#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nd6 s GLU 2 N 0.00 3.33 0.27 1.64 2.12 -0.18 -4.93 118.70 120.95 1nd6 s GLU 2 Ca 0.00 -0.68 -0.30 0.00 0.36 0.00 0.00 54.97 54.35 1nd6 s GLU 2 Cb 0.00 -2.76 -0.10 0.00 0.26 0.00 0.00 34.13 31.52 1nd6 s GLU 2 CO 0.00 0.01 1.44 -1.17 -0.54 0.00 0.00 175.26 175.00 1nd6 s LEU 3 N 0.88 4.38 0.00 2.70 2.96 -1.26 -0.44 118.68 127.90 1nd6 s LEU 3 Ca -0.03 2.72 0.00 0.00 -0.22 0.00 0.00 54.13 56.60 1nd6 s LEU 3 Cb -0.15 -3.63 0.00 0.00 0.50 0.00 0.00 46.19 42.91 1nd6 s LEU 3 CO 0.00 -0.71 0.00 1.17 -1.32 0.00 0.00 176.35 175.49 1nd6 n LYS 4 N 1.98 1.92 -3.82 1.98 4.81 0.54 -4.87 118.16 120.69 1nd6 n LYS 4 Ca 0.06 0.00 -0.12 0.00 -0.87 0.00 0.00 58.31 57.37 1nd6 n LYS 4 Cb 0.40 -0.94 -0.10 0.00 0.02 0.00 0.00 35.03 34.41 1nd6 n LYS 4 CO 0.00 0.00 0.00 0.12 1.17 0.00 0.00 177.40 178.69 1nd6 s PHE 5 N -1.88 -0.09 -0.03 5.64 5.36 -1.04 -4.73 117.98 121.21 1nd6 s PHE 5 Ca 0.00 0.16 -0.05 0.00 -0.96 0.00 0.00 56.93 56.08 1nd6 s PHE 5 Cb 0.00 0.03 0.01 0.00 -0.34 0.00 0.00 43.02 42.71 1nd6 s PHE 5 CO 0.00 -0.28 0.12 0.08 -1.46 0.00 0.00 175.22 173.67 1nd6 s VAL 6 N -1.04 0.03 -0.06 3.12 1.01 0.19 -0.81 120.40 122.84 1nd6 s VAL 6 Ca -0.11 -0.21 0.02 0.00 0.00 0.00 0.00 61.98 61.67 1nd6 s VAL 6 Cb -0.06 -0.24 0.02 0.00 0.00 0.00 0.00 36.38 36.10 1nd6 s VAL 6 CO 0.02 -0.12 -0.09 -0.89 0.00 0.00 0.00 175.10 174.02 1nd6 s THR 7 N -0.36 0.91 -0.11 3.92 2.01 -0.89 -1.53 115.64 119.59 1nd6 s THR 7 Ca -0.04 -0.35 0.03 0.00 0.31 0.00 0.00 61.69 61.64 1nd6 s THR 7 Cb -0.03 -0.86 0.00 0.00 0.01 0.00 0.00 72.50 71.63 1nd6 s THR 7 CO 0.00 0.30 -0.22 -0.76 -0.69 0.00 0.00 174.62 173.26 1nd6 s LEU 8 N 0.74 2.04 -0.22 4.42 1.43 -0.77 -1.68 118.68 124.63 1nd6 s LEU 8 Ca -0.14 -0.54 0.02 0.00 -1.03 0.00 0.00 54.13 52.44 1nd6 s LEU 8 Cb -0.15 -1.36 0.05 0.00 0.03 0.00 0.00 46.19 44.76 1nd6 s LEU 8 CO 0.02 0.12 -0.13 -0.69 0.23 0.00 0.00 176.35 175.91 1nd6 s VAL 9 N 0.53 1.97 0.09 -1.59 1.01 -0.83 -0.75 120.40 120.84 1nd6 s VAL 9 Ca -0.15 -1.27 0.03 0.00 0.00 0.00 0.00 61.98 60.59 1nd6 s VAL 9 Cb -0.17 -2.00 -0.04 0.00 0.00 0.00 0.00 36.38 34.17 1nd6 s VAL 9 CO 0.05 0.17 -0.08 0.72 0.00 0.00 0.00 175.10 175.95 1nd6 s PHE 10 N 1.24 0.95 0.26 5.22 -0.12 -0.94 0.06 117.98 124.65 1nd6 s PHE 10 Ca -0.03 -0.73 -0.07 0.00 -0.05 0.00 0.00 56.93 56.04 1nd6 s PHE 10 Cb -0.17 -0.53 -0.06 0.00 -0.63 0.00 0.00 43.02 41.63 1nd6 s PHE 10 CO -0.08 -0.06 0.55 0.50 -0.05 0.00 0.00 175.22 176.08 1nd6 s ARG 11 N -3.03 3.72 1.16 1.99 3.52 -0.93 -0.81 118.95 124.57 1nd6 s ARG 11 Ca 0.06 0.15 -0.15 0.00 -0.13 0.00 0.00 55.73 55.66 1nd6 s ARG 11 Cb -0.01 -2.64 0.23 0.00 -1.56 0.00 0.00 34.95 30.97 1nd6 s ARG 11 CO -0.02 0.26 0.67 -2.39 -0.81 0.00 0.00 175.30 173.01 1nd6 n HIS 12 N -0.54 -1.34 -1.77 5.12 1.44 -0.68 -2.27 115.22 115.18 1nd6 n HIS 12 Ca -0.00 -0.06 -0.14 0.00 -2.01 0.00 0.00 57.72 55.51 1nd6 n HIS 12 Cb 0.53 -1.65 0.09 0.00 0.12 0.00 0.00 29.99 29.08 1nd6 n HIS 12 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1nd6 n GLY 13 N 1.37 -0.68 3.57 -1.39 0.00 -1.26 -1.52 105.19 105.27 1nd6 n GLY 13 Ca 0.02 -1.79 -0.51 0.00 0.00 0.00 0.00 46.02 43.75 1nd6 n GLY 13 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1nd6 n ASP 14 N -3.29 1.34 -4.29 1.61 -0.08 -1.26 -4.84 116.55 105.74 1nd6 n ASP 14 Ca 0.09 1.13 -0.15 0.00 -1.51 0.00 0.00 54.79 54.34 1nd6 n ASP 14 Cb 0.30 -1.18 -0.10 0.00 2.34 0.00 0.00 41.12 42.48 1nd6 n ASP 14 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1nd6 s ARG 15 N 0.03 1.29 0.85 -0.67 1.70 -1.26 -1.41 118.95 119.48 1nd6 s ARG 15 Ca 0.79 -1.67 -0.12 0.00 -0.47 0.00 0.00 55.73 54.26 1nd6 s ARG 15 Cb -0.93 -0.28 0.10 0.00 -0.57 0.00 0.00 34.95 33.28 1nd6 s ARG 15 CO 0.50 -0.23 1.15 -1.54 -1.08 0.00 0.00 175.30 174.11 1nd6 s SER 16 N -3.26 4.13 0.83 -2.89 1.04 0.04 -4.90 113.70 108.70 1nd6 s SER 16 Ca 0.32 0.92 -0.11 0.00 0.48 0.00 0.00 55.95 57.56 1nd6 s SER 16 Cb 0.07 -1.48 0.09 0.00 0.10 0.00 0.00 66.02 64.80 1nd6 s SER 16 CO 0.10 -2.15 1.09 -2.16 0.98 0.00 0.00 173.24 171.10 1nd6 s PRO 17 N -5.41 1.76 0.02 4.02 0.04 -1.26 -3.71 135.00 130.46 1nd6 s PRO 17 Ca 0.62 1.01 0.13 0.00 0.04 0.00 0.00 61.00 62.81 1nd6 s PRO 17 Cb -0.13 -1.85 -0.19 0.00 0.04 0.00 0.00 34.50 32.37 1nd6 s PRO 17 CO 0.51 -1.95 0.83 0.82 0.04 0.00 0.00 177.00 177.26 1nd6 h ILE 18 N -1.34 0.90 -2.34 0.56 1.08 -1.92 0.22 117.51 114.67 1nd6 h ILE 18 Ca -0.46 -2.63 0.15 0.00 -0.39 0.00 0.00 64.86 61.53 1nd6 h ILE 18 Cb 1.26 2.40 -0.11 0.00 -3.07 0.00 0.00 36.82 37.30 1nd6 h ILE 18 CO 0.53 0.51 0.48 -0.62 -0.69 0.00 0.00 178.15 178.36 1nd6 s ASP 19 N -6.13 -0.25 0.34 1.72 2.15 -1.26 -4.68 116.67 108.55 1nd6 s ASP 19 Ca -0.03 -0.25 0.05 0.00 0.43 0.00 0.00 52.55 52.75 1nd6 s ASP 19 Cb 0.08 0.46 -0.02 0.00 -0.30 0.00 0.00 42.92 43.14 1nd6 s ASP 19 CO 0.82 -0.81 0.35 1.07 -0.17 0.00 0.00 175.17 176.43 1nd6 n THR 20 N -0.39 0.00 -3.19 1.71 5.66 -1.26 -4.43 114.28 112.38 1nd6 n THR 20 Ca -0.07 -2.26 -0.31 0.00 -3.05 0.00 0.00 64.05 58.37 1nd6 n THR 20 Cb 0.61 1.19 -0.04 0.00 -1.55 0.00 0.00 70.33 70.54 1nd6 n THR 20 CO 0.00 0.00 0.00 0.72 -3.05 0.00 0.00 175.07 172.74 1nd6 s PHE 21 N -3.21 3.45 0.32 1.09 -0.12 -0.47 -4.87 117.98 114.17 1nd6 s PHE 21 Ca 0.37 0.90 0.10 0.00 -0.05 0.00 0.00 56.93 58.25 1nd6 s PHE 21 Cb 0.01 -2.31 0.93 0.00 -0.63 0.00 0.00 43.02 41.03 1nd6 s PHE 21 CO 0.26 0.11 1.68 -1.35 -0.05 0.00 0.00 175.22 175.87 1nd6 h PRO 22 N 1.88 0.35 0.00 1.99 0.11 -1.84 -1.02 132.00 133.46 1nd6 h PRO 22 Ca -0.47 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1nd6 h PRO 22 Cb 1.18 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1nd6 h PRO 22 CO 0.66 0.23 0.00 2.41 -0.21 0.00 0.00 178.00 181.09 1nd6 n THR 23 N -5.05 0.55 -2.06 -1.15 -1.04 -0.89 -4.86 114.28 99.79 1nd6 n THR 23 Ca 0.28 -0.20 -0.42 0.00 -2.04 0.00 0.00 64.05 61.66 1nd6 n THR 23 Cb 0.84 -0.63 -0.03 0.00 -1.82 0.00 0.00 70.33 68.70 1nd6 n THR 23 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1nd6 s ASP 24 N -4.31 6.64 0.34 8.00 -1.08 -0.39 -4.86 116.67 121.00 1nd6 s ASP 24 Ca 0.10 2.10 0.27 0.00 -0.52 0.00 0.00 52.55 54.50 1nd6 s ASP 24 Cb 0.13 -2.53 1.02 0.00 -1.46 0.00 0.00 42.92 40.07 1nd6 s ASP 24 CO 0.57 -0.97 1.79 -0.65 0.52 0.00 0.00 175.17 176.42 1nd6 h PRO 25 N 9.64 0.00 -5.06 4.34 0.11 -1.89 -3.38 132.00 135.77 1nd6 h PRO 25 Ca -0.37 0.00 -0.67 0.00 0.11 0.00 0.00 66.00 65.07 1nd6 h PRO 25 Cb 1.17 0.00 -0.17 0.00 0.11 0.00 0.00 31.00 32.11 1nd6 h PRO 25 CO 0.96 0.00 0.44 0.42 -0.21 0.00 0.00 178.00 179.61 1nd6 s ILE 26 N -3.37 4.61 0.60 4.15 1.01 -1.26 -5.00 121.20 121.93 1nd6 s ILE 26 Ca 0.05 -0.87 0.04 0.00 0.00 0.00 0.00 60.65 59.86 1nd6 s ILE 26 Cb 0.09 -4.63 0.07 0.00 0.01 0.00 0.00 42.46 38.01 1nd6 s ILE 26 CO 0.48 -1.34 0.82 -0.54 0.00 0.00 0.00 174.94 174.36 1nd6 s LYS 27 N 3.21 2.23 0.36 2.79 -0.14 -1.26 -4.91 119.74 122.02 1nd6 s LYS 27 Ca 0.20 -1.17 0.13 0.00 -1.36 0.00 0.00 55.97 53.78 1nd6 s LYS 27 Cb -0.17 -2.51 0.96 0.00 -1.68 0.00 0.00 37.83 34.43 1nd6 s LYS 27 CO 0.04 -0.94 1.78 1.49 -0.76 0.00 0.00 175.35 176.97 1nd6 h GLU 28 N -0.03 0.52 -0.06 1.68 4.81 -1.95 0.66 114.58 120.21 1nd6 h GLU 28 Ca -0.37 -0.03 0.02 0.00 -0.13 0.00 0.00 59.36 58.85 1nd6 h GLU 28 Cb 1.28 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 30.54 1nd6 h GLU 28 CO 0.44 0.34 0.31 0.77 -0.73 0.00 0.00 179.01 180.14 1nd6 h SER 29 N 0.53 0.00 1.39 1.04 0.02 -1.98 0.27 113.55 114.82 1nd6 h SER 29 Ca 0.57 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.52 1nd6 h SER 29 Cb 1.22 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.76 1nd6 h SER 29 CO -0.32 0.00 -0.17 0.28 -1.14 0.00 0.00 176.83 175.48 1nd6 h SER 30 N 0.00 0.00 -3.50 3.07 0.02 -0.01 -3.44 113.55 109.69 1nd6 h SER 30 Ca 0.03 -0.05 -0.61 0.00 -0.84 0.00 0.00 61.79 60.32 1nd6 h SER 30 Cb 0.64 0.00 -0.14 0.00 0.14 0.00 0.00 62.40 63.05 1nd6 h SER 30 CO -0.00 0.02 -0.47 0.26 -1.14 0.00 0.00 176.83 175.50 1nd6 s TRP 31 N -3.14 3.34 0.23 3.45 0.52 0.08 -5.00 118.94 118.43 1nd6 s TRP 31 Ca 0.09 0.29 -0.01 0.00 0.02 0.00 0.00 56.10 56.49 1nd6 s TRP 31 Cb 0.12 -2.27 0.51 0.00 -1.15 0.00 0.00 33.47 30.68 1nd6 s TRP 31 CO 0.64 0.11 1.21 -2.30 0.02 0.00 0.00 176.95 176.63 1nd6 n PRO 32 N 4.12 -0.06 -0.23 4.98 -0.02 -1.26 -0.71 135.00 141.80 1nd6 n PRO 32 Ca -0.15 1.17 0.07 0.00 -2.02 0.00 0.00 63.50 62.58 1nd6 n PRO 32 Cb 0.52 -1.83 0.17 0.00 -0.02 0.00 0.00 33.50 32.34 1nd6 n PRO 32 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1nd6 n GLN 33 N -5.14 2.58 0.00 -0.52 3.00 -1.26 -5.10 117.38 110.93 1nd6 n GLN 33 Ca 0.16 -2.39 0.00 0.00 -0.01 0.00 0.00 57.00 54.76 1nd6 n GLN 33 Cb 0.53 -1.51 0.00 0.00 0.00 0.00 0.00 30.24 29.26 1nd6 n GLN 33 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1nd6 n GLY 34 N -0.45 -2.22 3.79 1.08 0.00 0.11 -4.81 105.19 102.69 1nd6 n GLY 34 Ca 0.15 -1.51 -0.34 0.00 0.00 0.00 0.00 46.02 44.32 1nd6 n GLY 34 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1nd6 s PHE 35 N -0.44 2.81 -1.51 1.61 2.99 -1.26 -4.02 117.98 118.17 1nd6 s PHE 35 Ca 0.00 1.54 0.00 0.00 0.00 0.00 0.00 56.93 58.47 1nd6 s PHE 35 Cb 0.00 -3.13 0.00 0.00 0.00 0.00 0.00 43.02 39.89 1nd6 s PHE 35 CO 0.00 -1.33 0.00 0.41 -0.00 0.00 0.00 175.22 174.30 1nd6 n GLY 36 N -0.44 0.98 3.70 4.36 0.00 0.78 -4.93 105.19 109.64 1nd6 n GLY 36 Ca 0.10 -0.29 -0.32 0.00 0.00 0.00 0.00 46.02 45.52 1nd6 n GLY 36 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1nd6 s GLN 37 N -3.75 2.73 0.18 1.61 2.00 -1.26 -4.47 119.66 116.71 1nd6 s GLN 37 Ca 0.00 -0.69 -0.30 0.00 -2.00 0.00 0.00 55.36 52.37 1nd6 s GLN 37 Cb 0.00 -2.64 -0.08 0.00 0.80 0.00 0.00 33.01 31.09 1nd6 s GLN 37 CO 0.00 0.59 1.16 -1.17 -0.50 0.00 0.00 175.29 175.37 1nd6 s LEU 38 N -1.89 4.46 0.54 3.68 2.96 -1.26 -0.78 118.68 126.39 1nd6 s LEU 38 Ca 0.23 2.18 0.03 0.00 -0.22 0.00 0.00 54.13 56.34 1nd6 s LEU 38 Cb -0.12 -3.61 0.04 0.00 0.50 0.00 0.00 46.19 43.01 1nd6 s LEU 38 CO 0.14 -0.32 0.76 0.42 -1.32 0.00 0.00 176.35 176.03 1nd6 s THR 39 N -0.10 2.65 0.41 3.68 -4.23 -0.50 -4.93 115.64 112.63 1nd6 s THR 39 Ca 0.52 -0.74 0.13 0.00 -1.18 0.00 0.00 61.69 60.41 1nd6 s THR 39 Cb -0.31 -2.91 0.15 0.00 1.34 0.00 0.00 72.50 70.77 1nd6 s THR 39 CO 0.36 0.00 1.93 0.06 -0.54 0.00 0.00 174.62 176.43 1nd6 h GLN 40 N 0.13 0.03 -0.59 3.99 -0.00 -1.97 -0.84 115.11 115.87 1nd6 h GLN 40 Ca -0.40 -0.01 -0.03 0.00 -0.00 0.00 0.00 58.65 58.21 1nd6 h GLN 40 Cb 1.29 -0.00 -0.03 0.00 -0.00 0.00 0.00 27.48 28.74 1nd6 h GLN 40 CO 0.49 0.27 0.25 1.25 -0.00 0.00 0.00 178.83 181.09 1nd6 h LEU 41 N 0.03 0.80 -1.81 0.06 5.85 -1.94 0.22 115.31 118.53 1nd6 h LEU 41 Ca 0.00 -0.16 -0.03 0.00 0.84 0.00 0.00 57.88 58.53 1nd6 h LEU 41 Cb 0.43 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 41.25 1nd6 h LEU 41 CO 0.03 0.74 -0.15 1.23 -0.34 0.00 0.00 178.44 179.95 1nd6 h GLY 42 N 0.82 0.00 0.95 3.75 0.00 -1.29 0.39 103.07 107.69 1nd6 h GLY 42 Ca 0.20 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.35 1nd6 h GLY 42 CO -0.02 0.00 -0.65 -0.33 0.00 0.00 0.00 176.54 175.54 1nd6 h MET 43 N 0.00 0.57 -0.55 4.80 2.86 -0.33 -3.01 114.93 119.27 1nd6 h MET 43 Ca -0.00 -0.51 0.00 0.00 -2.06 0.00 0.00 59.70 57.13 1nd6 h MET 43 Cb 0.33 0.12 -0.03 0.00 0.06 0.00 0.00 31.60 32.08 1nd6 h MET 43 CO 0.02 1.14 0.35 0.93 1.06 0.00 0.00 176.91 180.41 1nd6 h GLU 44 N 0.18 0.73 -0.98 1.72 5.08 -0.06 -1.08 114.58 120.16 1nd6 h GLU 44 Ca -0.06 -0.05 0.04 0.00 -1.00 0.00 0.00 59.36 58.29 1nd6 h GLU 44 Cb 1.31 -0.16 -0.06 0.00 0.50 0.00 0.00 28.75 30.34 1nd6 h GLU 44 CO 0.13 0.50 0.64 1.96 -1.00 0.00 0.00 179.01 181.25 1nd6 h GLN 45 N 0.74 1.20 0.00 2.33 4.20 -0.99 -0.02 115.11 122.56 1nd6 h GLN 45 Ca 0.20 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.84 1nd6 h GLN 45 Cb -0.05 -0.27 0.00 0.00 0.30 0.00 0.00 27.48 27.46 1nd6 h GLN 45 CO -0.04 0.79 0.00 0.45 -0.67 0.00 0.00 178.83 179.36 1nd6 h HIS 46 N 1.23 0.00 -0.19 2.96 3.86 -1.32 -1.50 115.15 120.19 1nd6 h HIS 46 Ca 0.40 0.00 -0.21 0.00 -1.16 0.00 0.00 60.37 59.39 1nd6 h HIS 46 Cb 0.03 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.50 1nd6 h HIS 46 CO -0.00 0.00 -0.71 -0.92 0.86 0.00 0.00 177.93 177.16 1nd6 h TYR 47 N 0.00 1.08 -0.43 2.45 3.20 0.11 -0.10 116.97 123.28 1nd6 h TYR 47 Ca 0.00 -0.45 -0.05 0.00 3.14 0.00 0.00 58.73 61.37 1nd6 h TYR 47 Cb 0.92 -0.18 -0.02 0.00 1.54 0.00 0.00 36.73 39.00 1nd6 h TYR 47 CO 0.00 1.28 0.06 1.49 -1.64 0.00 0.00 178.16 179.36 1nd6 h GLU 48 N 0.58 0.71 -0.62 1.82 4.22 -0.88 -0.68 114.58 119.74 1nd6 h GLU 48 Ca -0.03 -0.19 0.01 0.00 0.08 0.00 0.00 59.36 59.22 1nd6 h GLU 48 Cb 1.33 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 30.47 1nd6 h GLU 48 CO 0.15 0.75 0.41 1.25 -2.18 0.00 0.00 179.01 179.39 1nd6 h LEU 49 N 0.57 0.72 -0.99 1.64 6.46 -1.17 0.10 115.31 122.63 1nd6 h LEU 49 Ca 0.13 -0.02 -0.01 0.00 -0.12 0.00 0.00 57.88 57.86 1nd6 h LEU 49 Cb 0.38 -0.18 -0.04 0.00 -0.73 0.00 0.00 40.66 40.09 1nd6 h LEU 49 CO 0.01 0.52 0.53 1.23 -0.62 0.00 0.00 178.44 180.11 1nd6 h GLY 50 N 0.84 1.31 0.91 3.75 0.00 -0.67 -1.23 103.07 107.99 1nd6 h GLY 50 Ca 0.23 -0.56 -0.05 0.00 0.00 0.00 0.00 47.33 46.95 1nd6 h GLY 50 CO -0.05 0.54 0.03 0.83 0.00 0.00 0.00 176.54 177.90 1nd6 h GLU 51 N 1.24 0.60 -0.31 4.80 5.08 -0.44 -2.28 114.58 123.27 1nd6 h GLU 51 Ca 0.32 -0.17 0.03 0.00 -1.00 0.00 0.00 59.36 58.54 1nd6 h GLU 51 Cb -0.03 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.12 1nd6 h GLU 51 CO -0.06 0.69 0.11 -0.92 -1.00 0.00 0.00 179.01 177.84 1nd6 h TYR 52 N 0.43 0.20 -0.52 4.33 3.20 -0.43 -2.21 116.97 121.97 1nd6 h TYR 52 Ca 0.10 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.97 1nd6 h TYR 52 Cb 0.40 -0.04 -0.03 0.00 1.54 0.00 0.00 36.73 38.60 1nd6 h TYR 52 CO 0.03 0.09 0.26 0.82 -1.64 0.00 0.00 178.16 177.72 1nd6 h ILE 53 N 0.25 1.17 -0.51 1.81 2.04 -1.18 -1.37 117.51 119.72 1nd6 h ILE 53 Ca 0.14 -0.48 -0.02 0.00 1.00 0.00 0.00 64.86 65.50 1nd6 h ILE 53 Cb 0.10 0.50 -0.02 0.00 -0.74 0.00 0.00 36.82 36.66 1nd6 h ILE 53 CO -0.14 0.20 0.26 -0.09 0.00 0.00 0.00 178.15 178.39 1nd6 h ARG 54 N 0.73 0.73 0.31 2.37 2.43 -0.82 -1.51 114.38 118.63 1nd6 h ARG 54 Ca 0.18 -0.10 -0.02 0.00 -0.81 0.00 0.00 59.98 59.24 1nd6 h ARG 54 Cb 0.07 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.49 1nd6 h ARG 54 CO -0.03 0.59 -0.15 0.87 -1.51 0.00 0.00 179.97 179.75 1nd6 h LYS 55 N 0.69 -0.40 -0.97 0.20 1.57 -1.05 -2.54 116.57 114.06 1nd6 h LYS 55 Ca 0.18 0.03 0.26 0.00 -1.87 0.00 0.00 60.65 59.24 1nd6 h LYS 55 Cb 0.09 0.09 -0.06 0.00 0.08 0.00 0.00 32.23 32.43 1nd6 h LYS 55 CO -0.03 -0.08 0.67 -0.09 -0.57 0.00 0.00 179.45 179.35 1nd6 h ARG 56 N -0.75 0.21 -0.51 3.15 2.43 -1.19 -1.60 114.38 116.11 1nd6 h ARG 56 Ca -0.04 -0.01 -0.33 0.00 -0.81 0.00 0.00 59.98 58.79 1nd6 h ARG 56 Cb 0.50 -0.05 -0.21 0.00 -0.42 0.00 0.00 29.97 29.80 1nd6 h ARG 56 CO 0.07 0.14 -0.17 0.66 -1.51 0.00 0.00 179.97 179.15 1nd6 n TYR 57 N -4.42 1.71 -0.00 2.20 0.53 -0.57 -4.79 117.16 111.82 1nd6 n TYR 57 Ca 0.21 -1.94 -0.09 0.00 -1.02 0.00 0.00 57.90 55.06 1nd6 n TYR 57 Cb 0.90 -0.56 -0.03 0.00 -1.03 0.00 0.00 39.34 38.62 1nd6 n TYR 57 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1nd6 h ARG 58 N 1.41 -0.12 0.00 -0.72 3.08 -0.85 0.53 114.38 117.71 1nd6 h ARG 58 Ca 0.30 0.01 -0.17 0.00 0.07 0.00 0.00 59.98 60.19 1nd6 h ARG 58 Cb 1.50 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 31.55 1nd6 h ARG 58 CO 0.61 -0.08 -0.80 1.57 -1.07 0.00 0.00 179.97 180.20 1nd6 h LYS 59 N -0.13 0.00 -0.09 0.04 2.10 -1.86 -3.02 116.57 113.61 1nd6 h LYS 59 Ca 0.08 0.00 -0.13 0.00 -2.00 0.00 0.00 60.65 58.60 1nd6 h LYS 59 Cb 0.25 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 31.58 1nd6 h LYS 59 CO -0.20 0.80 -0.44 0.35 -2.00 0.00 0.00 179.45 177.96 1nd6 h PHE 60 N 0.00 0.61 -2.25 0.07 3.57 -1.83 -3.33 116.94 113.78 1nd6 h PHE 60 Ca -0.01 -0.27 -0.71 0.00 3.53 0.00 0.00 57.97 60.51 1nd6 h PHE 60 Cb 1.57 -0.09 -0.34 0.00 2.79 0.00 0.00 35.95 39.88 1nd6 h PHE 60 CO 0.00 1.04 0.25 1.28 -2.23 0.00 0.00 178.31 178.64 1nd6 n LEU 61 N -4.30 6.02 -1.64 0.59 4.32 0.18 -4.89 117.00 117.28 1nd6 n LEU 61 Ca -0.08 -5.52 -0.05 0.00 -0.02 0.00 0.00 56.01 50.34 1nd6 n LEU 61 Cb 0.57 -0.88 0.00 0.00 -1.62 0.00 0.00 43.42 41.49 1nd6 n LEU 61 CO 0.45 2.19 1.10 -0.46 -1.22 0.00 0.00 177.39 179.44 1nd6 n ASN 62 N -0.16 5.66 -3.25 -1.43 0.23 -1.14 -4.60 115.26 110.57 1nd6 n ASN 62 Ca 0.40 -2.60 -0.04 0.00 -0.53 0.00 0.00 54.58 51.80 1nd6 n ASN 62 Cb 0.32 -1.13 -0.04 0.00 -2.08 0.00 0.00 39.78 36.86 1nd6 n ASN 62 CO 0.00 0.00 0.00 -1.61 -0.93 0.00 0.00 177.26 174.72 1nd6 s GLU 63 N -0.46 0.47 -0.87 -3.83 2.02 -1.26 -5.08 118.70 109.68 1nd6 s GLU 63 Ca 0.12 0.28 -0.11 0.00 0.02 0.00 0.00 54.97 55.28 1nd6 s GLU 63 Cb 0.09 -0.11 -0.28 0.00 0.10 0.00 0.00 34.13 33.93 1nd6 s GLU 63 CO -0.00 -1.04 2.06 0.45 0.02 0.00 0.00 175.26 176.75 1nd6 n SER 64 N 5.38 -1.07 -2.21 -0.19 2.88 -1.26 -4.07 113.62 113.07 1nd6 n SER 64 Ca 0.02 -0.79 0.00 0.00 -1.33 0.00 0.00 58.87 56.77 1nd6 n SER 64 Cb 0.51 -0.70 0.00 0.00 -0.75 0.00 0.00 64.21 63.27 1nd6 n SER 64 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1nd6 n TYR 65 N 7.32 -3.45 -3.75 0.66 9.36 -1.26 -5.02 117.16 121.03 1nd6 n TYR 65 Ca 0.58 2.05 -0.28 0.00 3.32 0.00 0.00 57.90 63.57 1nd6 n TYR 65 Cb 0.22 -2.96 -0.16 0.00 -0.63 0.00 0.00 39.34 35.80 1nd6 n TYR 65 CO 0.00 0.00 0.00 0.15 0.22 0.00 0.00 176.86 177.23 1nd6 s LYS 66 N -0.42 0.74 0.44 2.98 1.02 -1.26 -5.03 119.74 118.21 1nd6 s LYS 66 Ca 0.00 -0.52 0.21 0.00 0.02 0.00 0.00 55.97 55.68 1nd6 s LYS 66 Cb 0.00 -2.13 1.19 0.00 -0.52 0.00 0.00 37.83 36.36 1nd6 s LYS 66 CO 0.00 -0.67 1.82 1.12 -0.92 0.00 0.00 175.35 176.70 1nd6 h HIS 67 N 8.21 0.47 0.00 3.18 2.07 -1.97 0.48 115.15 127.59 1nd6 h HIS 67 Ca -0.16 0.02 0.00 0.00 -2.85 0.00 0.00 60.37 57.37 1nd6 h HIS 67 Cb 1.11 -0.14 0.00 0.00 2.57 0.00 0.00 27.41 30.95 1nd6 h HIS 67 CO 0.31 0.08 0.00 -0.85 -3.07 0.00 0.00 177.93 174.40 1nd6 n GLU 68 N -4.49 0.19 -0.00 5.12 0.00 -1.26 -2.11 120.64 118.08 1nd6 n GLU 68 Ca 0.22 0.50 0.07 0.00 0.00 0.00 0.00 57.16 57.95 1nd6 n GLU 68 Cb 0.86 -1.92 -0.08 0.00 0.00 0.00 0.00 31.44 30.29 1nd6 n GLU 68 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 1nd6 n GLN 69 N -2.28 2.08 -4.11 3.44 6.02 0.16 -4.12 117.38 118.57 1nd6 n GLN 69 Ca 0.01 -0.00 -0.16 0.00 -0.01 0.00 0.00 57.00 56.84 1nd6 n GLN 69 Cb 0.17 -1.20 -0.15 0.00 1.02 0.00 0.00 30.24 30.08 1nd6 n GLN 69 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1nd6 s VAL 70 N -2.41 0.36 -0.02 5.09 1.01 -0.90 -1.26 120.40 122.26 1nd6 s VAL 70 Ca 0.05 -0.16 0.00 0.00 0.00 0.00 0.00 61.98 61.88 1nd6 s VAL 70 Cb 0.11 -0.33 0.03 0.00 0.00 0.00 0.00 36.38 36.19 1nd6 s VAL 70 CO 0.61 0.12 0.02 -0.47 0.00 0.00 0.00 175.10 175.37 1nd6 s TYR 71 N 0.12 0.16 -0.05 5.22 5.04 -0.22 -4.70 117.35 122.93 1nd6 s TYR 71 Ca -0.01 0.07 0.05 0.00 -2.44 0.00 0.00 57.07 54.74 1nd6 s TYR 71 Cb -0.04 -0.31 -0.01 0.00 0.35 0.00 0.00 41.96 41.94 1nd6 s TYR 71 CO -0.00 -0.11 -0.21 0.42 -1.34 0.00 0.00 175.55 174.31 1nd6 s ILE 72 N 1.02 1.71 0.01 3.14 1.01 -1.26 0.06 121.20 126.89 1nd6 s ILE 72 Ca -0.09 -0.88 0.02 0.00 0.00 0.00 0.00 60.65 59.70 1nd6 s ILE 72 Cb -0.13 -1.45 -0.01 0.00 0.01 0.00 0.00 42.46 40.88 1nd6 s ILE 72 CO -0.02 0.48 -0.08 -0.60 0.00 0.00 0.00 174.94 174.72 1nd6 s ARG 73 N -0.11 0.58 0.07 2.79 3.00 0.15 -1.79 118.95 123.65 1nd6 s ARG 73 Ca -0.02 -0.40 -0.04 0.00 -1.00 0.00 0.00 55.73 54.27 1nd6 s ARG 73 Cb -0.12 -0.52 -0.03 0.00 0.00 0.00 0.00 34.95 34.28 1nd6 s ARG 73 CO 0.02 0.13 0.05 0.45 0.00 0.00 0.00 175.30 175.96 1nd6 s SER 74 N -0.56 0.36 0.70 -2.12 0.15 0.07 0.19 113.70 112.50 1nd6 s SER 74 Ca -0.00 -0.89 -0.11 0.00 0.70 0.00 0.00 55.95 55.65 1nd6 s SER 74 Cb -0.05 0.25 0.01 0.00 -1.71 0.00 0.00 66.02 64.52 1nd6 s SER 74 CO 0.00 -0.65 1.06 0.42 1.20 0.00 0.00 173.24 175.27 1nd6 s THR 75 N -3.90 3.99 -1.38 6.45 -4.23 -1.01 -4.22 115.64 111.33 1nd6 s THR 75 Ca 0.07 0.65 -0.09 0.00 -1.18 0.00 0.00 61.69 61.13 1nd6 s THR 75 Cb 0.07 -3.37 0.09 0.00 1.34 0.00 0.00 72.50 70.63 1nd6 s THR 75 CO -0.10 -0.84 2.24 -0.67 -0.54 0.00 0.00 174.62 174.71 1nd6 n ASP 76 N -3.14 6.15 -4.08 3.99 2.03 -1.25 -4.42 116.55 115.83 1nd6 n ASP 76 Ca 0.08 -2.99 -0.23 0.00 0.52 0.00 0.00 54.79 52.17 1nd6 n ASP 76 Cb 0.53 -1.50 -0.16 0.00 -0.72 0.00 0.00 41.12 39.28 1nd6 n ASP 76 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1nd6 s VAL 77 N 0.80 1.11 0.16 5.18 1.01 -1.26 -4.72 120.40 122.68 1nd6 s VAL 77 Ca 0.49 -0.56 -0.17 0.00 0.00 0.00 0.00 61.98 61.74 1nd6 s VAL 77 Cb 0.14 -0.95 0.07 0.00 0.00 0.00 0.00 36.38 35.64 1nd6 s VAL 77 CO -0.05 0.32 1.68 0.44 0.00 0.00 0.00 175.10 177.49 1nd6 h ASP 78 N 6.13 -0.33 -0.21 3.32 3.45 -1.90 -1.60 116.42 125.28 1nd6 h ASP 78 Ca -0.33 0.11 0.06 0.00 0.43 0.00 0.00 57.03 57.29 1nd6 h ASP 78 Cb 1.17 0.22 -0.01 0.00 -0.56 0.00 0.00 39.33 40.15 1nd6 h ASP 78 CO 0.48 -0.12 0.15 0.08 -1.57 0.00 0.00 179.24 178.27 1nd6 h ARG 79 N 0.00 0.00 0.16 3.56 0.11 -1.96 0.21 114.38 116.47 1nd6 h ARG 79 Ca 0.18 0.00 -0.34 0.00 0.10 0.00 0.00 59.98 59.92 1nd6 h ARG 79 Cb 0.27 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.35 1nd6 h ARG 79 CO -0.37 0.00 -1.70 1.79 0.10 0.00 0.00 179.97 179.79 1nd6 h THR 80 N 0.00 0.99 -0.45 0.08 1.35 -1.73 -2.78 112.91 110.37 1nd6 h THR 80 Ca 0.10 -2.59 -0.03 0.00 -0.55 0.00 0.00 66.41 63.34 1nd6 h THR 80 Cb 0.41 2.75 -0.02 0.00 -1.73 0.00 0.00 68.15 69.56 1nd6 h THR 80 CO -0.00 0.84 0.17 -0.07 -0.25 0.00 0.00 175.52 176.20 1nd6 h LEU 81 N 0.09 0.64 -1.07 3.87 3.38 -0.83 -1.17 115.31 120.22 1nd6 h LEU 81 Ca -0.32 -0.18 -0.06 0.00 0.09 0.00 0.00 57.88 57.41 1nd6 h LEU 81 Cb 2.08 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 42.64 1nd6 h LEU 81 CO 0.17 0.65 0.03 0.24 0.09 0.00 0.00 178.44 179.62 1nd6 h MET 82 N 0.59 0.69 -0.27 1.13 2.86 -0.72 -1.89 114.93 117.32 1nd6 h MET 82 Ca 0.15 -0.16 -0.05 0.00 -2.06 0.00 0.00 59.70 57.58 1nd6 h MET 82 Cb 0.22 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.78 1nd6 h MET 82 CO -0.01 0.69 -0.01 0.77 1.06 0.00 0.00 176.91 179.41 1nd6 h SER 83 N 0.66 0.47 0.11 1.22 0.02 -1.18 -0.82 113.55 114.03 1nd6 h SER 83 Ca 0.14 -0.32 0.00 0.00 -0.84 0.00 0.00 61.79 60.78 1nd6 h SER 83 Cb 0.37 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.77 1nd6 h SER 83 CO 0.01 0.68 -0.12 0.00 -1.14 0.00 0.00 176.83 176.26 1nd6 h ALA 84 N 0.81 -0.23 -0.41 3.77 0.00 -0.97 0.31 119.26 122.55 1nd6 h ALA 84 Ca 0.08 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1nd6 h ALA 84 Cb 0.44 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 1nd6 h ALA 84 CO 0.02 -0.65 0.26 0.52 0.00 0.00 0.00 179.25 179.40 1nd6 h MET 85 N -0.26 0.54 -0.54 0.00 2.86 -1.32 0.19 114.93 116.39 1nd6 h MET 85 Ca 0.01 -0.04 -0.00 0.00 -2.06 0.00 0.00 59.70 57.61 1nd6 h MET 85 Cb 0.25 -0.12 -0.03 0.00 0.06 0.00 0.00 31.60 31.77 1nd6 h MET 85 CO -0.04 0.37 0.34 1.15 1.06 0.00 0.00 176.91 179.79 1nd6 h THR 86 N 0.55 1.16 -0.48 2.22 2.02 -0.93 -0.54 112.91 116.90 1nd6 h THR 86 Ca 0.15 -0.33 0.04 0.00 0.77 0.00 0.00 66.41 67.04 1nd6 h THR 86 Cb -0.05 0.40 -0.04 0.00 -1.74 0.00 0.00 68.15 66.71 1nd6 h THR 86 CO -0.03 0.16 0.23 -1.13 0.37 0.00 0.00 175.52 175.12 1nd6 h ASN 87 N 0.73 0.32 0.34 4.18 -0.73 0.18 -1.99 115.58 118.62 1nd6 h ASN 87 Ca 0.20 0.03 -0.07 0.00 1.87 0.00 0.00 56.30 58.32 1nd6 h ASN 87 Cb -0.04 -0.03 -0.01 0.00 0.27 0.00 0.00 38.32 38.51 1nd6 h ASN 87 CO -0.04 0.23 -0.35 -0.07 -0.37 0.00 0.00 177.43 176.83 1nd6 h LEU 88 N 0.46 0.01 -2.88 0.34 3.38 -0.07 -2.24 115.31 114.31 1nd6 h LEU 88 Ca 0.21 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.18 1nd6 h LEU 88 Cb 0.13 -0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.88 1nd6 h LEU 88 CO -0.16 0.36 -0.00 0.00 0.09 0.00 0.00 178.44 178.73 1nd6 h ALA 89 N 1.64 1.06 0.00 1.53 0.00 -0.32 -0.42 119.26 122.75 1nd6 h ALA 89 Ca -0.00 -0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.76 1nd6 h ALA 89 Cb 0.62 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.39 1nd6 h ALA 89 CO 0.05 0.00 -2.02 0.00 0.00 0.00 0.00 179.25 177.28 1nd6 n ALA 90 N -2.11 2.18 0.09 0.00 0.00 -0.89 -4.05 120.51 115.74 1nd6 n ALA 90 Ca -0.03 -0.77 -0.23 0.00 0.00 0.00 0.00 53.44 52.41 1nd6 n ALA 90 Cb 0.08 -0.40 -0.15 0.00 0.00 0.00 0.00 19.45 18.98 1nd6 n ALA 90 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1nd6 h LEU 91 N 0.00 0.66 -5.29 0.00 6.46 -0.93 -3.38 115.31 112.82 1nd6 h LEU 91 Ca -0.22 -0.92 -0.56 0.00 -0.12 0.00 0.00 57.88 56.06 1nd6 h LEU 91 Cb 1.42 -0.21 -0.42 0.00 -0.73 0.00 0.00 40.66 40.72 1nd6 h LEU 91 CO 0.01 1.64 -0.78 0.49 -0.62 0.00 0.00 178.44 179.18 1nd6 n PHE 92 N -3.82 3.15 -2.16 1.25 3.01 -0.22 -4.83 117.46 113.84 1nd6 n PHE 92 Ca -0.19 -3.78 -0.40 0.00 1.01 0.00 0.00 57.45 54.08 1nd6 n PHE 92 Cb 1.01 -0.41 -0.02 0.00 -0.01 0.00 0.00 39.48 40.04 1nd6 n PHE 92 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 1nd6 s PRO 93 N -3.29 4.35 0.34 -1.08 0.04 -1.26 -4.72 135.00 129.39 1nd6 s PRO 93 Ca 0.46 2.15 -0.28 0.00 0.04 0.00 0.00 61.00 63.37 1nd6 s PRO 93 Cb 0.32 -3.05 -0.10 0.00 0.04 0.00 0.00 34.50 31.71 1nd6 s PRO 93 CO -0.13 -0.17 1.34 -1.25 0.04 0.00 0.00 177.00 176.83 1nd6 s PRO 94 N -1.81 4.29 -0.06 0.56 0.04 -1.26 -4.98 135.00 131.78 1nd6 s PRO 94 Ca 0.49 2.27 -0.04 0.00 0.04 0.00 0.00 61.00 63.77 1nd6 s PRO 94 Cb -0.38 -3.03 0.02 0.00 0.04 0.00 0.00 34.50 31.15 1nd6 s PRO 94 CO 0.51 -0.27 0.14 -1.83 0.04 0.00 0.00 177.00 175.59 1nd6 s GLU 95 N -1.88 0.14 7.83 4.56 -1.05 -1.26 -4.78 118.70 122.26 1nd6 s GLU 95 Ca 0.50 0.26 0.00 0.00 -0.15 0.00 0.00 54.97 55.59 1nd6 s GLU 95 Cb -0.41 -0.02 0.00 0.00 -0.44 0.00 0.00 34.13 33.26 1nd6 s GLU 95 CO 0.54 -0.08 0.00 0.41 0.95 0.00 0.00 175.26 177.09 1nd6 n GLY 96 N 3.48 3.54 0.36 -3.83 0.00 -1.26 -3.00 105.19 104.47 1nd6 n GLY 96 Ca -0.18 -0.08 0.12 0.00 0.00 0.00 0.00 46.02 45.89 1nd6 n GLY 96 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1nd6 h VAL 97 N 0.00 0.88 0.00 1.61 3.04 -2.04 -2.36 116.25 117.38 1nd6 h VAL 97 Ca 0.00 -0.17 0.00 0.00 -1.01 0.00 0.00 66.70 65.52 1nd6 h VAL 97 Cb 0.00 0.33 0.00 0.00 -2.01 0.00 0.00 31.29 29.61 1nd6 h VAL 97 CO 0.00 0.09 0.00 -1.54 -1.01 0.00 0.00 177.57 175.11 1nd6 n SER 98 N -4.49 0.00 -4.54 3.17 3.41 -1.16 -4.60 113.62 105.41 1nd6 n SER 98 Ca 0.12 -1.02 -0.42 0.00 -0.26 0.00 0.00 58.87 57.29 1nd6 n SER 98 Cb 0.41 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.34 1nd6 n SER 98 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1nd6 s ILE 99 N -2.00 4.24 0.34 -1.33 1.01 -0.89 -4.66 121.20 117.92 1nd6 s ILE 99 Ca 0.37 -1.48 0.11 0.00 0.00 0.00 0.00 60.65 59.65 1nd6 s ILE 99 Cb 0.17 -5.04 0.07 0.00 0.01 0.00 0.00 42.46 37.66 1nd6 s ILE 99 CO 0.29 -1.86 1.77 4.11 0.00 0.00 0.00 174.94 179.24 1nd6 h TRP 100 N 8.64 0.08 -3.72 3.97 5.08 -1.89 -3.40 115.95 124.71 1nd6 h TRP 100 Ca 0.28 -0.02 -0.63 0.00 1.08 0.00 0.00 58.89 59.60 1nd6 h TRP 100 Cb 0.95 -0.02 -0.38 0.00 -3.00 0.00 0.00 29.16 26.72 1nd6 h TRP 100 CO 1.29 0.47 -0.79 1.21 -1.28 0.00 0.00 178.44 179.33 1nd6 s ASN 101 N -6.91 4.10 0.35 0.11 3.84 -1.26 -5.03 114.94 110.14 1nd6 s ASN 101 Ca -0.03 -1.29 0.07 0.00 0.21 0.00 0.00 52.86 51.82 1nd6 s ASN 101 Cb 0.14 -1.33 0.76 0.00 -0.55 0.00 0.00 41.25 40.28 1nd6 s ASN 101 CO 0.74 -0.22 1.88 -0.65 -2.79 0.00 0.00 177.10 176.06 1nd6 h PRO 102 N 7.88 0.73 -0.72 0.43 0.11 -2.00 -2.53 132.00 135.90 1nd6 h PRO 102 Ca -0.18 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.89 1nd6 h PRO 102 Cb 1.06 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.00 1nd6 h PRO 102 CO 0.43 0.48 0.00 0.44 -0.21 0.00 0.00 178.00 179.15 1nd6 n ILE 103 N -4.55 1.24 -3.45 4.15 -5.35 -1.26 -4.69 119.36 105.45 1nd6 n ILE 103 Ca 0.16 -1.06 -0.24 0.00 -0.27 0.00 0.00 62.75 61.34 1nd6 n ILE 103 Cb 0.41 0.39 -0.11 0.00 -1.74 0.00 0.00 39.64 38.59 1nd6 n ILE 103 CO 0.00 0.00 0.00 -0.22 -1.76 0.00 0.00 176.55 174.57 1nd6 s LEU 104 N -1.24 0.44 -1.45 7.28 2.96 -0.95 -5.05 118.68 120.67 1nd6 s LEU 104 Ca 0.50 -1.61 -0.10 0.00 -0.22 0.00 0.00 54.13 52.70 1nd6 s LEU 104 Cb 0.28 -0.03 -0.07 0.00 0.50 0.00 0.00 46.19 46.87 1nd6 s LEU 104 CO 0.31 -0.34 2.66 0.18 -1.32 0.00 0.00 176.35 177.84 1nd6 n LEU 105 N 4.58 7.65 -3.90 -0.68 4.77 -1.26 -4.49 117.00 123.67 1nd6 n LEU 105 Ca 0.05 -4.03 -0.09 0.00 -0.03 0.00 0.00 56.01 51.91 1nd6 n LEU 105 Cb 0.41 -1.48 -0.09 0.00 -2.33 0.00 0.00 43.42 39.94 1nd6 n LEU 105 CO 0.08 1.58 -0.17 0.86 -1.33 0.00 0.00 177.39 178.41 1nd6 s TRP 106 N 2.66 0.17 -0.05 -1.77 -0.00 -1.26 -4.40 118.94 114.29 1nd6 s TRP 106 Ca 0.61 -0.48 -0.08 0.00 -0.00 0.00 0.00 56.10 56.14 1nd6 s TRP 106 Cb 0.16 -0.11 0.02 0.00 -0.00 0.00 0.00 33.47 33.53 1nd6 s TRP 106 CO -0.05 -0.41 0.20 1.14 -0.00 0.00 0.00 176.95 177.83 1nd6 s GLN 107 N -2.83 0.38 0.22 5.86 -2.07 -1.26 -4.80 119.66 115.16 1nd6 s GLN 107 Ca -0.03 0.02 -0.30 0.00 -1.82 0.00 0.00 55.36 53.23 1nd6 s GLN 107 Cb 0.00 0.17 -0.09 0.00 -1.09 0.00 0.00 33.01 32.00 1nd6 s GLN 107 CO -0.06 -0.08 1.33 -1.25 -1.32 0.00 0.00 175.29 173.92 1nd6 s PRO 108 N -0.54 4.37 -0.06 9.60 0.04 -1.26 -4.95 135.00 142.19 1nd6 s PRO 108 Ca -0.06 2.11 -0.01 0.00 0.04 0.00 0.00 61.00 63.07 1nd6 s PRO 108 Cb -0.04 -3.17 0.03 0.00 0.04 0.00 0.00 34.50 31.36 1nd6 s PRO 108 CO 0.01 -0.26 0.01 0.42 0.04 0.00 0.00 177.00 177.22 1nd6 s ILE 109 N -0.06 0.29 0.23 0.56 1.01 -1.26 -5.13 121.20 116.84 1nd6 s ILE 109 Ca 0.56 0.17 -0.32 0.00 0.00 0.00 0.00 60.65 61.06 1nd6 s ILE 109 Cb -0.38 -0.46 -0.13 0.00 0.01 0.00 0.00 42.46 41.51 1nd6 s ILE 109 CO 0.41 0.24 1.58 -0.81 0.00 0.00 0.00 174.94 176.36 1nd6 n PRO 110 N 5.13 2.45 -3.96 2.79 -0.04 -1.26 -4.98 135.00 135.13 1nd6 n PRO 110 Ca -0.07 0.88 -0.31 0.00 -0.04 0.00 0.00 63.50 63.96 1nd6 n PRO 110 Cb 0.50 -2.65 -0.15 0.00 -0.04 0.00 0.00 33.50 31.16 1nd6 n PRO 110 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1nd6 s VAL 111 N 0.49 1.84 0.50 0.52 1.01 -1.26 -4.51 120.40 118.98 1nd6 s VAL 111 Ca 0.71 -1.78 -0.18 0.00 0.00 0.00 0.00 61.98 60.73 1nd6 s VAL 111 Cb -0.57 -2.22 -0.08 0.00 0.00 0.00 0.00 36.38 33.51 1nd6 s VAL 111 CO 0.42 -0.38 1.00 -1.00 0.00 0.00 0.00 175.10 175.14 1nd6 s HIS 112 N 1.18 3.22 0.33 5.22 3.76 -0.74 -4.89 115.29 123.38 1nd6 s HIS 112 Ca 0.03 1.54 -0.15 0.00 -0.15 0.00 0.00 55.06 56.32 1nd6 s HIS 112 Cb -0.19 -2.91 0.03 0.00 1.11 0.00 0.00 32.58 30.62 1nd6 s HIS 112 CO -0.10 -0.57 0.69 -0.08 -0.85 0.00 0.00 174.74 173.84 1nd6 s THR 113 N -2.34 0.00 0.05 1.30 -1.32 -1.26 -0.75 115.64 111.32 1nd6 s THR 113 Ca 0.63 -1.12 0.00 0.00 -1.21 0.00 0.00 61.69 59.98 1nd6 s THR 113 Cb -0.12 -2.51 -0.03 0.00 -1.51 0.00 0.00 72.50 68.33 1nd6 s THR 113 CO 0.26 0.00 -0.04 -0.69 -2.21 0.00 0.00 174.62 171.93 1nd6 s VAL 114 N -3.08 0.30 0.44 5.08 1.01 -1.26 -5.02 120.40 117.87 1nd6 s VAL 114 Ca 0.17 -1.41 -0.26 0.00 0.00 0.00 0.00 61.98 60.48 1nd6 s VAL 114 Cb -0.04 -0.98 -0.09 0.00 0.00 0.00 0.00 36.38 35.27 1nd6 s VAL 114 CO 0.11 -0.72 1.44 -0.81 0.00 0.00 0.00 175.10 175.12 1nd6 n PRO 115 N 0.80 2.33 -0.03 2.72 -0.04 -1.26 -3.84 135.00 135.67 1nd6 n PRO 115 Ca -0.18 0.83 -0.14 0.00 -0.04 0.00 0.00 63.50 63.96 1nd6 n PRO 115 Cb 0.58 -2.63 -0.10 0.00 -0.04 0.00 0.00 33.50 31.31 1nd6 n PRO 115 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1nd6 h LEU 116 N 2.42 -1.69 -0.19 1.53 3.38 -1.98 0.52 115.31 119.30 1nd6 h LEU 116 Ca -0.51 0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.67 1nd6 h LEU 116 Cb 1.26 0.66 0.00 0.00 0.09 0.00 0.00 40.66 42.68 1nd6 h LEU 116 CO 0.61 -0.45 0.21 -1.54 0.09 0.00 0.00 178.44 177.36 1nd6 n SER 117 N -5.29 0.07 -0.11 -0.43 3.41 -1.26 -0.49 113.62 109.52 1nd6 n SER 117 Ca -0.05 0.36 0.01 0.00 -0.26 0.00 0.00 58.87 58.94 1nd6 n SER 117 Cb 0.35 -0.35 0.01 0.00 -0.26 0.00 0.00 64.21 63.96 1nd6 n SER 117 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1nd6 n GLU 118 N -1.47 -0.26 -1.68 4.33 1.02 0.07 -5.00 120.64 117.65 1nd6 n GLU 118 Ca -0.00 -0.65 -0.43 0.00 -0.02 0.00 0.00 57.16 56.06 1nd6 n GLU 118 Cb 0.21 -1.04 -0.03 0.00 -0.02 0.00 0.00 31.44 30.57 1nd6 n GLU 118 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1nd6 s ASP 119 N -0.30 5.50 -0.04 1.62 -1.08 0.36 -4.81 116.67 117.92 1nd6 s ASP 119 Ca 0.03 1.76 0.21 0.00 -0.52 0.00 0.00 52.55 54.03 1nd6 s ASP 119 Cb 0.02 -2.51 0.68 0.00 -1.46 0.00 0.00 42.92 39.65 1nd6 s ASP 119 CO 0.04 -1.94 1.58 0.00 0.52 0.00 0.00 175.17 175.37 1nd6 n GLN 120 N 8.71 3.09 0.00 4.34 6.02 -1.26 -4.55 117.38 133.73 1nd6 n GLN 120 Ca 0.29 -2.76 0.00 0.00 -0.01 0.00 0.00 57.00 54.52 1nd6 n GLN 120 Cb 0.46 -1.69 0.00 0.00 1.02 0.00 0.00 30.24 30.03 1nd6 n GLN 120 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.06 175.94 1nd6 n LEU 121 N 1.50 0.00 -0.04 1.08 7.94 -1.26 -4.96 117.00 121.26 1nd6 n LEU 121 Ca 0.25 0.01 0.01 0.00 -1.11 0.00 0.00 56.01 55.17 1nd6 n LEU 121 Cb 0.72 0.00 -0.13 0.00 0.53 0.00 0.00 43.42 44.55 1nd6 n LEU 121 CO 0.19 -0.38 -0.84 0.18 -1.11 0.00 0.00 177.39 175.44 1nd6 n LEU 122 N -2.64 0.00 -3.69 -1.96 4.77 -1.26 -4.67 117.00 107.55 1nd6 n LEU 122 Ca 0.00 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.56 1nd6 n LEU 122 Cb 0.13 0.17 -0.02 0.00 -2.33 0.00 0.00 43.42 41.37 1nd6 n LEU 122 CO 0.00 0.17 2.53 0.00 -1.33 0.00 0.00 177.39 178.76 1nd6 n TYR 123 N -2.30 3.05 -3.17 -1.77 -0.00 -1.26 -4.67 117.16 107.03 1nd6 n TYR 123 Ca -0.13 -2.64 -0.30 0.00 -0.00 0.00 0.00 57.90 54.83 1nd6 n TYR 123 Cb 0.69 -2.31 -0.04 0.00 -0.00 0.00 0.00 39.34 37.68 1nd6 n TYR 123 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.86 176.35 1nd6 s LEU 124 N 1.88 4.00 0.28 2.98 1.02 -1.26 -4.07 118.68 123.51 1nd6 s LEU 124 Ca 0.50 0.93 -0.21 0.00 0.02 0.00 0.00 54.13 55.37 1nd6 s LEU 124 Cb 0.14 -3.76 -0.09 0.00 0.02 0.00 0.00 46.19 42.50 1nd6 s LEU 124 CO -0.03 -0.25 0.81 -2.16 0.02 0.00 0.00 176.35 174.74 1nd6 s PRO 125 N -3.49 4.30 0.26 1.29 0.04 -1.26 -4.54 135.00 131.60 1nd6 s PRO 125 Ca 0.48 0.99 -0.30 0.00 0.04 0.00 0.00 61.00 62.21 1nd6 s PRO 125 Cb -0.11 -2.73 -0.10 0.00 0.04 0.00 0.00 34.50 31.61 1nd6 s PRO 125 CO 0.28 0.29 1.44 -0.06 0.04 0.00 0.00 177.00 178.99 1nd6 s PHE 126 N -1.68 2.99 -0.25 0.56 0.08 -1.26 -4.93 117.98 113.50 1nd6 s PHE 126 Ca 0.48 1.05 0.13 0.00 0.12 0.00 0.00 56.93 58.71 1nd6 s PHE 126 Cb -0.15 -3.83 0.30 0.00 -0.57 0.00 0.00 43.02 38.76 1nd6 s PHE 126 CO 0.20 -2.67 1.21 0.54 -0.10 0.00 0.00 175.22 174.40 1nd6 n ARG 127 N 2.13 2.37 -2.04 0.44 1.74 -1.26 -4.60 116.66 115.44 1nd6 n ARG 127 Ca 0.06 -2.34 -0.29 0.00 -0.77 0.00 0.00 57.85 54.51 1nd6 n ARG 127 Cb 0.40 -1.45 0.03 0.00 -1.02 0.00 0.00 32.46 30.42 1nd6 n ARG 127 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 1nd6 n ASN 128 N -0.66 5.74 -3.63 0.55 2.04 -1.26 -4.89 115.26 113.14 1nd6 n ASN 128 Ca 0.13 -3.76 -0.29 0.00 -0.44 0.00 0.00 54.58 50.22 1nd6 n ASN 128 Cb 0.59 -0.60 -0.14 0.00 -2.53 0.00 0.00 39.78 37.10 1nd6 n ASN 128 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1nd6 h PRO 130 N 7.55 -0.16 -1.01 0.00 0.11 -1.87 -0.33 132.00 136.29 1nd6 h PRO 130 Ca -0.07 0.01 0.24 0.00 0.11 0.00 0.00 66.00 66.29 1nd6 h PRO 130 Cb 0.98 0.04 -0.11 0.00 0.11 0.00 0.00 31.00 32.02 1nd6 h PRO 130 CO 0.42 -0.11 0.62 -0.09 -0.21 0.00 0.00 178.00 178.63 1nd6 h ARG 131 N -0.17 0.54 -0.10 1.05 9.65 -0.41 0.32 114.38 125.27 1nd6 h ARG 131 Ca 0.17 -0.03 -0.22 0.00 -1.10 0.00 0.00 59.98 58.80 1nd6 h ARG 131 Cb 0.43 -0.12 0.01 0.00 -1.39 0.00 0.00 29.97 28.90 1nd6 h ARG 131 CO -0.44 0.36 -0.82 0.35 2.80 0.00 0.00 179.97 182.22 1nd6 h PHE 132 N 0.56 0.91 -0.81 2.20 3.57 -1.46 -2.63 116.94 119.28 1nd6 h PHE 132 Ca 0.62 -0.42 0.03 0.00 3.53 0.00 0.00 57.97 61.73 1nd6 h PHE 132 Cb 1.25 -0.13 -0.04 0.00 2.79 0.00 0.00 35.95 39.81 1nd6 h PHE 132 CO -0.00 1.24 0.54 0.37 -2.23 0.00 0.00 178.31 178.22 1nd6 h GLN 133 N 0.43 1.00 0.17 1.11 -0.00 0.11 -1.52 115.11 116.42 1nd6 h GLN 133 Ca -0.06 -0.06 -0.01 0.00 -0.00 0.00 0.00 58.65 58.52 1nd6 h GLN 133 Cb 1.44 -0.23 0.00 0.00 0.00 0.00 0.00 27.48 28.69 1nd6 h GLN 133 CO 0.16 0.66 -0.08 0.93 0.00 0.00 0.00 178.83 180.50 1nd6 h GLU 134 N 1.03 -0.22 -0.98 1.69 5.08 -0.80 -3.05 114.58 117.34 1nd6 h GLU 134 Ca 0.32 0.02 0.21 0.00 -1.00 0.00 0.00 59.36 58.91 1nd6 h GLU 134 Cb -0.01 0.05 -0.09 0.00 0.50 0.00 0.00 28.75 29.20 1nd6 h GLU 134 CO -0.09 0.09 0.62 -0.07 -1.00 0.00 0.00 179.01 178.56 1nd6 h LEU 135 N -0.54 0.59 0.01 1.33 3.38 -1.04 0.48 115.31 119.52 1nd6 h LEU 135 Ca -0.02 0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 1nd6 h LEU 135 Cb 0.41 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1nd6 h LEU 135 CO 0.04 0.19 -0.00 -0.33 0.09 0.00 0.00 178.44 178.43 1nd6 h GLU 136 N 0.56 -0.01 -0.58 1.13 5.08 -1.19 0.81 114.58 120.39 1nd6 h GLU 136 Ca 0.55 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.86 1nd6 h GLU 136 Cb 1.14 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.36 1nd6 h GLU 136 CO -0.30 -0.00 0.16 0.66 -1.00 0.00 0.00 179.01 178.53 1nd6 h SER 137 N -0.01 0.86 -0.62 1.42 4.64 -1.11 -2.21 113.55 116.51 1nd6 h SER 137 Ca -0.00 -0.22 0.06 0.00 -0.47 0.00 0.00 61.79 61.16 1nd6 h SER 137 Cb 0.01 -0.23 -0.06 0.00 -0.31 0.00 0.00 62.40 61.82 1nd6 h SER 137 CO 0.00 0.86 0.32 -0.33 -0.87 0.00 0.00 176.83 176.81 1nd6 h GLU 138 N 0.82 0.58 -0.99 4.77 5.08 -0.68 0.17 114.58 124.34 1nd6 h GLU 138 Ca 0.18 -0.03 0.15 0.00 -1.00 0.00 0.00 59.36 58.66 1nd6 h GLU 138 Cb 0.32 -0.13 -0.09 0.00 0.50 0.00 0.00 28.75 29.35 1nd6 h GLU 138 CO -0.00 0.38 0.62 1.15 -1.00 0.00 0.00 179.01 180.16 1nd6 h THR 139 N 0.60 0.83 -0.44 1.13 2.02 -0.32 0.14 112.91 116.87 1nd6 h THR 139 Ca 0.29 -0.30 -0.02 0.00 0.77 0.00 0.00 66.41 67.15 1nd6 h THR 139 Cb 0.21 -0.11 -0.02 0.00 -1.74 0.00 0.00 68.15 66.50 1nd6 h THR 139 CO -0.20 0.16 0.20 -0.07 0.37 0.00 0.00 175.52 175.98 1nd6 h LEU 140 N 0.86 0.59 -0.02 2.58 4.07 -0.40 -2.11 115.31 120.89 1nd6 h LEU 140 Ca 0.52 -0.14 0.00 0.00 0.08 0.00 0.00 57.88 58.33 1nd6 h LEU 140 Cb 0.68 -0.15 0.00 0.00 1.08 0.00 0.00 40.66 42.27 1nd6 h LEU 140 CO -0.29 0.57 -0.01 0.29 -1.08 0.00 0.00 178.44 177.92 1nd6 n LYS 141 N -4.64 0.58 -1.87 1.13 4.01 -0.45 -4.61 118.16 112.31 1nd6 n LYS 141 Ca 0.01 -0.02 -0.41 0.00 -0.51 0.00 0.00 58.31 57.38 1nd6 n LYS 141 Cb 0.13 -1.50 -0.01 0.00 -0.51 0.00 0.00 35.03 33.14 1nd6 n LYS 141 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 1nd6 s SER 142 N -2.44 6.46 0.09 4.39 0.15 0.38 -4.92 113.70 117.82 1nd6 s SER 142 Ca 0.33 2.91 -0.17 0.00 0.70 0.00 0.00 55.95 59.72 1nd6 s SER 142 Cb 0.21 -2.65 -0.07 0.00 -1.71 0.00 0.00 66.02 61.80 1nd6 s SER 142 CO 0.44 -0.81 1.49 -0.33 1.20 0.00 0.00 173.24 175.23 1nd6 h GLU 143 N 3.91 0.55 -0.15 5.44 4.39 -1.89 -2.06 114.58 124.78 1nd6 h GLU 143 Ca -0.49 -0.21 0.04 0.00 0.34 0.00 0.00 59.36 59.05 1nd6 h GLU 143 Cb 1.23 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.84 1nd6 h GLU 143 CO 0.71 0.75 0.11 1.49 -1.16 0.00 0.00 179.01 180.91 1nd6 h GLU 144 N 0.32 0.00 0.02 2.33 4.57 -1.93 -1.07 114.58 118.82 1nd6 h GLU 144 Ca 0.07 0.00 -0.14 0.00 -1.18 0.00 0.00 59.36 58.11 1nd6 h GLU 144 Cb 0.54 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 29.15 1nd6 h GLU 144 CO 0.03 0.00 -0.56 0.35 -1.18 0.00 0.00 179.01 177.65 1nd6 h PHE 145 N 0.00 0.53 -0.26 0.92 3.57 -1.74 -3.27 116.94 116.69 1nd6 h PHE 145 Ca 0.07 -0.30 -0.03 0.00 3.53 0.00 0.00 57.97 61.24 1nd6 h PHE 145 Cb 0.28 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.95 1nd6 h PHE 145 CO 0.00 1.13 0.05 1.96 -2.23 0.00 0.00 178.31 179.22 1nd6 h GLN 146 N -0.22 0.37 0.21 1.11 1.08 -0.77 -1.79 115.11 115.10 1nd6 h GLN 146 Ca -0.07 -0.05 0.00 0.00 -1.45 0.00 0.00 58.65 57.07 1nd6 h GLN 146 Cb 1.29 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 28.64 1nd6 h GLN 146 CO 0.11 0.36 -0.19 0.87 -0.95 0.00 0.00 178.83 179.04 1nd6 h LYS 147 N 0.37 -0.40 -0.53 1.46 6.56 -1.27 0.19 116.57 122.94 1nd6 h LYS 147 Ca 0.09 0.03 -0.06 0.00 -1.06 0.00 0.00 60.65 59.65 1nd6 h LYS 147 Cb 0.18 0.09 -0.02 0.00 -0.57 0.00 0.00 32.23 31.90 1nd6 h LYS 147 CO -0.00 -0.27 0.11 0.00 -2.06 0.00 0.00 179.45 177.23 1nd6 h ARG 148 N -0.42 0.83 -0.05 3.15 3.08 -1.52 -3.19 114.38 116.26 1nd6 h ARG 148 Ca -0.00 -0.18 -0.12 0.00 0.07 0.00 0.00 59.98 59.74 1nd6 h ARG 148 Cb 0.38 -0.12 0.01 0.00 0.08 0.00 0.00 29.97 30.32 1nd6 h ARG 148 CO -0.03 0.76 -0.45 1.25 -1.07 0.00 0.00 179.97 180.43 1nd6 h LEU 149 N 0.80 0.48 -0.72 3.04 5.85 -1.09 -3.36 115.31 120.31 1nd6 h LEU 149 Ca 0.17 -0.69 0.13 0.00 0.84 0.00 0.00 57.88 58.33 1nd6 h LEU 149 Cb 0.33 -0.14 -0.13 0.00 0.37 0.00 0.00 40.66 41.08 1nd6 h LEU 149 CO 0.00 1.10 -0.22 1.57 -0.34 0.00 0.00 178.44 180.56 1nd6 n HIS 150 N -4.32 0.17 0.01 1.25 -0.00 0.63 0.01 115.22 112.98 1nd6 n HIS 150 Ca -0.09 0.88 0.01 0.00 0.46 0.00 0.00 57.72 58.98 1nd6 n HIS 150 Cb 0.58 -0.86 0.04 0.00 -0.12 0.00 0.00 29.99 29.63 1nd6 n HIS 150 CO 0.00 0.00 0.00 -2.30 0.46 0.00 0.00 176.34 174.50 1nd6 n PRO 151 N -5.13 0.01 -0.00 1.57 -0.02 -1.26 -2.14 135.00 128.03 1nd6 n PRO 151 Ca 0.10 0.43 0.04 0.00 -2.02 0.00 0.00 63.50 62.06 1nd6 n PRO 151 Cb 0.33 -1.61 -0.05 0.00 -0.02 0.00 0.00 33.50 32.15 1nd6 n PRO 151 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1nd6 n TYR 152 N -1.48 0.00 -0.36 6.00 4.02 0.10 -4.75 117.16 120.69 1nd6 n TYR 152 Ca -0.00 0.00 0.27 0.00 -0.01 0.00 0.00 57.90 58.16 1nd6 n TYR 152 Cb 0.08 -0.07 0.53 0.00 -0.02 0.00 0.00 39.34 39.87 1nd6 n TYR 152 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 176.86 176.72 1nd6 h LYS 153 N 0.00 0.27 -0.18 -0.72 1.57 -1.43 0.36 116.57 116.45 1nd6 h LYS 153 Ca 0.00 -0.02 -0.13 0.00 -1.87 0.00 0.00 60.65 58.63 1nd6 h LYS 153 Cb 0.27 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.52 1nd6 h LYS 153 CO 0.00 0.18 -0.41 -0.44 -0.57 0.00 0.00 179.45 178.21 1nd6 h ASP 154 N 0.28 0.67 0.67 0.86 5.19 -1.85 -1.79 116.42 120.44 1nd6 h ASP 154 Ca 0.72 -0.57 -0.03 0.00 -0.62 0.00 0.00 57.03 56.54 1nd6 h ASP 154 Cb 1.88 -0.19 -0.00 0.00 0.18 0.00 0.00 39.33 41.20 1nd6 h ASP 154 CO -0.48 1.11 -0.39 0.15 -3.12 0.00 0.00 179.24 176.52 1nd6 h PHE 155 N 0.25 -1.02 -0.90 4.55 3.57 -1.08 -2.02 116.94 120.29 1nd6 h PHE 155 Ca -0.00 -0.01 0.23 0.00 3.53 0.00 0.00 57.97 61.72 1nd6 h PHE 155 Cb 1.02 0.36 -0.13 0.00 2.79 0.00 0.00 35.95 39.99 1nd6 h PHE 155 CO 0.09 -0.60 0.35 0.82 -2.23 0.00 0.00 178.31 176.75 1nd6 h ILE 156 N -0.99 0.41 -0.35 1.41 2.04 -0.45 0.18 117.51 119.76 1nd6 h ILE 156 Ca -0.08 -0.11 -0.02 0.00 1.00 0.00 0.00 64.86 65.65 1nd6 h ILE 156 Cb 0.79 0.05 -0.02 0.00 -0.74 0.00 0.00 36.82 36.91 1nd6 h ILE 156 CO 0.10 0.06 0.15 0.00 0.00 0.00 0.00 178.15 178.46 1nd6 h ALA 157 N 1.74 0.45 -0.00 1.87 0.00 -0.83 -2.01 119.26 120.48 1nd6 h ALA 157 Ca 0.57 -0.12 -0.17 0.00 0.00 0.00 0.00 54.91 55.19 1nd6 h ALA 157 Cb 1.13 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.76 1nd6 h ALA 157 CO -0.58 0.04 -0.79 1.79 0.00 0.00 0.00 179.25 179.71 1nd6 h THR 158 N 0.42 1.54 0.00 0.00 1.35 -0.53 -2.90 112.91 112.79 1nd6 h THR 158 Ca 0.12 -2.64 -0.02 0.00 -0.55 0.00 0.00 66.41 63.33 1nd6 h THR 158 Cb 0.16 2.43 -0.00 0.00 -1.73 0.00 0.00 68.15 69.01 1nd6 h THR 158 CO -0.01 0.76 -0.07 0.25 -0.25 0.00 0.00 175.52 176.19 1nd6 h LEU 159 N 0.03 0.00 -0.79 3.87 7.12 -0.48 -1.91 115.31 123.14 1nd6 h LEU 159 Ca -0.01 0.00 -0.06 0.00 0.13 0.00 0.00 57.88 57.94 1nd6 h LEU 159 Cb 1.39 0.00 -0.03 0.00 -0.53 0.00 0.00 40.66 41.49 1nd6 h LEU 159 CO 0.11 0.07 0.23 1.23 -0.13 0.00 0.00 178.44 179.95 1nd6 h GLY 160 N 0.24 1.23 1.40 3.75 0.00 -1.15 -0.29 103.07 108.24 1nd6 h GLY 160 Ca -0.00 -0.72 -0.10 0.00 0.00 0.00 0.00 47.33 46.51 1nd6 h GLY 160 CO 0.01 0.67 -0.17 1.70 0.00 0.00 0.00 176.54 178.75 1nd6 h LYS 161 N 1.10 0.71 -0.03 4.80 3.64 -1.43 0.95 116.57 126.29 1nd6 h LYS 161 Ca 0.24 -0.26 -0.17 0.00 -1.27 0.00 0.00 60.65 59.19 1nd6 h LYS 161 Cb 0.30 -0.05 0.01 0.00 -0.41 0.00 0.00 32.23 32.09 1nd6 h LYS 161 CO -0.01 0.84 -0.65 -0.07 -2.27 0.00 0.00 179.45 177.29 1nd6 h LEU 162 N 0.63 0.63 0.00 5.20 3.38 -1.29 -3.35 115.31 120.51 1nd6 h LEU 162 Ca 0.10 -0.72 -0.16 0.00 0.09 0.00 0.00 57.88 57.19 1nd6 h LEU 162 Cb 0.65 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.18 1nd6 h LEU 162 CO 0.05 1.26 -1.29 0.77 0.09 0.00 0.00 178.44 179.32 1nd6 h SER 163 N 0.06 0.00 0.00 -0.43 4.64 -1.10 -3.44 113.55 113.29 1nd6 h SER 163 Ca -0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.25 1nd6 h SER 163 Cb 1.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.42 1nd6 h SER 163 CO 0.13 0.55 0.00 0.61 -0.87 0.00 0.00 176.83 177.25 1nd6 n GLY 164 N 1.37 0.75 3.18 -0.77 0.00 0.32 -2.09 105.19 107.95 1nd6 n GLY 164 Ca -0.08 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.55 1nd6 n GLY 164 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1nd6 s LEU 165 N 0.00 5.40 0.45 0.99 2.96 -1.19 -4.78 118.68 122.51 1nd6 s LEU 165 Ca 0.00 -1.90 -0.03 0.00 -0.22 0.00 0.00 54.13 51.98 1nd6 s LEU 165 Cb 0.00 -1.92 -0.03 0.00 0.50 0.00 0.00 46.19 44.74 1nd6 s LEU 165 CO 0.00 -0.60 0.72 -1.00 -1.32 0.00 0.00 176.35 174.15 1nd6 s HIS 166 N 1.27 3.49 0.00 5.38 3.76 -1.26 -4.33 115.29 123.60 1nd6 s HIS 166 Ca 0.06 0.62 0.00 0.00 -0.15 0.00 0.00 55.06 55.59 1nd6 s HIS 166 Cb -0.24 -2.22 0.00 0.00 1.11 0.00 0.00 32.58 31.22 1nd6 s HIS 166 CO -0.02 -0.22 0.00 0.41 -0.85 0.00 0.00 174.74 174.06 1nd6 n GLY 167 N -2.14 2.96 1.30 -2.22 0.00 -1.26 -4.87 105.19 98.97 1nd6 n GLY 167 Ca -0.01 -2.00 0.10 0.00 0.00 0.00 0.00 46.02 44.11 1nd6 n GLY 167 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1nd6 n GLN 168 N -0.60 2.99 -2.04 1.61 6.02 -1.26 -4.93 117.38 119.17 1nd6 n GLN 168 Ca 0.00 -2.64 -0.43 0.00 -0.01 0.00 0.00 57.00 53.92 1nd6 n GLN 168 Cb 0.00 -1.61 -0.03 0.00 1.02 0.00 0.00 30.24 29.63 1nd6 n GLN 168 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1nd6 s ASP 169 N -1.00 6.16 0.39 1.08 2.15 -1.26 -4.88 116.67 119.31 1nd6 s ASP 169 Ca 0.46 1.53 0.15 0.00 0.43 0.00 0.00 52.55 55.12 1nd6 s ASP 169 Cb 0.26 -2.53 0.79 0.00 -0.30 0.00 0.00 42.92 41.14 1nd6 s ASP 169 CO 0.29 -1.45 1.83 -0.07 -0.17 0.00 0.00 175.17 175.60 1nd6 h LEU 170 N 12.54 0.00 -0.62 -1.34 3.38 -1.93 -2.83 115.31 124.50 1nd6 h LEU 170 Ca -0.34 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.50 1nd6 h LEU 170 Cb 1.16 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.90 1nd6 h LEU 170 CO 1.01 0.35 -0.30 0.15 0.09 0.00 0.00 178.44 179.75 1nd6 h PHE 171 N 0.00 0.89 -0.11 1.13 3.57 -1.92 -0.61 116.94 119.89 1nd6 h PHE 171 Ca -0.00 -0.23 -0.00 0.00 3.53 0.00 0.00 57.97 61.26 1nd6 h PHE 171 Cb 0.67 -0.20 -0.00 0.00 2.79 0.00 0.00 35.95 39.21 1nd6 h PHE 171 CO 0.00 0.97 0.05 0.78 -2.23 0.00 0.00 178.31 177.88 1nd6 h GLY 172 N 0.95 0.17 0.80 2.40 0.00 -1.91 -1.63 103.07 103.84 1nd6 h GLY 172 Ca 0.08 -0.09 0.04 0.00 0.00 0.00 0.00 47.33 47.36 1nd6 h GLY 172 CO 0.07 0.08 0.36 -2.22 0.00 0.00 0.00 176.54 174.84 1nd6 h ILE 173 N 0.04 1.03 0.73 2.60 2.04 -1.30 0.77 117.51 123.43 1nd6 h ILE 173 Ca 0.04 -0.24 -0.04 0.00 1.00 0.00 0.00 64.86 65.62 1nd6 h ILE 173 Cb 0.13 0.27 0.01 0.00 -0.74 0.00 0.00 36.82 36.49 1nd6 h ILE 173 CO -0.00 0.13 -0.35 -0.25 0.00 0.00 0.00 178.15 177.67 1nd6 h TRP 174 N 0.70 -0.91 -0.48 1.37 7.01 -0.94 -0.69 115.95 122.01 1nd6 h TRP 174 Ca 0.26 -0.02 -0.10 0.00 2.11 0.00 0.00 58.89 61.14 1nd6 h TRP 174 Cb 0.08 0.30 -0.02 0.00 -2.10 0.00 0.00 29.16 27.43 1nd6 h TRP 174 CO -0.07 -0.57 -0.12 0.66 -2.79 0.00 0.00 178.44 175.56 1nd6 h SER 175 N -1.08 0.88 -0.02 2.65 4.64 -1.27 -0.11 113.55 119.24 1nd6 h SER 175 Ca -0.10 -0.28 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 1nd6 h SER 175 Cb 0.75 -0.24 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 1nd6 h SER 175 CO 0.17 1.01 -0.32 0.29 -0.87 0.00 0.00 176.83 177.10 1nd6 n LYS 176 N -4.15 1.53 0.08 4.77 5.02 0.26 -4.34 118.16 121.33 1nd6 n LYS 176 Ca 0.01 -1.18 0.00 0.00 -2.02 0.00 0.00 58.31 55.12 1nd6 n LYS 176 Cb 0.39 -1.43 0.00 0.00 -0.02 0.00 0.00 35.03 33.97 1nd6 n LYS 176 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1nd6 n VAL 177 N 0.30 0.60 0.28 -0.18 0.31 -0.74 -1.37 118.33 117.53 1nd6 n VAL 177 Ca 0.10 0.20 -0.14 0.00 -0.01 0.00 0.00 64.34 64.48 1nd6 n VAL 177 Cb 0.47 -1.10 -0.07 0.00 -0.91 0.00 0.00 33.84 32.22 1nd6 n VAL 177 CO 0.00 0.00 0.00 0.22 -1.32 0.00 0.00 176.83 175.73 1nd6 h TYR 178 N 0.00 -0.68 -0.46 3.52 3.20 -1.06 -2.69 116.97 118.80 1nd6 h TYR 178 Ca 0.00 -0.02 0.09 0.00 3.14 0.00 0.00 58.73 61.95 1nd6 h TYR 178 Cb 0.07 0.22 -0.09 0.00 1.54 0.00 0.00 36.73 38.48 1nd6 h TYR 178 CO 0.00 -0.35 -0.16 0.22 -1.64 0.00 0.00 178.16 176.23 1nd6 h ASP 179 N -1.02 -0.57 -0.11 -2.11 3.58 -1.24 0.27 116.42 115.22 1nd6 h ASP 179 Ca -0.07 0.15 0.01 0.00 0.42 0.00 0.00 57.03 57.54 1nd6 h ASP 179 Cb 0.63 0.34 -0.01 0.00 1.72 0.00 0.00 39.33 42.01 1nd6 h ASP 179 CO 0.12 -0.20 0.04 -0.65 -2.88 0.00 0.00 179.24 175.67 1nd6 h PRO 180 N -0.06 0.09 -0.71 0.28 0.11 -1.76 0.18 132.00 130.12 1nd6 h PRO 180 Ca 0.22 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.31 1nd6 h PRO 180 Cb 0.40 -0.02 -0.03 0.00 0.11 0.00 0.00 31.00 31.45 1nd6 h PRO 180 CO -0.50 0.06 0.37 -0.07 -0.21 0.00 0.00 178.00 177.64 1nd6 h LEU 181 N 0.09 0.89 -0.16 2.35 3.38 -1.08 -0.69 115.31 120.09 1nd6 h LEU 181 Ca 0.04 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 1nd6 h LEU 181 Cb 0.02 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 1nd6 h LEU 181 CO -0.05 0.74 -0.01 0.22 0.09 0.00 0.00 178.44 179.43 1nd6 h TYR 182 N 1.00 0.31 -0.87 1.13 3.20 0.08 -1.66 116.97 120.16 1nd6 h TYR 182 Ca 0.25 -0.06 -0.02 0.00 3.14 0.00 0.00 58.73 62.04 1nd6 h TYR 182 Cb 0.06 -0.08 -0.04 0.00 1.54 0.00 0.00 36.73 38.21 1nd6 h TYR 182 CO 0.01 0.52 0.47 0.00 -1.64 0.00 0.00 178.16 177.52 1nd6 h GLU 184 N 1.21 0.00 -0.04 0.00 4.11 -1.11 -2.83 114.58 115.93 1nd6 h GLU 184 Ca 0.31 0.00 -0.24 0.00 0.07 0.00 0.00 59.36 59.49 1nd6 h GLU 184 Cb 0.03 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.30 1nd6 h GLU 184 CO -0.05 0.30 -0.92 0.66 0.07 0.00 0.00 179.01 179.07 1nd6 h SER 185 N 0.00 0.88 -1.00 3.06 4.64 -0.77 0.22 113.55 120.59 1nd6 h SER 185 Ca -0.00 -0.71 0.05 0.00 -0.47 0.00 0.00 61.79 60.66 1nd6 h SER 185 Cb 0.99 -0.27 -0.06 0.00 -0.31 0.00 0.00 62.40 62.75 1nd6 h SER 185 CO 0.04 1.47 0.65 0.58 -0.87 0.00 0.00 176.83 178.70 1nd6 h VAL 186 N 0.37 1.12 -0.29 0.95 2.07 -1.21 -1.08 116.25 118.18 1nd6 h VAL 186 Ca -0.10 -0.41 0.00 0.00 0.82 0.00 0.00 66.70 67.00 1nd6 h VAL 186 Cb 1.58 -0.19 0.00 0.00 -1.52 0.00 0.00 31.29 31.16 1nd6 h VAL 186 CO 0.18 0.22 0.00 1.41 0.02 0.00 0.00 177.57 179.40 1nd6 n HIS 187 N -4.47 0.44 -3.37 1.57 8.25 -1.07 -4.92 115.22 111.64 1nd6 n HIS 187 Ca 0.15 -0.21 -0.19 0.00 -0.26 0.00 0.00 57.72 57.21 1nd6 n HIS 187 Cb 0.15 -0.02 0.07 0.00 1.12 0.00 0.00 29.99 31.31 1nd6 n HIS 187 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1nd6 n ASN 188 N 0.36 -4.70 -4.63 0.41 3.02 -0.41 -4.99 115.26 104.31 1nd6 n ASN 188 Ca 0.10 -0.47 -0.37 0.00 -0.03 0.00 0.00 54.58 53.80 1nd6 n ASN 188 Cb 0.28 -4.35 -0.10 0.00 -0.61 0.00 0.00 39.78 35.01 1nd6 n ASN 188 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1nd6 s PHE 189 N -3.28 3.29 -0.00 3.10 2.99 0.74 -5.02 117.98 119.79 1nd6 s PHE 189 Ca 0.36 0.27 -0.30 0.00 0.00 0.00 0.00 56.93 57.26 1nd6 s PHE 189 Cb -0.16 -2.37 -0.08 0.00 0.00 0.00 0.00 43.02 40.41 1nd6 s PHE 189 CO 0.62 -0.05 1.95 -0.08 -0.00 0.00 0.00 175.22 177.66 1nd6 s THR 190 N 1.42 3.10 0.91 0.64 -1.32 -1.26 -4.45 115.64 114.67 1nd6 s THR 190 Ca 0.10 0.12 -0.13 0.00 -1.21 0.00 0.00 61.69 60.56 1nd6 s THR 190 Cb -0.15 -3.08 0.14 0.00 -1.51 0.00 0.00 72.50 67.90 1nd6 s THR 190 CO 0.07 -0.02 1.17 -0.76 -2.21 0.00 0.00 174.62 172.88 1nd6 s LEU 191 N 4.81 2.14 0.61 9.08 1.43 -1.26 -5.03 118.68 130.45 1nd6 s LEU 191 Ca 0.88 0.80 -0.17 0.00 -1.03 0.00 0.00 54.13 54.61 1nd6 s LEU 191 Cb -0.40 -3.09 -0.03 0.00 0.03 0.00 0.00 46.19 42.70 1nd6 s LEU 191 CO 0.39 -2.52 1.12 -2.16 0.23 0.00 0.00 176.35 173.41 1nd6 s PRO 192 N -5.44 3.04 0.51 1.29 0.04 -1.26 -4.91 135.00 128.27 1nd6 s PRO 192 Ca 0.65 1.50 0.21 0.00 0.04 0.00 0.00 61.00 63.40 1nd6 s PRO 192 Cb -0.12 -1.97 1.30 0.00 0.04 0.00 0.00 34.50 33.74 1nd6 s PRO 192 CO 0.52 -1.08 2.02 0.77 0.04 0.00 0.00 177.00 179.27 1nd6 h SER 193 N 0.55 0.08 0.57 6.66 0.02 -2.04 -1.29 113.55 118.10 1nd6 h SER 193 Ca -0.48 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.47 1nd6 h SER 193 Cb 1.25 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.78 1nd6 h SER 193 CO 0.55 0.05 0.00 -2.67 -1.14 0.00 0.00 176.83 173.62 1nd6 n TRP 194 N -4.43 0.00 -1.44 3.45 4.27 -1.26 -4.06 117.44 113.98 1nd6 n TRP 194 Ca 0.08 0.00 -0.25 0.00 -3.89 0.00 0.00 57.50 53.43 1nd6 n TRP 194 Cb 0.47 -0.31 -0.07 0.00 -1.36 0.00 0.00 31.31 30.04 1nd6 n TRP 194 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1nd6 n ALA 195 N -1.31 6.49 -0.59 -1.67 0.00 -0.49 -4.82 120.51 118.13 1nd6 n ALA 195 Ca 0.13 -2.92 -0.30 0.00 0.00 0.00 0.00 53.44 50.35 1nd6 n ALA 195 Cb 0.23 -2.26 0.26 0.00 0.00 0.00 0.00 19.45 17.69 1nd6 n ALA 195 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1nd6 s THR 196 N -1.46 1.55 0.17 0.00 -4.23 -1.26 -4.68 115.64 105.73 1nd6 s THR 196 Ca 0.60 0.00 -0.14 0.00 -1.18 0.00 0.00 61.69 60.97 1nd6 s THR 196 Cb 0.35 -2.17 0.06 0.00 1.34 0.00 0.00 72.50 72.09 1nd6 s THR 196 CO -0.17 0.00 1.82 -0.08 -0.54 0.00 0.00 174.62 175.66 1nd6 h GLU 197 N -2.97 0.70 -0.93 3.99 4.81 -1.96 -1.90 114.58 116.31 1nd6 h GLU 197 Ca -0.50 -0.05 0.01 0.00 -0.13 0.00 0.00 59.36 58.68 1nd6 h GLU 197 Cb 1.33 -0.15 -0.05 0.00 0.63 0.00 0.00 28.75 30.51 1nd6 h GLU 197 CO 0.38 0.48 0.61 0.22 -0.73 0.00 0.00 179.01 179.97 1nd6 h ASP 198 N 0.71 1.08 -0.52 1.04 3.58 -1.97 -0.71 116.42 119.62 1nd6 h ASP 198 Ca 0.19 -0.04 -0.11 0.00 0.42 0.00 0.00 57.03 57.49 1nd6 h ASP 198 Cb -0.05 -0.27 -0.02 0.00 1.72 0.00 0.00 39.33 40.71 1nd6 h ASP 198 CO -0.04 0.79 -0.11 0.74 -2.88 0.00 0.00 179.24 177.75 1nd6 h THR 199 N 1.27 1.27 -0.52 2.25 2.02 -1.80 -1.83 112.91 115.57 1nd6 h THR 199 Ca 0.34 -1.26 -0.09 0.00 0.77 0.00 0.00 66.41 66.17 1nd6 h THR 199 Cb -0.13 1.00 -0.02 0.00 -1.74 0.00 0.00 68.15 67.26 1nd6 h THR 199 CO -0.07 0.44 -0.05 0.24 0.37 0.00 0.00 175.52 176.45 1nd6 h MET 200 N 0.87 0.91 -0.82 6.66 2.86 -0.80 0.12 114.93 124.73 1nd6 h MET 200 Ca 0.14 -0.29 -0.03 0.00 -2.06 0.00 0.00 59.70 57.45 1nd6 h MET 200 Cb 0.67 -0.08 -0.04 0.00 0.06 0.00 0.00 31.60 32.21 1nd6 h MET 200 CO 0.05 0.93 0.38 1.15 1.06 0.00 0.00 176.91 180.48 1nd6 h THR 201 N 0.83 1.26 -0.15 2.22 2.02 -0.93 0.12 112.91 118.27 1nd6 h THR 201 Ca 0.15 -0.74 -0.20 0.00 0.77 0.00 0.00 66.41 66.39 1nd6 h THR 201 Cb 0.56 0.22 0.00 0.00 -1.74 0.00 0.00 68.15 67.19 1nd6 h THR 201 CO 0.03 0.31 -0.71 0.11 0.37 0.00 0.00 175.52 175.63 1nd6 h LYS 202 N 1.17 0.67 -0.30 6.66 1.57 -0.96 -1.54 116.57 123.84 1nd6 h LYS 202 Ca 0.28 -0.52 -0.07 0.00 -1.87 0.00 0.00 60.65 58.47 1nd6 h LYS 202 Cb 0.14 0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.53 1nd6 h LYS 202 CO -0.03 1.13 -0.13 -0.07 -0.57 0.00 0.00 179.45 179.78 1nd6 h LEU 203 N 0.47 0.49 -0.08 2.94 3.38 -0.36 -1.52 115.31 120.63 1nd6 h LEU 203 Ca -0.03 -0.13 -0.05 0.00 0.09 0.00 0.00 57.88 57.76 1nd6 h LEU 203 Cb 1.31 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1nd6 h LEU 203 CO 0.14 0.65 -0.15 -0.09 0.09 0.00 0.00 178.44 179.09 1nd6 h ARG 204 N 0.47 0.24 -0.84 1.13 2.43 -0.68 -1.91 114.38 115.21 1nd6 h ARG 204 Ca 0.09 -0.15 0.07 0.00 -0.81 0.00 0.00 59.98 59.18 1nd6 h ARG 204 Cb 0.51 0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 30.01 1nd6 h ARG 204 CO 0.03 0.74 0.51 0.93 -1.51 0.00 0.00 179.97 180.66 1nd6 h GLU 205 N -0.23 0.88 -0.48 0.20 5.08 -1.08 0.36 114.58 119.30 1nd6 h GLU 205 Ca 0.00 -0.05 -0.07 0.00 -1.00 0.00 0.00 59.36 58.24 1nd6 h GLU 205 Cb 0.72 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.76 1nd6 h GLU 205 CO 0.03 0.58 0.01 -0.07 -1.00 0.00 0.00 179.01 178.56 1nd6 h LEU 206 N 0.90 0.75 -0.36 1.33 3.38 -1.26 0.59 115.31 120.64 1nd6 h LEU 206 Ca 0.38 -0.18 -0.07 0.00 0.09 0.00 0.00 57.88 58.10 1nd6 h LEU 206 Cb 0.23 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1nd6 h LEU 206 CO -0.19 0.81 -0.05 0.28 0.09 0.00 0.00 178.44 179.38 1nd6 h SER 207 N 0.74 0.66 -0.89 -0.43 0.02 -0.29 0.21 113.55 113.57 1nd6 h SER 207 Ca 0.15 -0.34 0.05 0.00 -0.84 0.00 0.00 61.79 60.80 1nd6 h SER 207 Cb 0.43 -0.18 -0.06 0.00 0.14 0.00 0.00 62.40 62.74 1nd6 h SER 207 CO 0.02 0.85 0.57 -0.33 -1.14 0.00 0.00 176.83 176.79 1nd6 h GLU 208 N 0.46 1.04 0.00 3.45 5.08 0.13 0.04 114.58 124.79 1nd6 h GLU 208 Ca 0.09 -0.06 -0.09 0.00 -1.00 0.00 0.00 59.36 58.31 1nd6 h GLU 208 Cb 0.54 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 1nd6 h GLU 208 CO 0.03 0.69 -0.41 1.25 -1.00 0.00 0.00 179.01 179.57 1nd6 h LEU 209 N 1.07 0.00 0.09 1.33 5.85 -0.30 -0.67 115.31 122.68 1nd6 h LEU 209 Ca 0.37 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 59.08 1nd6 h LEU 209 Cb 0.07 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.10 1nd6 h LEU 209 CO -0.14 0.41 -0.04 -1.28 -0.34 0.00 0.00 178.44 177.05 1nd6 h SER 210 N 0.00 -0.10 0.06 1.25 0.87 0.13 -1.54 113.55 114.22 1nd6 h SER 210 Ca -0.00 -0.19 -0.12 0.00 -1.23 0.00 0.00 61.79 60.25 1nd6 h SER 210 Cb 0.76 0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 62.73 1nd6 h SER 210 CO 0.05 0.14 -0.39 0.25 -0.53 0.00 0.00 176.83 176.35 1nd6 h LEU 211 N -0.33 0.46 -1.09 2.23 5.85 -1.21 -2.46 115.31 118.75 1nd6 h LEU 211 Ca -0.01 -0.19 -0.07 0.00 0.84 0.00 0.00 57.88 58.45 1nd6 h LEU 211 Cb 0.28 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.17 1nd6 h LEU 211 CO 0.02 0.80 -0.08 0.25 -0.34 0.00 0.00 178.44 179.09 1nd6 h LEU 212 N 0.36 0.52 0.00 2.25 7.12 -1.03 -2.79 115.31 121.74 1nd6 h LEU 212 Ca 0.04 -0.13 -0.12 0.00 0.13 0.00 0.00 57.88 57.80 1nd6 h LEU 212 Cb 0.85 -0.14 -0.02 0.00 -0.53 0.00 0.00 40.66 40.82 1nd6 h LEU 212 CO 0.07 0.65 -0.73 0.77 -0.13 0.00 0.00 178.44 179.07 1nd6 h SER 213 N 0.51 0.00 -0.56 1.25 4.64 -1.14 -0.94 113.55 117.31 1nd6 h SER 213 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1nd6 h SER 213 Cb 0.46 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.52 1nd6 h SER 213 CO 0.02 0.54 0.35 0.25 -0.87 0.00 0.00 176.83 177.13 1nd6 h LEU 214 N 0.00 0.66 0.00 5.97 6.46 -1.16 -3.26 115.31 123.97 1nd6 h LEU 214 Ca -0.04 -0.04 0.00 0.00 -0.12 0.00 0.00 57.88 57.68 1nd6 h LEU 214 Cb 1.44 -0.17 0.00 0.00 -0.73 0.00 0.00 40.66 41.21 1nd6 h LEU 214 CO 0.06 0.50 -0.99 -1.22 -0.62 0.00 0.00 178.44 176.18 1nd6 n TYR 215 N -4.67 0.00 -1.07 1.25 0.53 -1.19 -4.94 117.16 107.06 1nd6 n TYR 215 Ca 0.03 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.91 1nd6 n TYR 215 Cb 0.04 -0.07 0.00 0.00 -1.03 0.00 0.00 39.34 38.27 1nd6 n TYR 215 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1nd6 n GLY 216 N 1.42 4.42 5.00 2.72 0.00 -0.36 -4.52 105.19 113.87 1nd6 n GLY 216 Ca 0.02 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.34 1nd6 n GLY 216 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1nd6 n ILE 217 N 0.00 0.00 -4.01 -0.61 5.41 -1.26 -4.52 119.36 114.37 1nd6 n ILE 217 Ca 0.00 0.00 -0.31 0.00 1.00 0.00 0.00 62.75 63.44 1nd6 n ILE 217 Cb 0.00 0.00 -0.15 0.00 -0.71 0.00 0.00 39.64 38.78 1nd6 n ILE 217 CO 0.00 0.00 0.00 -2.28 0.00 0.00 0.00 176.55 174.27 1nd6 s HIS 218 N 0.00 2.80 -1.16 1.39 5.04 -1.26 -4.80 115.29 117.30 1nd6 s HIS 218 Ca 0.00 -1.98 -0.06 0.00 -1.54 0.00 0.00 55.06 51.48 1nd6 s HIS 218 Cb 0.00 -1.76 -0.03 0.00 0.04 0.00 0.00 32.58 30.83 1nd6 s HIS 218 CO 0.00 -0.82 0.85 1.63 -2.34 0.00 0.00 174.74 174.06 1nd6 n LYS 219 N 4.56 -3.60 -0.27 2.88 5.02 -1.26 -4.88 118.16 120.61 1nd6 n LYS 219 Ca -0.14 0.72 -0.02 0.00 -2.02 0.00 0.00 58.31 56.85 1nd6 n LYS 219 Cb 0.44 -5.34 0.10 0.00 -0.02 0.00 0.00 35.03 30.21 1nd6 n LYS 219 CO 0.00 0.00 0.00 0.37 -0.52 0.00 0.00 177.40 177.25 1nd6 h GLN 220 N -1.61 0.90 -0.64 1.97 4.15 -1.85 -2.38 115.11 115.65 1nd6 h GLN 220 Ca -0.62 -0.05 0.04 0.00 0.77 0.00 0.00 58.65 58.79 1nd6 h GLN 220 Cb 1.34 -0.20 -0.05 0.00 0.21 0.00 0.00 27.48 28.78 1nd6 h GLN 220 CO 0.49 0.59 0.38 -0.22 -1.93 0.00 0.00 178.83 178.15 1nd6 h LYS 221 N 0.92 0.71 -0.22 1.69 1.63 -1.91 -1.47 116.57 117.93 1nd6 h LYS 221 Ca 0.31 -0.04 -0.17 0.00 -0.85 0.00 0.00 60.65 59.90 1nd6 h LYS 221 Cb 0.05 -0.16 -0.00 0.00 -0.60 0.00 0.00 32.23 31.51 1nd6 h LYS 221 CO -0.12 0.47 -0.56 1.49 -3.45 0.00 0.00 179.45 177.28 1nd6 h GLU 222 N 0.73 0.67 -0.17 1.90 4.81 -1.88 -2.99 114.58 117.65 1nd6 h GLU 222 Ca 0.27 -0.43 -0.06 0.00 -0.13 0.00 0.00 59.36 59.01 1nd6 h GLU 222 Cb 0.09 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.50 1nd6 h GLU 222 CO -0.13 1.05 -0.16 0.87 -0.73 0.00 0.00 179.01 179.90 1nd6 h LYS 223 N 0.51 0.28 -0.39 1.92 1.57 -1.09 -2.71 116.57 116.67 1nd6 h LYS 223 Ca 0.01 -0.07 -0.08 0.00 -1.87 0.00 0.00 60.65 58.64 1nd6 h LYS 223 Cb 1.13 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 33.38 1nd6 h LYS 223 CO 0.11 0.45 -0.08 0.77 -0.57 0.00 0.00 179.45 180.12 1nd6 h SER 224 N 0.26 0.65 0.41 0.86 0.02 -1.13 -0.71 113.55 113.92 1nd6 h SER 224 Ca 0.05 -0.17 -0.04 0.00 -0.84 0.00 0.00 61.79 60.78 1nd6 h SER 224 Cb 0.45 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.80 1nd6 h SER 224 CO 0.03 0.78 -0.20 0.03 -1.14 0.00 0.00 176.83 176.33 1nd6 h ARG 225 N 0.62 0.00 0.00 3.45 3.08 -1.42 1.17 114.38 121.28 1nd6 h ARG 225 Ca 0.11 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.16 1nd6 h ARG 225 Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.56 1nd6 h ARG 225 CO 0.03 0.20 -0.84 1.28 -1.07 0.00 0.00 179.97 179.57 1nd6 n LEU 226 N -3.80 0.76 0.00 3.04 4.77 -0.90 -4.13 117.00 116.74 1nd6 n LEU 226 Ca -0.02 -0.26 0.00 0.00 -0.03 0.00 0.00 56.01 55.70 1nd6 n LEU 226 Cb 0.30 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.29 1nd6 n LEU 226 CO 0.33 0.18 0.00 0.00 -1.33 0.00 0.00 177.39 176.57 1nd6 n GLN 227 N -1.56 0.00 -0.38 3.23 1.13 -0.32 -4.74 117.38 114.74 1nd6 n GLN 227 Ca 0.04 0.00 0.29 0.00 -1.94 0.00 0.00 57.00 55.39 1nd6 n GLN 227 Cb 0.35 0.00 0.56 0.00 0.11 0.00 0.00 30.24 31.26 1nd6 n GLN 227 CO 0.00 0.00 0.00 0.78 -1.44 0.00 0.00 177.06 176.40 1nd6 h GLY 228 N 0.00 1.42 -0.42 1.08 0.00 -1.65 -0.89 103.07 102.60 1nd6 h GLY 228 Ca 0.00 -0.17 0.33 0.00 0.00 0.00 0.00 47.33 47.49 1nd6 h GLY 228 CO 0.00 -0.32 0.78 -1.33 0.00 0.00 0.00 176.54 175.67 1nd6 h GLY 229 N 0.25 0.78 1.57 4.60 0.00 0.12 0.33 103.07 110.73 1nd6 h GLY 229 Ca 0.72 -0.12 -0.07 0.00 0.00 0.00 0.00 47.33 47.86 1nd6 h GLY 229 CO -0.41 -0.13 -0.13 -2.08 0.00 0.00 0.00 176.54 173.80 1nd6 h VAL 230 N 0.20 1.23 0.03 4.60 2.07 -1.33 -1.56 116.25 121.50 1nd6 h VAL 230 Ca 0.63 -1.03 -0.22 0.00 0.82 0.00 0.00 66.70 66.90 1nd6 h VAL 230 Cb 1.99 1.14 -0.02 0.00 -1.52 0.00 0.00 31.29 32.89 1nd6 h VAL 230 CO -0.21 0.34 -1.01 0.25 0.02 0.00 0.00 177.57 176.96 1nd6 h LEU 231 N 0.47 0.16 -0.25 2.57 6.46 -0.56 -2.90 115.31 121.26 1nd6 h LEU 231 Ca 0.09 -0.16 -0.01 0.00 -0.12 0.00 0.00 57.88 57.68 1nd6 h LEU 231 Cb 0.50 -0.05 -0.01 0.00 -0.73 0.00 0.00 40.66 40.37 1nd6 h LEU 231 CO 0.03 1.07 0.11 0.58 -0.62 0.00 0.00 178.44 179.61 1nd6 h VAL 232 N 0.04 1.15 -0.82 1.05 2.07 -1.01 -1.18 116.25 117.57 1nd6 h VAL 232 Ca -0.05 -0.45 -0.00 0.00 0.82 0.00 0.00 66.70 67.01 1nd6 h VAL 232 Cb 1.73 1.00 -0.04 0.00 -1.52 0.00 0.00 31.29 32.46 1nd6 h VAL 232 CO 0.15 0.15 0.49 -1.13 0.02 0.00 0.00 177.57 177.25 1nd6 h ASN 233 N 0.26 0.98 -0.29 0.57 -0.00 -1.31 0.16 115.58 115.95 1nd6 h ASN 233 Ca 0.08 -0.06 -0.05 0.00 -0.00 0.00 0.00 56.30 56.28 1nd6 h ASN 233 Cb 0.14 -0.25 -0.01 0.00 -0.00 0.00 0.00 38.32 38.21 1nd6 h ASN 233 CO -0.01 0.75 -0.02 -0.08 -0.00 0.00 0.00 177.43 178.07 1nd6 h GLU 234 N 1.12 0.53 -0.14 6.67 4.57 -1.27 -1.33 114.58 124.73 1nd6 h GLU 234 Ca 0.29 -0.18 -0.03 0.00 -1.18 0.00 0.00 59.36 58.26 1nd6 h GLU 234 Cb -0.04 -0.04 -0.00 0.00 -0.16 0.00 0.00 28.75 28.50 1nd6 h GLU 234 CO -0.05 0.70 -0.04 0.82 -1.18 0.00 0.00 179.01 179.25 1nd6 h ILE 235 N 0.31 1.30 -0.28 2.32 2.04 -0.80 -2.31 117.51 120.08 1nd6 h ILE 235 Ca 0.08 -1.01 0.06 0.00 1.00 0.00 0.00 64.86 64.98 1nd6 h ILE 235 Cb 0.47 1.68 -0.05 0.00 -0.74 0.00 0.00 36.82 38.18 1nd6 h ILE 235 CO 0.02 0.30 -0.07 0.25 0.00 0.00 0.00 178.15 178.65 1nd6 h LEU 236 N -0.04 -0.26 -1.11 1.44 6.46 -0.69 -0.72 115.31 120.39 1nd6 h LEU 236 Ca 0.03 0.08 0.03 0.00 -0.12 0.00 0.00 57.88 57.91 1nd6 h LEU 236 Cb 0.48 0.17 -0.05 0.00 -0.73 0.00 0.00 40.66 40.53 1nd6 h LEU 236 CO 0.02 -0.09 0.60 0.78 -0.62 0.00 0.00 178.44 179.13 1nd6 h ASN 237 N 0.00 1.00 -0.43 1.25 2.35 -1.21 0.19 115.58 118.73 1nd6 h ASN 237 Ca 0.14 -0.01 -0.03 0.00 -0.55 0.00 0.00 56.30 55.85 1nd6 h ASN 237 Cb 0.21 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.33 1nd6 h ASN 237 CO -0.29 0.69 0.16 0.45 -1.65 0.00 0.00 177.43 176.79 1nd6 h HIS 238 N 1.16 0.66 -0.75 1.19 3.86 -0.76 0.32 115.15 120.83 1nd6 h HIS 238 Ca 0.36 -0.05 -0.05 0.00 -1.16 0.00 0.00 60.37 59.47 1nd6 h HIS 238 Cb -0.00 -0.20 -0.03 0.00 1.06 0.00 0.00 27.41 28.24 1nd6 h HIS 238 CO -0.00 0.58 0.28 0.52 0.86 0.00 0.00 177.93 180.17 1nd6 h MET 239 N 0.55 1.14 -0.50 2.45 2.86 -0.24 0.39 114.93 121.58 1nd6 h MET 239 Ca 0.14 -0.21 -0.07 0.00 -2.06 0.00 0.00 59.70 57.50 1nd6 h MET 239 Cb 0.21 -0.18 -0.02 0.00 0.06 0.00 0.00 31.60 31.67 1nd6 h MET 239 CO -0.01 0.93 0.03 0.87 1.06 0.00 0.00 176.91 179.79 1nd6 h LYS 240 N 1.10 0.86 -0.21 1.72 1.57 -0.35 -2.80 116.57 118.46 1nd6 h LYS 240 Ca 0.25 -0.26 -0.10 0.00 -1.87 0.00 0.00 60.65 58.67 1nd6 h LYS 240 Cb 0.24 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 1nd6 h LYS 240 CO -0.02 0.88 -0.30 0.00 -0.57 0.00 0.00 179.45 179.45 1nd6 h ARG 241 N 0.73 0.43 0.00 3.15 3.08 -0.59 -2.62 114.38 118.55 1nd6 h ARG 241 Ca 0.14 -0.17 -0.00 0.00 0.07 0.00 0.00 59.98 60.02 1nd6 h ARG 241 Cb 0.48 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.51 1nd6 h ARG 241 CO 0.02 0.68 -0.01 0.00 -1.07 0.00 0.00 179.97 179.60 1nd6 h ALA 242 N 1.32 1.04 0.00 0.04 0.00 -0.66 -0.79 119.26 120.21 1nd6 h ALA 242 Ca 0.05 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.80 1nd6 h ALA 242 Cb 0.71 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 1nd6 h ALA 242 CO 0.05 0.01 -1.48 0.25 0.00 0.00 0.00 179.25 178.08 1nd6 n THR 243 N -3.15 1.08 0.01 0.00 -2.24 -1.00 -4.44 114.28 104.54 1nd6 n THR 243 Ca -0.02 -0.68 -0.21 0.00 -2.27 0.00 0.00 64.05 60.86 1nd6 n THR 243 Cb 0.13 -0.64 -0.14 0.00 -2.10 0.00 0.00 70.33 67.58 1nd6 n THR 243 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 1nd6 h GLN 244 N 0.00 0.26 -4.94 -0.78 5.75 -1.08 -3.45 115.11 110.86 1nd6 h GLN 244 Ca -0.17 -0.44 -0.67 0.00 -0.15 0.00 0.00 58.65 57.23 1nd6 h GLN 244 Cb 1.54 0.16 -0.30 0.00 1.07 0.00 0.00 27.48 29.95 1nd6 h GLN 244 CO 0.04 1.21 -0.74 -1.50 -2.65 0.00 0.00 178.83 175.19 1nd6 s ILE 245 N -2.48 3.06 0.15 2.39 2.07 -0.42 -5.04 121.20 120.93 1nd6 s ILE 245 Ca -0.19 -0.80 -0.30 0.00 -1.41 0.00 0.00 60.65 57.95 1nd6 s ILE 245 Cb 0.04 -2.48 -0.04 0.00 0.13 0.00 0.00 42.46 40.12 1nd6 s ILE 245 CO 0.77 0.30 1.55 1.55 -1.91 0.00 0.00 174.94 177.21 1nd6 h PRO 246 N 8.06 -0.23 -1.95 3.50 0.13 -1.87 -3.00 132.00 136.65 1nd6 h PRO 246 Ca -0.37 0.02 -0.10 0.00 -0.87 0.00 0.00 66.00 64.68 1nd6 h PRO 246 Cb 1.13 0.05 -0.04 0.00 0.13 0.00 0.00 31.00 32.28 1nd6 h PRO 246 CO 0.59 -0.15 -0.03 -1.13 -0.23 0.00 0.00 178.00 177.05 1nd6 n SER 247 N -5.36 5.50 -4.90 1.44 3.41 -1.26 -4.93 113.62 107.52 1nd6 n SER 247 Ca -0.00 -2.53 -0.29 0.00 -0.26 0.00 0.00 58.87 55.79 1nd6 n SER 247 Cb 0.33 -1.19 0.02 0.00 -0.26 0.00 0.00 64.21 63.10 1nd6 n SER 247 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 1nd6 s TYR 248 N -0.05 3.47 0.49 7.33 6.14 -1.13 -4.99 117.35 128.60 1nd6 s TYR 248 Ca 0.21 0.93 -0.21 0.00 0.64 0.00 0.00 57.07 58.63 1nd6 s TYR 248 Cb 0.11 -2.63 -0.09 0.00 0.42 0.00 0.00 41.96 39.77 1nd6 s TYR 248 CO -0.01 -0.65 0.82 1.63 0.64 0.00 0.00 175.55 177.98 1nd6 n LYS 249 N -2.57 0.95 -0.03 4.97 4.01 -1.26 -4.86 118.16 119.36 1nd6 n LYS 249 Ca 0.04 0.35 0.01 0.00 -0.51 0.00 0.00 58.31 58.20 1nd6 n LYS 249 Cb 0.56 -1.90 -0.11 0.00 -0.51 0.00 0.00 35.03 33.06 1nd6 n LYS 249 CO 0.00 0.00 0.00 1.63 -1.11 0.00 0.00 177.40 177.92 1nd6 n LYS 250 N -0.05 1.06 -3.70 1.97 5.02 -0.39 -4.85 118.16 117.22 1nd6 n LYS 250 Ca 0.11 -0.08 -0.17 0.00 -2.02 0.00 0.00 58.31 56.15 1nd6 n LYS 250 Cb 0.43 -1.34 -0.16 0.00 -0.02 0.00 0.00 35.03 33.93 1nd6 n LYS 250 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1nd6 s LEU 251 N -4.45 0.33 -0.18 -0.35 2.96 -0.62 -0.64 118.68 115.73 1nd6 s LEU 251 Ca -0.06 0.19 0.01 0.00 -0.22 0.00 0.00 54.13 54.04 1nd6 s LEU 251 Cb 0.07 0.08 0.03 0.00 0.50 0.00 0.00 46.19 46.86 1nd6 s LEU 251 CO 0.58 -0.21 -0.16 -0.63 -1.32 0.00 0.00 176.35 174.61 1nd6 s ILE 252 N 1.86 1.81 -0.12 6.68 1.01 -0.58 -1.06 121.20 130.79 1nd6 s ILE 252 Ca -0.00 -0.87 -0.03 0.00 0.00 0.00 0.00 60.65 59.74 1nd6 s ILE 252 Cb -0.12 -1.71 -0.03 0.00 0.01 0.00 0.00 42.46 40.61 1nd6 s ILE 252 CO -0.04 0.42 0.00 -0.04 0.00 0.00 0.00 174.94 175.28 1nd6 s MET 253 N 1.37 3.36 -0.22 2.79 -1.94 0.11 -1.85 119.30 122.92 1nd6 s MET 253 Ca 0.03 -0.42 0.01 0.00 -1.71 0.00 0.00 55.69 53.60 1nd6 s MET 253 Cb -0.14 -2.91 0.03 0.00 2.01 0.00 0.00 34.83 33.82 1nd6 s MET 253 CO -0.11 0.50 -0.13 0.71 -0.01 0.00 0.00 175.02 175.98 1nd6 s TYR 254 N -0.32 2.99 -0.35 -0.03 1.51 0.07 0.33 117.35 121.56 1nd6 s TYR 254 Ca 0.07 -1.77 -0.14 0.00 -1.01 0.00 0.00 57.07 54.21 1nd6 s TYR 254 Cb -0.12 -1.97 -0.01 0.00 -0.11 0.00 0.00 41.96 39.75 1nd6 s TYR 254 CO 0.02 -0.80 0.31 0.45 -1.11 0.00 0.00 175.55 174.43 1nd6 s SER 255 N 1.26 6.13 0.00 2.29 0.15 0.13 -2.21 113.70 121.45 1nd6 s SER 255 Ca 0.00 -0.35 0.00 0.00 0.70 0.00 0.00 55.95 56.31 1nd6 s SER 255 Cb -0.16 -2.17 0.00 0.00 -1.71 0.00 0.00 66.02 61.98 1nd6 s SER 255 CO -0.08 -0.31 0.00 0.00 1.20 0.00 0.00 173.24 174.05 1nd6 n ALA 256 N 5.26 0.00 -2.63 5.45 0.00 0.01 -2.42 120.51 126.19 1nd6 n ALA 256 Ca -0.11 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.05 1nd6 n ALA 256 Cb 0.49 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.84 1nd6 n ALA 256 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1nd6 s HIS 257 N 1.12 2.43 0.48 0.00 3.76 -1.26 -1.69 115.29 120.13 1nd6 s HIS 257 Ca 0.00 -0.71 0.22 0.00 -0.15 0.00 0.00 55.06 54.41 1nd6 s HIS 257 Cb 0.00 -1.74 1.36 0.00 1.11 0.00 0.00 32.58 33.30 1nd6 s HIS 257 CO 0.00 0.41 2.10 0.38 -0.85 0.00 0.00 174.74 176.78 1nd6 h ASP 258 N 1.74 0.00 0.98 1.40 -0.00 -1.92 0.15 116.42 118.77 1nd6 h ASP 258 Ca -0.44 0.00 -0.05 0.00 -0.00 0.00 0.00 57.03 56.54 1nd6 h ASP 258 Cb 1.25 0.00 -0.01 0.00 -0.00 0.00 0.00 39.33 40.57 1nd6 h ASP 258 CO 0.80 0.10 -0.26 0.74 -0.00 0.00 0.00 179.24 180.62 1nd6 h THR 259 N 0.00 0.60 0.13 1.15 2.02 -1.95 -1.66 112.91 113.20 1nd6 h THR 259 Ca -0.00 -1.25 -0.18 0.00 0.77 0.00 0.00 66.41 65.75 1nd6 h THR 259 Cb 0.20 1.84 0.02 0.00 -1.74 0.00 0.00 68.15 68.47 1nd6 h THR 259 CO 0.01 0.25 -0.80 0.74 0.37 0.00 0.00 175.52 176.10 1nd6 h THR 260 N 0.00 1.51 0.53 3.16 2.02 -0.97 -1.14 112.91 118.02 1nd6 h THR 260 Ca -0.00 -2.53 -0.03 0.00 0.77 0.00 0.00 66.41 64.63 1nd6 h THR 260 Cb 0.82 3.20 0.01 0.00 -1.74 0.00 0.00 68.15 70.43 1nd6 h THR 260 CO 0.03 0.71 -0.25 0.58 0.37 0.00 0.00 175.52 176.96 1nd6 h VAL 261 N -0.40 0.48 -0.28 3.16 2.07 -1.26 -0.48 116.25 119.54 1nd6 h VAL 261 Ca -0.14 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.34 1nd6 h VAL 261 Cb 1.62 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 31.87 1nd6 h VAL 261 CO 0.14 0.01 0.18 0.77 0.02 0.00 0.00 177.57 178.69 1nd6 h SER 262 N -0.73 0.33 -0.64 0.57 4.64 -1.44 0.26 113.55 116.55 1nd6 h SER 262 Ca -0.07 -0.03 0.11 0.00 -0.47 0.00 0.00 61.79 61.33 1nd6 h SER 262 Cb 0.55 -0.08 -0.08 0.00 -0.31 0.00 0.00 62.40 62.47 1nd6 h SER 262 CO 0.12 0.26 0.21 1.23 -0.87 0.00 0.00 176.83 177.78 1nd6 h GLY 263 N 0.37 0.89 0.63 -0.77 0.00 -1.06 0.62 103.07 103.76 1nd6 h GLY 263 Ca 0.10 -0.09 -0.02 0.00 0.00 0.00 0.00 47.33 47.33 1nd6 h GLY 263 CO -0.02 -0.08 -0.03 -2.00 0.00 0.00 0.00 176.54 174.41 1nd6 h LEU 264 N 0.36 0.11 -1.65 3.11 5.85 -0.80 -2.51 115.31 119.78 1nd6 h LEU 264 Ca 0.34 -0.43 -0.02 0.00 0.84 0.00 0.00 57.88 58.60 1nd6 h LEU 264 Cb 0.48 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 1nd6 h LEU 264 CO -0.37 0.52 -0.03 1.56 -0.34 0.00 0.00 178.44 179.78 1nd6 h GLN 265 N -0.30 0.18 -0.23 1.25 4.20 -0.36 -2.11 115.11 117.74 1nd6 h GLN 265 Ca 0.01 -0.03 -0.20 0.00 0.06 0.00 0.00 58.65 58.50 1nd6 h GLN 265 Cb 0.48 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.23 1nd6 h GLN 265 CO 0.01 0.23 -0.63 0.52 -0.67 0.00 0.00 178.83 178.29 1nd6 h MET 266 N 0.18 0.82 -0.07 1.46 2.86 0.28 0.18 114.93 120.64 1nd6 h MET 266 Ca 0.04 -0.57 -0.08 0.00 -2.06 0.00 0.00 59.70 57.04 1nd6 h MET 266 Cb 0.18 0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.91 1nd6 h MET 266 CO 0.01 1.19 -0.32 0.00 1.06 0.00 0.00 176.91 178.85 1nd6 h ALA 267 N 0.68 1.34 0.00 6.32 0.00 -1.00 -1.95 119.26 124.64 1nd6 h ALA 267 Ca -0.01 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1nd6 h ALA 267 Cb 1.24 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1nd6 h ALA 267 CO 0.13 0.47 -0.46 1.28 0.00 0.00 0.00 179.25 180.67 1nd6 n LEU 268 N -4.12 0.48 -2.58 0.00 4.77 -0.83 -4.91 117.00 109.80 1nd6 n LEU 268 Ca -0.01 0.11 -0.16 0.00 -0.03 0.00 0.00 56.01 55.92 1nd6 n LEU 268 Cb 0.39 -0.27 0.05 0.00 -2.33 0.00 0.00 43.42 41.27 1nd6 n LEU 268 CO 0.39 0.07 0.16 -0.67 -1.33 0.00 0.00 177.39 176.01 1nd6 n ASP 269 N -1.63 -4.64 -0.02 -1.43 2.03 -0.30 -4.57 116.55 106.00 1nd6 n ASP 269 Ca 0.05 -0.37 0.01 0.00 0.52 0.00 0.00 54.79 55.01 1nd6 n ASP 269 Cb 0.36 -3.54 0.02 0.00 -0.72 0.00 0.00 41.12 37.23 1nd6 n ASP 269 CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 1nd6 n VAL 270 N -4.07 0.98 -2.26 5.18 0.24 0.48 -4.58 118.33 114.30 1nd6 n VAL 270 Ca -0.01 -1.02 -0.41 0.00 -2.04 0.00 0.00 64.34 60.85 1nd6 n VAL 270 Cb 0.55 0.46 -0.03 0.00 -1.47 0.00 0.00 33.84 33.35 1nd6 n VAL 270 CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 1nd6 s TYR 271 N -1.10 3.30 -2.45 6.34 5.04 -1.05 -4.93 117.35 122.50 1nd6 s TYR 271 Ca 0.04 1.27 0.27 0.00 -2.44 0.00 0.00 57.07 56.21 1nd6 s TYR 271 Cb 0.04 -3.56 1.00 0.00 0.35 0.00 0.00 41.96 39.79 1nd6 s TYR 271 CO 0.00 -1.71 1.71 0.27 -1.34 0.00 0.00 175.55 174.49 1nd6 n ASN 272 N 2.66 1.52 0.00 4.32 0.23 -1.26 -4.93 115.26 117.80 1nd6 n ASN 272 Ca 0.06 -1.53 0.00 0.00 -0.53 0.00 0.00 54.58 52.57 1nd6 n ASN 272 Cb 0.43 -0.02 0.00 0.00 -2.08 0.00 0.00 39.78 38.11 1nd6 n ASN 272 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1nd6 n GLY 273 N 1.17 1.19 3.95 4.83 0.00 -1.26 -5.02 105.19 110.04 1nd6 n GLY 273 Ca 0.19 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.96 1nd6 n GLY 273 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nd6 s LEU 274 N 0.00 4.22 0.05 0.99 1.43 -1.26 -4.84 118.68 119.27 1nd6 s LEU 274 Ca 0.00 0.28 -0.31 0.00 -1.03 0.00 0.00 54.13 53.08 1nd6 s LEU 274 Cb 0.00 -3.07 -0.07 0.00 0.03 0.00 0.00 46.19 43.08 1nd6 s LEU 274 CO 0.00 -0.09 1.48 -0.76 0.23 0.00 0.00 176.35 177.21 1nd6 s LEU 275 N -3.72 4.34 -0.06 1.79 1.43 -1.26 -4.92 118.68 116.28 1nd6 s LEU 275 Ca 0.37 2.28 -0.29 0.00 -1.03 0.00 0.00 54.13 55.46 1nd6 s LEU 275 Cb -0.10 -3.57 -0.07 0.00 0.03 0.00 0.00 46.19 42.48 1nd6 s LEU 275 CO 0.30 -0.76 2.07 -2.65 0.23 0.00 0.00 176.35 175.55 1nd6 n PRO 276 N 5.14 2.54 -0.99 1.29 -0.02 -1.26 -4.95 135.00 136.74 1nd6 n PRO 276 Ca 0.14 0.86 -0.31 0.00 -2.02 0.00 0.00 63.50 62.17 1nd6 n PRO 276 Cb 0.42 -3.11 0.14 0.00 -0.02 0.00 0.00 33.50 30.93 1nd6 n PRO 276 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 1nd6 s PRO 277 N 5.20 1.45 0.43 0.52 0.02 -1.26 -4.82 135.00 136.55 1nd6 s PRO 277 Ca 0.94 1.25 -0.25 0.00 0.02 0.00 0.00 61.00 62.96 1nd6 s PRO 277 Cb -0.39 -1.80 -0.10 0.00 0.02 0.00 0.00 34.50 32.23 1nd6 s PRO 277 CO 0.39 -2.23 1.19 0.66 -0.33 0.00 0.00 177.00 176.68 1nd6 n TYR 278 N -3.93 1.81 -1.25 6.54 0.53 -1.26 -1.43 117.16 118.16 1nd6 n TYR 278 Ca 0.10 0.51 -0.11 0.00 -1.02 0.00 0.00 57.90 57.38 1nd6 n TYR 278 Cb 0.53 -2.32 -0.05 0.00 -1.03 0.00 0.00 39.34 36.47 1nd6 n TYR 278 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1nd6 n ALA 279 N -0.39 -0.16 -1.77 -0.72 0.00 -0.58 -4.94 120.51 111.95 1nd6 n ALA 279 Ca 0.08 0.17 -0.39 0.00 0.00 0.00 0.00 53.44 53.31 1nd6 n ALA 279 Cb 0.40 -1.59 -0.02 0.00 0.00 0.00 0.00 19.45 18.24 1nd6 n ALA 279 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1nd6 s SER 280 N -2.19 6.58 -0.07 0.00 1.04 -0.52 -4.77 113.70 113.78 1nd6 s SER 280 Ca 0.00 2.39 0.01 0.00 0.48 0.00 0.00 55.95 58.84 1nd6 s SER 280 Cb 0.00 -2.62 0.02 0.00 0.10 0.00 0.00 66.02 63.52 1nd6 s SER 280 CO 0.00 -0.64 -0.09 0.00 0.98 0.00 0.00 173.24 173.49 1nd6 s HIS 282 N 0.92 3.14 -0.22 0.00 2.46 0.11 0.08 115.29 121.77 1nd6 s HIS 282 Ca -0.10 0.05 -0.14 0.00 0.47 0.00 0.00 55.06 55.34 1nd6 s HIS 282 Cb -0.15 -3.07 -0.04 0.00 -0.13 0.00 0.00 32.58 29.19 1nd6 s HIS 282 CO 0.01 -0.67 0.33 -0.51 -2.47 0.00 0.00 174.74 171.43 1nd6 s LEU 283 N 2.52 4.12 -0.31 8.88 2.01 0.20 -1.97 118.68 134.13 1nd6 s LEU 283 Ca 0.20 0.36 0.02 0.00 0.01 0.00 0.00 54.13 54.72 1nd6 s LEU 283 Cb -0.15 -2.38 0.09 0.00 0.01 0.00 0.00 46.19 43.76 1nd6 s LEU 283 CO 0.15 -0.05 0.05 -0.89 1.01 0.00 0.00 176.35 176.62 1nd6 s THR 284 N 1.36 1.70 -0.11 5.49 2.01 -0.68 0.10 115.64 125.52 1nd6 s THR 284 Ca 0.15 -1.86 -0.03 0.00 0.31 0.00 0.00 61.69 60.26 1nd6 s THR 284 Cb -0.15 -2.21 -0.03 0.00 0.01 0.00 0.00 72.50 70.12 1nd6 s THR 284 CO 0.07 -0.55 0.03 -1.61 -0.69 0.00 0.00 174.62 171.87 1nd6 s GLU 285 N 1.21 3.20 -0.31 4.92 2.02 0.15 -2.10 118.70 127.80 1nd6 s GLU 285 Ca 0.08 -0.37 -0.07 0.00 0.02 0.00 0.00 54.97 54.64 1nd6 s GLU 285 Cb -0.18 -2.90 0.02 0.00 0.10 0.00 0.00 34.13 31.16 1nd6 s GLU 285 CO -0.14 0.64 0.09 -1.17 0.02 0.00 0.00 175.26 174.70 1nd6 s LEU 286 N -0.69 3.97 0.05 1.80 2.96 0.01 -0.32 118.68 126.46 1nd6 s LEU 286 Ca 0.11 -0.82 0.02 0.00 -0.22 0.00 0.00 54.13 53.22 1nd6 s LEU 286 Cb -0.12 -1.88 -0.04 0.00 0.50 0.00 0.00 46.19 44.66 1nd6 s LEU 286 CO 0.02 -0.23 0.07 -0.31 -1.32 0.00 0.00 176.35 174.59 1nd6 s TYR 287 N 1.47 3.20 -0.09 5.38 1.51 0.30 -0.34 117.35 128.78 1nd6 s TYR 287 Ca 0.02 0.10 0.02 0.00 -1.01 0.00 0.00 57.07 56.20 1nd6 s TYR 287 Cb -0.18 -1.65 -0.02 0.00 -0.11 0.00 0.00 41.96 40.01 1nd6 s TYR 287 CO 0.02 0.52 -0.15 0.12 -1.11 0.00 0.00 175.55 174.95 1nd6 s PHE 288 N -1.32 2.72 -0.26 2.71 5.36 0.41 -0.41 117.98 127.19 1nd6 s PHE 288 Ca 0.27 -0.50 -0.02 0.00 -0.96 0.00 0.00 56.93 55.72 1nd6 s PHE 288 Cb -0.12 -1.73 0.15 0.00 -0.34 0.00 0.00 43.02 40.98 1nd6 s PHE 288 CO 0.19 -0.08 0.46 -2.00 -1.46 0.00 0.00 175.22 172.33 1nd6 s GLU 289 N -0.09 0.43 -1.43 10.12 2.12 0.58 -1.02 118.70 129.41 1nd6 s GLU 289 Ca -0.03 0.71 -0.10 0.00 0.36 0.00 0.00 54.97 55.92 1nd6 s GLU 289 Cb -0.14 -0.10 0.05 0.00 0.26 0.00 0.00 34.13 34.20 1nd6 s GLU 289 CO 0.04 -0.63 0.99 1.63 -0.54 0.00 0.00 175.26 176.76 1nd6 n LYS 290 N 5.39 -6.16 -0.57 4.30 5.02 -1.26 -2.11 118.16 122.78 1nd6 n LYS 290 Ca -0.03 0.68 0.00 0.00 -2.02 0.00 0.00 58.31 56.94 1nd6 n LYS 290 Cb 0.50 -5.57 0.00 0.00 -0.02 0.00 0.00 35.03 29.95 1nd6 n LYS 290 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1nd6 n GLY 291 N -1.73 0.77 3.33 0.72 0.00 -1.26 -5.05 105.19 101.98 1nd6 n GLY 291 Ca -0.04 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.70 1nd6 n GLY 291 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1nd6 s GLU 292 N -0.43 1.46 -0.08 1.61 2.02 -0.90 -5.14 118.70 117.24 1nd6 s GLU 292 Ca 0.00 -1.18 0.00 0.00 0.02 0.00 0.00 54.97 53.82 1nd6 s GLU 292 Cb 0.00 -1.76 -0.03 0.00 0.10 0.00 0.00 34.13 32.44 1nd6 s GLU 292 CO 0.00 0.43 -0.07 0.71 0.02 0.00 0.00 175.26 176.35 1nd6 s TYR 293 N -0.96 2.94 0.01 1.61 1.51 -1.26 -0.31 117.35 120.89 1nd6 s TYR 293 Ca 0.11 -0.04 0.05 0.00 -1.01 0.00 0.00 57.07 56.17 1nd6 s TYR 293 Cb -0.10 -1.74 -0.02 0.00 -0.11 0.00 0.00 41.96 39.99 1nd6 s TYR 293 CO 0.04 0.27 -0.15 -0.06 -1.11 0.00 0.00 175.55 174.53 1nd6 s PHE 294 N -0.62 1.32 -0.21 2.71 0.40 0.45 -0.62 117.98 121.41 1nd6 s PHE 294 Ca 0.09 -0.29 -0.06 0.00 -0.60 0.00 0.00 56.93 56.07 1nd6 s PHE 294 Cb -0.12 -0.82 -0.03 0.00 0.51 0.00 0.00 43.02 42.56 1nd6 s PHE 294 CO 0.02 0.01 0.03 0.08 0.70 0.00 0.00 175.22 176.06 1nd6 s VAL 295 N -0.54 4.20 -0.13 -0.44 1.01 0.19 -0.54 120.40 124.15 1nd6 s VAL 295 Ca 0.04 -0.22 0.03 0.00 0.00 0.00 0.00 61.98 61.83 1nd6 s VAL 295 Cb -0.07 -2.92 0.00 0.00 0.00 0.00 0.00 36.38 33.40 1nd6 s VAL 295 CO 0.00 0.41 -0.21 -1.61 0.00 0.00 0.00 175.10 173.69 1nd6 s GLU 296 N 1.06 3.07 -0.08 2.72 2.02 0.56 -1.53 118.70 126.52 1nd6 s GLU 296 Ca 0.03 -0.84 0.02 0.00 0.02 0.00 0.00 54.97 54.20 1nd6 s GLU 296 Cb -0.14 -2.43 -0.02 0.00 0.10 0.00 0.00 34.13 31.64 1nd6 s GLU 296 CO 0.02 0.06 -0.12 -1.64 0.02 0.00 0.00 175.26 173.60 1nd6 s MET 297 N 0.64 2.87 0.10 1.61 -1.94 -1.26 0.32 119.30 121.65 1nd6 s MET 297 Ca -0.11 -0.66 0.03 0.00 -1.71 0.00 0.00 55.69 53.23 1nd6 s MET 297 Cb -0.16 -2.51 -0.04 0.00 2.01 0.00 0.00 34.83 34.12 1nd6 s MET 297 CO 0.02 0.48 -0.08 0.71 -0.01 0.00 0.00 175.02 176.15 1nd6 s TYR 298 N -0.35 0.97 -0.24 -0.03 1.51 0.11 -0.19 117.35 119.13 1nd6 s TYR 298 Ca 0.04 -0.82 -0.00 0.00 -1.01 0.00 0.00 57.07 55.28 1nd6 s TYR 298 Cb -0.12 -0.54 0.07 0.00 -0.11 0.00 0.00 41.96 41.25 1nd6 s TYR 298 CO 0.02 -0.08 0.00 -0.47 -1.11 0.00 0.00 175.55 173.92 1nd6 s TYR 299 N -3.25 2.02 -1.00 2.71 5.04 0.41 0.61 117.35 123.90 1nd6 s TYR 299 Ca 0.10 -1.60 -0.17 0.00 -2.44 0.00 0.00 57.07 52.96 1nd6 s TYR 299 Cb 0.03 -1.55 0.15 0.00 0.35 0.00 0.00 41.96 40.94 1nd6 s TYR 299 CO -0.03 -0.76 1.17 0.50 -1.34 0.00 0.00 175.55 175.09 1nd6 s ARG 300 N 1.52 3.75 -0.03 4.97 3.00 0.11 -0.77 118.95 131.50 1nd6 s ARG 300 Ca -0.01 -2.09 0.14 0.00 -1.00 0.00 0.00 55.73 52.77 1nd6 s ARG 300 Cb -0.18 -4.89 0.42 0.00 0.00 0.00 0.00 34.95 30.29 1nd6 s ARG 300 CO -0.10 -1.71 1.35 0.27 0.00 0.00 0.00 175.30 175.11 1nd6 n ASN 301 N 5.93 3.35 -3.64 -2.12 6.94 -1.26 -0.24 115.26 124.21 1nd6 n ASN 301 Ca 0.26 -2.16 -0.04 0.00 -0.02 0.00 0.00 54.58 52.62 1nd6 n ASN 301 Cb 0.47 -0.34 -0.07 0.00 -2.36 0.00 0.00 39.78 37.49 1nd6 n ASN 301 CO 0.00 0.00 0.00 -1.83 -1.03 0.00 0.00 177.26 174.40 1nd6 s GLU 302 N -1.29 0.49 0.31 -3.83 -1.05 -1.26 -4.81 118.70 107.26 1nd6 s GLU 302 Ca 0.32 0.84 0.10 0.00 -0.15 0.00 0.00 54.97 56.08 1nd6 s GLU 302 Cb 0.18 0.10 0.49 0.00 -0.44 0.00 0.00 34.13 34.47 1nd6 s GLU 302 CO 0.18 -0.10 1.70 1.79 0.95 0.00 0.00 175.26 179.78 1nd6 h THR 303 N 4.95 1.36 -0.68 1.83 1.35 -1.98 -3.19 112.91 116.55 1nd6 h THR 303 Ca -0.29 -1.74 0.08 0.00 -0.55 0.00 0.00 66.41 63.92 1nd6 h THR 303 Cb 1.20 1.92 -0.04 0.00 -1.73 0.00 0.00 68.15 69.50 1nd6 h THR 303 CO 0.18 0.50 0.45 -0.61 -0.25 0.00 0.00 175.52 175.79 1nd6 h GLN 304 N 0.04 0.60 -5.79 4.72 5.75 -2.03 -3.43 115.11 114.97 1nd6 h GLN 304 Ca -0.00 -0.04 -0.53 0.00 -0.15 0.00 0.00 58.65 57.93 1nd6 h GLN 304 Cb 0.91 -0.14 -0.14 0.00 1.07 0.00 0.00 27.48 29.18 1nd6 h GLN 304 CO 0.07 0.40 -0.72 -1.01 -2.65 0.00 0.00 178.83 174.92 1nd6 s HIS 305 N -5.57 2.05 0.82 3.99 3.76 -1.20 -5.14 115.29 114.00 1nd6 s HIS 305 Ca -0.09 -0.53 -0.11 0.00 -0.15 0.00 0.00 55.06 54.19 1nd6 s HIS 305 Cb 0.20 -1.03 0.08 0.00 1.11 0.00 0.00 32.58 32.94 1nd6 s HIS 305 CO 0.76 0.48 1.10 -1.21 -0.85 0.00 0.00 174.74 175.02 1nd6 s GLU 306 N -3.62 1.88 0.43 1.40 0.41 -1.26 -4.72 118.70 113.22 1nd6 s GLU 306 Ca 0.28 1.15 -0.23 0.00 -0.41 0.00 0.00 54.97 55.76 1nd6 s GLU 306 Cb -0.00 -1.86 -0.11 0.00 -1.78 0.00 0.00 34.13 30.38 1nd6 s GLU 306 CO 0.12 -1.90 0.83 -2.30 -0.49 0.00 0.00 175.26 171.52 1nd6 n PRO 307 N -3.69 1.00 -3.01 0.39 -0.02 -1.26 -4.92 135.00 123.48 1nd6 n PRO 307 Ca 0.09 0.36 -0.40 0.00 -2.02 0.00 0.00 63.50 61.53 1nd6 n PRO 307 Cb 0.53 -1.84 -0.05 0.00 -0.02 0.00 0.00 33.50 32.12 1nd6 n PRO 307 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 1nd6 s TYR 308 N -1.37 3.44 0.05 6.00 1.51 0.05 -4.78 117.35 122.25 1nd6 s TYR 308 Ca 0.64 1.13 -0.30 0.00 -1.01 0.00 0.00 57.07 57.53 1nd6 s TYR 308 Cb -0.57 -2.88 -0.08 0.00 -0.11 0.00 0.00 41.96 38.32 1nd6 s TYR 308 CO 0.56 -0.14 1.70 -2.14 -1.11 0.00 0.00 175.55 174.42 1nd6 s PRO 309 N 1.74 4.18 0.38 -1.71 0.02 -1.26 -0.44 135.00 137.92 1nd6 s PRO 309 Ca 0.34 2.35 0.06 0.00 0.02 0.00 0.00 61.00 63.78 1nd6 s PRO 309 Cb -0.16 -3.73 0.00 0.00 0.02 0.00 0.00 34.50 30.63 1nd6 s PRO 309 CO 0.13 -0.79 0.53 -0.51 -0.33 0.00 0.00 177.00 176.03 1nd6 s LEU 310 N 3.10 3.81 -0.21 -5.54 1.43 0.73 -4.92 118.68 117.08 1nd6 s LEU 310 Ca 0.76 -0.23 -0.07 0.00 -1.03 0.00 0.00 54.13 53.55 1nd6 s LEU 310 Cb -0.39 -2.75 0.09 0.00 0.03 0.00 0.00 46.19 43.17 1nd6 s LEU 310 CO 0.33 -0.60 0.44 -0.32 0.23 0.00 0.00 176.35 176.44 1nd6 s MET 311 N -4.29 0.35 0.06 1.70 1.75 -1.26 -4.52 119.30 113.09 1nd6 s MET 311 Ca 0.49 1.07 -0.30 0.00 -1.25 0.00 0.00 55.69 55.70 1nd6 s MET 311 Cb -0.10 0.38 -0.08 0.00 2.84 0.00 0.00 34.83 37.87 1nd6 s MET 311 CO 0.32 -0.24 1.71 -1.17 -0.65 0.00 0.00 175.02 174.99 1nd6 s LEU 312 N 2.59 4.37 0.16 4.11 2.96 -1.26 -4.80 118.68 126.81 1nd6 s LEU 312 Ca -0.02 2.51 -0.31 0.00 -0.22 0.00 0.00 54.13 56.08 1nd6 s LEU 312 Cb -0.12 -3.56 -0.10 0.00 0.50 0.00 0.00 46.19 42.91 1nd6 s LEU 312 CO -0.13 -0.92 1.64 -2.16 -1.32 0.00 0.00 176.35 173.46 1nd6 s PRO 313 N 3.03 4.18 0.00 0.98 0.04 -1.26 -0.77 135.00 141.20 1nd6 s PRO 313 Ca 0.76 2.44 0.00 0.00 0.04 0.00 0.00 61.00 64.24 1nd6 s PRO 313 Cb -0.40 -3.25 0.00 0.00 0.04 0.00 0.00 34.50 30.89 1nd6 s PRO 313 CO 0.33 -0.68 0.00 0.41 0.04 0.00 0.00 177.00 177.10 1nd6 n GLY 314 N 3.89 1.28 0.00 0.56 0.00 -1.26 -5.04 105.19 104.63 1nd6 n GLY 314 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1nd6 n GLY 314 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nd6 s SER 316 N 1.00 0.98 0.26 0.00 1.04 -1.26 -4.77 113.70 110.94 1nd6 s SER 316 Ca 0.00 -1.46 -0.05 0.00 0.48 0.00 0.00 55.95 54.91 1nd6 s SER 316 Cb 0.00 0.33 0.49 0.00 0.10 0.00 0.00 66.02 66.94 1nd6 s SER 316 CO 0.00 -0.83 1.62 -0.65 0.98 0.00 0.00 173.24 174.36 1nd6 h PRO 317 N 2.40 0.08 -4.23 4.02 0.11 -1.92 -3.07 132.00 129.39 1nd6 h PRO 317 Ca -0.35 -0.01 -0.75 0.00 0.11 0.00 0.00 66.00 65.01 1nd6 h PRO 317 Cb 1.25 -0.02 -0.23 0.00 0.11 0.00 0.00 31.00 32.11 1nd6 h PRO 317 CO 0.54 0.06 -0.29 0.45 -0.21 0.00 0.00 178.00 178.54 1nd6 s SER 318 N -5.17 6.15 -0.31 -2.05 0.15 -1.26 -4.29 113.70 106.93 1nd6 s SER 318 Ca -0.13 -1.50 -0.09 0.00 0.70 0.00 0.00 55.95 54.93 1nd6 s SER 318 Cb 0.24 -2.19 -0.01 0.00 -1.71 0.00 0.00 66.02 62.35 1nd6 s SER 318 CO 0.76 -0.72 0.14 0.00 1.20 0.00 0.00 173.24 174.62 1nd6 n PRO 320 N 4.97 1.91 -0.29 0.00 -0.04 -1.26 0.53 135.00 140.82 1nd6 n PRO 320 Ca -0.14 0.68 0.05 0.00 -0.04 0.00 0.00 63.50 64.05 1nd6 n PRO 320 Cb 0.49 -2.37 0.14 0.00 -0.04 0.00 0.00 33.50 31.72 1nd6 n PRO 320 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1nd6 h LEU 321 N 4.84 -0.62 -1.21 1.53 5.85 -1.20 -0.57 115.31 123.94 1nd6 h LEU 321 Ca -0.45 0.24 -0.03 0.00 0.84 0.00 0.00 57.88 58.48 1nd6 h LEU 321 Cb 1.28 0.46 -0.03 0.00 0.37 0.00 0.00 40.66 42.74 1nd6 h LEU 321 CO 0.81 -0.26 0.21 -0.33 -0.34 0.00 0.00 178.44 178.53 1nd6 h GLU 322 N 0.03 0.77 -0.35 1.25 5.08 -1.89 -1.30 114.58 118.17 1nd6 h GLU 322 Ca 0.42 -0.11 -0.17 0.00 -1.00 0.00 0.00 59.36 58.50 1nd6 h GLU 322 Cb 0.71 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.82 1nd6 h GLU 322 CO -0.80 0.63 -0.46 -0.09 -1.00 0.00 0.00 179.01 177.29 1nd6 h ARG 323 N 0.76 0.92 0.17 2.33 9.65 -1.52 -2.40 114.38 124.29 1nd6 h ARG 323 Ca 0.18 -0.53 0.01 0.00 -1.10 0.00 0.00 59.98 58.55 1nd6 h ARG 323 Cb 0.15 0.04 -0.03 0.00 -1.39 0.00 0.00 29.97 28.74 1nd6 h ARG 323 CO -0.02 1.18 -0.26 0.35 2.80 0.00 0.00 179.97 184.02 1nd6 h PHE 324 N 0.73 -0.70 -0.93 2.20 3.57 -0.59 0.24 116.94 121.46 1nd6 h PHE 324 Ca 0.04 0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.61 1nd6 h PHE 324 Cb 1.06 0.29 -0.06 0.00 2.79 0.00 0.00 35.95 40.02 1nd6 h PHE 324 CO 0.07 -0.37 0.59 0.00 -2.23 0.00 0.00 178.31 176.37 1nd6 h ALA 325 N 0.20 1.27 0.40 2.41 0.00 -1.26 -0.73 119.26 121.55 1nd6 h ALA 325 Ca 0.02 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1nd6 h ALA 325 Cb 0.50 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1nd6 h ALA 325 CO -0.12 0.40 -0.21 0.93 0.00 0.00 0.00 179.25 180.25 1nd6 h GLU 326 N 1.11 -0.55 -0.41 0.00 5.08 -0.89 0.27 114.58 119.20 1nd6 h GLU 326 Ca 0.39 0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.79 1nd6 h GLU 326 Cb 0.11 0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 1nd6 h GLU 326 CO -0.15 -0.36 0.24 -0.07 -1.00 0.00 0.00 179.01 177.66 1nd6 h LEU 327 N -0.57 0.48 0.00 1.33 3.38 -0.67 -2.88 115.31 116.39 1nd6 h LEU 327 Ca -0.05 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1nd6 h LEU 327 Cb 0.45 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1nd6 h LEU 327 CO 0.07 0.38 -0.74 0.55 0.09 0.00 0.00 178.44 178.79 1nd6 n VAL 328 N -4.44 0.30 -0.09 1.22 3.14 -0.30 -4.35 118.33 113.80 1nd6 n VAL 328 Ca 0.03 -0.26 -0.07 0.00 -2.96 0.00 0.00 64.34 61.08 1nd6 n VAL 328 Cb 0.08 -0.03 -0.01 0.00 -1.06 0.00 0.00 33.84 32.83 1nd6 n VAL 328 CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 1nd6 h GLY 329 N 4.52 -0.08 0.96 7.55 0.00 -0.23 -2.23 103.07 113.57 1nd6 h GLY 329 Ca 0.00 0.30 0.00 0.00 0.00 0.00 0.00 47.33 47.63 1nd6 h GLY 329 CO 0.00 -0.20 0.48 -0.56 0.00 0.00 0.00 176.54 176.25 1nd6 h PRO 330 N -0.20 0.00 -0.55 4.80 0.13 -1.76 0.78 132.00 135.20 1nd6 h PRO 330 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1nd6 h PRO 330 Cb 0.46 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.59 1nd6 h PRO 330 CO -0.45 0.00 0.00 1.33 -0.23 0.00 0.00 178.00 178.65 1nd6 n VAL 331 N -2.51 1.13 -3.53 1.56 0.24 -0.84 -4.88 118.33 109.49 1nd6 n VAL 331 Ca -0.01 -1.05 -0.40 0.00 -2.04 0.00 0.00 64.34 60.83 1nd6 n VAL 331 Cb 0.50 0.44 -0.11 0.00 -1.47 0.00 0.00 33.84 33.21 1nd6 n VAL 331 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 1nd6 s ILE 332 N -1.15 5.25 0.39 1.34 1.01 0.27 -3.75 121.20 124.56 1nd6 s ILE 332 Ca 0.38 -0.27 -0.27 0.00 0.00 0.00 0.00 60.65 60.49 1nd6 s ILE 332 Cb 0.21 -3.71 -0.10 0.00 0.01 0.00 0.00 42.46 38.87 1nd6 s ILE 332 CO 0.24 -0.03 1.39 -2.16 0.00 0.00 0.00 174.94 174.38 1nd6 s PRO 333 N 1.71 4.05 -0.02 2.79 0.04 -1.26 -4.95 135.00 137.37 1nd6 s PRO 333 Ca 0.06 2.36 -0.11 0.00 0.04 0.00 0.00 61.00 63.35 1nd6 s PRO 333 Cb -0.18 -2.88 -0.31 0.00 0.04 0.00 0.00 34.50 31.17 1nd6 s PRO 333 CO 0.10 -0.50 0.79 1.96 0.04 0.00 0.00 177.00 179.40 1nd6 h GLN 334 N 2.88 0.40 -1.46 4.56 1.08 -1.97 -3.42 115.11 117.18 1nd6 h GLN 334 Ca -0.50 -0.69 -0.33 0.00 -1.45 0.00 0.00 58.65 55.68 1nd6 h GLN 334 Cb 1.24 0.26 -0.25 0.00 -0.05 0.00 0.00 27.48 28.68 1nd6 h GLN 334 CO 0.63 1.31 -0.69 -3.47 -0.95 0.00 0.00 178.83 175.67 1nd6 n ASP 335 N -3.60 -2.25 -0.36 1.46 4.64 -1.26 -5.02 116.55 110.16 1nd6 n ASP 335 Ca -0.21 -2.74 0.07 0.00 -1.38 0.00 0.00 54.79 50.53 1nd6 n ASP 335 Cb 1.08 0.86 0.16 0.00 -1.04 0.00 0.00 41.12 42.18 1nd6 n ASP 335 CO 0.00 0.00 0.00 -0.25 -0.82 0.00 0.00 177.20 176.13 1nd6 h TRP 336 N 5.13 -0.46 -0.51 -0.67 7.01 -1.91 0.16 115.95 124.70 1nd6 h TRP 336 Ca 0.12 0.09 0.08 0.00 2.11 0.00 0.00 58.89 61.29 1nd6 h TRP 336 Cb 1.03 0.36 -0.07 0.00 -2.10 0.00 0.00 29.16 28.38 1nd6 h TRP 336 CO 0.16 -0.43 0.14 1.03 -2.79 0.00 0.00 178.44 176.55 1nd6 h SER 337 N 0.00 0.08 -0.14 2.65 0.87 -1.99 -1.04 113.55 113.98 1nd6 h SER 337 Ca 0.50 0.08 -0.05 0.00 -1.23 0.00 0.00 61.79 61.09 1nd6 h SER 337 Cb 0.80 0.09 -0.00 0.00 -0.44 0.00 0.00 62.40 62.85 1nd6 h SER 337 CO -1.01 0.07 -0.10 0.74 -0.53 0.00 0.00 176.83 176.00 1nd6 h THR 338 N 0.29 1.33 0.00 2.23 2.02 -1.19 -3.11 112.91 114.48 1nd6 h THR 338 Ca 0.25 -1.20 0.00 0.00 0.77 0.00 0.00 66.41 66.24 1nd6 h THR 338 Cb 0.32 1.82 0.00 0.00 -1.74 0.00 0.00 68.15 68.55 1nd6 h THR 338 CO -0.30 0.35 0.00 -0.33 0.37 0.00 0.00 175.52 175.61 1nd6 h GLU 339 N -0.05 0.00 0.00 6.66 5.08 -0.69 -1.95 114.58 123.64 1nd6 h GLU 339 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1nd6 h GLU 339 Cb 0.60 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.85 1nd6 h GLU 339 CO 0.03 0.00 -0.50 0.00 -1.00 0.00 0.00 179.01 177.54 1nd6 s MET 341 N -3.13 4.12 0.00 0.00 -1.94 -0.74 0.25 119.30 117.87 1nd6 s MET 341 Ca 0.08 2.57 0.32 0.00 -1.71 0.00 0.00 55.69 56.94 1nd6 s MET 341 Cb 0.14 -3.00 1.84 0.00 2.01 0.00 0.00 34.83 35.83 1nd6 s MET 341 CO 0.69 -0.57 2.19 -2.37 -0.01 0.00 0.00 175.02 174.95