#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h8b n PRO 2 N 0.00 0.38 0.13 0.00 -0.02 -1.26 -4.91 135.00 129.32 3h8b n PRO 2 Ca 0.00 0.20 0.00 0.00 -2.02 0.00 0.00 63.50 61.68 3h8b n PRO 2 Cb 0.00 -2.35 0.30 0.00 -0.02 0.00 0.00 33.50 31.43 3h8b n PRO 2 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3h8b h ARG 3 N -0.55 0.14 -3.35 -0.52 2.47 -2.03 -3.45 114.38 107.10 3h8b h ARG 3 Ca -0.47 -0.05 -0.16 0.00 -1.26 0.00 0.00 59.98 58.03 3h8b h ARG 3 Cb 1.31 -0.01 -0.23 0.00 -1.65 0.00 0.00 29.97 29.39 3h8b h ARG 3 CO 0.46 0.48 -0.48 -1.12 0.56 0.00 0.00 179.97 179.88 3h8b s SER 4 N -6.90 -0.11 -0.05 7.04 0.01 -1.26 -4.43 113.70 108.00 3h8b s SER 4 Ca -0.04 0.13 -0.04 0.00 1.31 0.00 0.00 55.95 57.31 3h8b s SER 4 Cb 0.14 0.31 0.01 0.00 0.21 0.00 0.00 66.02 66.70 3h8b s SER 4 CO 0.75 -0.22 0.12 -0.69 0.41 0.00 0.00 173.24 173.61 3h8b s VAL 5 N -0.59 -0.01 -0.34 3.43 1.01 0.64 -4.94 120.40 119.60 3h8b s VAL 5 Ca -0.07 0.02 0.03 0.00 0.00 0.00 0.00 61.98 61.96 3h8b s VAL 5 Cb -0.04 -0.18 0.16 0.00 0.00 0.00 0.00 36.38 36.32 3h8b s VAL 5 CO 0.01 0.01 0.42 -0.62 0.00 0.00 0.00 175.10 174.92 3h8b s ASP 6 N 0.19 0.49 0.23 3.32 -1.08 -1.26 -0.42 116.67 118.15 3h8b s ASP 6 Ca -0.01 -0.93 0.18 0.00 -0.52 0.00 0.00 52.55 51.26 3h8b s ASP 6 Cb -0.02 0.98 0.88 0.00 -1.46 0.00 0.00 42.92 43.30 3h8b s ASP 6 CO -0.01 -0.29 1.54 0.79 0.52 0.00 0.00 175.17 177.72 3h8b n TRP 7 N 4.78 0.57 0.22 -5.34 7.02 -0.23 -1.77 117.44 122.69 3h8b n TRP 7 Ca 0.06 0.27 0.06 0.00 -1.02 0.00 0.00 57.50 56.87 3h8b n TRP 7 Cb 0.49 -0.94 0.50 0.00 -2.42 0.00 0.00 31.31 28.94 3h8b n TRP 7 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 3h8b h ARG 8 N 0.00 0.00 0.00 -0.99 3.08 -1.95 -2.16 114.38 112.36 3h8b h ARG 8 Ca 0.00 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.01 3h8b h ARG 8 Cb 0.09 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 3h8b h ARG 8 CO 0.00 0.23 -0.19 0.93 -1.07 0.00 0.00 179.97 179.87 3h8b h GLU 9 N 0.00 0.00 -0.41 0.04 5.08 -1.75 -3.05 114.58 114.49 3h8b h GLU 9 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3h8b h GLU 9 Cb 0.43 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.68 3h8b h GLU 9 CO 0.03 0.19 0.00 1.63 -1.00 0.00 0.00 179.01 179.86 3h8b n LYS 10 N -4.03 2.46 -0.86 2.33 4.76 -0.82 -4.96 118.16 117.04 3h8b n LYS 10 Ca -0.02 -2.22 0.00 0.00 -2.87 0.00 0.00 58.31 53.20 3h8b n LYS 10 Cb 0.26 -1.51 0.00 0.00 -1.84 0.00 0.00 35.03 31.95 3h8b n LYS 10 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3h8b n GLY 11 N 1.49 0.53 0.12 0.72 0.00 -1.15 -4.95 105.19 101.95 3h8b n GLY 11 Ca 0.20 -0.38 0.13 0.00 0.00 0.00 0.00 46.02 45.97 3h8b n GLY 11 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3h8b h TYR 12 N 0.00 0.00 -3.69 1.61 -1.99 -1.78 -3.45 116.97 107.67 3h8b h TYR 12 Ca 0.00 0.00 -0.68 0.00 2.00 0.00 0.00 58.73 60.05 3h8b h TYR 12 Cb 0.00 0.00 -0.29 0.00 2.00 0.00 0.00 36.73 38.44 3h8b h TYR 12 CO 0.00 0.00 -0.83 0.08 -0.00 0.00 0.00 178.16 177.41 3h8b s VAL 13 N -3.12 2.49 0.74 -2.88 1.01 -1.26 -3.66 120.40 113.72 3h8b s VAL 13 Ca 0.10 -0.89 -0.11 0.00 0.00 0.00 0.00 61.98 61.08 3h8b s VAL 13 Cb 0.11 -1.97 0.05 0.00 0.00 0.00 0.00 36.38 34.57 3h8b s VAL 13 CO 0.61 0.56 1.11 0.42 0.00 0.00 0.00 175.10 177.80 3h8b s THR 14 N -0.01 2.73 0.90 3.92 -4.23 -1.26 -5.01 115.64 112.68 3h8b s THR 14 Ca -0.06 0.17 -0.10 0.00 -1.18 0.00 0.00 61.69 60.51 3h8b s THR 14 Cb -0.15 -3.22 0.14 0.00 1.34 0.00 0.00 72.50 70.61 3h8b s THR 14 CO 0.05 -0.28 1.13 -2.84 -0.54 0.00 0.00 174.62 172.14 3h8b s PRO 15 N -5.42 1.13 0.23 3.99 0.02 -1.26 -4.92 135.00 128.77 3h8b s PRO 15 Ca 0.60 1.45 -0.30 0.00 0.02 0.00 0.00 61.00 62.76 3h8b s PRO 15 Cb -0.11 -1.75 -0.09 0.00 0.02 0.00 0.00 34.50 32.57 3h8b s PRO 15 CO 0.49 -2.52 1.34 0.08 -0.33 0.00 0.00 177.00 176.07 3h8b s VAL 16 N -2.69 3.01 0.53 3.83 1.01 -1.26 -5.03 120.40 119.80 3h8b s VAL 16 Ca 0.66 0.85 0.07 0.00 0.00 0.00 0.00 61.98 63.56 3h8b s VAL 16 Cb -0.22 -3.55 0.04 0.00 0.00 0.00 0.00 36.38 32.66 3h8b s VAL 16 CO 0.58 0.14 0.49 -0.54 0.00 0.00 0.00 175.10 175.77 3h8b s LYS 17 N -0.40 2.31 -0.16 2.72 1.02 -1.26 -4.73 119.74 119.24 3h8b s LYS 17 Ca 0.56 -1.86 -0.02 0.00 0.02 0.00 0.00 55.97 54.67 3h8b s LYS 17 Cb -0.38 -2.27 0.05 0.00 -0.52 0.00 0.00 37.83 34.71 3h8b s LYS 17 CO 0.41 -0.60 0.03 1.21 -0.92 0.00 0.00 175.35 175.47 3h8b s ASN 18 N -4.34 2.53 0.43 2.83 3.84 -1.26 -1.03 114.94 117.94 3h8b s ASN 18 Ca 0.43 -0.61 0.29 0.00 0.21 0.00 0.00 52.86 53.18 3h8b s ASN 18 Cb -0.03 -0.55 1.18 0.00 -0.55 0.00 0.00 41.25 41.30 3h8b s ASN 18 CO 0.26 -0.27 1.86 0.06 -2.79 0.00 0.00 177.10 176.22 3h8b h GLN 19 N 8.27 0.00 0.00 0.43 3.07 -1.15 -3.47 115.11 122.26 3h8b h GLN 19 Ca -0.17 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.57 3h8b h GLN 19 Cb 1.12 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.68 3h8b h GLN 19 CO 0.32 0.00 0.00 0.41 0.09 0.00 0.00 178.83 179.65 3h8b n GLY 20 N 0.09 0.42 2.75 0.06 0.00 -1.26 -3.84 105.19 103.41 3h8b n GLY 20 Ca 0.01 -0.90 -0.42 0.00 0.00 0.00 0.00 46.02 44.72 3h8b n GLY 20 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3h8b n GLN 21 N 0.00 3.36 -3.66 1.61 6.02 -1.26 -4.81 117.38 118.65 3h8b n GLN 21 Ca 0.00 -3.05 -0.10 0.00 -0.01 0.00 0.00 57.00 53.83 3h8b n GLN 21 Cb 0.00 -3.05 -0.08 0.00 1.02 0.00 0.00 30.24 28.13 3h8b n GLN 21 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3h8b n GLY 23 N 3.74 4.19 1.00 0.00 0.00 0.27 -4.43 105.19 109.95 3h8b n GLY 23 Ca -0.18 -1.46 0.08 0.00 0.00 0.00 0.00 46.02 44.45 3h8b n GLY 23 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3h8b n SER 24 N 3.70 3.81 -0.33 1.61 3.41 -1.26 -3.07 113.62 121.49 3h8b n SER 24 Ca 0.76 -2.52 0.14 0.00 -0.26 0.00 0.00 58.87 56.98 3h8b n SER 24 Cb 0.23 -0.45 0.35 0.00 -0.26 0.00 0.00 64.21 64.09 3h8b n SER 24 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3h8b h TRP 26 N 0.71 0.05 -0.05 0.00 5.08 -1.82 -0.70 115.95 119.22 3h8b h TRP 26 Ca 0.55 0.00 -0.22 0.00 1.08 0.00 0.00 58.89 60.30 3h8b h TRP 26 Cb 0.92 -0.02 0.01 0.00 -3.00 0.00 0.00 29.16 27.07 3h8b h TRP 26 CO -0.00 0.03 -0.88 0.00 -1.28 0.00 0.00 178.44 176.31 3h8b h ALA 27 N 1.88 0.37 -0.09 0.11 0.00 -1.22 -2.35 119.26 117.96 3h8b h ALA 27 Ca 0.10 -0.66 -0.14 0.00 0.00 0.00 0.00 54.91 54.22 3h8b h ALA 27 Cb 0.35 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 3h8b h ALA 27 CO -0.01 0.76 -0.54 0.74 0.00 0.00 0.00 179.25 180.19 3h8b h PHE 28 N 0.33 0.33 -0.33 0.00 -1.00 -1.10 0.10 116.94 115.27 3h8b h PHE 28 Ca -0.07 -0.11 -0.12 0.00 2.81 0.00 0.00 57.97 60.48 3h8b h PHE 28 Cb 1.50 -0.06 -0.01 0.00 3.61 0.00 0.00 35.95 40.99 3h8b h PHE 28 CO 0.07 0.75 -0.24 1.03 -1.61 0.00 0.00 178.31 178.30 3h8b h SER 29 N 0.20 0.79 -0.07 2.17 0.87 -1.19 -1.04 113.55 115.29 3h8b h SER 29 Ca 0.00 -0.44 -0.01 0.00 -1.23 0.00 0.00 61.79 60.11 3h8b h SER 29 Cb 1.02 -0.22 -0.00 0.00 -0.44 0.00 0.00 62.40 62.76 3h8b h SER 29 CO 0.09 1.06 0.01 0.00 -0.53 0.00 0.00 176.83 177.46 3h8b h ALA 30 N 0.75 0.09 -0.08 6.23 0.00 -1.21 -1.45 119.26 123.59 3h8b h ALA 30 Ca 0.06 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 3h8b h ALA 30 Cb 0.80 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 3h8b h ALA 30 CO 0.06 -0.27 -0.08 1.79 0.00 0.00 0.00 179.25 180.76 3h8b h THR 31 N -0.14 1.11 -0.37 0.00 1.35 -1.00 -0.57 112.91 113.29 3h8b h THR 31 Ca 0.02 -0.47 -0.04 0.00 -0.55 0.00 0.00 66.41 65.37 3h8b h THR 31 Cb 0.28 1.13 -0.01 0.00 -1.73 0.00 0.00 68.15 67.82 3h8b h THR 31 CO 0.00 0.14 0.06 1.23 -0.25 0.00 0.00 175.52 176.71 3h8b h GLY 32 N 0.47 0.65 1.41 5.82 0.00 -0.79 -0.56 103.07 110.06 3h8b h GLY 32 Ca 0.03 -0.43 -0.14 0.00 0.00 0.00 0.00 47.33 46.79 3h8b h GLY 32 CO 0.01 0.40 -0.40 0.00 0.00 0.00 0.00 176.54 176.55 3h8b h ALA 33 N 0.91 0.79 -0.26 3.60 0.00 -0.72 -2.64 119.26 120.94 3h8b h ALA 33 Ca 0.11 -0.44 -0.04 0.00 0.00 0.00 0.00 54.91 54.54 3h8b h ALA 33 Cb 0.35 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 3h8b h ALA 33 CO 0.01 0.65 0.01 -0.07 0.00 0.00 0.00 179.25 179.85 3h8b h LEU 34 N 0.54 0.44 -0.77 0.00 3.38 -1.01 -2.25 115.31 115.63 3h8b h LEU 34 Ca 0.05 -0.29 0.12 0.00 0.09 0.00 0.00 57.88 57.84 3h8b h LEU 34 Cb 0.92 -0.12 -0.08 0.00 0.09 0.00 0.00 40.66 41.47 3h8b h LEU 34 CO 0.08 0.62 0.38 -0.33 0.09 0.00 0.00 178.44 179.28 3h8b h GLU 35 N 0.24 0.57 -0.41 1.13 5.08 -1.02 0.39 114.58 120.56 3h8b h GLU 35 Ca 0.08 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.36 3h8b h GLU 35 Cb 0.39 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.49 3h8b h GLU 35 CO 0.01 0.38 0.09 0.78 -1.00 0.00 0.00 179.01 179.27 3h8b h GLY 36 N 0.59 0.72 1.38 -3.84 0.00 -1.29 -1.84 103.07 98.79 3h8b h GLY 36 Ca 0.40 -0.46 -0.21 0.00 0.00 0.00 0.00 47.33 47.06 3h8b h GLY 36 CO -0.33 0.43 -0.78 1.46 0.00 0.00 0.00 176.54 177.32 3h8b h GLN 37 N 0.53 0.60 -0.00 4.80 1.08 -0.76 -1.37 115.11 119.99 3h8b h GLN 37 Ca 0.13 -0.51 -0.05 0.00 -1.45 0.00 0.00 58.65 56.78 3h8b h GLN 37 Cb 0.33 0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 27.87 3h8b h GLN 37 CO 0.00 1.13 -0.22 0.52 -0.95 0.00 0.00 178.83 179.31 3h8b h MET 38 N 0.40 0.00 -0.07 1.46 2.86 -0.23 -2.05 114.93 117.30 3h8b h MET 38 Ca -0.05 -0.00 -0.15 0.00 -2.06 0.00 0.00 59.70 57.44 3h8b h MET 38 Cb 1.39 -0.00 0.01 0.00 0.06 0.00 0.00 31.60 33.05 3h8b h MET 38 CO 0.15 0.22 -0.55 0.35 1.06 0.00 0.00 176.91 178.14 3h8b h PHE 39 N 0.00 0.68 -0.17 -0.22 3.57 -1.15 0.15 116.94 119.81 3h8b h PHE 39 Ca -0.00 -0.32 0.05 0.00 3.53 0.00 0.00 57.97 61.22 3h8b h PHE 39 Cb 0.39 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.02 3h8b h PHE 39 CO 0.00 1.11 0.15 -0.09 -2.23 0.00 0.00 178.31 177.25 3h8b h ARG 40 N 0.06 0.00 0.06 1.11 2.43 -0.87 0.22 114.38 117.39 3h8b h ARG 40 Ca -0.05 0.00 -0.35 0.00 -0.81 0.00 0.00 59.98 58.77 3h8b h ARG 40 Cb 1.21 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.73 3h8b h ARG 40 CO 0.11 0.00 -1.96 1.17 -1.51 0.00 0.00 179.97 177.78 3h8b n LYS 41 N -4.13 0.68 0.00 0.20 4.81 -0.81 -4.62 118.16 114.29 3h8b n LYS 41 Ca 0.01 0.32 0.07 0.00 -0.87 0.00 0.00 58.31 57.84 3h8b n LYS 41 Cb 0.28 -1.67 -0.03 0.00 0.02 0.00 0.00 35.03 33.63 3h8b n LYS 41 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 3h8b n THR 42 N -3.73 0.00 -0.89 3.15 -2.24 0.03 -4.96 114.28 105.64 3h8b n THR 42 Ca -0.37 -0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.14 3h8b n THR 42 Cb 0.94 1.10 0.00 0.00 -2.10 0.00 0.00 70.33 70.27 3h8b n THR 42 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3h8b n GLY 43 N 1.18 0.43 3.37 3.38 0.00 0.76 -4.98 105.19 109.34 3h8b n GLY 43 Ca 0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.74 3h8b n GLY 43 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3h8b s ARG 44 N -0.64 2.92 -0.36 1.61 0.52 -1.26 -5.03 118.95 116.72 3h8b s ARG 44 Ca 0.00 -0.75 -0.12 0.00 -0.52 0.00 0.00 55.73 54.35 3h8b s ARG 44 Cb 0.00 -2.43 0.01 0.00 0.52 0.00 0.00 34.95 33.05 3h8b s ARG 44 CO 0.00 0.37 0.21 -1.17 0.02 0.00 0.00 175.30 174.74 3h8b s LEU 45 N -0.09 4.60 -0.11 2.53 2.96 -1.26 -3.80 118.68 123.51 3h8b s LEU 45 Ca -0.03 -0.77 0.02 0.00 -0.22 0.00 0.00 54.13 53.13 3h8b s LEU 45 Cb -0.14 -2.06 0.01 0.00 0.50 0.00 0.00 46.19 44.51 3h8b s LEU 45 CO 0.04 -0.32 -0.16 -0.63 -1.32 0.00 0.00 176.35 173.96 3h8b s ILE 46 N 1.62 1.53 0.39 6.68 1.01 -1.26 -5.11 121.20 126.05 3h8b s ILE 46 Ca 0.04 -0.67 -0.26 0.00 0.00 0.00 0.00 60.65 59.75 3h8b s ILE 46 Cb -0.18 -1.39 -0.09 0.00 0.01 0.00 0.00 42.46 40.81 3h8b s ILE 46 CO 0.08 0.45 1.29 -0.55 0.00 0.00 0.00 174.94 176.20 3h8b s SER 47 N 0.91 6.42 0.18 3.58 0.15 -1.26 -4.82 113.70 118.86 3h8b s SER 47 Ca -0.08 2.63 0.07 0.00 0.70 0.00 0.00 55.95 59.27 3h8b s SER 47 Cb -0.15 -2.64 -0.04 0.00 -1.71 0.00 0.00 66.02 61.48 3h8b s SER 47 CO -0.00 -0.77 0.02 -0.76 1.20 0.00 0.00 173.24 172.92 3h8b s LEU 48 N -2.31 3.36 -0.49 3.45 1.43 -1.26 -1.25 118.68 121.61 3h8b s LEU 48 Ca 0.55 -0.39 -0.29 0.00 -1.03 0.00 0.00 54.13 52.98 3h8b s LEU 48 Cb -0.38 -2.00 0.02 0.00 0.03 0.00 0.00 46.19 43.87 3h8b s LEU 48 CO 0.49 0.08 1.31 -0.55 0.23 0.00 0.00 176.35 177.90 3h8b s SER 49 N -3.03 6.38 0.21 2.29 0.15 -0.62 -4.12 113.70 114.96 3h8b s SER 49 Ca 0.28 0.49 0.07 0.00 0.70 0.00 0.00 55.95 57.48 3h8b s SER 49 Cb -0.09 -2.55 0.12 0.00 -1.71 0.00 0.00 66.02 61.80 3h8b s SER 49 CO 0.19 -1.46 1.47 -0.33 1.20 0.00 0.00 173.24 174.31 3h8b h GLU 50 N 10.23 0.09 -0.34 5.44 3.07 -1.88 -3.14 114.58 128.05 3h8b h GLU 50 Ca -0.26 -0.09 -0.06 0.00 -0.50 0.00 0.00 59.36 58.46 3h8b h GLU 50 Cb 1.08 0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 29.00 3h8b h GLU 50 CO 1.14 0.81 -0.05 0.37 -1.40 0.00 0.00 179.01 179.88 3h8b h GLN 51 N 0.05 0.54 0.01 2.33 5.75 -1.84 -0.53 115.11 121.42 3h8b h GLN 51 Ca -0.02 -0.13 0.02 0.00 -0.15 0.00 0.00 58.65 58.37 3h8b h GLN 51 Cb 1.35 -0.07 -0.03 0.00 1.07 0.00 0.00 27.48 29.80 3h8b h GLN 51 CO 0.11 0.60 -0.13 -0.97 -2.65 0.00 0.00 178.83 175.80 3h8b h ASN 52 N 0.51 -0.37 -0.19 -0.69 -0.00 -1.78 -0.63 115.58 112.43 3h8b h ASN 52 Ca 0.10 0.05 0.01 0.00 -0.00 0.00 0.00 56.30 56.46 3h8b h ASN 52 Cb 0.40 0.15 -0.01 0.00 -0.00 0.00 0.00 38.32 38.87 3h8b h ASN 52 CO 0.02 -0.18 0.12 -0.07 -0.00 0.00 0.00 177.43 177.31 3h8b h LEU 53 N -0.22 0.19 -1.07 0.34 3.38 -1.41 -1.60 115.31 114.92 3h8b h LEU 53 Ca 0.04 -0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.03 3h8b h LEU 53 Cb 0.27 -0.04 -0.05 0.00 0.09 0.00 0.00 40.66 40.93 3h8b h LEU 53 CO -0.12 0.14 0.63 0.58 0.09 0.00 0.00 178.44 179.76 3h8b h VAL 54 N 0.24 1.22 0.00 1.22 2.07 -0.86 -1.56 116.25 118.58 3h8b h VAL 54 Ca 0.07 -0.43 -0.14 0.00 0.82 0.00 0.00 66.70 67.03 3h8b h VAL 54 Cb -0.01 -0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 29.59 3h8b h VAL 54 CO -0.03 0.23 -0.80 0.44 0.02 0.00 0.00 177.57 177.44 3h8b h ASP 55 N 1.25 0.00 -0.00 0.57 3.32 -0.94 -3.39 116.42 117.23 3h8b h ASP 55 Ca 0.36 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.41 3h8b h ASP 55 Cb -0.10 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.45 3h8b h ASP 55 CO -0.09 0.59 -0.04 0.00 -1.72 0.00 0.00 179.24 177.99 3h8b n SER 57 N -0.17 3.46 -0.26 0.00 3.41 -0.60 -4.39 113.62 115.07 3h8b n SER 57 Ca 0.01 -2.17 0.06 0.00 -0.26 0.00 0.00 58.87 56.52 3h8b n SER 57 Cb 0.07 -0.45 0.20 0.00 -0.26 0.00 0.00 64.21 63.77 3h8b n SER 57 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 3h8b h GLY 58 N 4.63 1.18 0.98 5.00 0.00 -1.83 -1.16 103.07 111.88 3h8b h GLY 58 Ca 0.00 -0.13 0.07 0.00 0.00 0.00 0.00 47.33 47.27 3h8b h GLY 58 CO 0.09 -0.14 0.49 -2.55 0.00 0.00 0.00 176.54 174.43 3h8b h PRO 59 N 0.41 0.72 0.00 4.80 0.11 -1.86 -0.53 132.00 135.65 3h8b h PRO 59 Ca 0.44 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.50 3h8b h PRO 59 Cb 0.71 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.65 3h8b h PRO 59 CO -0.44 0.48 0.00 1.04 -0.21 0.00 0.00 178.00 178.87 3h8b n GLN 60 N -4.49 0.18 0.00 1.05 3.00 -0.46 -4.87 117.38 111.80 3h8b n GLN 60 Ca 0.11 0.10 0.00 0.00 -0.01 0.00 0.00 57.00 57.20 3h8b n GLN 60 Cb 0.26 -1.50 0.00 0.00 0.00 0.00 0.00 30.24 29.00 3h8b n GLN 60 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3h8b n GLY 61 N 0.65 0.98 3.82 1.08 0.00 -0.21 -4.82 105.19 106.69 3h8b n GLY 61 Ca 0.08 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.77 3h8b n GLY 61 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3h8b s ASN 62 N -1.16 6.61 -0.37 1.61 0.01 -1.11 -4.87 114.94 115.66 3h8b s ASN 62 Ca 0.00 1.74 0.06 0.00 -0.71 0.00 0.00 52.86 53.94 3h8b s ASN 62 Cb 0.00 -2.54 0.47 0.00 0.41 0.00 0.00 41.25 39.59 3h8b s ASN 62 CO 0.00 -0.59 1.45 -0.62 -1.51 0.00 0.00 177.10 175.83 3h8b n GLU 63 N -1.06 2.85 0.00 -0.60 -0.58 0.12 -4.13 120.64 117.25 3h8b n GLU 63 Ca 0.08 -3.68 0.00 0.00 -0.42 0.00 0.00 57.16 53.13 3h8b n GLU 63 Cb 0.54 -2.13 0.00 0.00 -0.57 0.00 0.00 31.44 29.27 3h8b n GLU 63 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3h8b n GLY 64 N -0.89 3.53 0.00 0.62 0.00 -1.22 -0.84 105.19 106.39 3h8b n GLY 64 Ca 0.44 0.04 0.12 0.00 0.00 0.00 0.00 46.02 46.63 3h8b n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h8b n ASN 66 N -1.15 2.09 0.00 0.00 3.02 -0.02 -0.57 115.26 118.63 3h8b n ASN 66 Ca 0.15 -1.59 0.00 0.00 -0.03 0.00 0.00 54.58 53.11 3h8b n ASN 66 Cb 0.14 0.13 0.00 0.00 -0.61 0.00 0.00 39.78 39.44 3h8b n ASN 66 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3h8b n GLY 67 N 1.32 2.56 0.00 7.41 0.00 -1.12 -4.91 105.19 110.45 3h8b n GLY 67 Ca 0.14 -1.91 0.00 0.00 0.00 0.00 0.00 46.02 44.25 3h8b n GLY 67 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h8b n GLY 68 N -1.69 -1.43 3.12 -0.02 0.00 -1.26 0.14 105.19 104.05 3h8b n GLY 68 Ca 0.00 -1.02 -0.20 0.00 0.00 0.00 0.00 46.02 44.80 3h8b n GLY 68 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h8b s LEU 69 N 0.00 2.12 0.32 0.99 1.43 -1.26 -4.81 118.68 117.47 3h8b s LEU 69 Ca 0.00 -0.37 0.02 0.00 -1.03 0.00 0.00 54.13 52.75 3h8b s LEU 69 Cb 0.00 -0.61 0.55 0.00 0.03 0.00 0.00 46.19 46.16 3h8b s LEU 69 CO 0.00 0.07 1.90 0.24 0.23 0.00 0.00 176.35 178.79 3h8b h MET 70 N 5.25 0.71 -0.74 1.70 2.86 -1.97 -2.31 114.93 120.43 3h8b h MET 70 Ca -0.36 -0.12 -0.01 0.00 -2.06 0.00 0.00 59.70 57.16 3h8b h MET 70 Cb 1.18 -0.12 -0.04 0.00 0.06 0.00 0.00 31.60 32.68 3h8b h MET 70 CO 0.46 0.61 0.43 -0.44 1.06 0.00 0.00 176.91 179.03 3h8b h ASP 71 N 0.70 0.90 -0.52 1.22 3.32 -1.96 -0.59 116.42 119.49 3h8b h ASP 71 Ca 0.16 -0.08 -0.02 0.00 0.02 0.00 0.00 57.03 57.12 3h8b h ASP 71 Cb 0.20 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.49 3h8b h ASP 71 CO -0.01 0.71 0.27 1.88 -1.72 0.00 0.00 179.24 180.37 3h8b h TYR 72 N 1.01 0.76 -0.41 4.55 0.05 -1.77 0.56 116.97 121.72 3h8b h TYR 72 Ca 0.26 -0.02 -0.05 0.00 0.05 0.00 0.00 58.73 58.97 3h8b h TYR 72 Cb -0.01 -0.24 -0.02 0.00 1.01 0.00 0.00 36.73 37.47 3h8b h TYR 72 CO -0.01 0.55 0.06 0.00 -1.05 0.00 0.00 178.16 177.72 3h8b h ALA 73 N 1.53 0.54 -0.25 3.88 0.00 -0.73 -1.58 119.26 122.64 3h8b h ALA 73 Ca 0.19 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 3h8b h ALA 73 Cb 0.07 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 3h8b h ALA 73 CO -0.03 0.26 -0.13 0.74 0.00 0.00 0.00 179.25 180.10 3h8b h PHE 74 N 0.53 0.45 -0.28 0.00 0.04 -0.54 -2.25 116.94 114.89 3h8b h PHE 74 Ca 0.12 -0.07 -0.10 0.00 2.80 0.00 0.00 57.97 60.73 3h8b h PHE 74 Cb 0.38 -0.12 -0.01 0.00 2.20 0.00 0.00 35.95 38.40 3h8b h PHE 74 CO 0.03 0.55 -0.25 0.37 -0.60 0.00 0.00 178.31 178.40 3h8b h GLN 75 N 0.40 0.54 0.06 1.51 5.75 -0.62 -3.05 115.11 119.70 3h8b h GLN 75 Ca 0.07 -0.21 -0.00 0.00 -0.15 0.00 0.00 58.65 58.36 3h8b h GLN 75 Cb 0.47 -0.03 0.00 0.00 1.07 0.00 0.00 27.48 28.99 3h8b h GLN 75 CO 0.03 0.75 -0.03 -0.92 -2.65 0.00 0.00 178.83 176.01 3h8b h TYR 76 N 0.48 -0.08 -0.84 3.99 3.20 -0.75 -1.92 116.97 121.05 3h8b h TYR 76 Ca 0.07 -0.00 0.17 0.00 3.14 0.00 0.00 58.73 62.11 3h8b h TYR 76 Cb 0.69 0.03 -0.11 0.00 1.54 0.00 0.00 36.73 38.88 3h8b h TYR 76 CO 0.03 0.26 0.37 0.28 -1.64 0.00 0.00 178.16 177.45 3h8b h VAL 77 N -0.43 0.60 0.16 1.81 2.07 -1.41 0.34 116.25 119.39 3h8b h VAL 77 Ca -0.01 -0.16 -0.01 0.00 0.82 0.00 0.00 66.70 67.34 3h8b h VAL 77 Cb 0.37 0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.23 3h8b h VAL 77 CO 0.01 0.09 -0.08 -0.61 0.02 0.00 0.00 177.57 177.00 3h8b h GLN 78 N 0.47 -0.20 -1.04 1.57 4.15 -1.49 -1.28 115.11 117.28 3h8b h GLN 78 Ca 0.48 0.01 0.34 0.00 0.77 0.00 0.00 58.65 60.26 3h8b h GLN 78 Cb 0.80 0.05 -0.14 0.00 0.21 0.00 0.00 27.48 28.40 3h8b h GLN 78 CO -0.45 -0.14 0.61 -0.44 -1.93 0.00 0.00 178.83 176.49 3h8b h ASP 79 N -0.24 0.47 1.12 -0.69 3.32 -1.03 0.22 116.42 119.59 3h8b h ASP 79 Ca -0.02 0.18 0.00 0.00 0.02 0.00 0.00 57.03 57.21 3h8b h ASP 79 Cb 0.16 0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.85 3h8b h ASP 79 CO 0.04 -0.14 0.00 -3.20 -1.72 0.00 0.00 179.24 174.21 3h8b n ASN 80 N -4.99 0.20 0.00 6.45 5.15 0.12 -4.92 115.26 117.27 3h8b n ASN 80 Ca 0.32 0.52 0.00 0.00 -0.60 0.00 0.00 54.58 54.82 3h8b n ASN 80 Cb 1.05 -0.57 0.00 0.00 -0.53 0.00 0.00 39.78 39.73 3h8b n ASN 80 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3h8b n GLY 81 N 1.45 0.87 0.00 8.20 0.00 0.79 -4.95 105.19 111.55 3h8b n GLY 81 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 3h8b n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h8b n GLY 82 N -2.09 2.21 3.04 -0.02 0.00 -0.53 -4.92 105.19 102.88 3h8b n GLY 82 Ca 0.00 -1.18 -0.24 0.00 0.00 0.00 0.00 46.02 44.60 3h8b n GLY 82 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3h8b s LEU 83 N 0.00 1.73 0.68 0.99 2.96 -0.27 -4.75 118.68 120.02 3h8b s LEU 83 Ca 0.00 -0.29 -0.14 0.00 -0.22 0.00 0.00 54.13 53.48 3h8b s LEU 83 Cb 0.00 -0.80 0.01 0.00 0.50 0.00 0.00 46.19 45.90 3h8b s LEU 83 CO 0.00 0.07 1.11 -1.81 -1.32 0.00 0.00 176.35 174.40 3h8b s ASP 84 N 0.43 4.98 0.69 3.68 1.01 -1.26 -1.37 116.67 124.82 3h8b s ASP 84 Ca -0.10 2.00 -0.11 0.00 0.71 0.00 0.00 52.55 55.05 3h8b s ASP 84 Cb -0.13 -2.55 0.00 0.00 1.01 0.00 0.00 42.92 41.25 3h8b s ASP 84 CO 0.03 -1.72 1.06 -0.94 0.21 0.00 0.00 175.17 173.81 3h8b s SER 85 N -2.65 5.48 0.24 0.27 1.04 -0.90 -1.59 113.70 115.59 3h8b s SER 85 Ca 0.67 1.56 -0.07 0.00 0.48 0.00 0.00 55.95 58.58 3h8b s SER 85 Cb -0.20 -2.45 0.23 0.00 0.10 0.00 0.00 66.02 63.69 3h8b s SER 85 CO 0.43 -1.37 1.90 -0.08 0.98 0.00 0.00 173.24 175.11 3h8b h GLU 86 N -0.67 1.24 -0.69 4.02 4.57 -1.33 -1.45 114.58 120.28 3h8b h GLU 86 Ca -0.44 -0.09 -0.02 0.00 -1.18 0.00 0.00 59.36 57.63 3h8b h GLU 86 Cb 1.21 -0.27 -0.03 0.00 -0.16 0.00 0.00 28.75 29.50 3h8b h GLU 86 CO 0.58 0.84 0.37 1.49 -1.18 0.00 0.00 179.01 181.11 3h8b h GLU 87 N 1.27 0.97 0.00 1.92 4.81 -1.93 -2.89 114.58 118.74 3h8b h GLU 87 Ca 0.34 -0.12 -0.15 0.00 -0.13 0.00 0.00 59.36 59.30 3h8b h GLU 87 Cb -0.11 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 29.06 3h8b h GLU 87 CO -0.07 0.74 -0.70 0.66 -0.73 0.00 0.00 179.01 178.91 3h8b h SER 88 N 0.95 0.00 -2.58 1.04 4.64 -1.86 -3.39 113.55 112.35 3h8b h SER 88 Ca 0.24 0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 60.96 3h8b h SER 88 Cb 0.06 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 61.75 3h8b h SER 88 CO -0.04 0.70 -0.80 0.00 -0.87 0.00 0.00 176.83 175.82 3h8b n TYR 89 N -3.35 1.12 -1.64 4.77 4.19 -0.57 -4.98 117.16 116.70 3h8b n TYR 89 Ca 0.01 -3.79 -0.41 0.00 3.31 0.00 0.00 57.90 57.02 3h8b n TYR 89 Cb 0.78 -0.21 0.02 0.00 0.49 0.00 0.00 39.34 40.42 3h8b n TYR 89 CO 0.00 0.00 0.00 -2.30 0.91 0.00 0.00 176.86 175.47 3h8b n PRO 90 N 2.18 1.47 -2.68 2.98 -0.02 -1.10 -4.49 135.00 133.33 3h8b n PRO 90 Ca 0.25 0.53 -0.41 0.00 -2.02 0.00 0.00 63.50 61.85 3h8b n PRO 90 Cb 0.43 -2.15 -0.04 0.00 -0.02 0.00 0.00 33.50 31.71 3h8b n PRO 90 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 3h8b s TYR 91 N -1.28 3.77 0.00 6.00 5.04 -1.26 -4.71 117.35 124.91 3h8b s TYR 91 Ca 0.64 1.75 0.00 0.00 -2.44 0.00 0.00 57.07 57.02 3h8b s TYR 91 Cb -0.53 -3.11 0.00 0.00 0.35 0.00 0.00 41.96 38.68 3h8b s TYR 91 CO 0.56 0.01 0.32 0.39 -1.34 0.00 0.00 175.55 175.49 3h8b n GLU 92 N 2.65 0.58 -3.50 4.97 1.02 -1.26 -5.02 120.64 120.08 3h8b n GLU 92 Ca 0.02 -0.32 -0.25 0.00 -0.02 0.00 0.00 57.16 56.59 3h8b n GLU 92 Cb 0.48 -0.80 0.04 0.00 -0.02 0.00 0.00 31.44 31.14 3h8b n GLU 92 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3h8b n ALA 93 N -0.17 -1.18 -3.62 0.62 0.00 -1.26 -4.96 120.51 109.94 3h8b n ALA 93 Ca 0.00 0.29 -0.08 0.00 0.00 0.00 0.00 53.44 53.65 3h8b n ALA 93 Cb 0.04 -4.53 -0.06 0.00 0.00 0.00 0.00 19.45 14.90 3h8b n ALA 93 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 3h8b s THR 94 N -3.23 0.00 0.29 0.00 -1.32 -1.26 -4.67 115.64 105.44 3h8b s THR 94 Ca 0.51 0.00 -0.29 0.00 -1.21 0.00 0.00 61.69 60.71 3h8b s THR 94 Cb -0.24 -1.00 -0.09 0.00 -1.51 0.00 0.00 72.50 69.66 3h8b s THR 94 CO 0.63 0.00 1.08 -0.70 -2.21 0.00 0.00 174.62 173.42 3h8b s GLU 95 N -0.50 4.60 0.19 7.08 2.12 -1.26 -4.96 118.70 125.97 3h8b s GLU 95 Ca 0.03 1.74 0.04 0.00 0.36 0.00 0.00 54.97 57.15 3h8b s GLU 95 Cb -0.03 -3.11 -0.02 0.00 0.26 0.00 0.00 34.13 31.23 3h8b s GLU 95 CO -0.05 0.19 0.17 0.39 -0.54 0.00 0.00 175.26 175.42 3h8b n GLU 96 N 1.05 0.25 -2.27 4.30 -0.58 -1.26 -5.08 120.64 117.05 3h8b n GLU 96 Ca -0.00 -1.94 -0.38 0.00 -0.42 0.00 0.00 57.16 54.42 3h8b n GLU 96 Cb 0.46 1.60 -0.02 0.00 -0.57 0.00 0.00 31.44 32.91 3h8b n GLU 96 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 3h8b s SER 97 N -2.36 6.45 -0.27 1.62 1.04 -1.26 -4.59 113.70 114.34 3h8b s SER 97 Ca 0.23 2.36 -0.28 0.00 0.48 0.00 0.00 55.95 58.74 3h8b s SER 97 Cb 0.01 -2.61 -0.03 0.00 0.10 0.00 0.00 66.02 63.48 3h8b s SER 97 CO 0.16 -0.72 1.97 0.00 0.98 0.00 0.00 173.24 175.63 3h8b n LYS 99 N 8.51 2.31 -1.69 0.00 5.02 -1.26 -5.04 118.16 126.01 3h8b n LYS 99 Ca 0.26 -3.07 -0.44 0.00 -2.02 0.00 0.00 58.31 53.04 3h8b n LYS 99 Cb 0.46 -1.90 -0.03 0.00 -0.02 0.00 0.00 35.03 33.53 3h8b n LYS 99 CO 0.00 0.00 0.00 0.98 -0.52 0.00 0.00 177.40 177.86 3h8b n TYR 100 N -0.90 2.54 -3.92 2.13 9.36 -1.26 -4.99 117.16 120.11 3h8b n TYR 100 Ca 0.34 -0.03 -0.29 0.00 3.32 0.00 0.00 57.90 61.24 3h8b n TYR 100 Cb 1.11 -2.68 -0.16 0.00 -0.63 0.00 0.00 39.34 36.98 3h8b n TYR 100 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 3h8b s ASN 101 N 2.38 3.26 0.00 2.98 3.84 -1.26 -5.01 114.94 121.12 3h8b s ASN 101 Ca 0.82 -0.87 0.00 0.00 0.21 0.00 0.00 52.86 53.02 3h8b s ASN 101 Cb -0.55 -1.05 0.00 0.00 -0.55 0.00 0.00 41.25 39.10 3h8b s ASN 101 CO 0.39 -0.19 0.80 -0.81 -2.79 0.00 0.00 177.10 174.49 3h8b n PRO 102 N 4.78 0.00 0.18 0.43 -0.04 -1.26 -1.48 135.00 137.61 3h8b n PRO 102 Ca -0.13 0.32 0.09 0.00 -0.04 0.00 0.00 63.50 63.74 3h8b n PRO 102 Cb 0.46 -1.59 0.10 0.00 -0.04 0.00 0.00 33.50 32.43 3h8b n PRO 102 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 3h8b h LYS 103 N 0.00 0.00 -0.32 0.54 3.64 -2.01 -3.24 116.57 115.18 3h8b h LYS 103 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3h8b h LYS 103 Cb 0.18 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.00 3h8b h LYS 103 CO 0.00 0.16 0.00 0.66 -2.27 0.00 0.00 179.45 178.00 3h8b n TYR 104 N -3.08 0.73 -2.40 1.91 4.01 -0.55 -4.99 117.16 112.80 3h8b n TYR 104 Ca 0.02 -0.67 -0.42 0.00 -0.16 0.00 0.00 57.90 56.67 3h8b n TYR 104 Cb 0.61 -0.17 -0.03 0.00 -0.31 0.00 0.00 39.34 39.44 3h8b n TYR 104 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 3h8b s SER 105 N -1.41 7.00 0.00 7.72 0.15 -1.23 -2.11 113.70 123.83 3h8b s SER 105 Ca 0.33 1.89 0.04 0.00 0.70 0.00 0.00 55.95 58.91 3h8b s SER 105 Cb 0.23 -2.56 0.04 0.00 -1.71 0.00 0.00 66.02 62.02 3h8b s SER 105 CO 0.13 -0.61 0.65 1.33 1.20 0.00 0.00 173.24 175.94 3h8b n VAL 106 N 4.61 0.06 -3.86 4.45 0.24 -0.47 -4.92 118.33 118.43 3h8b n VAL 106 Ca 0.11 -0.53 -0.09 0.00 -2.04 0.00 0.00 64.34 61.79 3h8b n VAL 106 Cb 0.46 1.05 -0.05 0.00 -1.47 0.00 0.00 33.84 33.83 3h8b n VAL 106 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3h8b s ALA 107 N -0.37 -0.61 0.15 2.33 0.00 -1.21 -5.02 121.76 117.04 3h8b s ALA 107 Ca 0.05 -0.52 -0.25 0.00 0.00 0.00 0.00 51.96 51.24 3h8b s ALA 107 Cb 0.03 0.91 0.06 0.00 0.00 0.00 0.00 23.12 24.13 3h8b s ALA 107 CO 0.05 -0.81 0.89 1.21 0.00 0.00 0.00 175.76 177.10 3h8b s ASN 108 N -2.93 -0.24 0.16 0.00 3.04 -1.26 -1.12 114.94 112.59 3h8b s ASN 108 Ca 0.14 -0.36 -0.10 0.00 0.04 0.00 0.00 52.86 52.58 3h8b s ASN 108 Cb -0.01 0.52 -0.00 0.00 -1.54 0.00 0.00 41.25 40.22 3h8b s ASN 108 CO 0.02 -0.95 0.31 1.51 -3.04 0.00 0.00 177.10 174.95 3h8b s ASP 109 N -2.87 0.00 -0.41 -4.21 1.47 -1.26 -4.70 116.67 104.70 3h8b s ASP 109 Ca 0.10 -0.79 0.05 0.00 1.18 0.00 0.00 52.55 53.09 3h8b s ASP 109 Cb -0.02 0.45 0.45 0.00 -0.34 0.00 0.00 42.92 43.45 3h8b s ASP 109 CO 0.01 -0.90 1.36 1.07 0.68 0.00 0.00 175.17 177.39 3h8b n THR 110 N -0.22 2.74 0.00 2.11 5.66 0.18 -4.30 114.28 120.46 3h8b n THR 110 Ca -0.09 -4.12 0.00 0.00 -3.05 0.00 0.00 64.05 56.79 3h8b n THR 110 Cb 0.63 -1.17 0.00 0.00 -1.55 0.00 0.00 70.33 68.24 3h8b n THR 110 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3h8b n GLY 111 N -0.70 0.18 3.62 1.09 0.00 -1.26 -4.86 105.19 103.25 3h8b n GLY 111 Ca 0.47 -2.06 -0.08 0.00 0.00 0.00 0.00 46.02 44.35 3h8b n GLY 111 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3h8b s PHE 112 N 0.00 -0.31 -0.11 1.61 -0.71 -1.26 -2.42 117.98 114.78 3h8b s PHE 112 Ca 0.00 0.04 0.03 0.00 -1.04 0.00 0.00 56.93 55.96 3h8b s PHE 112 Cb 0.00 0.61 0.00 0.00 -1.21 0.00 0.00 43.02 42.42 3h8b s PHE 112 CO 0.00 -0.84 -0.22 0.08 -1.34 0.00 0.00 175.22 172.90 3h8b s VAL 113 N -3.49 2.20 -0.26 -2.49 1.01 -0.13 -4.87 120.40 112.37 3h8b s VAL 113 Ca 0.07 -0.96 -0.14 0.00 0.00 0.00 0.00 61.98 60.95 3h8b s VAL 113 Cb -0.02 -1.86 -0.04 0.00 0.00 0.00 0.00 36.38 34.46 3h8b s VAL 113 CO -0.04 0.55 0.34 -1.81 0.00 0.00 0.00 175.10 174.15 3h8b s ASP 114 N 0.47 6.24 0.33 3.32 1.01 -1.26 -2.10 116.67 124.68 3h8b s ASP 114 Ca -0.15 0.28 -0.26 0.00 0.71 0.00 0.00 52.55 53.13 3h8b s ASP 114 Cb -0.17 -2.20 -0.10 0.00 1.01 0.00 0.00 42.92 41.46 3h8b s ASP 114 CO 0.06 -0.14 0.95 -0.63 0.21 0.00 0.00 175.17 175.62 3h8b s ILE 115 N 1.86 4.19 0.30 0.77 -1.09 0.13 -5.00 121.20 122.36 3h8b s ILE 115 Ca 0.14 1.80 -0.29 0.00 -2.23 0.00 0.00 60.65 60.07 3h8b s ILE 115 Cb -0.15 -3.99 -0.12 0.00 -1.58 0.00 0.00 42.46 36.61 3h8b s ILE 115 CO 0.09 0.13 1.40 -2.65 -1.23 0.00 0.00 174.94 172.68 3h8b n PRO 116 N 0.52 2.25 -0.41 2.79 -0.02 -1.26 -4.61 135.00 134.27 3h8b n PRO 116 Ca 0.02 0.79 -0.06 0.00 -2.02 0.00 0.00 63.50 62.23 3h8b n PRO 116 Cb 0.50 -2.45 -0.06 0.00 -0.02 0.00 0.00 33.50 31.47 3h8b n PRO 116 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 3h8b n LYS 117 N 1.27 0.88 -4.23 -0.52 5.02 -1.26 -4.53 118.16 114.79 3h8b n LYS 117 Ca 0.07 -0.50 -0.17 0.00 -2.02 0.00 0.00 58.31 55.70 3h8b n LYS 117 Cb 0.35 -1.78 -0.14 0.00 -0.02 0.00 0.00 35.03 33.44 3h8b n LYS 117 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 3h8b s GLN 118 N 2.45 0.57 0.26 1.97 1.11 -1.25 -4.68 119.66 120.08 3h8b s GLN 118 Ca 0.26 -0.34 -0.03 0.00 0.01 0.00 0.00 55.36 55.27 3h8b s GLN 118 Cb 0.12 -0.53 0.39 0.00 -1.01 0.00 0.00 33.01 31.98 3h8b s GLN 118 CO -0.00 0.14 1.88 0.93 0.01 0.00 0.00 175.29 178.24 3h8b h GLU 119 N 5.74 1.11 -0.76 2.91 5.08 -1.87 -0.67 114.58 126.11 3h8b h GLU 119 Ca -0.30 -0.07 0.10 0.00 -1.00 0.00 0.00 59.36 58.09 3h8b h GLU 119 Cb 1.19 -0.25 -0.07 0.00 0.50 0.00 0.00 28.75 30.11 3h8b h GLU 119 CO 0.48 0.73 0.40 -0.22 -1.00 0.00 0.00 179.01 179.41 3h8b h LYS 120 N 1.14 0.65 -0.33 2.33 3.11 -1.96 0.16 116.57 121.67 3h8b h LYS 120 Ca 0.42 -0.04 -0.16 0.00 -2.81 0.00 0.00 60.65 58.06 3h8b h LYS 120 Cb 0.16 -0.15 -0.01 0.00 -1.00 0.00 0.00 32.23 31.24 3h8b h LYS 120 CO -0.17 0.43 -0.44 0.00 -2.81 0.00 0.00 179.45 176.46 3h8b h ALA 121 N 1.45 0.60 0.17 5.00 0.00 -1.60 -2.83 119.26 122.06 3h8b h ALA 121 Ca 0.38 -0.47 0.01 0.00 0.00 0.00 0.00 54.91 54.83 3h8b h ALA 121 Cb 0.39 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 3h8b h ALA 121 CO -0.27 0.68 -0.26 1.25 0.00 0.00 0.00 179.25 180.65 3h8b h LEU 122 N 0.68 -0.71 -0.61 0.00 5.85 0.35 -1.93 115.31 118.93 3h8b h LEU 122 Ca 0.04 0.08 0.13 0.00 0.84 0.00 0.00 57.88 58.97 3h8b h LEU 122 Cb 1.02 0.26 -0.10 0.00 0.37 0.00 0.00 40.66 42.20 3h8b h LEU 122 CO 0.10 -0.35 0.02 -0.03 -0.34 0.00 0.00 178.44 177.83 3h8b h MET 123 N -0.49 0.13 -0.88 1.25 4.05 -0.75 -0.79 114.93 117.45 3h8b h MET 123 Ca 0.02 -0.01 -0.02 0.00 -0.28 0.00 0.00 59.70 59.41 3h8b h MET 123 Cb 0.49 -0.03 -0.04 0.00 -0.80 0.00 0.00 31.60 31.22 3h8b h MET 123 CO -0.11 0.09 0.47 0.87 0.23 0.00 0.00 176.91 178.46 3h8b h LYS 124 N 0.13 1.23 -0.34 0.39 1.57 -1.23 -0.71 116.57 117.62 3h8b h LYS 124 Ca 0.32 -0.15 -0.09 0.00 -1.87 0.00 0.00 60.65 58.86 3h8b h LYS 124 Cb 0.52 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.58 3h8b h LYS 124 CO -0.51 0.90 -0.15 0.00 -0.57 0.00 0.00 179.45 179.12 3h8b h ALA 125 N 1.29 0.47 -0.56 3.86 0.00 -0.49 -0.77 119.26 123.06 3h8b h ALA 125 Ca 0.31 -0.34 -0.09 0.00 0.00 0.00 0.00 54.91 54.79 3h8b h ALA 125 Cb 0.04 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 3h8b h ALA 125 CO -0.05 0.38 -0.01 0.28 0.00 0.00 0.00 179.25 179.84 3h8b h VAL 126 N 0.47 1.26 -0.37 0.00 2.07 -0.99 0.31 116.25 119.00 3h8b h VAL 126 Ca 0.08 -1.13 -0.11 0.00 0.82 0.00 0.00 66.70 66.36 3h8b h VAL 126 Cb 0.68 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 31.27 3h8b h VAL 126 CO 0.05 0.40 -0.22 0.00 0.02 0.00 0.00 177.57 177.82 3h8b h ALA 127 N 1.08 0.93 0.00 1.67 0.00 -1.02 -3.18 119.26 118.75 3h8b h ALA 127 Ca 0.16 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.71 3h8b h ALA 127 Cb 0.54 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.18 3h8b h ALA 127 CO 0.03 0.62 -1.69 0.25 0.00 0.00 0.00 179.25 178.45 3h8b n THR 128 N -4.12 0.00 -0.11 0.00 -2.24 -0.30 -4.76 114.28 102.74 3h8b n THR 128 Ca 0.00 -0.37 -0.21 0.00 -2.27 0.00 0.00 64.05 61.20 3h8b n THR 128 Cb 0.42 0.19 -0.09 0.00 -2.10 0.00 0.00 70.33 68.75 3h8b n THR 128 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 3h8b n VAL 129 N -2.03 1.26 0.00 2.28 0.31 0.11 -5.07 118.33 115.19 3h8b n VAL 129 Ca -0.03 -0.38 0.00 0.00 -0.01 0.00 0.00 64.34 63.93 3h8b n VAL 129 Cb 0.43 -1.61 0.00 0.00 -0.91 0.00 0.00 33.84 31.75 3h8b n VAL 129 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3h8b n GLY 130 N 1.88 0.83 3.71 2.92 0.00 -1.20 -4.88 105.19 108.45 3h8b n GLY 130 Ca -0.43 -2.02 -0.43 0.00 0.00 0.00 0.00 46.02 43.14 3h8b n GLY 130 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3h8b n PRO 131 N 0.00 2.43 -4.72 1.61 -0.02 -1.26 -4.35 135.00 128.69 3h8b n PRO 131 Ca 0.00 0.87 -0.33 0.00 -2.02 0.00 0.00 63.50 62.02 3h8b n PRO 131 Cb 0.00 -2.61 -0.14 0.00 -0.02 0.00 0.00 33.50 30.74 3h8b n PRO 131 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3h8b s ILE 132 N 0.11 3.24 0.10 4.25 -1.09 -0.20 -4.72 121.20 122.88 3h8b s ILE 132 Ca 0.67 -0.61 -0.30 0.00 -2.23 0.00 0.00 60.65 58.18 3h8b s ILE 132 Cb -0.56 -2.36 -0.06 0.00 -1.58 0.00 0.00 42.46 37.90 3h8b s ILE 132 CO 0.47 0.53 1.14 -0.44 -1.23 0.00 0.00 174.94 175.42 3h8b s SER 133 N 0.13 7.17 0.21 3.58 0.01 0.12 -0.69 113.70 124.23 3h8b s SER 133 Ca -0.05 2.01 -0.04 0.00 1.31 0.00 0.00 55.95 59.18 3h8b s SER 133 Cb -0.15 -2.59 -0.03 0.00 0.21 0.00 0.00 66.02 63.47 3h8b s SER 133 CO 0.04 -0.36 0.21 0.68 0.41 0.00 0.00 173.24 174.22 3h8b s VAL 134 N 0.59 0.00 -0.03 3.43 -7.23 -0.79 -1.02 120.40 115.35 3h8b s VAL 134 Ca 0.55 -1.86 0.05 0.00 -1.81 0.00 0.00 61.98 58.91 3h8b s VAL 134 Cb -0.29 -2.42 -0.01 0.00 0.56 0.00 0.00 36.38 34.23 3h8b s VAL 134 CO 0.31 -0.01 -0.20 0.00 -0.31 0.00 0.00 175.10 174.89 3h8b s ALA 135 N -4.12 1.70 0.13 1.32 0.00 -1.23 -0.96 121.76 118.60 3h8b s ALA 135 Ca 0.35 -0.83 0.02 0.00 0.00 0.00 0.00 51.96 51.50 3h8b s ALA 135 Cb 0.05 -0.50 -0.04 0.00 0.00 0.00 0.00 23.12 22.63 3h8b s ALA 135 CO 0.11 0.36 -0.05 0.42 0.00 0.00 0.00 175.76 176.60 3h8b s ILE 136 N -0.23 0.79 -0.81 0.00 1.09 -0.29 -3.83 121.20 117.92 3h8b s ILE 136 Ca 0.01 -1.98 -0.25 0.00 -1.10 0.00 0.00 60.65 57.33 3h8b s ILE 136 Cb -0.10 -1.86 0.04 0.00 -1.06 0.00 0.00 42.46 39.48 3h8b s ILE 136 CO 0.01 -0.72 1.30 -0.62 -0.10 0.00 0.00 174.94 174.81 3h8b s ASP 137 N -3.11 6.26 -0.29 3.58 2.15 -0.54 -1.64 116.67 123.08 3h8b s ASP 137 Ca 0.17 -0.80 0.11 0.00 0.43 0.00 0.00 52.55 52.46 3h8b s ASP 137 Cb 0.05 -2.55 0.72 0.00 -0.30 0.00 0.00 42.92 40.84 3h8b s ASP 137 CO -0.01 -1.70 1.74 0.00 -0.17 0.00 0.00 175.17 175.02 3h8b n ALA 138 N 9.06 4.29 -0.68 3.66 0.00 -1.26 -4.77 120.51 130.81 3h8b n ALA 138 Ca 0.11 -2.35 -0.05 0.00 0.00 0.00 0.00 53.44 51.15 3h8b n ALA 138 Cb 0.49 -1.13 -0.04 0.00 0.00 0.00 0.00 19.45 18.77 3h8b n ALA 138 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h8b n GLY 139 N -0.17 2.82 3.14 0.00 0.00 -1.26 -4.82 105.19 104.89 3h8b n GLY 139 Ca 0.37 -0.43 -0.11 0.00 0.00 0.00 0.00 46.02 45.84 3h8b n GLY 139 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3h8b s HIS 140 N 0.01 0.05 0.29 1.61 3.76 -1.26 -5.04 115.29 114.71 3h8b s HIS 140 Ca 0.20 -0.20 -0.01 0.00 -0.15 0.00 0.00 55.06 54.89 3h8b s HIS 140 Cb 0.11 -0.05 0.46 0.00 1.11 0.00 0.00 32.58 34.21 3h8b s HIS 140 CO -0.01 -0.35 1.93 0.93 -0.85 0.00 0.00 174.74 176.40 3h8b h GLU 141 N 3.91 1.08 -0.31 1.40 5.08 -2.01 -1.98 114.58 121.76 3h8b h GLU 141 Ca -0.31 -0.07 0.04 0.00 -1.00 0.00 0.00 59.36 58.02 3h8b h GLU 141 Cb 1.19 -0.24 -0.02 0.00 0.50 0.00 0.00 28.75 30.18 3h8b h GLU 141 CO 0.44 0.72 0.21 0.66 -1.00 0.00 0.00 179.01 180.04 3h8b h SER 142 N 1.12 0.21 -0.06 1.42 4.64 -1.96 -1.83 113.55 117.08 3h8b h SER 142 Ca 0.36 -0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.45 3h8b h SER 142 Cb 0.03 -0.05 0.01 0.00 -0.31 0.00 0.00 62.40 62.08 3h8b h SER 142 CO -0.11 0.15 -0.80 0.15 -0.87 0.00 0.00 176.83 175.34 3h8b h PHE 143 N 0.25 0.98 -0.55 4.77 3.57 -1.69 -2.41 116.94 121.87 3h8b h PHE 143 Ca 0.13 -0.45 -0.03 0.00 3.53 0.00 0.00 57.97 61.15 3h8b h PHE 143 Cb 0.21 -0.15 -0.03 0.00 2.79 0.00 0.00 35.95 38.78 3h8b h PHE 143 CO -0.00 1.27 0.21 1.25 -2.23 0.00 0.00 178.31 178.81 3h8b h LEU 144 N 0.48 0.72 -2.04 0.59 5.85 -1.27 -2.86 115.31 116.78 3h8b h LEU 144 Ca -0.06 -0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.57 3h8b h LEU 144 Cb 1.43 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 42.27 3h8b h LEU 144 CO 0.16 0.65 0.00 0.49 -0.34 0.00 0.00 178.44 179.40 3h8b n PHE 145 N -4.33 0.65 -1.77 1.25 3.72 -0.75 -4.95 117.46 111.28 3h8b n PHE 145 Ca 0.04 -0.32 -0.41 0.00 -0.05 0.00 0.00 57.45 56.71 3h8b n PHE 145 Cb 0.16 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.69 3h8b n PHE 145 CO 0.00 0.00 0.00 -0.47 -0.05 0.00 0.00 176.76 176.24 3h8b s TYR 146 N -1.35 2.71 0.00 1.38 5.04 -0.91 -4.90 117.35 119.31 3h8b s TYR 146 Ca 0.38 0.83 0.00 0.00 -2.44 0.00 0.00 57.07 55.84 3h8b s TYR 146 Cb 0.20 -4.08 0.00 0.00 0.35 0.00 0.00 41.96 38.44 3h8b s TYR 146 CO 0.27 -3.54 0.00 1.63 -1.34 0.00 0.00 175.55 172.57 3h8b n LYS 147 N 1.89 0.00 -3.71 4.97 4.01 -1.26 -1.66 118.16 122.40 3h8b n LYS 147 Ca 0.07 0.00 -0.09 0.00 -0.51 0.00 0.00 58.31 57.78 3h8b n LYS 147 Cb 0.38 -0.51 -0.02 0.00 -0.51 0.00 0.00 35.03 34.37 3h8b n LYS 147 CO 0.00 0.00 0.00 -1.83 -1.11 0.00 0.00 177.40 174.46 3h8b s GLU 148 N -1.98 1.60 0.27 1.97 4.04 -1.26 -2.89 118.70 120.45 3h8b s GLU 148 Ca 0.00 -0.81 0.00 0.00 0.04 0.00 0.00 54.97 54.20 3h8b s GLU 148 Cb 0.00 0.60 0.00 0.00 0.02 0.00 0.00 34.13 34.75 3h8b s GLU 148 CO 0.00 -0.72 0.00 0.41 -1.84 0.00 0.00 175.26 173.11 3h8b n GLY 149 N -0.43 -2.51 3.65 -3.83 0.00 -1.26 -4.86 105.19 95.96 3h8b n GLY 149 Ca -0.09 -1.81 -0.42 0.00 0.00 0.00 0.00 46.02 43.71 3h8b n GLY 149 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h8b s ILE 150 N -0.40 4.85 -0.13 -0.61 1.01 -1.26 -4.04 121.20 120.61 3h8b s ILE 150 Ca 0.00 1.55 -0.29 0.00 0.00 0.00 0.00 60.65 61.90 3h8b s ILE 150 Cb 0.00 -4.11 -0.01 0.00 0.01 0.00 0.00 42.46 38.35 3h8b s ILE 150 CO 0.00 -0.05 1.05 -0.47 0.00 0.00 0.00 174.94 175.47 3h8b s TYR 151 N 2.73 3.40 -0.13 3.97 5.04 0.10 -4.87 117.35 127.59 3h8b s TYR 151 Ca 0.35 1.49 -0.04 0.00 -2.44 0.00 0.00 57.07 56.43 3h8b s TYR 151 Cb -0.15 -3.25 0.06 0.00 0.35 0.00 0.00 41.96 38.96 3h8b s TYR 151 CO 0.08 -0.49 0.14 0.12 -1.34 0.00 0.00 175.55 174.06 3h8b s PHE 152 N 2.37 -0.07 -0.34 4.97 5.36 -1.26 -1.75 117.98 127.26 3h8b s PHE 152 Ca 0.49 0.21 -0.05 0.00 -0.96 0.00 0.00 56.93 56.62 3h8b s PHE 152 Cb -0.18 -0.43 0.05 0.00 -0.34 0.00 0.00 43.02 42.11 3h8b s PHE 152 CO 0.16 -0.41 0.09 -2.00 -1.46 0.00 0.00 175.22 171.60 3h8b s GLU 153 N 2.24 2.50 0.63 10.12 2.56 -1.26 -4.98 118.70 130.51 3h8b s GLU 153 Ca 0.04 -1.29 0.26 0.00 0.00 0.00 0.00 54.97 53.99 3h8b s GLU 153 Cb -0.14 -3.40 1.35 0.00 2.00 0.00 0.00 34.13 33.94 3h8b s GLU 153 CO -0.08 -0.71 1.77 -1.35 -0.56 0.00 0.00 175.26 174.33 3h8b h PRO 154 N 8.15 0.00 -0.71 4.30 0.11 -2.05 0.75 132.00 142.55 3h8b h PRO 154 Ca -0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.89 3h8b h PRO 154 Cb 1.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.18 3h8b h PRO 154 CO 0.60 0.00 0.00 -3.47 -0.21 0.00 0.00 178.00 174.92 3h8b n ASP 155 N -3.24 4.26 -4.76 -2.05 2.03 -1.26 -4.99 116.55 106.54 3h8b n ASP 155 Ca 0.05 -2.16 -0.31 0.00 0.52 0.00 0.00 54.79 52.88 3h8b n ASP 155 Cb 0.66 -0.52 0.09 0.00 -0.72 0.00 0.00 41.12 40.63 3h8b n ASP 155 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3h8b s SER 157 N -3.20 1.96 -0.13 0.00 0.15 -1.26 -4.80 113.70 106.42 3h8b s SER 157 Ca 0.63 -0.89 0.15 0.00 0.70 0.00 0.00 55.95 56.53 3h8b s SER 157 Cb -0.18 -0.05 0.44 0.00 -1.71 0.00 0.00 66.02 64.51 3h8b s SER 157 CO 0.53 -0.21 1.34 -1.54 1.20 0.00 0.00 173.24 174.56 3h8b n SER 158 N 0.21 3.44 0.00 5.45 3.41 -1.26 -3.12 113.62 121.75 3h8b n SER 158 Ca -0.13 -2.79 0.00 0.00 -0.26 0.00 0.00 58.87 55.68 3h8b n SER 158 Cb 0.58 -0.45 0.00 0.00 -0.26 0.00 0.00 64.21 64.09 3h8b n SER 158 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3h8b n GLU 159 N -0.43 4.02 -1.71 4.33 1.02 -1.26 -4.58 120.64 122.02 3h8b n GLU 159 Ca 0.18 0.00 -0.16 0.00 -0.02 0.00 0.00 57.16 57.16 3h8b n GLU 159 Cb 0.75 -0.30 0.07 0.00 -0.02 0.00 0.00 31.44 31.93 3h8b n GLU 159 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 3h8b n ASP 160 N -0.59 4.02 -4.64 1.62 5.75 -1.26 -5.06 116.55 116.39 3h8b n ASP 160 Ca 0.00 -3.71 -0.49 0.00 -0.01 0.00 0.00 54.79 50.58 3h8b n ASP 160 Cb 0.00 -0.39 -0.05 0.00 -1.03 0.00 0.00 41.12 39.65 3h8b n ASP 160 CO 0.00 0.00 0.00 0.23 -0.11 0.00 0.00 177.20 177.32 3h8b n MET 161 N -0.79 1.68 0.00 0.11 2.81 -1.26 -4.76 117.12 114.91 3h8b n MET 161 Ca 0.36 0.61 0.00 0.00 -1.81 0.00 0.00 57.70 56.86 3h8b n MET 161 Cb 0.90 -2.32 0.00 0.00 -0.71 0.00 0.00 33.22 31.09 3h8b n MET 161 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 3h8b n ASP 162 N 3.38 0.99 -3.81 7.83 5.75 -0.77 -4.88 116.55 125.04 3h8b n ASP 162 Ca 0.18 -1.26 -0.23 0.00 -0.01 0.00 0.00 54.79 53.47 3h8b n ASP 162 Cb 0.24 0.00 -0.17 0.00 -1.03 0.00 0.00 41.12 40.16 3h8b n ASP 162 CO 0.00 0.00 0.00 -2.28 -0.11 0.00 0.00 177.20 174.81 3h8b s HIS 163 N -0.26 0.80 -0.02 2.11 5.04 -0.65 -4.92 115.29 117.39 3h8b s HIS 163 Ca 0.00 -0.26 -0.23 0.00 -1.54 0.00 0.00 55.06 53.03 3h8b s HIS 163 Cb 0.00 -0.85 -0.05 0.00 0.04 0.00 0.00 32.58 31.73 3h8b s HIS 163 CO 0.00 -0.34 0.67 0.20 -2.34 0.00 0.00 174.74 172.94 3h8b s GLY 164 N 1.79 2.65 0.00 1.59 0.00 -1.26 -1.13 107.32 110.96 3h8b s GLY 164 Ca 0.03 0.13 0.00 0.00 0.00 0.00 0.00 44.72 44.87 3h8b s GLY 164 CO -0.05 1.00 0.00 3.33 0.00 0.00 0.00 173.10 177.38 3h8b n VAL 165 N 3.17 0.00 -3.88 1.40 0.24 -0.13 -4.61 118.33 114.52 3h8b n VAL 165 Ca -0.04 0.00 -0.24 0.00 -2.04 0.00 0.00 64.34 62.03 3h8b n VAL 165 Cb 0.51 0.00 -0.17 0.00 -1.47 0.00 0.00 33.84 32.71 3h8b n VAL 165 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 3h8b s LEU 166 N 0.00 0.88 -0.23 1.34 2.96 -0.79 -1.89 118.68 120.95 3h8b s LEU 166 Ca 0.00 -0.16 -0.25 0.00 -0.22 0.00 0.00 54.13 53.51 3h8b s LEU 166 Cb 0.00 -0.56 -0.01 0.00 0.50 0.00 0.00 46.19 46.12 3h8b s LEU 166 CO 0.00 -0.15 0.83 -0.69 -1.32 0.00 0.00 176.35 175.02 3h8b s VAL 167 N 1.72 4.84 -1.62 1.68 1.01 0.13 0.12 120.40 128.28 3h8b s VAL 167 Ca 0.02 1.58 0.13 0.00 0.00 0.00 0.00 61.98 63.72 3h8b s VAL 167 Cb -0.13 -4.12 0.13 0.00 0.00 0.00 0.00 36.38 32.26 3h8b s VAL 167 CO -0.05 -0.06 0.96 1.33 0.00 0.00 0.00 175.10 177.27 3h8b n VAL 168 N 5.20 0.09 -3.59 2.92 0.24 0.28 -1.04 118.33 122.43 3h8b n VAL 168 Ca 0.06 -0.54 0.00 0.00 -2.04 0.00 0.00 64.34 61.81 3h8b n VAL 168 Cb 0.48 1.21 0.00 0.00 -1.47 0.00 0.00 33.84 34.06 3h8b n VAL 168 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3h8b n GLY 169 N 0.75 -1.11 3.56 7.63 0.00 -1.20 -1.06 105.19 113.76 3h8b n GLY 169 Ca 0.08 -1.01 -0.09 0.00 0.00 0.00 0.00 46.02 45.00 3h8b n GLY 169 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3h8b s TYR 170 N -3.00 -0.36 0.00 1.61 -0.85 0.44 -0.33 117.35 114.86 3h8b s TYR 170 Ca 0.00 0.13 0.00 0.00 -0.52 0.00 0.00 57.07 56.68 3h8b s TYR 170 Cb 0.00 0.58 0.00 0.00 0.38 0.00 0.00 41.96 42.92 3h8b s TYR 170 CO 0.00 -0.79 0.00 0.41 -1.52 0.00 0.00 175.55 173.65 3h8b n GLY 171 N -0.36 1.18 3.36 5.49 0.00 -0.74 -0.26 105.19 113.86 3h8b n GLY 171 Ca -0.11 -0.45 -0.10 0.00 0.00 0.00 0.00 46.02 45.37 3h8b n GLY 171 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3h8b s PHE 172 N -1.58 -0.01 0.06 1.61 -0.71 -1.26 -1.62 117.98 114.46 3h8b s PHE 172 Ca 0.00 -0.34 0.04 0.00 -1.04 0.00 0.00 56.93 55.60 3h8b s PHE 172 Cb 0.00 0.19 -0.04 0.00 -1.21 0.00 0.00 43.02 41.96 3h8b s PHE 172 CO 0.00 -0.74 -0.02 -1.21 -1.34 0.00 0.00 175.22 171.91 3h8b s GLU 173 N -3.86 2.54 0.00 1.99 2.02 -1.26 -4.99 118.70 115.13 3h8b s GLU 173 Ca 0.08 -0.81 -0.00 0.00 0.02 0.00 0.00 54.97 54.26 3h8b s GLU 173 Cb 0.02 -2.53 -0.00 0.00 0.10 0.00 0.00 34.13 31.72 3h8b s GLU 173 CO -0.07 0.56 0.45 0.43 0.02 0.00 0.00 175.26 176.65 3h8b n SER 174 N 0.87 0.12 0.00 -0.19 7.64 -1.26 -4.90 113.62 115.90 3h8b n SER 174 Ca -0.12 -1.41 0.00 0.00 1.01 0.00 0.00 58.87 58.34 3h8b n SER 174 Cb 0.52 -0.03 0.00 0.00 -1.01 0.00 0.00 64.21 63.69 3h8b n SER 174 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 3h8b n ASN 180 N 2.77 0.00 -4.86 6.43 6.94 -1.26 -5.30 115.26 119.97 3h8b n ASN 180 Ca 0.01 0.00 -0.35 0.00 -0.02 0.00 0.00 54.58 54.22 3h8b n ASN 180 Cb 0.02 0.00 -0.05 0.00 -2.36 0.00 0.00 39.78 37.38 3h8b n ASN 180 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 3h8b s LYS 181 N 0.00 3.78 0.06 -3.83 1.02 -1.26 -4.31 119.74 115.20 3h8b s LYS 181 Ca 0.00 0.21 -0.08 0.00 0.02 0.00 0.00 55.97 56.12 3h8b s LYS 181 Cb 0.00 -3.01 -0.01 0.00 -0.52 0.00 0.00 37.83 34.30 3h8b s LYS 181 CO 0.00 0.56 0.15 1.52 -0.92 0.00 0.00 175.35 176.66 3h8b s TYR 182 N -1.38 0.17 -0.11 3.18 -0.85 -0.64 -0.72 117.35 117.00 3h8b s TYR 182 Ca 0.33 -0.52 -0.13 0.00 -0.52 0.00 0.00 57.07 56.23 3h8b s TYR 182 Cb -0.14 -0.10 -0.05 0.00 0.38 0.00 0.00 41.96 42.05 3h8b s TYR 182 CO 0.18 -0.46 0.31 -1.58 -1.52 0.00 0.00 175.55 172.48 3h8b s TRP 183 N -3.21 3.56 -0.43 -3.49 0.52 0.17 -1.80 118.94 114.26 3h8b s TRP 183 Ca 0.00 0.71 -0.22 0.00 0.02 0.00 0.00 56.10 56.61 3h8b s TRP 183 Cb 0.02 -2.27 0.02 0.00 -1.15 0.00 0.00 33.47 30.09 3h8b s TRP 183 CO -0.07 0.43 0.74 -1.17 0.02 0.00 0.00 176.95 176.89 3h8b s LEU 184 N -0.19 4.29 -0.13 2.99 0.20 0.55 -1.11 118.68 125.29 3h8b s LEU 184 Ca 0.19 -0.10 0.01 0.00 0.69 0.00 0.00 54.13 54.92 3h8b s LEU 184 Cb -0.14 -2.90 -0.01 0.00 -0.43 0.00 0.00 46.19 42.71 3h8b s LEU 184 CO 0.07 -0.84 -0.17 -0.69 -0.29 0.00 0.00 176.35 174.43 3h8b s VAL 185 N 3.13 2.67 -0.27 1.68 1.01 0.11 -0.55 120.40 128.17 3h8b s VAL 185 Ca 0.28 -0.79 -0.21 0.00 0.00 0.00 0.00 61.98 61.26 3h8b s VAL 185 Cb -0.13 -2.10 -0.01 0.00 0.00 0.00 0.00 36.38 34.14 3h8b s VAL 185 CO 0.21 0.53 0.65 -0.75 0.00 0.00 0.00 175.10 175.74 3h8b s LYS 186 N 0.45 4.06 0.46 2.72 2.20 0.12 -0.64 119.74 129.10 3h8b s LYS 186 Ca -0.12 0.52 0.07 0.00 -0.36 0.00 0.00 55.97 56.08 3h8b s LYS 186 Cb -0.16 -3.67 0.02 0.00 -1.51 0.00 0.00 37.83 32.51 3h8b s LYS 186 CO 0.05 -0.47 0.63 1.21 -0.36 0.00 0.00 175.35 176.41 3h8b s ASN 187 N 1.51 5.54 -0.37 1.43 2.47 -0.52 -1.88 114.94 123.12 3h8b s ASN 187 Ca 0.27 -0.39 0.07 0.00 0.42 0.00 0.00 52.86 53.23 3h8b s ASN 187 Cb -0.15 -0.61 0.44 0.00 -1.45 0.00 0.00 41.25 39.48 3h8b s ASN 187 CO 0.09 -0.88 1.14 -1.54 -3.72 0.00 0.00 177.10 172.19 3h8b n SER 188 N -1.97 4.57 -0.74 -4.21 3.41 -1.26 -4.54 113.62 108.88 3h8b n SER 188 Ca 0.09 -3.64 0.04 0.00 -0.26 0.00 0.00 58.87 55.10 3h8b n SER 188 Cb 0.59 -0.41 0.20 0.00 -0.26 0.00 0.00 64.21 64.33 3h8b n SER 188 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 3h8b n TRP 189 N -0.56 0.61 0.00 7.33 8.01 -1.20 -0.49 117.44 131.14 3h8b n TRP 189 Ca 0.39 -1.25 0.00 0.00 -1.31 0.00 0.00 57.50 55.32 3h8b n TRP 189 Cb 0.80 -0.33 0.00 0.00 -2.01 0.00 0.00 31.31 29.77 3h8b n TRP 189 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3h8b n GLY 190 N -1.04 -1.55 0.33 6.99 0.00 -0.20 -4.42 105.19 105.30 3h8b n GLY 190 Ca 0.24 -1.54 0.14 0.00 0.00 0.00 0.00 46.02 44.86 3h8b n GLY 190 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 3h8b n GLU 191 N -1.78 1.37 0.02 1.61 0.28 -1.26 -3.66 120.64 117.22 3h8b n GLU 191 Ca 0.00 -0.66 0.12 0.00 -0.16 0.00 0.00 57.16 56.46 3h8b n GLU 191 Cb 0.00 -1.49 0.23 0.00 1.43 0.00 0.00 31.44 31.62 3h8b n GLU 191 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 3h8b n GLU 192 N -0.23 0.12 -3.39 3.44 -0.58 -1.26 -3.64 120.64 115.09 3h8b n GLU 192 Ca 0.19 0.03 -0.36 0.00 -0.42 0.00 0.00 57.16 56.60 3h8b n GLU 192 Cb 0.30 -1.57 -0.06 0.00 -0.57 0.00 0.00 31.44 29.54 3h8b n GLU 192 CO 0.00 0.00 0.00 -0.46 -0.48 0.00 0.00 177.13 176.19 3h8b s TRP 193 N -3.07 3.67 0.00 -0.32 -0.00 -1.24 -4.92 118.94 113.06 3h8b s TRP 193 Ca 0.09 1.06 0.00 0.00 -0.00 0.00 0.00 56.10 57.25 3h8b s TRP 193 Cb 0.16 -2.36 0.00 0.00 -0.00 0.00 0.00 33.47 31.27 3h8b s TRP 193 CO 0.70 0.52 0.00 0.41 -0.00 0.00 0.00 176.95 178.58 3h8b n GLY 194 N 1.22 2.07 3.40 5.86 0.00 -0.67 -0.10 105.19 116.98 3h8b n GLY 194 Ca -0.08 -0.43 -0.45 0.00 0.00 0.00 0.00 46.02 45.05 3h8b n GLY 194 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3h8b s MET 195 N 0.00 3.83 -1.87 1.61 -1.94 -0.13 -4.35 119.30 116.44 3h8b s MET 195 Ca 0.00 -2.42 0.00 0.00 -1.71 0.00 0.00 55.69 51.56 3h8b s MET 195 Cb 0.00 -4.74 0.00 0.00 2.01 0.00 0.00 34.83 32.10 3h8b s MET 195 CO 0.00 -1.53 0.00 0.41 -0.01 0.00 0.00 175.02 173.89 3h8b n GLY 196 N 4.22 -0.06 0.23 -0.03 0.00 -1.25 -1.88 105.19 106.42 3h8b n GLY 196 Ca 0.24 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.26 3h8b n GLY 196 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h8b n GLY 197 N -0.91 0.48 3.67 -0.02 0.00 0.86 -4.58 105.19 104.70 3h8b n GLY 197 Ca -0.24 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.52 3h8b n GLY 197 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3h8b s TYR 198 N -2.14 2.85 0.01 1.61 1.51 -0.79 -1.44 117.35 118.97 3h8b s TYR 198 Ca 0.00 -0.14 0.03 0.00 -1.01 0.00 0.00 57.07 55.94 3h8b s TYR 198 Cb 0.00 -1.36 -0.01 0.00 -0.11 0.00 0.00 41.96 40.48 3h8b s TYR 198 CO 0.00 0.53 -0.08 0.54 -1.11 0.00 0.00 175.55 175.43 3h8b s VAL 199 N -1.83 0.63 -0.54 0.71 0.11 0.19 -0.96 120.40 118.71 3h8b s VAL 199 Ca 0.28 -0.61 -0.17 0.00 -2.93 0.00 0.00 61.98 58.56 3h8b s VAL 199 Cb -0.09 -0.58 0.10 0.00 -1.53 0.00 0.00 36.38 34.29 3h8b s VAL 199 CO 0.19 -0.01 0.56 -0.54 -3.33 0.00 0.00 175.10 171.97 3h8b s LYS 200 N -0.68 3.02 -0.03 1.54 1.02 -1.26 -0.72 119.74 122.64 3h8b s LYS 200 Ca -0.01 -1.44 -0.23 0.00 0.02 0.00 0.00 55.97 54.31 3h8b s LYS 200 Cb -0.05 -4.24 -0.04 0.00 -0.52 0.00 0.00 37.83 32.97 3h8b s LYS 200 CO 0.00 -1.34 0.70 -1.64 -0.92 0.00 0.00 175.35 172.15 3h8b s MET 201 N 2.06 4.43 0.07 1.68 -1.94 -0.27 0.02 119.30 125.35 3h8b s MET 201 Ca 0.07 0.90 -0.37 0.00 -1.71 0.00 0.00 55.69 54.58 3h8b s MET 201 Cb -0.26 -3.41 -0.18 0.00 2.01 0.00 0.00 34.83 32.99 3h8b s MET 201 CO 0.06 0.16 1.19 0.00 -0.01 0.00 0.00 175.02 176.41 3h8b n ALA 202 N 3.39 -1.98 -2.46 3.03 0.00 -0.72 0.44 120.51 122.21 3h8b n ALA 202 Ca -0.02 0.54 -0.30 0.00 0.00 0.00 0.00 53.44 53.65 3h8b n ALA 202 Cb 0.51 -1.94 -0.12 0.00 0.00 0.00 0.00 19.45 17.90 3h8b n ALA 202 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 3h8b s LYS 203 N 0.13 1.83 -1.41 0.00 2.20 0.11 -4.62 119.74 117.97 3h8b s LYS 203 Ca 0.84 -1.13 -0.08 0.00 -0.36 0.00 0.00 55.97 55.24 3h8b s LYS 203 Cb -1.05 -2.10 0.04 0.00 -1.51 0.00 0.00 37.83 33.21 3h8b s LYS 203 CO 0.52 0.50 0.91 -0.25 -0.36 0.00 0.00 175.35 176.66 3h8b n ASP 204 N 1.11 -3.55 -2.71 1.43 8.00 -1.26 -4.55 116.55 115.01 3h8b n ASP 204 Ca -0.16 -0.76 -0.22 0.00 0.71 0.00 0.00 54.79 54.37 3h8b n ASP 204 Cb 0.52 -4.16 -0.01 0.00 -0.02 0.00 0.00 41.12 37.46 3h8b n ASP 204 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3h8b n ARG 205 N -4.55 2.55 -3.46 -1.24 5.12 -1.26 -4.92 116.66 108.89 3h8b n ARG 205 Ca -0.10 -4.15 -0.20 0.00 -1.93 0.00 0.00 57.85 51.46 3h8b n ARG 205 Cb 0.59 -1.94 0.08 0.00 -1.16 0.00 0.00 32.46 30.02 3h8b n ARG 205 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 3h8b n ARG 206 N -0.24 -7.01 -3.59 5.56 1.74 -1.26 -2.88 116.66 108.98 3h8b n ARG 206 Ca 0.28 0.76 -0.21 0.00 -0.77 0.00 0.00 57.85 57.91 3h8b n ARG 206 Cb 0.64 -5.59 0.07 0.00 -1.02 0.00 0.00 32.46 26.56 3h8b n ARG 206 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 3h8b n ASN 207 N -2.70 -3.26 -4.59 0.55 5.15 -1.26 -4.84 115.26 104.31 3h8b n ASN 207 Ca -0.06 -0.66 -0.56 0.00 -0.60 0.00 0.00 54.58 52.70 3h8b n ASN 207 Cb 0.58 -4.72 -0.07 0.00 -0.53 0.00 0.00 39.78 35.04 3h8b n ASN 207 CO 0.00 0.00 0.00 1.57 1.40 0.00 0.00 177.26 180.23 3h8b n HIS 208 N -4.45 1.31 -1.66 1.20 -0.00 -1.14 -0.05 115.22 110.43 3h8b n HIS 208 Ca -0.18 0.79 -0.19 0.00 -0.00 0.00 0.00 57.72 58.15 3h8b n HIS 208 Cb 0.63 -2.26 -0.07 0.00 -0.00 0.00 0.00 29.99 28.28 3h8b n HIS 208 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 3h8b n GLY 210 N -0.43 1.79 0.51 0.00 0.00 0.93 -1.47 105.19 106.52 3h8b n GLY 210 Ca -0.20 -0.14 0.32 0.00 0.00 0.00 0.00 46.02 46.00 3h8b n GLY 210 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3h8b h ILE 211 N 0.00 0.31 -0.02 -0.61 2.04 -1.63 -0.33 117.51 117.28 3h8b h ILE 211 Ca -0.38 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.48 3h8b h ILE 211 Cb 1.20 0.38 0.00 0.00 -0.74 0.00 0.00 36.82 37.65 3h8b h ILE 211 CO 0.55 0.00 -0.46 0.00 0.00 0.00 0.00 178.15 178.24 3h8b n ALA 212 N -2.59 3.52 0.21 1.87 0.00 -1.26 -4.46 120.51 117.79 3h8b n ALA 212 Ca 0.22 -0.64 0.09 0.00 0.00 0.00 0.00 53.44 53.11 3h8b n ALA 212 Cb 1.19 -0.80 0.32 0.00 0.00 0.00 0.00 19.45 20.15 3h8b n ALA 212 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 3h8b h SER 213 N 2.49 0.00 -1.77 0.00 0.02 -1.32 -3.34 113.55 109.63 3h8b h SER 213 Ca 0.00 0.00 -0.47 0.00 -0.84 0.00 0.00 61.79 60.48 3h8b h SER 213 Cb 0.76 0.00 -0.40 0.00 0.14 0.00 0.00 62.40 62.90 3h8b h SER 213 CO 0.00 0.22 -1.10 0.00 -1.14 0.00 0.00 176.83 174.81 3h8b n ALA 214 N -2.18 2.86 -2.73 3.77 0.00 -1.26 -4.79 120.51 116.17 3h8b n ALA 214 Ca 0.01 -3.55 -0.37 0.00 0.00 0.00 0.00 53.44 49.53 3h8b n ALA 214 Cb 0.51 -0.89 -0.06 0.00 0.00 0.00 0.00 19.45 19.01 3h8b n ALA 214 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h8b s ALA 215 N -2.79 3.75 0.31 0.00 0.00 -1.26 -3.55 121.76 118.22 3h8b s ALA 215 Ca 0.38 -0.49 -0.19 0.00 0.00 0.00 0.00 51.96 51.66 3h8b s ALA 215 Cb 0.37 -2.19 0.03 0.00 0.00 0.00 0.00 23.12 21.34 3h8b s ALA 215 CO -0.06 0.43 0.76 -1.54 0.00 0.00 0.00 175.76 175.34 3h8b s SER 216 N -0.59 -0.16 0.11 0.00 1.04 -0.19 -0.70 113.70 113.21 3h8b s SER 216 Ca 0.17 -0.79 -0.21 0.00 0.48 0.00 0.00 55.95 55.60 3h8b s SER 216 Cb -0.13 0.76 0.05 0.00 0.10 0.00 0.00 66.02 66.80 3h8b s SER 216 CO 0.06 -1.45 0.51 -0.72 0.98 0.00 0.00 173.24 172.62 3h8b s TYR 217 N -3.32 -0.39 0.06 5.02 1.13 -0.89 -0.70 117.35 118.25 3h8b s TYR 217 Ca 0.13 0.23 -0.17 0.00 -1.41 0.00 0.00 57.07 55.84 3h8b s TYR 217 Cb -0.06 0.39 -0.06 0.00 -1.10 0.00 0.00 41.96 41.13 3h8b s TYR 217 CO 0.08 -0.73 0.52 -1.25 -2.51 0.00 0.00 175.55 171.66 3h8b s PRO 218 N -3.34 4.10 -0.18 -3.49 0.04 -1.26 -0.95 135.00 129.90 3h8b s PRO 218 Ca -0.00 0.62 -0.23 0.00 0.04 0.00 0.00 61.00 61.43 3h8b s PRO 218 Cb 0.00 -3.21 -0.02 0.00 0.04 0.00 0.00 34.50 31.31 3h8b s PRO 218 CO -0.09 0.64 0.71 0.95 0.04 0.00 0.00 177.00 179.25 3h8b s THR 219 N -1.13 4.97 0.00 1.26 -4.23 -1.01 -4.91 115.64 110.58 3h8b s THR 219 Ca 0.28 1.36 0.00 0.00 -1.18 0.00 0.00 61.69 62.15 3h8b s THR 219 Cb -0.18 -4.02 0.00 0.00 1.34 0.00 0.00 72.50 69.64 3h8b s THR 219 CO 0.17 0.08 0.47 1.33 -0.54 0.00 0.00 174.62 176.14