#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a8d h ASP 2 N 0.00 0.46 0.09 6.12 1.82 -2.05 -1.08 116.42 121.78 2a8d h ASP 2 Ca 0.00 0.02 -0.07 0.00 -0.39 0.00 0.00 57.03 56.59 2a8d h ASP 2 Cb 0.00 -0.07 -0.01 0.00 0.68 0.00 0.00 39.33 39.92 2a8d h ASP 2 CO 0.00 0.32 -0.22 0.11 -1.61 0.00 0.00 179.24 177.84 2a8d h LYS 3 N 0.58 0.23 -0.02 0.28 1.57 -2.05 0.88 116.57 118.04 2a8d h LYS 3 Ca 0.23 -0.07 -0.18 0.00 -1.87 0.00 0.00 60.65 58.76 2a8d h LYS 3 Cb 0.09 -0.02 0.01 0.00 0.08 0.00 0.00 32.23 32.39 2a8d h LYS 3 CO -0.13 0.44 -0.69 0.82 -0.57 0.00 0.00 179.45 179.31 2a8d h ILE 4 N 0.21 1.38 -0.55 1.86 1.08 -1.93 -2.01 117.51 117.55 2a8d h ILE 4 Ca 0.04 -2.08 -0.00 0.00 -0.39 0.00 0.00 64.86 62.42 2a8d h ILE 4 Cb 0.51 2.49 -0.03 0.00 -3.07 0.00 0.00 36.82 36.72 2a8d h ILE 4 CO 0.03 0.62 0.34 0.11 -0.69 0.00 0.00 178.15 178.57 2a8d h LYS 5 N 0.05 0.74 -0.95 2.37 1.57 -0.94 -1.24 116.57 118.17 2a8d h LYS 5 Ca -0.08 -0.06 0.02 0.00 -1.87 0.00 0.00 60.65 58.66 2a8d h LYS 5 Cb 1.38 -0.16 -0.05 0.00 0.08 0.00 0.00 32.23 33.48 2a8d h LYS 5 CO 0.14 0.52 0.62 0.37 -0.57 0.00 0.00 179.45 180.53 2a8d h GLN 6 N 0.75 1.20 -0.62 3.15 5.75 -0.84 -1.48 115.11 123.02 2a8d h GLN 6 Ca 0.20 -0.07 -0.00 0.00 -0.15 0.00 0.00 58.65 58.62 2a8d h GLN 6 Cb -0.04 -0.27 -0.03 0.00 1.07 0.00 0.00 27.48 28.21 2a8d h GLN 6 CO -0.04 0.80 0.37 1.25 -2.65 0.00 0.00 178.83 178.56 2a8d h LEU 7 N 1.24 0.75 -1.07 -2.39 6.46 -0.65 0.24 115.31 119.89 2a8d h LEU 7 Ca 0.37 -0.07 -0.09 0.00 -0.12 0.00 0.00 57.88 57.97 2a8d h LEU 7 Cb -0.07 -0.19 -0.01 0.00 -0.73 0.00 0.00 40.66 39.66 2a8d h LEU 7 CO -0.10 0.59 -0.28 -0.26 -0.62 0.00 0.00 178.44 177.78 2a8d h PHE 8 N 0.84 0.35 -0.51 1.25 0.04 -0.66 -1.61 116.94 116.64 2a8d h PHE 8 Ca 0.22 -0.07 -0.12 0.00 2.80 0.00 0.00 57.97 60.80 2a8d h PHE 8 Cb -0.01 -0.09 -0.01 0.00 2.20 0.00 0.00 35.95 38.04 2a8d h PHE 8 CO -0.02 0.57 -0.16 0.00 -0.60 0.00 0.00 178.31 178.10 2a8d h ALA 9 N 1.43 0.71 -0.34 2.45 0.00 -0.55 -0.79 119.26 122.17 2a8d h ALA 9 Ca 0.04 -0.37 -0.03 0.00 0.00 0.00 0.00 54.91 54.55 2a8d h ALA 9 Cb 0.64 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2a8d h ALA 9 CO 0.05 0.66 0.09 -0.91 0.00 0.00 0.00 179.25 179.14 2a8d h ASN 10 N 0.87 0.50 -0.55 0.00 2.35 -0.67 -1.31 115.58 116.77 2a8d h ASN 10 Ca 0.12 -0.22 -0.01 0.00 -0.55 0.00 0.00 56.30 55.65 2a8d h ASN 10 Cb 0.73 -0.13 -0.03 0.00 0.05 0.00 0.00 38.32 38.95 2a8d h ASN 10 CO 0.06 0.59 0.30 -1.13 -1.65 0.00 0.00 177.43 175.60 2a8d h ASN 11 N 0.39 0.69 -0.07 5.81 -0.73 -1.14 -0.01 115.58 120.51 2a8d h ASN 11 Ca 0.11 -0.09 -0.00 0.00 1.87 0.00 0.00 56.30 58.18 2a8d h ASN 11 Cb 0.27 -0.18 -0.00 0.00 0.27 0.00 0.00 38.32 38.69 2a8d h ASN 11 CO -0.00 0.58 0.03 0.22 -0.37 0.00 0.00 177.43 177.89 2a8d h TYR 12 N 0.74 0.11 -0.36 0.67 3.20 -1.03 0.29 116.97 120.59 2a8d h TYR 12 Ca 0.19 -0.01 0.06 0.00 3.14 0.00 0.00 58.73 62.12 2a8d h TYR 12 Cb 0.05 -0.03 -0.06 0.00 1.54 0.00 0.00 36.73 38.23 2a8d h TYR 12 CO -0.01 0.23 0.01 1.03 -1.64 0.00 0.00 178.16 177.78 2a8d h SER 13 N -0.04 -0.12 0.68 -2.11 0.87 -1.05 0.16 113.55 111.95 2a8d h SER 13 Ca 0.02 0.08 -0.03 0.00 -1.23 0.00 0.00 61.79 60.63 2a8d h SER 13 Cb 0.16 0.14 0.01 0.00 -0.44 0.00 0.00 62.40 62.26 2a8d h SER 13 CO -0.00 -0.02 -0.33 -0.25 -0.53 0.00 0.00 176.83 175.70 2a8d h TRP 14 N 0.12 -0.85 -0.42 2.24 7.01 -0.82 -1.13 115.95 122.10 2a8d h TRP 14 Ca 0.18 -0.02 0.03 0.00 2.11 0.00 0.00 58.89 61.19 2a8d h TRP 14 Cb 0.24 0.28 -0.02 0.00 -2.10 0.00 0.00 29.16 27.56 2a8d h TRP 14 CO -0.24 -0.50 0.28 0.00 -2.79 0.00 0.00 178.44 175.20 2a8d h ALA 15 N -0.92 1.84 -0.15 2.65 0.00 -0.85 -1.34 119.26 120.49 2a8d h ALA 15 Ca -0.09 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.68 2a8d h ALA 15 Cb 0.74 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2a8d h ALA 15 CO 0.15 0.11 -0.37 0.37 0.00 0.00 0.00 179.25 179.51 2a8d h GLN 16 N 0.45 0.52 -0.79 0.00 5.75 -0.65 -2.30 115.11 118.09 2a8d h GLN 16 Ca 0.17 -0.36 0.13 0.00 -0.15 0.00 0.00 58.65 58.44 2a8d h GLN 16 Cb 0.13 0.05 -0.09 0.00 1.07 0.00 0.00 27.48 28.65 2a8d h GLN 16 CO -0.04 0.97 0.39 -0.09 -2.65 0.00 0.00 178.83 177.41 2a8d h ARG 17 N 0.16 0.57 -0.37 1.69 2.43 -0.43 0.34 114.38 118.76 2a8d h ARG 17 Ca -0.00 -0.03 -0.08 0.00 -0.81 0.00 0.00 59.98 59.06 2a8d h ARG 17 Cb 0.98 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 30.38 2a8d h ARG 17 CO 0.08 0.38 -0.09 0.52 -1.51 0.00 0.00 179.97 179.35 2a8d h MET 18 N 0.59 0.63 0.21 0.20 2.86 -1.17 -1.63 114.93 116.63 2a8d h MET 18 Ca 0.42 -0.19 -0.01 0.00 -2.06 0.00 0.00 59.70 57.86 2a8d h MET 18 Cb 0.56 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 32.15 2a8d h MET 18 CO -0.34 0.72 -0.10 -0.22 1.06 0.00 0.00 176.91 178.03 2a8d h LYS 19 N 0.59 -0.28 0.00 1.72 3.64 -0.36 0.24 116.57 122.11 2a8d h LYS 19 Ca 0.11 0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.49 2a8d h LYS 19 Cb 0.51 0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 32.39 2a8d h LYS 19 CO 0.03 -0.18 -0.07 1.05 -2.27 0.00 0.00 179.45 178.01 2a8d h GLU 20 N -0.36 0.00 -0.01 1.90 4.11 -1.47 0.16 114.58 118.91 2a8d h GLU 20 Ca -0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.40 2a8d h GLU 20 Cb 0.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.47 2a8d h GLU 20 CO 0.05 0.07 0.00 -1.91 0.07 0.00 0.00 179.01 177.28 2a8d n GLU 21 N -3.78 1.08 -4.05 1.06 2.13 -0.61 -4.89 120.64 111.58 2a8d n GLU 21 Ca -0.02 -0.12 -0.31 0.00 0.66 0.00 0.00 57.16 57.37 2a8d n GLU 21 Cb 0.16 -1.44 -0.01 0.00 0.27 0.00 0.00 31.44 30.43 2a8d n GLU 21 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 2a8d n ASN 22 N -0.80 -2.84 -4.75 4.31 4.05 0.56 -4.91 115.26 110.89 2a8d n ASN 22 Ca 0.21 -0.94 -0.36 0.00 0.45 0.00 0.00 54.58 53.93 2a8d n ASN 22 Cb 0.12 -3.20 0.04 0.00 1.23 0.00 0.00 39.78 37.98 2a8d n ASN 22 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 177.26 173.66 2a8d s SER 23 N -3.62 5.00 0.00 1.20 0.15 0.04 -4.95 113.70 111.52 2a8d s SER 23 Ca 0.50 2.47 0.24 0.00 0.70 0.00 0.00 55.95 59.85 2a8d s SER 23 Cb -0.26 -2.61 0.29 0.00 -1.71 0.00 0.00 66.02 61.74 2a8d s SER 23 CO 0.89 -1.73 1.32 0.35 1.20 0.00 0.00 173.24 175.27 2a8d n THR 24 N -1.68 0.23 -0.21 6.45 -2.24 -1.26 -4.62 114.28 110.94 2a8d n THR 24 Ca 0.14 -0.61 -0.07 0.00 -2.27 0.00 0.00 64.05 61.24 2a8d n THR 24 Cb 0.49 1.27 -0.01 0.00 -2.10 0.00 0.00 70.33 69.98 2a8d n THR 24 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 2a8d h TYR 25 N 4.60 -1.12 0.00 4.78 3.20 -1.95 0.13 116.97 126.61 2a8d h TYR 25 Ca 0.00 0.08 -0.06 0.00 3.14 0.00 0.00 58.73 61.89 2a8d h TYR 25 Cb 0.99 0.58 -0.01 0.00 1.54 0.00 0.00 36.73 39.83 2a8d h TYR 25 CO 0.11 -0.40 -0.29 0.74 -1.64 0.00 0.00 178.16 176.67 2a8d h PHE 26 N -0.19 0.00 -0.08 -3.82 -1.00 -1.99 -0.62 116.94 109.23 2a8d h PHE 26 Ca 0.21 0.00 -0.23 0.00 2.81 0.00 0.00 57.97 60.76 2a8d h PHE 26 Cb 0.56 0.00 0.01 0.00 3.61 0.00 0.00 35.95 40.13 2a8d h PHE 26 CO -0.69 0.29 -0.87 0.87 -1.61 0.00 0.00 178.31 176.31 2a8d h LYS 27 N 0.00 0.69 -0.43 1.51 1.57 -1.46 -1.84 116.57 116.61 2a8d h LYS 27 Ca -0.00 -0.63 -0.13 0.00 -1.87 0.00 0.00 60.65 58.02 2a8d h LYS 27 Cb 0.59 0.15 -0.01 0.00 0.08 0.00 0.00 32.23 33.04 2a8d h LYS 27 CO 0.04 1.23 -0.25 0.93 -0.57 0.00 0.00 179.45 180.83 2a8d h GLU 28 N 0.44 0.89 0.23 3.15 5.08 -0.55 -2.12 114.58 121.69 2a8d h GLU 28 Ca -0.08 -0.38 0.00 0.00 -1.00 0.00 0.00 59.36 57.90 2a8d h GLU 28 Cb 1.50 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 30.71 2a8d h GLU 28 CO 0.17 1.03 -0.22 1.25 -1.00 0.00 0.00 179.01 180.24 2a8d h LEU 29 N 0.76 -0.59 -2.06 1.33 6.46 -1.07 -1.24 115.31 118.90 2a8d h LEU 29 Ca 0.10 0.06 0.11 0.00 -0.12 0.00 0.00 57.88 58.02 2a8d h LEU 29 Cb 0.80 0.20 -0.01 0.00 -0.73 0.00 0.00 40.66 40.92 2a8d h LEU 29 CO 0.07 -0.33 0.30 0.00 -0.62 0.00 0.00 178.44 177.86 2a8d h ALA 30 N 0.22 2.21 -0.36 1.25 0.00 -1.15 0.99 119.26 122.42 2a8d h ALA 30 Ca -0.00 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.76 2a8d h ALA 30 Cb 0.45 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 2a8d h ALA 30 CO -0.05 -0.49 -0.30 0.22 0.00 0.00 0.00 179.25 178.63 2a8d h ASP 31 N 0.00 0.80 -2.00 0.00 1.82 -0.55 -3.29 116.42 113.21 2a8d h ASP 31 Ca 0.17 -0.32 -0.77 0.00 -0.39 0.00 0.00 57.03 55.72 2a8d h ASP 31 Cb 0.78 -0.22 -0.20 0.00 0.68 0.00 0.00 39.33 40.36 2a8d h ASP 31 CO -0.00 1.05 1.53 1.41 -1.61 0.00 0.00 179.24 181.61 2a8d n HIS 32 N -4.08 2.88 -0.16 0.28 8.25 0.34 -4.80 115.22 117.93 2a8d n HIS 32 Ca -0.01 -2.78 -0.11 0.00 -0.26 0.00 0.00 57.72 54.56 2a8d n HIS 32 Cb 0.48 -1.72 -0.00 0.00 1.12 0.00 0.00 29.99 29.87 2a8d n HIS 32 CO 0.00 0.00 0.00 1.96 0.64 0.00 0.00 176.34 178.94 2a8d h GLN 33 N 5.74 1.00 -5.14 -0.41 1.08 -1.68 -3.43 115.11 112.26 2a8d h GLN 33 Ca 0.32 -0.43 -0.65 0.00 -1.45 0.00 0.00 58.65 56.44 2a8d h GLN 33 Cb 0.64 -0.03 -0.25 0.00 -0.05 0.00 0.00 27.48 27.80 2a8d h GLN 33 CO 1.49 1.10 -0.69 0.99 -0.95 0.00 0.00 178.83 180.77 2a8d s THR 34 N -4.67 3.67 0.72 -0.54 2.01 -1.26 -5.06 115.64 110.51 2a8d s THR 34 Ca -0.11 -0.41 -0.14 0.00 0.31 0.00 0.00 61.69 61.33 2a8d s THR 34 Cb 0.12 -2.64 0.03 0.00 0.01 0.00 0.00 72.50 70.02 2a8d s THR 34 CO 0.87 0.45 1.15 -2.84 -0.69 0.00 0.00 174.62 173.55 2a8d s PRO 35 N 0.95 2.33 0.00 4.92 0.02 -1.24 -4.85 135.00 137.13 2a8d s PRO 35 Ca 0.00 1.51 0.10 0.00 0.02 0.00 0.00 61.00 62.63 2a8d s PRO 35 Cb -0.15 -1.88 -0.02 0.00 0.02 0.00 0.00 34.50 32.47 2a8d s PRO 35 CO 0.01 -1.64 0.58 0.72 -0.33 0.00 0.00 177.00 176.34 2a8d n HIS 36 N -2.82 0.00 -4.05 6.54 8.25 0.03 -4.79 115.22 118.38 2a8d n HIS 36 Ca 0.11 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.44 2a8d n HIS 36 Cb 0.51 0.00 -0.13 0.00 1.12 0.00 0.00 29.99 31.49 2a8d n HIS 36 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 2a8d s TYR 37 N -1.46 0.41 -0.21 4.41 2.02 -1.04 -4.01 117.35 117.47 2a8d s TYR 37 Ca 0.07 -0.25 -0.06 0.00 -0.37 0.00 0.00 57.07 56.46 2a8d s TYR 37 Cb 0.08 -0.26 -0.03 0.00 -0.40 0.00 0.00 41.96 41.35 2a8d s TYR 37 CO 0.28 -0.05 0.03 -1.17 -1.57 0.00 0.00 175.55 173.07 2a8d s LEU 38 N -0.69 3.43 -0.19 -1.29 2.96 -0.45 -0.31 118.68 122.15 2a8d s LEU 38 Ca -0.04 -0.14 -0.02 0.00 -0.22 0.00 0.00 54.13 53.72 2a8d s LEU 38 Cb -0.05 -1.88 -0.00 0.00 0.50 0.00 0.00 46.19 44.76 2a8d s LEU 38 CO -0.00 0.07 -0.11 0.86 -1.32 0.00 0.00 176.35 175.85 2a8d s TRP 39 N 0.98 2.87 -0.40 5.38 -0.11 0.94 -0.27 118.94 128.33 2a8d s TRP 39 Ca 0.03 -1.05 -0.03 0.00 1.22 0.00 0.00 56.10 56.26 2a8d s TRP 39 Cb -0.14 -1.99 0.10 0.00 -1.50 0.00 0.00 33.47 29.95 2a8d s TRP 39 CO 0.02 -0.53 0.20 0.42 -4.62 0.00 0.00 176.95 172.44 2a8d s ILE 40 N 1.13 3.36 0.26 5.86 1.01 0.41 -0.96 121.20 132.28 2a8d s ILE 40 Ca 0.01 -1.96 0.00 0.00 0.00 0.00 0.00 60.65 58.70 2a8d s ILE 40 Cb -0.14 -3.26 -0.00 0.00 0.01 0.00 0.00 42.46 39.06 2a8d s ILE 40 CO -0.03 -0.64 0.00 0.61 0.00 0.00 0.00 174.94 174.88 2a8d n GLY 41 N 4.63 3.86 3.86 6.18 0.00 -0.68 -1.21 105.19 121.84 2a8d n GLY 41 Ca -0.04 -2.29 -0.32 0.00 0.00 0.00 0.00 46.02 43.37 2a8d n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a8d h SER 43 N 2.53 0.00 -0.92 0.00 0.02 -1.59 -1.40 113.55 112.20 2a8d h SER 43 Ca -0.47 0.00 0.19 0.00 -0.84 0.00 0.00 61.79 60.67 2a8d h SER 43 Cb 1.17 0.00 -0.08 0.00 0.14 0.00 0.00 62.40 63.64 2a8d h SER 43 CO 0.68 0.02 0.60 0.44 -1.14 0.00 0.00 176.83 177.42 2a8d h ASP 44 N 0.00 0.52 -7.02 3.07 3.32 -1.93 -3.46 116.42 110.93 2a8d h ASP 44 Ca -0.00 0.05 -0.61 0.00 0.02 0.00 0.00 57.03 56.49 2a8d h ASP 44 Cb 0.04 -0.04 -0.12 0.00 0.22 0.00 0.00 39.33 39.43 2a8d h ASP 44 CO 0.00 0.21 -0.99 -0.24 -1.72 0.00 0.00 179.24 176.50 2a8d n SER 45 N -4.57 -1.40 0.35 6.45 2.88 -0.53 -4.89 113.62 111.92 2a8d n SER 45 Ca 0.20 -1.29 -0.14 0.00 -1.33 0.00 0.00 58.87 56.31 2a8d n SER 45 Cb 0.64 -1.64 -0.06 0.00 -0.75 0.00 0.00 64.21 62.39 2a8d n SER 45 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 2a8d h ARG 46 N -2.20 -0.86 -4.76 -1.46 2.47 -1.88 -3.38 114.38 102.31 2a8d h ARG 46 Ca -0.69 0.06 -0.68 0.00 -1.26 0.00 0.00 59.98 57.41 2a8d h ARG 46 Cb 1.40 0.19 -0.29 0.00 -1.65 0.00 0.00 29.97 29.63 2a8d h ARG 46 CO 0.62 -0.57 -0.64 0.08 0.56 0.00 0.00 179.97 180.02 2a8d s VAL 47 N -4.82 3.65 0.52 2.04 1.01 -1.26 -5.08 120.40 116.46 2a8d s VAL 47 Ca -0.13 -0.98 -0.20 0.00 0.00 0.00 0.00 61.98 60.68 2a8d s VAL 47 Cb 0.01 -2.97 -0.09 0.00 0.00 0.00 0.00 36.38 33.33 2a8d s VAL 47 CO 0.39 -0.02 0.67 -2.65 0.00 0.00 0.00 175.10 173.49 2a8d n PRO 48 N 4.79 0.71 -0.02 2.72 -0.02 -1.26 -4.74 135.00 137.17 2a8d n PRO 48 Ca -0.14 0.27 0.03 0.00 -2.02 0.00 0.00 63.50 61.64 2a8d n PRO 48 Cb 0.46 -1.79 0.40 0.00 -0.02 0.00 0.00 33.50 32.55 2a8d n PRO 48 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2a8d h ALA 49 N 0.57 1.65 -0.36 3.55 0.00 -1.98 -1.75 119.26 120.95 2a8d h ALA 49 Ca -0.45 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.35 2a8d h ALA 49 Cb 1.38 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 2a8d h ALA 49 CO 0.50 0.31 -0.04 0.93 0.00 0.00 0.00 179.25 180.94 2a8d h GLU 50 N 0.60 0.58 -0.07 0.00 3.07 -1.97 -1.10 114.58 115.69 2a8d h GLU 50 Ca 0.16 -0.15 -0.16 0.00 -0.50 0.00 0.00 59.36 58.71 2a8d h GLU 50 Cb -0.03 -0.07 0.01 0.00 -0.84 0.00 0.00 28.75 27.81 2a8d h GLU 50 CO -0.03 0.64 -0.57 -0.22 -1.40 0.00 0.00 179.01 177.43 2a8d h LYS 51 N 0.55 0.51 -0.32 2.33 1.63 -1.72 0.27 116.57 119.83 2a8d h LYS 51 Ca 0.11 -0.46 -0.08 0.00 -0.85 0.00 0.00 60.65 59.37 2a8d h LYS 51 Cb 0.42 0.11 -0.02 0.00 -0.60 0.00 0.00 32.23 32.14 2a8d h LYS 51 CO 0.02 1.09 -0.14 -0.07 -3.45 0.00 0.00 179.45 176.90 2a8d h LEU 52 N 0.10 0.54 0.00 5.20 3.38 -1.17 -3.28 115.31 120.08 2a8d h LEU 52 Ca -0.05 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.77 2a8d h LEU 52 Cb 1.23 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.84 2a8d h LEU 52 CO 0.12 0.71 -1.33 0.35 0.09 0.00 0.00 178.44 178.37 2a8d n THR 53 N -4.18 0.00 -4.06 0.22 -2.24 -0.43 -4.99 114.28 98.60 2a8d n THR 53 Ca 0.01 -0.27 -0.29 0.00 -2.27 0.00 0.00 64.05 61.22 2a8d n THR 53 Cb 0.35 0.48 -0.03 0.00 -2.10 0.00 0.00 70.33 69.03 2a8d n THR 53 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2a8d n ASN 54 N -1.78 -1.19 -4.92 3.42 4.05 0.08 -4.94 115.26 109.99 2a8d n ASN 54 Ca -0.01 -1.02 -0.27 0.00 0.45 0.00 0.00 54.58 53.73 2a8d n ASN 54 Cb 0.35 -2.89 0.05 0.00 1.23 0.00 0.00 39.78 38.52 2a8d n ASN 54 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 2a8d s LEU 55 N -7.09 2.95 0.16 1.20 1.43 -1.25 -5.03 118.68 111.05 2a8d s LEU 55 Ca 0.23 0.67 -0.30 0.00 -1.03 0.00 0.00 54.13 53.70 2a8d s LEU 55 Cb -0.13 -3.39 -0.08 0.00 0.03 0.00 0.00 46.19 42.63 2a8d s LEU 55 CO 0.91 -1.40 1.28 -1.61 0.23 0.00 0.00 176.35 175.76 2a8d s GLU 56 N -5.20 4.41 0.29 1.70 8.01 -1.26 -4.93 118.70 121.73 2a8d s GLU 56 Ca 0.58 1.97 -0.28 0.00 0.01 0.00 0.00 54.97 57.24 2a8d s GLU 56 Cb -0.11 -3.24 -0.14 0.00 -4.31 0.00 0.00 34.13 26.34 2a8d s GLU 56 CO 0.46 -0.24 1.08 -0.35 0.01 0.00 0.00 175.26 176.22 2a8d n PRO 57 N 3.00 1.52 0.00 0.39 -0.04 -1.26 -1.59 135.00 137.02 2a8d n PRO 57 Ca 0.07 0.53 0.00 0.00 -0.04 0.00 0.00 63.50 64.06 2a8d n PRO 57 Cb 0.44 -1.96 0.00 0.00 -0.04 0.00 0.00 33.50 31.94 2a8d n PRO 57 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2a8d n GLY 58 N 1.20 1.57 0.22 0.55 0.00 -1.26 -4.66 105.19 102.80 2a8d n GLY 58 Ca 0.09 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.25 2a8d n GLY 58 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2a8d h GLU 59 N 2.96 0.00 -5.69 1.61 4.39 -1.57 -3.30 114.58 112.99 2a8d h GLU 59 Ca 0.00 0.00 -0.66 0.00 0.34 0.00 0.00 59.36 59.04 2a8d h GLU 59 Cb 0.00 0.00 -0.13 0.00 -0.10 0.00 0.00 28.75 28.52 2a8d h GLU 59 CO 0.00 0.00 -0.56 -0.51 -1.16 0.00 0.00 179.01 176.78 2a8d s LEU 60 N -5.72 3.91 -0.19 1.33 1.43 -1.26 -0.79 118.68 117.39 2a8d s LEU 60 Ca 0.05 0.24 -0.05 0.00 -1.03 0.00 0.00 54.13 53.33 2a8d s LEU 60 Cb 0.08 -1.94 -0.03 0.00 0.03 0.00 0.00 46.19 44.34 2a8d s LEU 60 CO 0.57 0.34 0.01 0.12 0.23 0.00 0.00 176.35 177.61 2a8d s PHE 61 N -0.63 3.07 0.03 0.29 5.36 0.58 -4.88 117.98 121.80 2a8d s PHE 61 Ca 0.11 -0.35 0.08 0.00 -0.96 0.00 0.00 56.93 55.81 2a8d s PHE 61 Cb -0.12 -2.07 -0.02 0.00 -0.34 0.00 0.00 43.02 40.47 2a8d s PHE 61 CO 0.02 -0.15 -0.23 0.08 -1.46 0.00 0.00 175.22 173.48 2a8d s VAL 62 N 0.83 1.82 -0.02 3.12 1.01 -1.26 -0.04 120.40 125.86 2a8d s VAL 62 Ca 0.01 -1.19 0.01 0.00 0.00 0.00 0.00 61.98 60.81 2a8d s VAL 62 Cb -0.14 -1.56 0.01 0.00 0.00 0.00 0.00 36.38 34.69 2a8d s VAL 62 CO 0.02 0.32 -0.04 -2.28 0.00 0.00 0.00 175.10 173.12 2a8d s HIS 63 N -0.73 0.54 -0.02 5.22 2.46 -0.13 -4.97 115.29 117.65 2a8d s HIS 63 Ca 0.09 -0.11 0.02 0.00 0.47 0.00 0.00 55.06 55.53 2a8d s HIS 63 Cb -0.09 -0.44 0.01 0.00 -0.13 0.00 0.00 32.58 31.92 2a8d s HIS 63 CO 0.01 -0.09 -0.06 1.03 -2.47 0.00 0.00 174.74 173.16 2a8d s ARG 64 N 0.41 0.70 0.24 2.88 0.52 -1.26 -1.69 118.95 120.75 2a8d s ARG 64 Ca -0.05 -0.20 -0.06 0.00 -0.52 0.00 0.00 55.73 54.90 2a8d s ARG 64 Cb -0.08 -0.69 -0.02 0.00 0.52 0.00 0.00 34.95 34.68 2a8d s ARG 64 CO -0.00 0.06 0.33 0.54 0.02 0.00 0.00 175.30 176.24 2a8d s ASN 65 N 0.28 0.14 -0.18 0.23 2.20 -1.07 -4.73 114.94 111.81 2a8d s ASN 65 Ca -0.03 -1.19 -0.29 0.00 -0.94 0.00 0.00 52.86 50.40 2a8d s ASN 65 Cb -0.08 0.51 -0.04 0.00 -2.00 0.00 0.00 41.25 39.64 2a8d s ASN 65 CO 0.00 -1.03 1.73 -0.69 -2.94 0.00 0.00 177.10 174.17 2a8d s VAL 66 N -3.98 3.53 -0.37 3.54 1.01 -1.26 -1.60 120.40 121.27 2a8d s VAL 66 Ca 0.31 0.61 0.00 0.00 0.00 0.00 0.00 61.98 62.89 2a8d s VAL 66 Cb 0.03 -3.53 0.00 0.00 0.00 0.00 0.00 36.38 32.87 2a8d s VAL 66 CO 0.12 -0.21 0.00 0.00 0.00 0.00 0.00 175.10 175.01 2a8d n ALA 67 N 8.62 -0.09 -3.85 5.51 0.00 -1.26 -4.33 120.51 125.11 2a8d n ALA 67 Ca 0.20 0.05 -0.32 0.00 0.00 0.00 0.00 53.44 53.37 2a8d n ALA 67 Cb 0.45 -0.81 0.01 0.00 0.00 0.00 0.00 19.45 19.10 2a8d n ALA 67 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2a8d n ASN 68 N 1.30 -3.55 -4.94 0.00 6.94 -0.96 -4.94 115.26 109.12 2a8d n ASN 68 Ca -0.04 -0.97 -0.27 0.00 -0.02 0.00 0.00 54.58 53.28 2a8d n ASN 68 Cb 0.36 -1.29 -0.03 0.00 -2.36 0.00 0.00 39.78 36.46 2a8d n ASN 68 CO 0.00 0.00 0.00 -1.10 -1.03 0.00 0.00 177.26 175.13 2a8d s GLN 69 N -6.05 3.44 -0.50 -3.83 -0.21 -1.26 -4.92 119.66 106.33 2a8d s GLN 69 Ca 0.25 -0.57 0.03 0.00 0.02 0.00 0.00 55.36 55.10 2a8d s GLN 69 Cb -0.14 -2.98 0.13 0.00 1.00 0.00 0.00 33.01 31.02 2a8d s GLN 69 CO 0.77 0.54 0.26 0.08 -2.12 0.00 0.00 175.29 174.82 2a8d s VAL 70 N -1.70 2.21 0.01 1.09 1.01 -1.26 -4.95 120.40 116.81 2a8d s VAL 70 Ca 0.35 -3.10 -0.26 0.00 0.00 0.00 0.00 61.98 58.97 2a8d s VAL 70 Cb -0.11 -2.54 -0.05 0.00 0.00 0.00 0.00 36.38 33.68 2a8d s VAL 70 CO 0.28 -0.84 0.79 -0.63 0.00 0.00 0.00 175.10 174.71 2a8d s ILE 71 N -0.11 4.82 0.33 2.22 1.01 -1.26 -4.69 121.20 123.52 2a8d s ILE 71 Ca 0.17 1.67 0.11 0.00 0.00 0.00 0.00 60.65 62.61 2a8d s ILE 71 Cb -0.25 -4.14 0.36 0.00 0.01 0.00 0.00 42.46 38.44 2a8d s ILE 71 CO -0.00 0.30 1.61 0.45 0.00 0.00 0.00 174.94 177.30 2a8d h HIS 72 N 6.09 0.52 -0.32 3.97 3.86 -1.99 -1.83 115.15 125.46 2a8d h HIS 72 Ca -0.43 0.05 -0.16 0.00 -1.16 0.00 0.00 60.37 58.67 2a8d h HIS 72 Cb 1.21 -0.07 -0.10 0.00 1.06 0.00 0.00 27.41 29.51 2a8d h HIS 72 CO 0.65 -0.36 -0.11 0.25 0.86 0.00 0.00 177.93 179.22 2a8d n THR 73 N -5.28 2.52 -3.00 2.45 -2.24 -1.26 -4.96 114.28 102.52 2a8d n THR 73 Ca 0.30 -2.76 -0.43 0.00 -2.27 0.00 0.00 64.05 58.88 2a8d n THR 73 Cb 0.98 -0.31 -0.05 0.00 -2.10 0.00 0.00 70.33 68.84 2a8d n THR 73 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2a8d s ASP 74 N -2.58 6.28 0.35 3.42 2.15 -0.69 -4.91 116.67 120.69 2a8d s ASP 74 Ca 0.44 -0.63 0.04 0.00 0.43 0.00 0.00 52.55 52.82 2a8d s ASP 74 Cb 0.40 -2.36 0.67 0.00 -0.30 0.00 0.00 42.92 41.33 2a8d s ASP 74 CO -0.01 -1.06 1.98 0.15 -0.17 0.00 0.00 175.17 176.07 2a8d h PHE 75 N 9.15 0.81 0.80 -5.34 3.57 -1.92 -1.38 116.94 122.63 2a8d h PHE 75 Ca -0.27 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.21 2a8d h PHE 75 Cb 1.08 -0.27 0.01 0.00 2.79 0.00 0.00 35.95 39.56 2a8d h PHE 75 CO 0.83 0.47 -0.39 -0.97 -2.23 0.00 0.00 178.31 176.02 2a8d h ASN 76 N 0.84 -0.92 -0.55 0.41 -0.73 -1.98 -0.45 115.58 112.20 2a8d h ASN 76 Ca 0.28 0.03 -0.03 0.00 1.87 0.00 0.00 56.30 58.46 2a8d h ASN 76 Cb 0.08 0.24 -0.02 0.00 0.27 0.00 0.00 38.32 38.88 2a8d h ASN 76 CO -0.08 -0.64 0.25 0.00 -0.37 0.00 0.00 177.43 176.58 2a8d h LEU 78 N 0.75 0.69 -0.79 0.00 3.38 -1.28 -0.26 115.31 117.80 2a8d h LEU 78 Ca 0.19 -0.03 -0.09 0.00 0.09 0.00 0.00 57.88 58.04 2a8d h LEU 78 Cb 0.16 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 2a8d h LEU 78 CO -0.02 0.53 -0.04 0.28 0.09 0.00 0.00 178.44 179.28 2a8d h SER 79 N 0.81 0.85 -0.29 -0.43 0.02 -0.69 0.23 113.55 114.06 2a8d h SER 79 Ca 0.21 -0.23 -0.04 0.00 -0.84 0.00 0.00 61.79 60.89 2a8d h SER 79 Cb -0.04 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.26 2a8d h SER 79 CO -0.04 0.94 0.03 0.58 -1.14 0.00 0.00 176.83 177.20 2a8d h VAL 80 N 0.80 1.24 0.22 2.27 2.07 -0.90 -1.52 116.25 120.43 2a8d h VAL 80 Ca 0.14 -0.84 -0.01 0.00 0.82 0.00 0.00 66.70 66.81 2a8d h VAL 80 Cb 0.53 1.24 0.00 0.00 -1.52 0.00 0.00 31.29 31.54 2a8d h VAL 80 CO 0.03 0.27 -0.11 0.58 0.02 0.00 0.00 177.57 178.37 2a8d h VAL 81 N 0.29 0.80 -0.82 2.57 2.07 -0.74 -0.60 116.25 119.82 2a8d h VAL 81 Ca 0.09 -0.07 -0.00 0.00 0.82 0.00 0.00 66.70 67.53 2a8d h VAL 81 Cb 0.37 0.84 -0.04 0.00 -1.52 0.00 0.00 31.29 30.94 2a8d h VAL 81 CO 0.01 0.02 0.51 -0.61 0.02 0.00 0.00 177.57 177.51 2a8d h GLN 82 N -0.33 1.11 -0.05 1.57 -0.00 -0.53 0.11 115.11 116.99 2a8d h GLN 82 Ca -0.03 -0.09 -0.01 0.00 -0.00 0.00 0.00 58.65 58.52 2a8d h GLN 82 Cb 0.25 -0.24 -0.00 0.00 0.00 0.00 0.00 27.48 27.49 2a8d h GLN 82 CO 0.05 0.77 -0.02 -0.92 0.00 0.00 0.00 178.83 178.71 2a8d h TYR 83 N 1.13 0.12 -0.46 3.99 3.20 -1.17 0.68 116.97 124.45 2a8d h TYR 83 Ca 0.30 -0.03 0.04 0.00 3.14 0.00 0.00 58.73 62.18 2a8d h TYR 83 Cb -0.07 -0.03 -0.04 0.00 1.54 0.00 0.00 36.73 38.14 2a8d h TYR 83 CO 0.00 0.47 0.23 0.00 -1.64 0.00 0.00 178.16 177.22 2a8d h ALA 84 N 0.63 0.58 0.01 1.82 0.00 -0.73 0.49 119.26 122.07 2a8d h ALA 84 Ca 0.01 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 2a8d h ALA 84 Cb 0.43 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.17 2a8d h ALA 84 CO 0.01 -0.13 -0.01 0.28 0.00 0.00 0.00 179.25 179.40 2a8d h VAL 85 N 0.45 1.51 0.10 0.00 2.07 -0.80 0.07 116.25 119.66 2a8d h VAL 85 Ca 0.20 -1.96 -0.27 0.00 0.82 0.00 0.00 66.70 65.49 2a8d h VAL 85 Cb 0.12 2.78 0.01 0.00 -1.52 0.00 0.00 31.29 32.67 2a8d h VAL 85 CO -0.15 0.48 -1.18 0.44 0.02 0.00 0.00 177.57 177.19 2a8d h ASP 86 N -0.91 0.48 0.00 0.57 3.32 -0.93 -3.13 116.42 115.81 2a8d h ASP 86 Ca -0.00 -0.47 -0.43 0.00 0.02 0.00 0.00 57.03 56.14 2a8d h ASP 86 Cb 0.80 -0.15 -0.07 0.00 0.22 0.00 0.00 39.33 40.13 2a8d h ASP 86 CO 0.00 1.34 -2.51 0.52 -1.72 0.00 0.00 179.24 176.87 2a8d n VAL 87 N -3.60 1.50 0.50 -1.35 0.31 0.02 -4.50 118.33 111.21 2a8d n VAL 87 Ca -0.08 -0.45 0.12 0.00 -0.01 0.00 0.00 64.34 63.91 2a8d n VAL 87 Cb 0.98 -1.70 0.26 0.00 -0.91 0.00 0.00 33.84 32.47 2a8d n VAL 87 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2a8d h LEU 88 N -0.61 0.00 1.84 7.52 3.38 -1.10 -3.48 115.31 122.87 2a8d h LEU 88 Ca -0.65 -0.07 -0.37 0.00 0.09 0.00 0.00 57.88 56.87 2a8d h LEU 88 Cb 1.72 0.00 0.02 0.00 0.09 0.00 0.00 40.66 42.49 2a8d h LEU 88 CO -0.30 0.03 -0.51 0.29 0.09 0.00 0.00 178.44 178.04 2a8d n LYS 89 N -2.38 -2.86 -1.96 1.13 4.76 -0.42 -4.95 118.16 111.48 2a8d n LYS 89 Ca 0.04 0.87 -0.40 0.00 -2.87 0.00 0.00 58.31 55.95 2a8d n LYS 89 Cb 0.46 -5.48 -0.00 0.00 -1.84 0.00 0.00 35.03 28.16 2a8d n LYS 89 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2a8d s ILE 90 N -3.02 2.40 -1.67 -0.18 1.01 -0.12 -4.93 121.20 114.68 2a8d s ILE 90 Ca 0.13 0.38 0.17 0.00 0.00 0.00 0.00 60.65 61.32 2a8d s ILE 90 Cb -0.06 -3.23 0.03 0.00 0.01 0.00 0.00 42.46 39.21 2a8d s ILE 90 CO 0.16 0.07 0.91 -0.62 0.00 0.00 0.00 174.94 175.46 2a8d n GLU 91 N 0.33 1.59 -3.95 2.79 1.02 -1.26 -4.68 120.64 116.49 2a8d n GLU 91 Ca 0.02 -1.00 -0.19 0.00 -0.02 0.00 0.00 57.16 55.97 2a8d n GLU 91 Cb 0.42 -1.30 -0.17 0.00 -0.02 0.00 0.00 31.44 30.37 2a8d n GLU 91 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 2a8d s HIS 92 N -1.81 0.49 -0.12 -0.32 3.76 -1.26 -0.44 115.29 115.59 2a8d s HIS 92 Ca 0.15 -0.08 0.03 0.00 -0.15 0.00 0.00 55.06 55.02 2a8d s HIS 92 Cb 0.14 -0.56 0.00 0.00 1.11 0.00 0.00 32.58 33.27 2a8d s HIS 92 CO 0.37 -0.19 -0.22 0.42 -0.85 0.00 0.00 174.74 174.26 2a8d s ILE 93 N 1.25 2.11 -0.14 0.60 1.01 -0.15 -1.34 121.20 124.54 2a8d s ILE 93 Ca -0.06 -0.98 0.02 0.00 0.00 0.00 0.00 60.65 59.63 2a8d s ILE 93 Cb -0.13 -1.83 0.01 0.00 0.01 0.00 0.00 42.46 40.52 2a8d s ILE 93 CO -0.02 0.55 -0.21 -0.63 0.00 0.00 0.00 174.94 174.63 2a8d s ILE 94 N 0.57 2.14 -0.21 2.92 1.01 0.63 -0.60 121.20 127.65 2a8d s ILE 94 Ca -0.13 -0.96 -0.08 0.00 0.00 0.00 0.00 60.65 59.49 2a8d s ILE 94 Cb -0.17 -1.86 -0.04 0.00 0.01 0.00 0.00 42.46 40.41 2a8d s ILE 94 CO 0.04 0.55 0.07 -0.63 0.00 0.00 0.00 174.94 174.97 2a8d s ILE 95 N 0.78 4.69 -0.09 2.92 1.01 0.47 -0.44 121.20 130.54 2a8d s ILE 95 Ca -0.08 -0.06 0.01 0.00 0.00 0.00 0.00 60.65 60.52 2a8d s ILE 95 Cb -0.16 -3.14 0.02 0.00 0.01 0.00 0.00 42.46 39.19 2a8d s ILE 95 CO -0.01 0.41 -0.10 0.00 0.00 0.00 0.00 174.94 175.25 2a8d n GLY 97 N 4.33 2.65 3.37 0.00 0.00 -0.27 -3.91 105.19 111.37 2a8d n GLY 97 Ca -0.18 -2.27 -0.13 0.00 0.00 0.00 0.00 46.02 43.44 2a8d n GLY 97 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2a8d s HIS 98 N -2.26 -0.36 0.76 1.61 -3.43 -1.26 -3.00 115.29 107.35 2a8d s HIS 98 Ca 0.30 0.27 -0.11 0.00 -0.80 0.00 0.00 55.06 54.73 2a8d s HIS 98 Cb -0.02 0.33 0.05 0.00 -1.43 0.00 0.00 32.58 31.50 2a8d s HIS 98 CO 0.19 -0.67 1.08 0.95 -2.00 0.00 0.00 174.74 174.29 2a8d s THR 99 N -2.95 3.46 -1.39 -5.38 -4.23 -0.94 -3.67 115.64 100.54 2a8d s THR 99 Ca -0.02 0.47 -0.07 0.00 -1.18 0.00 0.00 61.69 60.89 2a8d s THR 99 Cb -0.00 -3.12 0.04 0.00 1.34 0.00 0.00 72.50 70.75 2a8d s THR 99 CO -0.06 -0.62 0.94 -3.20 -0.54 0.00 0.00 174.62 171.14 2a8d n ASN 100 N -3.39 -3.66 -4.63 3.99 5.15 -1.26 -4.53 115.26 106.93 2a8d n ASN 100 Ca 0.08 -0.73 -0.42 0.00 -0.60 0.00 0.00 54.58 52.91 2a8d n ASN 100 Cb 0.54 -4.30 -0.04 0.00 -0.53 0.00 0.00 39.78 35.46 2a8d n ASN 100 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2a8d h GLY 102 N 9.68 0.90 1.01 0.00 0.00 -1.93 -0.59 103.07 112.15 2a8d h GLY 102 Ca -0.22 -0.25 -0.06 0.00 0.00 0.00 0.00 47.33 46.80 2a8d h GLY 102 CO 0.95 0.12 0.13 -1.33 0.00 0.00 0.00 176.54 176.40 2a8d h GLY 103 N 0.59 1.00 0.90 4.60 0.00 -1.94 -0.21 103.07 108.01 2a8d h GLY 103 Ca 0.36 -0.64 -0.06 0.00 0.00 0.00 0.00 47.33 47.00 2a8d h GLY 103 CO -0.13 0.59 -0.01 -2.22 0.00 0.00 0.00 176.54 174.77 2a8d h ILE 104 N 0.83 1.26 -0.47 2.60 1.08 -1.61 -1.30 117.51 119.90 2a8d h ILE 104 Ca 0.18 -0.99 -0.00 0.00 -0.39 0.00 0.00 64.86 63.66 2a8d h ILE 104 Cb 0.36 1.25 -0.02 0.00 -3.07 0.00 0.00 36.82 35.34 2a8d h ILE 104 CO 0.00 0.32 0.27 0.45 -0.69 0.00 0.00 178.15 178.51 2a8d h HIS 105 N 0.39 0.62 -0.68 1.37 3.86 -1.01 -1.74 115.15 117.96 2a8d h HIS 105 Ca 0.09 -0.01 -0.03 0.00 -1.16 0.00 0.00 60.37 59.27 2a8d h HIS 105 Cb 0.47 -0.20 -0.03 0.00 1.06 0.00 0.00 27.41 28.70 2a8d h HIS 105 CO 0.04 0.45 0.31 0.00 0.86 0.00 0.00 177.93 179.58 2a8d h ALA 106 N 1.12 1.26 -0.37 2.45 0.00 -0.91 0.10 119.26 122.92 2a8d h ALA 106 Ca 0.17 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 2a8d h ALA 106 Cb 0.01 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 2a8d h ALA 106 CO -0.03 0.56 -0.10 0.00 0.00 0.00 0.00 179.25 179.68 2a8d h ALA 107 N 1.37 1.13 0.00 0.00 0.00 -0.82 -2.88 119.26 118.06 2a8d h ALA 107 Ca 0.23 -0.29 -0.15 0.00 0.00 0.00 0.00 54.91 54.71 2a8d h ALA 107 Cb 0.13 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 2a8d h ALA 107 CO -0.03 0.55 -0.71 0.52 0.00 0.00 0.00 179.25 179.58 2a8d h MET 108 N 0.59 0.00 -6.90 0.00 2.86 -0.66 -3.45 114.93 107.37 2a8d h MET 108 Ca 0.11 0.00 -0.51 0.00 -2.06 0.00 0.00 59.70 57.24 2a8d h MET 108 Cb 0.52 0.00 0.04 0.00 0.06 0.00 0.00 31.60 32.22 2a8d h MET 108 CO 0.03 0.71 0.50 0.00 1.06 0.00 0.00 176.91 179.22 2a8d s ALA 109 N -2.92 3.25 -1.03 6.32 0.00 0.29 -4.93 121.76 122.75 2a8d s ALA 109 Ca 0.02 0.95 -0.03 0.00 0.00 0.00 0.00 51.96 52.91 2a8d s ALA 109 Cb 0.09 -3.37 0.22 0.00 0.00 0.00 0.00 23.12 20.06 2a8d s ALA 109 CO 0.77 -0.41 2.18 -3.47 0.00 0.00 0.00 175.76 174.83 2a8d n ASP 110 N 0.44 7.52 -4.35 0.00 -0.08 -1.26 -4.94 116.55 113.88 2a8d n ASP 110 Ca 0.02 -3.45 -0.26 0.00 -1.51 0.00 0.00 54.79 49.59 2a8d n ASP 110 Cb 0.46 -1.23 -0.13 0.00 2.34 0.00 0.00 41.12 42.56 2a8d n ASP 110 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 2a8d s LYS 111 N -2.84 1.29 -0.50 -0.67 1.02 -1.26 -5.09 119.74 111.69 2a8d s LYS 111 Ca 0.49 -1.30 -0.21 0.00 0.02 0.00 0.00 55.97 54.97 2a8d s LYS 111 Cb 0.25 -1.65 0.04 0.00 -0.52 0.00 0.00 37.83 35.95 2a8d s LYS 111 CO -0.17 0.38 0.71 0.34 -0.92 0.00 0.00 175.35 175.69 2a8d s ASP 112 N -2.11 6.28 0.00 2.83 2.15 -1.26 -4.86 116.67 119.70 2a8d s ASP 112 Ca 0.12 -0.60 0.17 0.00 0.43 0.00 0.00 52.55 52.67 2a8d s ASP 112 Cb -0.09 -2.33 0.07 0.00 -0.30 0.00 0.00 42.92 40.26 2a8d s ASP 112 CO 0.06 -0.94 0.98 0.18 -0.17 0.00 0.00 175.17 175.28 2a8d n LEU 113 N 6.51 2.10 0.00 -1.34 4.77 -1.26 -5.10 117.00 122.68 2a8d n LEU 113 Ca -0.03 -0.89 0.00 0.00 -0.03 0.00 0.00 56.01 55.06 2a8d n LEU 113 Cb 0.47 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 2a8d n LEU 113 CO 0.56 0.38 0.00 0.61 -1.33 0.00 0.00 177.39 177.61 2a8d n GLY 114 N 1.08 0.10 0.36 -0.72 0.00 -1.26 -4.62 105.19 100.13 2a8d n GLY 114 Ca 0.09 -1.85 0.19 0.00 0.00 0.00 0.00 46.02 44.44 2a8d n GLY 114 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2a8d h LEU 115 N 0.00 0.63 -2.04 0.99 5.85 -2.03 -0.99 115.31 117.72 2a8d h LEU 115 Ca 0.00 0.12 0.05 0.00 0.84 0.00 0.00 57.88 58.89 2a8d h LEU 115 Cb 0.00 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 2a8d h LEU 115 CO 0.00 0.10 0.13 -0.29 -0.34 0.00 0.00 178.44 178.04 2a8d h ILE 116 N 0.54 0.86 -0.65 4.05 6.09 -2.01 -1.67 117.51 124.72 2a8d h ILE 116 Ca 0.63 0.00 0.09 0.00 -1.37 0.00 0.00 64.86 64.21 2a8d h ILE 116 Cb 1.29 0.91 -0.04 0.00 0.47 0.00 0.00 36.82 39.45 2a8d h ILE 116 CO -0.43 0.00 0.43 0.78 -3.07 0.00 0.00 178.15 175.86 2a8d h ASN 117 N 0.00 0.48 -0.45 2.19 -0.26 -1.49 0.44 115.58 116.50 2a8d h ASN 117 Ca 0.08 0.01 -0.14 0.00 -0.56 0.00 0.00 56.30 55.69 2a8d h ASN 117 Cb 0.34 -0.09 -0.01 0.00 -1.06 0.00 0.00 38.32 37.49 2a8d h ASN 117 CO -0.00 0.30 -0.24 0.78 -1.06 0.00 0.00 177.43 177.20 2a8d h ASN 118 N 0.54 1.00 -0.65 5.81 2.35 -1.47 -1.51 115.58 121.65 2a8d h ASN 118 Ca 0.29 -0.39 -0.05 0.00 -0.55 0.00 0.00 56.30 55.60 2a8d h ASN 118 Cb 0.44 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 38.50 2a8d h ASN 118 CO -0.09 1.18 0.22 -0.25 -1.65 0.00 0.00 177.43 176.84 2a8d h TRP 119 N 0.83 1.04 0.00 1.19 2.91 -1.16 -2.72 115.95 118.04 2a8d h TRP 119 Ca 0.10 -0.10 0.00 0.00 1.13 0.00 0.00 58.89 60.02 2a8d h TRP 119 Cb 0.82 -0.30 0.00 0.00 -0.51 0.00 0.00 29.16 29.17 2a8d h TRP 119 CO 0.05 0.84 0.00 1.28 -1.03 0.00 0.00 178.44 179.58 2a8d n LEU 120 N -4.36 0.00 0.25 0.65 4.77 -0.01 -3.39 117.00 114.91 2a8d n LEU 120 Ca 0.04 0.39 0.08 0.00 -0.03 0.00 0.00 56.01 56.49 2a8d n LEU 120 Cb 0.21 -0.39 0.62 0.00 -2.33 0.00 0.00 43.42 41.53 2a8d n LEU 120 CO 0.40 -0.04 1.02 -0.07 -1.33 0.00 0.00 177.39 177.37 2a8d h LEU 121 N 0.00 0.00 -1.28 2.23 3.38 -0.94 0.12 115.31 118.81 2a8d h LEU 121 Ca 0.00 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 2a8d h LEU 121 Cb 0.35 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 2a8d h LEU 121 CO 0.00 0.06 -0.11 0.45 0.09 0.00 0.00 178.44 178.93 2a8d h HIS 122 N 0.00 0.37 -0.19 1.13 3.86 -1.74 -1.00 115.15 117.58 2a8d h HIS 122 Ca -0.00 -0.04 -0.21 0.00 -1.16 0.00 0.00 60.37 58.96 2a8d h HIS 122 Cb 0.11 -0.10 0.01 0.00 1.06 0.00 0.00 27.41 28.49 2a8d h HIS 122 CO 0.00 0.46 -0.69 0.82 0.86 0.00 0.00 177.93 179.38 2a8d h ILE 123 N 0.33 1.28 -0.26 2.45 1.08 -1.23 -2.69 117.51 118.48 2a8d h ILE 123 Ca 0.07 -1.88 -0.04 0.00 -0.39 0.00 0.00 64.86 62.61 2a8d h ILE 123 Cb 0.40 1.89 -0.01 0.00 -3.07 0.00 0.00 36.82 36.03 2a8d h ILE 123 CO 0.02 0.60 -0.02 0.03 -0.69 0.00 0.00 178.15 178.09 2a8d h ARG 124 N 0.55 0.39 -0.33 2.37 3.08 -0.98 -0.05 114.38 119.41 2a8d h ARG 124 Ca -0.03 -0.08 -0.07 0.00 0.07 0.00 0.00 59.98 59.88 2a8d h ARG 124 Cb 1.31 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 31.29 2a8d h ARG 124 CO 0.15 0.44 -0.08 -0.44 -1.07 0.00 0.00 179.97 178.96 2a8d h ASP 125 N 0.38 0.52 -0.20 7.04 3.32 -1.04 -0.87 116.42 125.57 2a8d h ASP 125 Ca 0.08 -0.13 -0.16 0.00 0.02 0.00 0.00 57.03 56.84 2a8d h ASP 125 Cb 0.29 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 39.69 2a8d h ASP 125 CO 0.01 0.65 -0.47 0.40 -1.72 0.00 0.00 179.24 178.11 2a8d h ILE 126 N 0.51 1.29 -0.01 0.35 2.04 -0.91 -1.03 117.51 119.75 2a8d h ILE 126 Ca 0.10 -1.67 0.01 0.00 1.00 0.00 0.00 64.86 64.31 2a8d h ILE 126 Cb 0.46 1.57 -0.02 0.00 -0.74 0.00 0.00 36.82 38.09 2a8d h ILE 126 CO 0.02 0.54 -0.07 -0.25 0.00 0.00 0.00 178.15 178.39 2a8d h TRP 127 N 0.61 -0.18 -0.74 1.37 7.01 -0.43 -2.38 115.95 121.22 2a8d h TRP 127 Ca 0.03 0.01 -0.05 0.00 2.11 0.00 0.00 58.89 60.99 2a8d h TRP 127 Cb 1.05 0.08 -0.03 0.00 -2.10 0.00 0.00 29.16 28.16 2a8d h TRP 127 CO 0.06 -0.11 0.25 0.74 -2.79 0.00 0.00 178.44 176.59 2a8d h PHE 128 N -0.12 1.15 -0.63 2.65 0.04 -1.06 -0.22 116.94 118.76 2a8d h PHE 128 Ca 0.03 -0.10 0.09 0.00 2.80 0.00 0.00 57.97 60.79 2a8d h PHE 128 Cb 0.16 -0.34 -0.04 0.00 2.20 0.00 0.00 35.95 37.94 2a8d h PHE 128 CO -0.15 0.90 0.42 -0.22 -0.60 0.00 0.00 178.31 178.66 2a8d h LYS 129 N 1.08 0.48 -0.41 1.51 3.64 -0.81 -0.26 116.57 121.80 2a8d h LYS 129 Ca 0.24 -0.03 -0.19 0.00 -1.27 0.00 0.00 60.65 59.40 2a8d h LYS 129 Cb 0.27 -0.11 -0.11 0.00 -0.41 0.00 0.00 32.23 31.87 2a8d h LYS 129 CO -0.01 0.32 0.01 0.72 -2.27 0.00 0.00 179.45 178.22 2a8d n HIS 130 N -4.48 1.29 -0.20 1.91 8.25 -0.93 -4.76 115.22 116.31 2a8d n HIS 130 Ca 0.10 -1.51 0.11 0.00 -0.26 0.00 0.00 57.72 56.16 2a8d n HIS 130 Cb 0.34 -0.52 0.42 0.00 1.12 0.00 0.00 29.99 31.35 2a8d n HIS 130 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 2a8d h GLY 131 N 1.15 0.94 0.76 -1.41 0.00 0.79 -1.46 103.07 103.83 2a8d h GLY 131 Ca 0.23 -0.26 -0.01 0.00 0.00 0.00 0.00 47.33 47.30 2a8d h GLY 131 CO 0.44 0.12 0.01 0.84 0.00 0.00 0.00 176.54 177.95 2a8d h HIS 132 N 0.61 0.08 0.29 5.60 6.17 -1.86 -1.22 115.15 124.82 2a8d h HIS 132 Ca 0.37 -0.01 -0.01 0.00 0.71 0.00 0.00 60.37 61.43 2a8d h HIS 132 Cb 0.61 -0.02 0.00 0.00 2.52 0.00 0.00 27.41 30.52 2a8d h HIS 132 CO -0.00 0.31 -0.14 1.25 0.71 0.00 0.00 177.93 180.07 2a8d h LEU 133 N -0.17 -0.33 -1.79 0.26 7.12 -1.82 -2.83 115.31 115.74 2a8d h LEU 133 Ca 0.01 -0.03 0.00 0.00 0.13 0.00 0.00 57.88 58.00 2a8d h LEU 133 Cb 0.28 0.08 -0.01 0.00 -0.53 0.00 0.00 40.66 40.48 2a8d h LEU 133 CO 0.00 -0.19 0.13 -0.07 -0.13 0.00 0.00 178.44 178.19 2a8d h LEU 134 N -0.44 0.24 -1.22 2.25 3.38 -1.31 -2.11 115.31 116.09 2a8d h LEU 134 Ca -0.04 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.84 2a8d h LEU 134 Cb 0.33 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 2a8d h LEU 134 CO 0.06 0.18 -0.38 1.23 0.09 0.00 0.00 178.44 179.62 2a8d h GLY 135 N 0.29 0.00 1.07 0.83 0.00 -1.00 -2.43 103.07 101.82 2a8d h GLY 135 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.41 2a8d h GLY 135 CO -0.02 0.00 -0.01 0.28 0.00 0.00 0.00 176.54 176.79 2a8d n LYS 136 N -4.00 0.84 -4.06 4.80 5.02 -0.80 -4.83 118.16 115.14 2a8d n LYS 136 Ca -0.02 -0.08 -0.35 0.00 -2.02 0.00 0.00 58.31 55.84 2a8d n LYS 136 Cb 0.42 -1.50 -0.09 0.00 -0.02 0.00 0.00 35.03 33.85 2a8d n LYS 136 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2a8d s LEU 137 N -2.22 3.91 0.13 -0.35 2.96 -0.92 -0.69 118.68 121.51 2a8d s LEU 137 Ca 0.40 0.20 -0.35 0.00 -0.22 0.00 0.00 54.13 54.16 2a8d s LEU 137 Cb 0.21 -1.96 -0.15 0.00 0.50 0.00 0.00 46.19 44.79 2a8d s LEU 137 CO 0.41 0.28 1.48 -0.24 -1.32 0.00 0.00 176.35 176.96 2a8d n SER 138 N 2.80 2.50 -0.30 3.68 2.88 -0.47 -4.79 113.62 119.92 2a8d n SER 138 Ca -0.18 1.10 0.12 0.00 -1.33 0.00 0.00 58.87 58.58 2a8d n SER 138 Cb 0.53 -1.33 0.23 0.00 -0.75 0.00 0.00 64.21 62.89 2a8d n SER 138 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 2a8d n PRO 139 N 3.04 -0.07 0.00 -1.46 -0.02 -1.26 -0.72 135.00 134.50 2a8d n PRO 139 Ca 0.17 1.30 0.06 0.00 -2.02 0.00 0.00 63.50 63.01 2a8d n PRO 139 Cb 0.25 -2.05 0.28 0.00 -0.02 0.00 0.00 33.50 31.96 2a8d n PRO 139 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 2a8d n GLU 140 N -5.27 0.09 -0.00 -0.52 0.00 -1.26 -2.25 120.64 111.43 2a8d n GLU 140 Ca 0.19 0.23 0.07 0.00 0.00 0.00 0.00 57.16 57.66 2a8d n GLU 140 Cb 0.63 -1.50 -0.09 0.00 0.00 0.00 0.00 31.44 30.48 2a8d n GLU 140 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 2a8d n LYS 141 N -1.39 2.02 -0.25 3.44 4.76 0.10 -4.61 118.16 122.22 2a8d n LYS 141 Ca 0.04 -0.00 -0.02 0.00 -2.87 0.00 0.00 58.31 55.46 2a8d n LYS 141 Cb 0.12 -1.21 0.17 0.00 -1.84 0.00 0.00 35.03 32.27 2a8d n LYS 141 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2a8d h ARG 142 N 0.00 1.08 -0.21 1.97 3.08 -1.45 -2.44 114.38 116.41 2a8d h ARG 142 Ca 0.00 -0.12 -0.00 0.00 0.07 0.00 0.00 59.98 59.93 2a8d h ARG 142 Cb 0.36 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 30.19 2a8d h ARG 142 CO 0.00 0.78 0.13 0.00 -1.07 0.00 0.00 179.97 179.81 2a8d h ALA 143 N 1.39 0.27 -0.73 0.04 0.00 -1.82 0.15 119.26 118.56 2a8d h ALA 143 Ca 0.28 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.11 2a8d h ALA 143 Cb 0.02 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 2a8d h ALA 143 CO -0.05 -0.23 0.30 -0.44 0.00 0.00 0.00 179.25 178.84 2a8d h ASP 144 N 0.26 0.98 -0.41 0.00 3.45 -1.83 -1.47 116.42 117.40 2a8d h ASP 144 Ca 0.08 -0.14 -0.12 0.00 0.43 0.00 0.00 57.03 57.28 2a8d h ASP 144 Cb 0.01 -0.25 -0.01 0.00 -0.56 0.00 0.00 39.33 38.52 2a8d h ASP 144 CO -0.01 0.87 -0.22 -0.03 -1.57 0.00 0.00 179.24 178.27 2a8d h MET 145 N 1.05 0.87 -0.21 3.56 4.05 -0.98 -2.73 114.93 120.54 2a8d h MET 145 Ca 0.25 -0.39 -0.08 0.00 -0.28 0.00 0.00 59.70 59.20 2a8d h MET 145 Cb 0.18 -0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 30.95 2a8d h MET 145 CO -0.02 1.04 -0.22 1.25 0.23 0.00 0.00 176.91 179.19 2a8d h LEU 146 N 0.68 0.36 -0.67 3.39 5.85 -0.51 -0.99 115.31 123.42 2a8d h LEU 146 Ca 0.09 -0.11 0.02 0.00 0.84 0.00 0.00 57.88 58.72 2a8d h LEU 146 Cb 0.79 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.69 2a8d h LEU 146 CO 0.07 0.59 0.43 0.74 -0.34 0.00 0.00 178.44 179.93 2a8d h THR 147 N 0.33 1.12 -0.18 1.05 2.02 -1.08 0.24 112.91 116.41 2a8d h THR 147 Ca 0.06 -0.29 -0.14 0.00 0.77 0.00 0.00 66.41 66.80 2a8d h THR 147 Cb 0.57 0.19 0.00 0.00 -1.74 0.00 0.00 68.15 67.17 2a8d h THR 147 CO 0.04 0.16 -0.43 0.11 0.37 0.00 0.00 175.52 175.76 2a8d h LYS 148 N 0.86 0.61 -0.62 6.66 1.57 -1.14 -2.87 116.57 121.64 2a8d h LYS 148 Ca 0.26 -0.41 -0.08 0.00 -1.87 0.00 0.00 60.65 58.55 2a8d h LYS 148 Cb -0.03 0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.32 2a8d h LYS 148 CO -0.09 1.03 0.08 0.82 -0.57 0.00 0.00 179.45 180.73 2a8d h ILE 149 N 0.27 1.26 -0.23 1.86 2.04 -1.01 -2.40 117.51 119.30 2a8d h ILE 149 Ca -0.00 -1.02 0.05 0.00 1.00 0.00 0.00 64.86 64.89 2a8d h ILE 149 Cb 1.04 0.70 -0.05 0.00 -0.74 0.00 0.00 36.82 37.77 2a8d h ILE 149 CO 0.09 0.38 -0.09 -1.13 0.00 0.00 0.00 178.15 177.40 2a8d h ASN 150 N 0.95 -0.32 -0.65 1.72 -1.24 -0.49 -0.13 115.58 115.42 2a8d h ASN 150 Ca 0.19 0.08 0.04 0.00 0.71 0.00 0.00 56.30 57.32 2a8d h ASN 150 Cb 0.44 0.19 -0.05 0.00 0.73 0.00 0.00 38.32 39.63 2a8d h ASN 150 CO 0.01 -0.12 0.39 0.58 -1.29 0.00 0.00 177.43 177.00 2a8d h VAL 151 N -0.05 1.04 -0.56 2.57 2.07 -1.27 0.56 116.25 120.61 2a8d h VAL 151 Ca 0.12 -0.26 0.01 0.00 0.82 0.00 0.00 66.70 67.39 2a8d h VAL 151 Cb 0.24 0.23 -0.03 0.00 -1.52 0.00 0.00 31.29 30.21 2a8d h VAL 151 CO -0.27 0.14 0.37 0.00 0.02 0.00 0.00 177.57 177.83 2a8d h ALA 152 N 1.30 0.71 -0.48 1.67 0.00 -0.87 -1.70 119.26 119.89 2a8d h ALA 152 Ca 0.27 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 55.02 2a8d h ALA 152 Cb 0.07 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 2a8d h ALA 152 CO -0.13 0.15 -0.17 0.93 0.00 0.00 0.00 179.25 180.03 2a8d h GLU 153 N 0.76 0.95 -0.61 0.00 4.39 -0.37 -2.16 114.58 117.53 2a8d h GLU 153 Ca 0.21 -0.37 -0.07 0.00 0.34 0.00 0.00 59.36 59.46 2a8d h GLU 153 Cb -0.09 -0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 28.49 2a8d h GLU 153 CO -0.04 1.04 0.10 1.96 -1.16 0.00 0.00 179.01 180.91 2a8d h GLN 154 N 0.83 0.99 -0.75 2.33 1.08 -0.64 0.19 115.11 119.14 2a8d h GLN 154 Ca 0.12 -0.25 -0.06 0.00 -1.45 0.00 0.00 58.65 57.02 2a8d h GLN 154 Cb 0.73 -0.13 -0.03 0.00 -0.05 0.00 0.00 27.48 28.00 2a8d h GLN 154 CO 0.06 0.91 0.25 0.28 -0.95 0.00 0.00 178.83 179.38 2a8d h VAL 155 N 0.94 1.26 -0.62 -0.54 2.07 -1.19 0.68 116.25 118.85 2a8d h VAL 155 Ca 0.19 -0.89 -0.02 0.00 0.82 0.00 0.00 66.70 66.80 2a8d h VAL 155 Cb 0.40 0.42 -0.03 0.00 -1.52 0.00 0.00 31.29 30.56 2a8d h VAL 155 CO 0.01 0.35 0.29 0.22 0.02 0.00 0.00 177.57 178.46 2a8d h TYR 156 N 1.11 0.89 -0.55 1.57 3.20 -0.67 0.16 116.97 122.68 2a8d h TYR 156 Ca 0.24 -0.05 -0.03 0.00 3.14 0.00 0.00 58.73 62.04 2a8d h TYR 156 Cb 0.29 -0.28 -0.02 0.00 1.54 0.00 0.00 36.73 38.26 2a8d h TYR 156 CO 0.02 0.68 0.22 -0.91 -1.64 0.00 0.00 178.16 176.53 2a8d h ASN 157 N 0.85 0.76 -0.48 -2.11 2.35 -0.11 -2.48 115.58 114.35 2a8d h ASN 157 Ca 0.21 -0.17 -0.01 0.00 -0.55 0.00 0.00 56.30 55.78 2a8d h ASN 157 Cb 0.13 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.28 2a8d h ASN 157 CO -0.03 0.72 0.28 0.25 -1.65 0.00 0.00 177.43 177.01 2a8d h LEU 158 N 0.75 0.58 -1.28 1.61 5.85 -0.53 -1.96 115.31 120.32 2a8d h LEU 158 Ca 0.18 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.83 2a8d h LEU 158 Cb 0.21 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.09 2a8d h LEU 158 CO -0.01 0.48 0.00 1.23 -0.34 0.00 0.00 178.44 179.80 2a8d h GLY 159 N 0.63 0.00 0.44 3.75 0.00 -0.76 -2.55 103.07 104.59 2a8d h GLY 159 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.50 2a8d h GLY 159 CO -0.03 0.00 -0.81 0.54 0.00 0.00 0.00 176.54 176.24 2a8d n ARG 160 N -2.48 0.02 -1.72 4.80 1.74 -0.77 -4.31 116.66 113.95 2a8d n ARG 160 Ca 0.00 -0.00 -0.37 0.00 -0.77 0.00 0.00 57.85 56.71 2a8d n ARG 160 Cb 0.17 -1.51 0.07 0.00 -1.02 0.00 0.00 32.46 30.17 2a8d n ARG 160 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2a8d s THR 161 N -3.02 2.08 0.41 0.55 -4.23 -0.96 -4.82 115.64 105.65 2a8d s THR 161 Ca 0.09 0.05 0.21 0.00 -1.18 0.00 0.00 61.69 60.86 2a8d s THR 161 Cb 0.16 -2.98 0.23 0.00 1.34 0.00 0.00 72.50 71.25 2a8d s THR 161 CO 0.80 -0.01 2.00 0.77 -0.54 0.00 0.00 174.62 177.64 2a8d h SER 162 N 0.48 0.00 0.23 3.99 4.64 -1.92 -2.03 113.55 118.94 2a8d h SER 162 Ca -0.51 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.80 2a8d h SER 162 Cb 1.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.42 2a8d h SER 162 CO 0.53 0.18 -0.11 0.40 -0.87 0.00 0.00 176.83 176.96 2a8d h ILE 163 N 0.00 0.81 -0.02 0.95 2.04 -1.92 -0.71 117.51 118.66 2a8d h ILE 163 Ca -0.00 -0.25 -0.00 0.00 1.00 0.00 0.00 64.86 65.61 2a8d h ILE 163 Cb 0.39 0.96 -0.00 0.00 -0.74 0.00 0.00 36.82 37.43 2a8d h ILE 163 CO 0.02 0.06 -0.01 0.58 0.00 0.00 0.00 178.15 178.80 2a8d h VAL 164 N -0.44 1.33 -0.77 1.67 2.07 -1.76 -1.85 116.25 116.50 2a8d h VAL 164 Ca -0.03 -0.98 0.10 0.00 0.82 0.00 0.00 66.70 66.61 2a8d h VAL 164 Cb 0.33 1.95 -0.07 0.00 -1.52 0.00 0.00 31.29 31.98 2a8d h VAL 164 CO 0.05 0.26 0.40 0.11 0.02 0.00 0.00 177.57 178.41 2a8d h LYS 165 N -0.37 0.64 -0.53 1.57 1.57 -1.42 -0.26 116.57 117.78 2a8d h LYS 165 Ca 0.00 -0.04 -0.06 0.00 -1.87 0.00 0.00 60.65 58.69 2a8d h LYS 165 Cb 0.42 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.56 2a8d h LYS 165 CO 0.00 0.43 0.10 0.77 -0.57 0.00 0.00 179.45 180.17 2a8d h SER 166 N 0.66 0.79 -0.16 0.86 0.02 -1.09 0.46 113.55 115.10 2a8d h SER 166 Ca 0.38 -0.16 -0.00 0.00 -0.84 0.00 0.00 61.79 61.17 2a8d h SER 166 Cb 0.41 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.73 2a8d h SER 166 CO -0.28 0.80 0.09 0.00 -1.14 0.00 0.00 176.83 176.30 2a8d h ALA 167 N 1.30 0.20 -0.30 3.77 0.00 -0.23 -1.59 119.26 122.41 2a8d h ALA 167 Ca 0.17 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 2a8d h ALA 167 Cb 0.34 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 2a8d h ALA 167 CO 0.00 -0.27 0.08 -1.49 0.00 0.00 0.00 179.25 177.57 2a8d h TRP 168 N 0.16 0.49 -0.59 0.00 6.55 -0.92 -0.17 115.95 121.48 2a8d h TRP 168 Ca 0.06 -0.06 0.12 0.00 0.95 0.00 0.00 58.89 59.96 2a8d h TRP 168 Cb 0.06 -0.14 -0.11 0.00 -0.86 0.00 0.00 29.16 28.10 2a8d h TRP 168 CO -0.04 0.52 -0.16 1.49 -1.05 0.00 0.00 178.44 179.20 2a8d h GLU 169 N 0.32 -0.01 0.00 0.49 4.57 -0.69 0.18 114.58 119.45 2a8d h GLU 169 Ca 0.09 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.28 2a8d h GLU 169 Cb 0.27 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.86 2a8d h GLU 169 CO -0.00 -0.01 0.00 2.89 -1.18 0.00 0.00 179.01 180.71 2a8d n ARG 170 N -5.41 0.99 -0.71 1.92 1.85 -0.62 -4.87 116.66 109.81 2a8d n ARG 170 Ca 0.06 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.91 2a8d n ARG 170 Cb 0.31 -1.17 0.00 0.00 -1.05 0.00 0.00 32.46 30.55 2a8d n ARG 170 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2a8d n GLY 171 N 0.66 0.59 3.75 2.89 0.00 0.64 -5.04 105.19 108.68 2a8d n GLY 171 Ca 0.08 -0.47 -0.40 0.00 0.00 0.00 0.00 46.02 45.22 2a8d n GLY 171 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2a8d s GLN 172 N -0.98 4.72 -0.28 1.61 0.74 -0.09 -4.98 119.66 120.41 2a8d s GLN 172 Ca 0.00 1.62 -0.29 0.00 0.05 0.00 0.00 55.36 56.74 2a8d s GLN 172 Cb 0.00 -3.27 0.01 0.00 1.10 0.00 0.00 33.01 30.85 2a8d s GLN 172 CO 0.00 0.29 1.16 0.21 -0.55 0.00 0.00 175.29 176.40 2a8d s LYS 173 N -0.90 4.08 -0.18 1.67 2.20 -1.26 -4.37 119.74 120.98 2a8d s LYS 173 Ca 0.45 1.24 -0.09 0.00 -0.36 0.00 0.00 55.97 57.21 2a8d s LYS 173 Cb -0.28 -3.76 0.07 0.00 -1.51 0.00 0.00 37.83 32.34 2a8d s LYS 173 CO 0.35 -0.89 0.41 -1.17 -0.36 0.00 0.00 175.35 173.69 2a8d s LEU 174 N 3.75 -0.23 0.08 5.43 2.96 -1.26 -4.50 118.68 124.91 2a8d s LEU 174 Ca 0.49 0.92 0.09 0.00 -0.22 0.00 0.00 54.13 55.42 2a8d s LEU 174 Cb -0.15 1.35 -0.03 0.00 0.50 0.00 0.00 46.19 47.86 2a8d s LEU 174 CO 0.16 -0.20 -0.25 -0.94 -1.32 0.00 0.00 176.35 173.79 2a8d s SER 175 N 1.69 3.05 -0.01 3.68 1.04 0.41 -4.29 113.70 119.27 2a8d s SER 175 Ca -0.08 -0.65 0.06 0.00 0.48 0.00 0.00 55.95 55.76 2a8d s SER 175 Cb -0.09 -0.23 -0.03 0.00 0.10 0.00 0.00 66.02 65.77 2a8d s SER 175 CO -0.13 0.19 -0.18 -0.76 0.98 0.00 0.00 173.24 173.34 2a8d s LEU 176 N -1.60 2.53 0.04 2.42 1.43 0.12 -0.98 118.68 122.64 2a8d s LEU 176 Ca 0.11 -0.34 0.02 0.00 -1.03 0.00 0.00 54.13 52.90 2a8d s LEU 176 Cb -0.10 -1.49 -0.02 0.00 0.03 0.00 0.00 46.19 44.61 2a8d s LEU 176 CO 0.04 0.31 -0.08 -1.00 0.23 0.00 0.00 176.35 175.85 2a8d s HIS 177 N -0.76 0.70 -0.18 0.29 3.76 0.23 -2.20 115.29 117.12 2a8d s HIS 177 Ca 0.12 -0.46 -0.03 0.00 -0.15 0.00 0.00 55.06 54.54 2a8d s HIS 177 Cb -0.10 -0.42 0.06 0.00 1.11 0.00 0.00 32.58 33.22 2a8d s HIS 177 CO 0.02 -0.07 0.03 0.20 -0.85 0.00 0.00 174.74 174.07 2a8d s GLY 178 N -1.46 0.65 0.29 -2.22 0.00 -1.22 -0.40 107.32 102.97 2a8d s GLY 178 Ca -0.08 -0.60 0.08 0.00 0.00 0.00 0.00 44.72 44.12 2a8d s GLY 178 CO 0.00 1.40 -0.08 -0.98 0.00 0.00 0.00 173.10 173.45 2a8d s TRP 179 N 1.89 2.07 -0.01 1.90 0.51 0.04 -1.76 118.94 123.58 2a8d s TRP 179 Ca 0.00 -0.63 -0.05 0.00 -2.12 0.00 0.00 56.10 53.31 2a8d s TRP 179 Cb -0.16 -1.16 0.00 0.00 -0.81 0.00 0.00 33.47 31.34 2a8d s TRP 179 CO -0.08 0.38 0.10 0.08 -0.51 0.00 0.00 176.95 176.93 2a8d s VAL 180 N -2.89 0.06 0.06 4.03 1.01 -0.35 -1.11 120.40 121.21 2a8d s VAL 180 Ca 0.30 -0.46 0.03 0.00 0.00 0.00 0.00 61.98 61.85 2a8d s VAL 180 Cb 0.03 -0.31 -0.03 0.00 0.00 0.00 0.00 36.38 36.07 2a8d s VAL 180 CO 0.13 -0.25 -0.10 -0.72 0.00 0.00 0.00 175.10 174.15 2a8d s TYR 181 N -0.84 0.90 -0.07 5.22 -0.85 -1.16 0.51 117.35 121.06 2a8d s TYR 181 Ca -0.09 -0.51 -0.24 0.00 -0.52 0.00 0.00 57.07 55.70 2a8d s TYR 181 Cb -0.05 -0.52 -0.03 0.00 0.38 0.00 0.00 41.96 41.73 2a8d s TYR 181 CO 0.01 -0.03 0.74 0.34 -1.52 0.00 0.00 175.55 175.09 2a8d s ASP 182 N -1.76 7.02 0.00 -0.18 -1.08 -1.26 -2.22 116.67 117.20 2a8d s ASP 182 Ca -0.05 1.23 0.10 0.00 -0.52 0.00 0.00 52.55 53.31 2a8d s ASP 182 Cb -0.09 -2.43 0.53 0.00 -1.46 0.00 0.00 42.92 39.47 2a8d s ASP 182 CO 0.01 -0.15 1.17 1.33 0.52 0.00 0.00 175.17 178.04 2a8d n VAL 183 N 3.88 0.60 0.07 1.11 0.24 -1.26 -0.96 118.33 122.01 2a8d n VAL 183 Ca -0.00 0.15 0.10 0.00 -2.04 0.00 0.00 64.34 62.54 2a8d n VAL 183 Cb 0.51 -0.99 -0.04 0.00 -1.47 0.00 0.00 33.84 31.85 2a8d n VAL 183 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 2a8d n ASN 184 N -1.22 0.71 0.00 -1.34 3.02 -1.26 -4.66 115.26 110.50 2a8d n ASN 184 Ca 0.05 0.28 0.00 0.00 -0.03 0.00 0.00 54.58 54.88 2a8d n ASN 184 Cb 0.07 0.66 0.00 0.00 -0.61 0.00 0.00 39.78 39.90 2a8d n ASN 184 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 2a8d n ASP 185 N -2.64 0.45 0.00 6.41 5.68 -0.81 -5.05 116.55 120.59 2a8d n ASP 185 Ca -0.02 -0.08 0.00 0.00 -0.50 0.00 0.00 54.79 54.18 2a8d n ASP 185 Cb 0.60 0.26 0.00 0.00 -1.14 0.00 0.00 41.12 40.84 2a8d n ASP 185 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2a8d n GLY 186 N 0.39 0.45 3.69 6.12 0.00 -0.13 -4.99 105.19 110.73 2a8d n GLY 186 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2a8d n GLY 186 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2a8d s PHE 187 N -2.21 3.34 0.01 1.61 0.40 -1.26 -4.90 117.98 114.97 2a8d s PHE 187 Ca 0.00 1.35 -0.30 0.00 -0.60 0.00 0.00 56.93 57.38 2a8d s PHE 187 Cb 0.00 -3.35 -0.03 0.00 0.51 0.00 0.00 43.02 40.15 2a8d s PHE 187 CO 0.00 -0.96 1.03 -0.51 0.70 0.00 0.00 175.22 175.48 2a8d s LEU 188 N 1.84 4.36 -0.15 -0.37 1.43 -1.26 -4.02 118.68 120.52 2a8d s LEU 188 Ca 0.55 1.73 0.02 0.00 -1.03 0.00 0.00 54.13 55.40 2a8d s LEU 188 Cb -0.24 -3.57 0.01 0.00 0.03 0.00 0.00 46.19 42.42 2a8d s LEU 188 CO 0.23 -0.31 -0.20 -0.69 0.23 0.00 0.00 176.35 175.60 2a8d s VAL 189 N 1.07 2.19 0.16 -1.59 1.01 0.18 -4.95 120.40 118.47 2a8d s VAL 189 Ca 0.53 -0.93 -0.30 0.00 0.00 0.00 0.00 61.98 61.28 2a8d s VAL 189 Cb -0.23 -1.89 -0.08 0.00 0.00 0.00 0.00 36.38 34.18 2a8d s VAL 189 CO 0.28 0.54 1.29 -0.62 0.00 0.00 0.00 175.10 176.59 2a8d s ASP 190 N 0.88 6.94 0.00 3.32 -1.08 -1.26 -1.22 116.67 124.26 2a8d s ASP 190 Ca -0.05 2.31 0.27 0.00 -0.52 0.00 0.00 52.55 54.56 2a8d s ASP 190 Cb -0.15 -2.60 0.82 0.00 -1.46 0.00 0.00 42.92 39.53 2a8d s ASP 190 CO -0.03 -0.51 1.61 0.00 0.52 0.00 0.00 175.17 176.75 2a8d n GLN 191 N 3.00 1.14 0.00 4.34 1.13 -0.72 -4.95 117.38 121.32 2a8d n GLN 191 Ca 0.07 -0.68 0.00 0.00 -1.94 0.00 0.00 57.00 54.45 2a8d n GLN 191 Cb 0.43 -1.49 0.00 0.00 0.11 0.00 0.00 30.24 29.30 2a8d n GLN 191 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2a8d n GLY 192 N 1.29 2.03 3.58 1.08 0.00 -1.26 -4.73 105.19 107.18 2a8d n GLY 192 Ca 0.14 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.74 2a8d n GLY 192 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2a8d s VAL 193 N -2.19 4.64 -0.14 1.61 1.01 -1.26 -4.62 120.40 119.45 2a8d s VAL 193 Ca 0.00 0.84 -0.04 0.00 0.00 0.00 0.00 61.98 62.78 2a8d s VAL 193 Cb 0.00 -4.30 0.06 0.00 0.00 0.00 0.00 36.38 32.14 2a8d s VAL 193 CO 0.00 -0.58 0.12 -0.32 0.00 0.00 0.00 175.10 174.32 2a8d s MET 194 N 3.33 0.05 0.03 2.72 1.75 -1.26 -3.38 119.30 122.54 2a8d s MET 194 Ca 0.33 0.17 0.07 0.00 -1.25 0.00 0.00 55.69 55.01 2a8d s MET 194 Cb -0.12 -1.20 -0.02 0.00 2.84 0.00 0.00 34.83 36.32 2a8d s MET 194 CO 0.20 -0.54 -0.21 0.00 -0.65 0.00 0.00 175.02 173.82 2a8d s ALA 195 N 2.20 1.81 0.00 4.11 0.00 -0.94 -4.63 121.76 124.31 2a8d s ALA 195 Ca 0.04 -1.06 0.00 0.00 0.00 0.00 0.00 51.96 50.94 2a8d s ALA 195 Cb -0.14 -0.37 0.00 0.00 0.00 0.00 0.00 23.12 22.60 2a8d s ALA 195 CO -0.08 0.42 0.46 0.25 0.00 0.00 0.00 175.76 176.81 2a8d n THR 196 N 1.96 0.22 -3.73 0.00 -2.24 -1.26 0.10 114.28 109.33 2a8d n THR 196 Ca -0.17 -0.33 -0.02 0.00 -2.27 0.00 0.00 64.05 61.27 2a8d n THR 196 Cb 0.53 1.18 -0.01 0.00 -2.10 0.00 0.00 70.33 69.93 2a8d n THR 196 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2a8d s SER 197 N -0.22 -0.11 0.17 3.42 1.04 -1.26 -4.74 113.70 112.00 2a8d s SER 197 Ca 0.00 -0.33 -0.11 0.00 0.48 0.00 0.00 55.95 55.99 2a8d s SER 197 Cb 0.00 0.37 0.07 0.00 0.10 0.00 0.00 66.02 66.56 2a8d s SER 197 CO 0.00 -0.69 1.68 -0.09 0.98 0.00 0.00 173.24 175.12 2a8d h ARG 198 N 2.00 0.97 -0.43 4.02 1.12 -1.98 -0.59 114.38 119.49 2a8d h ARG 198 Ca -0.27 -0.24 -0.10 0.00 -1.11 0.00 0.00 59.98 58.26 2a8d h ARG 198 Cb 1.22 -0.12 -0.01 0.00 -0.01 0.00 0.00 29.97 31.04 2a8d h ARG 198 CO 0.28 0.90 -0.14 1.49 -3.11 0.00 0.00 179.97 179.38 2a8d h GLU 199 N 0.88 0.85 0.00 0.20 4.81 -1.99 -1.74 114.58 117.58 2a8d h GLU 199 Ca 0.19 -0.34 -0.09 0.00 -0.13 0.00 0.00 59.36 58.98 2a8d h GLU 199 Cb 0.38 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.71 2a8d h GLU 199 CO 0.01 0.98 -0.43 1.79 -0.73 0.00 0.00 179.01 180.63 2a8d h THR 200 N 0.68 1.18 0.33 0.32 1.35 -1.89 -0.98 112.91 113.90 2a8d h THR 200 Ca 0.10 -1.54 -0.02 0.00 -0.55 0.00 0.00 66.41 64.41 2a8d h THR 200 Cb 0.69 1.86 0.00 0.00 -1.73 0.00 0.00 68.15 68.97 2a8d h THR 200 CO 0.05 0.42 -0.16 0.25 -0.25 0.00 0.00 175.52 175.83 2a8d h LEU 201 N 0.00 -0.37 0.20 3.87 5.85 -0.76 -0.55 115.31 123.55 2a8d h LEU 201 Ca -0.00 -0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.66 2a8d h LEU 201 Cb 0.82 0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.95 2a8d h LEU 201 CO 0.06 -0.18 -0.13 -0.33 -0.34 0.00 0.00 178.44 177.51 2a8d h GLU 202 N -0.55 -0.32 -0.20 1.25 4.39 -1.10 -0.23 114.58 117.83 2a8d h GLU 202 Ca -0.05 0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.67 2a8d h GLU 202 Cb 0.41 0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.12 2a8d h GLU 202 CO 0.07 -0.21 0.11 0.82 -1.16 0.00 0.00 179.01 178.64 2a8d h ILE 203 N -0.33 1.11 -0.18 3.13 1.08 -1.19 -1.49 117.51 119.64 2a8d h ILE 203 Ca -0.02 -0.30 -0.11 0.00 -0.39 0.00 0.00 64.86 64.04 2a8d h ILE 203 Cb 0.28 0.95 -0.01 0.00 -3.07 0.00 0.00 36.82 34.97 2a8d h ILE 203 CO 0.01 0.11 -0.37 0.77 -0.69 0.00 0.00 178.15 177.98 2a8d h SER 204 N 0.21 0.39 0.23 1.72 4.64 -1.08 -0.16 113.55 119.51 2a8d h SER 204 Ca 0.07 -0.16 -0.01 0.00 -0.47 0.00 0.00 61.79 61.22 2a8d h SER 204 Cb 0.07 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 62.06 2a8d h SER 204 CO -0.01 0.73 -0.11 0.22 -0.87 0.00 0.00 176.83 176.79 2a8d h TYR 205 N 0.32 -0.28 -0.06 4.77 3.20 -0.85 0.29 116.97 124.36 2a8d h TYR 205 Ca 0.03 -0.01 0.04 0.00 3.14 0.00 0.00 58.73 61.93 2a8d h TYR 205 Cb 0.80 0.09 -0.05 0.00 1.54 0.00 0.00 36.73 39.12 2a8d h TYR 205 CO 0.02 -0.12 -0.21 0.00 -1.64 0.00 0.00 178.16 176.21 2a8d h ARG 206 N -0.38 -0.29 -0.63 1.82 3.08 -1.11 -1.22 114.38 115.64 2a8d h ARG 206 Ca -0.03 0.02 0.07 0.00 0.07 0.00 0.00 59.98 60.11 2a8d h ARG 206 Cb 0.29 0.07 -0.06 0.00 0.08 0.00 0.00 29.97 30.34 2a8d h ARG 206 CO 0.05 -0.19 0.31 -0.91 -1.07 0.00 0.00 179.97 178.16 2a8d h ASN 207 N -0.30 0.42 0.02 7.04 2.35 -0.85 -1.46 115.58 122.79 2a8d h ASN 207 Ca 0.08 0.05 -0.00 0.00 -0.55 0.00 0.00 56.30 55.88 2a8d h ASN 207 Cb 0.41 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 38.76 2a8d h ASN 207 CO -0.24 0.26 -0.01 0.00 -1.65 0.00 0.00 177.43 175.79 2a8d h ALA 208 N 1.37 -0.03 -0.71 -0.83 0.00 0.02 -0.92 119.26 118.16 2a8d h ALA 208 Ca 0.30 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.20 2a8d h ALA 208 Cb 0.27 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 2a8d h ALA 208 CO -0.23 -0.51 0.46 0.82 0.00 0.00 0.00 179.25 179.79 2a8d h ILE 209 N -0.05 1.19 -0.42 0.00 1.08 -0.94 -0.29 117.51 118.07 2a8d h ILE 209 Ca -0.00 -0.37 0.02 0.00 -0.39 0.00 0.00 64.86 64.12 2a8d h ILE 209 Cb 0.04 0.17 -0.03 0.00 -3.07 0.00 0.00 36.82 33.93 2a8d h ILE 209 CO 0.01 0.19 0.24 0.00 -0.69 0.00 0.00 178.15 177.89 2a8d h ALA 210 N 1.25 0.53 -0.25 1.87 0.00 -1.00 -1.27 119.26 120.40 2a8d h ALA 210 Ca 0.26 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 2a8d h ALA 210 Cb -0.08 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2a8d h ALA 210 CO -0.05 -0.10 0.12 -0.09 0.00 0.00 0.00 179.25 179.13 2a8d h ARG 211 N 0.48 0.36 0.00 0.00 9.65 -0.75 -2.44 114.38 121.68 2a8d h ARG 211 Ca 0.17 -0.05 -0.00 0.00 -1.10 0.00 0.00 59.98 59.00 2a8d h ARG 211 Cb 0.03 -0.07 -0.00 0.00 -1.39 0.00 0.00 29.97 28.55 2a8d h ARG 211 CO -0.09 0.36 -0.01 -0.07 2.80 0.00 0.00 179.97 182.95 2a8d h LEU 212 N 0.27 0.00 -0.05 3.80 -0.00 -0.73 -2.40 115.31 116.19 2a8d h LEU 212 Ca 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.97 2a8d h LEU 212 Cb 0.12 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.78 2a8d h LEU 212 CO -0.01 0.01 -0.02 -1.20 -0.00 0.00 0.00 178.44 177.23 2a8d n SER 213 N -3.17 0.10 -4.47 -0.43 7.64 -0.51 -4.62 113.62 108.16 2a8d n SER 213 Ca -0.02 -0.52 -0.43 0.00 1.01 0.00 0.00 58.87 58.91 2a8d n SER 213 Cb 0.16 -0.15 -0.04 0.00 -1.01 0.00 0.00 64.21 63.16 2a8d n SER 213 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2a8d s ILE 214 N -2.36 4.44 0.33 0.44 1.01 -0.91 -5.02 121.20 119.14 2a8d s ILE 214 Ca 0.35 -0.21 -0.15 0.00 0.00 0.00 0.00 60.65 60.64 2a8d s ILE 214 Cb 0.21 -4.58 -0.09 0.00 0.01 0.00 0.00 42.46 38.01 2a8d s ILE 214 CO 0.43 -1.25 0.74 -0.76 0.00 0.00 0.00 174.94 174.10 2a8d s LEU 215 N 3.78 4.05 0.26 2.97 1.43 -1.26 -5.02 118.68 124.89 2a8d s LEU 215 Ca 0.23 1.29 -0.29 0.00 -1.03 0.00 0.00 54.13 54.32 2a8d s LEU 215 Cb -0.16 -4.09 -0.10 0.00 0.03 0.00 0.00 46.19 41.87 2a8d s LEU 215 CO 0.13 -0.21 1.28 -1.81 0.23 0.00 0.00 176.35 175.96 2a8d s ASP 216 N -2.29 6.90 0.49 2.29 1.01 -1.26 -4.90 116.67 118.91 2a8d s ASP 216 Ca 0.54 2.50 0.22 0.00 0.71 0.00 0.00 52.55 56.52 2a8d s ASP 216 Cb -0.10 -2.63 1.27 0.00 1.01 0.00 0.00 42.92 42.47 2a8d s ASP 216 CO 0.18 -0.47 1.95 -0.33 0.21 0.00 0.00 175.17 176.70 2a8d h GLU 217 N 4.37 0.17 0.00 8.23 5.08 -1.98 -0.96 114.58 129.49 2a8d h GLU 217 Ca -0.47 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 57.88 2a8d h GLU 217 Cb 1.22 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.43 2a8d h GLU 217 CO 0.71 0.11 0.00 -0.85 -1.00 0.00 0.00 179.01 177.98 2a8d n GLU 218 N -4.41 0.01 -0.11 2.33 0.00 -1.26 -3.09 120.64 114.11 2a8d n GLU 218 Ca 0.13 0.16 0.05 0.00 0.00 0.00 0.00 57.16 57.50 2a8d n GLU 218 Cb 0.63 -1.51 0.10 0.00 0.00 0.00 0.00 31.44 30.67 2a8d n GLU 218 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 2a8d n ASN 219 N -1.52 2.49 -4.76 -1.84 5.03 -0.37 -5.03 115.26 109.26 2a8d n ASN 219 Ca 0.05 -1.83 -0.39 0.00 0.87 0.00 0.00 54.58 53.27 2a8d n ASN 219 Cb 0.23 -0.14 -0.05 0.00 -1.02 0.00 0.00 39.78 38.80 2a8d n ASN 219 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2a8d s ILE 220 N -0.94 4.70 -1.85 2.41 1.01 -1.18 -1.37 121.20 123.99 2a8d s ILE 220 Ca 0.17 1.50 0.15 0.00 0.00 0.00 0.00 60.65 62.47 2a8d s ILE 220 Cb 0.09 -4.05 0.12 0.00 0.01 0.00 0.00 42.46 38.63 2a8d s ILE 220 CO 0.13 0.43 0.97 0.18 0.00 0.00 0.00 174.94 176.65