#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ds8 h LEU 12 N 0.00 0.52 -0.71 -2.67 6.46 -2.05 -2.09 115.31 114.76 1ds8 h LEU 12 Ca 0.00 -0.08 0.05 0.00 -0.12 0.00 0.00 57.88 57.73 1ds8 h LEU 12 Cb 0.00 -0.13 -0.05 0.00 -0.73 0.00 0.00 40.66 39.75 1ds8 h LEU 12 CO 0.00 0.45 0.43 0.00 -0.62 0.00 0.00 178.44 178.70 1ds8 h ALA 13 N 1.09 0.95 -0.68 1.25 0.00 -2.05 -0.21 119.26 119.60 1ds8 h ALA 13 Ca 0.15 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 1ds8 h ALA 13 Cb 0.04 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 1ds8 h ALA 13 CO -0.03 0.16 0.26 0.77 0.00 0.00 0.00 179.25 180.41 1ds8 h SER 14 N 0.80 0.95 -0.38 0.00 0.02 -1.93 -1.04 113.55 111.97 1ds8 h SER 14 Ca 0.30 -0.18 -0.11 0.00 -0.84 0.00 0.00 61.79 60.96 1ds8 h SER 14 Cb 0.11 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.39 1ds8 h SER 14 CO -0.15 0.88 -0.17 0.25 -1.14 0.00 0.00 176.83 176.50 1ds8 h LEU 15 N 0.97 0.86 0.09 5.07 5.85 -0.92 -1.08 115.31 126.15 1ds8 h LEU 15 Ca 0.22 -0.29 -0.00 0.00 0.84 0.00 0.00 57.88 58.65 1ds8 h LEU 15 Cb 0.23 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.03 1ds8 h LEU 15 CO -0.02 1.02 -0.04 0.00 -0.34 0.00 0.00 178.44 179.06 1ds8 h ALA 16 N 1.05 -0.13 -0.41 1.25 0.00 -0.67 0.94 119.26 121.29 1ds8 h ALA 16 Ca 0.11 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.88 1ds8 h ALA 16 Cb 0.69 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 1ds8 h ALA 16 CO 0.05 -0.55 -0.15 0.97 0.00 0.00 0.00 179.25 179.57 1ds8 h ILE 17 N -0.16 1.26 -0.34 0.00 6.09 -1.15 0.10 117.51 123.31 1ds8 h ILE 17 Ca -0.01 -1.22 -0.02 0.00 -1.37 0.00 0.00 64.86 62.23 1ds8 h ILE 17 Cb 0.13 1.11 -0.01 0.00 0.47 0.00 0.00 36.82 38.52 1ds8 h ILE 17 CO 0.02 0.41 0.12 0.22 -3.07 0.00 0.00 178.15 175.85 1ds8 h TYR 18 N 0.67 0.54 -0.58 2.19 3.20 -1.01 -2.77 116.97 119.22 1ds8 h TYR 18 Ca 0.11 -0.05 -0.04 0.00 3.14 0.00 0.00 58.73 61.88 1ds8 h TYR 18 Cb 0.63 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.72 1ds8 h TYR 18 CO 0.03 0.52 0.19 0.77 -1.64 0.00 0.00 178.16 178.03 1ds8 h SER 19 N 0.40 0.83 -0.38 -2.11 0.02 -0.55 -3.04 113.55 108.73 1ds8 h SER 19 Ca 0.11 -0.20 0.07 0.00 -0.84 0.00 0.00 61.79 60.93 1ds8 h SER 19 Cb 0.22 -0.22 -0.07 0.00 0.14 0.00 0.00 62.40 62.48 1ds8 h SER 19 CO -0.01 0.81 -0.08 0.15 -1.14 0.00 0.00 176.83 176.57 1ds8 h PHE 20 N 0.81 -0.17 -0.74 3.45 3.57 -0.74 -0.79 116.94 122.32 1ds8 h PHE 20 Ca 0.19 0.03 0.04 0.00 3.53 0.00 0.00 57.97 61.76 1ds8 h PHE 20 Cb 0.28 0.13 -0.04 0.00 2.79 0.00 0.00 35.95 39.11 1ds8 h PHE 20 CO 0.02 -0.15 0.49 -1.49 -2.23 0.00 0.00 178.31 174.95 1ds8 h TRP 21 N 0.01 0.86 0.60 0.41 4.06 -1.42 0.41 115.95 120.90 1ds8 h TRP 21 Ca 0.18 0.02 -0.03 0.00 2.06 0.00 0.00 58.89 61.12 1ds8 h TRP 21 Cb 0.27 -0.29 0.01 0.00 -1.00 0.00 0.00 29.16 28.15 1ds8 h TRP 21 CO -0.33 0.50 -0.29 0.82 -3.56 0.00 0.00 178.44 175.58 1ds8 h ILE 22 N 0.89 0.40 -0.54 1.49 1.08 -1.14 -1.12 117.51 118.57 1ds8 h ILE 22 Ca 0.30 -0.06 0.11 0.00 -0.39 0.00 0.00 64.86 64.82 1ds8 h ILE 22 Cb 0.08 0.42 -0.09 0.00 -3.07 0.00 0.00 36.82 34.16 1ds8 h ILE 22 CO -0.09 0.01 -0.01 0.15 -0.69 0.00 0.00 178.15 177.52 1ds8 h PHE 23 N -0.85 -0.06 -0.99 1.37 3.57 -0.29 -1.23 116.94 118.45 1ds8 h PHE 23 Ca -0.08 0.04 0.02 0.00 3.53 0.00 0.00 57.97 61.48 1ds8 h PHE 23 Cb 0.64 0.11 -0.05 0.00 2.79 0.00 0.00 35.95 39.43 1ds8 h PHE 23 CO -0.03 -0.14 0.65 1.25 -2.23 0.00 0.00 178.31 177.82 1ds8 h LEU 24 N 0.10 1.12 -0.72 0.59 5.85 0.03 0.25 115.31 122.53 1ds8 h LEU 24 Ca 0.27 -0.02 -0.10 0.00 0.84 0.00 0.00 57.88 58.87 1ds8 h LEU 24 Cb 0.42 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.16 1ds8 h LEU 24 CO -0.47 0.80 -0.07 0.00 -0.34 0.00 0.00 178.44 178.36 1ds8 h ALA 25 N 1.38 0.92 -0.28 1.25 0.00 -0.44 -0.51 119.26 121.58 1ds8 h ALA 25 Ca 0.37 -0.32 -0.13 0.00 0.00 0.00 0.00 54.91 54.83 1ds8 h ALA 25 Cb -0.10 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 1ds8 h ALA 25 CO -0.09 0.63 -0.37 0.78 0.00 0.00 0.00 179.25 180.19 1ds8 h GLY 26 N 0.98 0.70 0.75 0.00 0.00 -0.31 -1.66 103.07 103.52 1ds8 h GLY 26 Ca 0.14 -0.68 -0.03 0.00 0.00 0.00 0.00 47.33 46.76 1ds8 h GLY 26 CO 0.04 0.62 -0.04 -2.00 0.00 0.00 0.00 176.54 175.16 1ds8 h LEU 27 N 0.53 0.27 -1.00 3.11 5.85 -0.23 -1.21 115.31 122.64 1ds8 h LEU 27 Ca 0.05 -0.37 0.05 0.00 0.84 0.00 0.00 57.88 58.45 1ds8 h LEU 27 Cb 0.89 -0.07 -0.06 0.00 0.37 0.00 0.00 40.66 41.78 1ds8 h LEU 27 CO 0.08 0.58 0.65 0.40 -0.34 0.00 0.00 178.44 179.81 1ds8 h ILE 28 N -0.04 1.15 -0.04 4.05 2.04 -1.05 0.35 117.51 123.97 1ds8 h ILE 28 Ca 0.04 -0.42 0.00 0.00 1.00 0.00 0.00 64.86 65.47 1ds8 h ILE 28 Cb 0.46 -0.20 -0.00 0.00 -0.74 0.00 0.00 36.82 36.34 1ds8 h ILE 28 CO 0.01 0.23 0.02 0.22 0.00 0.00 0.00 178.15 178.63 1ds8 h TYR 29 N 1.24 0.04 -0.05 1.37 3.20 -1.11 -0.44 116.97 121.22 1ds8 h TYR 29 Ca 0.41 0.00 0.01 0.00 3.14 0.00 0.00 58.73 62.29 1ds8 h TYR 29 Cb 0.06 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.30 1ds8 h TYR 29 CO -0.00 0.03 -0.02 -0.92 -1.64 0.00 0.00 178.16 175.60 1ds8 h TYR 30 N 0.05 -0.05 -0.23 -3.82 3.20 -0.28 -2.12 116.97 113.72 1ds8 h TYR 30 Ca 0.01 0.01 0.04 0.00 3.14 0.00 0.00 58.73 61.92 1ds8 h TYR 30 Cb -0.00 0.03 -0.03 0.00 1.54 0.00 0.00 36.73 38.26 1ds8 h TYR 30 CO -0.08 -0.04 0.02 -0.07 -1.64 0.00 0.00 178.16 176.35 1ds8 h LEU 31 N -0.02 -0.05 0.03 2.82 3.38 -0.14 -1.19 115.31 120.14 1ds8 h LEU 31 Ca 0.03 0.05 0.01 0.00 0.09 0.00 0.00 57.88 58.05 1ds8 h LEU 31 Cb 0.06 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 1ds8 h LEU 31 CO -0.06 0.00 -0.08 -0.61 0.09 0.00 0.00 178.44 177.78 1ds8 h GLN 32 N 0.09 -0.15 -0.69 1.13 5.75 -0.95 -1.13 115.11 119.16 1ds8 h GLN 32 Ca 0.11 0.01 -0.02 0.00 -0.15 0.00 0.00 58.65 58.60 1ds8 h GLN 32 Cb 0.13 0.03 -0.03 0.00 1.07 0.00 0.00 27.48 28.68 1ds8 h GLN 32 CO -0.17 -0.10 0.35 1.79 -2.65 0.00 0.00 178.83 178.05 1ds8 h THR 33 N -0.16 1.21 0.00 2.39 1.35 -1.30 -0.76 112.91 115.65 1ds8 h THR 33 Ca 0.02 -0.58 -0.02 0.00 -0.55 0.00 0.00 66.41 65.29 1ds8 h THR 33 Cb 0.18 0.31 -0.00 0.00 -1.73 0.00 0.00 68.15 66.91 1ds8 h THR 33 CO -0.06 0.25 -0.09 -0.08 -0.25 0.00 0.00 175.52 175.28 1ds8 h GLU 34 N 0.97 0.00 -0.79 4.72 4.57 -0.70 -1.13 114.58 122.21 1ds8 h GLU 34 Ca 0.24 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.40 1ds8 h GLU 34 Cb 0.07 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.64 1ds8 h GLU 34 CO -0.03 0.09 0.03 0.09 -1.18 0.00 0.00 179.01 178.01 1ds8 n ASN 35 N -4.27 3.60 -0.35 1.04 3.02 -0.30 -3.65 115.26 114.36 1ds8 n ASN 35 Ca -0.03 -2.54 0.09 0.00 -0.03 0.00 0.00 54.58 52.07 1ds8 n ASN 35 Cb 0.17 -0.61 0.17 0.00 -0.61 0.00 0.00 39.78 38.90 1ds8 n ASN 35 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 1ds8 n MET 36 N 0.28 1.98 0.00 3.52 2.81 -0.43 -4.61 117.12 120.68 1ds8 n MET 36 Ca 0.17 -2.57 0.08 0.00 -1.81 0.00 0.00 57.70 53.57 1ds8 n MET 36 Cb 0.81 -1.56 0.38 0.00 -0.71 0.00 0.00 33.22 32.13 1ds8 n MET 36 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 1ds8 n ARG 37 N -1.01 0.07 -3.83 0.03 3.00 -1.24 -4.45 116.66 109.23 1ds8 n ARG 37 Ca 0.16 0.19 -0.12 0.00 -0.01 0.00 0.00 57.85 58.07 1ds8 n ARG 37 Cb 0.68 -1.50 -0.11 0.00 0.00 0.00 0.00 32.46 31.54 1ds8 n ARG 37 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.63 176.42 1ds8 s GLU 38 N -2.88 0.40 0.00 5.56 0.41 -1.26 -4.17 118.70 116.75 1ds8 s GLU 38 Ca 0.10 -0.11 0.00 0.00 -0.41 0.00 0.00 54.97 54.55 1ds8 s GLU 38 Cb 0.11 0.17 0.00 0.00 -1.78 0.00 0.00 34.13 32.63 1ds8 s GLU 38 CO 0.29 -0.09 0.00 0.41 -0.49 0.00 0.00 175.26 175.39 1ds8 n GLY 39 N 2.05 2.19 3.62 -1.39 0.00 -1.26 -5.03 105.19 105.38 1ds8 n GLY 39 Ca -0.19 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.58 1ds8 n GLY 39 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ds8 s TYR 40 N -2.64 2.73 0.74 1.61 1.51 -1.26 -4.31 117.35 115.72 1ds8 s TYR 40 Ca 0.00 -0.19 -0.14 0.00 -1.01 0.00 0.00 57.07 55.73 1ds8 s TYR 40 Cb 0.00 -1.29 0.04 0.00 -0.11 0.00 0.00 41.96 40.60 1ds8 s TYR 40 CO 0.00 0.54 1.15 -2.14 -1.11 0.00 0.00 175.55 174.00 1ds8 s PRO 41 N -3.10 2.20 0.60 -1.71 0.02 -1.26 -4.82 135.00 126.93 1ds8 s PRO 41 Ca 0.28 1.55 -0.17 0.00 0.02 0.00 0.00 61.00 62.67 1ds8 s PRO 41 Cb -0.08 -1.86 -0.03 0.00 0.02 0.00 0.00 34.50 32.55 1ds8 s PRO 41 CO 0.18 -1.75 1.12 -0.51 -0.33 0.00 0.00 177.00 175.71 1ds8 s LEU 42 N -5.36 3.57 0.30 -5.54 1.43 -1.26 -4.95 118.68 106.88 1ds8 s LEU 42 Ca 0.69 2.10 0.08 0.00 -1.03 0.00 0.00 54.13 55.97 1ds8 s LEU 42 Cb -0.24 -4.57 -0.06 0.00 0.03 0.00 0.00 46.19 41.35 1ds8 s LEU 42 CO 0.47 -1.43 -0.08 -1.61 0.23 0.00 0.00 176.35 173.93 1ds8 s GLU 43 N -3.67 1.65 0.52 1.70 2.02 -1.26 -1.69 118.70 117.97 1ds8 s GLU 43 Ca 0.70 -1.84 -0.06 0.00 0.02 0.00 0.00 54.97 53.79 1ds8 s GLU 43 Cb -0.23 -1.37 -0.03 0.00 0.10 0.00 0.00 34.13 32.61 1ds8 s GLU 43 CO 0.34 0.08 0.85 -0.80 0.02 0.00 0.00 175.26 175.75 1ds8 s ASN 44 N -3.50 6.15 0.25 -0.19 0.01 0.19 -4.55 114.94 113.29 1ds8 s ASN 44 Ca 0.31 0.98 0.14 0.00 -0.71 0.00 0.00 52.86 53.58 1ds8 s ASN 44 Cb 0.03 -2.20 0.77 0.00 0.41 0.00 0.00 41.25 40.26 1ds8 s ASN 44 CO 0.14 -0.71 1.38 -0.62 -1.51 0.00 0.00 177.10 175.78 1ds8 n GLU 45 N -2.40 0.09 0.00 -0.60 1.02 -1.26 -0.45 120.64 117.04 1ds8 n GLU 45 Ca 0.02 0.57 0.13 0.00 -0.02 0.00 0.00 57.16 57.85 1ds8 n GLU 45 Cb 0.55 -1.93 0.30 0.00 -0.02 0.00 0.00 31.44 30.35 1ds8 n GLU 45 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1ds8 n ASP 46 N -2.01 1.30 0.00 1.62 5.75 -1.26 -4.95 116.55 117.00 1ds8 n ASP 46 Ca -0.01 -1.08 0.00 0.00 -0.01 0.00 0.00 54.79 53.69 1ds8 n ASP 46 Cb 0.14 0.20 0.00 0.00 -1.03 0.00 0.00 41.12 40.43 1ds8 n ASP 46 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ds8 n GLY 47 N 1.35 2.81 3.81 6.12 0.00 0.40 -5.08 105.19 114.60 1ds8 n GLY 47 Ca 0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 1ds8 n GLY 47 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ds8 s THR 48 N -2.63 4.06 0.11 2.61 -4.23 -1.26 -4.68 115.64 109.62 1ds8 s THR 48 Ca 0.00 1.04 -0.33 0.00 -1.18 0.00 0.00 61.69 61.22 1ds8 s THR 48 Cb 0.00 -3.51 -0.13 0.00 1.34 0.00 0.00 72.50 70.21 1ds8 s THR 48 CO 0.00 -0.51 1.71 -2.65 -0.54 0.00 0.00 174.62 172.63 1ds8 n PRO 49 N -1.66 2.38 -2.33 3.99 -0.02 -1.26 0.54 135.00 136.64 1ds8 n PRO 49 Ca 0.08 0.86 -0.36 0.00 -2.02 0.00 0.00 63.50 62.07 1ds8 n PRO 49 Cb 0.53 -2.68 -0.01 0.00 -0.02 0.00 0.00 33.50 31.32 1ds8 n PRO 49 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ds8 s ALA 50 N 1.93 2.83 0.03 3.55 0.00 -0.68 -4.63 121.76 124.79 1ds8 s ALA 50 Ca 0.82 0.81 -0.26 0.00 0.00 0.00 0.00 51.96 53.32 1ds8 s ALA 50 Cb -0.61 -3.34 -0.17 0.00 0.00 0.00 0.00 23.12 18.99 1ds8 s ALA 50 CO 0.39 -0.62 1.38 0.00 0.00 0.00 0.00 175.76 176.92 1ds8 h ALA 51 N 1.59 -0.35 -1.90 0.00 0.00 -1.92 -3.40 119.26 113.28 1ds8 h ALA 51 Ca -0.50 -0.16 -0.60 0.00 0.00 0.00 0.00 54.91 53.66 1ds8 h ALA 51 Cb 1.25 0.14 -0.10 0.00 0.00 0.00 0.00 17.79 19.07 1ds8 h ALA 51 CO 0.59 -0.57 0.62 1.21 0.00 0.00 0.00 179.25 181.09 1ds8 s ASN 52 N -5.08 6.51 0.00 0.00 3.84 -1.26 -4.86 114.94 114.09 1ds8 s ASN 52 Ca -0.15 0.16 0.23 0.00 0.21 0.00 0.00 52.86 53.31 1ds8 s ASN 52 Cb 0.03 -2.46 0.30 0.00 -0.55 0.00 0.00 41.25 38.57 1ds8 s ASN 52 CO 0.59 -1.07 1.31 0.00 -2.79 0.00 0.00 177.10 175.14 1ds8 n GLN 53 N 7.24 2.37 0.00 0.43 1.13 -1.26 -4.91 117.38 122.38 1ds8 n GLN 53 Ca 0.07 -2.08 0.00 0.00 -1.94 0.00 0.00 57.00 53.04 1ds8 n GLN 53 Cb 0.49 -1.48 0.00 0.00 0.11 0.00 0.00 30.24 29.36 1ds8 n GLN 53 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1ds8 n GLY 54 N 1.40 -0.58 0.12 1.08 0.00 -1.26 -4.72 105.19 101.24 1ds8 n GLY 54 Ca 0.16 -1.74 -0.19 0.00 0.00 0.00 0.00 46.02 44.25 1ds8 n GLY 54 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ds8 h PRO 55 N 0.00 0.38 -6.26 1.61 0.13 -2.03 -3.45 132.00 122.38 1ds8 h PRO 55 Ca 0.00 -0.63 -0.55 0.00 -0.87 0.00 0.00 66.00 63.95 1ds8 h PRO 55 Cb 0.00 0.23 -0.02 0.00 0.13 0.00 0.00 31.00 31.34 1ds8 h PRO 55 CO 0.00 1.30 0.89 -0.06 -0.23 0.00 0.00 178.00 179.89 1ds8 s PHE 56 N -2.67 2.74 0.54 1.56 0.08 -1.26 -5.01 117.98 113.95 1ds8 s PHE 56 Ca -0.06 0.83 -0.13 0.00 0.12 0.00 0.00 56.93 57.69 1ds8 s PHE 56 Cb 0.06 -3.61 -0.06 0.00 -0.57 0.00 0.00 43.02 38.84 1ds8 s PHE 56 CO 0.91 -2.25 0.96 -1.25 -0.10 0.00 0.00 175.22 173.48 1ds8 s PRO 57 N 3.10 3.77 0.40 0.24 0.04 -1.26 -5.01 135.00 136.28 1ds8 s PRO 57 Ca 0.61 0.77 -0.27 0.00 0.04 0.00 0.00 61.00 62.15 1ds8 s PRO 57 Cb -0.27 -2.16 -0.09 0.00 0.04 0.00 0.00 34.50 32.02 1ds8 s PRO 57 CO 0.22 -0.35 1.38 -0.51 0.04 0.00 0.00 177.00 177.78 1ds8 s LEU 58 N -4.50 4.25 0.77 -3.56 1.43 -1.26 -4.79 118.68 111.02 1ds8 s LEU 58 Ca 0.56 2.82 -0.11 0.00 -1.03 0.00 0.00 54.13 56.37 1ds8 s LEU 58 Cb -0.10 -3.81 0.05 0.00 0.03 0.00 0.00 46.19 42.36 1ds8 s LEU 58 CO 0.41 -0.89 1.09 -2.16 0.23 0.00 0.00 176.35 175.03 1ds8 s PRO 59 N -2.18 2.35 0.48 1.29 0.04 -1.26 -5.02 135.00 130.70 1ds8 s PRO 59 Ca 0.56 0.66 -0.20 0.00 0.04 0.00 0.00 61.00 62.06 1ds8 s PRO 59 Cb -0.42 -1.95 -0.09 0.00 0.04 0.00 0.00 34.50 32.09 1ds8 s PRO 59 CO 0.55 -1.44 1.02 -1.59 0.04 0.00 0.00 177.00 175.57 1ds8 s LYS 60 N -5.17 3.87 0.47 4.56 -2.85 -1.26 -4.62 119.74 114.75 1ds8 s LYS 60 Ca 0.60 1.27 -0.22 0.00 -1.00 0.00 0.00 55.97 56.62 1ds8 s LYS 60 Cb -0.14 -2.11 -0.10 0.00 -2.06 0.00 0.00 37.83 33.42 1ds8 s LYS 60 CO 0.54 -0.36 0.76 -2.30 0.10 0.00 0.00 175.35 174.09 1ds8 n PRO 61 N -1.01 0.87 -4.11 1.78 -0.02 -1.26 -4.68 135.00 126.57 1ds8 n PRO 61 Ca 0.09 0.32 -0.15 0.00 -2.02 0.00 0.00 63.50 61.74 1ds8 n PRO 61 Cb 0.53 -1.82 -0.12 0.00 -0.02 0.00 0.00 33.50 32.07 1ds8 n PRO 61 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 1ds8 s LYS 62 N -1.98 0.62 -0.14 -0.52 -2.85 -0.67 -4.96 119.74 109.24 1ds8 s LYS 62 Ca 0.66 -0.77 0.01 0.00 -1.00 0.00 0.00 55.97 54.87 1ds8 s LYS 62 Cb -0.53 -0.47 0.02 0.00 -2.06 0.00 0.00 37.83 34.79 1ds8 s LYS 62 CO 0.55 0.10 -0.16 0.99 0.10 0.00 0.00 175.35 176.93 1ds8 s THR 63 N -1.24 1.66 -0.08 3.79 2.01 -1.26 -1.96 115.64 118.56 1ds8 s THR 63 Ca -0.07 -0.70 -0.20 0.00 0.31 0.00 0.00 61.69 61.03 1ds8 s THR 63 Cb -0.09 -1.52 -0.04 0.00 0.01 0.00 0.00 72.50 70.85 1ds8 s THR 63 CO 0.01 0.47 0.54 -0.36 -0.69 0.00 0.00 174.62 174.60 1ds8 s PHE 64 N 1.26 3.58 -0.40 4.92 0.08 0.13 -4.90 117.98 122.64 1ds8 s PHE 64 Ca 0.01 1.04 -0.17 0.00 0.12 0.00 0.00 56.93 57.92 1ds8 s PHE 64 Cb -0.14 -2.60 0.01 0.00 -0.57 0.00 0.00 43.02 39.73 1ds8 s PHE 64 CO -0.08 0.22 0.42 0.42 -0.10 0.00 0.00 175.22 176.10 1ds8 s ILE 65 N 0.38 5.11 0.19 0.64 1.01 -1.26 -1.13 121.20 126.13 1ds8 s ILE 65 Ca 0.29 -0.28 -0.25 0.00 0.00 0.00 0.00 60.65 60.42 1ds8 s ILE 65 Cb -0.16 -3.99 -0.08 0.00 0.01 0.00 0.00 42.46 38.23 1ds8 s ILE 65 CO 0.14 -0.35 0.79 -0.76 0.00 0.00 0.00 174.94 174.75 1ds8 s LEU 66 N 2.10 4.55 0.83 2.97 1.43 -0.42 -5.01 118.68 125.12 1ds8 s LEU 66 Ca 0.12 1.64 -0.11 0.00 -1.03 0.00 0.00 54.13 54.75 1ds8 s LEU 66 Cb -0.17 -3.39 0.09 0.00 0.03 0.00 0.00 46.19 42.75 1ds8 s LEU 66 CO 0.13 0.17 1.09 -2.84 0.23 0.00 0.00 176.35 175.13 1ds8 s PRO 67 N -1.31 1.81 -1.06 1.29 0.02 -1.26 -4.15 135.00 130.33 1ds8 s PRO 67 Ca 0.38 0.97 -0.20 0.00 0.02 0.00 0.00 61.00 62.16 1ds8 s PRO 67 Cb -0.22 -1.86 0.02 0.00 0.02 0.00 0.00 34.50 32.46 1ds8 s PRO 67 CO 0.26 -1.90 0.69 0.72 -0.33 0.00 0.00 177.00 176.44 1ds8 n HIS 68 N -3.67 -1.77 -4.05 6.54 8.25 -1.26 -2.78 115.22 116.48 1ds8 n HIS 68 Ca 0.08 0.42 -0.32 0.00 -0.26 0.00 0.00 57.72 57.63 1ds8 n HIS 68 Cb 0.54 -2.98 -0.00 0.00 1.12 0.00 0.00 29.99 28.67 1ds8 n HIS 68 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ds8 n GLY 69 N -1.87 -0.45 0.99 -1.41 0.00 -1.26 -4.86 105.19 96.34 1ds8 n GLY 69 Ca -0.16 0.16 0.08 0.00 0.00 0.00 0.00 46.02 46.10 1ds8 n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ds8 n ARG 70 N -4.52 3.14 0.00 1.61 1.74 -1.12 -5.07 116.66 112.44 1ds8 n ARG 70 Ca 0.02 -2.55 0.00 0.00 -0.77 0.00 0.00 57.85 54.55 1ds8 n ARG 70 Cb 0.53 -1.63 0.00 0.00 -1.02 0.00 0.00 32.46 30.33 1ds8 n ARG 70 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ds8 n GLY 71 N 0.35 1.02 3.22 -0.13 0.00 -1.26 -4.82 105.19 103.57 1ds8 n GLY 71 Ca 0.19 -0.76 -0.13 0.00 0.00 0.00 0.00 46.02 45.31 1ds8 n GLY 71 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ds8 s THR 72 N 0.00 0.03 -0.04 2.61 -4.23 -1.26 -1.31 115.64 111.45 1ds8 s THR 72 Ca 0.00 -2.00 -0.01 0.00 -1.18 0.00 0.00 61.69 58.50 1ds8 s THR 72 Cb 0.00 -2.51 0.03 0.00 1.34 0.00 0.00 72.50 71.36 1ds8 s THR 72 CO 0.00 0.00 0.04 -0.22 -0.54 0.00 0.00 174.62 173.90 1ds8 s LEU 73 N -3.20 0.54 -0.16 4.79 1.98 -0.29 -4.91 118.68 117.44 1ds8 s LEU 73 Ca 0.39 0.04 0.01 0.00 -2.89 0.00 0.00 54.13 51.68 1ds8 s LEU 73 Cb 0.06 -0.16 0.00 0.00 0.66 0.00 0.00 46.19 46.75 1ds8 s LEU 73 CO 0.14 -0.20 -0.18 -0.89 -1.89 0.00 0.00 176.35 173.34 1ds8 s THR 74 N 1.74 2.43 0.00 3.68 2.01 -1.26 0.22 115.64 124.46 1ds8 s THR 74 Ca -0.00 -0.85 0.01 0.00 0.31 0.00 0.00 61.69 61.16 1ds8 s THR 74 Cb -0.12 -2.01 -0.00 0.00 0.01 0.00 0.00 72.50 70.37 1ds8 s THR 74 CO -0.03 0.52 -0.02 0.68 -0.69 0.00 0.00 174.62 175.08 1ds8 s VAL 75 N 0.90 0.17 0.69 3.82 -7.23 -0.83 -3.80 120.40 114.13 1ds8 s VAL 75 Ca -0.04 -0.17 -0.15 0.00 -1.81 0.00 0.00 61.98 59.81 1ds8 s VAL 75 Cb -0.15 -0.17 0.02 0.00 0.56 0.00 0.00 36.38 36.64 1ds8 s VAL 75 CO -0.02 0.00 1.16 -2.84 -0.31 0.00 0.00 175.10 173.09 1ds8 s PRO 76 N -0.18 2.48 0.29 4.82 0.02 -1.26 -1.66 135.00 139.50 1ds8 s PRO 76 Ca -0.01 1.59 -0.16 0.00 0.02 0.00 0.00 61.00 62.44 1ds8 s PRO 76 Cb -0.02 -1.89 0.01 0.00 0.02 0.00 0.00 34.50 32.62 1ds8 s PRO 76 CO -0.00 -1.53 0.61 0.20 -0.33 0.00 0.00 177.00 175.95 1ds8 s GLY 77 N -2.27 0.35 0.24 0.52 0.00 -1.25 -4.79 107.32 100.12 1ds8 s GLY 77 Ca 0.71 -0.69 -0.31 0.00 0.00 0.00 0.00 44.72 44.42 1ds8 s GLY 77 CO 0.43 -0.41 1.53 -1.05 0.00 0.00 0.00 173.10 173.60 1ds8 n PRO 78 N -0.45 2.34 -1.68 2.90 -0.02 -1.26 -4.84 135.00 132.00 1ds8 n PRO 78 Ca -0.03 0.84 -0.53 0.00 -2.02 0.00 0.00 63.50 61.76 1ds8 n PRO 78 Cb 0.60 -2.57 -0.06 0.00 -0.02 0.00 0.00 33.50 31.46 1ds8 n PRO 78 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1ds8 n GLU 79 N 2.47 1.56 -0.06 -0.52 4.07 -1.26 -4.88 120.64 122.02 1ds8 n GLU 79 Ca 0.12 0.57 -0.11 0.00 -0.06 0.00 0.00 57.16 57.67 1ds8 n GLU 79 Cb 0.33 -2.30 -0.05 0.00 -0.06 0.00 0.00 31.44 29.36 1ds8 n GLU 79 CO 0.00 0.00 0.00 0.66 -0.06 0.00 0.00 177.13 177.73 1ds8 h SER 80 N 7.18 0.33 -1.85 4.31 4.64 -2.02 -3.44 113.55 122.70 1ds8 h SER 80 Ca -0.47 -0.30 -0.66 0.00 -0.47 0.00 0.00 61.79 59.89 1ds8 h SER 80 Cb 1.30 -0.09 0.02 0.00 -0.31 0.00 0.00 62.40 63.33 1ds8 h SER 80 CO 0.92 0.55 0.95 1.21 -0.87 0.00 0.00 176.83 179.58 1ds8 n GLU 81 N -4.71 1.72 0.00 4.77 2.13 -1.26 -4.83 120.64 118.46 1ds8 n GLU 81 Ca -0.04 0.63 0.00 0.00 0.66 0.00 0.00 57.16 58.40 1ds8 n GLU 81 Cb 0.22 -2.39 0.00 0.00 0.27 0.00 0.00 31.44 29.54 1ds8 n GLU 81 CO 0.00 0.00 0.00 -0.40 -0.41 0.00 0.00 177.13 176.32 1ds8 n ASP 82 N 5.53 0.00 -4.67 4.31 5.68 -1.26 -5.11 116.55 121.03 1ds8 n ASP 82 Ca 0.23 -0.43 -0.31 0.00 -0.50 0.00 0.00 54.79 53.78 1ds8 n ASP 82 Cb 0.23 0.00 0.17 0.00 -1.14 0.00 0.00 41.12 40.38 1ds8 n ASP 82 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1ds8 s ARG 83 N 0.00 0.93 0.21 0.11 1.70 -1.26 -4.94 118.95 115.69 1ds8 s ARG 83 Ca 0.00 1.50 -0.30 0.00 -0.47 0.00 0.00 55.73 56.46 1ds8 s ARG 83 Cb 0.00 -1.72 -0.08 0.00 -0.57 0.00 0.00 34.95 32.57 1ds8 s ARG 83 CO 0.00 -2.68 1.19 -2.14 -1.08 0.00 0.00 175.30 170.60 1ds8 s PRO 84 N -4.65 4.50 -0.40 3.89 0.02 -1.26 -5.01 135.00 132.10 1ds8 s PRO 84 Ca 0.67 1.89 -0.10 0.00 0.02 0.00 0.00 61.00 63.48 1ds8 s PRO 84 Cb -0.23 -3.22 0.05 0.00 0.02 0.00 0.00 34.50 31.13 1ds8 s PRO 84 CO 0.58 -0.06 0.23 0.42 -0.33 0.00 0.00 177.00 177.85 1ds8 s ILE 85 N -0.26 4.39 -0.92 2.83 -1.09 -1.26 -5.00 121.20 119.89 1ds8 s ILE 85 Ca 0.52 -1.15 -0.06 0.00 -2.23 0.00 0.00 60.65 57.73 1ds8 s ILE 85 Cb -0.33 -3.57 -0.05 0.00 -1.58 0.00 0.00 42.46 36.92 1ds8 s ILE 85 CO 0.38 -0.38 2.13 0.00 -1.23 0.00 0.00 174.94 175.84 1ds8 n ALA 86 N 4.96 4.76 -2.78 9.38 0.00 -1.26 -4.83 120.51 130.75 1ds8 n ALA 86 Ca -0.11 -2.01 -0.14 0.00 0.00 0.00 0.00 53.44 51.17 1ds8 n ALA 86 Cb 0.44 -3.00 -0.11 0.00 0.00 0.00 0.00 19.45 16.78 1ds8 n ALA 86 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1ds8 s LEU 87 N 0.10 2.28 -0.01 0.00 1.43 -1.26 -0.75 118.68 120.46 1ds8 s LEU 87 Ca 0.40 -0.60 0.05 0.00 -1.03 0.00 0.00 54.13 52.96 1ds8 s LEU 87 Cb 0.10 -0.25 -0.01 0.00 0.03 0.00 0.00 46.19 46.06 1ds8 s LEU 87 CO -0.03 -0.19 -0.17 0.00 0.23 0.00 0.00 176.35 176.19 1ds8 s ALA 88 N -1.49 1.41 0.46 4.21 0.00 0.10 -4.84 121.76 121.61 1ds8 s ALA 88 Ca -0.06 -0.74 -0.23 0.00 0.00 0.00 0.00 51.96 50.92 1ds8 s ALA 88 Cb -0.09 -0.35 -0.10 0.00 0.00 0.00 0.00 23.12 22.58 1ds8 s ALA 88 CO 0.01 0.34 0.94 -2.13 0.00 0.00 0.00 175.76 174.92 1ds8 n ARG 89 N 2.60 1.17 -0.00 0.00 0.63 -1.26 -1.66 116.66 118.14 1ds8 n ARG 89 Ca -0.15 0.43 0.05 0.00 -0.92 0.00 0.00 57.85 57.26 1ds8 n ARG 89 Cb 0.54 -2.00 -0.07 0.00 0.45 0.00 0.00 32.46 31.38 1ds8 n ARG 89 CO 0.00 0.00 0.00 2.41 -2.51 0.00 0.00 177.63 177.53 1ds8 n THR 90 N -0.78 0.00 -4.00 5.15 -1.04 -1.18 -4.80 114.28 107.64 1ds8 n THR 90 Ca 0.10 -0.22 -0.09 0.00 -2.04 0.00 0.00 64.05 61.80 1ds8 n THR 90 Cb 0.41 0.33 -0.08 0.00 -1.82 0.00 0.00 70.33 69.16 1ds8 n THR 90 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ds8 s ALA 91 N -2.61 0.23 0.14 2.41 0.00 -1.26 -5.05 121.76 115.62 1ds8 s ALA 91 Ca -0.03 -1.00 -0.03 0.00 0.00 0.00 0.00 51.96 50.90 1ds8 s ALA 91 Cb 0.06 0.58 -0.07 0.00 0.00 0.00 0.00 23.12 23.69 1ds8 s ALA 91 CO 0.40 -0.50 1.32 0.28 0.00 0.00 0.00 175.76 177.26 1ds8 h VAL 92 N 2.84 1.41 -4.11 0.00 2.07 -2.01 -3.45 116.25 112.99 1ds8 h VAL 92 Ca -0.34 -2.45 -0.46 0.00 0.82 0.00 0.00 66.70 64.28 1ds8 h VAL 92 Cb 1.19 2.40 -0.00 0.00 -1.52 0.00 0.00 31.29 33.36 1ds8 h VAL 92 CO 0.58 0.73 0.36 -0.94 0.02 0.00 0.00 177.57 178.32 1ds8 s SER 93 N -7.05 6.73 0.88 0.57 1.04 -1.26 -5.06 113.70 109.55 1ds8 s SER 93 Ca -0.05 1.67 -0.12 0.00 0.48 0.00 0.00 55.95 57.93 1ds8 s SER 93 Cb 0.09 -2.53 0.12 0.00 0.10 0.00 0.00 66.02 63.80 1ds8 s SER 93 CO 0.86 -0.51 1.10 -1.61 0.98 0.00 0.00 173.24 174.06 1ds8 s GLU 94 N -3.53 1.36 0.00 4.02 0.41 -1.26 -4.27 118.70 115.43 1ds8 s GLU 94 Ca 0.61 0.70 0.00 0.00 -0.41 0.00 0.00 54.97 55.87 1ds8 s GLU 94 Cb -0.10 -1.83 0.00 0.00 -1.78 0.00 0.00 34.13 30.42 1ds8 s GLU 94 CO 0.21 -2.14 0.00 0.41 -0.49 0.00 0.00 175.26 173.25 1ds8 n GLY 95 N -1.45 0.67 3.66 -1.39 0.00 -1.26 -5.07 105.19 100.35 1ds8 n GLY 95 Ca 0.07 -0.05 -0.23 0.00 0.00 0.00 0.00 46.02 45.81 1ds8 n GLY 95 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ds8 s PHE 96 N -2.00 2.71 0.73 1.61 0.40 -1.26 -5.11 117.98 115.06 1ds8 s PHE 96 Ca 0.00 -0.23 -0.15 0.00 -0.60 0.00 0.00 56.93 55.95 1ds8 s PHE 96 Cb 0.00 -1.23 0.04 0.00 0.51 0.00 0.00 43.02 42.34 1ds8 s PHE 96 CO 0.00 0.60 1.21 -2.14 0.70 0.00 0.00 175.22 175.58 1ds8 s PRO 97 N -3.69 2.13 -0.24 0.24 0.02 -1.26 -4.83 135.00 127.37 1ds8 s PRO 97 Ca 0.32 1.75 -0.01 0.00 0.02 0.00 0.00 61.00 63.08 1ds8 s PRO 97 Cb -0.06 -1.83 0.03 0.00 0.02 0.00 0.00 34.50 32.66 1ds8 s PRO 97 CO 0.20 -1.84 -0.08 -1.01 -0.33 0.00 0.00 177.00 173.94 1ds8 s HIS 98 N -1.99 3.06 0.39 6.54 3.76 -1.26 -3.08 115.29 122.71 1ds8 s HIS 98 Ca 0.74 -1.65 -0.21 0.00 -0.15 0.00 0.00 55.06 53.79 1ds8 s HIS 98 Cb -0.29 -2.03 -0.10 0.00 1.11 0.00 0.00 32.58 31.26 1ds8 s HIS 98 CO 0.45 -0.75 0.90 0.00 -0.85 0.00 0.00 174.74 174.49 1ds8 s ALA 99 N 1.30 3.12 0.33 -1.40 0.00 -0.66 -4.62 121.76 119.82 1ds8 s ALA 99 Ca -0.00 0.35 -0.29 0.00 0.00 0.00 0.00 51.96 52.01 1ds8 s ALA 99 Cb -0.17 -3.08 -0.11 0.00 0.00 0.00 0.00 23.12 19.77 1ds8 s ALA 99 CO -0.05 0.18 1.43 -2.14 0.00 0.00 0.00 175.76 175.18 1ds8 s PRO 100 N -2.95 4.22 0.08 0.00 0.02 -1.26 0.03 135.00 135.14 1ds8 s PRO 100 Ca 0.58 2.41 0.11 0.00 0.02 0.00 0.00 61.00 64.12 1ds8 s PRO 100 Cb -0.11 -3.04 -0.16 0.00 0.02 0.00 0.00 34.50 31.21 1ds8 s PRO 100 CO 0.15 -0.41 1.05 1.79 -0.33 0.00 0.00 177.00 179.25 1ds8 h THR 101 N 3.16 1.14 0.00 0.99 1.35 -1.27 -3.45 112.91 114.83 1ds8 h THR 101 Ca -0.49 -2.81 0.00 0.00 -0.55 0.00 0.00 66.41 62.56 1ds8 h THR 101 Cb 1.23 2.53 0.00 0.00 -1.73 0.00 0.00 68.15 70.18 1ds8 h THR 101 CO 0.69 0.65 0.00 0.61 -0.25 0.00 0.00 175.52 177.22 1ds8 n GLY 102 N 1.40 4.17 3.55 5.82 0.00 -1.26 -5.08 105.19 113.79 1ds8 n GLY 102 Ca -0.06 -0.73 -0.42 0.00 0.00 0.00 0.00 46.02 44.81 1ds8 n GLY 102 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ds8 s ASP 103 N 1.00 6.38 0.28 1.61 -1.08 -1.26 -4.95 116.67 118.64 1ds8 s ASP 103 Ca 0.00 -0.06 -0.00 0.00 -0.52 0.00 0.00 52.55 51.97 1ds8 s ASP 103 Cb 0.00 -2.32 0.49 0.00 -1.46 0.00 0.00 42.92 39.63 1ds8 s ASP 103 CO 0.00 -0.66 1.86 1.55 0.52 0.00 0.00 175.17 178.44 1ds8 h PRO 104 N 8.63 1.05 0.07 4.34 0.13 -1.93 0.26 132.00 144.55 1ds8 h PRO 104 Ca -0.26 -0.06 -0.00 0.00 -0.87 0.00 0.00 66.00 64.80 1ds8 h PRO 104 Cb 1.11 -0.24 0.00 0.00 0.13 0.00 0.00 31.00 32.00 1ds8 h PRO 104 CO 0.85 0.69 -0.04 0.52 -0.23 0.00 0.00 178.00 179.80 1ds8 h MET 105 N 1.08 -0.10 -0.04 0.86 2.86 -1.92 -0.38 114.93 117.29 1ds8 h MET 105 Ca 0.47 0.01 -0.14 0.00 -2.06 0.00 0.00 59.70 57.97 1ds8 h MET 105 Cb 0.34 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.01 1ds8 h MET 105 CO -0.22 -0.02 -0.61 0.87 1.06 0.00 0.00 176.91 177.99 1ds8 h LYS 106 N -0.14 0.13 -0.00 1.72 1.57 -1.84 -3.18 116.57 114.82 1ds8 h LYS 106 Ca -0.01 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.68 1ds8 h LYS 106 Cb 0.12 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.44 1ds8 h LYS 106 CO 0.02 0.70 -0.23 -0.25 -0.57 0.00 0.00 179.45 179.12 1ds8 n ASP 107 N -3.84 0.39 -2.80 0.86 8.00 0.88 -4.98 116.55 115.06 1ds8 n ASP 107 Ca -0.02 -0.18 -0.12 0.00 0.71 0.00 0.00 54.79 55.18 1ds8 n ASP 107 Cb 0.61 -0.06 0.06 0.00 -0.02 0.00 0.00 41.12 41.71 1ds8 n ASP 107 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ds8 n GLY 108 N 1.42 -0.32 3.40 0.44 0.00 -0.18 -4.74 105.19 105.21 1ds8 n GLY 108 Ca 0.09 0.09 -0.20 0.00 0.00 0.00 0.00 46.02 46.01 1ds8 n GLY 108 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ds8 s VAL 109 N -3.27 0.96 0.00 1.61 -7.23 -1.05 -3.88 120.40 107.54 1ds8 s VAL 109 Ca 0.12 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.29 1ds8 s VAL 109 Cb -0.02 -2.72 0.00 0.00 0.56 0.00 0.00 36.38 34.20 1ds8 s VAL 109 CO 0.54 -0.01 0.00 0.61 -0.31 0.00 0.00 175.10 175.93 1ds8 n GLY 110 N -0.60 1.04 0.00 2.32 0.00 -1.26 -1.77 105.19 104.92 1ds8 n GLY 110 Ca -0.01 -0.66 0.04 0.00 0.00 0.00 0.00 46.02 45.38 1ds8 n GLY 110 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1ds8 n PRO 111 N 2.18 0.47 -0.23 1.61 -0.04 -1.26 -0.95 135.00 136.78 1ds8 n PRO 111 Ca 0.00 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.53 1ds8 n PRO 111 Cb 0.00 -1.24 0.20 0.00 -0.04 0.00 0.00 33.50 32.42 1ds8 n PRO 111 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ds8 n ALA 112 N -0.74 2.26 -1.22 0.55 0.00 -0.73 -2.27 120.51 118.36 1ds8 n ALA 112 Ca 0.05 -1.22 -0.33 0.00 0.00 0.00 0.00 53.44 51.94 1ds8 n ALA 112 Cb 0.02 -0.55 0.10 0.00 0.00 0.00 0.00 19.45 19.02 1ds8 n ALA 112 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1ds8 s SER 113 N -1.03 4.12 0.07 0.00 0.01 -0.13 -3.83 113.70 112.92 1ds8 s SER 113 Ca 0.30 2.17 -0.06 0.00 1.31 0.00 0.00 55.95 59.66 1ds8 s SER 113 Cb 0.16 -2.57 -0.01 0.00 0.21 0.00 0.00 66.02 63.81 1ds8 s SER 113 CO 0.19 -2.30 0.12 -1.66 0.41 0.00 0.00 173.24 170.00 1ds8 s TRP 114 N -2.35 0.24 0.05 2.43 1.48 -1.25 -4.33 118.94 115.21 1ds8 s TRP 114 Ca 0.69 -0.67 0.05 0.00 -1.06 0.00 0.00 56.10 55.12 1ds8 s TRP 114 Cb -0.24 -0.15 -0.04 0.00 -1.16 0.00 0.00 33.47 31.88 1ds8 s TRP 114 CO 0.49 -0.46 -0.10 0.08 -4.06 0.00 0.00 176.95 172.89 1ds8 s VAL 115 N -3.57 3.36 -1.05 -0.66 1.01 -1.26 -5.02 120.40 113.22 1ds8 s VAL 115 Ca 0.03 -1.05 -0.16 0.00 0.00 0.00 0.00 61.98 60.80 1ds8 s VAL 115 Cb 0.04 -2.50 -0.08 0.00 0.00 0.00 0.00 36.38 33.84 1ds8 s VAL 115 CO -0.09 0.27 2.12 0.00 0.00 0.00 0.00 175.10 177.40 1ds8 n ALA 116 N 1.23 4.48 -1.58 5.51 0.00 -1.26 -4.83 120.51 124.06 1ds8 n ALA 116 Ca -0.15 -3.28 -0.30 0.00 0.00 0.00 0.00 53.44 49.71 1ds8 n ALA 116 Cb 0.52 -3.49 0.08 0.00 0.00 0.00 0.00 19.45 16.56 1ds8 n ALA 116 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1ds8 s ARG 117 N 4.03 2.33 0.12 0.00 0.52 -1.26 -4.93 118.95 119.75 1ds8 s ARG 117 Ca 0.53 0.70 -0.36 0.00 -0.52 0.00 0.00 55.73 56.08 1ds8 s ARG 117 Cb 0.14 -1.94 -0.16 0.00 0.52 0.00 0.00 34.95 33.51 1ds8 s ARG 117 CO 0.02 -1.46 1.40 -2.13 0.02 0.00 0.00 175.30 173.15 1ds8 n ARG 118 N -3.33 1.46 -1.48 3.54 0.63 -1.26 -3.96 116.66 112.24 1ds8 n ARG 118 Ca 0.07 0.52 -0.30 0.00 -0.92 0.00 0.00 57.85 57.22 1ds8 n ARG 118 Cb 0.56 -2.20 -0.06 0.00 0.45 0.00 0.00 32.46 31.21 1ds8 n ARG 118 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 1ds8 n ASP 119 N 2.74 7.24 -3.96 6.15 2.03 -1.26 -2.33 116.55 127.16 1ds8 n ASP 119 Ca 0.18 -2.87 -0.09 0.00 0.52 0.00 0.00 54.79 52.53 1ds8 n ASP 119 Cb 0.22 -1.39 -0.10 0.00 -0.72 0.00 0.00 41.12 39.13 1ds8 n ASP 119 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1ds8 s LEU 120 N -1.10 2.02 0.66 -2.67 1.43 -1.26 -4.92 118.68 112.84 1ds8 s LEU 120 Ca 0.62 -0.57 -0.13 0.00 -1.03 0.00 0.00 54.13 53.02 1ds8 s LEU 120 Cb 0.26 0.40 -0.00 0.00 0.03 0.00 0.00 46.19 46.88 1ds8 s LEU 120 CO -0.10 -0.45 1.07 -2.84 0.23 0.00 0.00 176.35 174.27 1ds8 s PRO 121 N -2.38 2.94 0.17 1.29 0.02 -1.26 -1.55 135.00 134.23 1ds8 s PRO 121 Ca -0.07 1.17 -0.30 0.00 0.02 0.00 0.00 61.00 61.82 1ds8 s PRO 121 Cb -0.03 -1.98 -0.08 0.00 0.02 0.00 0.00 34.50 32.43 1ds8 s PRO 121 CO -0.04 -1.11 1.12 -2.00 -0.33 0.00 0.00 177.00 174.64 1ds8 s GLU 122 N -4.46 4.56 0.03 5.54 2.12 -1.26 -4.85 118.70 120.38 1ds8 s GLU 122 Ca 0.62 1.75 -0.00 0.00 0.36 0.00 0.00 54.97 57.70 1ds8 s GLU 122 Cb -0.17 -3.27 -0.04 0.00 0.26 0.00 0.00 34.13 30.91 1ds8 s GLU 122 CO 0.46 0.02 0.15 -0.51 -0.54 0.00 0.00 175.26 174.84 1ds8 s LEU 123 N -0.26 4.17 0.00 2.70 1.02 -1.26 -0.58 118.68 124.46 1ds8 s LEU 123 Ca 0.51 0.22 0.00 0.00 0.02 0.00 0.00 54.13 54.87 1ds8 s LEU 123 Cb -0.30 -2.63 0.00 0.00 0.02 0.00 0.00 46.19 43.28 1ds8 s LEU 123 CO 0.35 0.22 0.00 -0.90 0.02 0.00 0.00 176.35 176.04 1ds8 n ASP 124 N 0.69 0.00 0.27 2.29 5.68 0.19 -4.73 116.55 120.95 1ds8 n ASP 124 Ca -0.09 -0.92 0.14 0.00 -0.50 0.00 0.00 54.79 53.42 1ds8 n ASP 124 Cb 0.52 0.00 0.79 0.00 -1.14 0.00 0.00 41.12 41.29 1ds8 n ASP 124 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 1ds8 h GLY 125 N 0.00 0.00 1.04 6.12 0.00 -2.00 -2.34 103.07 105.89 1ds8 h GLY 125 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1ds8 h GLY 125 CO 0.00 0.00 -0.58 1.42 0.00 0.00 0.00 176.54 177.38 1ds8 n HIS 126 N -3.53 0.21 -0.10 5.60 8.25 -1.26 -4.92 115.22 119.46 1ds8 n HIS 126 Ca -0.02 0.06 0.00 0.00 -0.26 0.00 0.00 57.72 57.50 1ds8 n HIS 126 Cb 0.22 -0.41 0.00 0.00 1.12 0.00 0.00 29.99 30.92 1ds8 n HIS 126 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ds8 n GLY 127 N 1.43 0.95 3.94 -1.41 0.00 -0.88 -5.08 105.19 104.14 1ds8 n GLY 127 Ca 0.04 -0.01 -0.25 0.00 0.00 0.00 0.00 46.02 45.81 1ds8 n GLY 127 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1ds8 s HIS 128 N -2.00 3.36 0.18 1.61 3.76 -1.26 -4.75 115.29 116.19 1ds8 s HIS 128 Ca 0.00 0.43 -0.31 0.00 -0.15 0.00 0.00 55.06 55.03 1ds8 s HIS 128 Cb 0.00 -2.27 -0.10 0.00 1.11 0.00 0.00 32.58 31.32 1ds8 s HIS 128 CO 0.00 -0.30 1.51 -0.80 -0.85 0.00 0.00 174.74 174.30 1ds8 s ASN 129 N -4.17 6.63 0.14 1.40 0.01 -1.26 0.57 114.94 118.27 1ds8 s ASN 129 Ca 0.47 2.60 -0.12 0.00 -0.71 0.00 0.00 52.86 55.10 1ds8 s ASN 129 Cb -0.10 -2.60 -0.01 0.00 0.41 0.00 0.00 41.25 38.95 1ds8 s ASN 129 CO 0.40 -0.77 1.53 0.50 -1.51 0.00 0.00 177.10 177.25 1ds8 h LYS 130 N 6.26 0.91 -6.11 -0.60 3.64 -1.13 -3.43 116.57 116.11 1ds8 h LYS 130 Ca -0.44 -0.39 -0.67 0.00 -1.27 0.00 0.00 60.65 57.89 1ds8 h LYS 130 Cb 1.21 -0.03 -0.13 0.00 -0.41 0.00 0.00 32.23 32.86 1ds8 h LYS 130 CO 0.87 1.04 -0.63 0.42 -2.27 0.00 0.00 179.45 178.88 1ds8 s ILE 131 N -4.68 4.24 -0.18 2.00 1.01 -1.26 -1.00 121.20 121.33 1ds8 s ILE 131 Ca -0.12 -0.53 -0.26 0.00 0.00 0.00 0.00 60.65 59.75 1ds8 s ILE 131 Cb 0.11 -2.88 0.07 0.00 0.01 0.00 0.00 42.46 39.77 1ds8 s ILE 131 CO 0.85 0.41 0.67 -0.75 0.00 0.00 0.00 174.94 176.12 1ds8 s LYS 132 N -1.47 0.87 0.27 2.79 2.20 -0.48 -4.76 119.74 119.16 1ds8 s LYS 132 Ca 0.19 0.68 -0.30 0.00 -0.36 0.00 0.00 55.97 56.18 1ds8 s LYS 132 Cb -0.12 0.42 -0.11 0.00 -1.51 0.00 0.00 37.83 36.51 1ds8 s LYS 132 CO 0.09 -0.17 1.59 -1.25 -0.36 0.00 0.00 175.35 175.25 1ds8 s PRO 133 N -0.20 4.15 0.40 4.03 0.04 -1.26 -0.84 135.00 141.31 1ds8 s PRO 133 Ca -0.04 2.53 0.15 0.00 0.04 0.00 0.00 61.00 63.69 1ds8 s PRO 133 Cb -0.03 -3.05 1.02 0.00 0.04 0.00 0.00 34.50 32.48 1ds8 s PRO 133 CO 0.04 -0.62 1.84 1.98 0.04 0.00 0.00 177.00 180.28 1ds8 h MET 134 N 5.25 0.46 -1.07 4.56 4.05 -0.80 0.19 114.93 127.57 1ds8 h MET 134 Ca -0.46 -0.03 0.29 0.00 -0.28 0.00 0.00 59.70 59.22 1ds8 h MET 134 Cb 1.22 -0.10 -0.09 0.00 -0.80 0.00 0.00 31.60 31.82 1ds8 h MET 134 CO 0.82 0.31 0.70 -0.22 0.23 0.00 0.00 176.91 178.74 1ds8 h LYS 135 N 0.47 0.32 -0.29 0.39 3.64 -1.88 0.12 116.57 119.34 1ds8 h LYS 135 Ca 0.49 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.85 1ds8 h LYS 135 Cb 1.12 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.87 1ds8 h LYS 135 CO -0.21 0.21 0.00 0.00 -2.27 0.00 0.00 179.45 177.18 1ds8 n ALA 136 N -2.50 2.37 -3.14 5.00 0.00 0.64 -4.85 120.51 118.03 1ds8 n ALA 136 Ca 0.26 -0.94 -0.45 0.00 0.00 0.00 0.00 53.44 52.32 1ds8 n ALA 136 Cb 0.96 -0.63 -0.04 0.00 0.00 0.00 0.00 19.45 19.74 1ds8 n ALA 136 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ds8 s ALA 137 N -1.21 3.47 -0.30 0.00 0.00 0.41 -4.96 121.76 119.17 1ds8 s ALA 137 Ca 0.28 -2.34 -0.41 0.00 0.00 0.00 0.00 51.96 49.49 1ds8 s ALA 137 Cb 0.17 -3.52 -0.16 0.00 0.00 0.00 0.00 23.12 19.61 1ds8 s ALA 137 CO 0.23 -2.33 1.75 0.00 0.00 0.00 0.00 175.76 175.40 1ds8 n ALA 138 N 6.10 -0.25 0.00 0.00 0.00 -1.26 -1.50 120.51 123.60 1ds8 n ALA 138 Ca -0.08 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.75 1ds8 n ALA 138 Cb 0.43 -2.21 0.00 0.00 0.00 0.00 0.00 19.45 17.67 1ds8 n ALA 138 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ds8 n GLY 139 N 4.26 2.80 3.78 0.00 0.00 -1.26 -5.02 105.19 109.74 1ds8 n GLY 139 Ca 0.27 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.92 1ds8 n GLY 139 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ds8 s PHE 140 N -2.81 3.42 0.23 1.61 0.40 -0.57 -5.04 117.98 115.23 1ds8 s PHE 140 Ca 0.00 1.69 -0.20 0.00 -0.60 0.00 0.00 56.93 57.82 1ds8 s PHE 140 Cb 0.00 -3.12 0.03 0.00 0.51 0.00 0.00 43.02 40.43 1ds8 s PHE 140 CO 0.00 -0.45 0.62 -3.38 0.70 0.00 0.00 175.22 172.71 1ds8 s HIS 141 N -1.53 -0.17 -0.09 0.36 -3.43 -1.26 -4.97 115.29 104.20 1ds8 s HIS 141 Ca 0.53 -0.20 -0.30 0.00 -0.80 0.00 0.00 55.06 54.29 1ds8 s HIS 141 Cb -0.24 0.54 -0.02 0.00 -1.43 0.00 0.00 32.58 31.43 1ds8 s HIS 141 CO 0.30 -1.06 1.10 0.08 -2.00 0.00 0.00 174.74 173.16 1ds8 s VAL 142 N -3.89 4.54 -0.05 -5.38 1.01 -1.26 -4.91 120.40 110.46 1ds8 s VAL 142 Ca 0.10 1.83 0.20 0.00 0.00 0.00 0.00 61.98 64.12 1ds8 s VAL 142 Cb -0.03 -4.18 -0.31 0.00 0.00 0.00 0.00 36.38 31.86 1ds8 s VAL 142 CO 0.01 -0.01 0.40 -1.54 0.00 0.00 0.00 175.10 173.96 1ds8 n SER 143 N 5.16 0.25 -3.47 3.32 3.41 -1.26 -5.03 113.62 116.00 1ds8 n SER 143 Ca 0.10 0.00 -0.14 0.00 -0.26 0.00 0.00 58.87 58.57 1ds8 n SER 143 Cb 0.47 1.81 -0.04 0.00 -0.26 0.00 0.00 64.21 66.20 1ds8 n SER 143 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ds8 s ALA 144 N -3.30 -1.70 0.00 7.33 0.00 -1.26 -5.15 121.76 117.68 1ds8 s ALA 144 Ca -0.08 0.89 0.00 0.00 0.00 0.00 0.00 51.96 52.77 1ds8 s ALA 144 Cb 0.12 0.45 0.00 0.00 0.00 0.00 0.00 23.12 23.69 1ds8 s ALA 144 CO 0.85 -0.60 0.00 0.41 0.00 0.00 0.00 175.76 176.42 1ds8 n GLY 145 N 0.14 -0.87 3.69 0.00 0.00 -1.26 -4.87 105.19 102.03 1ds8 n GLY 145 Ca -0.16 -1.68 -0.42 0.00 0.00 0.00 0.00 46.02 43.75 1ds8 n GLY 145 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ds8 s LYS 146 N -1.47 4.32 -0.19 1.61 2.47 -1.26 -4.97 119.74 120.25 1ds8 s LYS 146 Ca 0.00 1.91 -0.29 0.00 -1.56 0.00 0.00 55.97 56.02 1ds8 s LYS 146 Cb 0.00 -3.50 -0.01 0.00 -1.46 0.00 0.00 37.83 32.85 1ds8 s LYS 146 CO 0.00 -0.50 1.32 1.21 0.16 0.00 0.00 175.35 177.54 1ds8 s ASN 147 N 1.62 6.84 0.40 1.43 3.84 -1.26 -4.90 114.94 122.91 1ds8 s ASN 147 Ca 0.62 1.62 0.26 0.00 0.21 0.00 0.00 52.86 55.57 1ds8 s ASN 147 Cb -0.31 -2.54 0.75 0.00 -0.55 0.00 0.00 41.25 38.61 1ds8 s ASN 147 CO 0.26 -0.87 1.74 1.55 -2.79 0.00 0.00 177.10 177.00 1ds8 h PRO 148 N 8.67 0.00 -6.52 0.43 0.13 -1.96 -3.46 132.00 129.30 1ds8 h PRO 148 Ca -0.28 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.32 1ds8 h PRO 148 Cb 1.11 0.00 0.04 0.00 0.13 0.00 0.00 31.00 32.28 1ds8 h PRO 148 CO 0.98 0.00 1.10 -0.89 -0.23 0.00 0.00 178.00 178.96 1ds8 n ILE 149 N -2.82 0.33 0.00 -3.56 5.41 -1.26 -1.34 119.36 116.11 1ds8 n ILE 149 Ca 0.03 -0.06 0.00 0.00 1.00 0.00 0.00 62.75 63.72 1ds8 n ILE 149 Cb 0.42 -2.10 0.00 0.00 -0.71 0.00 0.00 39.64 37.26 1ds8 n ILE 149 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1ds8 n GLY 150 N 4.20 1.48 3.80 7.39 0.00 0.13 -5.00 105.19 117.19 1ds8 n GLY 150 Ca 0.18 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.84 1ds8 n GLY 150 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ds8 s LEU 151 N 0.00 4.24 0.56 0.99 1.43 -0.45 -4.71 118.68 120.73 1ds8 s LEU 151 Ca 0.00 1.68 -0.17 0.00 -1.03 0.00 0.00 54.13 54.61 1ds8 s LEU 151 Cb 0.00 -4.04 -0.05 0.00 0.03 0.00 0.00 46.19 42.13 1ds8 s LEU 151 CO 0.00 -0.11 1.05 -2.16 0.23 0.00 0.00 176.35 175.36 1ds8 s PRO 152 N -2.32 3.48 -0.21 1.29 0.04 -1.26 -0.48 135.00 135.53 1ds8 s PRO 152 Ca 0.51 1.27 -0.03 0.00 0.04 0.00 0.00 61.00 62.79 1ds8 s PRO 152 Cb -0.16 -2.05 -0.01 0.00 0.04 0.00 0.00 34.50 32.33 1ds8 s PRO 152 CO 0.21 -0.69 -0.06 0.08 0.04 0.00 0.00 177.00 176.58 1ds8 s VAL 153 N -2.27 3.24 -0.12 -0.36 1.01 0.88 -1.35 120.40 121.43 1ds8 s VAL 153 Ca 0.65 -0.54 -0.05 0.00 0.00 0.00 0.00 61.98 62.04 1ds8 s VAL 153 Cb -0.16 -2.47 -0.04 0.00 0.00 0.00 0.00 36.38 33.71 1ds8 s VAL 153 CO 0.31 0.44 0.07 -0.60 0.00 0.00 0.00 175.10 175.32 1ds8 s ARG 154 N 1.44 3.39 0.68 2.72 3.52 0.05 0.11 118.95 130.85 1ds8 s ARG 154 Ca 0.05 -0.28 -0.01 0.00 -0.13 0.00 0.00 55.73 55.37 1ds8 s ARG 154 Cb -0.14 -3.05 0.10 0.00 -1.56 0.00 0.00 34.95 30.29 1ds8 s ARG 154 CO -0.04 0.64 0.94 0.20 -0.81 0.00 0.00 175.30 176.23 1ds8 s GLY 155 N -0.68 1.77 0.23 8.12 0.00 -0.05 -0.68 107.32 116.04 1ds8 s GLY 155 Ca 0.12 -1.58 0.21 0.00 0.00 0.00 0.00 44.72 43.47 1ds8 s GLY 155 CO 0.02 -1.09 1.64 0.00 0.00 0.00 0.00 173.10 173.67 1ds8 n ASP 157 N -2.12 0.61 -1.22 0.00 5.75 -1.23 -1.65 116.55 116.68 1ds8 n ASP 157 Ca 0.01 -1.42 -0.13 0.00 -0.01 0.00 0.00 54.79 53.24 1ds8 n ASP 157 Cb 0.17 -0.03 -0.04 0.00 -1.03 0.00 0.00 41.12 40.20 1ds8 n ASP 157 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1ds8 n LEU 158 N -0.43 -1.23 -4.70 -2.12 4.77 0.33 -4.87 117.00 108.75 1ds8 n LEU 158 Ca 0.17 0.19 -0.29 0.00 -0.03 0.00 0.00 56.01 56.05 1ds8 n LEU 158 Cb 0.18 -2.02 -0.08 0.00 -2.33 0.00 0.00 43.42 39.17 1ds8 n LEU 158 CO 0.13 -0.46 -0.32 -1.61 -1.33 0.00 0.00 177.39 173.80 1ds8 s GLU 159 N -3.76 2.58 0.05 3.23 0.41 -1.25 -4.86 118.70 115.09 1ds8 s GLU 159 Ca 0.00 -0.88 -0.31 0.00 -0.41 0.00 0.00 54.97 53.38 1ds8 s GLU 159 Cb 0.00 -2.53 -0.06 0.00 -1.78 0.00 0.00 34.13 29.76 1ds8 s GLU 159 CO 0.00 0.52 1.23 0.42 -0.49 0.00 0.00 175.26 176.95 1ds8 s ILE 160 N -1.43 3.96 -0.84 -1.63 1.09 -1.26 -0.87 121.20 120.22 1ds8 s ILE 160 Ca 0.27 1.39 0.16 0.00 -1.10 0.00 0.00 60.65 61.37 1ds8 s ILE 160 Cb -0.11 -3.89 -0.16 0.00 -1.06 0.00 0.00 42.46 37.24 1ds8 s ILE 160 CO 0.19 0.09 0.71 0.00 -0.10 0.00 0.00 174.94 175.82 1ds8 n ALA 161 N 4.20 4.03 0.00 9.38 0.00 0.30 -4.91 120.51 133.51 1ds8 n ALA 161 Ca 0.10 -0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.07 1ds8 n ALA 161 Cb 0.46 -0.59 0.00 0.00 0.00 0.00 0.00 19.45 19.32 1ds8 n ALA 161 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ds8 n GLY 162 N 1.36 -0.39 3.12 0.00 0.00 -1.18 -4.43 105.19 103.68 1ds8 n GLY 162 Ca 0.03 -1.00 -0.10 0.00 0.00 0.00 0.00 46.02 44.95 1ds8 n GLY 162 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ds8 s LYS 163 N -2.00 0.58 -0.21 1.61 -2.85 -0.75 -0.08 119.74 116.03 1ds8 s LYS 163 Ca 0.00 -0.65 -0.27 0.00 -1.00 0.00 0.00 55.97 54.05 1ds8 s LYS 163 Cb 0.00 0.23 -0.00 0.00 -2.06 0.00 0.00 37.83 36.00 1ds8 s LYS 163 CO 0.00 -0.15 0.93 0.08 0.10 0.00 0.00 175.35 176.32 1ds8 s VAL 164 N -2.31 4.77 -0.76 1.79 1.01 0.37 -0.51 120.40 124.77 1ds8 s VAL 164 Ca -0.07 1.82 0.11 0.00 0.00 0.00 0.00 61.98 63.84 1ds8 s VAL 164 Cb -0.03 -4.22 -0.07 0.00 0.00 0.00 0.00 36.38 32.06 1ds8 s VAL 164 CO -0.03 -0.10 0.57 1.33 0.00 0.00 0.00 175.10 176.87 1ds8 n VAL 165 N 5.14 0.00 -3.59 2.92 0.24 -0.06 0.21 118.33 123.19 1ds8 n VAL 165 Ca 0.08 -0.29 0.01 0.00 -2.04 0.00 0.00 64.34 62.11 1ds8 n VAL 165 Cb 0.47 1.06 -0.01 0.00 -1.47 0.00 0.00 33.84 33.89 1ds8 n VAL 165 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1ds8 s ASP 166 N -1.85 -0.04 -0.09 -1.34 2.15 -1.22 -4.91 116.67 109.37 1ds8 s ASP 166 Ca 0.06 -0.05 0.04 0.00 0.43 0.00 0.00 52.55 53.04 1ds8 s ASP 166 Cb 0.09 0.07 -0.00 0.00 -0.30 0.00 0.00 42.92 42.78 1ds8 s ASP 166 CO 0.40 -0.13 -0.23 -0.63 -0.17 0.00 0.00 175.17 174.41 1ds8 s ILE 167 N -2.20 2.17 -0.24 4.11 1.01 -1.26 -0.39 121.20 124.40 1ds8 s ILE 167 Ca 0.14 -0.99 -0.16 0.00 0.00 0.00 0.00 60.65 59.64 1ds8 s ILE 167 Cb 0.05 -1.83 -0.04 0.00 0.01 0.00 0.00 42.46 40.65 1ds8 s ILE 167 CO -0.05 0.56 0.41 0.26 0.00 0.00 0.00 174.94 176.12 1ds8 s TRP 168 N 0.23 3.30 0.05 3.97 0.52 0.10 -0.03 118.94 127.09 1ds8 s TRP 168 Ca -0.15 0.53 0.03 0.00 0.02 0.00 0.00 56.10 56.53 1ds8 s TRP 168 Cb -0.17 -2.58 -0.04 0.00 -1.15 0.00 0.00 33.47 29.53 1ds8 s TRP 168 CO 0.08 -0.16 0.04 0.14 0.02 0.00 0.00 176.95 177.06 1ds8 s VAL 169 N 1.84 4.30 -0.55 4.03 -7.23 -0.02 -0.76 120.40 122.01 1ds8 s VAL 169 Ca 0.18 -0.75 -0.24 0.00 -1.81 0.00 0.00 61.98 59.36 1ds8 s VAL 169 Cb -0.15 -3.02 0.04 0.00 0.56 0.00 0.00 36.38 33.82 1ds8 s VAL 169 CO 0.09 0.21 0.92 -0.62 -0.31 0.00 0.00 175.10 175.39 1ds8 s ASP 170 N -2.08 6.32 0.05 4.85 -1.08 0.14 -1.38 116.67 123.48 1ds8 s ASP 170 Ca 0.25 -0.44 -0.26 0.00 -0.52 0.00 0.00 52.55 51.58 1ds8 s ASP 170 Cb -0.12 -2.42 -0.17 0.00 -1.46 0.00 0.00 42.92 38.75 1ds8 s ASP 170 CO 0.17 -1.22 1.53 0.40 0.52 0.00 0.00 175.17 176.57 1ds8 h ILE 171 N 6.00 0.88 -0.99 4.11 2.04 -1.37 0.43 117.51 128.61 1ds8 h ILE 171 Ca -0.26 -0.33 0.06 0.00 1.00 0.00 0.00 64.86 65.33 1ds8 h ILE 171 Cb 1.07 1.08 -0.07 0.00 -0.74 0.00 0.00 36.82 38.17 1ds8 h ILE 171 CO 1.08 0.08 0.64 -0.65 0.00 0.00 0.00 178.15 179.31 1ds8 h PRO 172 N -0.41 1.14 -0.26 2.37 0.11 -1.93 -1.94 132.00 131.09 1ds8 h PRO 172 Ca -0.03 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 66.02 1ds8 h PRO 172 Cb 0.32 -0.26 0.00 0.00 0.11 0.00 0.00 31.00 31.17 1ds8 h PRO 172 CO 0.04 0.76 0.00 0.39 -0.21 0.00 0.00 178.00 178.98 1ds8 n GLU 173 N -4.49 2.12 -3.91 1.05 1.02 -1.19 -4.98 120.64 110.25 1ds8 n GLU 173 Ca 0.15 -1.69 -0.36 0.00 -0.02 0.00 0.00 57.16 55.24 1ds8 n GLU 173 Cb 0.17 -1.45 0.02 0.00 -0.02 0.00 0.00 31.44 30.15 1ds8 n GLU 173 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1ds8 n GLN 174 N 0.92 -0.82 -3.87 3.49 6.02 0.14 -4.98 117.38 118.28 1ds8 n GLN 174 Ca 0.17 0.39 -0.11 0.00 -0.01 0.00 0.00 57.00 57.45 1ds8 n GLN 174 Cb 0.47 -2.67 -0.09 0.00 1.02 0.00 0.00 30.24 28.97 1ds8 n GLN 174 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ds8 s MET 175 N -6.29 0.59 -0.13 -1.09 0.23 -0.82 -4.95 119.30 106.85 1ds8 s MET 175 Ca 0.30 -0.57 -0.29 0.00 -1.03 0.00 0.00 55.69 54.10 1ds8 s MET 175 Cb -0.16 0.24 -0.02 0.00 -1.53 0.00 0.00 34.83 33.37 1ds8 s MET 175 CO 0.93 -0.16 1.19 0.00 -2.03 0.00 0.00 175.02 174.95 1ds8 s ALA 176 N -2.13 3.59 -0.08 3.16 0.00 -1.26 0.28 121.76 125.33 1ds8 s ALA 176 Ca -0.09 0.46 0.08 0.00 0.00 0.00 0.00 51.96 52.41 1ds8 s ALA 176 Cb -0.03 -3.56 -0.11 0.00 0.00 0.00 0.00 23.12 19.42 1ds8 s ALA 176 CO -0.02 -0.97 0.05 0.54 0.00 0.00 0.00 175.76 175.36 1ds8 n ARG 177 N 5.96 2.36 -3.83 0.00 1.74 0.06 -4.76 116.66 118.19 1ds8 n ARG 177 Ca 0.12 -0.01 -0.12 0.00 -0.77 0.00 0.00 57.85 57.07 1ds8 n ARG 177 Cb 0.46 -1.22 -0.09 0.00 -1.02 0.00 0.00 32.46 30.59 1ds8 n ARG 177 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1ds8 s PHE 178 N -2.25 -0.03 -0.13 -1.55 0.08 -1.09 -0.69 117.98 112.32 1ds8 s PHE 178 Ca -0.04 -0.04 -0.03 0.00 0.12 0.00 0.00 56.93 56.95 1ds8 s PHE 178 Cb 0.03 0.00 -0.03 0.00 -0.57 0.00 0.00 43.02 42.45 1ds8 s PHE 178 CO 0.36 -0.36 -0.04 -0.51 -0.10 0.00 0.00 175.22 174.57 1ds8 s LEU 179 N -1.54 3.29 -0.23 -0.37 1.43 0.13 0.03 118.68 121.43 1ds8 s LEU 179 Ca -0.12 -0.07 -0.20 0.00 -1.03 0.00 0.00 54.13 52.71 1ds8 s LEU 179 Cb -0.05 -1.77 -0.02 0.00 0.03 0.00 0.00 46.19 44.37 1ds8 s LEU 179 CO 0.01 0.24 0.61 -0.70 0.23 0.00 0.00 176.35 176.74 1ds8 s GLU 180 N -0.03 4.15 -0.18 1.70 2.12 0.48 -0.58 118.70 126.35 1ds8 s GLU 180 Ca 0.01 0.55 -0.01 0.00 0.36 0.00 0.00 54.97 55.88 1ds8 s GLU 180 Cb -0.13 -3.62 0.00 0.00 0.26 0.00 0.00 34.13 30.64 1ds8 s GLU 180 CO 0.03 -0.32 -0.13 0.08 -0.54 0.00 0.00 175.26 174.37 1ds8 s VAL 181 N 2.21 2.74 -0.13 3.70 1.01 0.12 -0.88 120.40 129.16 1ds8 s VAL 181 Ca 0.27 -0.72 -0.24 0.00 0.00 0.00 0.00 61.98 61.28 1ds8 s VAL 181 Cb -0.16 -2.19 -0.02 0.00 0.00 0.00 0.00 36.38 34.01 1ds8 s VAL 181 CO 0.09 0.49 0.75 -0.70 0.00 0.00 0.00 175.10 175.74 1ds8 s GLU 182 N 1.15 4.34 0.79 2.72 2.12 0.34 -0.17 118.70 129.98 1ds8 s GLU 182 Ca 0.01 0.91 -0.06 0.00 0.36 0.00 0.00 54.97 56.19 1ds8 s GLU 182 Cb -0.14 -3.53 0.17 0.00 0.26 0.00 0.00 34.13 30.89 1ds8 s GLU 182 CO -0.05 -0.16 1.08 1.28 -0.54 0.00 0.00 175.26 176.87 1ds8 n LEU 183 N 4.64 0.00 -0.29 2.70 4.77 0.17 -1.81 117.00 127.18 1ds8 n LEU 183 Ca 0.01 -1.81 0.04 0.00 -0.03 0.00 0.00 56.01 54.23 1ds8 n LEU 183 Cb 0.50 -0.75 0.25 0.00 -2.33 0.00 0.00 43.42 41.09 1ds8 n LEU 183 CO 0.47 -1.13 1.25 0.11 -1.33 0.00 0.00 177.39 176.76 1ds8 h LYS 184 N 0.00 0.97 0.00 3.23 6.56 -1.86 -2.22 116.57 123.24 1ds8 h LYS 184 Ca -0.35 -0.06 0.00 0.00 -1.06 0.00 0.00 60.65 59.18 1ds8 h LYS 184 Cb 1.17 -0.22 0.00 0.00 -0.57 0.00 0.00 32.23 32.61 1ds8 h LYS 184 CO 0.32 0.64 0.00 -0.40 -2.06 0.00 0.00 179.45 177.95 1ds8 n ASP 185 N -4.49 0.00 0.00 0.86 5.75 -1.26 -4.86 116.55 112.55 1ds8 n ASP 185 Ca 0.13 -1.80 0.00 0.00 -0.01 0.00 0.00 54.79 53.12 1ds8 n ASP 185 Cb 0.21 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.30 1ds8 n ASP 185 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ds8 n GLY 186 N 0.50 2.41 3.93 6.12 0.00 -0.83 -5.04 105.19 112.28 1ds8 n GLY 186 Ca 0.03 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.78 1ds8 n GLY 186 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ds8 s SER 187 N -2.48 4.67 0.18 1.61 1.04 -1.26 -4.76 113.70 112.70 1ds8 s SER 187 Ca 0.00 0.46 0.07 0.00 0.48 0.00 0.00 55.95 56.96 1ds8 s SER 187 Cb 0.00 -1.05 -0.05 0.00 0.10 0.00 0.00 66.02 65.02 1ds8 s SER 187 CO 0.00 -1.71 -0.13 0.42 0.98 0.00 0.00 173.24 172.80 1ds8 s THR 188 N -3.32 1.53 0.13 2.02 -4.23 -1.26 0.46 115.64 110.97 1ds8 s THR 188 Ca 0.61 -2.15 0.03 0.00 -1.18 0.00 0.00 61.69 59.00 1ds8 s THR 188 Cb -0.10 -1.97 -0.04 0.00 1.34 0.00 0.00 72.50 71.72 1ds8 s THR 188 CO 0.46 -0.65 -0.07 -0.13 -0.54 0.00 0.00 174.62 173.69 1ds8 s ARG 189 N -3.67 0.96 -0.19 3.99 1.81 0.76 -4.91 118.95 117.69 1ds8 s ARG 189 Ca 0.20 -1.40 -0.07 0.00 -1.72 0.00 0.00 55.73 52.74 1ds8 s ARG 189 Cb 0.00 -0.39 -0.04 0.00 -0.45 0.00 0.00 34.95 34.08 1ds8 s ARG 189 CO 0.05 0.01 0.06 -0.51 -0.68 0.00 0.00 175.30 174.22 1ds8 s LEU 190 N -3.11 3.72 -0.19 2.53 1.43 -1.26 0.11 118.68 121.91 1ds8 s LEU 190 Ca 0.15 0.02 -0.04 0.00 -1.03 0.00 0.00 54.13 53.23 1ds8 s LEU 190 Cb 0.04 -1.95 -0.02 0.00 0.03 0.00 0.00 46.19 44.30 1ds8 s LEU 190 CO -0.02 0.14 -0.04 -0.76 0.23 0.00 0.00 176.35 175.90 1ds8 s LEU 191 N 0.58 3.04 0.14 1.79 2.01 0.25 -4.91 118.68 121.60 1ds8 s LEU 191 Ca 0.03 -0.28 -0.34 0.00 0.01 0.00 0.00 54.13 53.55 1ds8 s LEU 191 Cb -0.13 -1.76 -0.14 0.00 0.01 0.00 0.00 46.19 44.17 1ds8 s LEU 191 CO 0.01 0.06 1.57 -2.65 1.01 0.00 0.00 176.35 176.35 1ds8 n PRO 192 N 4.26 2.05 -0.35 1.29 -0.02 -1.26 -0.69 135.00 140.28 1ds8 n PRO 192 Ca -0.18 0.74 0.07 0.00 -2.02 0.00 0.00 63.50 62.11 1ds8 n PRO 192 Cb 0.52 -2.50 0.25 0.00 -0.02 0.00 0.00 33.50 31.74 1ds8 n PRO 192 CO 0.00 0.00 0.00 0.52 1.98 0.00 0.00 175.50 178.00 1ds8 h MET 193 N 5.91 0.96 0.00 -0.52 2.86 -1.21 -1.02 114.93 121.91 1ds8 h MET 193 Ca -0.45 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.13 1ds8 h MET 193 Cb 1.26 -0.22 0.00 0.00 0.06 0.00 0.00 31.60 32.70 1ds8 h MET 193 CO 0.88 0.64 0.00 0.00 1.06 0.00 0.00 176.91 179.49 1ds8 n GLN 194 N -4.58 0.81 -0.06 1.72 0.00 -1.26 -2.73 117.38 111.27 1ds8 n GLN 194 Ca 0.18 0.00 0.05 0.00 0.00 0.00 0.00 57.00 57.23 1ds8 n GLN 194 Cb 0.33 -1.15 0.08 0.00 0.00 0.00 0.00 30.24 29.50 1ds8 n GLN 194 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.06 175.73 1ds8 n MET 195 N -0.65 2.25 -4.34 2.61 2.81 -0.39 -5.02 117.12 114.38 1ds8 n MET 195 Ca 0.06 -2.06 -0.18 0.00 -1.81 0.00 0.00 57.70 53.71 1ds8 n MET 195 Cb 0.03 -1.27 -0.10 0.00 -0.71 0.00 0.00 33.22 31.17 1ds8 n MET 195 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 1ds8 s VAL 196 N -1.90 1.59 -0.26 2.03 -7.23 -1.10 -4.52 120.40 109.01 1ds8 s VAL 196 Ca 0.17 -2.16 0.00 0.00 -1.81 0.00 0.00 61.98 58.18 1ds8 s VAL 196 Cb 0.14 -2.10 0.07 0.00 0.56 0.00 0.00 36.38 35.05 1ds8 s VAL 196 CO 0.02 -0.55 0.01 -0.75 -0.31 0.00 0.00 175.10 173.52 1ds8 s LYS 197 N -3.69 1.26 -0.22 4.82 2.47 -0.21 -4.97 119.74 119.20 1ds8 s LYS 197 Ca 0.23 -1.04 -0.29 0.00 -1.56 0.00 0.00 55.97 53.31 1ds8 s LYS 197 Cb 0.01 -2.47 0.00 0.00 -1.46 0.00 0.00 37.83 33.92 1ds8 s LYS 197 CO 0.07 -0.73 1.13 0.08 0.16 0.00 0.00 175.35 176.06 1ds8 s VAL 198 N 1.45 4.50 0.52 4.02 1.01 -1.26 -1.06 120.40 129.57 1ds8 s VAL 198 Ca 0.00 1.80 0.04 0.00 0.00 0.00 0.00 61.98 63.82 1ds8 s VAL 198 Cb -0.18 -4.20 0.01 0.00 0.00 0.00 0.00 36.38 32.01 1ds8 s VAL 198 CO -0.11 -0.21 0.26 -1.10 0.00 0.00 0.00 175.10 173.94 1ds8 s GLN 199 N 3.40 2.24 0.33 2.72 -0.21 0.15 -5.01 119.66 123.28 1ds8 s GLN 199 Ca 0.48 -2.11 0.03 0.00 0.02 0.00 0.00 55.36 53.79 1ds8 s GLN 199 Cb -0.17 -1.92 0.57 0.00 1.00 0.00 0.00 33.01 32.50 1ds8 s GLN 199 CO 0.11 -0.48 1.88 0.66 -2.12 0.00 0.00 175.29 175.33 1ds8 h SER 200 N 1.01 0.55 0.00 5.90 4.64 -2.01 -3.26 113.55 120.39 1ds8 h SER 200 Ca -0.40 -0.10 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 1ds8 h SER 200 Cb 1.30 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 1ds8 h SER 200 CO 0.64 0.59 0.00 -0.46 -0.87 0.00 0.00 176.83 176.73 1ds8 n ASN 201 N -4.29 1.97 -3.64 4.97 6.94 -1.26 -5.08 115.26 114.87 1ds8 n ASN 201 Ca 0.02 -1.98 0.01 0.00 -0.02 0.00 0.00 54.58 52.61 1ds8 n ASN 201 Cb 0.23 0.00 -0.00 0.00 -2.36 0.00 0.00 39.78 37.64 1ds8 n ASN 201 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1ds8 s ARG 202 N -0.98 0.51 -0.21 -3.83 1.70 -1.23 -4.55 118.95 110.36 1ds8 s ARG 202 Ca 0.00 -0.28 -0.00 0.00 -0.47 0.00 0.00 55.73 54.97 1ds8 s ARG 202 Cb 0.00 0.17 0.02 0.00 -0.57 0.00 0.00 34.95 34.57 1ds8 s ARG 202 CO 0.00 -0.23 -0.13 0.08 -1.08 0.00 0.00 175.30 173.93 1ds8 s VAL 203 N -2.51 2.48 -0.17 4.99 1.01 -0.46 0.32 120.40 126.07 1ds8 s VAL 203 Ca 0.15 -0.94 -0.08 0.00 0.00 0.00 0.00 61.98 61.10 1ds8 s VAL 203 Cb 0.04 -2.15 -0.04 0.00 0.00 0.00 0.00 36.38 34.22 1ds8 s VAL 203 CO -0.03 0.39 0.10 -2.28 0.00 0.00 0.00 175.10 173.29 1ds8 s HIS 204 N 1.31 3.39 -0.40 5.22 2.46 -0.22 -0.77 115.29 126.28 1ds8 s HIS 204 Ca 0.03 0.29 0.03 0.00 0.47 0.00 0.00 55.06 55.88 1ds8 s HIS 204 Cb -0.15 -2.06 0.11 0.00 -0.13 0.00 0.00 32.58 30.35 1ds8 s HIS 204 CO -0.09 0.37 0.13 0.08 -2.47 0.00 0.00 174.74 172.76 1ds8 s VAL 205 N -0.05 2.48 0.32 0.89 1.01 0.15 -1.05 120.40 124.14 1ds8 s VAL 205 Ca 0.09 -2.59 0.02 0.00 0.00 0.00 0.00 61.98 59.50 1ds8 s VAL 205 Cb -0.12 -2.78 0.15 0.00 0.00 0.00 0.00 36.38 33.64 1ds8 s VAL 205 CO 0.00 -0.66 1.85 -1.13 0.00 0.00 0.00 175.10 175.16 1ds8 h ASN 206 N 7.35 0.58 0.43 3.32 -0.73 -1.84 -2.85 115.58 121.84 1ds8 h ASN 206 Ca -0.06 -0.11 -0.01 0.00 1.87 0.00 0.00 56.30 57.99 1ds8 h ASN 206 Cb 0.99 -0.15 -0.00 0.00 0.27 0.00 0.00 38.32 39.42 1ds8 h ASN 206 CO 0.58 0.63 -0.06 0.00 -0.37 0.00 0.00 177.43 178.21 1ds8 h ALA 207 N 1.44 1.15 -3.72 1.57 0.00 -1.87 -3.40 119.26 114.43 1ds8 h ALA 207 Ca 0.13 -0.06 -0.41 0.00 0.00 0.00 0.00 54.91 54.57 1ds8 h ALA 207 Cb 0.33 -0.01 -0.25 0.00 0.00 0.00 0.00 17.79 17.86 1ds8 h ALA 207 CO 0.01 0.08 -0.78 -0.51 0.00 0.00 0.00 179.25 178.05 1ds8 s LEU 208 N -6.75 2.15 0.22 0.00 1.02 -1.19 -3.49 118.68 110.64 1ds8 s LEU 208 Ca -0.02 -0.41 -0.07 0.00 0.02 0.00 0.00 54.13 53.65 1ds8 s LEU 208 Cb 0.12 -0.50 -0.06 0.00 0.02 0.00 0.00 46.19 45.76 1ds8 s LEU 208 CO 0.53 0.01 0.50 -0.94 0.02 0.00 0.00 176.35 176.48 1ds8 s SER 209 N -1.00 6.55 0.31 2.29 1.04 -1.26 0.42 113.70 122.05 1ds8 s SER 209 Ca 0.00 0.78 0.07 0.00 0.48 0.00 0.00 55.95 57.28 1ds8 s SER 209 Cb -0.07 -2.17 0.89 0.00 0.10 0.00 0.00 66.02 64.77 1ds8 s SER 209 CO 0.01 -0.06 1.62 0.77 0.98 0.00 0.00 173.24 176.56 1ds8 h SER 210 N 2.43 0.03 0.32 7.02 4.64 -1.86 0.17 113.55 126.30 1ds8 h SER 210 Ca -0.47 0.23 0.00 0.00 -0.47 0.00 0.00 61.79 61.08 1ds8 h SER 210 Cb 1.17 0.30 0.00 0.00 -0.31 0.00 0.00 62.40 63.56 1ds8 h SER 210 CO 0.69 -0.24 0.00 -0.90 -0.87 0.00 0.00 176.83 175.51 1ds8 n ASP 211 N -5.26 0.38 -0.04 4.97 5.75 -1.26 -2.53 116.55 118.56 1ds8 n ASP 211 Ca 0.26 0.63 0.11 0.00 -0.01 0.00 0.00 54.79 55.79 1ds8 n ASP 211 Cb 0.85 -0.70 0.11 0.00 -1.03 0.00 0.00 41.12 40.35 1ds8 n ASP 211 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1ds8 n LEU 212 N -1.97 0.79 -0.27 -2.12 4.77 0.60 -4.38 117.00 114.42 1ds8 n LEU 212 Ca 0.01 -0.24 -0.06 0.00 -0.03 0.00 0.00 56.01 55.69 1ds8 n LEU 212 Cb 0.11 -0.14 0.06 0.00 -2.33 0.00 0.00 43.42 41.12 1ds8 n LEU 212 CO 0.12 0.19 1.04 -0.26 -1.33 0.00 0.00 177.39 177.15 1ds8 h PHE 213 N 0.19 1.14 -0.52 -1.77 -1.00 -1.58 -2.25 116.94 111.15 1ds8 h PHE 213 Ca 0.00 -0.08 0.07 0.00 2.81 0.00 0.00 57.97 60.77 1ds8 h PHE 213 Cb 0.51 -0.34 -0.03 0.00 3.61 0.00 0.00 35.95 39.70 1ds8 h PHE 213 CO 0.00 0.86 0.35 0.00 -1.61 0.00 0.00 178.31 177.91 1ds8 h ALA 214 N 1.16 1.93 0.00 2.45 0.00 -1.79 -1.52 119.26 121.48 1ds8 h ALA 214 Ca 0.25 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1ds8 h ALA 214 Cb 0.20 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1ds8 h ALA 214 CO -0.02 -0.02 0.00 0.41 0.00 0.00 0.00 179.25 179.61 1ds8 n GLY 215 N -1.51 -1.21 3.72 0.00 0.00 -0.85 -4.82 105.19 100.52 1ds8 n GLY 215 Ca 0.07 -0.06 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 1ds8 n GLY 215 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ds8 s ILE 216 N -3.02 2.19 0.48 -0.61 1.01 -0.57 -4.90 121.20 115.78 1ds8 s ILE 216 Ca 0.09 0.08 -0.22 0.00 0.00 0.00 0.00 60.65 60.61 1ds8 s ILE 216 Cb 0.13 -3.05 -0.09 0.00 0.01 0.00 0.00 42.46 39.45 1ds8 s ILE 216 CO 0.37 0.01 0.89 -2.65 0.00 0.00 0.00 174.94 173.56 1ds8 n PRO 217 N 4.26 1.06 -3.39 2.79 -0.02 -1.26 -4.98 135.00 133.45 1ds8 n PRO 217 Ca 0.16 0.39 -0.19 0.00 -2.02 0.00 0.00 63.50 61.84 1ds8 n PRO 217 Cb 0.36 -1.97 -0.01 0.00 -0.02 0.00 0.00 33.50 31.86 1ds8 n PRO 217 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1ds8 s THR 218 N -1.41 3.29 -0.05 3.45 -4.23 -1.26 -4.78 115.64 110.65 1ds8 s THR 218 Ca 0.67 -1.14 0.00 0.00 -1.18 0.00 0.00 61.69 60.04 1ds8 s THR 218 Cb -0.51 -3.14 -0.03 0.00 1.34 0.00 0.00 72.50 70.16 1ds8 s THR 218 CO 0.54 -0.07 -0.01 0.27 -0.54 0.00 0.00 174.62 174.81 1ds8 s ILE 219 N -2.33 4.13 0.08 2.99 -4.36 -1.26 -4.99 121.20 115.47 1ds8 s ILE 219 Ca 0.48 -0.44 -0.34 0.00 -0.26 0.00 0.00 60.65 60.09 1ds8 s ILE 219 Cb -0.08 -2.77 -0.17 0.00 1.25 0.00 0.00 42.46 40.69 1ds8 s ILE 219 CO 0.30 0.51 1.60 0.11 0.24 0.00 0.00 174.94 177.70 1ds8 h LYS 220 N 4.82 -0.94 -5.98 0.37 1.57 -2.00 -3.43 116.57 110.98 1ds8 h LYS 220 Ca -0.50 0.06 -0.61 0.00 -1.87 0.00 0.00 60.65 57.74 1ds8 h LYS 220 Cb 1.18 0.21 -0.04 0.00 0.08 0.00 0.00 32.23 33.66 1ds8 h LYS 220 CO 0.55 -0.63 -0.40 0.45 -0.57 0.00 0.00 179.45 178.86 1ds8 s SER 221 N -4.36 6.46 0.00 0.86 0.15 -1.26 -5.01 113.70 110.53 1ds8 s SER 221 Ca -0.18 0.49 0.29 0.00 0.70 0.00 0.00 55.95 57.25 1ds8 s SER 221 Cb 0.04 -2.06 1.18 0.00 -1.71 0.00 0.00 66.02 63.47 1ds8 s SER 221 CO 0.62 0.17 1.86 -2.65 1.20 0.00 0.00 173.24 174.44 1ds8 n PRO 222 N 0.61 0.20 0.00 5.44 -0.02 -1.26 -3.78 135.00 136.18 1ds8 n PRO 222 Ca -0.07 -0.04 0.05 0.00 -2.02 0.00 0.00 63.50 61.42 1ds8 n PRO 222 Cb 0.52 -1.50 0.02 0.00 -0.02 0.00 0.00 33.50 32.52 1ds8 n PRO 222 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1ds8 n THR 223 N -1.37 0.00 -3.86 3.45 -2.24 -1.26 -4.91 114.28 104.09 1ds8 n THR 223 Ca 0.09 -0.44 -0.09 0.00 -2.27 0.00 0.00 64.05 61.35 1ds8 n THR 223 Cb 0.31 1.15 -0.07 0.00 -2.10 0.00 0.00 70.33 69.63 1ds8 n THR 223 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1ds8 s GLU 224 N -1.16 0.99 -0.03 -0.78 -1.05 -1.25 -4.48 118.70 110.94 1ds8 s GLU 224 Ca 0.10 -0.99 0.01 0.00 -0.15 0.00 0.00 54.97 53.94 1ds8 s GLU 224 Cb 0.08 0.37 0.01 0.00 -0.44 0.00 0.00 34.13 34.16 1ds8 s GLU 224 CO 0.20 -0.34 -0.04 0.54 0.95 0.00 0.00 175.26 176.57 1ds8 s VAL 225 N -3.89 0.42 0.54 1.83 0.11 -1.26 -4.47 120.40 113.68 1ds8 s VAL 225 Ca 0.09 -0.12 -0.03 0.00 -2.93 0.00 0.00 61.98 58.99 1ds8 s VAL 225 Cb 0.04 -0.43 0.01 0.00 -1.53 0.00 0.00 36.38 34.47 1ds8 s VAL 225 CO -0.07 0.17 0.80 0.42 -3.33 0.00 0.00 175.10 173.09 1ds8 s THR 226 N 0.57 3.59 0.29 5.04 -4.23 -1.26 -4.28 115.64 115.35 1ds8 s THR 226 Ca -0.07 -0.30 -0.01 0.00 -1.18 0.00 0.00 61.69 60.14 1ds8 s THR 226 Cb -0.10 -3.38 0.16 0.00 1.34 0.00 0.00 72.50 70.52 1ds8 s THR 226 CO -0.00 -0.33 1.84 -0.07 -0.54 0.00 0.00 174.62 175.51 1ds8 h LEU 227 N 0.06 0.75 -0.50 4.79 3.38 -1.26 0.77 115.31 123.30 1ds8 h LEU 227 Ca -0.45 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 57.37 1ds8 h LEU 227 Cb 1.26 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.80 1ds8 h LEU 227 CO 0.58 0.74 0.23 0.25 0.09 0.00 0.00 178.44 180.33 1ds8 h LEU 228 N 0.78 0.66 -0.46 1.67 6.46 -1.59 -1.31 115.31 121.52 1ds8 h LEU 228 Ca 0.17 -0.14 -0.09 0.00 -0.12 0.00 0.00 57.88 57.71 1ds8 h LEU 228 Cb 0.28 -0.17 -0.02 0.00 -0.73 0.00 0.00 40.66 40.03 1ds8 h LEU 228 CO -0.00 0.62 -0.05 -0.33 -0.62 0.00 0.00 178.44 178.05 1ds8 h GLU 229 N 0.66 0.85 -0.55 1.25 5.08 -1.73 -2.11 114.58 118.03 1ds8 h GLU 229 Ca 0.17 -0.30 0.02 0.00 -1.00 0.00 0.00 59.36 58.26 1ds8 h GLU 229 Cb 0.14 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.29 1ds8 h GLU 229 CO -0.02 0.93 0.33 0.93 -1.00 0.00 0.00 179.01 180.18 1ds8 h GLU 230 N 0.70 0.64 -0.47 2.33 5.08 -0.62 0.52 114.58 122.76 1ds8 h GLU 230 Ca 0.12 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.42 1ds8 h GLU 230 Cb 0.58 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.66 1ds8 h GLU 230 CO 0.03 0.43 0.18 0.22 -1.00 0.00 0.00 179.01 178.87 1ds8 h ASP 231 N 0.66 0.66 -0.76 1.42 3.58 -1.13 0.24 116.42 121.10 1ds8 h ASP 231 Ca 0.22 -0.18 -0.06 0.00 0.42 0.00 0.00 57.03 57.43 1ds8 h ASP 231 Cb 0.01 -0.17 -0.03 0.00 1.72 0.00 0.00 39.33 40.86 1ds8 h ASP 231 CO -0.09 0.66 0.24 0.11 -2.88 0.00 0.00 179.24 177.28 1ds8 h LYS 232 N 0.63 1.17 0.02 0.28 1.57 -0.97 0.19 116.57 119.46 1ds8 h LYS 232 Ca 0.16 -0.25 -0.00 0.00 -1.87 0.00 0.00 60.65 58.69 1ds8 h LYS 232 Cb 0.21 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.35 1ds8 h LYS 232 CO -0.01 0.99 -0.01 0.82 -0.57 0.00 0.00 179.45 180.67 1ds8 h ILE 233 N 1.12 1.23 -0.52 1.86 2.04 -0.56 -1.17 117.51 121.53 1ds8 h ILE 233 Ca 0.24 -0.80 -0.11 0.00 1.00 0.00 0.00 64.86 65.19 1ds8 h ILE 233 Cb 0.30 1.77 -0.02 0.00 -0.74 0.00 0.00 36.82 38.14 1ds8 h ILE 233 CO -0.01 0.20 -0.12 0.00 0.00 0.00 0.00 178.15 178.23 1ds8 h GLY 235 N 0.95 0.67 0.97 0.00 0.00 -0.63 -2.21 103.07 102.81 1ds8 h GLY 235 Ca 0.13 -0.33 -0.00 0.00 0.00 0.00 0.00 47.33 47.13 1ds8 h GLY 235 CO 0.05 0.32 0.14 -1.82 0.00 0.00 0.00 176.54 175.23 1ds8 h TYR 236 N 0.56 0.32 -0.21 5.60 5.03 -1.01 -1.78 116.97 125.48 1ds8 h TYR 236 Ca 0.15 -0.00 -0.01 0.00 2.58 0.00 0.00 58.73 61.45 1ds8 h TYR 236 Cb 0.12 -0.11 -0.01 0.00 1.55 0.00 0.00 36.73 38.29 1ds8 h TYR 236 CO -0.01 0.25 0.09 0.28 -1.32 0.00 0.00 178.16 177.45 1ds8 h VAL 237 N 0.30 1.16 -0.81 1.81 2.07 -1.21 -2.80 116.25 116.77 1ds8 h VAL 237 Ca 0.09 -0.46 -0.01 0.00 0.82 0.00 0.00 66.70 67.13 1ds8 h VAL 237 Cb 0.03 1.07 -0.04 0.00 -1.52 0.00 0.00 31.29 30.83 1ds8 h VAL 237 CO -0.02 0.15 0.45 0.00 0.02 0.00 0.00 177.57 178.17 1ds8 h ALA 238 N 0.94 1.27 0.00 1.67 0.00 -1.38 -1.96 119.26 119.80 1ds8 h ALA 238 Ca 0.07 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1ds8 h ALA 238 Cb 0.16 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.62 1ds8 h ALA 238 CO -0.01 0.60 0.17 0.78 0.00 0.00 0.00 179.25 180.79 1ds8 h GLY 239 N 1.15 0.00 2.00 0.00 0.00 -0.88 -1.72 103.07 103.62 1ds8 h GLY 239 Ca 0.29 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.53 1ds8 h GLY 239 CO -0.05 0.00 -0.40 -1.33 0.00 0.00 0.00 176.54 174.76 1ds8 h GLY 240 N 0.00 0.00 0.45 4.60 0.00 -1.31 -1.61 103.07 105.20 1ds8 h GLY 240 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 47.33 47.46 1ds8 h GLY 240 CO 0.00 0.00 0.62 1.41 0.00 0.00 0.00 176.54 178.57 1ds8 h LEU 241 N 0.00 0.85 0.00 3.11 3.38 -1.34 0.20 115.31 121.51 1ds8 h LEU 241 Ca -0.00 0.05 -0.07 0.00 0.09 0.00 0.00 57.88 57.95 1ds8 h LEU 241 Cb 0.74 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 1ds8 h LEU 241 CO 0.05 0.43 -0.71 -0.03 0.09 0.00 0.00 178.44 178.27 1ds8 h MET 242 N 0.90 0.00 0.00 1.13 4.05 -1.72 -3.36 114.93 115.93 1ds8 h MET 242 Ca 0.50 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.92 1ds8 h MET 242 Cb 0.59 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.39 1ds8 h MET 242 CO -0.26 0.30 0.00 0.66 0.23 0.00 0.00 176.91 177.83 1ds8 n TYR 243 N -4.57 0.00 0.05 1.39 4.01 -0.62 -2.86 117.16 114.56 1ds8 n TYR 243 Ca -0.14 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.63 1ds8 n TYR 243 Cb 0.38 -0.41 0.06 0.00 -0.31 0.00 0.00 39.34 39.06 1ds8 n TYR 243 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1ds8 n ALA 244 N -1.41 2.26 -0.32 -0.72 0.00 0.70 -4.67 120.51 116.36 1ds8 n ALA 244 Ca 0.06 -0.86 0.16 0.00 0.00 0.00 0.00 53.44 52.80 1ds8 n ALA 244 Cb 0.19 -0.23 0.39 0.00 0.00 0.00 0.00 19.45 19.81 1ds8 n ALA 244 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ds8 h ALA 245 N 1.15 1.88 -0.22 0.00 0.00 -1.59 0.12 119.26 120.60 1ds8 h ALA 245 Ca 0.00 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1ds8 h ALA 245 Cb 0.47 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1ds8 h ALA 245 CO 0.00 -0.23 0.07 -1.35 0.00 0.00 0.00 179.25 177.74 1ds8 h PRO 246 N 0.63 0.30 -0.01 0.00 0.11 -1.83 -2.32 132.00 128.87 1ds8 h PRO 246 Ca 0.55 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.63 1ds8 h PRO 246 Cb 1.03 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.08 1ds8 h PRO 246 CO -0.31 0.26 -0.21 1.63 -0.21 0.00 0.00 178.00 179.16 1ds8 n LYS 247 N -4.43 1.29 -2.77 1.05 5.02 -0.04 -4.86 118.16 113.43 1ds8 n LYS 247 Ca 0.00 -0.88 -0.43 0.00 -2.02 0.00 0.00 58.31 54.98 1ds8 n LYS 247 Cb 0.13 -1.48 -0.03 0.00 -0.02 0.00 0.00 35.03 33.62 1ds8 n LYS 247 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 1ds8 s ARG 248 N -2.32 3.65 0.55 1.97 3.52 -0.80 -3.56 118.95 121.96 1ds8 s ARG 248 Ca 0.27 0.36 -0.19 0.00 -0.13 0.00 0.00 55.73 56.04 1ds8 s ARG 248 Cb 0.20 -3.89 -0.06 0.00 -1.56 0.00 0.00 34.95 29.64 1ds8 s ARG 248 CO 0.46 -1.19 1.11 0.15 -0.81 0.00 0.00 175.30 175.02 1ds8 s LYS 249 N 3.84 3.36 1.04 5.12 1.02 -0.66 -4.99 119.74 128.47 1ds8 s LYS 249 Ca 0.40 1.54 -0.14 0.00 0.02 0.00 0.00 55.97 57.78 1ds8 s LYS 249 Cb -0.10 -2.01 0.12 0.00 -0.52 0.00 0.00 37.83 35.32 1ds8 s LYS 249 CO 0.26 -0.83 0.49 -1.13 -0.92 0.00 0.00 175.35 173.21 1ds8 n SER 250 N -1.40 -1.77 -0.10 2.83 3.41 -1.26 -4.78 113.62 110.55 1ds8 n SER 250 Ca 0.11 0.11 -0.09 0.00 -0.26 0.00 0.00 58.87 58.74 1ds8 n SER 250 Cb 0.51 -1.17 0.07 0.00 -0.26 0.00 0.00 64.21 63.36 1ds8 n SER 250 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1ds8 h VAL 251 N -1.98 1.27 -0.29 -3.33 2.07 -1.99 -2.22 116.25 109.79 1ds8 h VAL 251 Ca -0.50 -1.37 -0.10 0.00 0.82 0.00 0.00 66.70 65.54 1ds8 h VAL 251 Cb 1.31 1.22 -0.01 0.00 -1.52 0.00 0.00 31.29 32.29 1ds8 h VAL 251 CO 0.39 0.46 -0.25 1.62 0.02 0.00 0.00 177.57 179.81 1ds8 h VAL 252 N 0.71 1.27 -0.42 2.57 3.04 -1.98 -0.29 116.25 121.15 1ds8 h VAL 252 Ca 0.09 -1.31 -0.07 0.00 -1.01 0.00 0.00 66.70 64.40 1ds8 h VAL 252 Cb 0.77 1.32 -0.01 0.00 -2.01 0.00 0.00 31.29 31.35 1ds8 h VAL 252 CO 0.06 0.42 -0.01 0.00 -1.01 0.00 0.00 177.57 177.03 1ds8 h ALA 253 N 1.22 0.56 -0.05 3.17 0.00 -1.87 -2.42 119.26 119.87 1ds8 h ALA 253 Ca 0.07 -0.27 -0.07 0.00 0.00 0.00 0.00 54.91 54.64 1ds8 h ALA 253 Cb 0.70 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 1ds8 h ALA 253 CO 0.05 0.36 -0.27 0.00 0.00 0.00 0.00 179.25 179.39 1ds8 h ALA 254 N 0.89 1.45 0.00 0.00 0.00 -1.16 -2.36 119.26 118.07 1ds8 h ALA 254 Ca 0.12 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.69 1ds8 h ALA 254 Cb 0.50 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1ds8 h ALA 254 CO 0.02 0.40 -0.26 1.98 0.00 0.00 0.00 179.25 181.39 1ds8 h MET 255 N 0.09 0.00 -0.00 0.00 1.85 -0.57 -3.51 114.93 112.78 1ds8 h MET 255 Ca 0.01 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.10 1ds8 h MET 255 Cb 0.53 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.56 1ds8 h MET 255 CO 0.04 0.26 0.00 1.28 -0.40 0.00 0.00 176.91 178.09