#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1m7a s LEU 2 N 0.00 4.18 -0.85 -0.89 2.96 -1.26 -4.21 118.68 118.60 1m7a s LEU 2 Ca 0.00 0.24 -0.24 0.00 -0.22 0.00 0.00 54.13 53.91 1m7a s LEU 2 Cb 0.00 -2.14 0.03 0.00 0.50 0.00 0.00 46.19 44.58 1m7a s LEU 2 CO 0.00 0.12 0.48 0.29 -1.32 0.00 0.00 176.35 175.93 1m7a n LYS 3 N 3.80 -0.49 -1.66 1.98 4.76 -1.26 -4.92 118.16 120.37 1m7a n LYS 3 Ca -0.15 -0.06 -0.32 0.00 -2.87 0.00 0.00 58.31 54.91 1m7a n LYS 3 Cb 0.52 -1.49 0.05 0.00 -1.84 0.00 0.00 35.03 32.27 1m7a n LYS 3 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1m7a s PRO 4 N -6.59 2.73 0.12 1.97 0.04 -1.26 -4.99 135.00 127.02 1m7a s PRO 4 Ca 0.33 1.29 -0.30 0.00 0.04 0.00 0.00 61.00 62.36 1m7a s PRO 4 Cb -0.18 -1.95 -0.06 0.00 0.04 0.00 0.00 34.50 32.35 1m7a s PRO 4 CO 0.70 -1.29 1.01 -0.80 0.04 0.00 0.00 177.00 176.66 1m7a s ASN 5 N -2.87 7.41 0.05 6.66 0.01 -1.26 -4.85 114.94 120.09 1m7a s ASN 5 Ca 0.65 1.89 0.08 0.00 -0.71 0.00 0.00 52.86 54.76 1m7a s ASN 5 Cb -0.19 -2.59 -0.03 0.00 0.41 0.00 0.00 41.25 38.85 1m7a s ASN 5 CO 0.45 -0.14 -0.20 -0.69 -1.51 0.00 0.00 177.10 175.02 1m7a s VAL 6 N 0.01 2.66 -0.01 1.60 1.01 -0.54 -4.39 120.40 120.74 1m7a s VAL 6 Ca 0.48 -1.29 0.07 0.00 0.00 0.00 0.00 61.98 61.25 1m7a s VAL 6 Cb -0.25 -2.12 -0.02 0.00 0.00 0.00 0.00 36.38 33.98 1m7a s VAL 6 CO 0.31 0.30 -0.23 0.00 0.00 0.00 0.00 175.10 175.49 1m7a s ALA 7 N -0.94 2.33 -0.07 5.51 0.00 -0.58 -0.96 121.76 127.05 1m7a s ALA 7 Ca 0.14 -1.12 -0.11 0.00 0.00 0.00 0.00 51.96 50.88 1m7a s ALA 7 Cb -0.10 -0.65 -0.05 0.00 0.00 0.00 0.00 23.12 22.32 1m7a s ALA 7 CO 0.05 0.54 0.27 0.42 0.00 0.00 0.00 175.76 177.04 1m7a s ILE 8 N -0.70 5.28 -0.09 0.00 1.01 0.26 -0.72 121.20 126.23 1m7a s ILE 8 Ca 0.11 0.51 0.02 0.00 0.00 0.00 0.00 60.65 61.29 1m7a s ILE 8 Cb -0.10 -3.56 0.01 0.00 0.01 0.00 0.00 42.46 38.83 1m7a s ILE 8 CO 0.00 0.58 -0.14 -0.51 0.00 0.00 0.00 174.94 174.88 1m7a s ILE 9 N -0.92 1.36 0.07 2.92 2.07 -0.70 -0.34 121.20 125.67 1m7a s ILE 9 Ca 0.19 -0.58 -0.16 0.00 -1.41 0.00 0.00 60.65 58.70 1m7a s ILE 9 Cb -0.14 -1.25 0.03 0.00 0.13 0.00 0.00 42.46 41.22 1m7a s ILE 9 CO 0.08 0.41 0.36 0.54 -1.91 0.00 0.00 174.94 174.42 1m7a s VAL 10 N 0.92 0.07 -0.14 4.00 0.11 -0.46 -4.57 120.40 120.32 1m7a s VAL 10 Ca -0.09 -0.61 -0.00 0.00 -2.93 0.00 0.00 61.98 58.36 1m7a s VAL 10 Cb -0.15 -1.03 -0.01 0.00 -1.53 0.00 0.00 36.38 33.66 1m7a s VAL 10 CO 0.00 -0.33 -0.14 0.00 -3.33 0.00 0.00 175.10 171.30 1m7a s ALA 11 N -2.92 2.57 0.01 1.54 0.00 -1.26 -0.71 121.76 120.99 1m7a s ALA 11 Ca -0.02 -0.95 -0.02 0.00 0.00 0.00 0.00 51.96 50.97 1m7a s ALA 11 Cb 0.00 -1.22 -0.01 0.00 0.00 0.00 0.00 23.12 21.89 1m7a s ALA 11 CO -0.06 0.14 0.01 0.00 0.00 0.00 0.00 175.76 175.85 1m7a s ALA 12 N 0.54 0.00 -0.18 0.00 0.00 -0.25 -4.69 121.76 117.19 1m7a s ALA 12 Ca -0.09 -0.40 -0.19 0.00 0.00 0.00 0.00 51.96 51.28 1m7a s ALA 12 Cb -0.16 0.11 -0.03 0.00 0.00 0.00 0.00 23.12 23.04 1m7a s ALA 12 CO 0.04 -0.15 0.55 -1.17 0.00 0.00 0.00 175.76 175.03 1m7a s LEU 13 N -1.24 4.18 0.49 0.00 2.96 -0.50 -1.42 118.68 123.16 1m7a s LEU 13 Ca -0.13 0.78 -0.18 0.00 -0.22 0.00 0.00 54.13 54.37 1m7a s LEU 13 Cb -0.08 -2.78 -0.09 0.00 0.50 0.00 0.00 46.19 43.74 1m7a s LEU 13 CO -0.00 -0.17 0.98 -0.54 -1.32 0.00 0.00 176.35 175.30 1m7a s LYS 14 N 1.47 4.03 0.00 1.98 1.02 0.37 -0.37 119.74 128.24 1m7a s LYS 14 Ca 0.27 1.01 0.23 0.00 0.02 0.00 0.00 55.97 57.49 1m7a s LYS 14 Cb -0.16 -2.15 0.16 0.00 -0.52 0.00 0.00 37.83 35.17 1m7a s LYS 14 CO 0.10 -0.21 1.17 -0.35 -0.92 0.00 0.00 175.35 175.15 1m7a n PRO 15 N -1.31 0.05 0.13 -1.68 -0.04 -1.26 -4.74 135.00 126.16 1m7a n PRO 15 Ca 0.07 -0.03 0.13 0.00 -0.04 0.00 0.00 63.50 63.62 1m7a n PRO 15 Cb 0.54 -1.50 0.42 0.00 -0.04 0.00 0.00 33.50 32.92 1m7a n PRO 15 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1m7a h ALA 16 N 3.04 1.00 -4.96 0.55 0.00 -1.99 -3.47 119.26 113.42 1m7a h ALA 16 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.65 1m7a h ALA 16 Cb 0.51 0.00 0.14 0.00 0.00 0.00 0.00 17.79 18.44 1m7a h ALA 16 CO 0.00 0.00 -0.63 1.28 0.00 0.00 0.00 179.25 179.90 1m7a n LEU 17 N -2.40 -3.78 -4.78 0.00 4.77 0.50 -4.54 117.00 106.78 1m7a n LEU 17 Ca 0.04 -0.51 -0.37 0.00 -0.03 0.00 0.00 56.01 55.14 1m7a n LEU 17 Cb 0.38 -2.64 -0.06 0.00 -2.33 0.00 0.00 43.42 38.78 1m7a n LEU 17 CO 0.28 0.29 0.67 -0.83 -1.33 0.00 0.00 177.39 176.46 1m7a s GLY 18 N -4.03 2.82 0.00 -0.72 0.00 -0.99 -1.27 107.32 103.13 1m7a s GLY 18 Ca 0.04 0.57 0.00 0.00 0.00 0.00 0.00 44.72 45.33 1m7a s GLY 18 CO 0.59 1.03 0.00 0.29 0.00 0.00 0.00 173.10 175.01 1m7a n ILE 19 N 0.56 0.00 -3.81 0.90 -5.35 -0.66 -1.41 119.36 109.59 1m7a n ILE 19 Ca 0.02 -0.22 -0.03 0.00 -0.27 0.00 0.00 62.75 62.25 1m7a n ILE 19 Cb 0.50 0.84 0.00 0.00 -1.74 0.00 0.00 39.64 39.24 1m7a n ILE 19 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1m7a s GLY 20 N -0.71 -0.06 -0.30 3.28 0.00 -1.18 -4.62 107.32 103.74 1m7a s GLY 20 Ca 0.00 -0.09 -0.10 0.00 0.00 0.00 0.00 44.72 44.54 1m7a s GLY 20 CO 0.00 1.25 0.67 -0.47 0.00 0.00 0.00 173.10 174.55 1m7a s TYR 21 N -2.64 -1.32 -1.34 1.90 6.14 0.02 -1.67 117.35 118.43 1m7a s TYR 21 Ca 0.17 2.20 -0.03 0.00 0.64 0.00 0.00 57.07 60.05 1m7a s TYR 21 Cb -0.02 0.76 0.02 0.00 0.42 0.00 0.00 41.96 43.14 1m7a s TYR 21 CO 0.04 -0.66 0.81 0.36 0.64 0.00 0.00 175.55 176.73 1m7a n LYS 22 N 5.42 -5.36 -0.93 4.97 2.85 -1.26 -1.93 118.16 121.92 1m7a n LYS 22 Ca -0.11 0.65 0.00 0.00 -1.05 0.00 0.00 58.31 57.80 1m7a n LYS 22 Cb 0.49 -5.34 0.00 0.00 -0.65 0.00 0.00 35.03 29.53 1m7a n LYS 22 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1m7a n GLY 23 N -1.58 0.43 3.48 2.58 0.00 -1.26 -5.00 105.19 103.85 1m7a n GLY 23 Ca -0.22 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.57 1m7a n GLY 23 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1m7a s LYS 24 N -0.60 1.70 0.10 1.61 0.00 -0.81 -5.02 119.74 116.71 1m7a s LYS 24 Ca 0.00 -1.93 -0.26 0.00 0.00 0.00 0.00 55.97 53.79 1m7a s LYS 24 Cb 0.00 -1.11 -0.06 0.00 0.00 0.00 0.00 37.83 36.65 1m7a s LYS 24 CO 0.00 -0.10 0.80 -1.64 0.00 0.00 0.00 175.35 174.41 1m7a s MET 25 N -3.81 4.56 0.00 1.78 -1.94 -1.26 -0.80 119.30 117.82 1m7a s MET 25 Ca 0.34 1.16 0.06 0.00 -1.71 0.00 0.00 55.69 55.54 1m7a s MET 25 Cb 0.08 -3.33 0.34 0.00 2.01 0.00 0.00 34.83 33.93 1m7a s MET 25 CO 0.15 0.38 1.08 -0.35 -0.01 0.00 0.00 175.02 176.27 1m7a n PRO 26 N 2.34 0.84 -3.77 2.03 -0.05 -1.26 -4.82 135.00 130.31 1m7a n PRO 26 Ca -0.03 0.00 -0.09 0.00 -0.05 0.00 0.00 63.50 63.33 1m7a n PRO 26 Cb 0.49 -1.11 -0.04 0.00 -0.05 0.00 0.00 33.50 32.80 1m7a n PRO 26 CO 0.00 0.00 0.00 1.67 -0.05 0.00 0.00 175.50 177.12 1m7a s TRP 27 N -2.00 -0.07 -0.31 0.54 -2.14 -1.26 -5.00 118.94 108.69 1m7a s TRP 27 Ca 0.09 -0.28 -0.02 0.00 2.66 0.00 0.00 56.10 58.55 1m7a s TRP 27 Cb 0.04 0.39 0.10 0.00 -3.10 0.00 0.00 33.47 30.90 1m7a s TRP 27 CO 0.07 -0.94 0.12 0.50 -2.66 0.00 0.00 176.95 174.04 1m7a s ARG 28 N -3.89 0.58 -0.36 3.25 3.52 -1.26 -5.09 118.95 115.71 1m7a s ARG 28 Ca 0.10 -0.98 -0.04 0.00 -0.13 0.00 0.00 55.73 54.69 1m7a s ARG 28 Cb -0.01 -1.72 0.07 0.00 -1.56 0.00 0.00 34.95 31.73 1m7a s ARG 28 CO -0.01 -1.02 0.11 -0.51 -0.81 0.00 0.00 175.30 173.06 1m7a s LEU 29 N 1.66 4.57 0.21 -0.88 1.43 -1.26 -5.00 118.68 119.42 1m7a s LEU 29 Ca 0.10 -1.54 -0.08 0.00 -1.03 0.00 0.00 54.13 51.58 1m7a s LEU 29 Cb -0.18 -1.81 0.16 0.00 0.03 0.00 0.00 46.19 44.40 1m7a s LEU 29 CO -0.26 -0.40 1.80 0.03 0.23 0.00 0.00 176.35 177.75 1m7a h ARG 30 N 8.09 1.16 -0.12 1.70 3.08 -2.00 -2.53 114.38 123.77 1m7a h ARG 30 Ca -0.19 -0.18 -0.15 0.00 0.07 0.00 0.00 59.98 59.53 1m7a h ARG 30 Cb 1.06 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.90 1m7a h ARG 30 CO 0.62 0.91 -0.57 0.87 -1.07 0.00 0.00 179.97 180.73 1m7a h LYS 31 N 1.14 0.38 -0.44 0.04 1.57 -2.00 -2.90 116.57 114.37 1m7a h LYS 31 Ca 0.27 -0.25 -0.06 0.00 -1.87 0.00 0.00 60.65 58.74 1m7a h LYS 31 Cb 0.14 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.47 1m7a h LYS 31 CO -0.03 0.85 0.04 1.49 -0.57 0.00 0.00 179.45 181.23 1m7a h GLU 32 N 0.29 0.74 -0.61 3.15 4.22 -1.96 -1.48 114.58 118.94 1m7a h GLU 32 Ca 0.00 -0.22 0.05 0.00 0.08 0.00 0.00 59.36 59.28 1m7a h GLU 32 Cb 1.09 -0.08 -0.05 0.00 0.50 0.00 0.00 28.75 30.21 1m7a h GLU 32 CO 0.10 0.79 0.34 0.82 -2.18 0.00 0.00 179.01 178.87 1m7a h ILE 33 N 0.59 0.97 -0.73 2.32 2.04 -1.45 -0.64 117.51 120.62 1m7a h ILE 33 Ca 0.13 -0.22 -0.01 0.00 1.00 0.00 0.00 64.86 65.76 1m7a h ILE 33 Cb 0.43 0.28 -0.03 0.00 -0.74 0.00 0.00 36.82 36.76 1m7a h ILE 33 CO 0.01 0.12 0.42 -0.09 0.00 0.00 0.00 178.15 178.61 1m7a h ARG 34 N 0.63 1.01 0.02 2.37 2.43 -1.26 -1.31 114.38 118.28 1m7a h ARG 34 Ca 0.27 -0.11 0.00 0.00 -0.81 0.00 0.00 59.98 59.34 1m7a h ARG 34 Cb 0.15 -0.20 -0.00 0.00 -0.42 0.00 0.00 29.97 29.50 1m7a h ARG 34 CO -0.17 0.73 -0.02 -0.92 -1.51 0.00 0.00 179.97 178.08 1m7a h TYR 35 N 1.01 -0.06 -0.51 2.20 5.03 -0.62 -0.35 116.97 123.67 1m7a h TYR 35 Ca 0.26 0.00 0.10 0.00 2.58 0.00 0.00 58.73 61.67 1m7a h TYR 35 Cb 0.00 0.02 -0.08 0.00 1.55 0.00 0.00 36.73 38.23 1m7a h TYR 35 CO -0.01 -0.04 0.04 0.35 -1.32 0.00 0.00 178.16 177.18 1m7a h PHE 36 N -0.05 0.04 -0.13 -3.82 3.04 -0.97 0.13 116.94 115.17 1m7a h PHE 36 Ca 0.00 0.04 -0.01 0.00 3.98 0.00 0.00 57.97 61.97 1m7a h PHE 36 Cb 0.05 0.06 -0.01 0.00 2.56 0.00 0.00 35.95 38.62 1m7a h PHE 36 CO -0.09 -0.08 0.03 -0.22 -2.02 0.00 0.00 178.31 175.93 1m7a h LYS 37 N 0.16 0.21 -0.42 1.11 3.64 -0.77 -2.26 116.57 118.24 1m7a h LYS 37 Ca 0.26 -0.05 0.01 0.00 -1.27 0.00 0.00 60.65 59.59 1m7a h LYS 37 Cb 0.38 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.15 1m7a h LYS 37 CO -0.39 0.39 0.27 -0.44 -2.27 0.00 0.00 179.45 177.01 1m7a h ASP 38 N 0.01 0.47 -0.46 4.20 3.45 -0.60 -2.25 116.42 121.25 1m7a h ASP 38 Ca 0.04 -0.01 -0.08 0.00 0.43 0.00 0.00 57.03 57.41 1m7a h ASP 38 Cb 0.27 -0.11 -0.02 0.00 -0.56 0.00 0.00 39.33 38.91 1m7a h ASP 38 CO 0.00 0.34 -0.03 0.58 -1.57 0.00 0.00 179.24 178.56 1m7a h VAL 39 N 0.56 1.27 0.00 -1.35 2.07 -0.72 -1.80 116.25 116.27 1m7a h VAL 39 Ca 0.16 -1.10 0.00 0.00 0.82 0.00 0.00 66.70 66.58 1m7a h VAL 39 Cb -0.05 1.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.79 1m7a h VAL 39 CO -0.04 0.38 0.00 0.71 0.02 0.00 0.00 177.57 178.63 1m7a h THR 40 N 0.67 0.00 0.01 2.57 1.35 -1.41 -3.33 112.91 112.76 1m7a h THR 40 Ca 0.13 -0.68 -0.38 0.00 -0.55 0.00 0.00 66.41 64.93 1m7a h THR 40 Cb 0.54 1.66 -0.06 0.00 -1.73 0.00 0.00 68.15 68.55 1m7a h THR 40 CO 0.03 0.00 -2.36 0.35 -0.25 0.00 0.00 175.52 173.29 1m7a n THR 41 N -2.90 1.49 -2.19 6.82 -2.24 -0.85 -4.59 114.28 109.82 1m7a n THR 41 Ca 0.03 -0.68 -0.40 0.00 -2.27 0.00 0.00 64.05 60.72 1m7a n THR 41 Cb 0.41 -1.12 -0.02 0.00 -2.10 0.00 0.00 70.33 67.49 1m7a n THR 41 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1m7a s ARG 42 N -2.52 4.36 0.12 -0.78 1.81 -0.69 -4.62 118.95 116.64 1m7a s ARG 42 Ca -0.24 2.11 0.01 0.00 -1.72 0.00 0.00 55.73 55.89 1m7a s ARG 42 Cb 0.08 -3.04 -0.04 0.00 -0.45 0.00 0.00 34.95 31.49 1m7a s ARG 42 CO 0.70 -0.15 -0.03 0.95 -0.68 0.00 0.00 175.30 176.09 1m7a s THR 43 N -1.17 0.62 -0.16 0.02 -4.23 -1.26 -4.90 115.64 104.56 1m7a s THR 43 Ca 0.49 -1.94 -0.01 0.00 -1.18 0.00 0.00 61.69 59.05 1m7a s THR 43 Cb -0.38 -1.85 -0.09 0.00 1.34 0.00 0.00 72.50 71.53 1m7a s THR 43 CO 0.49 -0.72 -0.16 0.35 -0.54 0.00 0.00 174.62 174.05 1m7a n THR 44 N -0.10 0.88 -1.04 3.99 -2.24 -1.26 -5.00 114.28 109.51 1m7a n THR 44 Ca -0.10 -0.31 -0.30 0.00 -2.27 0.00 0.00 64.05 61.08 1m7a n THR 44 Cb 0.62 -1.22 0.16 0.00 -2.10 0.00 0.00 70.33 67.78 1m7a n THR 44 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1m7a s LYS 45 N -2.30 0.94 -0.05 -0.78 3.01 -1.26 -5.02 119.74 114.28 1m7a s LYS 45 Ca -0.21 0.94 -0.10 0.00 -1.01 0.00 0.00 55.97 55.59 1m7a s LYS 45 Cb 0.06 -1.76 -0.05 0.00 -1.01 0.00 0.00 37.83 35.07 1m7a s LYS 45 CO 0.34 -2.49 0.44 -1.00 0.51 0.00 0.00 175.35 173.14 1m7a h PRO 46 N -1.74 -0.34 -1.85 -1.68 0.13 -2.02 -3.37 132.00 121.13 1m7a h PRO 46 Ca -0.50 0.02 -0.72 0.00 -0.87 0.00 0.00 66.00 63.93 1m7a h PRO 46 Cb 1.29 0.08 -0.31 0.00 0.13 0.00 0.00 31.00 32.18 1m7a h PRO 46 CO 0.52 -0.23 0.57 0.09 -0.23 0.00 0.00 178.00 178.73 1m7a n ASN 47 N -4.64 6.76 -4.60 1.44 3.02 -1.26 -4.98 115.26 111.00 1m7a n ASN 47 Ca -0.04 -3.81 -0.27 0.00 -0.03 0.00 0.00 54.58 50.43 1m7a n ASN 47 Cb 0.14 -0.90 -0.11 0.00 -0.61 0.00 0.00 39.78 38.30 1m7a n ASN 47 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1m7a s THR 48 N -5.20 2.07 0.14 3.41 -4.23 -1.26 -4.92 115.64 105.65 1m7a s THR 48 Ca 0.51 -2.05 -0.08 0.00 -1.18 0.00 0.00 61.69 58.89 1m7a s THR 48 Cb 0.43 -2.91 -0.01 0.00 1.34 0.00 0.00 72.50 71.35 1m7a s THR 48 CO -0.35 -0.05 0.24 0.00 -0.54 0.00 0.00 174.62 173.92 1m7a s ARG 49 N -3.69 1.05 0.35 3.99 1.70 -1.16 -4.93 118.95 116.27 1m7a s ARG 49 Ca 0.34 -1.13 0.04 0.00 -0.47 0.00 0.00 55.73 54.51 1m7a s ARG 49 Cb 0.08 0.36 -0.01 0.00 -0.57 0.00 0.00 34.95 34.81 1m7a s ARG 49 CO 0.18 -0.37 0.52 -0.80 -1.08 0.00 0.00 175.30 173.74 1m7a s ASN 50 N -2.94 6.00 -0.04 -2.89 0.01 -1.26 -1.21 114.94 112.61 1m7a s ASN 50 Ca 0.14 0.02 0.01 0.00 -0.71 0.00 0.00 52.86 52.33 1m7a s ASN 50 Cb 0.04 -1.46 -0.03 0.00 0.41 0.00 0.00 41.25 40.21 1m7a s ASN 50 CO -0.03 -0.45 -0.04 0.00 -1.51 0.00 0.00 177.10 175.07 1m7a s ALA 51 N -2.26 3.10 -0.10 0.60 0.00 -0.16 -1.11 121.76 121.83 1m7a s ALA 51 Ca 0.44 -0.92 0.04 0.00 0.00 0.00 0.00 51.96 51.52 1m7a s ALA 51 Cb -0.10 -1.27 -0.00 0.00 0.00 0.00 0.00 23.12 21.75 1m7a s ALA 51 CO 0.33 0.60 -0.23 0.14 0.00 0.00 0.00 175.76 176.60 1m7a s VAL 52 N -0.93 2.17 -0.06 0.00 -7.23 0.71 -1.07 120.40 113.99 1m7a s VAL 52 Ca 0.15 -0.98 0.04 0.00 -1.81 0.00 0.00 61.98 59.37 1m7a s VAL 52 Cb -0.11 -1.83 -0.02 0.00 0.56 0.00 0.00 36.38 34.97 1m7a s VAL 52 CO 0.05 0.56 -0.16 0.27 -0.31 0.00 0.00 175.10 175.51 1m7a s ILE 53 N 0.30 2.90 0.08 -0.62 -5.25 0.13 -0.76 121.20 118.00 1m7a s ILE 53 Ca -0.17 -0.77 -0.09 0.00 -0.99 0.00 0.00 60.65 58.63 1m7a s ILE 53 Cb -0.17 -2.13 -0.00 0.00 2.95 0.00 0.00 42.46 43.10 1m7a s ILE 53 CO 0.08 0.58 0.20 0.00 -1.79 0.00 0.00 174.94 174.01 1m7a s MET 54 N -0.52 0.83 0.63 0.37 0.23 -0.46 -0.19 119.30 120.20 1m7a s MET 54 Ca 0.07 -0.92 -0.12 0.00 -1.03 0.00 0.00 55.69 53.69 1m7a s MET 54 Cb -0.12 0.34 -0.03 0.00 -1.53 0.00 0.00 34.83 33.50 1m7a s MET 54 CO 0.01 -0.26 1.04 0.20 -2.03 0.00 0.00 175.02 173.98 1m7a s GLY 55 N -2.78 1.75 0.28 3.16 0.00 -0.40 -1.30 107.32 108.04 1m7a s GLY 55 Ca 0.04 0.05 -0.01 0.00 0.00 0.00 0.00 44.72 44.80 1m7a s GLY 55 CO -0.10 0.34 1.89 -0.09 0.00 0.00 0.00 173.10 175.14 1m7a h ARG 56 N -0.25 1.07 -0.53 2.90 2.43 -1.75 -2.48 114.38 115.77 1m7a h ARG 56 Ca -0.44 -0.06 -0.07 0.00 -0.81 0.00 0.00 59.98 58.59 1m7a h ARG 56 Cb 1.20 -0.24 -0.02 0.00 -0.42 0.00 0.00 29.97 30.49 1m7a h ARG 56 CO 0.60 0.71 0.03 0.87 -1.51 0.00 0.00 179.97 180.66 1m7a h LYS 57 N 1.10 0.87 -0.26 0.20 1.57 -1.93 -0.55 116.57 117.56 1m7a h LYS 57 Ca 0.42 -0.23 -0.04 0.00 -1.87 0.00 0.00 60.65 58.93 1m7a h LYS 57 Cb 0.20 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.40 1m7a h LYS 57 CO -0.16 0.85 0.03 1.15 -0.57 0.00 0.00 179.45 180.74 1m7a h THR 58 N 0.81 1.24 -0.32 -0.16 2.02 -1.83 -2.43 112.91 112.24 1m7a h THR 58 Ca 0.16 -0.84 0.06 0.00 0.77 0.00 0.00 66.41 66.56 1m7a h THR 58 Cb 0.45 1.28 -0.05 0.00 -1.74 0.00 0.00 68.15 68.08 1m7a h THR 58 CO 0.02 0.27 -0.02 -0.25 0.37 0.00 0.00 175.52 175.90 1m7a h TRP 59 N 0.25 -0.05 0.00 3.16 2.91 -1.22 -2.06 115.95 118.94 1m7a h TRP 59 Ca 0.08 0.02 -0.02 0.00 1.13 0.00 0.00 58.89 60.10 1m7a h TRP 59 Cb 0.37 0.07 -0.00 0.00 -0.51 0.00 0.00 29.16 29.09 1m7a h TRP 59 CO 0.03 -0.08 -0.10 0.93 -1.03 0.00 0.00 178.44 178.19 1m7a h GLU 60 N 0.07 0.00 0.00 2.65 5.08 -0.97 -2.62 114.58 118.79 1m7a h GLU 60 Ca 0.15 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 1m7a h GLU 60 Cb 0.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.47 1m7a h GLU 60 CO -0.28 0.10 0.00 0.66 -1.00 0.00 0.00 179.01 178.49 1m7a h SER 61 N 0.00 0.00 -3.35 1.42 4.64 -0.87 -3.43 113.55 111.96 1m7a h SER 61 Ca -0.00 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.75 1m7a h SER 61 Cb 0.27 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.30 1m7a h SER 61 CO 0.01 0.00 0.22 -0.63 -0.87 0.00 0.00 176.83 175.57 1m7a s ILE 62 N -3.25 4.97 0.20 0.95 1.01 -0.99 -4.99 121.20 119.11 1m7a s ILE 62 Ca 0.07 1.53 -0.32 0.00 0.00 0.00 0.00 60.65 61.93 1m7a s ILE 62 Cb 0.10 -4.09 -0.14 0.00 0.01 0.00 0.00 42.46 38.34 1m7a s ILE 62 CO 0.54 0.15 1.33 -2.65 0.00 0.00 0.00 174.94 174.31 1m7a n PRO 63 N 4.46 1.70 -0.34 2.79 -0.02 -1.26 -4.82 135.00 137.51 1m7a n PRO 63 Ca 0.01 0.61 0.22 0.00 -2.02 0.00 0.00 63.50 62.32 1m7a n PRO 63 Cb 0.50 -2.22 0.48 0.00 -0.02 0.00 0.00 33.50 32.24 1m7a n PRO 63 CO 0.00 0.00 0.00 -0.56 1.98 0.00 0.00 175.50 176.92 1m7a h GLN 64 N 4.07 0.42 0.00 -0.52 3.07 -1.93 0.16 115.11 120.38 1m7a h GLN 64 Ca -0.44 -0.03 -0.01 0.00 0.09 0.00 0.00 58.65 58.26 1m7a h GLN 64 Cb 1.30 -0.09 -0.00 0.00 0.08 0.00 0.00 27.48 28.76 1m7a h GLN 64 CO 0.75 0.28 -0.07 0.87 0.09 0.00 0.00 178.83 180.75 1m7a h LYS 65 N 0.43 0.00 -0.48 0.06 6.56 -2.02 -3.05 116.57 118.07 1m7a h LYS 65 Ca 0.64 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 60.23 1m7a h LYS 65 Cb 1.50 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 33.16 1m7a h LYS 65 CO -0.38 0.07 0.00 1.19 -2.06 0.00 0.00 179.45 178.26 1m7a n PHE 66 N -3.95 0.96 -4.34 -1.35 3.72 0.57 -4.93 117.46 108.14 1m7a n PHE 66 Ca -0.03 -0.61 -0.24 0.00 -0.05 0.00 0.00 57.45 56.53 1m7a n PHE 66 Cb 0.16 -0.15 -0.13 0.00 -0.94 0.00 0.00 39.48 38.42 1m7a n PHE 66 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 176.76 175.73 1m7a s ARG 67 N -1.62 1.15 0.73 -1.08 1.70 -1.15 -4.16 118.95 114.51 1m7a s ARG 67 Ca 0.39 -1.11 -0.12 0.00 -0.47 0.00 0.00 55.73 54.42 1m7a s ARG 67 Cb 0.25 -1.37 0.04 0.00 -0.57 0.00 0.00 34.95 33.30 1m7a s ARG 67 CO 0.20 0.32 1.11 -1.25 -1.08 0.00 0.00 175.30 174.60 1m7a s PRO 68 N -1.76 2.40 0.17 3.89 0.04 -1.26 -4.96 135.00 133.51 1m7a s PRO 68 Ca 0.06 1.30 -0.31 0.00 0.04 0.00 0.00 61.00 62.09 1m7a s PRO 68 Cb -0.10 -1.91 -0.10 0.00 0.04 0.00 0.00 34.50 32.43 1m7a s PRO 68 CO 0.04 -1.55 1.57 -0.51 0.04 0.00 0.00 177.00 176.58 1m7a s LEU 69 N -5.51 4.37 0.57 -3.56 1.43 -1.26 -4.91 118.68 109.81 1m7a s LEU 69 Ca 0.64 2.64 -0.18 0.00 -1.03 0.00 0.00 54.13 56.20 1m7a s LEU 69 Cb -0.19 -3.60 -0.04 0.00 0.03 0.00 0.00 46.19 42.39 1m7a s LEU 69 CO 0.50 -0.83 1.12 -2.16 0.23 0.00 0.00 176.35 175.21 1m7a s PRO 70 N 1.03 3.23 -0.29 1.29 0.04 -1.26 -3.48 135.00 135.56 1m7a s PRO 70 Ca 0.70 1.52 0.00 0.00 0.04 0.00 0.00 61.00 63.25 1m7a s PRO 70 Cb -0.44 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.10 1m7a s PRO 70 CO 0.32 -0.93 0.00 -0.25 0.04 0.00 0.00 177.00 176.18 1m7a n ASP 71 N -1.61 -4.55 -3.98 6.66 8.00 -1.26 -4.98 116.55 114.83 1m7a n ASP 71 Ca 0.11 0.07 -0.11 0.00 0.71 0.00 0.00 54.79 55.56 1m7a n ASP 71 Cb 0.51 -2.29 -0.12 0.00 -0.02 0.00 0.00 41.12 39.20 1m7a n ASP 71 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1m7a s ARG 72 N -1.53 0.32 -0.09 -1.24 0.52 -1.23 -4.52 118.95 111.18 1m7a s ARG 72 Ca 0.00 -0.48 -0.30 0.00 -0.52 0.00 0.00 55.73 54.43 1m7a s ARG 72 Cb 0.00 -0.07 -0.03 0.00 0.52 0.00 0.00 34.95 35.37 1m7a s ARG 72 CO 0.00 0.00 1.29 -1.17 0.02 0.00 0.00 175.30 175.45 1m7a s LEU 73 N -1.06 4.25 -0.18 2.53 2.96 -0.27 -4.81 118.68 122.11 1m7a s LEU 73 Ca -0.09 1.86 -0.12 0.00 -0.22 0.00 0.00 54.13 55.55 1m7a s LEU 73 Cb -0.07 -3.55 -0.05 0.00 0.50 0.00 0.00 46.19 43.02 1m7a s LEU 73 CO -0.00 -0.70 0.22 0.20 -1.32 0.00 0.00 176.35 174.75 1m7a s ASN 74 N 1.88 6.34 -0.13 3.68 0.02 0.83 -0.21 114.94 127.34 1m7a s ASN 74 Ca 0.58 0.39 0.02 0.00 -1.02 0.00 0.00 52.86 52.83 1m7a s ASN 74 Cb -0.25 -2.14 0.01 0.00 0.02 0.00 0.00 41.25 38.88 1m7a s ASN 74 CO 0.21 0.14 -0.21 -0.63 0.02 0.00 0.00 177.10 176.63 1m7a s ILE 75 N 0.39 2.20 -0.14 0.60 1.01 0.06 -1.64 121.20 123.68 1m7a s ILE 75 Ca 0.13 -0.94 0.00 0.00 0.00 0.00 0.00 60.65 59.84 1m7a s ILE 75 Cb -0.12 -1.88 -0.01 0.00 0.01 0.00 0.00 42.46 40.46 1m7a s ILE 75 CO 0.01 0.54 -0.14 -0.63 0.00 0.00 0.00 174.94 174.73 1m7a s ILE 76 N 0.70 2.85 -0.13 2.92 1.09 -0.41 -1.35 121.20 126.87 1m7a s ILE 76 Ca -0.09 -0.72 -0.07 0.00 -1.10 0.00 0.00 60.65 58.67 1m7a s ILE 76 Cb -0.16 -2.20 -0.04 0.00 -1.06 0.00 0.00 42.46 39.00 1m7a s ILE 76 CO 0.01 0.52 0.10 -0.76 -0.10 0.00 0.00 174.94 174.71 1m7a s LEU 77 N 0.59 4.13 -0.13 2.97 1.43 -0.42 -1.92 118.68 125.33 1m7a s LEU 77 Ca -0.08 0.32 -0.13 0.00 -1.03 0.00 0.00 54.13 53.20 1m7a s LEU 77 Cb -0.16 -2.01 0.04 0.00 0.03 0.00 0.00 46.19 44.09 1m7a s LEU 77 CO 0.03 0.34 0.38 -0.55 0.23 0.00 0.00 176.35 176.78 1m7a s SER 78 N -0.59 -0.39 0.35 2.29 0.15 -0.80 -1.91 113.70 112.80 1m7a s SER 78 Ca 0.12 0.73 0.26 0.00 0.70 0.00 0.00 55.95 57.76 1m7a s SER 78 Cb -0.12 0.75 1.15 0.00 -1.71 0.00 0.00 66.02 66.09 1m7a s SER 78 CO 0.02 -0.15 1.79 0.03 1.20 0.00 0.00 173.24 176.13 1m7a h ARG 79 N 5.42 0.00 -0.02 5.44 3.08 -1.84 -2.58 114.38 123.88 1m7a h ARG 79 Ca -0.27 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.78 1m7a h ARG 79 Cb 1.18 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.23 1m7a h ARG 79 CO 0.28 0.00 -0.13 -1.13 -1.07 0.00 0.00 179.97 177.92 1m7a n SER 80 N -2.45 1.95 -4.81 7.04 3.41 -1.26 -4.94 113.62 112.55 1m7a n SER 80 Ca 0.01 -1.54 -0.38 0.00 -0.26 0.00 0.00 58.87 56.70 1m7a n SER 80 Cb 0.21 0.10 -0.06 0.00 -0.26 0.00 0.00 64.21 64.21 1m7a n SER 80 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 1m7a s TYR 81 N -2.17 3.77 0.37 7.33 2.02 -0.97 -5.08 117.35 122.62 1m7a s TYR 81 Ca 0.29 1.32 -0.07 0.00 -0.37 0.00 0.00 57.07 58.24 1m7a s TYR 81 Cb 0.20 -2.54 -0.05 0.00 -0.40 0.00 0.00 41.96 39.16 1m7a s TYR 81 CO 0.40 0.51 0.69 -1.21 -1.57 0.00 0.00 175.55 174.37 1m7a s GLU 82 N -1.40 3.69 -0.48 -0.62 0.41 -1.26 -3.98 118.70 115.05 1m7a s GLU 82 Ca 0.34 0.25 -0.28 0.00 -0.41 0.00 0.00 54.97 54.86 1m7a s GLU 82 Cb -0.19 -2.48 0.01 0.00 -1.78 0.00 0.00 34.13 29.68 1m7a s GLU 82 CO 0.21 0.03 1.48 -0.80 -0.49 0.00 0.00 175.26 175.69 1m7a s ASN 83 N -3.32 6.14 -0.05 -0.19 0.01 -1.26 -4.14 114.94 112.13 1m7a s ASN 83 Ca 0.48 0.62 -0.05 0.00 -0.71 0.00 0.00 52.86 53.20 1m7a s ASN 83 Cb -0.10 -2.54 0.01 0.00 0.41 0.00 0.00 41.25 39.03 1m7a s ASN 83 CO 0.33 -1.64 0.14 -0.70 -1.51 0.00 0.00 177.10 173.72 1m7a s GLU 84 N 5.38 0.17 -0.32 -0.60 2.12 -0.62 -5.01 118.70 119.83 1m7a s GLU 84 Ca 0.60 0.17 -0.22 0.00 0.36 0.00 0.00 54.97 55.88 1m7a s GLU 84 Cb -0.13 0.08 -0.00 0.00 0.26 0.00 0.00 34.13 34.34 1m7a s GLU 84 CO 0.29 -0.02 0.74 0.42 -0.54 0.00 0.00 175.26 176.15 1m7a s ILE 85 N 0.02 4.83 -0.09 -3.70 1.01 -1.26 -1.00 121.20 121.02 1m7a s ILE 85 Ca -0.01 1.03 -0.12 0.00 0.00 0.00 0.00 60.65 61.55 1m7a s ILE 85 Cb -0.01 -4.11 -0.09 0.00 0.01 0.00 0.00 42.46 38.25 1m7a s ILE 85 CO 0.00 -0.25 0.43 0.40 0.00 0.00 0.00 174.94 175.53 1m7a h ILE 86 N 5.61 0.50 -1.70 2.92 2.04 -1.09 -3.49 117.51 122.30 1m7a h ILE 86 Ca -0.25 -1.20 0.00 0.00 1.00 0.00 0.00 64.86 64.41 1m7a h ILE 86 Cb 1.10 0.91 0.00 0.00 -0.74 0.00 0.00 36.82 38.09 1m7a h ILE 86 CO 0.86 0.16 0.00 -0.90 0.00 0.00 0.00 178.15 178.27 1m7a n ASP 87 N -4.84 0.00 0.26 1.72 3.85 -1.06 -5.00 116.55 111.48 1m7a n ASP 87 Ca -0.05 -0.70 0.18 0.00 -0.71 0.00 0.00 54.79 53.51 1m7a n ASP 87 Cb 0.18 0.00 0.86 0.00 -1.35 0.00 0.00 41.12 40.81 1m7a n ASP 87 CO 0.00 0.00 0.00 -0.78 -1.01 0.00 0.00 177.20 175.41 1m7a h ASP 88 N 0.00 0.00 0.00 -1.12 -0.00 -2.03 -3.01 116.42 110.27 1m7a h ASP 88 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.03 1m7a h ASP 88 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.33 1m7a h ASP 88 CO 0.00 0.00 -0.48 0.59 -0.00 0.00 0.00 179.24 179.35 1m7a n ASN 89 N -2.82 0.48 -3.86 2.28 3.02 -1.26 -4.91 115.26 108.18 1m7a n ASN 89 Ca -0.01 -0.73 -0.17 0.00 -0.03 0.00 0.00 54.58 53.64 1m7a n ASN 89 Cb 0.15 1.00 -0.16 0.00 -0.61 0.00 0.00 39.78 40.17 1m7a n ASN 89 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1m7a s ILE 90 N -1.95 0.27 0.00 2.41 1.01 -1.14 -0.12 121.20 121.69 1m7a s ILE 90 Ca 0.04 -0.01 0.06 0.00 0.00 0.00 0.00 60.65 60.73 1m7a s ILE 90 Cb 0.08 -0.32 -0.02 0.00 0.01 0.00 0.00 42.46 42.20 1m7a s ILE 90 CO 0.41 0.15 -0.19 -0.63 0.00 0.00 0.00 174.94 174.68 1m7a s ILE 91 N 0.73 1.50 -0.10 2.92 1.01 -0.65 -0.38 121.20 126.23 1m7a s ILE 91 Ca -0.08 -0.91 0.00 0.00 0.00 0.00 0.00 60.65 59.66 1m7a s ILE 91 Cb -0.11 -1.27 -0.03 0.00 0.01 0.00 0.00 42.46 41.07 1m7a s ILE 91 CO -0.01 0.34 -0.09 -1.00 0.00 0.00 0.00 174.94 174.18 1m7a s HIS 92 N -0.55 2.88 0.16 3.97 3.76 -0.17 -1.28 115.29 124.05 1m7a s HIS 92 Ca 0.07 -0.22 -0.15 0.00 -0.15 0.00 0.00 55.06 54.61 1m7a s HIS 92 Cb -0.08 -1.77 0.02 0.00 1.11 0.00 0.00 32.58 31.86 1m7a s HIS 92 CO 0.00 0.11 0.42 0.00 -0.85 0.00 0.00 174.74 174.42 1m7a s ALA 93 N -0.30 -0.73 -1.18 -1.40 0.00 -0.81 -1.59 121.76 115.74 1m7a s ALA 93 Ca 0.04 -0.29 0.12 0.00 0.00 0.00 0.00 51.96 51.83 1m7a s ALA 93 Cb -0.13 0.78 0.01 0.00 0.00 0.00 0.00 23.12 23.78 1m7a s ALA 93 CO 0.02 -0.70 0.74 -1.13 0.00 0.00 0.00 175.76 174.69 1m7a n SER 94 N -0.26 1.44 -3.66 0.00 3.41 -1.25 -1.91 113.62 111.40 1m7a n SER 94 Ca -0.12 -1.22 -0.15 0.00 -0.26 0.00 0.00 58.87 57.12 1m7a n SER 94 Cb 0.63 0.42 -0.08 0.00 -0.26 0.00 0.00 64.21 64.92 1m7a n SER 94 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1m7a s SER 95 N -1.51 -0.41 0.17 4.04 1.04 -1.26 -4.73 113.70 111.04 1m7a s SER 95 Ca 0.11 0.42 -0.15 0.00 0.48 0.00 0.00 55.95 56.82 1m7a s SER 95 Cb 0.10 0.47 0.10 0.00 0.10 0.00 0.00 66.02 66.79 1m7a s SER 95 CO 0.29 -0.49 1.77 -0.29 0.98 0.00 0.00 173.24 175.50 1m7a h ILE 96 N 3.57 0.92 -0.35 -1.02 2.10 -2.00 -2.13 117.51 118.59 1m7a h ILE 96 Ca -0.28 -0.13 -0.12 0.00 1.08 0.00 0.00 64.86 65.40 1m7a h ILE 96 Cb 1.16 0.51 -0.01 0.00 -1.09 0.00 0.00 36.82 37.39 1m7a h ILE 96 CO 0.38 0.07 -0.29 -0.08 -1.08 0.00 0.00 178.15 177.15 1m7a h GLU 97 N 0.38 0.74 -0.63 2.19 4.81 -2.00 -2.53 114.58 117.54 1m7a h GLU 97 Ca 0.19 -0.33 -0.05 0.00 -0.13 0.00 0.00 59.36 59.05 1m7a h GLU 97 Cb 0.14 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.47 1m7a h GLU 97 CO -0.17 0.94 0.19 0.77 -0.73 0.00 0.00 179.01 180.01 1m7a h SER 98 N 0.63 0.88 -0.74 1.04 0.02 -1.95 -2.83 113.55 110.61 1m7a h SER 98 Ca 0.08 -0.15 -0.01 0.00 -0.84 0.00 0.00 61.79 60.86 1m7a h SER 98 Cb 0.81 -0.23 -0.04 0.00 0.14 0.00 0.00 62.40 63.08 1m7a h SER 98 CO 0.07 0.83 0.42 0.77 -1.14 0.00 0.00 176.83 177.78 1m7a h SER 99 N 0.92 0.92 0.38 3.07 4.64 -1.01 -2.95 113.55 119.51 1m7a h SER 99 Ca 0.21 -0.08 -0.03 0.00 -0.47 0.00 0.00 61.79 61.41 1m7a h SER 99 Cb 0.27 -0.23 -0.00 0.00 -0.31 0.00 0.00 62.40 62.12 1m7a h SER 99 CO -0.01 0.73 -0.14 -0.07 -0.87 0.00 0.00 176.83 176.48 1m7a h LEU 100 N 1.02 0.00 -1.86 5.97 3.38 -1.21 -2.09 115.31 120.53 1m7a h LEU 100 Ca 0.26 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.21 1m7a h LEU 100 Cb 0.01 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.76 1m7a h LEU 100 CO -0.05 0.14 -0.10 0.78 0.09 0.00 0.00 178.44 179.31 1m7a h ASN 101 N 0.00 0.00 0.16 -0.43 2.35 -1.42 -1.41 115.58 114.83 1m7a h ASN 101 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1m7a h ASN 101 Cb 0.36 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.73 1m7a h ASN 101 CO 0.02 0.10 -0.11 0.18 -1.65 0.00 0.00 177.43 175.96 1m7a n LEU 102 N -3.43 0.96 -4.65 1.61 7.99 -0.78 -4.32 117.00 114.37 1m7a n LEU 102 Ca -0.01 -0.25 -0.29 0.00 -0.01 0.00 0.00 56.01 55.45 1m7a n LEU 102 Cb 0.26 -0.09 -0.08 0.00 -0.11 0.00 0.00 43.42 43.40 1m7a n LEU 102 CO 0.29 0.17 -0.35 0.68 -1.51 0.00 0.00 177.39 176.66 1m7a s VAL 103 N -2.28 3.74 0.07 4.08 -7.23 -0.97 -5.01 120.40 112.80 1m7a s VAL 103 Ca 0.32 -1.23 -0.08 0.00 -1.81 0.00 0.00 61.98 59.18 1m7a s VAL 103 Cb 0.20 -2.82 -0.00 0.00 0.56 0.00 0.00 36.38 34.32 1m7a s VAL 103 CO 0.43 0.02 0.17 -0.94 -0.31 0.00 0.00 175.10 174.48 1m7a s SER 104 N -2.55 0.13 -1.40 4.85 1.04 -1.26 -1.79 113.70 112.72 1m7a s SER 104 Ca 0.25 -0.62 -0.08 0.00 0.48 0.00 0.00 55.95 55.99 1m7a s SER 104 Cb -0.11 0.32 0.01 0.00 0.10 0.00 0.00 66.02 66.34 1m7a s SER 104 CO 0.17 -0.68 1.05 -0.90 0.98 0.00 0.00 173.24 173.87 1m7a n ASP 105 N 0.12 -6.34 -4.49 7.02 5.68 -1.26 -5.00 116.55 112.28 1m7a n ASP 105 Ca -0.16 -0.48 -0.33 0.00 -0.50 0.00 0.00 54.79 53.32 1m7a n ASP 105 Cb 0.62 -5.01 -0.13 0.00 -1.14 0.00 0.00 41.12 35.46 1m7a n ASP 105 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1m7a s VAL 106 N -3.29 3.34 -0.03 2.12 1.01 -1.26 -2.99 120.40 119.30 1m7a s VAL 106 Ca 0.52 -0.60 -0.02 0.00 0.00 0.00 0.00 61.98 61.88 1m7a s VAL 106 Cb -0.23 -2.36 -0.01 0.00 0.00 0.00 0.00 36.38 33.78 1m7a s VAL 106 CO 0.65 0.57 -0.04 1.21 0.00 0.00 0.00 175.10 177.48 1m7a n GLU 107 N 2.68 0.09 -4.39 2.72 2.13 -0.35 -4.92 120.64 118.60 1m7a n GLU 107 Ca -0.18 0.26 -0.24 0.00 0.66 0.00 0.00 57.16 57.67 1m7a n GLU 107 Cb 0.53 -0.90 -0.09 0.00 0.27 0.00 0.00 31.44 31.25 1m7a n GLU 107 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 1m7a s ARG 108 N -1.27 1.95 -0.09 5.31 0.52 -1.26 -5.04 118.95 119.08 1m7a s ARG 108 Ca -0.03 -1.59 0.04 0.00 -0.52 0.00 0.00 55.73 53.63 1m7a s ARG 108 Cb 0.00 -1.96 0.00 0.00 0.52 0.00 0.00 34.95 33.52 1m7a s ARG 108 CO 0.05 0.35 -0.22 0.54 0.02 0.00 0.00 175.30 176.04 1m7a s VAL 109 N -2.36 1.89 -0.03 3.52 0.11 -1.26 -0.99 120.40 121.27 1m7a s VAL 109 Ca 0.30 -0.93 0.05 0.00 -2.93 0.00 0.00 61.98 58.47 1m7a s VAL 109 Cb -0.06 -1.63 -0.01 0.00 -1.53 0.00 0.00 36.38 33.15 1m7a s VAL 109 CO 0.17 0.52 -0.18 -0.36 -3.33 0.00 0.00 175.10 171.92 1m7a s PHE 110 N 0.31 1.76 -0.22 1.54 0.08 -0.23 -1.53 117.98 119.68 1m7a s PHE 110 Ca -0.16 -0.45 -0.16 0.00 0.12 0.00 0.00 56.93 56.29 1m7a s PHE 110 Cb -0.17 -1.16 -0.04 0.00 -0.57 0.00 0.00 43.02 41.08 1m7a s PHE 110 CO 0.07 -0.12 0.42 0.42 -0.10 0.00 0.00 175.22 175.91 1m7a s ILE 111 N -0.15 5.17 -1.14 0.64 1.01 0.10 0.22 121.20 127.06 1m7a s ILE 111 Ca 0.00 0.72 0.12 0.00 0.00 0.00 0.00 60.65 61.49 1m7a s ILE 111 Cb -0.10 -3.74 0.27 0.00 0.01 0.00 0.00 42.46 38.89 1m7a s ILE 111 CO 0.01 0.21 1.17 2.30 0.00 0.00 0.00 174.94 178.64 1m7a n ILE 112 N 4.56 0.73 0.00 2.92 -5.35 0.73 -1.71 119.36 121.25 1m7a n ILE 112 Ca -0.08 -0.87 0.00 0.00 -0.27 0.00 0.00 62.75 61.54 1m7a n ILE 112 Cb 0.51 0.70 0.00 0.00 -1.74 0.00 0.00 39.64 39.11 1m7a n ILE 112 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1m7a n GLY 113 N 0.62 1.24 0.00 3.28 0.00 -1.26 -4.96 105.19 104.11 1m7a n GLY 113 Ca 0.11 -2.18 0.00 0.00 0.00 0.00 0.00 46.02 43.95 1m7a n GLY 113 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1m7a n GLY 114 N -1.30 1.72 0.24 -0.02 0.00 -1.26 -1.28 105.19 103.29 1m7a n GLY 114 Ca 0.00 -1.91 0.00 0.00 0.00 0.00 0.00 46.02 44.12 1m7a n GLY 114 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1m7a h ALA 115 N -1.11 0.81 -0.14 4.61 0.00 -1.97 -0.50 119.26 120.96 1m7a h ALA 115 Ca 0.00 0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 1m7a h ALA 115 Cb 0.00 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1m7a h ALA 115 CO 0.00 -0.20 0.07 1.49 0.00 0.00 0.00 179.25 180.62 1m7a h GLU 116 N 0.41 0.19 -0.12 0.00 4.81 -1.96 -0.64 114.58 117.27 1m7a h GLU 116 Ca 0.32 -0.02 0.04 0.00 -0.13 0.00 0.00 59.36 59.56 1m7a h GLU 116 Cb 0.40 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.70 1m7a h GLU 116 CO -0.32 0.21 -0.15 0.82 -0.73 0.00 0.00 179.01 178.84 1m7a h ILE 117 N 0.12 0.61 -0.15 2.32 1.08 -1.79 -2.41 117.51 117.30 1m7a h ILE 117 Ca 0.05 0.00 0.03 0.00 -0.39 0.00 0.00 64.86 64.55 1m7a h ILE 117 Cb 0.07 0.61 -0.03 0.00 -3.07 0.00 0.00 36.82 34.40 1m7a h ILE 117 CO -0.01 0.00 -0.07 1.88 -0.69 0.00 0.00 178.15 179.26 1m7a h TYR 118 N -0.19 -0.16 0.00 1.37 0.05 -0.78 -0.18 116.97 117.09 1m7a h TYR 118 Ca 0.09 0.02 -0.04 0.00 0.05 0.00 0.00 58.73 58.85 1m7a h TYR 118 Cb 0.31 0.09 -0.01 0.00 1.01 0.00 0.00 36.73 38.14 1m7a h TYR 118 CO -0.26 -0.11 -0.17 -0.91 -1.05 0.00 0.00 178.16 175.66 1m7a h ASN 119 N -0.05 0.00 0.01 3.88 2.35 -1.07 -1.89 115.58 118.82 1m7a h ASN 119 Ca 0.08 0.00 -0.31 0.00 -0.55 0.00 0.00 56.30 55.53 1m7a h ASN 119 Cb 0.17 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.50 1m7a h ASN 119 CO -0.19 0.17 -1.69 1.21 -1.65 0.00 0.00 177.43 175.29 1m7a n GLU 120 N -3.70 0.60 0.08 0.81 4.07 -0.91 -4.41 120.64 117.17 1m7a n GLU 120 Ca -0.02 0.45 0.11 0.00 -0.06 0.00 0.00 57.16 57.65 1m7a n GLU 120 Cb 0.29 -1.68 0.45 0.00 -0.06 0.00 0.00 31.44 30.44 1m7a n GLU 120 CO 0.00 0.00 0.00 1.28 -0.06 0.00 0.00 177.13 178.35 1m7a n LEU 121 N -4.24 0.49 0.24 4.31 4.32 -0.09 -2.72 117.00 119.32 1m7a n LEU 121 Ca -0.38 0.60 0.08 0.00 -0.02 0.00 0.00 56.01 56.28 1m7a n LEU 121 Cb 0.78 -0.50 0.60 0.00 -1.62 0.00 0.00 43.42 42.68 1m7a n LEU 121 CO 0.18 -0.36 0.97 -0.29 -1.22 0.00 0.00 177.39 176.67 1m7a h ILE 122 N 0.00 0.98 -0.36 -0.08 6.09 -1.55 -1.05 117.51 121.54 1m7a h ILE 122 Ca 0.00 -0.42 0.00 0.00 -1.37 0.00 0.00 64.86 63.07 1m7a h ILE 122 Cb 0.43 1.23 0.00 0.00 0.47 0.00 0.00 36.82 38.96 1m7a h ILE 122 CO 0.00 0.12 0.00 0.59 -3.07 0.00 0.00 178.15 175.79 1m7a n ASN 123 N -4.25 2.05 -4.73 2.19 3.02 -1.10 -4.86 115.26 107.58 1m7a n ASN 123 Ca -0.03 -2.03 -0.36 0.00 -0.03 0.00 0.00 54.58 52.13 1m7a n ASN 123 Cb 0.19 -0.27 -0.07 0.00 -0.61 0.00 0.00 39.78 39.03 1m7a n ASN 123 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1m7a s ASN 124 N -0.96 6.46 0.08 6.41 3.84 -0.40 -4.99 114.94 125.38 1m7a s ASN 124 Ca 0.25 0.53 0.12 0.00 0.21 0.00 0.00 52.86 53.97 1m7a s ASN 124 Cb 0.13 -2.19 0.55 0.00 -0.55 0.00 0.00 41.25 39.19 1m7a s ASN 124 CO 0.16 0.09 1.38 -1.54 -2.79 0.00 0.00 177.10 174.41 1m7a n SER 125 N 3.58 0.17 0.17 -4.21 3.41 -1.26 -1.61 113.62 113.87 1m7a n SER 125 Ca -0.11 0.56 0.03 0.00 -0.26 0.00 0.00 58.87 59.08 1m7a n SER 125 Cb 0.52 -0.59 0.40 0.00 -0.26 0.00 0.00 64.21 64.28 1m7a n SER 125 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1m7a h LEU 126 N 0.00 0.10 -9.05 1.04 3.38 -1.92 -3.41 115.31 105.44 1m7a h LEU 126 Ca 0.00 -0.02 -0.56 0.00 0.09 0.00 0.00 57.88 57.38 1m7a h LEU 126 Cb 0.16 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 1m7a h LEU 126 CO 0.00 0.34 1.05 -0.69 0.09 0.00 0.00 178.44 179.23 1m7a s VAL 127 N -4.50 3.89 -0.05 1.22 1.01 -0.63 -1.47 120.40 119.86 1m7a s VAL 127 Ca -0.04 1.02 0.06 0.00 0.00 0.00 0.00 61.98 63.02 1m7a s VAL 127 Cb 0.15 -3.85 -0.08 0.00 0.00 0.00 0.00 36.38 32.59 1m7a s VAL 127 CO 0.72 -0.31 0.14 -1.54 0.00 0.00 0.00 175.10 174.12 1m7a n SER 128 N 7.85 3.07 -3.79 3.32 3.41 -0.13 -4.92 113.62 122.43 1m7a n SER 128 Ca 0.17 -0.12 -0.13 0.00 -0.26 0.00 0.00 58.87 58.53 1m7a n SER 128 Cb 0.45 1.21 -0.14 0.00 -0.26 0.00 0.00 64.21 65.47 1m7a n SER 128 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1m7a s HIS 129 N -2.23 -0.09 -0.17 7.33 3.76 -1.20 -4.05 115.29 118.64 1m7a s HIS 129 Ca -0.01 0.29 -0.01 0.00 -0.15 0.00 0.00 55.06 55.18 1m7a s HIS 129 Cb 0.04 -0.07 -0.01 0.00 1.11 0.00 0.00 32.58 33.65 1m7a s HIS 129 CO 0.23 -0.10 -0.11 -0.51 -0.85 0.00 0.00 174.74 173.40 1m7a s LEU 130 N 0.70 2.66 -0.43 0.89 1.43 -0.81 -0.58 118.68 122.55 1m7a s LEU 130 Ca -0.05 -0.42 -0.07 0.00 -1.03 0.00 0.00 54.13 52.56 1m7a s LEU 130 Cb -0.07 -1.63 0.10 0.00 0.03 0.00 0.00 46.19 44.61 1m7a s LEU 130 CO -0.03 0.06 0.26 -0.76 0.23 0.00 0.00 176.35 176.12 1m7a s LEU 131 N 0.96 5.31 -0.21 1.79 1.02 0.54 -0.84 118.68 127.25 1m7a s LEU 131 Ca -0.02 -1.77 -0.04 0.00 0.02 0.00 0.00 54.13 52.33 1m7a s LEU 131 Cb -0.15 -1.94 -0.01 0.00 0.02 0.00 0.00 46.19 44.11 1m7a s LEU 131 CO -0.01 -0.58 -0.05 -0.63 0.02 0.00 0.00 176.35 175.10 1m7a s ILE 132 N 1.32 3.37 -0.36 -0.59 1.01 -0.88 -1.36 121.20 123.71 1m7a s ILE 132 Ca 0.05 -0.50 -0.24 0.00 0.00 0.00 0.00 60.65 59.96 1m7a s ILE 132 Cb -0.24 -2.52 0.01 0.00 0.01 0.00 0.00 42.46 39.72 1m7a s ILE 132 CO -0.01 0.43 0.81 -0.89 0.00 0.00 0.00 174.94 175.29 1m7a s THR 133 N 1.34 4.72 -0.40 2.92 2.01 0.11 -1.57 115.64 124.77 1m7a s THR 133 Ca 0.04 0.97 -0.20 0.00 0.31 0.00 0.00 61.69 62.81 1m7a s THR 133 Cb -0.14 -4.22 0.01 0.00 0.01 0.00 0.00 72.50 68.16 1m7a s THR 133 CO -0.02 -0.43 0.62 -1.61 -0.69 0.00 0.00 174.62 172.49 1m7a s GLU 134 N 3.14 3.46 -0.11 4.92 2.02 0.60 -1.09 118.70 131.64 1m7a s GLU 134 Ca 0.33 -0.20 -0.10 0.00 0.02 0.00 0.00 54.97 55.02 1m7a s GLU 134 Cb -0.13 -3.88 -0.05 0.00 0.10 0.00 0.00 34.13 30.17 1m7a s GLU 134 CO 0.17 -0.87 0.22 0.42 0.02 0.00 0.00 175.26 175.22 1m7a s ILE 135 N 2.72 5.37 0.06 -1.63 1.01 -0.50 -2.18 121.20 126.05 1m7a s ILE 135 Ca 0.23 0.39 0.05 0.00 0.00 0.00 0.00 60.65 61.32 1m7a s ILE 135 Cb -0.14 -3.51 -0.03 0.00 0.01 0.00 0.00 42.46 38.79 1m7a s ILE 135 CO 0.17 0.56 -0.15 -1.61 0.00 0.00 0.00 174.94 173.90 1m7a s GLU 136 N -0.64 0.91 0.02 2.79 2.02 0.23 -0.48 118.70 123.54 1m7a s GLU 136 Ca 0.16 -0.91 -0.05 0.00 0.02 0.00 0.00 54.97 54.18 1m7a s GLU 136 Cb -0.13 -0.95 -0.01 0.00 0.10 0.00 0.00 34.13 33.14 1m7a s GLU 136 CO 0.05 0.22 0.09 -1.58 0.02 0.00 0.00 175.26 174.06 1m7a s HIS 137 N -1.11 0.13 0.39 1.61 5.65 -1.26 -1.37 115.29 119.33 1m7a s HIS 137 Ca 0.00 -0.32 0.19 0.00 0.25 0.00 0.00 55.06 55.19 1m7a s HIS 137 Cb -0.09 -0.10 1.06 0.00 -1.18 0.00 0.00 32.58 32.26 1m7a s HIS 137 CO 0.02 -0.29 1.95 -1.00 -0.65 0.00 0.00 174.74 174.77 1m7a h PRO 138 N 4.19 0.00 -2.07 2.88 0.13 -2.01 -3.35 132.00 131.78 1m7a h PRO 138 Ca -0.31 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.25 1m7a h PRO 138 Cb 1.19 0.00 -0.38 0.00 0.13 0.00 0.00 31.00 31.94 1m7a h PRO 138 CO 0.43 0.23 -1.07 0.45 -0.23 0.00 0.00 178.00 177.81 1m7a n SER 139 N -3.93 -0.05 0.18 1.44 2.88 -1.26 -4.96 113.62 107.92 1m7a n SER 139 Ca -0.02 -2.62 0.14 0.00 -1.33 0.00 0.00 58.87 55.04 1m7a n SER 139 Cb 0.31 -0.58 0.70 0.00 -0.75 0.00 0.00 64.21 63.89 1m7a n SER 139 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 1m7a h PRO 140 N 4.42 0.00 0.00 -1.46 0.13 -1.90 -0.50 132.00 132.68 1m7a h PRO 140 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1m7a h PRO 140 Cb 0.89 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.02 1m7a h PRO 140 CO 0.43 0.00 0.00 1.05 -0.23 0.00 0.00 178.00 179.25 1m7a h GLU 141 N 0.00 0.00 0.00 0.86 9.09 -1.94 -2.06 114.58 120.53 1m7a h GLU 141 Ca 0.09 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.50 1m7a h GLU 141 Cb 0.38 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.48 1m7a h GLU 141 CO -0.00 0.00 -0.58 -1.13 0.05 0.00 0.00 179.01 177.35 1m7a n SER 142 N -2.56 0.61 -4.63 3.06 3.41 -0.20 -4.76 113.62 108.54 1m7a n SER 142 Ca 0.00 0.01 -0.41 0.00 -0.26 0.00 0.00 58.87 58.21 1m7a n SER 142 Cb 0.18 0.19 -0.06 0.00 -0.26 0.00 0.00 64.21 64.27 1m7a n SER 142 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1m7a s ILE 143 N -3.11 4.96 0.02 -1.33 1.01 -0.77 -5.02 121.20 116.95 1m7a s ILE 143 Ca 0.08 1.21 -0.30 0.00 0.00 0.00 0.00 60.65 61.64 1m7a s ILE 143 Cb 0.15 -3.97 -0.05 0.00 0.01 0.00 0.00 42.46 38.60 1m7a s ILE 143 CO 0.71 0.01 1.19 -1.61 0.00 0.00 0.00 174.94 175.24 1m7a s GLU 144 N 2.56 4.41 -0.09 2.79 0.41 -1.26 -5.00 118.70 122.52 1m7a s GLU 144 Ca 0.28 1.72 -0.11 0.00 -0.41 0.00 0.00 54.97 56.46 1m7a s GLU 144 Cb -0.15 -3.43 0.03 0.00 -1.78 0.00 0.00 34.13 28.79 1m7a s GLU 144 CO 0.08 -0.32 0.28 1.41 -0.49 0.00 0.00 175.26 176.23 1m7a s MET 145 N 1.47 0.40 0.00 1.61 1.75 -1.26 -4.72 119.30 118.55 1m7a s MET 145 Ca 0.58 0.25 0.00 0.00 -1.25 0.00 0.00 55.69 55.27 1m7a s MET 145 Cb -0.27 0.19 0.00 0.00 2.84 0.00 0.00 34.83 37.58 1m7a s MET 145 CO 0.27 -0.07 0.07 -0.40 -0.65 0.00 0.00 175.02 174.24 1m7a n ASP 146 N 2.56 0.14 -3.99 1.11 3.85 -0.67 -5.00 116.55 114.55 1m7a n ASP 146 Ca -0.15 -0.45 -0.22 0.00 -0.71 0.00 0.00 54.79 53.25 1m7a n ASP 146 Cb 0.57 0.41 -0.16 0.00 -1.35 0.00 0.00 41.12 40.59 1m7a n ASP 146 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.20 175.30 1m7a s THR 147 N -0.41 0.90 0.04 2.12 2.01 -1.02 -5.01 115.64 114.27 1m7a s THR 147 Ca 0.00 -0.36 0.00 0.00 0.31 0.00 0.00 61.69 61.64 1m7a s THR 147 Cb 0.00 -0.83 -0.03 0.00 0.01 0.00 0.00 72.50 71.65 1m7a s THR 147 CO 0.00 0.30 -0.04 -0.36 -0.69 0.00 0.00 174.62 173.82 1m7a s PHE 148 N 0.60 0.49 0.35 4.92 0.40 -1.26 -1.65 117.98 121.82 1m7a s PHE 148 Ca -0.11 -0.75 -0.25 0.00 -0.60 0.00 0.00 56.93 55.22 1m7a s PHE 148 Cb -0.14 -0.33 -0.10 0.00 0.51 0.00 0.00 43.02 42.97 1m7a s PHE 148 CO 0.02 -0.23 0.96 -0.51 0.70 0.00 0.00 175.22 176.16 1m7a s LEU 149 N -2.16 4.27 -0.57 -0.37 1.43 -0.40 -4.95 118.68 115.93 1m7a s LEU 149 Ca -0.04 1.85 0.06 0.00 -1.03 0.00 0.00 54.13 54.97 1m7a s LEU 149 Cb -0.02 -4.10 0.24 0.00 0.03 0.00 0.00 46.19 42.34 1m7a s LEU 149 CO -0.04 -0.15 0.64 2.29 0.23 0.00 0.00 176.35 179.32 1m7a n LYS 150 N 0.34 1.87 -4.09 1.70 2.85 -1.26 -4.90 118.16 114.66 1m7a n LYS 150 Ca 0.03 -4.20 -0.35 0.00 -1.05 0.00 0.00 58.31 52.74 1m7a n LYS 150 Cb 0.50 -1.95 -0.09 0.00 -0.65 0.00 0.00 35.03 32.84 1m7a n LYS 150 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 177.40 177.29 1m7a s PHE 151 N -1.92 3.25 -1.31 5.58 0.08 -1.26 -4.88 117.98 117.52 1m7a s PHE 151 Ca 0.37 0.11 -0.14 0.00 0.12 0.00 0.00 56.93 57.39 1m7a s PHE 151 Cb 0.13 -2.00 0.11 0.00 -0.57 0.00 0.00 43.02 40.69 1m7a s PHE 151 CO -0.06 0.26 1.80 -0.35 -0.10 0.00 0.00 175.22 176.77 1m7a n PRO 152 N 3.11 3.26 0.02 0.24 -0.04 -1.26 -4.77 135.00 135.56 1m7a n PRO 152 Ca -0.17 -3.34 0.06 0.00 -0.04 0.00 0.00 63.50 60.01 1m7a n PRO 152 Cb 0.53 -3.20 0.28 0.00 -0.04 0.00 0.00 33.50 31.07 1m7a n PRO 152 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1m7a n LEU 153 N 6.15 0.08 0.24 1.53 4.77 -1.26 -1.56 117.00 126.95 1m7a n LEU 153 Ca 0.44 0.52 0.16 0.00 -0.03 0.00 0.00 56.01 57.11 1m7a n LEU 153 Cb 0.41 -0.52 0.72 0.00 -2.33 0.00 0.00 43.42 41.71 1m7a n LEU 153 CO 0.77 -0.34 0.97 1.05 -1.33 0.00 0.00 177.39 178.51 1m7a h GLU 154 N 0.00 0.00 -0.40 3.23 9.09 -2.03 -0.61 114.58 123.86 1m7a h GLU 154 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1m7a h GLU 154 Cb 0.21 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.31 1m7a h GLU 154 CO 0.00 0.00 0.00 0.43 0.05 0.00 0.00 179.01 179.49 1m7a n SER 155 N -2.77 2.78 -4.34 3.06 7.64 -0.60 -4.94 113.62 114.45 1m7a n SER 155 Ca 0.00 -1.92 -0.21 0.00 1.01 0.00 0.00 58.87 57.75 1m7a n SER 155 Cb 0.21 -0.26 -0.11 0.00 -1.01 0.00 0.00 64.21 63.05 1m7a n SER 155 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 1m7a s TRP 156 N -1.48 1.79 -0.11 1.43 0.52 -0.24 -1.79 118.94 119.07 1m7a s TRP 156 Ca 0.36 -0.50 0.02 0.00 0.02 0.00 0.00 56.10 56.00 1m7a s TRP 156 Cb 0.20 -0.87 -0.01 0.00 -1.15 0.00 0.00 33.47 31.64 1m7a s TRP 156 CO 0.27 0.35 -0.18 0.99 0.02 0.00 0.00 176.95 178.41 1m7a s THR 157 N -2.37 2.60 -0.17 2.01 2.01 0.11 -4.80 115.64 115.03 1m7a s THR 157 Ca 0.18 -0.83 -0.28 0.00 0.31 0.00 0.00 61.69 61.07 1m7a s THR 157 Cb -0.04 -2.05 -0.00 0.00 0.01 0.00 0.00 72.50 70.42 1m7a s THR 157 CO 0.07 0.54 0.98 -0.75 -0.69 0.00 0.00 174.62 174.77 1m7a s LYS 158 N 0.29 4.33 0.62 4.92 2.20 -1.26 -1.14 119.74 129.70 1m7a s LYS 158 Ca -0.13 1.29 -0.08 0.00 -0.36 0.00 0.00 55.97 56.68 1m7a s LYS 158 Cb -0.17 -3.59 0.00 0.00 -1.51 0.00 0.00 37.83 32.57 1m7a s LYS 158 CO 0.07 -0.44 0.96 -0.65 -0.36 0.00 0.00 175.35 174.94 1m7a s GLN 159 N 2.49 3.04 0.75 4.03 -1.52 0.24 -5.00 119.66 123.69 1m7a s GLN 159 Ca 0.44 0.25 -0.12 0.00 -1.95 0.00 0.00 55.36 53.98 1m7a s GLN 159 Cb -0.17 -2.18 0.05 0.00 -0.22 0.00 0.00 33.01 30.49 1m7a s GLN 159 CO 0.12 -0.74 1.10 -1.25 -0.25 0.00 0.00 175.29 174.27 1m7a s PRO 160 N -5.10 2.32 0.51 2.91 0.04 -1.26 -4.65 135.00 129.76 1m7a s PRO 160 Ca 0.55 1.25 0.22 0.00 0.04 0.00 0.00 61.00 63.05 1m7a s PRO 160 Cb -0.11 -1.90 1.31 0.00 0.04 0.00 0.00 34.50 33.84 1m7a s PRO 160 CO 0.48 -1.61 2.02 -0.22 0.04 0.00 0.00 177.00 177.71 1m7a h LYS 161 N -0.88 0.07 -0.84 4.56 3.64 -1.97 -0.99 116.57 120.17 1m7a h LYS 161 Ca -0.44 -0.00 0.09 0.00 -1.27 0.00 0.00 60.65 59.03 1m7a h LYS 161 Cb 1.24 -0.02 -0.07 0.00 -0.41 0.00 0.00 32.23 32.97 1m7a h LYS 161 CO 0.51 0.05 0.48 0.66 -2.27 0.00 0.00 179.45 178.89 1m7a h SER 162 N 0.08 0.70 -0.52 4.20 4.64 -1.99 0.33 113.55 120.98 1m7a h SER 162 Ca 0.21 0.05 -0.10 0.00 -0.47 0.00 0.00 61.79 61.48 1m7a h SER 162 Cb 0.75 -0.09 -0.02 0.00 -0.31 0.00 0.00 62.40 62.74 1m7a h SER 162 CO -0.02 0.40 -0.08 -0.33 -0.87 0.00 0.00 176.83 175.93 1m7a h GLU 163 N 0.81 0.98 -0.38 4.77 4.39 -1.54 -1.92 114.58 121.69 1m7a h GLU 163 Ca 0.40 -0.35 -0.01 0.00 0.34 0.00 0.00 59.36 59.73 1m7a h GLU 163 Cb 0.36 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 28.93 1m7a h GLU 163 CO -0.24 1.03 0.19 1.25 -1.16 0.00 0.00 179.01 180.07 1m7a h LEU 164 N 0.84 0.50 -0.98 1.33 5.85 -1.32 -1.45 115.31 120.09 1m7a h LEU 164 Ca 0.14 -0.13 0.06 0.00 0.84 0.00 0.00 57.88 58.79 1m7a h LEU 164 Cb 0.64 -0.13 -0.06 0.00 0.37 0.00 0.00 40.66 41.48 1m7a h LEU 164 CO 0.04 0.49 0.63 -0.61 -0.34 0.00 0.00 178.44 178.65 1m7a h GLN 165 N 0.48 1.13 -0.67 1.25 5.75 -0.85 0.59 115.11 122.80 1m7a h GLN 165 Ca 0.13 -0.07 -0.08 0.00 -0.15 0.00 0.00 58.65 58.49 1m7a h GLN 165 Cb 0.12 -0.25 -0.03 0.00 1.07 0.00 0.00 27.48 28.38 1m7a h GLN 165 CO -0.02 0.75 0.12 0.87 -2.65 0.00 0.00 178.83 177.90 1m7a h LYS 166 N 1.16 1.10 0.11 1.69 1.57 -1.10 -0.16 116.57 120.93 1m7a h LYS 166 Ca 0.41 -0.28 -0.01 0.00 -1.87 0.00 0.00 60.65 58.91 1m7a h LYS 166 Cb 0.13 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.30 1m7a h LYS 166 CO -0.16 0.99 -0.05 0.35 -0.57 0.00 0.00 179.45 180.01 1m7a h PHE 167 N 1.03 -0.13 0.00 -1.35 3.04 -0.05 -3.12 116.94 116.35 1m7a h PHE 167 Ca 0.21 -0.00 0.00 0.00 3.98 0.00 0.00 57.97 62.15 1m7a h PHE 167 Cb 0.42 0.04 0.00 0.00 2.56 0.00 0.00 35.95 38.97 1m7a h PHE 167 CO 0.03 -0.07 0.00 1.33 -2.02 0.00 0.00 178.31 177.58 1m7a n VAL 168 N -5.15 0.65 0.00 1.41 0.24 0.06 -5.00 118.33 110.54 1m7a n VAL 168 Ca -0.08 -0.19 0.00 0.00 -2.04 0.00 0.00 64.34 62.02 1m7a n VAL 168 Cb 0.09 -0.70 0.00 0.00 -1.47 0.00 0.00 33.84 31.76 1m7a n VAL 168 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1m7a n GLY 169 N 1.06 3.27 0.24 7.63 0.00 -0.09 -3.35 105.19 113.96 1m7a n GLY 169 Ca 0.05 -0.16 0.11 0.00 0.00 0.00 0.00 46.02 46.02 1m7a n GLY 169 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1m7a h ASP 170 N 0.00 0.00 -2.58 1.61 3.45 -1.94 -3.45 116.42 113.51 1m7a h ASP 170 Ca 0.00 0.00 -0.58 0.00 0.43 0.00 0.00 57.03 56.88 1m7a h ASP 170 Cb 0.00 0.00 0.07 0.00 -0.56 0.00 0.00 39.33 38.84 1m7a h ASP 170 CO 0.00 0.18 0.69 0.41 -1.57 0.00 0.00 179.24 178.95 1m7a n THR 171 N -3.61 0.65 -2.48 0.35 -1.04 -1.21 -4.94 114.28 102.00 1m7a n THR 171 Ca -0.01 -0.16 -0.42 0.00 -2.04 0.00 0.00 64.05 61.41 1m7a n THR 171 Cb 0.32 -1.52 -0.03 0.00 -1.82 0.00 0.00 70.33 67.27 1m7a n THR 171 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1m7a s VAL 172 N 0.25 4.26 -0.37 12.58 1.01 -1.26 -5.01 120.40 131.86 1m7a s VAL 172 Ca 0.71 1.60 0.00 0.00 0.00 0.00 0.00 61.98 64.30 1m7a s VAL 172 Cb -0.65 -4.03 0.10 0.00 0.00 0.00 0.00 36.38 31.81 1m7a s VAL 172 CO 0.46 0.04 0.13 -0.76 0.00 0.00 0.00 175.10 174.96 1m7a s LEU 173 N 1.86 5.00 0.41 3.92 1.43 -1.26 -5.08 118.68 124.95 1m7a s LEU 173 Ca 0.56 -2.07 -0.17 0.00 -1.03 0.00 0.00 54.13 51.41 1m7a s LEU 173 Cb -0.25 -1.73 -0.09 0.00 0.03 0.00 0.00 46.19 44.14 1m7a s LEU 173 CO 0.24 -0.46 0.87 -1.61 0.23 0.00 0.00 176.35 175.61 1m7a s GLU 174 N 1.03 4.06 0.08 1.70 2.02 -1.26 -5.08 118.70 121.26 1m7a s GLU 174 Ca 0.09 0.87 0.03 0.00 0.02 0.00 0.00 54.97 55.98 1m7a s GLU 174 Cb -0.21 -2.28 -0.04 0.00 0.10 0.00 0.00 34.13 31.70 1m7a s GLU 174 CO -0.06 -0.01 0.11 -0.51 0.02 0.00 0.00 175.26 174.81 1m7a s ASP 175 N -2.47 5.71 -1.27 -0.19 1.01 -1.26 -4.70 116.67 113.50 1m7a s ASP 175 Ca 0.58 0.04 -0.27 0.00 0.71 0.00 0.00 52.55 53.61 1m7a s ASP 175 Cb -0.10 -1.58 0.03 0.00 1.01 0.00 0.00 42.92 42.28 1m7a s ASP 175 CO 0.20 0.16 0.58 0.47 0.21 0.00 0.00 175.17 176.79 1m7a n ASP 176 N 0.34 -3.33 -4.72 0.27 10.43 -1.24 -4.88 116.55 113.42 1m7a n ASP 176 Ca -0.08 -1.26 -0.42 0.00 2.57 0.00 0.00 54.79 55.60 1m7a n ASP 176 Cb 0.52 -1.88 -0.03 0.00 1.84 0.00 0.00 41.12 41.56 1m7a n ASP 176 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 1m7a s ILE 177 N -3.67 3.50 -0.09 0.53 1.01 -0.35 -4.75 121.20 117.39 1m7a s ILE 177 Ca 0.40 1.14 0.03 0.00 0.00 0.00 0.00 60.65 62.21 1m7a s ILE 177 Cb -0.21 -3.73 -0.02 0.00 0.01 0.00 0.00 42.46 38.51 1m7a s ILE 177 CO 0.96 0.12 -0.17 -0.54 0.00 0.00 0.00 174.94 175.32 1m7a s LYS 178 N 0.61 2.89 -0.27 2.79 1.02 -1.26 -0.42 119.74 125.10 1m7a s LYS 178 Ca 0.59 -0.75 -0.02 0.00 0.02 0.00 0.00 55.97 55.81 1m7a s LYS 178 Cb -0.34 -2.42 0.11 0.00 -0.52 0.00 0.00 37.83 34.66 1m7a s LYS 178 CO 0.33 0.38 0.23 -1.21 -0.92 0.00 0.00 175.35 174.16 1m7a s GLU 179 N -0.11 0.25 7.26 1.68 2.02 -0.33 -5.02 118.70 124.45 1m7a s GLU 179 Ca -0.03 -0.16 0.00 0.00 0.02 0.00 0.00 54.97 54.80 1m7a s GLU 179 Cb -0.14 -0.95 0.00 0.00 0.10 0.00 0.00 34.13 33.14 1m7a s GLU 179 CO 0.04 -0.93 0.00 0.41 0.02 0.00 0.00 175.26 174.80 1m7a n GLY 180 N 5.30 2.39 0.39 -1.39 0.00 -1.26 -1.80 105.19 108.82 1m7a n GLY 180 Ca -0.04 -0.32 0.14 0.00 0.00 0.00 0.00 46.02 45.79 1m7a n GLY 180 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1m7a n ASP 181 N 5.75 1.31 -4.85 1.61 10.43 -1.26 -4.89 116.55 124.64 1m7a n ASP 181 Ca 0.00 -1.25 -0.35 0.00 2.57 0.00 0.00 54.79 55.76 1m7a n ASP 181 Cb 0.00 0.05 -0.06 0.00 1.84 0.00 0.00 41.12 42.96 1m7a n ASP 181 CO 0.00 0.00 0.00 -0.36 -1.07 0.00 0.00 177.20 175.77 1m7a s PHE 182 N -2.21 3.60 -0.07 1.24 0.08 -0.74 -4.35 117.98 115.52 1m7a s PHE 182 Ca 0.32 0.95 0.03 0.00 0.12 0.00 0.00 56.93 58.35 1m7a s PHE 182 Cb 0.20 -2.28 0.01 0.00 -0.57 0.00 0.00 43.02 40.38 1m7a s PHE 182 CO 0.41 0.46 -0.14 0.99 -0.10 0.00 0.00 175.22 176.84 1m7a s THR 183 N -1.44 1.31 0.04 0.64 2.01 -0.47 -1.19 115.64 116.54 1m7a s THR 183 Ca 0.36 -0.58 -0.06 0.00 0.31 0.00 0.00 61.69 61.72 1m7a s THR 183 Cb -0.15 -1.18 -0.01 0.00 0.01 0.00 0.00 72.50 71.18 1m7a s THR 183 CO 0.19 0.39 0.11 -0.72 -0.69 0.00 0.00 174.62 173.90 1m7a s TYR 184 N 0.59 0.19 0.03 4.92 1.13 0.44 0.78 117.35 125.43 1m7a s TYR 184 Ca -0.15 -0.50 0.02 0.00 -1.41 0.00 0.00 57.07 55.02 1m7a s TYR 184 Cb -0.16 -0.13 -0.02 0.00 -1.10 0.00 0.00 41.96 40.55 1m7a s TYR 184 CO 0.05 -0.39 -0.07 -0.80 -2.51 0.00 0.00 175.55 171.82 1m7a s ASN 185 N -2.22 0.78 0.05 -0.18 -0.87 -0.93 -1.21 114.94 110.36 1m7a s ASN 185 Ca -0.03 -0.48 -0.19 0.00 -1.57 0.00 0.00 52.86 50.59 1m7a s ASN 185 Cb -0.00 0.02 -0.06 0.00 -0.02 0.00 0.00 41.25 41.19 1m7a s ASN 185 CO -0.05 -0.17 0.55 -0.31 -2.57 0.00 0.00 177.10 174.54 1m7a s TYR 186 N -1.19 3.78 0.07 2.20 2.02 -1.26 -0.29 117.35 122.68 1m7a s TYR 186 Ca -0.08 1.22 0.01 0.00 -0.37 0.00 0.00 57.07 57.85 1m7a s TYR 186 Cb -0.09 -2.48 -0.04 0.00 -0.40 0.00 0.00 41.96 38.96 1m7a s TYR 186 CO 0.00 0.58 -0.05 0.95 -1.57 0.00 0.00 175.55 175.45 1m7a s THR 187 N -1.02 0.51 -0.03 -0.71 -4.23 -0.61 -4.94 115.64 104.62 1m7a s THR 187 Ca 0.28 -1.75 0.06 0.00 -1.18 0.00 0.00 61.69 59.10 1m7a s THR 187 Cb -0.19 -1.44 -0.01 0.00 1.34 0.00 0.00 72.50 72.20 1m7a s THR 187 CO 0.18 -0.84 -0.20 -0.22 -0.54 0.00 0.00 174.62 173.00 1m7a s LEU 188 N -2.76 2.02 0.04 4.79 2.96 -1.26 -2.08 118.68 122.39 1m7a s LEU 188 Ca 0.07 -0.38 0.05 0.00 -0.22 0.00 0.00 54.13 53.64 1m7a s LEU 188 Cb 0.04 -1.08 -0.02 0.00 0.50 0.00 0.00 46.19 45.62 1m7a s LEU 188 CO -0.06 0.23 -0.14 0.26 -1.32 0.00 0.00 176.35 175.33 1m7a s TRP 189 N -0.35 1.25 0.22 5.38 0.52 -0.02 -0.59 118.94 125.34 1m7a s TRP 189 Ca 0.05 -0.36 0.03 0.00 0.02 0.00 0.00 56.10 55.83 1m7a s TRP 189 Cb -0.09 -0.74 -0.05 0.00 -1.15 0.00 0.00 33.47 31.44 1m7a s TRP 189 CO 0.00 0.04 0.02 0.95 0.02 0.00 0.00 176.95 177.98 1m7a s THR 190 N -0.88 0.86 0.35 2.01 -4.23 -0.29 -1.92 115.64 111.54 1m7a s THR 190 Ca 0.01 -2.01 -0.25 0.00 -1.18 0.00 0.00 61.69 58.26 1m7a s THR 190 Cb -0.08 -2.34 -0.09 0.00 1.34 0.00 0.00 72.50 71.32 1m7a s THR 190 CO 0.01 -0.31 1.01 -0.13 -0.54 0.00 0.00 174.62 174.66 1m7a s ARG 191 N -3.91 4.41 0.00 3.99 0.52 -1.26 0.06 118.95 122.77 1m7a s ARG 191 Ca 0.29 1.46 0.18 0.00 -0.52 0.00 0.00 55.73 57.14 1m7a s ARG 191 Cb 0.06 -2.72 1.09 0.00 0.52 0.00 0.00 34.95 33.90 1m7a s ARG 191 CO 0.08 0.09 1.49 0.36 0.02 0.00 0.00 175.30 177.34