#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sdi n ALA 2 N 0.00 -1.30 -1.62 4.61 0.00 -1.26 -4.80 120.51 116.14 1sdi n ALA 2 Ca 0.00 -0.15 -0.49 0.00 0.00 0.00 0.00 53.44 52.80 1sdi n ALA 2 Cb 0.00 -1.86 -0.05 0.00 0.00 0.00 0.00 19.45 17.54 1sdi n ALA 2 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1sdi n LYS 3 N -0.49 1.55 -3.67 0.00 4.81 -1.26 -4.99 118.16 114.11 1sdi n LYS 3 Ca 0.11 0.56 -0.14 0.00 -0.87 0.00 0.00 58.31 57.96 1sdi n LYS 3 Cb 0.49 -2.23 -0.07 0.00 0.02 0.00 0.00 35.03 33.24 1sdi n LYS 3 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 1sdi s ASN 4 N 0.56 -0.33 0.47 3.14 2.20 -1.26 -5.06 114.94 114.66 1sdi s ASN 4 Ca 0.80 0.20 0.25 0.00 -0.94 0.00 0.00 52.86 53.17 1sdi s ASN 4 Cb -0.83 0.41 1.17 0.00 -2.00 0.00 0.00 41.25 39.99 1sdi s ASN 4 CO 0.45 -0.57 1.95 1.88 -2.94 0.00 0.00 177.10 177.87 1sdi h TYR 5 N 3.35 0.00 0.20 1.54 0.05 -1.95 -2.63 116.97 117.53 1sdi h TYR 5 Ca -0.30 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.48 1sdi h TYR 5 Cb 1.18 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.92 1sdi h TYR 5 CO 0.45 0.19 -0.11 -0.92 -1.05 0.00 0.00 178.16 176.72 1sdi h TYR 6 N 0.00 -0.29 -0.45 4.88 3.20 -1.97 -1.12 116.97 121.22 1sdi h TYR 6 Ca -0.00 -0.00 -0.11 0.00 3.14 0.00 0.00 58.73 61.75 1sdi h TYR 6 Cb 0.54 0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.89 1sdi h TYR 6 CO 0.00 -0.18 -0.16 -0.44 -1.64 0.00 0.00 178.16 175.74 1sdi h ASP 7 N -0.29 0.87 -0.39 -2.11 3.32 -1.95 -2.25 116.42 113.62 1sdi h ASP 7 Ca -0.02 -0.29 -0.08 0.00 0.02 0.00 0.00 57.03 56.65 1sdi h ASP 7 Cb 0.24 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.53 1sdi h ASP 7 CO 0.03 1.02 -0.03 0.40 -1.72 0.00 0.00 179.24 178.94 1sdi h ILE 8 N 0.76 1.25 -0.30 0.35 2.04 -1.42 -1.77 117.51 118.42 1sdi h ILE 8 Ca 0.11 -1.06 -0.06 0.00 1.00 0.00 0.00 64.86 64.86 1sdi h ILE 8 Cb 0.69 0.93 -0.01 0.00 -0.74 0.00 0.00 36.82 37.69 1sdi h ILE 8 CO 0.05 0.37 -0.06 0.74 0.00 0.00 0.00 178.15 179.25 1sdi h THR 9 N 0.73 1.28 -0.42 -0.27 2.02 -1.00 -1.06 112.91 114.19 1sdi h THR 9 Ca 0.14 -1.08 0.02 0.00 0.77 0.00 0.00 66.41 66.26 1sdi h THR 9 Cb 0.49 1.38 -0.03 0.00 -1.74 0.00 0.00 68.15 68.25 1sdi h THR 9 CO 0.03 0.34 0.25 -0.07 0.37 0.00 0.00 175.52 176.43 1sdi h LEU 10 N 0.33 0.39 -0.62 2.58 3.38 -1.18 0.10 115.31 120.30 1sdi h LEU 10 Ca 0.08 0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.97 1sdi h LEU 10 Cb 0.53 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 1sdi h LEU 10 CO 0.03 0.28 0.06 0.00 0.09 0.00 0.00 178.44 178.90 1sdi h ALA 11 N 1.19 0.83 -0.80 1.53 0.00 -1.17 -1.51 119.26 119.32 1sdi h ALA 11 Ca 0.17 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 1sdi h ALA 11 Cb 0.02 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.54 1sdi h ALA 11 CO -0.08 0.62 0.44 1.25 0.00 0.00 0.00 179.25 181.49 1sdi h LEU 12 N 0.96 0.99 -1.53 0.00 5.85 -1.03 -1.62 115.31 118.93 1sdi h LEU 12 Ca 0.18 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.82 1sdi h LEU 12 Cb 0.49 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 1sdi h LEU 12 CO 0.02 0.80 0.30 0.00 -0.34 0.00 0.00 178.44 179.21 1sdi h ALA 13 N 1.37 1.66 -0.42 1.25 0.00 -0.41 -1.16 119.26 121.55 1sdi h ALA 13 Ca 0.28 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 55.07 1sdi h ALA 13 Cb 0.02 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1sdi h ALA 13 CO -0.05 0.31 -0.08 0.78 0.00 0.00 0.00 179.25 180.22 1sdi h GLY 14 N 0.64 0.78 0.83 0.00 0.00 -0.31 0.63 103.07 105.65 1sdi h GLY 14 Ca 0.17 -0.56 -0.00 0.00 0.00 0.00 0.00 47.33 46.93 1sdi h GLY 14 CO -0.04 0.52 0.02 -2.22 0.00 0.00 0.00 176.54 174.82 1sdi h ILE 15 N 0.67 1.16 -0.14 2.60 2.04 -0.97 -2.84 117.51 120.02 1sdi h ILE 15 Ca 0.12 -0.47 -0.05 0.00 1.00 0.00 0.00 64.86 65.47 1sdi h ILE 15 Cb 0.53 1.36 -0.01 0.00 -0.74 0.00 0.00 36.82 37.96 1sdi h ILE 15 CO 0.03 0.13 -0.12 0.00 0.00 0.00 0.00 178.15 178.19 1sdi h GLN 17 N 0.21 0.61 -0.60 0.00 4.15 -0.80 -0.67 115.11 118.01 1sdi h GLN 17 Ca 0.04 -0.24 0.07 0.00 0.77 0.00 0.00 58.65 59.29 1sdi h GLN 17 Cb 0.36 -0.03 -0.06 0.00 0.21 0.00 0.00 27.48 27.96 1sdi h GLN 17 CO 0.02 0.80 0.30 1.03 -1.93 0.00 0.00 178.83 179.05 1sdi h SER 18 N 0.39 0.41 -0.61 -0.69 0.87 -1.23 -1.24 113.55 111.44 1sdi h SER 18 Ca 0.08 0.04 0.04 0.00 -1.23 0.00 0.00 61.79 60.73 1sdi h SER 18 Cb 0.57 -0.03 -0.05 0.00 -0.44 0.00 0.00 62.40 62.46 1sdi h SER 18 CO 0.03 0.26 0.35 0.00 -0.53 0.00 0.00 176.83 176.94 1sdi h ALA 19 N 1.35 0.81 -0.29 6.23 0.00 -0.87 -0.47 119.26 126.02 1sdi h ALA 19 Ca 0.28 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 55.01 1sdi h ALA 19 Cb 0.23 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 1sdi h ALA 19 CO -0.21 0.05 -0.54 -0.09 0.00 0.00 0.00 179.25 178.46 1sdi h ARG 20 N 0.67 0.85 -0.68 0.00 9.65 -0.80 -1.97 114.38 122.11 1sdi h ARG 20 Ca 0.26 -0.53 -0.08 0.00 -1.10 0.00 0.00 59.98 58.53 1sdi h ARG 20 Cb 0.11 0.06 -0.03 0.00 -1.39 0.00 0.00 29.97 28.72 1sdi h ARG 20 CO -0.14 1.17 0.13 -0.07 2.80 0.00 0.00 179.97 183.85 1sdi h LEU 21 N 0.66 1.06 -0.21 3.80 3.38 -0.90 -1.28 115.31 121.82 1sdi h LEU 21 Ca 0.02 -0.25 0.03 0.00 0.09 0.00 0.00 57.88 57.76 1sdi h LEU 21 Cb 1.14 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.58 1sdi h LEU 21 CO 0.12 1.04 0.05 0.58 0.09 0.00 0.00 178.44 180.32 1sdi h VAL 22 N 1.03 0.91 -0.81 1.22 2.07 -0.97 0.11 116.25 119.82 1sdi h VAL 22 Ca 0.21 -0.05 0.07 0.00 0.82 0.00 0.00 66.70 67.75 1sdi h VAL 22 Cb 0.42 0.77 -0.06 0.00 -1.52 0.00 0.00 31.29 30.90 1sdi h VAL 22 CO 0.01 0.02 0.49 -0.61 0.02 0.00 0.00 177.57 177.50 1sdi h GLN 23 N 0.13 0.85 -0.15 1.57 4.15 -0.93 0.14 115.11 120.87 1sdi h GLN 23 Ca 0.09 -0.05 -0.01 0.00 0.77 0.00 0.00 58.65 59.45 1sdi h GLN 23 Cb 0.08 -0.19 -0.01 0.00 0.21 0.00 0.00 27.48 27.57 1sdi h GLN 23 CO -0.12 0.56 0.06 1.96 -1.93 0.00 0.00 178.83 179.37 1sdi h GLN 24 N 0.88 0.23 -0.83 1.69 4.20 -0.95 -2.25 115.11 118.07 1sdi h GLN 24 Ca 0.36 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 59.02 1sdi h GLN 24 Cb 0.20 -0.04 -0.04 0.00 0.30 0.00 0.00 27.48 27.90 1sdi h GLN 24 CO -0.18 0.30 0.46 -0.07 -0.67 0.00 0.00 178.83 178.67 1sdi h LEU 25 N 0.10 1.04 -0.71 1.46 3.38 -0.65 -0.30 115.31 119.63 1sdi h LEU 25 Ca 0.05 -0.09 -0.14 0.00 0.09 0.00 0.00 57.88 57.79 1sdi h LEU 25 Cb 0.16 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 1sdi h LEU 25 CO -0.00 0.83 -0.63 0.00 0.09 0.00 0.00 178.44 178.73 1sdi h ALA 26 N 1.25 0.92 0.06 1.53 0.00 -0.58 -0.41 119.26 122.03 1sdi h ALA 26 Ca 0.29 -0.57 -0.34 0.00 0.00 0.00 0.00 54.91 54.30 1sdi h ALA 26 Cb 0.02 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 1sdi h ALA 26 CO -0.05 0.78 -1.92 0.72 0.00 0.00 0.00 179.25 178.78 1sdi n HIS 27 N -3.80 1.03 -0.02 0.00 8.25 -0.86 -1.14 115.22 118.67 1sdi n HIS 27 Ca -0.01 0.28 0.00 0.00 -0.26 0.00 0.00 57.72 57.73 1sdi n HIS 27 Cb 0.63 -1.16 -0.05 0.00 1.12 0.00 0.00 29.99 30.53 1sdi n HIS 27 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1sdi n GLN 28 N -3.25 1.58 -0.95 -0.41 6.02 -0.13 -4.42 117.38 115.82 1sdi n GLN 28 Ca -0.26 -0.03 0.00 0.00 -0.01 0.00 0.00 57.00 56.69 1sdi n GLN 28 Cb 1.05 -1.17 0.00 0.00 1.02 0.00 0.00 30.24 31.14 1sdi n GLN 28 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1sdi n GLY 29 N 2.34 0.80 3.22 1.08 0.00 -0.16 -5.01 105.19 107.46 1sdi n GLY 29 Ca -0.06 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.86 1sdi n GLY 29 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1sdi s HIS 30 N -3.15 0.03 0.30 1.61 -3.43 -1.26 -4.94 115.29 104.45 1sdi s HIS 30 Ca 0.00 -0.35 0.07 0.00 -0.80 0.00 0.00 55.06 53.98 1sdi s HIS 30 Cb 0.00 0.02 -0.02 0.00 -1.43 0.00 0.00 32.58 31.15 1sdi s HIS 30 CO 0.00 -0.53 0.24 0.00 -2.00 0.00 0.00 174.74 172.44 1sdi n ASP 32 N -1.82 3.54 0.06 0.00 -0.08 -1.26 -4.86 116.55 112.13 1sdi n ASP 32 Ca 0.06 0.59 -0.09 0.00 -1.51 0.00 0.00 54.79 53.83 1sdi n ASP 32 Cb 0.53 -1.50 0.03 0.00 2.34 0.00 0.00 41.12 42.52 1sdi n ASP 32 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1sdi h ALA 33 N 12.38 0.59 -0.22 -1.67 0.00 -1.99 -1.87 119.26 126.48 1sdi h ALA 33 Ca -0.44 -0.62 -0.05 0.00 0.00 0.00 0.00 54.91 53.79 1sdi h ALA 33 Cb 1.25 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 1sdi h ALA 33 CO 0.96 0.78 -0.07 -0.44 0.00 0.00 0.00 179.25 180.47 1sdi h ASP 34 N 0.24 0.45 -0.75 0.00 5.19 -2.00 -1.30 116.42 118.25 1sdi h ASP 34 Ca -0.03 -0.38 -0.01 0.00 -0.62 0.00 0.00 57.03 55.98 1sdi h ASP 34 Cb 1.33 -0.12 -0.04 0.00 0.18 0.00 0.00 39.33 40.68 1sdi h ASP 34 CO 0.13 0.73 0.41 0.00 -3.12 0.00 0.00 179.24 177.39 1sdi h ALA 35 N 0.73 0.96 -0.68 3.45 0.00 -1.88 -1.60 119.26 120.24 1sdi h ALA 35 Ca 0.05 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 1sdi h ALA 35 Cb 0.55 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 1sdi h ALA 35 CO 0.03 0.47 0.19 1.25 0.00 0.00 0.00 179.25 181.18 1sdi h LEU 36 N 1.03 1.01 -0.52 0.00 5.85 -1.29 -1.12 115.31 120.27 1sdi h LEU 36 Ca 0.26 -0.22 0.02 0.00 0.84 0.00 0.00 57.88 58.78 1sdi h LEU 36 Cb 0.03 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 40.77 1sdi h LEU 36 CO -0.04 0.96 0.31 -0.74 -0.34 0.00 0.00 178.44 178.60 1sdi h HIS 37 N 1.00 0.59 -0.40 1.25 2.76 -0.88 0.16 115.15 119.64 1sdi h HIS 37 Ca 0.22 0.02 0.02 0.00 -2.20 0.00 0.00 60.37 58.43 1sdi h HIS 37 Cb 0.33 -0.19 -0.03 0.00 1.55 0.00 0.00 27.41 29.07 1sdi h HIS 37 CO 0.03 0.34 0.22 0.28 -1.30 0.00 0.00 177.93 177.49 1sdi h VAL 38 N 0.63 1.01 -0.18 5.26 2.07 -0.98 -0.36 116.25 123.69 1sdi h VAL 38 Ca 0.21 -0.15 -0.06 0.00 0.82 0.00 0.00 66.70 67.51 1sdi h VAL 38 Cb 0.01 0.53 -0.00 0.00 -1.52 0.00 0.00 31.29 30.31 1sdi h VAL 38 CO -0.09 0.08 -0.13 0.28 0.02 0.00 0.00 177.57 177.73 1sdi h SER 39 N 0.44 0.43 -0.71 0.57 0.02 -0.71 -1.35 113.55 112.24 1sdi h SER 39 Ca 0.17 -0.45 -0.01 0.00 -0.84 0.00 0.00 61.79 60.66 1sdi h SER 39 Cb 0.05 -0.12 -0.03 0.00 0.14 0.00 0.00 62.40 62.43 1sdi h SER 39 CO -0.10 0.78 0.40 -0.07 -1.14 0.00 0.00 176.83 176.70 1sdi h LEU 40 N 0.07 0.87 -1.49 5.07 3.38 -0.98 -2.63 115.31 119.61 1sdi h LEU 40 Ca 0.03 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 1sdi h LEU 40 Cb 0.64 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.15 1sdi h LEU 40 CO 0.03 0.71 0.23 -1.13 0.09 0.00 0.00 178.44 178.37 1sdi h ASN 41 N 0.97 0.51 -0.04 -0.43 -0.73 -0.87 -1.58 115.58 113.41 1sdi h ASN 41 Ca 0.25 -0.03 0.01 0.00 1.87 0.00 0.00 56.30 58.40 1sdi h ASN 41 Cb 0.02 -0.13 -0.00 0.00 0.27 0.00 0.00 38.32 38.48 1sdi h ASN 41 CO -0.04 0.41 0.06 0.77 -0.37 0.00 0.00 177.43 178.26 1sdi h SER 42 N 0.58 0.00 -0.45 1.15 4.64 -0.86 -0.75 113.55 117.87 1sdi h SER 42 Ca 0.15 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.34 1sdi h SER 42 Cb 0.02 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.10 1sdi h SER 42 CO -0.03 0.00 -0.25 0.40 -0.87 0.00 0.00 176.83 176.08 1sdi h ILE 43 N 0.00 1.27 -0.02 0.95 2.04 -1.31 -3.34 117.51 117.11 1sdi h ILE 43 Ca 0.02 -1.41 0.00 0.00 1.00 0.00 0.00 64.86 64.47 1sdi h ILE 43 Cb 0.13 1.21 0.00 0.00 -0.74 0.00 0.00 36.82 37.43 1sdi h ILE 43 CO -0.00 0.48 -0.24 2.30 0.00 0.00 0.00 178.15 180.69 1sdi n ILE 44 N -4.13 0.00 -2.90 -0.67 -5.35 -0.69 -4.88 119.36 100.75 1sdi n ILE 44 Ca -0.01 -0.38 -0.43 0.00 -0.27 0.00 0.00 62.75 61.66 1sdi n ILE 44 Cb 0.47 1.28 -0.03 0.00 -1.74 0.00 0.00 39.64 39.62 1sdi n ILE 44 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1sdi s ASP 45 N -1.90 6.38 0.45 7.28 -1.08 -0.37 -4.98 116.67 122.44 1sdi s ASP 45 Ca 0.17 -1.48 -0.22 0.00 -0.52 0.00 0.00 52.55 50.50 1sdi s ASP 45 Cb 0.15 -2.41 -0.08 0.00 -1.46 0.00 0.00 42.92 39.12 1sdi s ASP 45 CO 0.38 -1.26 1.09 -0.32 0.52 0.00 0.00 175.17 175.58 1sdi s MET 46 N 3.41 3.89 -1.22 4.34 -2.45 -1.26 -4.30 119.30 121.70 1sdi s MET 46 Ca 0.27 1.58 -0.17 0.00 -1.25 0.00 0.00 55.69 56.12 1sdi s MET 46 Cb -0.12 -2.36 -0.00 0.00 1.25 0.00 0.00 34.83 33.60 1sdi s MET 46 CO 0.01 -0.39 0.68 0.09 1.05 0.00 0.00 175.02 176.45 1sdi n ASN 47 N -0.49 -3.75 -4.77 1.11 3.02 -1.26 -4.92 115.26 104.21 1sdi n ASN 47 Ca 0.07 -1.05 -0.39 0.00 -0.03 0.00 0.00 54.58 53.18 1sdi n ASN 47 Cb 0.50 -3.10 0.01 0.00 -0.61 0.00 0.00 39.78 36.58 1sdi n ASN 47 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1sdi s PRO 48 N -6.31 3.81 0.00 3.52 0.04 -1.26 -4.93 135.00 129.87 1sdi s PRO 48 Ca 0.34 2.26 0.26 0.00 0.04 0.00 0.00 61.00 63.90 1sdi s PRO 48 Cb -0.13 -2.68 0.72 0.00 0.04 0.00 0.00 34.50 32.44 1sdi s PRO 48 CO 0.88 -0.66 1.55 -1.13 0.04 0.00 0.00 177.00 177.68 1sdi n SER 49 N -0.07 0.84 -3.88 6.66 3.41 -1.26 -4.92 113.62 114.40 1sdi n SER 49 Ca 0.05 -0.69 -0.08 0.00 -0.26 0.00 0.00 58.87 57.89 1sdi n SER 49 Cb 0.43 0.15 -0.03 0.00 -0.26 0.00 0.00 64.21 64.50 1sdi n SER 49 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1sdi s SER 50 N -2.64 -0.21 0.23 4.04 1.04 -1.26 -5.00 113.70 109.89 1sdi s SER 50 Ca 0.21 -0.68 -0.07 0.00 0.48 0.00 0.00 55.95 55.89 1sdi s SER 50 Cb 0.19 0.66 0.25 0.00 0.10 0.00 0.00 66.02 67.21 1sdi s SER 50 CO 0.57 -1.23 1.88 0.74 0.98 0.00 0.00 173.24 176.18 1sdi h THR 51 N 2.11 1.15 -0.15 2.02 2.02 -1.96 -2.71 112.91 115.39 1sdi h THR 51 Ca -0.23 -0.37 -0.11 0.00 0.77 0.00 0.00 66.41 66.47 1sdi h THR 51 Cb 1.25 -0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 67.63 1sdi h THR 51 CO 0.29 0.20 -0.39 0.25 0.37 0.00 0.00 175.52 176.24 1sdi h LEU 52 N 1.08 0.35 -1.59 2.58 5.85 -1.96 -2.65 115.31 118.97 1sdi h LEU 52 Ca 0.33 -0.14 0.06 0.00 0.84 0.00 0.00 57.88 58.97 1sdi h LEU 52 Cb -0.02 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 40.88 1sdi h LEU 52 CO -0.11 0.71 0.36 0.00 -0.34 0.00 0.00 178.44 179.06 1sdi h ALA 53 N 1.31 1.85 -0.95 1.25 0.00 -1.82 -0.96 119.26 119.94 1sdi h ALA 53 Ca 0.03 -0.02 0.23 0.00 0.00 0.00 0.00 54.91 55.15 1sdi h ALA 53 Cb 0.81 -0.13 -0.07 0.00 0.00 0.00 0.00 17.79 18.40 1sdi h ALA 53 CO 0.06 0.06 0.63 0.28 0.00 0.00 0.00 179.25 180.29 1sdi h VAL 54 N 0.51 0.63 -0.66 0.00 2.07 -1.44 -2.03 116.25 115.32 1sdi h VAL 54 Ca 0.23 -0.13 -0.27 0.00 0.82 0.00 0.00 66.70 67.35 1sdi h VAL 54 Cb 0.26 0.21 -0.16 0.00 -1.52 0.00 0.00 31.29 30.08 1sdi h VAL 54 CO -0.06 0.07 0.26 0.49 0.02 0.00 0.00 177.57 178.35 1sdi n PHE 55 N -4.52 2.12 -0.78 1.57 3.72 -0.45 -4.17 117.46 114.95 1sdi n PHE 55 Ca 0.21 -1.45 0.00 0.00 -0.05 0.00 0.00 57.45 56.16 1sdi n PHE 55 Cb 0.77 -0.67 0.00 0.00 -0.94 0.00 0.00 39.48 38.64 1sdi n PHE 55 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1sdi n GLY 56 N -0.72 0.72 1.21 1.37 0.00 -0.76 -4.34 105.19 102.67 1sdi n GLY 56 Ca 0.42 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.44 1sdi n GLY 56 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sdi n GLY 57 N -2.49 0.74 2.85 -0.02 0.00 -0.69 -4.94 105.19 100.65 1sdi n GLY 57 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.84 1sdi n GLY 57 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1sdi s SER 58 N -2.64 0.69 0.52 1.61 0.01 -1.26 -4.89 113.70 107.75 1sdi s SER 58 Ca 0.00 -0.07 0.19 0.00 1.31 0.00 0.00 55.95 57.38 1sdi s SER 58 Cb 0.00 -0.33 1.32 0.00 0.21 0.00 0.00 66.02 67.22 1sdi s SER 58 CO 0.00 -0.08 2.10 -0.33 0.41 0.00 0.00 173.24 175.34 1sdi h GLU 59 N 7.24 0.00 -0.06 12.44 5.08 -1.93 -1.69 114.58 135.66 1sdi h GLU 59 Ca -0.40 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 57.98 1sdi h GLU 59 Cb 1.14 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.39 1sdi h GLU 59 CO 0.47 0.00 0.06 0.00 -1.00 0.00 0.00 179.01 178.54 1sdi h ALA 60 N 1.92 1.71 0.00 3.43 0.00 -1.96 -0.79 119.26 123.56 1sdi h ALA 60 Ca 0.08 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1sdi h ALA 60 Cb 0.31 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1sdi h ALA 60 CO -0.00 -0.10 0.00 -0.91 0.00 0.00 0.00 179.25 178.24 1sdi h ASN 61 N 0.00 0.00 -0.46 0.00 2.35 -1.60 -2.73 115.58 113.14 1sdi h ASN 61 Ca 0.03 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.78 1sdi h ASN 61 Cb 0.16 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.53 1sdi h ASN 61 CO -0.00 0.00 0.00 0.18 -1.65 0.00 0.00 177.43 175.96 1sdi n LEU 62 N -2.44 3.45 -0.22 1.61 4.77 -0.30 -4.73 117.00 119.13 1sdi n LEU 62 Ca 0.02 -2.14 0.02 0.00 -0.03 0.00 0.00 56.01 53.88 1sdi n LEU 62 Cb 0.23 -0.36 0.14 0.00 -2.33 0.00 0.00 43.42 41.10 1sdi n LEU 62 CO 0.21 0.79 0.95 -0.09 -1.33 0.00 0.00 177.39 177.92 1sdi h ARG 63 N 2.74 0.31 -0.39 3.23 2.43 -1.50 0.82 114.38 122.02 1sdi h ARG 63 Ca 0.00 -0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.17 1sdi h ARG 63 Cb 0.93 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.39 1sdi h ARG 63 CO 0.05 0.20 0.24 0.28 -1.51 0.00 0.00 179.97 179.23 1sdi h VAL 64 N 0.32 1.05 -0.75 0.20 2.07 -1.85 -1.37 116.25 115.93 1sdi h VAL 64 Ca 0.35 -0.16 -0.03 0.00 0.82 0.00 0.00 66.70 67.68 1sdi h VAL 64 Cb 0.53 0.53 -0.03 0.00 -1.52 0.00 0.00 31.29 30.80 1sdi h VAL 64 CO -0.41 0.09 0.35 1.23 0.02 0.00 0.00 177.57 178.85 1sdi h GLY 65 N 0.48 1.16 1.11 2.17 0.00 -1.55 -1.14 103.07 105.29 1sdi h GLY 65 Ca 0.15 -0.58 -0.14 0.00 0.00 0.00 0.00 47.33 46.75 1sdi h GLY 65 CO -0.06 0.55 -0.30 1.41 0.00 0.00 0.00 176.54 178.14 1sdi h LEU 66 N 1.06 0.99 -0.35 3.11 3.38 -0.66 0.43 115.31 123.27 1sdi h LEU 66 Ca 0.26 -0.43 -0.03 0.00 0.09 0.00 0.00 57.88 57.76 1sdi h LEU 66 Cb 0.13 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 1sdi h LEU 66 CO -0.03 1.22 0.11 -0.33 0.09 0.00 0.00 178.44 179.50 1sdi h GLU 67 N 0.78 0.54 -0.97 1.13 5.08 -1.17 -2.97 114.58 117.00 1sdi h GLU 67 Ca 0.08 -0.12 0.05 0.00 -1.00 0.00 0.00 59.36 58.37 1sdi h GLU 67 Cb 0.89 -0.08 -0.06 0.00 0.50 0.00 0.00 28.75 30.00 1sdi h GLU 67 CO 0.08 0.57 0.63 1.15 -1.00 0.00 0.00 179.01 180.43 1sdi h THR 68 N 0.41 1.13 -0.56 1.13 2.02 -1.02 -2.58 112.91 113.44 1sdi h THR 68 Ca 0.11 -0.41 -0.03 0.00 0.77 0.00 0.00 66.41 66.86 1sdi h THR 68 Cb 0.25 -0.16 -0.03 0.00 -1.74 0.00 0.00 68.15 66.47 1sdi h THR 68 CO -0.00 0.22 0.24 0.25 0.37 0.00 0.00 175.52 176.59 1sdi h LEU 69 N 1.19 0.73 -0.57 2.58 6.46 -0.76 -0.95 115.31 123.99 1sdi h LEU 69 Ca 0.40 -0.08 0.01 0.00 -0.12 0.00 0.00 57.88 58.09 1sdi h LEU 69 Cb 0.06 -0.19 -0.03 0.00 -0.73 0.00 0.00 40.66 39.77 1sdi h LEU 69 CO -0.14 0.65 0.36 -0.07 -0.62 0.00 0.00 178.44 178.62 1sdi h LEU 70 N 0.80 0.61 -0.30 2.25 3.38 -1.35 -0.33 115.31 120.38 1sdi h LEU 70 Ca 0.19 -0.01 -0.20 0.00 0.09 0.00 0.00 57.88 57.95 1sdi h LEU 70 Cb 0.13 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.74 1sdi h LEU 70 CO -0.02 0.44 -0.82 1.23 0.09 0.00 0.00 178.44 179.35 1sdi h GLY 71 N 0.73 0.46 0.98 0.83 0.00 -1.39 -2.08 103.07 102.61 1sdi h GLY 71 Ca 0.22 -0.72 -0.05 0.00 0.00 0.00 0.00 47.33 46.78 1sdi h GLY 71 CO -0.07 0.64 0.13 -2.08 0.00 0.00 0.00 176.54 175.16 1sdi h VAL 72 N 0.27 1.24 0.02 4.60 2.07 -0.87 0.18 116.25 123.75 1sdi h VAL 72 Ca -0.05 -0.85 -0.20 0.00 0.82 0.00 0.00 66.70 66.41 1sdi h VAL 72 Cb 1.42 0.80 -0.02 0.00 -1.52 0.00 0.00 31.29 31.98 1sdi h VAL 72 CO 0.14 0.31 -0.95 -0.07 0.02 0.00 0.00 177.57 177.02 1sdi h LEU 73 N 0.73 0.13 -0.00 2.57 3.38 -1.10 -3.41 115.31 117.61 1sdi h LEU 73 Ca 0.16 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1sdi h LEU 73 Cb 0.33 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.04 1sdi h LEU 73 CO 0.00 1.00 0.00 0.59 0.09 0.00 0.00 178.44 180.12 1sdi n ASN 74 N -3.52 0.00 -4.69 -0.43 4.13 -0.78 -4.96 115.26 105.01 1sdi n ASN 74 Ca -0.02 -0.42 -0.40 0.00 1.68 0.00 0.00 54.58 55.42 1sdi n ASN 74 Cb 0.87 0.84 -0.06 0.00 -1.54 0.00 0.00 39.78 39.89 1sdi n ASN 74 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1sdi s ALA 75 N -0.84 3.48 -0.50 5.41 0.00 0.63 -4.96 121.76 124.98 1sdi s ALA 75 Ca 0.00 -0.14 0.07 0.00 0.00 0.00 0.00 51.96 51.88 1sdi s ALA 75 Cb 0.00 -2.91 0.23 0.00 0.00 0.00 0.00 23.12 20.45 1sdi s ALA 75 CO 0.00 -0.33 0.57 0.43 0.00 0.00 0.00 175.76 176.43 1sdi n SER 76 N 4.45 1.45 -4.91 0.00 7.64 -1.26 -4.81 113.62 116.18 1sdi n SER 76 Ca -0.02 -2.93 -0.31 0.00 1.01 0.00 0.00 58.87 56.62 1sdi n SER 76 Cb 0.50 -0.65 -0.04 0.00 -1.01 0.00 0.00 64.21 63.02 1sdi n SER 76 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1sdi s SER 77 N -1.46 6.31 0.00 6.43 0.01 -1.26 -4.98 113.70 118.75 1sdi s SER 77 Ca 0.35 0.25 0.08 0.00 1.31 0.00 0.00 55.95 57.94 1sdi s SER 77 Cb 0.13 -1.93 0.23 0.00 0.21 0.00 0.00 66.02 64.66 1sdi s SER 77 CO -0.09 0.16 1.19 -2.11 0.41 0.00 0.00 173.24 172.80 1sdi n ARG 78 N 0.26 1.59 -4.30 12.44 1.85 -1.26 -4.58 116.66 122.66 1sdi n ARG 78 Ca -0.05 -0.92 -0.18 0.00 -1.00 0.00 0.00 57.85 55.70 1sdi n ARG 78 Cb 0.51 -1.20 -0.09 0.00 -1.05 0.00 0.00 32.46 30.63 1sdi n ARG 78 CO 0.00 0.00 0.00 1.14 -0.01 0.00 0.00 177.63 178.76 1sdi s GLN 79 N -1.66 1.59 0.00 2.89 -2.07 -1.26 -4.89 119.66 114.25 1sdi s GLN 79 Ca 0.17 -1.90 0.00 0.00 -1.82 0.00 0.00 55.36 51.81 1sdi s GLN 79 Cb 0.09 0.12 0.00 0.00 -1.09 0.00 0.00 33.01 32.13 1sdi s GLN 79 CO 0.12 -0.51 0.00 0.41 -1.32 0.00 0.00 175.29 173.98 1sdi n GLY 80 N -0.55 -0.63 0.24 2.60 0.00 -1.26 -3.82 105.19 101.77 1sdi n GLY 80 Ca 0.03 -1.72 0.03 0.00 0.00 0.00 0.00 46.02 44.36 1sdi n GLY 80 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1sdi h LEU 81 N 0.00 0.15 -1.29 0.99 3.38 -2.00 -2.12 115.31 114.42 1sdi h LEU 81 Ca 0.00 -0.03 -0.06 0.00 0.09 0.00 0.00 57.88 57.88 1sdi h LEU 81 Cb 0.00 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1sdi h LEU 81 CO 0.00 0.31 -0.13 -1.13 0.09 0.00 0.00 178.44 177.58 1sdi h ASN 82 N 0.16 0.30 0.66 -0.43 -1.24 -1.96 -2.33 115.58 110.73 1sdi h ASN 82 Ca 0.03 -0.07 -0.02 0.00 0.71 0.00 0.00 56.30 56.96 1sdi h ASN 82 Cb 0.34 -0.08 -0.00 0.00 0.73 0.00 0.00 38.32 39.31 1sdi h ASN 82 CO 0.02 0.46 -0.09 0.00 -1.29 0.00 0.00 177.43 176.53 1sdi h ALA 83 N 1.57 1.09 -0.77 1.57 0.00 -1.48 -1.79 119.26 119.46 1sdi h ALA 83 Ca 0.06 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1sdi h ALA 83 Cb 0.42 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 1sdi h ALA 83 CO 0.02 0.12 0.43 0.93 0.00 0.00 0.00 179.25 180.75 1sdi h GLU 84 N 0.00 1.07 -0.62 0.00 5.08 -1.47 -1.60 114.58 117.05 1sdi h GLU 84 Ca -0.00 -0.12 -0.06 0.00 -1.00 0.00 0.00 59.36 58.18 1sdi h GLU 84 Cb 0.45 -0.21 -0.03 0.00 0.50 0.00 0.00 28.75 29.46 1sdi h GLU 84 CO 0.01 0.78 0.15 -0.07 -1.00 0.00 0.00 179.01 178.88 1sdi h LEU 85 N 1.06 0.91 -0.38 1.33 3.38 -1.39 -1.36 115.31 118.85 1sdi h LEU 85 Ca 0.27 -0.18 -0.06 0.00 0.09 0.00 0.00 57.88 58.01 1sdi h LEU 85 Cb 0.02 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 1sdi h LEU 85 CO -0.05 0.88 0.01 0.74 0.09 0.00 0.00 178.44 180.11 1sdi h THR 86 N 0.92 1.26 -0.74 0.22 2.02 -1.45 -1.49 112.91 113.66 1sdi h THR 86 Ca 0.20 -0.98 0.01 0.00 0.77 0.00 0.00 66.41 66.41 1sdi h THR 86 Cb 0.33 1.14 -0.04 0.00 -1.74 0.00 0.00 68.15 67.85 1sdi h THR 86 CO 0.00 0.33 0.49 0.03 0.37 0.00 0.00 175.52 176.74 1sdi h ARG 87 N 0.49 0.96 -0.44 6.66 3.08 -0.98 -1.54 114.38 122.62 1sdi h ARG 87 Ca 0.11 -0.06 -0.13 0.00 0.07 0.00 0.00 59.98 59.97 1sdi h ARG 87 Cb 0.45 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 30.27 1sdi h ARG 87 CO 0.02 0.64 -0.24 1.88 -1.07 0.00 0.00 179.97 181.19 1sdi h TYR 88 N 0.99 1.05 -0.17 3.04 0.05 -1.09 -1.19 116.97 119.65 1sdi h TYR 88 Ca 0.27 -0.26 -0.01 0.00 0.05 0.00 0.00 58.73 58.78 1sdi h TYR 88 Cb -0.11 -0.24 -0.01 0.00 1.01 0.00 0.00 36.73 37.38 1sdi h TYR 88 CO -0.02 1.05 0.05 1.15 -1.05 0.00 0.00 178.16 179.34 1sdi h THR 89 N 0.78 1.19 -0.40 -2.88 2.02 -0.96 -1.41 112.91 111.25 1sdi h THR 89 Ca 0.10 -0.59 -0.10 0.00 0.77 0.00 0.00 66.41 66.58 1sdi h THR 89 Cb 0.80 1.26 -0.02 0.00 -1.74 0.00 0.00 68.15 68.45 1sdi h THR 89 CO 0.07 0.18 -0.17 -0.07 0.37 0.00 0.00 175.52 175.90 1sdi h LEU 90 N 0.10 0.77 -0.65 2.58 3.38 -1.29 -2.24 115.31 117.96 1sdi h LEU 90 Ca 0.06 -0.25 -0.09 0.00 0.09 0.00 0.00 57.88 57.68 1sdi h LEU 90 Cb 0.24 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 1sdi h LEU 90 CO -0.00 0.94 0.04 0.28 0.09 0.00 0.00 178.44 179.79 1sdi h SER 91 N 0.68 1.07 -0.51 -0.43 0.02 -1.05 0.38 113.55 113.71 1sdi h SER 91 Ca 0.10 -0.29 -0.05 0.00 -0.84 0.00 0.00 61.79 60.72 1sdi h SER 91 Cb 0.67 -0.29 -0.03 0.00 0.14 0.00 0.00 62.40 62.89 1sdi h SER 91 CO 0.05 1.09 0.16 -0.07 -1.14 0.00 0.00 176.83 176.92 1sdi h LEU 92 N 1.01 0.78 -0.43 5.07 3.38 -1.10 -1.77 115.31 122.25 1sdi h LEU 92 Ca 0.19 -0.13 -0.09 0.00 0.09 0.00 0.00 57.88 57.94 1sdi h LEU 92 Cb 0.52 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1sdi h LEU 92 CO 0.02 0.75 -0.09 0.24 0.09 0.00 0.00 178.44 179.45 1sdi h MET 93 N 0.82 0.82 -0.60 1.13 2.86 -0.78 -0.35 114.93 118.83 1sdi h MET 93 Ca 0.18 -0.31 -0.02 0.00 -2.06 0.00 0.00 59.70 57.50 1sdi h MET 93 Cb 0.26 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 31.84 1sdi h MET 93 CO -0.01 0.93 0.31 0.28 1.06 0.00 0.00 176.91 179.49 1sdi h VAL 94 N 0.64 1.20 -0.24 -2.22 2.07 -0.72 -2.49 116.25 114.50 1sdi h VAL 94 Ca 0.11 -0.53 -0.16 0.00 0.82 0.00 0.00 66.70 66.94 1sdi h VAL 94 Cb 0.62 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 1sdi h VAL 94 CO 0.04 0.22 -0.50 0.25 0.02 0.00 0.00 177.57 177.60 1sdi h LEU 95 N 0.81 0.75 -1.24 2.57 5.85 -1.22 -2.53 115.31 120.30 1sdi h LEU 95 Ca 0.21 -0.38 -0.01 0.00 0.84 0.00 0.00 57.88 58.54 1sdi h LEU 95 Cb 0.07 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 40.85 1sdi h LEU 95 CO -0.03 1.12 0.40 -0.08 -0.34 0.00 0.00 178.44 179.51 1sdi h GLU 96 N 0.53 0.92 -0.50 1.25 4.22 -0.92 -0.76 114.58 119.33 1sdi h GLU 96 Ca 0.02 -0.08 -0.08 0.00 0.08 0.00 0.00 59.36 59.30 1sdi h GLU 96 Cb 1.06 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 30.10 1sdi h GLU 96 CO 0.10 0.65 -0.02 0.00 -2.18 0.00 0.00 179.01 177.56 1sdi h ARG 97 N 0.93 0.85 -0.47 1.92 2.47 -1.14 0.03 114.38 118.98 1sdi h ARG 97 Ca 0.24 -0.25 -0.06 0.00 -1.26 0.00 0.00 59.98 58.65 1sdi h ARG 97 Cb -0.02 -0.09 -0.02 0.00 -1.65 0.00 0.00 29.97 28.19 1sdi h ARG 97 CO -0.04 0.87 0.04 0.87 0.56 0.00 0.00 179.97 182.26 1sdi h LYS 98 N 0.78 0.80 -0.23 0.04 1.79 -1.00 -1.52 116.57 117.23 1sdi h LYS 98 Ca 0.15 -0.23 0.02 0.00 -2.18 0.00 0.00 60.65 58.41 1sdi h LYS 98 Cb 0.51 -0.08 -0.02 0.00 -1.58 0.00 0.00 32.23 31.05 1sdi h LYS 98 CO 0.03 0.83 0.08 1.25 -1.08 0.00 0.00 179.45 180.55 1sdi h LEU 99 N 0.66 0.08 -0.55 2.94 5.85 -0.90 -2.02 115.31 121.37 1sdi h LEU 99 Ca 0.14 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.88 1sdi h LEU 99 Cb 0.44 0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.49 1sdi h LEU 99 CO 0.02 0.08 0.00 0.28 -0.34 0.00 0.00 178.44 178.47 1sdi h SER 100 N 0.18 0.00 1.01 1.25 0.02 -0.87 -3.02 113.55 112.12 1sdi h SER 100 Ca 0.10 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 60.97 1sdi h SER 100 Cb 0.07 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.60 1sdi h SER 100 CO -0.11 0.00 -1.04 0.28 -1.14 0.00 0.00 176.83 174.82 1sdi h SER 101 N 0.00 0.00 -3.20 3.07 0.02 -0.99 -3.47 113.55 108.99 1sdi h SER 101 Ca 0.00 0.00 -0.58 0.00 -0.84 0.00 0.00 61.79 60.37 1sdi h SER 101 Cb 0.59 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 63.07 1sdi h SER 101 CO 0.00 0.31 0.83 0.00 -1.14 0.00 0.00 176.83 176.83 1sdi s ALA 102 N -3.12 3.58 -0.04 3.77 0.00 -0.79 -4.96 121.76 120.21 1sdi s ALA 102 Ca -0.00 0.06 -0.35 0.00 0.00 0.00 0.00 51.96 51.66 1sdi s ALA 102 Cb 0.09 -3.62 -0.13 0.00 0.00 0.00 0.00 23.12 19.45 1sdi s ALA 102 CO 0.78 -1.29 1.73 1.17 0.00 0.00 0.00 175.76 178.15 1sdi n LYS 103 N 6.63 1.89 0.00 0.00 3.00 -1.26 -1.76 118.16 126.66 1sdi n LYS 103 Ca 0.12 0.69 0.00 0.00 -0.00 0.00 0.00 58.31 59.12 1sdi n LYS 103 Cb 0.47 -2.47 0.00 0.00 0.00 0.00 0.00 35.03 33.03 1sdi n LYS 103 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1sdi n GLY 104 N 3.93 2.17 0.21 3.14 0.00 -1.26 -4.92 105.19 108.46 1sdi n GLY 104 Ca 0.21 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.13 1sdi n GLY 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sdi h ALA 105 N 0.00 0.53 -0.43 4.61 0.00 -1.60 -1.64 119.26 120.73 1sdi h ALA 105 Ca 0.00 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.63 1sdi h ALA 105 Cb 0.00 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 1sdi h ALA 105 CO 0.00 0.26 0.05 -0.07 0.00 0.00 0.00 179.25 179.49 1sdi h LEU 106 N 0.51 0.62 -0.24 0.00 3.38 -1.79 0.53 115.31 118.32 1sdi h LEU 106 Ca 0.12 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1sdi h LEU 106 Cb 0.41 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1sdi h LEU 106 CO 0.01 0.66 0.11 -0.78 0.09 0.00 0.00 178.44 178.53 1sdi h ASP 107 N 0.64 0.33 -0.20 -0.43 3.58 -1.89 -1.02 116.42 117.43 1sdi h ASP 107 Ca 0.14 -0.15 0.03 0.00 0.42 0.00 0.00 57.03 57.47 1sdi h ASP 107 Cb 0.33 -0.08 -0.03 0.00 1.72 0.00 0.00 39.33 41.26 1sdi h ASP 107 CO 0.01 0.38 0.00 0.74 -2.88 0.00 0.00 179.24 177.49 1sdi h THR 108 N 0.25 0.86 -0.27 2.25 2.02 -0.99 -1.65 112.91 115.38 1sdi h THR 108 Ca 0.08 -0.02 0.05 0.00 0.77 0.00 0.00 66.41 67.29 1sdi h THR 108 Cb 0.15 0.79 -0.05 0.00 -1.74 0.00 0.00 68.15 67.30 1sdi h THR 108 CO -0.01 0.01 -0.04 0.25 0.37 0.00 0.00 175.52 176.11 1sdi h LEU 109 N 0.07 -0.19 -0.69 2.58 5.85 -0.69 -0.32 115.31 121.91 1sdi h LEU 109 Ca 0.09 0.07 0.05 0.00 0.84 0.00 0.00 57.88 58.93 1sdi h LEU 109 Cb 0.12 0.14 -0.05 0.00 0.37 0.00 0.00 40.66 41.24 1sdi h LEU 109 CO -0.16 -0.06 0.41 1.23 -0.34 0.00 0.00 178.44 179.52 1sdi h GLY 110 N 0.03 1.00 1.03 3.75 0.00 -0.93 -0.75 103.07 107.20 1sdi h GLY 110 Ca 0.13 -0.30 -0.06 0.00 0.00 0.00 0.00 47.33 47.11 1sdi h GLY 110 CO -0.25 0.22 0.19 3.43 0.00 0.00 0.00 176.54 180.12 1sdi h ASN 111 N 0.77 0.97 -0.55 0.19 2.35 -1.02 -1.11 115.58 117.18 1sdi h ASN 111 Ca 0.29 -0.21 -0.07 0.00 -0.55 0.00 0.00 56.30 55.76 1sdi h ASN 111 Cb 0.11 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.20 1sdi h ASN 111 CO -0.15 0.93 0.09 0.03 -1.65 0.00 0.00 177.43 176.68 1sdi h ARG 112 N 0.96 0.92 -0.34 0.81 2.47 -0.65 -1.26 114.38 117.30 1sdi h ARG 112 Ca 0.21 -0.25 -0.03 0.00 -1.26 0.00 0.00 59.98 58.66 1sdi h ARG 112 Cb 0.31 -0.11 -0.01 0.00 -1.65 0.00 0.00 29.97 28.51 1sdi h ARG 112 CO -0.00 0.89 0.11 0.82 0.56 0.00 0.00 179.97 182.34 1sdi h ILE 113 N 0.81 1.21 0.00 2.04 2.04 -0.98 -2.47 117.51 120.16 1sdi h ILE 113 Ca 0.17 -0.67 -0.05 0.00 1.00 0.00 0.00 64.86 65.31 1sdi h ILE 113 Cb 0.42 1.01 -0.01 0.00 -0.74 0.00 0.00 36.82 37.50 1sdi h ILE 113 CO 0.01 0.23 -0.22 -1.13 0.00 0.00 0.00 178.15 177.04 1sdi h ASN 114 N 0.39 0.00 0.47 1.72 -1.24 -1.06 -1.40 115.58 114.47 1sdi h ASN 114 Ca 0.11 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.12 1sdi h ASN 114 Cb 0.25 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.30 1sdi h ASN 114 CO -0.00 0.22 0.00 0.61 -1.29 0.00 0.00 177.43 176.97 1sdi n GLY 115 N -0.43 -1.03 0.26 1.57 0.00 -0.49 -2.52 105.19 102.56 1sdi n GLY 115 Ca -0.01 0.04 0.18 0.00 0.00 0.00 0.00 46.02 46.22 1sdi n GLY 115 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1sdi h LEU 116 N 0.00 0.00 -2.09 0.99 3.38 -1.13 -0.93 115.31 115.53 1sdi h LEU 116 Ca 0.00 0.00 0.09 0.00 0.09 0.00 0.00 57.88 58.06 1sdi h LEU 116 Cb 0.24 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 1sdi h LEU 116 CO 0.00 0.00 0.31 1.56 0.09 0.00 0.00 178.44 180.40 1sdi h GLN 117 N 0.00 0.00 -0.92 1.13 4.20 -1.70 0.84 115.11 118.66 1sdi h GLN 117 Ca 0.00 0.00 0.08 0.00 0.06 0.00 0.00 58.65 58.79 1sdi h GLN 117 Cb 0.04 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 27.76 1sdi h GLN 117 CO 0.00 0.00 0.59 0.00 -0.67 0.00 0.00 178.83 178.75 1sdi h ARG 118 N 0.00 0.96 0.00 1.46 3.08 -1.42 -2.99 114.38 115.47 1sdi h ARG 118 Ca 0.15 -0.06 -0.34 0.00 0.07 0.00 0.00 59.98 59.81 1sdi h ARG 118 Cb 0.77 -0.22 -0.06 0.00 0.08 0.00 0.00 29.97 30.54 1sdi h ARG 118 CO -0.00 0.64 -2.27 1.04 -1.07 0.00 0.00 179.97 178.31 1sdi n GLN 119 N -4.51 0.68 0.28 0.04 3.00 -0.71 -4.47 117.38 111.69 1sdi n GLN 119 Ca 0.15 0.02 0.17 0.00 -0.01 0.00 0.00 57.00 57.33 1sdi n GLN 119 Cb 0.24 -1.56 0.77 0.00 0.00 0.00 0.00 30.24 29.70 1sdi n GLN 119 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.06 176.99 1sdi h LEU 120 N 0.00 0.00 -1.01 1.08 3.38 -0.78 -0.54 115.31 117.44 1sdi h LEU 120 Ca -0.48 0.00 0.07 0.00 0.09 0.00 0.00 57.88 57.56 1sdi h LEU 120 Cb 2.14 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 42.82 1sdi h LEU 120 CO 0.03 0.04 0.65 -0.08 0.09 0.00 0.00 178.44 179.17 1sdi h GLU 121 N 0.00 1.14 0.00 1.13 4.81 -1.75 -3.30 114.58 116.62 1sdi h GLU 121 Ca -0.00 -0.07 -0.05 0.00 -0.13 0.00 0.00 59.36 59.11 1sdi h GLU 121 Cb 0.42 -0.26 -0.01 0.00 0.63 0.00 0.00 28.75 29.53 1sdi h GLU 121 CO 0.01 0.75 -1.73 0.72 -0.73 0.00 0.00 179.01 178.03 1sdi n HIS 122 N -4.51 0.00 -4.19 0.92 8.25 -0.77 -5.04 115.22 109.89 1sdi n HIS 122 Ca 0.16 0.00 -0.18 0.00 -0.26 0.00 0.00 57.72 57.44 1sdi n HIS 122 Cb 0.19 -0.41 -0.12 0.00 1.12 0.00 0.00 29.99 30.78 1sdi n HIS 122 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1sdi s PHE 123 N -2.90 1.08 0.67 4.41 0.08 -0.28 -5.15 117.98 115.90 1sdi s PHE 123 Ca -0.06 -0.43 -0.11 0.00 0.12 0.00 0.00 56.93 56.45 1sdi s PHE 123 Cb 0.08 -0.62 -0.01 0.00 -0.57 0.00 0.00 43.02 41.91 1sdi s PHE 123 CO 0.61 0.02 1.05 -0.51 -0.10 0.00 0.00 175.22 176.29 1sdi s ASP 124 N -1.51 5.62 0.26 1.36 1.01 -1.26 -4.34 116.67 117.80 1sdi s ASP 124 Ca -0.03 1.57 -0.03 0.00 0.71 0.00 0.00 52.55 54.77 1sdi s ASP 124 Cb -0.09 -2.49 0.38 0.00 1.01 0.00 0.00 42.92 41.72 1sdi s ASP 124 CO 0.02 -1.28 1.89 0.25 0.21 0.00 0.00 175.17 176.25 1sdi h LEU 125 N -0.60 1.05 -0.82 1.23 5.85 -1.97 -2.36 115.31 117.69 1sdi h LEU 125 Ca -0.44 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.28 1sdi h LEU 125 Cb 1.20 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 42.01 1sdi h LEU 125 CO 0.58 0.68 0.00 0.00 -0.34 0.00 0.00 178.44 179.37 1sdi n GLN 126 N -4.49 1.54 -1.15 1.25 1.13 -1.26 -4.36 117.38 110.05 1sdi n GLN 126 Ca 0.15 -0.81 -0.32 0.00 -1.94 0.00 0.00 57.00 54.08 1sdi n GLN 126 Cb 0.15 -1.39 0.12 0.00 0.11 0.00 0.00 30.24 29.22 1sdi n GLN 126 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 1sdi s SER 127 N -1.66 3.90 0.29 1.08 1.04 -0.89 -4.84 113.70 112.62 1sdi s SER 127 Ca 0.33 2.11 0.03 0.00 0.48 0.00 0.00 55.95 58.90 1sdi s SER 127 Cb 0.17 -2.56 0.64 0.00 0.10 0.00 0.00 66.02 64.37 1sdi s SER 127 CO 0.27 -2.45 1.80 -0.33 0.98 0.00 0.00 173.24 173.51 1sdi h GLU 128 N -1.08 0.81 -0.48 4.02 5.08 -1.92 -1.63 114.58 119.39 1sdi h GLU 128 Ca -0.45 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 57.86 1sdi h GLU 128 Cb 1.26 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 30.31 1sdi h GLU 128 CO 0.48 0.54 0.27 1.15 -1.00 0.00 0.00 179.01 180.44 1sdi h THR 129 N 0.84 1.16 -0.19 1.13 2.02 -1.92 -0.81 112.91 115.14 1sdi h THR 129 Ca 0.53 -0.40 -0.18 0.00 0.77 0.00 0.00 66.41 67.13 1sdi h THR 129 Cb 0.71 0.56 -0.00 0.00 -1.74 0.00 0.00 68.15 67.67 1sdi h THR 129 CO -0.33 0.17 -0.61 -0.07 0.37 0.00 0.00 175.52 175.04 1sdi h LEU 130 N 0.64 0.75 -0.96 2.58 -0.00 -1.70 -1.60 115.31 115.01 1sdi h LEU 130 Ca 0.17 -0.43 0.02 0.00 -0.00 0.00 0.00 57.88 57.64 1sdi h LEU 130 Cb 0.04 -0.22 -0.05 0.00 -0.00 0.00 0.00 40.66 40.43 1sdi h LEU 130 CO -0.03 1.18 0.64 -0.03 -0.00 0.00 0.00 178.44 180.20 1sdi h MET 131 N 0.49 1.24 -0.33 1.13 4.05 -1.15 0.13 114.93 120.49 1sdi h MET 131 Ca -0.01 -0.07 -0.16 0.00 -0.28 0.00 0.00 59.70 59.18 1sdi h MET 131 Cb 1.19 -0.28 -0.01 0.00 -0.80 0.00 0.00 31.60 31.71 1sdi h MET 131 CO 0.12 0.82 -0.42 1.03 0.23 0.00 0.00 176.91 178.69 1sdi h SER 132 N 1.28 0.88 -0.44 1.39 0.87 -1.01 0.21 113.55 116.74 1sdi h SER 132 Ca 0.36 -0.42 -0.11 0.00 -1.23 0.00 0.00 61.79 60.39 1sdi h SER 132 Cb -0.11 -0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 61.59 1sdi h SER 132 CO -0.09 1.18 -0.14 0.00 -0.53 0.00 0.00 176.83 177.25 1sdi h ALA 133 N 0.85 0.83 -0.44 6.23 0.00 -0.82 -0.97 119.26 124.95 1sdi h ALA 133 Ca 0.05 -0.35 -0.10 0.00 0.00 0.00 0.00 54.91 54.51 1sdi h ALA 133 Cb 1.00 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 1sdi h ALA 133 CO 0.10 0.65 -0.10 0.52 0.00 0.00 0.00 179.25 180.41 1sdi h MET 134 N 0.81 0.85 -0.86 0.00 2.86 -0.60 -2.67 114.93 115.32 1sdi h MET 134 Ca 0.12 -0.32 0.04 0.00 -2.06 0.00 0.00 59.70 57.48 1sdi h MET 134 Cb 0.68 -0.05 -0.05 0.00 0.06 0.00 0.00 31.60 32.24 1sdi h MET 134 CO 0.05 0.96 0.55 0.00 1.06 0.00 0.00 176.91 179.53 1sdi h ALA 135 N 0.87 1.14 -0.15 6.32 0.00 -0.78 -2.19 119.26 124.46 1sdi h ALA 135 Ca 0.11 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 1sdi h ALA 135 Cb 0.64 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1sdi h ALA 135 CO 0.04 0.39 -0.17 0.00 0.00 0.00 0.00 179.25 179.51 1sdi h ALA 136 N 1.36 1.42 -0.11 0.00 0.00 -0.94 -0.11 119.26 120.88 1sdi h ALA 136 Ca 0.35 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1sdi h ALA 136 Cb 0.02 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 1sdi h ALA 136 CO -0.12 0.40 0.03 0.82 0.00 0.00 0.00 179.25 180.38 1sdi h ILE 137 N 0.24 1.20 0.13 0.00 2.04 -1.07 0.64 117.51 120.68 1sdi h ILE 137 Ca 0.05 -0.62 -0.00 0.00 1.00 0.00 0.00 64.86 65.28 1sdi h ILE 137 Cb 0.45 1.41 -0.00 0.00 -0.74 0.00 0.00 36.82 37.94 1sdi h ILE 137 CO 0.03 0.18 -0.09 0.22 0.00 0.00 0.00 178.15 178.49 1sdi h TYR 138 N -0.03 -0.23 -0.68 1.37 3.20 -0.96 -1.07 116.97 118.57 1sdi h TYR 138 Ca 0.03 -0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.84 1sdi h TYR 138 Cb 0.26 0.08 -0.03 0.00 1.54 0.00 0.00 36.73 38.58 1sdi h TYR 138 CO 0.01 -0.14 0.19 0.28 -1.64 0.00 0.00 178.16 176.86 1sdi h VAL 139 N -0.22 1.25 0.13 1.81 2.07 -0.94 -0.75 116.25 119.60 1sdi h VAL 139 Ca -0.01 -0.90 -0.30 0.00 0.82 0.00 0.00 66.70 66.32 1sdi h VAL 139 Cb 0.19 0.53 -0.00 0.00 -1.52 0.00 0.00 31.29 30.49 1sdi h VAL 139 CO 0.00 0.35 -1.42 0.44 0.02 0.00 0.00 177.57 176.96 1sdi h ASP 140 N 1.01 0.43 0.00 0.57 3.32 -0.78 -3.39 116.42 117.58 1sdi h ASP 140 Ca 0.22 -0.53 -0.30 0.00 0.02 0.00 0.00 57.03 56.44 1sdi h ASP 140 Cb 0.32 -0.14 -0.06 0.00 0.22 0.00 0.00 39.33 39.68 1sdi h ASP 140 CO -0.00 1.43 -2.15 0.52 -1.72 0.00 0.00 179.24 177.31 1sdi n VAL 141 N -3.49 1.16 -0.08 -1.35 0.31 -0.42 -4.84 118.33 109.62 1sdi n VAL 141 Ca -0.13 -0.48 -0.14 0.00 -0.01 0.00 0.00 64.34 63.57 1sdi n VAL 141 Cb 1.04 -1.12 -0.05 0.00 -0.91 0.00 0.00 33.84 32.80 1sdi n VAL 141 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 1sdi n ILE 142 N -3.02 1.35 -0.32 2.52 5.41 -0.77 -4.68 119.36 119.85 1sdi n ILE 142 Ca -0.35 -0.02 0.10 0.00 1.00 0.00 0.00 62.75 63.49 1sdi n ILE 142 Cb 0.91 -2.03 0.31 0.00 -0.71 0.00 0.00 39.64 38.12 1sdi n ILE 142 CO 0.00 0.00 0.00 -1.28 0.00 0.00 0.00 176.55 175.27 1sdi h SER 143 N -0.80 0.79 0.11 4.38 0.87 -1.36 -1.38 113.55 116.16 1sdi h SER 143 Ca -0.24 0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.37 1sdi h SER 143 Cb 1.09 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 62.95 1sdi h SER 143 CO -0.14 0.38 0.00 -2.65 -0.53 0.00 0.00 176.83 173.89 1sdi n PRO 144 N -4.62 0.05 0.04 2.24 -0.02 -1.26 -2.24 135.00 129.20 1sdi n PRO 144 Ca 0.19 0.50 0.13 0.00 -2.02 0.00 0.00 63.50 62.30 1sdi n PRO 144 Cb 0.45 -1.65 0.51 0.00 -0.02 0.00 0.00 33.50 32.79 1sdi n PRO 144 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1sdi n LEU 145 N -1.76 0.31 -3.99 2.45 4.77 -0.52 -4.85 117.00 113.41 1sdi n LEU 145 Ca 0.00 0.54 -0.12 0.00 -0.03 0.00 0.00 56.01 56.40 1sdi n LEU 145 Cb 0.05 -0.44 -0.03 0.00 -2.33 0.00 0.00 43.42 40.66 1sdi n LEU 145 CO 0.06 -0.12 0.25 -0.83 -1.33 0.00 0.00 177.39 175.42 1sdi s GLY 146 N -3.22 0.92 0.56 -0.72 0.00 -0.95 -4.98 107.32 98.92 1sdi s GLY 146 Ca 0.12 -1.13 -0.21 0.00 0.00 0.00 0.00 44.72 43.50 1sdi s GLY 146 CO 0.52 -0.71 1.33 -1.05 0.00 0.00 0.00 173.10 173.19 1sdi n PRO 147 N -0.50 1.57 -1.64 2.90 -0.02 -1.26 -4.88 135.00 131.16 1sdi n PRO 147 Ca -0.02 0.58 -0.42 0.00 -2.02 0.00 0.00 63.50 61.62 1sdi n PRO 147 Cb 0.61 -2.54 0.01 0.00 -0.02 0.00 0.00 33.50 31.55 1sdi n PRO 147 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1sdi n ARG 148 N -1.11 1.60 -1.91 -0.52 5.12 -1.26 -4.92 116.66 113.65 1sdi n ARG 148 Ca 0.11 0.57 -0.42 0.00 -1.93 0.00 0.00 57.85 56.18 1sdi n ARG 148 Cb 0.45 -2.13 -0.03 0.00 -1.16 0.00 0.00 32.46 29.59 1sdi n ARG 148 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1sdi s ILE 149 N -1.20 2.82 -0.49 0.55 1.01 -1.26 -4.96 121.20 117.67 1sdi s ILE 149 Ca 0.61 0.44 -0.25 0.00 0.00 0.00 0.00 60.65 61.44 1sdi s ILE 149 Cb -0.57 -3.28 0.03 0.00 0.01 0.00 0.00 42.46 38.65 1sdi s ILE 149 CO 0.58 0.01 0.94 -1.10 0.00 0.00 0.00 174.94 175.38 1sdi s GLN 150 N 2.00 3.48 -0.24 2.79 -1.52 -1.26 -5.02 119.66 119.89 1sdi s GLN 150 Ca 0.73 0.05 -0.09 0.00 -1.95 0.00 0.00 55.36 54.10 1sdi s GLN 150 Cb -0.42 -3.96 -0.04 0.00 -0.22 0.00 0.00 33.01 28.36 1sdi s GLN 150 CO 0.32 -1.31 0.13 0.08 -0.25 0.00 0.00 175.29 174.25 1sdi s VAL 151 N 3.86 5.02 0.31 1.09 1.01 -1.26 -5.01 120.40 125.42 1sdi s VAL 151 Ca 0.36 0.06 0.10 0.00 0.00 0.00 0.00 61.98 62.50 1sdi s VAL 151 Cb -0.11 -3.34 -0.06 0.00 0.00 0.00 0.00 36.38 32.88 1sdi s VAL 151 CO 0.24 0.35 -0.13 0.42 0.00 0.00 0.00 175.10 175.98 1sdi s THR 152 N 1.18 2.21 0.00 3.92 -4.23 -1.26 -5.07 115.64 112.39 1sdi s THR 152 Ca 0.06 -2.26 0.00 0.00 -1.18 0.00 0.00 61.69 58.31 1sdi s THR 152 Cb -0.14 -2.48 0.00 0.00 1.34 0.00 0.00 72.50 71.22 1sdi s THR 152 CO 0.05 -0.30 0.00 0.61 -0.54 0.00 0.00 174.62 174.44 1sdi n GLY 153 N -0.69 -0.25 3.51 3.99 0.00 -1.26 -4.66 105.19 105.82 1sdi n GLY 153 Ca -0.05 0.43 -0.42 0.00 0.00 0.00 0.00 46.02 45.97 1sdi n GLY 153 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1sdi s SER 154 N -4.00 6.23 0.25 1.61 0.15 -0.30 -4.89 113.70 112.75 1sdi s SER 154 Ca 0.00 -0.49 -0.03 0.00 0.70 0.00 0.00 55.95 56.13 1sdi s SER 154 Cb 0.00 -2.24 0.46 0.00 -1.71 0.00 0.00 66.02 62.53 1sdi s SER 154 CO 0.00 -0.56 1.78 -0.65 1.20 0.00 0.00 173.24 175.01 1sdi h PRO 155 N 8.68 0.65 -0.21 5.44 0.11 -1.97 -1.23 132.00 143.47 1sdi h PRO 155 Ca -0.27 -0.04 -0.12 0.00 0.11 0.00 0.00 66.00 65.68 1sdi h PRO 155 Cb 1.11 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.07 1sdi h PRO 155 CO 0.79 0.43 -0.40 0.00 -0.21 0.00 0.00 178.00 178.62 1sdi h ALA 156 N 1.51 0.92 -0.53 -0.75 0.00 -1.96 -2.57 119.26 115.88 1sdi h ALA 156 Ca 0.42 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1sdi h ALA 156 Cb 0.52 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 1sdi h ALA 156 CO -0.31 0.63 0.33 0.28 0.00 0.00 0.00 179.25 180.18 1sdi h VAL 157 N 0.41 1.15 0.00 0.00 2.07 -1.70 -2.48 116.25 115.70 1sdi h VAL 157 Ca 0.04 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 67.24 1sdi h VAL 157 Cb 0.87 0.40 0.00 0.00 -1.52 0.00 0.00 31.29 31.05 1sdi h VAL 157 CO 0.07 0.15 0.00 0.18 0.02 0.00 0.00 177.57 178.00 1sdi n LEU 158 N -4.69 0.00 0.16 2.57 4.77 -0.53 -1.91 117.00 117.37 1sdi n LEU 158 Ca 0.03 0.40 0.13 0.00 -0.03 0.00 0.00 56.01 56.54 1sdi n LEU 158 Cb 0.04 -0.40 0.51 0.00 -2.33 0.00 0.00 43.42 41.24 1sdi n LEU 158 CO 0.36 -0.20 0.89 1.56 -1.33 0.00 0.00 177.39 178.67 1sdi h GLN 159 N 0.00 0.00 -6.41 3.23 4.20 -1.06 -3.43 115.11 111.64 1sdi h GLN 159 Ca 0.00 0.00 -0.54 0.00 0.06 0.00 0.00 58.65 58.17 1sdi h GLN 159 Cb 0.21 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.98 1sdi h GLN 159 CO 0.00 0.00 0.65 0.45 -0.67 0.00 0.00 178.83 179.26 1sdi s SER 160 N -4.69 7.03 0.38 1.46 0.15 -0.80 -4.92 113.70 112.30 1sdi s SER 160 Ca 0.05 1.97 0.12 0.00 0.70 0.00 0.00 55.95 58.79 1sdi s SER 160 Cb 0.09 -2.57 0.74 0.00 -1.71 0.00 0.00 66.02 62.57 1sdi s SER 160 CO 0.47 -0.55 1.84 1.55 1.20 0.00 0.00 173.24 177.75 1sdi h PRO 161 N 7.18 0.04 -0.52 5.44 0.13 -1.90 -1.74 132.00 140.63 1sdi h PRO 161 Ca -0.39 -0.01 -0.05 0.00 -0.87 0.00 0.00 66.00 64.69 1sdi h PRO 161 Cb 1.19 -0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.30 1sdi h PRO 161 CO 0.85 0.37 0.15 1.96 -0.23 0.00 0.00 178.00 181.10 1sdi h GLN 162 N 0.03 0.82 -0.41 0.86 7.50 -1.96 -0.21 115.11 121.74 1sdi h GLN 162 Ca 0.00 -0.19 -0.01 0.00 0.50 0.00 0.00 58.65 58.95 1sdi h GLN 162 Cb 0.61 -0.11 -0.02 0.00 0.05 0.00 0.00 27.48 28.01 1sdi h GLN 162 CO 0.04 0.77 0.21 0.28 -1.50 0.00 0.00 178.83 178.64 1sdi h VAL 163 N 0.72 1.16 -0.90 -0.54 2.07 -1.81 -1.67 116.25 115.28 1sdi h VAL 163 Ca 0.17 -0.44 0.07 0.00 0.82 0.00 0.00 66.70 67.31 1sdi h VAL 163 Cb 0.30 0.70 -0.06 0.00 -1.52 0.00 0.00 31.29 30.71 1sdi h VAL 163 CO -0.00 0.17 0.56 1.56 0.02 0.00 0.00 177.57 179.88 1sdi h GLN 164 N 0.53 0.98 -0.30 1.57 1.08 -1.06 -0.08 115.11 117.83 1sdi h GLN 164 Ca 0.14 -0.06 -0.04 0.00 -1.45 0.00 0.00 58.65 57.24 1sdi h GLN 164 Cb 0.08 -0.22 -0.01 0.00 -0.05 0.00 0.00 27.48 27.28 1sdi h GLN 164 CO -0.02 0.65 0.03 0.00 -0.95 0.00 0.00 178.83 178.54 1sdi h ALA 165 N 1.43 0.40 -0.73 3.87 0.00 -0.79 -0.81 119.26 122.62 1sdi h ALA 165 Ca 0.40 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 1sdi h ALA 165 Cb 0.19 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 1sdi h ALA 165 CO -0.18 0.12 0.36 0.87 0.00 0.00 0.00 179.25 180.41 1sdi h LYS 166 N 0.32 1.06 -0.14 0.00 1.57 -0.65 -0.33 116.57 118.41 1sdi h LYS 166 Ca 0.09 -0.15 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1sdi h LYS 166 Cb 0.38 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.50 1sdi h LYS 166 CO 0.01 0.82 0.09 0.28 -0.57 0.00 0.00 179.45 180.08 1sdi h VAL 167 N 1.03 1.05 -0.63 0.50 2.07 -0.83 -1.07 116.25 118.37 1sdi h VAL 167 Ca 0.25 -0.11 -0.08 0.00 0.82 0.00 0.00 66.70 67.58 1sdi h VAL 167 Cb 0.11 0.88 -0.02 0.00 -1.52 0.00 0.00 31.29 30.74 1sdi h VAL 167 CO -0.03 0.05 0.07 0.03 0.02 0.00 0.00 177.57 177.70 1sdi h ARG 168 N 0.17 1.05 -0.80 1.57 2.47 -0.87 -0.20 114.38 117.78 1sdi h ARG 168 Ca 0.05 -0.29 -0.04 0.00 -1.26 0.00 0.00 59.98 58.44 1sdi h ARG 168 Cb 0.00 -0.12 -0.04 0.00 -1.65 0.00 0.00 29.97 28.17 1sdi h ARG 168 CO -0.01 0.98 0.33 0.00 0.56 0.00 0.00 179.97 181.83 1sdi h ALA 169 N 1.09 1.07 -0.32 0.04 0.00 -0.97 -0.32 119.26 119.85 1sdi h ALA 169 Ca 0.19 -0.19 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 1sdi h ALA 169 Cb 0.47 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1sdi h ALA 169 CO 0.02 0.66 -0.27 1.15 0.00 0.00 0.00 179.25 180.81 1sdi h THR 170 N 1.16 1.28 -0.84 0.00 2.02 -0.83 -1.82 112.91 113.88 1sdi h THR 170 Ca 0.27 -1.37 -0.03 0.00 0.77 0.00 0.00 66.41 66.05 1sdi h THR 170 Cb 0.20 1.33 -0.04 0.00 -1.74 0.00 0.00 68.15 67.90 1sdi h THR 170 CO -0.02 0.44 0.42 -0.07 0.37 0.00 0.00 175.52 176.66 1sdi h LEU 171 N 0.56 1.09 -0.86 2.58 3.38 -0.80 -1.15 115.31 120.10 1sdi h LEU 171 Ca 0.07 -0.12 -0.00 0.00 0.09 0.00 0.00 57.88 57.92 1sdi h LEU 171 Cb 0.75 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 41.18 1sdi h LEU 171 CO 0.06 0.90 0.53 0.25 0.09 0.00 0.00 178.44 180.27 1sdi h LEU 172 N 1.19 1.02 -1.01 1.67 5.85 -0.56 0.36 115.31 123.83 1sdi h LEU 172 Ca 0.29 -0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.96 1sdi h LEU 172 Cb 0.09 -0.26 -0.05 0.00 0.37 0.00 0.00 40.66 40.82 1sdi h LEU 172 CO -0.04 0.78 0.63 0.00 -0.34 0.00 0.00 178.44 179.47 1sdi h ALA 173 N 1.29 1.27 -0.59 1.25 0.00 -0.79 -1.21 119.26 120.49 1sdi h ALA 173 Ca 0.31 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 1sdi h ALA 173 Cb -0.07 -0.39 -0.03 0.00 0.00 0.00 0.00 17.79 17.30 1sdi h ALA 173 CO -0.06 0.66 0.30 0.78 0.00 0.00 0.00 179.25 180.93 1sdi h GLY 174 N 1.33 0.89 0.99 0.00 0.00 -0.07 -0.40 103.07 105.81 1sdi h GLY 174 Ca 0.35 -0.42 -0.01 0.00 0.00 0.00 0.00 47.33 47.25 1sdi h GLY 174 CO -0.07 0.41 0.31 -2.22 0.00 0.00 0.00 176.54 174.96 1sdi h ILE 175 N 0.80 1.17 -0.80 2.60 1.08 -0.66 -1.36 117.51 120.33 1sdi h ILE 175 Ca 0.20 -0.42 -0.01 0.00 -0.39 0.00 0.00 64.86 64.24 1sdi h ILE 175 Cb 0.08 0.47 -0.04 0.00 -3.07 0.00 0.00 36.82 34.27 1sdi h ILE 175 CO -0.03 0.18 0.46 -0.09 -0.69 0.00 0.00 178.15 177.98 1sdi h ARG 176 N 0.73 1.10 -0.19 2.37 1.12 -0.84 -0.50 114.38 118.17 1sdi h ARG 176 Ca 0.19 -0.11 -0.10 0.00 -1.11 0.00 0.00 59.98 58.86 1sdi h ARG 176 Cb 0.02 -0.23 -0.01 0.00 -0.01 0.00 0.00 29.97 29.74 1sdi h ARG 176 CO -0.03 0.79 -0.31 0.00 -3.11 0.00 0.00 179.97 177.31 1sdi h ALA 177 N 1.39 1.14 -0.09 2.80 0.00 -0.82 -2.83 119.26 120.86 1sdi h ALA 177 Ca 0.29 -0.36 -0.13 0.00 0.00 0.00 0.00 54.91 54.71 1sdi h ALA 177 Cb -0.01 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1sdi h ALA 177 CO -0.05 0.55 -0.53 0.00 0.00 0.00 0.00 179.25 179.22 1sdi h ALA 178 N 1.36 0.95 -0.23 0.00 0.00 -0.39 -0.10 119.26 120.84 1sdi h ALA 178 Ca 0.04 -0.49 -0.02 0.00 0.00 0.00 0.00 54.91 54.44 1sdi h ALA 178 Cb 0.70 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1sdi h ALA 178 CO 0.05 0.68 0.05 0.28 0.00 0.00 0.00 179.25 180.31 1sdi h VAL 179 N 0.19 1.21 -0.56 0.00 2.07 -1.00 -2.45 116.25 115.70 1sdi h VAL 179 Ca 0.00 -0.69 0.04 0.00 0.82 0.00 0.00 66.70 66.87 1sdi h VAL 179 Cb 0.99 1.23 -0.04 0.00 -1.52 0.00 0.00 31.29 31.95 1sdi h VAL 179 CO 0.08 0.22 0.33 0.25 0.02 0.00 0.00 177.57 178.47 1sdi h LEU 180 N 0.19 0.51 -0.69 2.57 5.85 -1.24 -1.67 115.31 120.83 1sdi h LEU 180 Ca 0.07 0.01 0.09 0.00 0.84 0.00 0.00 57.88 58.90 1sdi h LEU 180 Cb 0.28 -0.09 -0.07 0.00 0.37 0.00 0.00 40.66 41.15 1sdi h LEU 180 CO 0.00 0.35 0.33 -0.25 -0.34 0.00 0.00 178.44 178.53 1sdi h TRP 181 N 0.63 0.59 -0.06 1.25 7.01 -0.79 -0.38 115.95 124.21 1sdi h TRP 181 Ca 0.24 0.03 -0.16 0.00 2.11 0.00 0.00 58.89 61.10 1sdi h TRP 181 Cb 0.07 -0.16 -0.01 0.00 -2.10 0.00 0.00 29.16 26.96 1sdi h TRP 181 CO -0.07 0.20 -0.68 0.45 -2.79 0.00 0.00 178.44 175.55 1sdi h HIS 182 N 0.56 0.37 0.00 2.65 3.86 -1.16 0.85 115.15 122.28 1sdi h HIS 182 Ca 0.34 -0.15 -0.06 0.00 -1.16 0.00 0.00 60.37 59.34 1sdi h HIS 182 Cb 0.37 -0.06 -0.01 0.00 1.06 0.00 0.00 27.41 28.77 1sdi h HIS 182 CO -0.12 0.87 -0.28 1.96 0.86 0.00 0.00 177.93 181.22 1sdi h GLN 183 N 0.19 0.00 -0.39 2.45 4.20 -0.22 -2.79 115.11 118.55 1sdi h GLN 183 Ca -0.02 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.69 1sdi h GLN 183 Cb 1.22 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.00 1sdi h GLN 183 CO 0.11 0.28 0.00 1.33 -0.67 0.00 0.00 178.83 179.88 1sdi n VAL 184 N -4.19 0.51 0.00 -0.54 0.24 -0.29 -4.93 118.33 109.13 1sdi n VAL 184 Ca -0.02 -0.68 0.00 0.00 -2.04 0.00 0.00 64.34 61.60 1sdi n VAL 184 Cb 0.33 0.75 0.00 0.00 -1.47 0.00 0.00 33.84 33.45 1sdi n VAL 184 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1sdi n GLY 185 N 1.43 0.96 3.81 7.63 0.00 -1.05 -4.55 105.19 113.43 1sdi n GLY 185 Ca 0.19 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.91 1sdi n GLY 185 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1sdi s GLY 186 N -0.70 1.65 0.00 -0.02 0.00 0.27 -4.89 107.32 103.63 1sdi s GLY 186 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 44.72 44.66 1sdi s GLY 186 CO 0.00 0.30 0.00 0.61 0.00 0.00 0.00 173.10 174.01 1sdi n GLY 187 N -2.06 -2.21 0.45 0.20 0.00 -1.26 -4.32 105.19 95.98 1sdi n GLY 187 Ca 0.07 -1.20 -0.15 0.00 0.00 0.00 0.00 46.02 44.73 1sdi n GLY 187 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1sdi h ARG 188 N 0.00 -0.70 -0.49 1.61 2.43 -1.99 -0.79 114.38 114.45 1sdi h ARG 188 Ca 0.00 0.05 -0.13 0.00 -0.81 0.00 0.00 59.98 59.09 1sdi h ARG 188 Cb 0.00 0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.69 1sdi h ARG 188 CO 0.00 -0.47 -0.18 -0.07 -1.51 0.00 0.00 179.97 177.74 1sdi h LEU 189 N -0.73 1.00 -0.62 3.80 3.38 -1.99 -2.47 115.31 117.68 1sdi h LEU 189 Ca 0.00 -0.36 -0.03 0.00 0.09 0.00 0.00 57.88 57.58 1sdi h LEU 189 Cb 0.73 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.18 1sdi h LEU 189 CO -0.24 1.15 0.26 -0.61 0.09 0.00 0.00 178.44 179.09 1sdi h GLN 190 N 0.86 0.92 -0.11 1.13 5.75 -1.86 -1.57 115.11 120.22 1sdi h GLN 190 Ca 0.12 -0.16 -0.00 0.00 -0.15 0.00 0.00 58.65 58.46 1sdi h GLN 190 Cb 0.75 -0.15 -0.01 0.00 1.07 0.00 0.00 27.48 29.14 1sdi h GLN 190 CO 0.06 0.76 0.06 1.25 -2.65 0.00 0.00 178.83 178.32 1sdi h LEU 191 N 0.86 0.13 -1.08 -2.39 5.85 -1.07 -1.77 115.31 115.85 1sdi h LEU 191 Ca 0.21 -0.06 0.27 0.00 0.84 0.00 0.00 57.88 59.14 1sdi h LEU 191 Cb 0.18 -0.03 -0.12 0.00 0.37 0.00 0.00 40.66 41.05 1sdi h LEU 191 CO -0.02 0.15 0.61 -0.03 -0.34 0.00 0.00 178.44 178.82 1sdi h MET 192 N 0.10 0.46 -0.09 1.25 4.05 -1.15 -2.52 114.93 117.03 1sdi h MET 192 Ca 0.04 -0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.43 1sdi h MET 192 Cb 0.05 -0.10 0.00 0.00 -0.80 0.00 0.00 31.60 30.74 1sdi h MET 192 CO -0.01 0.31 0.00 1.19 0.23 0.00 0.00 176.91 178.63 1sdi n PHE 193 N -4.87 0.09 -1.75 1.39 3.72 -0.62 -4.52 117.46 110.90 1sdi n PHE 193 Ca 0.28 -0.04 0.00 0.00 -0.05 0.00 0.00 57.45 57.64 1sdi n PHE 193 Cb 0.85 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.39 1sdi n PHE 193 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1sdi n SER 194 N 1.22 0.10 -0.11 4.37 7.64 -0.69 -4.92 113.62 121.23 1sdi n SER 194 Ca 0.15 -1.84 -0.05 0.00 1.01 0.00 0.00 58.87 58.14 1sdi n SER 194 Cb 0.57 -0.17 0.01 0.00 -1.01 0.00 0.00 64.21 63.61 1sdi n SER 194 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 1sdi h ARG 195 N 0.00 0.01 -0.84 1.43 2.43 -1.74 -1.33 114.38 114.34 1sdi h ARG 195 Ca 0.00 -0.00 0.05 0.00 -0.81 0.00 0.00 59.98 59.22 1sdi h ARG 195 Cb 1.30 -0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 30.79 1sdi h ARG 195 CO 0.00 0.01 0.53 -0.97 -1.51 0.00 0.00 179.97 178.03 1sdi h ASN 196 N 0.01 0.86 -0.94 -3.80 -0.73 -1.91 -0.55 115.58 108.51 1sdi h ASN 196 Ca 0.18 0.01 -0.01 0.00 1.87 0.00 0.00 56.30 58.34 1sdi h ASN 196 Cb 0.27 -0.18 -0.05 0.00 0.27 0.00 0.00 38.32 38.64 1sdi h ASN 196 CO -0.37 0.57 0.56 0.03 -0.37 0.00 0.00 177.43 177.85 1sdi h ARG 197 N 1.00 1.29 -0.13 6.67 3.08 -1.80 -0.42 114.38 124.07 1sdi h ARG 197 Ca 0.35 -0.12 -0.12 0.00 0.07 0.00 0.00 59.98 60.15 1sdi h ARG 197 Cb 0.08 -0.27 0.00 0.00 0.08 0.00 0.00 29.97 29.87 1sdi h ARG 197 CO -0.14 0.91 -0.39 -0.07 -1.07 0.00 0.00 179.97 179.20 1sdi h LEU 198 N 1.31 0.56 0.02 3.04 3.38 -1.08 -1.33 115.31 121.20 1sdi h LEU 198 Ca 0.34 -0.60 0.01 0.00 0.09 0.00 0.00 57.88 57.72 1sdi h LEU 198 Cb -0.04 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 1sdi h LEU 198 CO -0.06 1.07 -0.08 0.74 0.09 0.00 0.00 178.44 180.19 1sdi h THR 199 N 0.09 0.79 -0.44 0.22 2.02 -0.95 -0.58 112.91 114.06 1sdi h THR 199 Ca -0.01 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.22 1sdi h THR 199 Cb 1.02 0.79 -0.05 0.00 -1.74 0.00 0.00 68.15 68.17 1sdi h THR 199 CO 0.08 0.00 0.17 0.74 0.37 0.00 0.00 175.52 176.88 1sdi h THR 200 N -0.16 0.88 -0.83 3.16 2.02 -1.06 -0.96 112.91 115.96 1sdi h THR 200 Ca 0.03 -0.12 -0.03 0.00 0.77 0.00 0.00 66.41 67.06 1sdi h THR 200 Cb 0.19 0.50 -0.04 0.00 -1.74 0.00 0.00 68.15 67.06 1sdi h THR 200 CO -0.07 0.06 0.42 -0.61 0.37 0.00 0.00 175.52 175.70 1sdi h GLN 201 N 0.35 1.19 -0.26 6.66 5.75 -1.01 -0.17 115.11 127.62 1sdi h GLN 201 Ca 0.20 -0.16 -0.04 0.00 -0.15 0.00 0.00 58.65 58.50 1sdi h GLN 201 Cb 0.18 -0.22 -0.01 0.00 1.07 0.00 0.00 27.48 28.50 1sdi h GLN 201 CO -0.19 0.90 0.01 0.00 -2.65 0.00 0.00 178.83 176.90 1sdi h ALA 202 N 1.23 0.35 -0.37 3.38 0.00 -0.82 -1.34 119.26 121.68 1sdi h ALA 202 Ca 0.29 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1sdi h ALA 202 Cb 0.09 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1sdi h ALA 202 CO -0.04 0.06 0.16 0.87 0.00 0.00 0.00 179.25 180.31 1sdi h LYS 203 N 0.23 0.51 -0.54 0.00 1.57 -1.02 -1.30 116.57 116.03 1sdi h LYS 203 Ca 0.07 -0.06 -0.09 0.00 -1.87 0.00 0.00 60.65 58.71 1sdi h LYS 203 Cb 0.39 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.58 1sdi h LYS 203 CO 0.01 0.41 -0.02 0.37 -0.57 0.00 0.00 179.45 179.65 1sdi h GLN 204 N 0.52 0.94 -0.48 3.15 -0.00 -0.60 -1.06 115.11 117.58 1sdi h GLN 204 Ca 0.13 -0.29 -0.13 0.00 -0.00 0.00 0.00 58.65 58.35 1sdi h GLN 204 Cb 0.08 -0.09 -0.01 0.00 0.00 0.00 0.00 27.48 27.46 1sdi h GLN 204 CO -0.02 0.95 -0.22 0.82 0.00 0.00 0.00 178.83 180.36 1sdi h ILE 205 N 0.87 1.27 -0.27 2.39 2.04 -0.89 -1.20 117.51 121.71 1sdi h ILE 205 Ca 0.16 -1.39 -0.09 0.00 1.00 0.00 0.00 64.86 64.54 1sdi h ILE 205 Cb 0.54 1.13 -0.01 0.00 -0.74 0.00 0.00 36.82 37.74 1sdi h ILE 205 CO 0.03 0.48 -0.21 -0.07 0.00 0.00 0.00 178.15 178.38 1sdi h LEU 206 N 0.86 0.50 -0.44 1.44 3.38 -1.03 -1.00 115.31 119.01 1sdi h LEU 206 Ca 0.11 -0.16 -0.09 0.00 0.09 0.00 0.00 57.88 57.83 1sdi h LEU 206 Cb 0.80 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.40 1sdi h LEU 206 CO 0.07 0.72 -0.07 0.00 0.09 0.00 0.00 178.44 179.24 1sdi h ALA 207 N 1.33 0.61 -0.66 1.53 0.00 -1.02 -2.67 119.26 118.37 1sdi h ALA 207 Ca 0.07 -0.31 0.02 0.00 0.00 0.00 0.00 54.91 54.68 1sdi h ALA 207 Cb 0.62 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 1sdi h ALA 207 CO 0.04 0.47 0.44 1.25 0.00 0.00 0.00 179.25 181.45 1sdi h HIS 208 N 0.67 0.81 0.00 0.00 -0.00 -0.58 -1.41 115.15 114.65 1sdi h HIS 208 Ca 0.12 0.02 0.00 0.00 -0.00 0.00 0.00 60.37 60.51 1sdi h HIS 208 Cb 0.60 -0.27 0.00 0.00 -0.00 0.00 0.00 27.41 27.74 1sdi h HIS 208 CO 0.05 0.50 0.00 1.28 -0.00 0.00 0.00 177.93 179.75 1sdi n LEU 209 N -4.44 0.00 -3.14 0.26 4.77 -0.44 -4.27 117.00 109.74 1sdi n LEU 209 Ca 0.07 0.29 -0.21 0.00 -0.03 0.00 0.00 56.01 56.13 1sdi n LEU 209 Cb 0.07 -0.29 -0.04 0.00 -2.33 0.00 0.00 43.42 40.83 1sdi n LEU 209 CO 0.36 -0.06 -0.13 0.41 -1.33 0.00 0.00 177.39 176.64 1sdi n THR 210 N -1.29 0.69 0.24 -5.08 -1.04 -0.53 -4.92 114.28 102.35 1sdi n THR 210 Ca 0.11 -4.79 0.07 0.00 -2.04 0.00 0.00 64.05 57.40 1sdi n THR 210 Cb 0.20 -0.86 0.59 0.00 -1.82 0.00 0.00 70.33 68.43 1sdi n THR 210 CO 0.00 0.00 0.00 1.55 -0.64 0.00 0.00 175.07 175.98 1sdi h PRO 211 N 3.19 0.00 0.00 -2.82 0.13 -1.74 -2.34 132.00 128.42 1sdi h PRO 211 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1sdi h PRO 211 Cb 0.83 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.96 1sdi h PRO 211 CO 0.59 0.09 0.00 1.05 -0.23 0.00 0.00 178.00 179.50 1sdi h GLU 212 N 0.00 0.00 -0.01 0.86 9.09 -1.92 -3.53 114.58 119.07 1sdi h GLU 212 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1sdi h GLU 212 Cb 0.17 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.27 1sdi h GLU 212 CO 0.01 0.00 0.00 1.28 0.05 0.00 0.00 179.01 180.35