#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1di6 s THR 3 N 0.00 4.76 -0.14 0.00 2.01 -1.26 -4.59 115.64 116.42 1di6 s THR 3 Ca 0.00 1.98 -0.29 0.00 0.31 0.00 0.00 61.69 63.70 1di6 s THR 3 Cb 0.00 -4.27 -0.01 0.00 0.01 0.00 0.00 72.50 68.23 1di6 s THR 3 CO 0.00 0.13 0.97 -0.22 -0.69 0.00 0.00 174.62 174.82 1di6 s LEU 4 N 1.17 4.21 -0.35 4.42 2.96 -0.68 -4.90 118.68 125.51 1di6 s LEU 4 Ca 0.52 1.44 -0.15 0.00 -0.22 0.00 0.00 54.13 55.72 1di6 s LEU 4 Cb -0.22 -3.49 -0.01 0.00 0.50 0.00 0.00 46.19 42.98 1di6 s LEU 4 CO 0.27 -0.47 0.33 -0.13 -1.32 0.00 0.00 176.35 175.03 1di6 s ARG 5 N 2.20 3.46 -0.14 1.98 0.52 -1.26 -0.71 118.95 125.00 1di6 s ARG 5 Ca 0.46 -0.55 -0.00 0.00 -0.52 0.00 0.00 55.73 55.11 1di6 s ARG 5 Cb -0.17 -3.83 -0.01 0.00 0.52 0.00 0.00 34.95 31.45 1di6 s ARG 5 CO 0.15 -0.55 -0.14 0.42 0.02 0.00 0.00 175.30 175.21 1di6 s ILE 6 N 1.92 2.94 -0.08 1.52 1.01 0.14 -0.68 121.20 127.97 1di6 s ILE 6 Ca 0.10 -0.69 -0.13 0.00 0.00 0.00 0.00 60.65 59.92 1di6 s ILE 6 Cb -0.17 -2.24 -0.05 0.00 0.01 0.00 0.00 42.46 40.01 1di6 s ILE 6 CO 0.11 0.52 0.34 -0.83 0.00 0.00 0.00 174.94 175.08 1di6 s GLY 7 N 0.52 2.34 -0.17 6.18 0.00 0.02 -1.70 107.32 114.51 1di6 s GLY 7 Ca -0.09 -0.35 0.01 0.00 0.00 0.00 0.00 44.72 44.29 1di6 s GLY 7 CO 0.04 0.19 -0.20 1.08 0.00 0.00 0.00 173.10 174.22 1di6 s LEU 8 N -0.48 2.08 -0.18 0.66 1.43 -0.14 -1.01 118.68 121.04 1di6 s LEU 8 Ca 0.20 -0.63 0.01 0.00 -1.03 0.00 0.00 54.13 52.68 1di6 s LEU 8 Cb -0.15 -1.45 0.03 0.00 0.03 0.00 0.00 46.19 44.66 1di6 s LEU 8 CO 0.09 -0.00 -0.14 -0.69 0.23 0.00 0.00 176.35 175.84 1di6 s VAL 9 N 1.28 1.72 -0.26 -1.59 1.01 -0.58 -0.85 120.40 121.13 1di6 s VAL 9 Ca 0.04 -0.88 -0.09 0.00 0.00 0.00 0.00 61.98 61.05 1di6 s VAL 9 Cb -0.13 -1.68 -0.03 0.00 0.00 0.00 0.00 36.38 34.53 1di6 s VAL 9 CO -0.12 0.34 0.11 -0.55 0.00 0.00 0.00 175.10 174.88 1di6 s SER 10 N 1.40 5.43 -0.35 3.32 0.15 -0.29 -0.65 113.70 122.70 1di6 s SER 10 Ca 0.02 -0.16 -0.08 0.00 0.70 0.00 0.00 55.95 56.43 1di6 s SER 10 Cb -0.14 -1.99 0.04 0.00 -1.71 0.00 0.00 66.02 62.21 1di6 s SER 10 CO -0.10 -0.05 0.15 -0.63 1.20 0.00 0.00 173.24 173.81 1di6 s ILE 11 N 1.66 4.06 -0.17 6.45 1.01 -0.51 -1.41 121.20 132.29 1di6 s ILE 11 Ca 0.07 -1.06 -0.04 0.00 0.00 0.00 0.00 60.65 59.61 1di6 s ILE 11 Cb -0.15 -3.30 -0.02 0.00 0.01 0.00 0.00 42.46 38.99 1di6 s ILE 11 CO 0.06 -0.22 -0.04 -0.55 0.00 0.00 0.00 174.94 174.20 1di6 s SER 12 N 1.49 4.72 0.47 3.58 0.15 0.36 -4.41 113.70 120.06 1di6 s SER 12 Ca -0.00 -0.17 0.29 0.00 0.70 0.00 0.00 55.95 56.76 1di6 s SER 12 Cb -0.20 -1.78 0.94 0.00 -1.71 0.00 0.00 66.02 63.28 1di6 s SER 12 CO 0.04 0.13 1.82 0.44 1.20 0.00 0.00 173.24 176.88 1di6 h ASP 13 N 6.96 0.00 0.00 5.45 3.32 -1.92 -1.41 116.42 128.82 1di6 h ASP 13 Ca -0.32 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.73 1di6 h ASP 13 Cb 1.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.74 1di6 h ASP 13 CO 0.62 0.00 0.00 0.54 -1.72 0.00 0.00 179.24 178.68 1di6 n ARG 14 N -2.99 0.00 -3.64 3.56 3.00 -1.26 -4.78 116.66 110.55 1di6 n ARG 14 Ca 0.02 0.00 -0.09 0.00 -0.01 0.00 0.00 57.85 57.78 1di6 n ARG 14 Cb 0.39 -0.02 -0.07 0.00 0.00 0.00 0.00 32.46 32.76 1di6 n ARG 14 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 1di6 s ASP 22 N -1.28 -0.80 -0.00 0.55 3.68 -1.26 -4.90 116.67 112.65 1di6 s ASP 22 Ca 0.00 1.37 0.14 0.00 2.13 0.00 0.00 52.55 56.18 1di6 s ASP 22 Cb 0.00 1.35 -0.16 0.00 -1.45 0.00 0.00 42.92 42.66 1di6 s ASP 22 CO 0.00 -0.22 0.53 0.29 0.13 0.00 0.00 175.17 175.90 1di6 n LYS 23 N 3.64 2.15 0.11 4.34 5.02 -1.26 -4.66 118.16 127.50 1di6 n LYS 23 Ca -0.18 -0.02 -0.11 0.00 -2.02 0.00 0.00 58.31 55.98 1di6 n LYS 23 Cb 0.57 -1.17 -0.07 0.00 -0.02 0.00 0.00 35.03 34.34 1di6 n LYS 23 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 1di6 h GLY 24 N 3.09 -0.36 0.74 0.72 0.00 -1.97 -2.08 103.07 103.22 1di6 h GLY 24 Ca 0.00 0.13 0.01 0.00 0.00 0.00 0.00 47.33 47.48 1di6 h GLY 24 CO 0.00 -0.13 -0.14 -2.22 0.00 0.00 0.00 176.54 174.05 1di6 h ILE 25 N -0.87 0.67 -0.95 2.60 1.08 -1.93 -2.40 117.51 115.72 1di6 h ILE 25 Ca -0.03 0.00 0.10 0.00 -0.39 0.00 0.00 64.86 64.53 1di6 h ILE 25 Cb 0.51 0.67 -0.07 0.00 -3.07 0.00 0.00 36.82 34.86 1di6 h ILE 25 CO 0.06 0.00 0.61 -0.65 -0.69 0.00 0.00 178.15 177.48 1di6 h PRO 26 N -0.27 0.96 -0.72 2.37 0.11 -1.83 -0.12 132.00 132.50 1di6 h PRO 26 Ca 0.03 -0.06 -0.07 0.00 0.11 0.00 0.00 66.00 66.01 1di6 h PRO 26 Cb 0.29 -0.22 -0.03 0.00 0.11 0.00 0.00 31.00 31.16 1di6 h PRO 26 CO -0.09 0.63 0.19 0.00 -0.21 0.00 0.00 178.00 178.53 1di6 h ALA 27 N 1.53 0.94 -0.46 -0.75 0.00 -1.17 -1.80 119.26 117.55 1di6 h ALA 27 Ca 0.44 -0.24 -0.14 0.00 0.00 0.00 0.00 54.91 54.97 1di6 h ALA 27 Cb 0.37 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1di6 h ALA 27 CO -0.20 0.65 -0.26 -0.07 0.00 0.00 0.00 179.25 179.37 1di6 h LEU 28 N 1.08 1.02 -0.56 0.00 3.38 -0.88 -1.71 115.31 117.65 1di6 h LEU 28 Ca 0.23 -0.42 -0.02 0.00 0.09 0.00 0.00 57.88 57.76 1di6 h LEU 28 Cb 0.35 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 1di6 h LEU 28 CO -0.00 1.22 0.26 -0.33 0.09 0.00 0.00 178.44 179.67 1di6 h GLU 29 N 0.84 0.82 -0.13 1.13 5.08 -0.76 -1.19 114.58 120.36 1di6 h GLU 29 Ca 0.10 -0.13 -0.01 0.00 -1.00 0.00 0.00 59.36 58.32 1di6 h GLU 29 Cb 0.85 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.95 1di6 h GLU 29 CO 0.08 0.68 0.06 0.93 -1.00 0.00 0.00 179.01 179.75 1di6 h GLU 30 N 0.76 0.19 -0.28 2.33 5.08 -1.34 -2.44 114.58 118.88 1di6 h GLU 30 Ca 0.19 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.49 1di6 h GLU 30 Cb 0.14 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 1di6 h GLU 30 CO -0.02 0.27 0.05 2.35 -1.00 0.00 0.00 179.01 180.66 1di6 h TRP 31 N 0.07 0.49 -0.62 4.33 7.01 -1.12 -2.47 115.95 123.63 1di6 h TRP 31 Ca 0.04 -0.06 -0.04 0.00 2.11 0.00 0.00 58.89 60.94 1di6 h TRP 31 Cb 0.15 -0.13 -0.03 0.00 -2.10 0.00 0.00 29.16 27.05 1di6 h TRP 31 CO -0.02 0.55 0.21 -0.07 -2.79 0.00 0.00 178.44 176.32 1di6 h LEU 32 N 0.28 0.86 -1.14 0.65 3.38 -1.28 -0.49 115.31 117.57 1di6 h LEU 32 Ca 0.09 -0.13 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 1di6 h LEU 32 Cb 0.32 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.82 1di6 h LEU 32 CO 0.00 0.79 0.23 0.74 0.09 0.00 0.00 178.44 180.30 1di6 h THR 33 N 0.90 1.21 0.03 0.22 2.02 -1.27 -1.68 112.91 114.34 1di6 h THR 33 Ca 0.21 -0.65 -0.22 0.00 0.77 0.00 0.00 66.41 66.53 1di6 h THR 33 Cb 0.23 0.52 -0.01 0.00 -1.74 0.00 0.00 68.15 67.15 1di6 h THR 33 CO -0.01 0.26 -0.97 0.77 0.37 0.00 0.00 175.52 175.93 1di6 h SER 34 N 0.82 0.24 0.41 4.18 4.64 -0.94 -3.37 113.55 119.54 1di6 h SER 34 Ca 0.20 -0.22 -0.31 0.00 -0.47 0.00 0.00 61.79 60.98 1di6 h SER 34 Cb 0.16 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 62.16 1di6 h SER 34 CO -0.02 1.08 -1.61 0.00 -0.87 0.00 0.00 176.83 175.41 1di6 h ALA 35 N 0.90 0.35 -2.74 5.18 0.00 -0.88 -3.43 119.26 118.63 1di6 h ALA 35 Ca -0.06 -1.19 -0.57 0.00 0.00 0.00 0.00 54.91 53.10 1di6 h ALA 35 Cb 1.65 0.36 -0.05 0.00 0.00 0.00 0.00 17.79 19.74 1di6 h ALA 35 CO 0.15 1.21 -0.02 -0.51 0.00 0.00 0.00 179.25 180.08 1di6 s LEU 36 N -6.89 4.43 -0.01 0.00 1.43 -0.65 -0.55 118.68 116.44 1di6 s LEU 36 Ca -0.10 1.17 0.14 0.00 -1.03 0.00 0.00 54.13 54.31 1di6 s LEU 36 Cb 0.07 -2.92 -0.19 0.00 0.03 0.00 0.00 46.19 43.18 1di6 s LEU 36 CO 0.84 0.13 0.45 0.35 0.23 0.00 0.00 176.35 178.34 1di6 n THR 37 N 2.58 0.00 -3.20 5.49 -2.24 -0.32 -4.82 114.28 111.78 1di6 n THR 37 Ca -0.07 -0.26 -0.28 0.00 -2.27 0.00 0.00 64.05 61.17 1di6 n THR 37 Cb 0.51 0.55 -0.02 0.00 -2.10 0.00 0.00 70.33 69.27 1di6 n THR 37 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1di6 s THR 38 N -2.70 5.00 0.49 4.28 -4.23 -1.22 -5.00 115.64 112.25 1di6 s THR 38 Ca -0.00 0.05 -0.23 0.00 -1.18 0.00 0.00 61.69 60.33 1di6 s THR 38 Cb 0.10 -3.77 -0.06 0.00 1.34 0.00 0.00 72.50 70.10 1di6 s THR 38 CO 0.60 -0.46 1.25 -2.16 -0.54 0.00 0.00 174.62 173.31 1di6 s PRO 39 N -3.87 3.52 0.09 3.99 0.04 -1.26 -4.93 135.00 132.58 1di6 s PRO 39 Ca 0.44 1.97 -0.05 0.00 0.04 0.00 0.00 61.00 63.41 1di6 s PRO 39 Cb -0.10 -2.36 -0.02 0.00 0.04 0.00 0.00 34.50 32.05 1di6 s PRO 39 CO 0.33 -0.80 0.11 -0.59 0.04 0.00 0.00 177.00 176.09 1di6 s PHE 40 N -1.44 0.42 -0.01 0.56 -0.12 -1.26 -1.69 117.98 114.45 1di6 s PHE 40 Ca 0.66 -0.87 0.02 0.00 -0.05 0.00 0.00 56.93 56.70 1di6 s PHE 40 Cb -0.34 -0.23 -0.01 0.00 -0.63 0.00 0.00 43.02 41.82 1di6 s PHE 40 CO 0.40 -0.51 -0.08 -1.83 -0.05 0.00 0.00 175.22 173.16 1di6 s GLU 41 N -3.93 0.62 -0.07 1.99 -1.05 0.11 -4.89 118.70 111.49 1di6 s GLU 41 Ca 0.10 -0.27 -0.01 0.00 -0.15 0.00 0.00 54.97 54.64 1di6 s GLU 41 Cb 0.06 -0.60 -0.03 0.00 -0.44 0.00 0.00 34.13 33.12 1di6 s GLU 41 CO -0.07 0.16 0.01 -0.51 0.95 0.00 0.00 175.26 175.80 1di6 s LEU 42 N -0.18 3.59 -0.29 1.83 1.43 -1.26 -0.69 118.68 123.12 1di6 s LEU 42 Ca 0.03 0.12 0.03 0.00 -1.03 0.00 0.00 54.13 53.28 1di6 s LEU 42 Cb -0.03 -1.88 0.08 0.00 0.03 0.00 0.00 46.19 44.39 1di6 s LEU 42 CO -0.00 0.36 -0.05 -1.61 0.23 0.00 0.00 176.35 175.28 1di6 s GLU 43 N -1.04 1.91 -0.09 1.70 0.41 -0.69 -4.97 118.70 115.93 1di6 s GLU 43 Ca 0.15 -1.52 -0.01 0.00 -0.41 0.00 0.00 54.97 53.17 1di6 s GLU 43 Cb -0.11 -2.98 -0.03 0.00 -1.78 0.00 0.00 34.13 29.22 1di6 s GLU 43 CO 0.04 -0.71 -0.02 0.95 -0.49 0.00 0.00 175.26 175.03 1di6 s THR 44 N 1.05 4.10 -0.03 3.63 -4.23 -1.26 -0.96 115.64 117.93 1di6 s THR 44 Ca -0.01 -0.32 0.01 0.00 -1.18 0.00 0.00 61.69 60.18 1di6 s THR 44 Cb -0.20 -2.72 0.02 0.00 1.34 0.00 0.00 72.50 70.95 1di6 s THR 44 CO -0.06 0.59 -0.01 -0.13 -0.54 0.00 0.00 174.62 174.46 1di6 s ARG 45 N -0.69 0.40 -0.27 3.99 1.81 -0.03 -4.97 118.95 119.18 1di6 s ARG 45 Ca 0.11 0.03 -0.02 0.00 -1.72 0.00 0.00 55.73 54.13 1di6 s ARG 45 Cb -0.12 -0.53 0.03 0.00 -0.45 0.00 0.00 34.95 33.89 1di6 s ARG 45 CO 0.02 -0.11 -0.02 -1.17 -0.68 0.00 0.00 175.30 173.34 1di6 s LEU 46 N 0.93 3.53 0.12 2.53 2.96 -1.26 -1.14 118.68 126.35 1di6 s LEU 46 Ca -0.10 -1.01 0.03 0.00 -0.22 0.00 0.00 54.13 52.83 1di6 s LEU 46 Cb -0.13 -1.70 -0.04 0.00 0.50 0.00 0.00 46.19 44.81 1di6 s LEU 46 CO -0.01 -0.19 -0.08 0.27 -1.32 0.00 0.00 176.35 175.02 1di6 s ILE 47 N 1.31 0.90 0.75 6.68 -4.36 -0.50 -4.99 121.20 121.00 1di6 s ILE 47 Ca -0.02 -1.96 -0.11 0.00 -0.26 0.00 0.00 60.65 58.30 1di6 s ILE 47 Cb -0.18 -1.72 0.05 0.00 1.25 0.00 0.00 42.46 41.85 1di6 s ILE 47 CO -0.02 -0.80 1.09 -2.16 0.24 0.00 0.00 174.94 173.29 1di6 s PRO 48 N -3.72 2.36 -1.36 0.37 0.04 -1.26 -0.49 135.00 130.94 1di6 s PRO 48 Ca 0.13 1.20 -0.15 0.00 0.04 0.00 0.00 61.00 62.22 1di6 s PRO 48 Cb 0.04 -1.91 0.07 0.00 0.04 0.00 0.00 34.50 32.74 1di6 s PRO 48 CO -0.02 -1.56 1.93 -0.40 0.04 0.00 0.00 177.00 176.98 1di6 n ASP 49 N -3.32 4.53 -3.91 6.66 5.75 -0.53 -4.64 116.55 121.09 1di6 n ASP 49 Ca 0.09 -2.91 -0.26 0.00 -0.01 0.00 0.00 54.79 51.71 1di6 n ASP 49 Cb 0.53 -1.67 -0.17 0.00 -1.03 0.00 0.00 41.12 38.77 1di6 n ASP 49 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 1di6 s GLU 50 N 3.25 1.39 0.25 0.11 0.41 -1.26 -4.91 118.70 117.94 1di6 s GLU 50 Ca 0.49 -0.22 -0.03 0.00 -0.41 0.00 0.00 54.97 54.80 1di6 s GLU 50 Cb 0.08 -1.43 0.47 0.00 -1.78 0.00 0.00 34.13 31.46 1di6 s GLU 50 CO -0.00 -0.22 1.77 0.37 -0.49 0.00 0.00 175.26 176.69 1di6 h GLN 51 N 7.95 0.63 -0.08 1.61 4.15 -1.90 -2.02 115.11 125.46 1di6 h GLN 51 Ca -0.29 -0.04 -0.09 0.00 0.77 0.00 0.00 58.65 59.00 1di6 h GLN 51 Cb 1.14 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 28.67 1di6 h GLN 51 CO 0.40 0.42 -0.35 0.00 -1.93 0.00 0.00 178.83 177.37 1di6 h ALA 52 N 1.51 1.27 -0.03 3.38 0.00 -1.97 -1.10 119.26 122.32 1di6 h ALA 52 Ca 0.43 -0.35 -0.19 0.00 0.00 0.00 0.00 54.91 54.80 1di6 h ALA 52 Cb 0.54 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1di6 h ALA 52 CO -0.32 0.51 -0.79 0.82 0.00 0.00 0.00 179.25 179.46 1di6 h ILE 53 N 0.13 1.44 -0.25 0.00 2.04 -1.75 -1.33 117.51 117.79 1di6 h ILE 53 Ca 0.01 -2.36 -0.05 0.00 1.00 0.00 0.00 64.86 63.47 1di6 h ILE 53 Cb 0.69 2.28 -0.01 0.00 -0.74 0.00 0.00 36.82 39.05 1di6 h ILE 53 CO 0.05 0.69 -0.03 0.40 0.00 0.00 0.00 178.15 179.27 1di6 h ILE 54 N 0.17 1.27 -0.50 -0.67 2.04 -1.05 -1.00 117.51 117.77 1di6 h ILE 54 Ca -0.04 -0.98 0.04 0.00 1.00 0.00 0.00 64.86 64.88 1di6 h ILE 54 Cb 1.38 1.42 -0.04 0.00 -0.74 0.00 0.00 36.82 38.84 1di6 h ILE 54 CO 0.13 0.31 0.27 -0.33 0.00 0.00 0.00 178.15 178.52 1di6 h GLU 55 N 0.21 0.51 -0.82 2.37 5.08 -1.18 -1.28 114.58 119.47 1di6 h GLU 55 Ca 0.07 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 1di6 h GLU 55 Cb 0.46 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.56 1di6 h GLU 55 CO 0.02 0.34 0.52 0.37 -1.00 0.00 0.00 179.01 179.26 1di6 h GLN 56 N 0.52 1.10 -0.55 2.33 5.75 -0.97 -1.68 115.11 121.62 1di6 h GLN 56 Ca 0.22 -0.08 -0.02 0.00 -0.15 0.00 0.00 58.65 58.61 1di6 h GLN 56 Cb 0.10 -0.24 -0.03 0.00 1.07 0.00 0.00 27.48 28.39 1di6 h GLN 56 CO -0.14 0.75 0.26 1.15 -2.65 0.00 0.00 178.83 178.20 1di6 h THR 57 N 1.12 1.20 -0.58 2.39 2.02 -0.75 0.34 112.91 118.65 1di6 h THR 57 Ca 0.30 -0.58 -0.08 0.00 0.77 0.00 0.00 66.41 66.82 1di6 h THR 57 Cb -0.09 0.57 -0.02 0.00 -1.74 0.00 0.00 68.15 66.87 1di6 h THR 57 CO -0.06 0.23 0.05 -0.07 0.37 0.00 0.00 175.52 176.04 1di6 h LEU 58 N 0.74 0.95 -0.76 2.58 3.38 -1.04 -0.98 115.31 120.18 1di6 h LEU 58 Ca 0.19 -0.28 -0.09 0.00 0.09 0.00 0.00 57.88 57.78 1di6 h LEU 58 Cb 0.13 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 1di6 h LEU 58 CO -0.02 1.00 -0.07 0.00 0.09 0.00 0.00 178.44 179.43 1di6 h GLU 60 N 0.79 -0.09 -0.55 0.00 4.81 -0.66 0.11 114.58 119.00 1di6 h GLU 60 Ca 0.14 0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.31 1di6 h GLU 60 Cb 0.57 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.95 1di6 h GLU 60 CO 0.03 -0.06 0.08 -0.07 -0.73 0.00 0.00 179.01 178.27 1di6 h LEU 61 N -0.09 0.88 0.02 1.64 3.38 -0.99 -0.95 115.31 119.19 1di6 h LEU 61 Ca 0.04 -0.26 -0.07 0.00 0.09 0.00 0.00 57.88 57.68 1di6 h LEU 61 Cb 0.15 -0.23 0.01 0.00 0.09 0.00 0.00 40.66 40.67 1di6 h LEU 61 CO -0.10 0.92 -0.29 0.58 0.09 0.00 0.00 178.44 179.64 1di6 h VAL 62 N 0.80 1.58 0.08 1.22 2.07 -1.18 -1.87 116.25 118.95 1di6 h VAL 62 Ca 0.17 -2.09 -0.19 0.00 0.82 0.00 0.00 66.70 65.41 1di6 h VAL 62 Cb 0.42 2.93 0.00 0.00 -1.52 0.00 0.00 31.29 33.12 1di6 h VAL 62 CO 0.01 0.57 -0.92 0.44 0.02 0.00 0.00 177.57 177.69 1di6 h ASP 63 N -0.56 0.27 0.28 0.57 3.32 -0.84 -3.05 116.42 116.40 1di6 h ASP 63 Ca -0.04 -0.87 -0.33 0.00 0.02 0.00 0.00 57.03 55.81 1di6 h ASP 63 Cb 1.09 -0.09 -0.04 0.00 0.22 0.00 0.00 39.33 40.51 1di6 h ASP 63 CO 0.06 1.41 -1.93 -0.62 -1.72 0.00 0.00 179.24 176.43 1di6 n GLU 64 N -4.20 0.69 0.00 3.56 1.02 -0.63 -4.25 120.64 116.82 1di6 n GLU 64 Ca -0.20 0.24 0.12 0.00 -0.02 0.00 0.00 57.16 57.31 1di6 n GLU 64 Cb 0.76 -1.72 0.22 0.00 -0.02 0.00 0.00 31.44 30.68 1di6 n GLU 64 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 1di6 n MET 65 N -3.19 1.12 -3.83 3.49 2.81 -0.46 -4.99 117.12 112.07 1di6 n MET 65 Ca -0.26 -0.80 -0.27 0.00 -1.81 0.00 0.00 57.70 54.56 1di6 n MET 65 Cb 1.06 -1.48 0.03 0.00 -0.71 0.00 0.00 33.22 32.11 1di6 n MET 65 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1di6 n SER 66 N -0.24 -3.32 -4.76 7.83 7.64 -1.07 -4.95 113.62 114.74 1di6 n SER 66 Ca 0.11 -0.80 -0.40 0.00 1.01 0.00 0.00 58.87 58.79 1di6 n SER 66 Cb 0.41 -3.93 -0.03 0.00 -1.01 0.00 0.00 64.21 59.64 1di6 n SER 66 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1di6 h HIS 68 N 3.54 0.00 -3.52 0.00 3.86 -1.25 -3.43 115.15 114.36 1di6 h HIS 68 Ca -0.48 0.00 -0.23 0.00 -1.16 0.00 0.00 60.37 58.50 1di6 h HIS 68 Cb 1.22 0.00 -0.29 0.00 1.06 0.00 0.00 27.41 29.40 1di6 h HIS 68 CO 0.58 0.68 -0.65 -1.17 0.86 0.00 0.00 177.93 178.22 1di6 s LEU 69 N -6.19 1.49 -0.09 2.43 2.96 -1.16 -2.27 118.68 115.84 1di6 s LEU 69 Ca -0.00 0.14 0.02 0.00 -0.22 0.00 0.00 54.13 54.06 1di6 s LEU 69 Cb 0.08 0.18 0.02 0.00 0.50 0.00 0.00 46.19 46.97 1di6 s LEU 69 CO 0.79 -0.06 -0.12 -0.69 -1.32 0.00 0.00 176.35 174.95 1di6 s VAL 70 N 0.39 1.22 -0.19 1.68 1.01 0.05 -0.80 120.40 123.77 1di6 s VAL 70 Ca -0.03 -0.49 -0.01 0.00 0.00 0.00 0.00 61.98 61.45 1di6 s VAL 70 Cb -0.04 -1.14 -0.00 0.00 0.00 0.00 0.00 36.38 35.20 1di6 s VAL 70 CO -0.01 0.38 -0.11 -0.76 0.00 0.00 0.00 175.10 174.60 1di6 s LEU 71 N 0.97 2.62 0.13 3.92 1.43 -0.18 -1.31 118.68 126.26 1di6 s LEU 71 Ca -0.08 -0.45 0.03 0.00 -1.03 0.00 0.00 54.13 52.60 1di6 s LEU 71 Cb -0.15 -1.63 -0.04 0.00 0.03 0.00 0.00 46.19 44.40 1di6 s LEU 71 CO -0.00 0.03 0.19 0.42 0.23 0.00 0.00 176.35 177.22 1di6 s THR 72 N 1.14 4.92 -0.04 5.49 -4.23 -0.60 -1.53 115.64 120.78 1di6 s THR 72 Ca 0.01 -0.81 0.01 0.00 -1.18 0.00 0.00 61.69 59.72 1di6 s THR 72 Cb -0.14 -3.49 0.02 0.00 1.34 0.00 0.00 72.50 70.23 1di6 s THR 72 CO -0.03 -0.04 -0.03 0.42 -0.54 0.00 0.00 174.62 174.40 1di6 s THR 73 N -1.67 0.42 0.00 3.99 -4.23 0.17 -0.35 115.64 113.97 1di6 s THR 73 Ca 0.33 -0.05 0.00 0.00 -1.18 0.00 0.00 61.69 60.79 1di6 s THR 73 Cb -0.11 -0.47 0.00 0.00 1.34 0.00 0.00 72.50 73.26 1di6 s THR 73 CO 0.26 0.20 0.00 0.61 -0.54 0.00 0.00 174.62 175.15 1di6 n GLY 74 N 4.14 2.33 2.33 3.99 0.00 -0.97 -1.42 105.19 115.59 1di6 n GLY 74 Ca -0.24 -1.84 -0.11 0.00 0.00 0.00 0.00 46.02 43.83 1di6 n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1di6 n GLY 75 N 1.71 0.10 0.51 -0.02 0.00 -1.26 -4.70 105.19 101.52 1di6 n GLY 75 Ca 0.00 -0.36 0.05 0.00 0.00 0.00 0.00 46.02 45.70 1di6 n GLY 75 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1di6 n THR 76 N -3.86 0.80 -0.62 2.61 -2.24 -1.26 -1.70 114.28 108.01 1di6 n THR 76 Ca -0.06 -0.90 0.00 0.00 -2.27 0.00 0.00 64.05 60.82 1di6 n THR 76 Cb 0.56 0.64 0.00 0.00 -2.10 0.00 0.00 70.33 69.43 1di6 n THR 76 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1di6 n GLY 77 N 0.40 -0.47 0.11 3.38 0.00 -1.26 -0.08 105.19 107.28 1di6 n GLY 77 Ca 0.09 -1.71 0.12 0.00 0.00 0.00 0.00 46.02 44.52 1di6 n GLY 77 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1di6 h PRO 78 N 0.00 0.00 -7.21 1.61 0.13 -1.91 -3.44 132.00 121.18 1di6 h PRO 78 Ca 0.00 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.60 1di6 h PRO 78 Cb 0.00 0.00 0.17 0.00 0.13 0.00 0.00 31.00 31.30 1di6 h PRO 78 CO 0.00 0.00 0.34 0.00 -0.23 0.00 0.00 178.00 178.11 1di6 s ALA 79 N -3.24 1.89 0.29 -0.56 0.00 -1.26 -4.91 121.76 113.97 1di6 s ALA 79 Ca 0.04 0.80 0.01 0.00 0.00 0.00 0.00 51.96 52.81 1di6 s ALA 79 Cb 0.10 -3.47 0.52 0.00 0.00 0.00 0.00 23.12 20.28 1di6 s ALA 79 CO 0.73 -2.21 1.88 0.00 0.00 0.00 0.00 175.76 176.16 1di6 h ARG 80 N -0.84 1.01 0.00 0.00 -0.00 -2.04 -1.77 114.38 110.74 1di6 h ARG 80 Ca -0.46 -0.06 0.00 0.00 -0.50 0.00 0.00 59.98 58.96 1di6 h ARG 80 Cb 1.29 -0.23 0.00 0.00 0.00 0.00 0.00 29.97 31.03 1di6 h ARG 80 CO 0.47 0.67 0.00 0.00 0.00 0.00 0.00 179.97 181.11 1di6 h ARG 81 N 1.04 0.00 -6.38 0.04 3.08 -1.96 -3.43 114.38 106.78 1di6 h ARG 81 Ca 0.43 0.00 -0.54 0.00 0.07 0.00 0.00 59.98 59.94 1di6 h ARG 81 Cb 0.30 0.00 -0.08 0.00 0.08 0.00 0.00 29.97 30.28 1di6 h ARG 81 CO -0.19 0.00 1.06 -0.51 -1.07 0.00 0.00 179.97 179.26 1di6 s ASP 82 N -4.55 6.17 -0.08 7.04 1.11 -0.67 -4.79 116.67 120.90 1di6 s ASP 82 Ca 0.08 -0.37 0.11 0.00 0.18 0.00 0.00 52.55 52.56 1di6 s ASP 82 Cb 0.11 -2.56 0.17 0.00 1.07 0.00 0.00 42.92 41.72 1di6 s ASP 82 CO 0.54 -1.81 1.07 1.33 1.18 0.00 0.00 175.17 177.48 1di6 n VAL 83 N 6.43 1.36 -0.23 -1.27 0.24 -1.18 -4.77 118.33 118.92 1di6 n VAL 83 Ca 0.04 -1.59 -0.06 0.00 -2.04 0.00 0.00 64.34 60.69 1di6 n VAL 83 Cb 0.49 0.08 0.04 0.00 -1.47 0.00 0.00 33.84 32.99 1di6 n VAL 83 CO 0.00 0.00 0.00 0.74 -2.14 0.00 0.00 176.83 175.43 1di6 h THR 84 N 0.98 1.17 -0.13 3.34 2.02 -1.61 -1.02 112.91 117.66 1di6 h THR 84 Ca 0.00 -0.34 -0.06 0.00 0.77 0.00 0.00 66.41 66.77 1di6 h THR 84 Cb 0.93 0.26 -0.01 0.00 -1.74 0.00 0.00 68.15 67.58 1di6 h THR 84 CO 0.00 0.17 -0.21 -0.65 0.37 0.00 0.00 175.52 175.20 1di6 h PRO 85 N 0.87 0.23 -0.37 6.66 0.11 -1.86 -1.61 132.00 136.02 1di6 h PRO 85 Ca 0.23 -0.06 -0.10 0.00 0.11 0.00 0.00 66.00 66.17 1di6 h PRO 85 Cb -0.07 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.00 1di6 h PRO 85 CO -0.05 0.43 -0.18 -0.44 -0.21 0.00 0.00 178.00 177.56 1di6 h ASP 86 N 0.21 0.80 -0.53 -2.05 5.19 -1.78 -0.57 116.42 117.69 1di6 h ASP 86 Ca 0.04 -0.40 -0.06 0.00 -0.62 0.00 0.00 57.03 55.98 1di6 h ASP 86 Cb 0.49 -0.22 -0.03 0.00 0.18 0.00 0.00 39.33 39.75 1di6 h ASP 86 CO 0.03 1.03 0.11 0.00 -3.12 0.00 0.00 179.24 177.29 1di6 h ALA 87 N 0.80 1.10 -0.35 3.45 0.00 -0.96 -0.86 119.26 122.45 1di6 h ALA 87 Ca 0.08 -0.23 -0.11 0.00 0.00 0.00 0.00 54.91 54.65 1di6 h ALA 87 Cb 0.72 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1di6 h ALA 87 CO 0.05 0.59 -0.22 1.15 0.00 0.00 0.00 179.25 180.82 1di6 h THR 88 N 0.87 1.29 -0.39 0.00 2.02 -0.93 -2.60 112.91 113.17 1di6 h THR 88 Ca 0.18 -1.36 -0.06 0.00 0.77 0.00 0.00 66.41 65.94 1di6 h THR 88 Cb 0.36 1.40 -0.02 0.00 -1.74 0.00 0.00 68.15 68.15 1di6 h THR 88 CO 0.01 0.45 -0.01 -0.07 0.37 0.00 0.00 175.52 176.26 1di6 h LEU 89 N 0.56 0.60 -1.27 2.58 3.38 -1.05 -2.85 115.31 117.26 1di6 h LEU 89 Ca 0.07 -0.13 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 1di6 h LEU 89 Cb 0.78 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.35 1di6 h LEU 89 CO 0.06 0.68 0.17 0.00 0.09 0.00 0.00 178.44 179.43 1di6 h ALA 90 N 1.40 1.42 -0.03 1.53 0.00 -0.83 -2.64 119.26 120.11 1di6 h ALA 90 Ca 0.12 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1di6 h ALA 90 Cb 0.39 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1di6 h ALA 90 CO 0.01 0.43 0.00 1.33 0.00 0.00 0.00 179.25 181.03 1di6 n VAL 91 N -4.34 0.02 -2.79 0.00 0.24 -1.01 -4.98 118.33 105.46 1di6 n VAL 91 Ca 0.03 -0.32 -0.34 0.00 -2.04 0.00 0.00 64.34 61.68 1di6 n VAL 91 Cb 0.17 0.73 -0.07 0.00 -1.47 0.00 0.00 33.84 33.20 1di6 n VAL 91 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1di6 s ALA 92 N -1.98 3.05 -0.06 2.33 0.00 -1.00 -4.74 121.76 119.36 1di6 s ALA 92 Ca 0.35 0.44 0.04 0.00 0.00 0.00 0.00 51.96 52.79 1di6 s ALA 92 Cb 0.21 -3.16 -0.25 0.00 0.00 0.00 0.00 23.12 19.92 1di6 s ALA 92 CO 0.32 0.10 0.58 -0.44 0.00 0.00 0.00 175.76 176.32 1di6 h ASP 93 N 2.06 0.19 -4.63 0.00 3.32 -1.09 -3.49 116.42 112.78 1di6 h ASP 93 Ca -0.49 -0.40 -0.09 0.00 0.02 0.00 0.00 57.03 56.07 1di6 h ASP 93 Cb 1.18 -0.06 -0.21 0.00 0.22 0.00 0.00 39.33 40.47 1di6 h ASP 93 CO 0.61 1.36 -0.09 -0.60 -1.72 0.00 0.00 179.24 178.81 1di6 s ARG 94 N -2.59 0.76 0.15 3.56 3.52 -0.98 -5.02 118.95 118.36 1di6 s ARG 94 Ca -0.11 0.24 -0.06 0.00 -0.13 0.00 0.00 55.73 55.67 1di6 s ARG 94 Cb 0.07 0.35 -0.06 0.00 -1.56 0.00 0.00 34.95 33.76 1di6 s ARG 94 CO 0.81 -0.19 0.40 -2.00 -0.81 0.00 0.00 175.30 173.51 1di6 s GLU 95 N -0.75 3.65 -0.64 5.12 2.12 -1.26 -0.86 118.70 126.08 1di6 s GLU 95 Ca -0.08 -0.02 0.02 0.00 0.36 0.00 0.00 54.97 55.25 1di6 s GLU 95 Cb -0.03 -2.82 0.16 0.00 0.26 0.00 0.00 34.13 31.69 1di6 s GLU 95 CO 0.05 0.45 0.42 -1.64 -0.54 0.00 0.00 175.26 174.00 1di6 s MET 96 N -2.65 2.39 0.53 4.30 -1.94 -0.60 -4.91 119.30 116.42 1di6 s MET 96 Ca 0.42 -2.89 0.18 0.00 -1.71 0.00 0.00 55.69 51.69 1di6 s MET 96 Cb -0.12 -3.51 1.33 0.00 2.01 0.00 0.00 34.83 34.54 1di6 s MET 96 CO 0.24 -1.19 2.13 -1.00 -0.01 0.00 0.00 175.02 175.19 1di6 h PRO 97 N 6.24 0.00 -0.17 2.03 0.13 -1.98 -2.32 132.00 135.93 1di6 h PRO 97 Ca 0.02 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.13 1di6 h PRO 97 Cb 0.86 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.98 1di6 h PRO 97 CO 0.72 0.00 -0.01 0.78 -0.23 0.00 0.00 178.00 179.26 1di6 h GLY 98 N 0.00 0.27 0.78 1.56 0.00 -1.94 -2.19 103.07 101.54 1di6 h GLY 98 Ca 0.04 -0.13 -0.05 0.00 0.00 0.00 0.00 47.33 47.19 1di6 h GLY 98 CO -0.00 0.13 -0.07 0.74 0.00 0.00 0.00 176.54 177.34 1di6 h PHE 99 N 0.25 0.40 -0.11 5.60 -1.00 -1.76 -0.45 116.94 119.88 1di6 h PHE 99 Ca 0.06 -0.10 0.01 0.00 2.81 0.00 0.00 57.97 60.75 1di6 h PHE 99 Cb 0.19 -0.10 -0.01 0.00 3.61 0.00 0.00 35.95 39.65 1di6 h PHE 99 CO 0.00 0.65 0.05 0.78 -1.61 0.00 0.00 178.31 178.18 1di6 h GLY 100 N 0.05 0.13 0.76 -1.45 0.00 -1.66 -0.62 103.07 100.29 1di6 h GLY 100 Ca 0.04 -0.03 0.04 0.00 0.00 0.00 0.00 47.33 47.38 1di6 h GLY 100 CO 0.02 0.03 0.24 0.83 0.00 0.00 0.00 176.54 177.65 1di6 h GLU 101 N 0.10 0.45 0.00 4.80 5.08 -1.38 -2.01 114.58 121.63 1di6 h GLU 101 Ca 0.04 -0.03 -0.18 0.00 -1.00 0.00 0.00 59.36 58.19 1di6 h GLU 101 Cb 0.01 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.14 1di6 h GLU 101 CO -0.04 0.30 -0.87 0.37 -1.00 0.00 0.00 179.01 177.77 1di6 h GLN 102 N 0.47 0.00 -0.84 2.33 5.75 -1.01 -0.79 115.11 121.02 1di6 h GLN 102 Ca 0.20 0.00 -0.03 0.00 -0.15 0.00 0.00 58.65 58.67 1di6 h GLN 102 Cb 0.10 0.00 -0.04 0.00 1.07 0.00 0.00 27.48 28.62 1di6 h GLN 102 CO -0.14 0.87 0.41 0.52 -2.65 0.00 0.00 178.83 177.84 1di6 h MET 103 N 0.00 1.20 -0.47 1.69 2.86 -1.03 0.84 114.93 120.02 1di6 h MET 103 Ca -0.01 -0.17 -0.08 0.00 -2.06 0.00 0.00 59.70 57.38 1di6 h MET 103 Cb 1.60 -0.22 -0.02 0.00 0.06 0.00 0.00 31.60 33.02 1di6 h MET 103 CO 0.11 0.92 -0.03 0.00 1.06 0.00 0.00 176.91 178.97 1di6 h ARG 104 N 1.19 0.86 -0.57 1.72 3.08 -1.17 -1.32 114.38 118.17 1di6 h ARG 104 Ca 0.29 -0.29 -0.06 0.00 0.07 0.00 0.00 59.98 59.99 1di6 h ARG 104 Cb 0.11 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.07 1di6 h ARG 104 CO -0.04 0.92 0.13 1.96 -1.07 0.00 0.00 179.97 181.87 1di6 h GLN 105 N 0.71 0.92 -0.05 0.04 1.08 -0.79 -0.47 115.11 116.55 1di6 h GLN 105 Ca 0.13 -0.23 0.01 0.00 -1.45 0.00 0.00 58.65 57.12 1di6 h GLN 105 Cb 0.55 -0.12 -0.01 0.00 -0.05 0.00 0.00 27.48 27.85 1di6 h GLN 105 CO 0.03 0.86 -0.03 0.82 -0.95 0.00 0.00 178.83 179.57 1di6 h ILE 106 N 0.82 0.91 0.00 2.54 2.04 -0.79 -3.07 117.51 119.95 1di6 h ILE 106 Ca 0.18 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 66.01 1di6 h ILE 106 Cb 0.36 0.91 -0.00 0.00 -0.74 0.00 0.00 36.82 37.34 1di6 h ILE 106 CO 0.00 0.00 -0.14 0.28 0.00 0.00 0.00 178.15 178.29 1di6 h SER 107 N -0.03 0.00 0.76 1.72 0.02 -0.93 -1.75 113.55 113.34 1di6 h SER 107 Ca 0.03 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.98 1di6 h SER 107 Cb 0.07 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.61 1di6 h SER 107 CO -0.07 0.14 -0.01 -0.07 -1.14 0.00 0.00 176.83 175.68 1di6 h LEU 108 N 0.00 0.00 -1.31 5.07 3.38 -0.99 -1.30 115.31 120.16 1di6 h LEU 108 Ca -0.00 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.90 1di6 h LEU 108 Cb 0.36 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 1di6 h LEU 108 CO 0.02 0.01 -0.31 0.45 0.09 0.00 0.00 178.44 178.70 1di6 h HIS 109 N 0.00 0.00 0.00 1.13 3.86 -1.33 -3.32 115.15 115.49 1di6 h HIS 109 Ca -0.00 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.18 1di6 h HIS 109 Cb 0.39 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.85 1di6 h HIS 109 CO 0.00 0.31 -0.52 0.74 0.86 0.00 0.00 177.93 179.32 1di6 h PHE 110 N 0.00 0.00 -3.96 2.45 -1.00 -1.40 -3.49 116.94 109.53 1di6 h PHE 110 Ca -0.00 0.00 -0.19 0.00 2.81 0.00 0.00 57.97 60.58 1di6 h PHE 110 Cb 0.66 0.00 -0.22 0.00 3.61 0.00 0.00 35.95 40.00 1di6 h PHE 110 CO 0.00 0.20 -0.71 0.14 -1.61 0.00 0.00 178.31 176.33 1di6 s VAL 111 N -2.16 0.19 0.11 -0.55 -7.23 -0.90 -5.04 120.40 104.82 1di6 s VAL 111 Ca -0.14 -0.88 0.25 0.00 -1.81 0.00 0.00 61.98 59.40 1di6 s VAL 111 Cb 0.02 -0.31 0.26 0.00 0.56 0.00 0.00 36.38 36.91 1di6 s VAL 111 CO 0.24 -0.44 1.83 1.55 -0.31 0.00 0.00 175.10 177.98 1di6 h PRO 112 N 4.73 0.00 0.00 4.82 0.13 -1.86 -2.95 132.00 136.86 1di6 h PRO 112 Ca -0.32 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 1di6 h PRO 112 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1di6 h PRO 112 CO 0.42 0.19 0.00 0.25 -0.23 0.00 0.00 178.00 178.63 1di6 n THR 113 N -3.34 0.21 0.22 1.56 -2.24 -1.26 -3.05 114.28 106.39 1di6 n THR 113 Ca 0.00 0.05 0.17 0.00 -2.27 0.00 0.00 64.05 62.01 1di6 n THR 113 Cb 0.42 -0.75 0.85 0.00 -2.10 0.00 0.00 70.33 68.76 1di6 n THR 113 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1di6 h ALA 114 N 3.06 1.72 0.00 6.98 0.00 -1.81 -0.59 119.26 128.62 1di6 h ALA 114 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1di6 h ALA 114 Cb 0.08 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1di6 h ALA 114 CO 0.00 -0.28 0.00 0.44 0.00 0.00 0.00 179.25 179.41 1di6 n ILE 115 N -3.70 0.70 0.98 0.00 -5.35 -1.17 -2.08 119.36 108.74 1di6 n ILE 115 Ca 0.01 0.17 0.14 0.00 -0.27 0.00 0.00 62.75 62.80 1di6 n ILE 115 Cb 0.31 -0.89 0.57 0.00 -1.74 0.00 0.00 39.64 37.89 1di6 n ILE 115 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 1di6 n LEU 116 N -1.40 0.09 -4.76 7.28 4.77 -0.23 -4.84 117.00 117.90 1di6 n LEU 116 Ca 0.06 0.46 -0.39 0.00 -0.03 0.00 0.00 56.01 56.11 1di6 n LEU 116 Cb 0.17 -0.47 -0.05 0.00 -2.33 0.00 0.00 43.42 40.74 1di6 n LEU 116 CO 0.14 0.00 0.72 -0.44 -1.33 0.00 0.00 177.39 176.48 1di6 s SER 117 N -3.09 7.31 -0.16 -1.43 0.01 -0.88 -3.56 113.70 111.90 1di6 s SER 117 Ca 0.14 2.06 0.16 0.00 1.31 0.00 0.00 55.95 59.61 1di6 s SER 117 Cb 0.18 -2.61 0.55 0.00 0.21 0.00 0.00 66.02 64.35 1di6 s SER 117 CO 0.55 -0.10 1.45 0.54 0.41 0.00 0.00 173.24 176.09 1di6 n ARG 118 N 0.96 3.21 -1.58 12.44 1.74 0.89 -5.00 116.66 129.32 1di6 n ARG 118 Ca 0.00 -2.77 -0.42 0.00 -0.77 0.00 0.00 57.85 53.89 1di6 n ARG 118 Cb 0.47 -1.82 0.01 0.00 -1.02 0.00 0.00 32.46 30.10 1di6 n ARG 118 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1di6 n GLN 119 N -0.13 1.22 -4.35 5.56 10.64 -1.26 -4.75 117.38 124.31 1di6 n GLN 119 Ca 0.21 0.44 -0.18 0.00 -1.83 0.00 0.00 57.00 55.64 1di6 n GLN 119 Cb 0.86 -1.92 -0.10 0.00 -0.86 0.00 0.00 30.24 28.22 1di6 n GLN 119 CO 0.00 0.00 0.00 0.14 -1.83 0.00 0.00 177.06 175.37 1di6 s VAL 120 N -1.27 1.12 -0.06 -0.39 -7.23 -1.26 -4.43 120.40 106.88 1di6 s VAL 120 Ca 0.63 -2.04 0.04 0.00 -1.81 0.00 0.00 61.98 58.80 1di6 s VAL 120 Cb -0.59 -2.36 -0.00 0.00 0.56 0.00 0.00 36.38 33.98 1di6 s VAL 120 CO 0.57 -0.32 -0.21 -0.83 -0.31 0.00 0.00 175.10 174.01 1di6 s GLY 121 N -3.33 1.12 0.22 2.32 0.00 -1.26 -1.52 107.32 104.88 1di6 s GLY 121 Ca 0.29 -0.83 0.00 0.00 0.00 0.00 0.00 44.72 44.18 1di6 s GLY 121 CO 0.09 -0.37 0.14 -1.34 0.00 0.00 0.00 173.10 171.62 1di6 s VAL 122 N 0.14 0.08 -0.09 1.40 -7.23 -0.24 -1.56 120.40 112.90 1di6 s VAL 122 Ca -0.09 -2.00 0.04 0.00 -1.81 0.00 0.00 61.98 58.13 1di6 s VAL 122 Cb -0.14 -2.52 -0.00 0.00 0.56 0.00 0.00 36.38 34.28 1di6 s VAL 122 CO 0.05 0.00 -0.23 -0.63 -0.31 0.00 0.00 175.10 173.97 1di6 s ILE 123 N -4.02 1.99 -0.16 -0.62 1.01 -0.04 -0.99 121.20 118.38 1di6 s ILE 123 Ca 0.39 -1.00 0.01 0.00 0.00 0.00 0.00 60.65 60.05 1di6 s ILE 123 Cb 0.07 -1.72 0.02 0.00 0.01 0.00 0.00 42.46 40.84 1di6 s ILE 123 CO 0.14 0.55 -0.18 -0.60 0.00 0.00 0.00 174.94 174.85 1di6 s ARG 124 N 0.22 2.70 7.24 2.79 3.52 -0.65 -0.45 118.95 134.32 1di6 s ARG 124 Ca -0.14 -0.72 0.00 0.00 -0.13 0.00 0.00 55.73 54.74 1di6 s ARG 124 Cb -0.17 -2.36 0.00 0.00 -1.56 0.00 0.00 34.95 30.86 1di6 s ARG 124 CO 0.07 -0.20 0.00 1.63 -0.81 0.00 0.00 175.30 175.99 1di6 n LYS 125 N 4.63 0.00 -0.27 5.12 5.02 -1.26 -0.73 118.16 130.68 1di6 n LYS 125 Ca -0.19 0.00 0.07 0.00 -2.02 0.00 0.00 58.31 56.16 1di6 n LYS 125 Cb 0.50 0.00 0.19 0.00 -0.02 0.00 0.00 35.03 35.70 1di6 n LYS 125 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1di6 n GLN 126 N 10.76 2.89 -3.86 1.97 6.02 -1.26 -5.02 117.38 128.88 1di6 n GLN 126 Ca 0.00 -2.32 -0.36 0.00 -0.01 0.00 0.00 57.00 54.31 1di6 n GLN 126 Cb 0.00 -1.47 -0.06 0.00 1.02 0.00 0.00 30.24 29.74 1di6 n GLN 126 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1di6 s ALA 127 N -1.66 3.89 -0.15 -1.58 0.00 0.09 -4.87 121.76 117.47 1di6 s ALA 127 Ca 0.29 -0.65 -0.16 0.00 0.00 0.00 0.00 51.96 51.45 1di6 s ALA 127 Cb 0.20 -1.98 -0.04 0.00 0.00 0.00 0.00 23.12 21.30 1di6 s ALA 127 CO 0.13 0.65 0.37 -1.17 0.00 0.00 0.00 175.76 175.74 1di6 s LEU 128 N -1.35 4.24 -0.19 0.00 2.96 -0.96 -1.64 118.68 121.73 1di6 s LEU 128 Ca 0.20 0.61 -0.01 0.00 -0.22 0.00 0.00 54.13 54.71 1di6 s LEU 128 Cb -0.12 -2.51 0.01 0.00 0.50 0.00 0.00 46.19 44.07 1di6 s LEU 128 CO 0.10 0.03 -0.14 -0.63 -1.32 0.00 0.00 176.35 174.39 1di6 s ILE 129 N 0.68 2.61 -0.09 6.68 1.01 -0.16 -0.77 121.20 131.17 1di6 s ILE 129 Ca 0.20 -0.76 0.04 0.00 0.00 0.00 0.00 60.65 60.13 1di6 s ILE 129 Cb -0.14 -2.14 -0.01 0.00 0.01 0.00 0.00 42.46 40.19 1di6 s ILE 129 CO 0.07 0.50 -0.21 -0.76 0.00 0.00 0.00 174.94 174.53 1di6 s LEU 130 N 1.26 2.27 -0.25 2.97 1.43 -0.43 -1.08 118.68 124.86 1di6 s LEU 130 Ca 0.03 -0.47 -0.18 0.00 -1.03 0.00 0.00 54.13 52.48 1di6 s LEU 130 Cb -0.14 -1.46 -0.03 0.00 0.03 0.00 0.00 46.19 44.60 1di6 s LEU 130 CO -0.07 0.20 0.53 0.20 0.23 0.00 0.00 176.35 177.43 1di6 s ASN 131 N 0.13 6.48 0.32 2.29 0.01 -0.57 -1.56 114.94 122.03 1di6 s ASN 131 Ca -0.11 0.57 0.08 0.00 -0.71 0.00 0.00 52.86 52.70 1di6 s ASN 131 Cb -0.16 -2.29 -0.04 0.00 0.41 0.00 0.00 41.25 39.17 1di6 s ASN 131 CO 0.06 -0.27 0.11 -0.76 -1.51 0.00 0.00 177.10 174.73 1di6 s LEU 132 N 2.17 3.25 1.13 0.60 1.43 0.52 -4.63 118.68 123.16 1di6 s LEU 132 Ca 0.22 -0.74 -0.12 0.00 -1.03 0.00 0.00 54.13 52.46 1di6 s LEU 132 Cb -0.16 -1.73 0.26 0.00 0.03 0.00 0.00 46.19 44.59 1di6 s LEU 132 CO 0.09 -0.22 1.05 -2.84 0.23 0.00 0.00 176.35 174.66 1di6 s PRO 133 N -3.80 -0.63 0.19 1.29 0.02 -1.26 -2.28 135.00 128.52 1di6 s PRO 133 Ca 0.36 1.00 0.19 0.00 0.02 0.00 0.00 61.00 62.56 1di6 s PRO 133 Cb -0.03 -1.57 -0.00 0.00 0.02 0.00 0.00 34.50 32.91 1di6 s PRO 133 CO 0.22 -3.58 1.10 0.78 -0.33 0.00 0.00 177.00 175.19 1di6 h GLY 134 N -2.53 0.00 -4.85 0.52 0.00 -1.89 -3.22 103.07 91.10 1di6 h GLY 134 Ca -0.58 0.00 -0.56 0.00 0.00 0.00 0.00 47.33 46.18 1di6 h GLY 134 CO 0.48 0.00 0.02 -0.86 0.00 0.00 0.00 176.54 176.19 1di6 s GLN 135 N -3.09 4.36 0.26 4.80 1.03 -1.26 -4.69 119.66 121.07 1di6 s GLN 135 Ca 0.00 0.80 -0.01 0.00 0.04 0.00 0.00 55.36 56.19 1di6 s GLN 135 Cb 0.08 -3.35 0.55 0.00 0.03 0.00 0.00 33.01 30.32 1di6 s GLN 135 CO 0.78 0.34 1.73 -1.35 -2.54 0.00 0.00 175.29 174.24 1di6 h PRO 136 N 5.70 0.46 -0.63 9.60 0.11 -1.89 -1.42 132.00 143.93 1di6 h PRO 136 Ca -0.45 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 65.57 1di6 h PRO 136 Cb 1.20 -0.10 -0.03 0.00 0.11 0.00 0.00 31.00 32.18 1di6 h PRO 136 CO 0.70 0.30 0.13 -0.22 -0.21 0.00 0.00 178.00 178.71 1di6 h LYS 137 N 0.47 1.01 -0.26 1.05 3.64 -1.99 -2.61 116.57 117.88 1di6 h LYS 137 Ca 0.47 -0.24 -0.11 0.00 -1.27 0.00 0.00 60.65 59.50 1di6 h LYS 137 Cb 0.75 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.42 1di6 h LYS 137 CO -0.43 0.91 -0.30 0.77 -2.27 0.00 0.00 179.45 178.13 1di6 h SER 138 N 0.96 0.54 -0.04 4.20 0.02 -1.72 -1.45 113.55 116.06 1di6 h SER 138 Ca 0.20 -0.20 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1di6 h SER 138 Cb 0.37 -0.15 -0.00 0.00 0.14 0.00 0.00 62.40 62.76 1di6 h SER 138 CO 0.00 0.82 0.03 0.40 -1.14 0.00 0.00 176.83 176.94 1di6 h ILE 139 N 0.46 1.01 -0.44 3.27 2.04 -0.93 -1.65 117.51 121.26 1di6 h ILE 139 Ca 0.06 -0.02 -0.11 0.00 1.00 0.00 0.00 64.86 65.78 1di6 h ILE 139 Cb 0.75 0.96 -0.02 0.00 -0.74 0.00 0.00 36.82 37.78 1di6 h ILE 139 CO 0.06 0.01 -0.17 0.50 0.00 0.00 0.00 178.15 178.55 1di6 h LYS 140 N 0.05 0.85 -0.77 2.37 3.64 -1.36 -2.57 116.57 118.78 1di6 h LYS 140 Ca 0.01 -0.33 -0.05 0.00 -1.27 0.00 0.00 60.65 59.02 1di6 h LYS 140 Cb -0.00 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 31.73 1di6 h LYS 140 CO -0.00 0.96 0.29 0.93 -2.27 0.00 0.00 179.45 179.36 1di6 h GLU 141 N 0.75 1.16 -0.29 1.90 5.08 -1.16 -1.77 114.58 120.26 1di6 h GLU 141 Ca 0.11 -0.22 -0.05 0.00 -1.00 0.00 0.00 59.36 58.20 1di6 h GLU 141 Cb 0.70 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.76 1di6 h GLU 141 CO 0.05 0.96 -0.03 1.15 -1.00 0.00 0.00 179.01 180.14 1di6 h THR 142 N 1.13 1.27 -0.30 1.13 2.02 -1.19 -0.01 112.91 116.96 1di6 h THR 142 Ca 0.26 -1.00 -0.17 0.00 0.77 0.00 0.00 66.41 66.27 1di6 h THR 142 Cb 0.24 1.34 -0.00 0.00 -1.74 0.00 0.00 68.15 67.99 1di6 h THR 142 CO -0.02 0.32 -0.48 -0.07 0.37 0.00 0.00 175.52 175.65 1di6 h LEU 143 N 0.30 0.89 0.00 2.58 3.38 -1.20 -1.21 115.31 120.05 1di6 h LEU 143 Ca 0.08 -0.44 -0.11 0.00 0.09 0.00 0.00 57.88 57.49 1di6 h LEU 143 Cb 0.48 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 1di6 h LEU 143 CO 0.02 1.22 -2.08 1.21 0.09 0.00 0.00 178.44 178.89 1di6 n GLU 144 N -4.02 0.69 0.00 1.13 2.13 -0.69 -1.82 120.64 118.06 1di6 n GLU 144 Ca -0.03 -0.14 0.00 0.00 0.66 0.00 0.00 57.16 57.65 1di6 n GLU 144 Cb 0.58 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.79 1di6 n GLU 144 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1di6 n GLY 145 N 1.46 -1.66 3.28 8.31 0.00 -0.02 -3.11 105.19 113.45 1di6 n GLY 145 Ca -0.13 -1.56 -0.33 0.00 0.00 0.00 0.00 46.02 44.00 1di6 n GLY 145 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1di6 s VAL 146 N 0.00 2.83 0.38 1.61 1.01 -0.11 -4.86 120.40 121.25 1di6 s VAL 146 Ca 0.00 -0.71 0.08 0.00 0.00 0.00 0.00 61.98 61.35 1di6 s VAL 146 Cb 0.00 -2.21 -0.06 0.00 0.00 0.00 0.00 36.38 34.11 1di6 s VAL 146 CO 0.00 0.50 0.06 -0.54 0.00 0.00 0.00 175.10 175.12 1di6 s LYS 147 N 0.88 2.08 0.15 2.72 1.02 -1.26 -0.02 119.74 125.31 1di6 s LYS 147 Ca -0.03 -1.87 0.01 0.00 0.02 0.00 0.00 55.97 54.10 1di6 s LYS 147 Cb -0.15 -1.87 0.03 0.00 -0.52 0.00 0.00 37.83 35.32 1di6 s LYS 147 CO -0.01 0.02 0.20 -0.40 -0.92 0.00 0.00 175.35 174.24 1di6 n ASP 148 N -1.03 0.38 0.08 2.83 5.68 0.05 -4.81 116.55 119.72 1di6 n ASP 148 Ca -0.03 -1.29 0.03 0.00 -0.50 0.00 0.00 54.79 53.00 1di6 n ASP 148 Cb 0.64 -0.12 0.43 0.00 -1.14 0.00 0.00 41.12 40.93 1di6 n ASP 148 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1di6 h ALA 149 N -0.06 1.64 -0.01 2.12 0.00 -2.02 -1.50 119.26 119.43 1di6 h ALA 149 Ca -0.07 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1di6 h ALA 149 Cb 0.27 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1di6 h ALA 149 CO 0.08 0.28 -0.18 0.39 0.00 0.00 0.00 179.25 179.82 1di6 n GLU 150 N -4.39 0.78 -0.14 0.00 -0.58 -1.26 -4.93 120.64 110.11 1di6 n GLU 150 Ca 0.01 -0.38 0.00 0.00 -0.42 0.00 0.00 57.16 56.37 1di6 n GLU 150 Cb 0.16 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.54 1di6 n GLU 150 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1di6 n GLY 151 N 1.31 0.75 3.77 0.62 0.00 -0.57 -5.07 105.19 106.00 1di6 n GLY 151 Ca 0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 1di6 n GLY 151 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1di6 s ASN 152 N -2.49 7.11 0.14 1.61 0.02 -1.26 -4.68 114.94 115.38 1di6 s ASN 152 Ca 0.00 2.13 -0.31 0.00 -1.02 0.00 0.00 52.86 53.66 1di6 s ASN 152 Cb 0.00 -2.61 -0.08 0.00 0.02 0.00 0.00 41.25 38.58 1di6 s ASN 152 CO 0.00 -0.25 1.39 -0.69 0.02 0.00 0.00 177.10 177.58 1di6 s VAL 153 N -1.38 3.18 -0.26 1.60 1.01 -1.26 -0.77 120.40 122.52 1di6 s VAL 153 Ca 0.50 0.88 -0.15 0.00 0.00 0.00 0.00 61.98 63.21 1di6 s VAL 153 Cb -0.27 -3.56 -0.11 0.00 0.00 0.00 0.00 36.38 32.43 1di6 s VAL 153 CO 0.34 0.09 -0.34 0.52 0.00 0.00 0.00 175.10 175.71 1di6 n VAL 154 N 3.59 1.53 -3.85 2.92 0.31 0.97 -4.90 118.33 118.90 1di6 n VAL 154 Ca 0.10 -0.30 -0.21 0.00 -0.01 0.00 0.00 64.34 63.93 1di6 n VAL 154 Cb 0.42 -1.95 -0.17 0.00 -0.91 0.00 0.00 33.84 31.22 1di6 n VAL 154 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1di6 s VAL 155 N -2.56 0.27 0.36 2.52 1.01 -0.74 -4.99 120.40 116.27 1di6 s VAL 155 Ca -0.37 0.13 -0.28 0.00 0.00 0.00 0.00 61.98 61.46 1di6 s VAL 155 Cb 0.13 -0.41 -0.10 0.00 0.00 0.00 0.00 36.38 36.01 1di6 s VAL 155 CO 0.48 0.21 1.34 -1.00 0.00 0.00 0.00 175.10 176.13 1di6 s HIS 156 N 1.62 2.89 0.94 5.22 0.09 -1.26 -0.94 115.29 123.85 1di6 s HIS 156 Ca -0.01 1.37 -0.11 0.00 -0.00 0.00 0.00 55.06 56.31 1di6 s HIS 156 Cb -0.13 -3.74 0.15 0.00 -0.00 0.00 0.00 32.58 28.87 1di6 s HIS 156 CO -0.03 -2.14 1.10 0.20 -0.00 0.00 0.00 174.74 173.87 1di6 s GLY 157 N -0.50 1.64 0.46 -2.22 0.00 -1.18 -4.65 107.32 100.87 1di6 s GLY 157 Ca 0.52 0.20 0.25 0.00 0.00 0.00 0.00 44.72 45.69 1di6 s GLY 157 CO 0.54 0.69 1.90 1.19 0.00 0.00 0.00 173.10 177.42 1di6 h ILE 158 N -1.81 0.57 0.00 0.90 6.09 -1.06 -1.67 117.51 120.53 1di6 h ILE 158 Ca -0.49 -0.96 0.00 0.00 -1.37 0.00 0.00 64.86 62.05 1di6 h ILE 158 Cb 1.28 1.64 0.00 0.00 0.47 0.00 0.00 36.82 40.21 1di6 h ILE 158 CO 0.49 0.20 0.00 0.15 -3.07 0.00 0.00 178.15 175.91 1di6 h PHE 159 N 0.00 0.00 0.00 2.19 3.57 -1.58 -2.97 116.94 118.15 1di6 h PHE 159 Ca -0.00 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 1di6 h PHE 159 Cb 0.62 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.36 1di6 h PHE 159 CO 0.00 0.00 -0.02 0.00 -2.23 0.00 0.00 178.31 176.06 1di6 h ALA 160 N 2.29 1.29 -0.01 2.41 0.00 -1.50 -1.70 119.26 122.04 1di6 h ALA 160 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1di6 h ALA 160 Cb 0.50 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1di6 h ALA 160 CO 0.00 0.03 -0.42 0.43 0.00 0.00 0.00 179.25 179.29 1di6 n SER 161 N -3.53 1.84 -0.09 0.00 7.64 -1.12 -1.89 113.62 116.47 1di6 n SER 161 Ca -0.03 -1.42 -0.14 0.00 1.01 0.00 0.00 58.87 58.30 1di6 n SER 161 Cb 0.12 0.48 -0.05 0.00 -1.01 0.00 0.00 64.21 63.75 1di6 n SER 161 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 1di6 h VAL 162 N 2.13 1.30 -0.24 0.44 2.07 -1.40 -2.01 116.25 118.54 1di6 h VAL 162 Ca 0.00 -1.50 0.03 0.00 0.82 0.00 0.00 66.70 66.05 1di6 h VAL 162 Cb 0.66 1.64 -0.03 0.00 -1.52 0.00 0.00 31.29 32.04 1di6 h VAL 162 CO 0.00 0.48 0.04 -0.65 0.02 0.00 0.00 177.57 177.46 1di6 h PRO 163 N 0.43 0.12 -0.56 1.57 0.11 -1.83 -0.55 132.00 131.30 1di6 h PRO 163 Ca 0.04 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 66.09 1di6 h PRO 163 Cb 0.90 -0.03 -0.03 0.00 0.11 0.00 0.00 31.00 31.96 1di6 h PRO 163 CO 0.08 0.08 0.15 -0.92 -0.21 0.00 0.00 178.00 177.18 1di6 h TYR 164 N 0.13 0.87 -0.69 0.65 3.20 -1.77 -1.82 116.97 117.54 1di6 h TYR 164 Ca 0.11 -0.08 -0.01 0.00 3.14 0.00 0.00 58.73 61.89 1di6 h TYR 164 Cb 0.12 -0.26 -0.03 0.00 1.54 0.00 0.00 36.73 38.10 1di6 h TYR 164 CO -0.16 0.72 0.39 0.00 -1.64 0.00 0.00 178.16 177.47 1di6 h ILE 166 N 0.94 1.25 -0.87 0.00 2.04 -0.84 -1.75 117.51 118.28 1di6 h ILE 166 Ca 0.24 -0.78 0.01 0.00 1.00 0.00 0.00 64.86 65.34 1di6 h ILE 166 Cb 0.02 0.43 -0.04 0.00 -0.74 0.00 0.00 36.82 36.49 1di6 h ILE 166 CO -0.04 0.31 0.57 -0.61 0.00 0.00 0.00 178.15 178.39 1di6 h GLN 167 N 1.01 1.13 0.00 2.37 4.15 -0.88 -1.17 115.11 121.72 1di6 h GLN 167 Ca 0.24 -0.07 -0.04 0.00 0.77 0.00 0.00 58.65 59.55 1di6 h GLN 167 Cb 0.21 -0.26 -0.01 0.00 0.21 0.00 0.00 27.48 27.64 1di6 h GLN 167 CO -0.02 0.75 -0.20 -0.07 -1.93 0.00 0.00 178.83 177.36 1di6 h LEU 168 N 1.17 0.00 -1.17 -2.39 3.38 -0.58 -1.52 115.31 114.20 1di6 h LEU 168 Ca 0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.29 1di6 h LEU 168 Cb -0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.63 1di6 h LEU 168 CO -0.08 0.20 0.00 0.18 0.09 0.00 0.00 178.44 178.83 1di6 n LEU 169 N -3.52 1.70 -1.79 1.67 4.77 -0.71 -4.91 117.00 114.20 1di6 n LEU 169 Ca -0.01 -0.85 -0.14 0.00 -0.03 0.00 0.00 56.01 54.99 1di6 n LEU 169 Cb 0.36 -0.23 0.01 0.00 -2.33 0.00 0.00 43.42 41.23 1di6 n LEU 169 CO 0.32 0.39 -0.06 -0.62 -1.33 0.00 0.00 177.39 176.10 1di6 n GLU 170 N 0.35 -2.35 -1.66 3.23 1.02 -0.57 -4.87 120.64 115.79 1di6 n GLU 170 Ca 0.10 0.59 -0.08 0.00 -0.02 0.00 0.00 57.16 57.75 1di6 n GLU 170 Cb 0.28 -4.76 0.03 0.00 -0.02 0.00 0.00 31.44 26.97 1di6 n GLU 170 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1di6 n GLY 171 N -1.15 1.67 3.72 0.62 0.00 -0.51 -5.02 105.19 104.51 1di6 n GLY 171 Ca -0.10 -2.13 -0.31 0.00 0.00 0.00 0.00 46.02 43.49 1di6 n GLY 171 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1di6 s PRO 172 N -3.09 1.56 -0.42 1.61 0.04 -1.26 -4.58 135.00 128.85 1di6 s PRO 172 Ca 0.24 1.20 -0.26 0.00 0.04 0.00 0.00 61.00 62.21 1di6 s PRO 172 Cb -0.02 -1.82 0.02 0.00 0.04 0.00 0.00 34.50 32.73 1di6 s PRO 172 CO 0.15 -2.14 0.98 -0.47 0.04 0.00 0.00 177.00 175.56 1di6 s TYR 173 N -2.81 2.97 -0.07 0.56 5.04 -1.26 -4.39 117.35 117.39 1di6 s TYR 173 Ca 0.63 0.63 -0.00 0.00 -2.44 0.00 0.00 57.07 55.89 1di6 s TYR 173 Cb -0.19 -3.94 -0.03 0.00 0.35 0.00 0.00 41.96 38.15 1di6 s TYR 173 CO 0.57 -1.02 -0.03 0.08 -1.34 0.00 0.00 175.55 173.81 1di6 s VAL 174 N 3.80 4.06 0.07 3.14 1.01 -1.26 -4.60 120.40 126.62 1di6 s VAL 174 Ca 0.40 -0.39 0.05 0.00 0.00 0.00 0.00 61.98 62.05 1di6 s VAL 174 Cb -0.10 -2.70 -0.03 0.00 0.00 0.00 0.00 36.38 33.54 1di6 s VAL 174 CO 0.24 0.57 -0.15 -1.61 0.00 0.00 0.00 175.10 174.15 1di6 s GLU 175 N -0.95 0.85 0.24 2.72 2.02 -1.26 -4.85 118.70 117.47 1di6 s GLU 175 Ca 0.14 -0.98 0.09 0.00 0.02 0.00 0.00 54.97 54.24 1di6 s GLU 175 Cb -0.11 -0.89 -0.05 0.00 0.10 0.00 0.00 34.13 33.18 1di6 s GLU 175 CO 0.03 0.20 -0.15 0.95 0.02 0.00 0.00 175.26 176.31 1di6 s THR 176 N -1.26 1.97 -0.34 3.63 -4.23 -1.26 -1.17 115.64 112.98 1di6 s THR 176 Ca -0.01 -2.26 -0.29 0.00 -1.18 0.00 0.00 61.69 57.95 1di6 s THR 176 Cb -0.10 -2.20 0.02 0.00 1.34 0.00 0.00 72.50 71.56 1di6 s THR 176 CO 0.02 -0.48 1.11 0.00 -0.54 0.00 0.00 174.62 174.74 1di6 s ALA 177 N -2.82 3.42 0.54 3.99 0.00 0.29 -4.75 121.76 122.42 1di6 s ALA 177 Ca 0.26 -0.11 0.28 0.00 0.00 0.00 0.00 51.96 52.39 1di6 s ALA 177 Cb -0.01 -3.73 1.44 0.00 0.00 0.00 0.00 23.12 20.82 1di6 s ALA 177 CO 0.10 -1.66 1.96 -1.35 0.00 0.00 0.00 175.76 174.81 1di6 h PRO 178 N 8.44 0.00 0.00 0.00 0.11 -1.90 0.14 132.00 138.78 1di6 h PRO 178 Ca -0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.89 1di6 h PRO 178 Cb 1.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1di6 h PRO 178 CO 1.05 0.00 0.00 0.93 -0.21 0.00 0.00 178.00 179.77 1di6 h GLU 179 N 0.00 0.00 0.00 1.05 3.07 -1.98 -3.29 114.58 113.43 1di6 h GLU 179 Ca 0.30 0.00 -0.14 0.00 -0.50 0.00 0.00 59.36 59.03 1di6 h GLU 179 Cb 1.25 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 29.14 1di6 h GLU 179 CO -0.00 0.00 -1.29 0.28 -1.40 0.00 0.00 179.01 176.60 1di6 n VAL 180 N -3.03 1.30 -3.67 3.13 0.31 0.36 -5.03 118.33 111.70 1di6 n VAL 180 Ca -0.01 0.01 -0.10 0.00 -0.01 0.00 0.00 64.34 64.23 1di6 n VAL 180 Cb 0.19 -1.99 -0.09 0.00 -0.91 0.00 0.00 33.84 31.04 1di6 n VAL 180 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1di6 s VAL 181 N -2.54 -0.01 0.03 2.52 0.11 -0.48 -4.93 120.40 115.11 1di6 s VAL 181 Ca -0.24 0.03 -0.21 0.00 -2.93 0.00 0.00 61.98 58.63 1di6 s VAL 181 Cb 0.06 -0.80 -0.06 0.00 -1.53 0.00 0.00 36.38 34.06 1di6 s VAL 181 CO 0.33 0.01 0.62 0.00 -3.33 0.00 0.00 175.10 172.73 1di6 s ALA 182 N 1.14 3.50 -0.57 1.54 0.00 -1.26 -3.96 121.76 122.14 1di6 s ALA 182 Ca -0.07 0.08 -0.22 0.00 0.00 0.00 0.00 51.96 51.76 1di6 s ALA 182 Cb -0.06 -2.76 0.06 0.00 0.00 0.00 0.00 23.12 20.37 1di6 s ALA 182 CO -0.11 0.23 0.82 0.00 0.00 0.00 0.00 175.76 176.70 1di6 s ALA 183 N -0.49 3.25 0.10 0.00 0.00 -1.26 -4.57 121.76 118.79 1di6 s ALA 183 Ca 0.32 -1.68 -0.30 0.00 0.00 0.00 0.00 51.96 50.30 1di6 s ALA 183 Cb -0.19 -3.63 -0.06 0.00 0.00 0.00 0.00 23.12 19.24 1di6 s ALA 183 CO 0.19 -2.37 1.10 0.12 0.00 0.00 0.00 175.76 174.80 1di6 s PHE 184 N 3.43 3.57 -0.04 0.00 5.36 -0.79 -5.00 117.98 124.50 1di6 s PHE 184 Ca 0.21 1.53 -0.12 0.00 -0.96 0.00 0.00 56.93 57.59 1di6 s PHE 184 Cb -0.17 -3.28 0.02 0.00 -0.34 0.00 0.00 43.02 39.25 1di6 s PHE 184 CO 0.13 -0.66 0.27 1.03 -1.46 0.00 0.00 175.22 174.53 1di6 s ARG 185 N 0.38 0.54 0.78 10.12 0.52 -1.26 -4.44 118.95 125.59 1di6 s ARG 185 Ca 0.53 -0.05 -0.12 0.00 -0.52 0.00 0.00 55.73 55.57 1di6 s ARG 185 Cb -0.27 0.24 0.06 0.00 0.52 0.00 0.00 34.95 35.50 1di6 s ARG 185 CO 0.31 -0.13 1.12 -1.25 0.02 0.00 0.00 175.30 175.38 1di6 s PRO 186 N -0.88 2.20 0.28 3.54 0.04 -1.26 -4.82 135.00 134.09 1di6 s PRO 186 Ca -0.10 0.41 0.02 0.00 0.04 0.00 0.00 61.00 61.37 1di6 s PRO 186 Cb -0.05 -1.95 0.63 0.00 0.04 0.00 0.00 34.50 33.18 1di6 s PRO 186 CO 0.03 -1.49 1.76 1.57 0.04 0.00 0.00 177.00 178.90 1di6 h LYS 187 N -0.99 0.62 -0.10 4.56 -0.00 -2.02 -0.12 116.57 118.53 1di6 h LYS 187 Ca -0.47 -0.04 0.03 0.00 -0.00 0.00 0.00 60.65 60.18 1di6 h LYS 187 Cb 1.29 -0.14 -0.00 0.00 -0.00 0.00 0.00 32.23 33.37 1di6 h LYS 187 CO 0.63 0.41 0.10 0.66 -0.00 0.00 0.00 179.45 181.24 1di6 h SER 188 N 0.64 0.00 -0.00 7.07 4.64 -2.06 -2.81 113.55 121.02 1di6 h SER 188 Ca 0.52 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.84 1di6 h SER 188 Cb 0.80 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.89 1di6 h SER 188 CO -0.39 0.00 -0.58 0.00 -0.87 0.00 0.00 176.83 174.98 1di6 n ALA 189 N -2.38 3.71 -2.42 5.18 0.00 -0.08 -5.00 120.51 119.51 1di6 n ALA 189 Ca -0.01 -0.47 -0.42 0.00 0.00 0.00 0.00 53.44 52.55 1di6 n ALA 189 Cb 0.20 -0.56 -0.03 0.00 0.00 0.00 0.00 19.45 19.06 1di6 n ALA 189 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1di6 s ARG 190 N -2.25 4.57 0.00 0.00 3.52 -1.05 -4.96 118.95 118.77 1di6 s ARG 190 Ca 0.08 1.57 0.27 0.00 -0.13 0.00 0.00 55.73 57.52 1di6 s ARG 190 Cb 0.12 -3.38 0.74 0.00 -1.56 0.00 0.00 34.95 30.87 1di6 s ARG 190 CO 0.55 -0.02 1.57 0.54 -0.81 0.00 0.00 175.30 177.13