Ca -0.00 -0.95 -0.05 0.00 0.77 0.00 0.00 66.41 66.18 1jt9 h THR 251 Cb 0.54 1.79 -0.03 0.00 -1.74 0.00 0.00 68.15 68.71 1jt9 h THR 251 CO 0.03 0.26 0.19 0.25 0.37 0.00 0.00 175.52 176.62 1jt9 h LEU 252 N -0.21 0.92 -0.76 2.58 5.85 -1.29 -2.39 115.31 120.01 1jt9 h LEU 252 Ca 0.02 -0.21 0.02 0.00 0.84 0.00 0.00 57.88 58.54 1jt9 h LEU 252 Cb 0.43 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 41.17 1jt9 h LEU 252 CO 0.01 0.89 0.50 -0.09 -0.34 0.00 0.00 178.44 179.40 1jt9 h ARG 253 N 0.90 0.97 -0.33 1.25 2.43 -1.13 0.32 114.38 118.79 1jt9 h ARG 253 Ca 0.20 -0.06 0.02 0.00 -0.81 0.00 0.00 59.98 59.33 1jt9 h ARG 253 Cb 0.30 -0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 29.61 1jt9 h ARG 253 CO -0.01 0.64 0.19 -0.92 -1.51 0.00 0.00 179.97 178.36 1jt9 h TYR 254 N 1.00 0.35 -0.04 2.20 3.20 -0.72 -1.72 116.97 121.23 1jt9 h TYR 254 Ca 0.29 0.01 -0.17 0.00 3.14 0.00 0.00 58.73 62.00 1jt9 h TYR 254 Cb -0.06 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.09 1jt9 h TYR 254 CO -0.03 0.20 -0.74 0.74 -1.64 0.00 0.00 178.16 176.70 1jt9 h PHE 255 N 0.38 0.32 -0.71 -3.82 0.04 -1.17 -2.31 116.94 109.67 1jt9 h PHE 255 Ca 0.13 -0.15 -0.01 0.00 2.80 0.00 0.00 57.97 60.75 1jt9 h PHE 255 Cb 0.02 -0.05 -0.03 0.00 2.20 0.00 0.00 35.95 38.09 1jt9 h PHE 255 CO -0.08 0.89 0.42 -0.91 -0.60 0.00 0.00 178.31 178.03 1jt9 h ASN 256 N 0.16 0.86 -0.14 2.17 2.35 -0.69 -0.70 115.58 119.58 1jt9 h ASN 256 Ca -0.03 -0.07 -0.12 0.00 -0.55 0.00 0.00 56.30 55.54 1jt9 h ASN 256 Cb 1.30 -0.22 0.00 0.00 0.05 0.00 0.00 38.32 39.46 1jt9 h ASN 256 CO 0.11 0.67 -0.38 1.05 -1.65 0.00 0.00 177.43 177.24 1jt9 h GLU 257 N 0.97 0.51 0.00 0.81 4.11 -1.29 -1.22 114.58 118.47 1jt9 h GLU 257 Ca 0.25 -0.36 -0.06 0.00 0.07 0.00 0.00 59.36 59.27 1jt9 h GLU 257 Cb -0.02 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 1jt9 h GLU 257 CO -0.05 0.97 -0.27 1.25 0.07 0.00 0.00 179.01 180.98 1jt9 h LEU 258 N 0.13 0.00 -1.94 3.06 5.85 -1.27 -3.05 115.31 118.10 1jt9 h LEU 258 Ca -0.01 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.71 1jt9 h LEU 258 Cb 0.99 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.02 1jt9 h LEU 258 CO 0.08 0.27 0.00 -0.62 -0.34 0.00 0.00 178.44 177.83 1jt9 n GLU 259 N -4.15 1.64 -0.31 1.25 -0.58 -0.28 -4.65 120.64 113.55 1jt9 n GLU 259 Ca -0.02 -1.67 0.12 0.00 -0.42 0.00 0.00 57.16 55.17 1jt9 n GLU 259 Cb 0.33 -1.33 0.30 0.00 -0.57 0.00 0.00 31.44 30.17 1jt9 n GLU 259 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1jt9 h ALA 260 N 3.08 1.46 0.00 0.62 0.00 -1.10 -0.05 119.26 123.27 1jt9 h ALA 260 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1jt9 h ALA 260 Cb 0.71 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.59 1jt9 h ALA 260 CO 0.00 -0.27 0.00 0.93 0.00 0.00 0.00 179.25 179.91 1jt9 h GLU 261 N 0.48 0.00 -0.22 0.00 4.39 -1.82 -3.26 114.58 114.15 1jt9 h GLU 261 Ca 0.55 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.25 1jt9 h GLU 261 Cb 0.99 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.64 1jt9 h GLU 261 CO -0.48 0.00 0.00 0.09 -1.16 0.00 0.00 179.01 177.46 1jt9 n ASN 262 N -2.62 2.73 -0.22 1.42 3.02 -0.05 -4.09 115.26 115.46 1jt9 n ASN 262 Ca 0.04 -1.88 0.02 0.00 -0.03 0.00 0.00 54.58 52.73 1jt9 n ASN 262 Cb 0.41 -0.13 0.04 0.00 -0.61 0.00 0.00 39.78 39.49 1jt9 n ASN 262 CO 0.00 0.00 0.00 2.30 -2.62 0.00 0.00 177.26 176.94 1jt9 n ILE 263 N 1.05 0.53 -2.23 2.41 -5.35 -1.13 -4.88 119.36 109.77 1jt9 n ILE 263 Ca 0.17 -0.77 -0.43 0.00 -0.27 0.00 0.00 62.75 61.46 1jt9 n ILE 263 Cb 0.51 0.78 -0.02 0.00 -1.74 0.00 0.00 39.64 39.17 1jt9 n ILE 263 CO 0.00 0.00 0.00 -0.54 -1.76 0.00 0.00 176.55 174.25 1jt9 s LYS 264 N -0.70 4.22 0.00 6.28 1.02 -1.26 -1.78 119.74 127.52 1jt9 s LYS 264 Ca 0.07 1.92 0.00 0.00 0.02 0.00 0.00 55.97 57.98 1jt9 s LYS 264 Cb 0.04 -3.83 0.00 0.00 -0.52 0.00 0.00 37.83 33.53 1jt9 s LYS 264 CO 0.06 -0.74 0.00 0.41 -0.92 0.00 0.00 175.35 174.16 1jt9 n GLY 265 N 3.82 1.78 3.65 -3.33 0.00 -1.26 -5.13 105.19 104.72 1jt9 n GLY 265 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1jt9 n GLY 265 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36