#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nuu h HIS -1 N 0.00 0.00 -0.00 1.57 2.07 -2.12 -1.92 115.15 114.75 2nuu h HIS -1 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 2nuu h HIS -1 Cb 0.00 0.00 0.00 0.00 2.57 0.00 0.00 27.41 29.98 2nuu h HIS -1 CO 0.00 0.00 -0.23 -2.39 -3.07 0.00 0.00 177.93 172.24 2nuu n HIS 0 N -4.20 0.00 -1.92 6.12 -0.00 -1.26 -4.90 115.22 109.06 2nuu n HIS 0 Ca -0.00 0.00 -0.39 0.00 -0.00 0.00 0.00 57.72 57.33 2nuu n HIS 0 Cb 0.22 -0.35 0.01 0.00 -0.00 0.00 0.00 29.99 29.86 2nuu n HIS 0 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 2nuu s HIS 1 N -2.94 2.60 0.15 -1.40 2.46 -0.72 -5.02 115.29 110.42 2nuu s HIS 1 Ca 0.14 1.35 -0.05 0.00 0.47 0.00 0.00 55.06 56.97 2nuu s HIS 1 Cb 0.18 -3.77 -0.02 0.00 -0.13 0.00 0.00 32.58 28.84 2nuu s HIS 1 CO 0.60 -2.52 0.18 -3.38 -2.47 0.00 0.00 174.74 167.15 2nuu s HIS 2 N -1.26 0.63 0.66 3.88 -3.43 -1.26 -5.09 115.29 109.42 2nuu s HIS 2 Ca 0.61 -0.99 -0.04 0.00 -0.80 0.00 0.00 55.06 53.83 2nuu s HIS 2 Cb -0.40 -0.26 0.05 0.00 -1.43 0.00 0.00 32.58 30.54 2nuu s HIS 2 CO 0.51 -0.63 0.94 0.00 -2.00 0.00 0.00 174.74 173.55 2nuu s ALA 3 N -4.01 3.40 -0.05 -1.38 0.00 -1.26 -5.10 121.76 113.35 2nuu s ALA 3 Ca 0.21 -1.07 0.06 0.00 0.00 0.00 0.00 51.96 51.17 2nuu s ALA 3 Cb 0.05 -2.42 -0.01 0.00 0.00 0.00 0.00 23.12 20.74 2nuu s ALA 3 CO 0.01 -1.13 -0.25 0.08 0.00 0.00 0.00 175.76 174.48 2nuu s VAL 4 N -3.09 2.02 0.36 0.00 1.01 -1.26 -4.76 120.40 114.67 2nuu s VAL 4 Ca 0.59 -1.05 -0.27 0.00 0.00 0.00 0.00 61.98 61.25 2nuu s VAL 4 Cb -0.10 -1.70 -0.09 0.00 0.00 0.00 0.00 36.38 34.48 2nuu s VAL 4 CO 0.43 0.56 1.21 0.00 0.00 0.00 0.00 175.10 177.30 2nuu s ALA 5 N -0.20 3.30 -0.27 5.51 0.00 -1.26 -4.79 121.76 124.05 2nuu s ALA 5 Ca -0.02 1.06 -0.14 0.00 0.00 0.00 0.00 51.96 52.86 2nuu s ALA 5 Cb -0.13 -3.41 -0.04 0.00 0.00 0.00 0.00 23.12 19.54 2nuu s ALA 5 CO 0.03 -0.53 0.33 0.34 0.00 0.00 0.00 175.76 175.93 2nuu s ASP 6 N -0.87 6.21 0.26 0.00 3.68 0.88 -4.97 116.67 121.85 2nuu s ASP 6 Ca 0.53 0.23 -0.02 0.00 2.13 0.00 0.00 52.55 55.41 2nuu s ASP 6 Cb -0.34 -2.19 0.45 0.00 -1.45 0.00 0.00 42.92 39.39 2nuu s ASP 6 CO 0.44 -0.15 1.83 0.11 0.13 0.00 0.00 175.17 177.54 2nuu h LYS 7 N 8.18 0.92 -0.52 4.34 1.57 -1.94 -0.77 116.57 128.34 2nuu h LYS 7 Ca -0.33 -0.06 0.08 0.00 -1.87 0.00 0.00 60.65 58.48 2nuu h LYS 7 Cb 1.17 -0.21 -0.07 0.00 0.08 0.00 0.00 32.23 33.20 2nuu h LYS 7 CO 0.63 0.61 0.14 0.00 -0.57 0.00 0.00 179.45 180.26 2nuu h ALA 8 N 1.48 0.62 -0.22 3.86 0.00 -1.95 0.59 119.26 123.65 2nuu h ALA 8 Ca 0.44 0.09 -0.10 0.00 0.00 0.00 0.00 54.91 55.33 2nuu h ALA 8 Cb 0.36 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2nuu h ALA 8 CO -0.23 -0.26 -0.31 -0.44 0.00 0.00 0.00 179.25 178.00 2nuu h ASP 9 N 0.30 0.45 0.01 0.00 3.32 -1.65 -1.80 116.42 117.06 2nuu h ASP 9 Ca 0.26 -0.17 -0.00 0.00 0.02 0.00 0.00 57.03 57.14 2nuu h ASP 9 Cb 0.33 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.75 2nuu h ASP 9 CO -0.30 0.75 -0.01 0.78 -1.72 0.00 0.00 179.24 178.74 2nuu h ASN 10 N 0.38 -0.02 -0.16 6.45 2.35 0.12 0.91 115.58 125.62 2nuu h ASN 10 Ca 0.05 -0.20 0.03 0.00 -0.55 0.00 0.00 56.30 55.63 2nuu h ASN 10 Cb 0.74 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 39.09 2nuu h ASN 10 CO 0.06 0.19 -0.02 0.00 -1.65 0.00 0.00 177.43 176.01 2nuu h ALA 11 N 0.76 0.12 -0.76 -0.83 0.00 -0.89 0.88 119.26 118.53 2nuu h ALA 11 Ca -0.00 0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.97 2nuu h ALA 11 Cb 0.22 0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 2nuu h ALA 11 CO 0.00 -0.46 0.50 0.35 0.00 0.00 0.00 179.25 179.64 2nuu h PHE 12 N 0.03 0.95 0.00 0.00 3.57 -1.22 -1.41 116.94 118.85 2nuu h PHE 12 Ca 0.08 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.52 2nuu h PHE 12 Cb 0.10 -0.32 -0.01 0.00 2.79 0.00 0.00 35.95 38.51 2nuu h PHE 12 CO -0.17 0.59 -0.38 0.52 -2.23 0.00 0.00 178.31 176.64 2nuu h MET 13 N 1.02 0.00 0.01 1.11 2.86 -0.40 -1.33 114.93 118.19 2nuu h MET 13 Ca 0.28 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.85 2nuu h MET 13 Cb -0.10 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.56 2nuu h MET 13 CO -0.07 0.38 -0.30 0.52 1.06 0.00 0.00 176.91 178.50 2nuu h MET 14 N 0.00 0.19 -0.79 1.72 2.86 -0.55 -2.58 114.93 115.78 2nuu h MET 14 Ca -0.00 -0.21 -0.00 0.00 -2.06 0.00 0.00 59.70 57.42 2nuu h MET 14 Cb 1.06 0.06 -0.04 0.00 0.06 0.00 0.00 31.60 32.75 2nuu h MET 14 CO 0.05 0.96 0.48 0.82 1.06 0.00 0.00 176.91 180.28 2nuu h ILE 15 N -0.49 1.22 -0.58 -1.22 1.08 -1.25 -1.74 117.51 114.53 2nuu h ILE 15 Ca -0.04 -0.47 -0.03 0.00 -0.39 0.00 0.00 64.86 63.93 2nuu h ILE 15 Cb 1.07 0.11 -0.03 0.00 -3.07 0.00 0.00 36.82 34.90 2nuu h ILE 15 CO 0.06 0.23 0.24 0.00 -0.69 0.00 0.00 178.15 177.98 2nuu h THR 17 N 0.82 1.26 -0.54 0.00 2.02 -0.92 -0.59 112.91 114.96 2nuu h THR 17 Ca 0.20 -0.90 -0.05 0.00 0.77 0.00 0.00 66.41 66.43 2nuu h THR 17 Cb 0.15 0.45 -0.02 0.00 -1.74 0.00 0.00 68.15 66.99 2nuu h THR 17 CO -0.02 0.35 0.14 0.00 0.37 0.00 0.00 175.52 176.37 2nuu h ALA 18 N 1.12 0.71 -0.83 6.16 0.00 -0.77 -1.57 119.26 124.09 2nuu h ALA 18 Ca 0.24 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 2nuu h ALA 18 Cb 0.30 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 2nuu h ALA 18 CO -0.01 0.40 0.40 -0.07 0.00 0.00 0.00 179.25 179.98 2nuu h LEU 19 N 0.76 1.08 -0.76 0.00 3.38 -0.94 0.59 115.31 119.42 2nuu h LEU 19 Ca 0.17 -0.12 -0.12 0.00 0.09 0.00 0.00 57.88 57.90 2nuu h LEU 19 Cb 0.32 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 2nuu h LEU 19 CO -0.00 0.90 -0.36 0.58 0.09 0.00 0.00 178.44 179.65 2nuu h VAL 20 N 1.18 1.29 0.00 1.22 2.07 -0.81 -2.03 116.25 119.17 2nuu h VAL 20 Ca 0.29 -1.49 -0.11 0.00 0.82 0.00 0.00 66.70 66.21 2nuu h VAL 20 Cb 0.11 1.50 -0.02 0.00 -1.52 0.00 0.00 31.29 31.36 2nuu h VAL 20 CO -0.04 0.47 -0.51 -0.07 0.02 0.00 0.00 177.57 177.44 2nuu h LEU 21 N 0.44 0.00 -1.25 2.57 3.38 -0.85 -2.45 115.31 117.15 2nuu h LEU 21 Ca 0.05 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 2nuu h LEU 21 Cb 0.83 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.56 2nuu h LEU 21 CO 0.07 0.51 0.16 0.15 0.09 0.00 0.00 178.44 179.41 2nuu h PHE 22 N 0.00 0.68 -0.41 1.13 3.57 -0.23 0.22 116.94 121.89 2nuu h PHE 22 Ca -0.01 -0.04 -0.00 0.00 3.53 0.00 0.00 57.97 61.46 2nuu h PHE 22 Cb 0.98 -0.21 -0.02 0.00 2.79 0.00 0.00 35.95 39.49 2nuu h PHE 22 CO 0.00 0.55 0.25 0.52 -2.23 0.00 0.00 178.31 177.40 2nuu h MET 23 N 0.66 0.55 0.01 1.11 2.86 -0.88 -2.25 114.93 116.99 2nuu h MET 23 Ca 0.16 -0.04 -0.31 0.00 -2.06 0.00 0.00 59.70 57.44 2nuu h MET 23 Cb 0.18 -0.12 -0.04 0.00 0.06 0.00 0.00 31.60 31.68 2nuu h MET 23 CO -0.01 0.39 -1.73 2.41 1.06 0.00 0.00 176.91 179.03 2nuu n THR 24 N -4.45 1.56 -3.69 2.22 -1.04 -0.99 0.14 114.28 108.02 2nuu n THR 24 Ca 0.03 -0.21 -0.38 0.00 -2.04 0.00 0.00 64.05 61.46 2nuu n THR 24 Cb 0.08 -1.95 -0.10 0.00 -1.82 0.00 0.00 70.33 66.54 2nuu n THR 24 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 2nuu s ILE 25 N -2.43 3.74 -1.83 12.58 -1.09 0.74 -3.45 121.20 129.46 2nuu s ILE 25 Ca -0.31 -2.41 0.16 0.00 -2.23 0.00 0.00 60.65 55.86 2nuu s ILE 25 Cb 0.09 -3.47 0.10 0.00 -1.58 0.00 0.00 42.46 37.59 2nuu s ILE 25 CO 0.58 -0.80 0.96 -0.81 -1.23 0.00 0.00 174.94 173.64 2nuu n PRO 26 N 4.16 1.32 0.00 2.79 -0.04 -1.10 -4.04 135.00 138.08 2nuu n PRO 26 Ca 0.02 -1.29 0.00 0.00 -0.04 0.00 0.00 63.50 62.19 2nuu n PRO 26 Cb 0.40 -1.29 0.00 0.00 -0.04 0.00 0.00 33.50 32.57 2nuu n PRO 26 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2nuu n GLY 27 N 0.93 -1.47 0.30 0.55 0.00 -0.87 -1.11 105.19 103.53 2nuu n GLY 27 Ca 0.08 0.31 0.03 0.00 0.00 0.00 0.00 46.02 46.45 2nuu n GLY 27 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2nuu h ILE 28 N 0.00 1.12 -0.71 -0.61 6.09 -0.39 -1.78 117.51 121.22 2nuu h ILE 28 Ca 0.00 -0.31 -0.02 0.00 -1.37 0.00 0.00 64.86 63.16 2nuu h ILE 28 Cb 0.00 0.64 -0.03 0.00 0.47 0.00 0.00 36.82 37.90 2nuu h ILE 28 CO 0.00 0.13 0.37 0.00 -3.07 0.00 0.00 178.15 175.58 2nuu h ALA 29 N 1.71 0.91 -0.12 0.18 0.00 -1.41 0.52 119.26 121.06 2nuu h ALA 29 Ca 0.13 -0.13 -0.13 0.00 0.00 0.00 0.00 54.91 54.78 2nuu h ALA 29 Cb 0.03 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.54 2nuu h ALA 29 CO -0.02 0.46 -0.42 -0.07 0.00 0.00 0.00 179.25 179.20 2nuu h LEU 30 N 0.99 0.58 -0.43 0.00 3.38 -0.80 0.18 115.31 119.21 2nuu h LEU 30 Ca 0.25 -0.61 0.06 0.00 0.09 0.00 0.00 57.88 57.67 2nuu h LEU 30 Cb 0.08 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 40.61 2nuu h LEU 30 CO -0.04 1.09 0.11 0.15 0.09 0.00 0.00 178.44 179.84 2nuu h PHE 31 N 0.10 0.18 0.04 1.13 3.57 -1.05 0.11 116.94 121.02 2nuu h PHE 31 Ca -0.02 0.02 -0.22 0.00 3.53 0.00 0.00 57.97 61.28 2nuu h PHE 31 Cb 1.04 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.76 2nuu h PHE 31 CO 0.11 0.04 -1.01 1.88 -2.23 0.00 0.00 178.31 177.09 2nuu h TYR 32 N 0.25 0.26 -0.73 0.41 0.05 -0.94 -3.17 116.97 113.09 2nuu h TYR 32 Ca 0.21 -0.17 -0.02 0.00 0.05 0.00 0.00 58.73 58.79 2nuu h TYR 32 Cb 0.24 -0.02 -0.03 0.00 1.01 0.00 0.00 36.73 37.92 2nuu h TYR 32 CO -0.19 1.06 0.36 0.78 -1.05 0.00 0.00 178.16 179.13 2nuu h GLY 33 N 2.11 1.13 2.00 3.88 0.00 -0.02 -2.84 103.07 109.32 2nuu h GLY 33 Ca -0.06 -0.55 -0.07 0.00 0.00 0.00 0.00 47.33 46.65 2nuu h GLY 33 CO 0.15 0.53 -0.34 -1.33 0.00 0.00 0.00 176.54 175.55 2nuu h GLY 34 N 1.03 0.00 2.00 4.60 0.00 -0.88 -3.30 103.07 106.52 2nuu h GLY 34 Ca 0.25 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.46 2nuu h GLY 34 CO -0.03 0.00 -0.57 1.41 0.00 0.00 0.00 176.54 177.35 2nuu h LEU 35 N 0.00 0.00-10.71 3.11 3.38 -1.47 -2.15 115.31 107.47 2nuu h LEU 35 Ca -0.00 0.00 -0.48 0.00 0.09 0.00 0.00 57.88 57.48 2nuu h LEU 35 Cb 1.04 0.00 0.06 0.00 0.09 0.00 0.00 40.66 41.85 2nuu h LEU 35 CO 0.04 0.57 0.03 0.27 0.09 0.00 0.00 178.44 179.44 2nuu s ILE 36 N -3.31 2.05 0.50 1.22 -4.36 -1.18 -3.55 121.20 112.58 2nuu s ILE 36 Ca 0.01 -0.78 -0.19 0.00 -0.26 0.00 0.00 60.65 59.44 2nuu s ILE 36 Cb 0.10 -2.28 -0.08 0.00 1.25 0.00 0.00 42.46 41.46 2nuu s ILE 36 CO 0.74 0.00 1.01 -0.13 0.24 0.00 0.00 174.94 176.80 2nuu s ARG 37 N -4.97 3.82 0.43 0.37 0.52 -1.26 -1.97 118.95 115.88 2nuu s ARG 37 Ca 0.65 1.18 0.18 0.00 -0.52 0.00 0.00 55.73 57.22 2nuu s ARG 37 Cb -0.05 -2.11 1.10 0.00 0.52 0.00 0.00 34.95 34.41 2nuu s ARG 37 CO 0.43 -0.39 1.87 0.78 0.02 0.00 0.00 175.30 178.01 2nuu h GLY 38 N 1.24 0.78 0.82 -3.53 0.00 -1.92 0.11 103.07 100.58 2nuu h GLY 38 Ca -0.48 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 46.67 2nuu h GLY 38 CO 0.60 0.01 0.00 0.58 0.00 0.00 0.00 176.54 177.73 2nuu n LYS 39 N -4.49 0.74 0.00 4.80 2.85 -1.26 -3.26 118.16 117.54 2nuu n LYS 39 Ca 0.18 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.44 2nuu n LYS 39 Cb 0.67 -1.41 0.00 0.00 -0.65 0.00 0.00 35.03 33.64 2nuu n LYS 39 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 2nuu n ASN 40 N -0.91 0.25 -0.29 -5.58 3.02 -0.02 -2.61 115.26 109.12 2nuu n ASN 40 Ca 0.15 -0.66 0.07 0.00 -0.03 0.00 0.00 54.58 54.11 2nuu n ASN 40 Cb 0.07 0.20 0.22 0.00 -0.61 0.00 0.00 39.78 39.65 2nuu n ASN 40 CO 0.00 0.00 0.00 1.62 -2.62 0.00 0.00 177.26 176.26 2nuu h VAL 41 N 0.31 0.72 -0.11 2.41 3.04 -1.41 -2.55 116.25 118.66 2nuu h VAL 41 Ca 0.00 -0.20 -0.10 0.00 -1.01 0.00 0.00 66.70 65.38 2nuu h VAL 41 Cb 0.15 0.07 -0.01 0.00 -2.01 0.00 0.00 31.29 29.49 2nuu h VAL 41 CO 0.00 0.11 -0.40 -0.07 -1.01 0.00 0.00 177.57 176.20 2nuu h LEU 42 N 0.60 0.25 -0.59 3.16 3.38 -1.90 -2.57 115.31 117.63 2nuu h LEU 42 Ca 0.45 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 58.32 2nuu h LEU 42 Cb 0.65 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.30 2nuu h LEU 42 CO -0.37 0.62 0.35 0.77 0.09 0.00 0.00 178.44 179.91 2nuu h SER 43 N 0.20 0.71 -0.42 -0.43 4.64 -1.79 0.75 113.55 117.22 2nuu h SER 43 Ca 0.02 -0.06 -0.01 0.00 -0.47 0.00 0.00 61.79 61.27 2nuu h SER 43 Cb 0.79 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 62.68 2nuu h SER 43 CO 0.06 0.56 0.23 -0.03 -0.87 0.00 0.00 176.83 176.78 2nuu h MET 44 N 0.80 0.58 -0.45 4.77 1.85 -1.44 0.37 114.93 121.40 2nuu h MET 44 Ca 0.21 -0.07 -0.11 0.00 -0.61 0.00 0.00 59.70 59.12 2nuu h MET 44 Cb -0.02 -0.11 -0.01 0.00 0.43 0.00 0.00 31.60 31.89 2nuu h MET 44 CO -0.04 0.47 -0.17 -0.07 -0.40 0.00 0.00 176.91 176.70 2nuu h LEU 45 N 0.54 0.92 -0.29 3.39 3.38 -1.16 -2.48 115.31 119.61 2nuu h LEU 45 Ca 0.15 -0.38 -0.05 0.00 0.09 0.00 0.00 57.88 57.68 2nuu h LEU 45 Cb 0.06 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 2nuu h LEU 45 CO -0.02 1.10 -0.00 0.74 0.09 0.00 0.00 178.44 180.34 2nuu h THR 46 N 0.74 1.26 0.11 0.22 2.02 -0.70 -2.04 112.91 114.51 2nuu h THR 46 Ca 0.11 -0.94 0.01 0.00 0.77 0.00 0.00 66.41 66.36 2nuu h THR 46 Cb 0.73 1.30 -0.02 0.00 -1.74 0.00 0.00 68.15 68.41 2nuu h THR 46 CO 0.06 0.30 -0.16 1.56 0.37 0.00 0.00 175.52 177.65 2nuu h GLN 47 N 0.30 -0.30 -0.53 6.66 4.20 -0.90 0.11 115.11 124.65 2nuu h GLN 47 Ca 0.08 0.02 0.02 0.00 0.06 0.00 0.00 58.65 58.83 2nuu h GLN 47 Cb 0.43 0.07 -0.03 0.00 0.30 0.00 0.00 27.48 28.25 2nuu h GLN 47 CO 0.02 -0.20 0.33 0.28 -0.67 0.00 0.00 178.83 178.58 2nuu h VAL 48 N -0.32 1.09 0.14 -0.54 2.07 -1.47 0.40 116.25 117.62 2nuu h VAL 48 Ca 0.02 -0.23 -0.01 0.00 0.82 0.00 0.00 66.70 67.30 2nuu h VAL 48 Cb 0.32 0.37 0.00 0.00 -1.52 0.00 0.00 31.29 30.46 2nuu h VAL 48 CO -0.07 0.12 -0.07 0.74 0.02 0.00 0.00 177.57 178.31 2nuu h THR 49 N 0.66 0.95 -0.50 2.57 2.02 -1.09 -1.37 112.91 116.14 2nuu h THR 49 Ca 0.21 -0.33 -0.10 0.00 0.77 0.00 0.00 66.41 66.95 2nuu h THR 49 Cb -0.02 1.16 -0.02 0.00 -1.74 0.00 0.00 68.15 67.53 2nuu h THR 49 CO -0.07 0.08 -0.11 0.58 0.37 0.00 0.00 175.52 176.37 2nuu h VAL 50 N -0.34 1.26 -0.17 3.16 2.07 -0.66 -1.73 116.25 119.85 2nuu h VAL 50 Ca -0.02 -1.23 -0.13 0.00 0.82 0.00 0.00 66.70 66.15 2nuu h VAL 50 Cb 0.27 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 31.02 2nuu h VAL 50 CO 0.03 0.43 -0.44 0.71 0.02 0.00 0.00 177.57 178.32 2nuu h THR 51 N 0.82 1.32 -0.12 2.57 1.35 -0.94 -0.88 112.91 117.03 2nuu h THR 51 Ca 0.13 -1.62 0.00 0.00 -0.55 0.00 0.00 66.41 64.37 2nuu h THR 51 Cb 0.64 1.67 -0.01 0.00 -1.73 0.00 0.00 68.15 68.72 2nuu h THR 51 CO 0.04 0.50 0.08 0.15 -0.25 0.00 0.00 175.52 176.04 2nuu h PHE 52 N 0.34 0.15 -0.60 4.73 3.57 -1.04 0.13 116.94 124.22 2nuu h PHE 52 Ca 0.02 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.51 2nuu h PHE 52 Cb 0.91 -0.05 -0.03 0.00 2.79 0.00 0.00 35.95 39.57 2nuu h PHE 52 CO 0.03 0.10 0.31 0.00 -2.23 0.00 0.00 178.31 176.52 2nuu h ALA 53 N 1.04 0.78 -0.40 2.41 0.00 -1.10 -0.38 119.26 121.60 2nuu h ALA 53 Ca 0.04 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2nuu h ALA 53 Cb -0.01 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 2nuu h ALA 53 CO -0.01 0.32 0.26 1.25 0.00 0.00 0.00 179.25 181.07 2nuu h LEU 54 N 0.82 0.47 -0.52 0.00 5.85 -0.73 -2.32 115.31 118.88 2nuu h LEU 54 Ca 0.21 -0.03 -0.06 0.00 0.84 0.00 0.00 57.88 58.84 2nuu h LEU 54 Cb 0.09 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 40.98 2nuu h LEU 54 CO -0.03 0.35 0.08 0.58 -0.34 0.00 0.00 178.44 179.09 2nuu h VAL 55 N 0.54 1.25 -0.47 1.05 2.07 -0.52 -1.38 116.25 118.79 2nuu h VAL 55 Ca 0.15 -0.95 0.07 0.00 0.82 0.00 0.00 66.70 66.79 2nuu h VAL 55 Cb -0.04 0.86 -0.06 0.00 -1.52 0.00 0.00 31.29 30.52 2nuu h VAL 55 CO -0.03 0.34 0.14 0.00 0.02 0.00 0.00 177.57 178.04 2nuu h ILE 57 N 0.29 0.89 -0.64 0.00 1.08 -1.28 -2.92 117.51 114.94 2nuu h ILE 57 Ca 0.23 -0.65 0.05 0.00 -0.39 0.00 0.00 64.86 64.10 2nuu h ILE 57 Cb 0.27 1.27 -0.04 0.00 -3.07 0.00 0.00 36.82 35.25 2nuu h ILE 57 CO -0.27 0.14 0.42 -0.07 -0.69 0.00 0.00 178.15 177.69 2nuu h LEU 58 N -0.60 0.60 -0.01 1.44 3.38 -1.07 -1.03 115.31 118.01 2nuu h LEU 58 Ca -0.03 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2nuu h LEU 58 Cb 0.44 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 2nuu h LEU 58 CO 0.05 0.40 -0.02 -0.25 0.09 0.00 0.00 178.44 178.71 2nuu h TRP 59 N 0.69 -0.04 -0.34 1.13 2.91 -0.92 -0.27 115.95 119.11 2nuu h TRP 59 Ca 0.27 0.00 -0.15 0.00 1.13 0.00 0.00 58.89 60.14 2nuu h TRP 59 Cb 0.19 0.02 -0.01 0.00 -0.51 0.00 0.00 29.16 28.85 2nuu h TRP 59 CO -0.00 -0.03 -0.38 -0.39 -1.03 0.00 0.00 178.44 176.62 2nuu h VAL 60 N -0.02 1.28 0.74 2.65 -1.51 -1.24 -0.68 116.25 117.47 2nuu h VAL 60 Ca 0.01 -1.55 -0.04 0.00 -1.23 0.00 0.00 66.70 63.90 2nuu h VAL 60 Cb 0.04 1.42 0.01 0.00 -2.13 0.00 0.00 31.29 30.63 2nuu h VAL 60 CO -0.03 0.51 -0.36 0.58 -1.23 0.00 0.00 177.57 177.04 2nuu h VAL 61 N 0.65 0.00 0.00 7.19 2.07 -1.04 -2.92 116.25 122.20 2nuu h VAL 61 Ca 0.06 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.58 2nuu h VAL 61 Cb 0.93 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.70 2nuu h VAL 61 CO 0.09 0.00 -0.19 0.00 0.02 0.00 0.00 177.57 177.48 2nuu n TYR 62 N -4.68 0.00 -0.23 1.57 0.18 -0.61 0.14 117.16 113.53 2nuu n TYR 62 Ca -0.12 0.00 -0.06 0.00 1.88 0.00 0.00 57.90 59.60 2nuu n TYR 62 Cb 0.39 0.00 -0.06 0.00 -0.38 0.00 0.00 39.34 39.30 2nuu n TYR 62 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 2nuu n GLY 63 N 0.81 -2.76 0.16 -7.48 0.00 -0.21 -1.76 105.19 93.95 2nuu n GLY 63 Ca 0.00 0.90 -0.05 0.00 0.00 0.00 0.00 46.02 46.87 2nuu n GLY 63 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2nuu h TYR 64 N 0.00 0.04 -0.68 1.61 3.20 -1.41 -2.05 116.97 117.68 2nuu h TYR 64 Ca 0.09 0.02 0.07 0.00 3.14 0.00 0.00 58.73 62.05 2nuu h TYR 64 Cb 0.23 0.04 -0.06 0.00 1.54 0.00 0.00 36.73 38.47 2nuu h TYR 64 CO -0.96 -0.03 0.37 1.03 -1.64 0.00 0.00 178.16 176.92 2nuu h SER 65 N 0.14 0.52 1.02 -2.11 0.87 -1.63 0.19 113.55 112.56 2nuu h SER 65 Ca 0.18 0.04 -0.12 0.00 -1.23 0.00 0.00 61.79 60.66 2nuu h SER 65 Cb 0.23 -0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 62.11 2nuu h SER 65 CO -0.27 0.33 -0.58 -0.07 -0.53 0.00 0.00 176.83 175.71 2nuu h LEU 66 N 0.66 0.00 0.03 2.23 3.38 -1.09 -2.20 115.31 118.32 2nuu h LEU 66 Ca 0.32 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 58.03 2nuu h LEU 66 Cb 0.25 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 2nuu h LEU 66 CO -0.21 0.58 -1.39 0.00 0.09 0.00 0.00 178.44 177.50 2nuu h ALA 67 N 1.42 0.29 -0.20 1.53 0.00 -1.08 1.02 119.26 122.24 2nuu h ALA 67 Ca -0.01 -1.23 0.00 0.00 0.00 0.00 0.00 54.91 53.67 2nuu h ALA 67 Cb 1.24 0.71 0.00 0.00 0.00 0.00 0.00 17.79 19.74 2nuu h ALA 67 CO 0.07 0.82 0.00 1.19 0.00 0.00 0.00 179.25 181.34 2nuu n PHE 68 N -4.22 0.24 -3.18 0.00 3.72 0.66 -4.14 117.46 110.54 2nuu n PHE 68 Ca -0.31 -0.12 -0.32 0.00 -0.05 0.00 0.00 57.45 56.65 2nuu n PHE 68 Cb 0.76 -0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 39.25 2nuu n PHE 68 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 2nuu s GLY 69 N -1.76 2.21 -0.33 1.37 0.00 -0.83 -5.02 107.32 102.97 2nuu s GLY 69 Ca 0.33 -0.15 -0.29 0.00 0.00 0.00 0.00 44.72 44.62 2nuu s GLY 69 CO 0.31 0.03 1.08 -1.83 0.00 0.00 0.00 173.10 172.69 2nuu s GLU 70 N -3.15 4.04 0.00 2.90 -1.05 -1.26 -3.63 118.70 116.55 2nuu s GLU 70 Ca 0.51 1.04 0.00 0.00 -0.15 0.00 0.00 54.97 56.37 2nuu s GLU 70 Cb -0.11 -3.75 0.00 0.00 -0.44 0.00 0.00 34.13 29.83 2nuu s GLU 70 CO 0.22 -0.94 0.00 0.41 0.95 0.00 0.00 175.26 175.90 2nuu n GLY 71 N 3.94 5.46 0.00 -3.83 0.00 -1.26 -3.95 105.19 105.55 2nuu n GLY 71 Ca 0.12 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 45.14 2nuu n GLY 71 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2nuu n ASN 72 N 0.00 0.00 -1.08 1.61 6.94 -1.17 -4.98 115.26 116.59 2nuu n ASN 72 Ca 0.00 0.00 0.12 0.00 -0.02 0.00 0.00 54.58 54.68 2nuu n ASN 72 Cb 0.00 0.00 0.19 0.00 -2.36 0.00 0.00 39.78 37.61 2nuu n ASN 72 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 2nuu n ASN 73 N 0.00 3.25 0.07 0.53 4.13 -1.26 -4.72 115.26 117.26 2nuu n ASN 73 Ca 0.00 -1.98 0.00 0.00 1.68 0.00 0.00 54.58 54.28 2nuu n ASN 73 Cb 0.00 -0.17 0.00 0.00 -1.54 0.00 0.00 39.78 38.07 2nuu n ASN 73 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 2nuu n PHE 74 N 1.40 -0.45 -3.91 3.10 3.01 -1.26 -3.29 117.46 116.05 2nuu n PHE 74 Ca 0.18 0.08 -0.23 0.00 1.01 0.00 0.00 57.45 58.49 2nuu n PHE 74 Cb 0.60 0.10 -0.05 0.00 -0.01 0.00 0.00 39.48 40.12 2nuu n PHE 74 CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 2nuu s PHE 75 N -2.00 2.71 0.00 1.38 0.40 -1.26 -4.39 117.98 114.81 2nuu s PHE 75 Ca 0.00 -0.46 0.00 0.00 -0.60 0.00 0.00 56.93 55.87 2nuu s PHE 75 Cb 0.00 -1.90 0.00 0.00 0.51 0.00 0.00 43.02 41.63 2nuu s PHE 75 CO 0.00 0.14 0.00 0.41 0.70 0.00 0.00 175.22 176.47 2nuu n GLY 76 N -1.32 2.36 3.98 4.36 0.00 0.35 -3.02 105.19 111.91 2nuu n GLY 76 Ca -0.00 -2.10 -0.24 0.00 0.00 0.00 0.00 46.02 43.67 2nuu n GLY 76 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2nuu s ASN 77 N -0.91 4.28 -0.34 1.61 2.20 -1.24 -4.67 114.94 115.87 2nuu s ASN 77 Ca 0.00 -0.25 0.07 0.00 -0.94 0.00 0.00 52.86 51.74 2nuu s ASN 77 Cb 0.00 -0.13 0.51 0.00 -2.00 0.00 0.00 41.25 39.63 2nuu s ASN 77 CO 0.00 -1.91 1.52 2.30 -2.94 0.00 0.00 177.10 176.07 2nuu n ILE 78 N -2.91 2.71 0.08 0.54 -5.35 -1.26 -3.74 119.36 109.43 2nuu n ILE 78 Ca 0.14 -2.92 -0.03 0.00 -0.27 0.00 0.00 62.75 59.67 2nuu n ILE 78 Cb 0.60 -0.52 -0.07 0.00 -1.74 0.00 0.00 39.64 37.91 2nuu n ILE 78 CO 0.00 0.00 0.00 0.78 -1.76 0.00 0.00 176.55 175.57 2nuu h ASN 79 N 1.25 0.00 -0.91 7.28 -0.26 -1.93 -3.36 115.58 117.66 2nuu h ASN 79 Ca 0.31 0.00 -0.62 0.00 -0.56 0.00 0.00 56.30 55.43 2nuu h ASN 79 Cb 1.66 0.00 -0.36 0.00 -1.06 0.00 0.00 38.32 38.56 2nuu h ASN 79 CO 0.61 0.80 0.06 0.79 -1.06 0.00 0.00 177.43 178.64 2nuu n TRP 80 N -3.25 3.01 -2.33 1.19 8.01 -1.25 -4.38 117.44 118.43 2nuu n TRP 80 Ca -0.01 -2.65 -0.43 0.00 -1.31 0.00 0.00 57.50 53.11 2nuu n TRP 80 Cb 0.87 -0.91 -0.02 0.00 -2.01 0.00 0.00 31.31 29.24 2nuu n TRP 80 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.69 176.17 2nuu s LEU 81 N -3.72 4.17 -0.74 -0.99 1.43 -1.26 -2.46 118.68 115.11 2nuu s LEU 81 Ca 0.58 1.75 0.00 0.00 -1.03 0.00 0.00 54.13 55.43 2nuu s LEU 81 Cb 0.46 -3.54 0.00 0.00 0.03 0.00 0.00 46.19 43.14 2nuu s LEU 81 CO 0.00 -0.84 0.00 0.23 0.23 0.00 0.00 176.35 175.97 2nuu n MET 82 N 6.81 -0.63 -1.87 1.70 2.81 0.12 -2.98 117.12 123.08 2nuu n MET 82 Ca 0.15 0.50 -0.18 0.00 -1.81 0.00 0.00 57.70 56.36 2nuu n MET 82 Cb 0.45 -4.43 -0.05 0.00 -0.71 0.00 0.00 33.22 28.48 2nuu n MET 82 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 2nuu n LEU 83 N -1.12 -1.51 -4.78 4.03 4.77 -1.03 -4.98 117.00 112.38 2nuu n LEU 83 Ca -0.09 0.24 -0.37 0.00 -0.03 0.00 0.00 56.01 55.76 2nuu n LEU 83 Cb 0.50 -2.53 -0.06 0.00 -2.33 0.00 0.00 43.42 39.00 2nuu n LEU 83 CO 0.12 -0.61 0.68 -1.59 -1.33 0.00 0.00 177.39 174.65 2nuu s LYS 84 N -4.09 4.46 0.00 3.23 -2.85 -1.16 -3.10 119.74 116.23 2nuu s LYS 84 Ca 0.00 1.37 0.00 0.00 -1.00 0.00 0.00 55.97 56.34 2nuu s LYS 84 Cb 0.00 -2.71 0.00 0.00 -2.06 0.00 0.00 37.83 33.06 2nuu s LYS 84 CO 0.00 0.16 0.00 0.09 0.10 0.00 0.00 175.35 175.70 2nuu n ASN 85 N 0.35 0.00 -4.37 0.03 3.02 -1.26 -3.91 115.26 109.12 2nuu n ASN 85 Ca 0.03 0.00 -0.45 0.00 -0.03 0.00 0.00 54.58 54.13 2nuu n ASN 85 Cb 0.50 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.61 2nuu n ASN 85 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2nuu s ILE 86 N -3.03 5.10 0.50 2.41 1.01 -1.18 -5.04 121.20 120.97 2nuu s ILE 86 Ca 0.00 -1.11 -0.22 0.00 0.00 0.00 0.00 60.65 59.32 2nuu s ILE 86 Cb 0.00 -4.28 -0.06 0.00 0.01 0.00 0.00 42.46 38.12 2nuu s ILE 86 CO 0.00 -0.80 1.18 -1.61 0.00 0.00 0.00 174.94 173.71 2nuu s GLU 87 N 1.95 3.54 0.54 2.79 2.02 -1.26 -4.89 118.70 123.39 2nuu s GLU 87 Ca 0.07 1.79 0.23 0.00 0.02 0.00 0.00 54.97 57.08 2nuu s GLU 87 Cb -0.25 -2.26 1.44 0.00 0.10 0.00 0.00 34.13 33.15 2nuu s GLU 87 CO 0.06 -0.74 2.09 1.25 0.02 0.00 0.00 175.26 177.94 2nuu h LEU 88 N 1.70 0.00 -0.98 1.80 5.85 -1.96 -0.90 115.31 120.82 2nuu h LEU 88 Ca -0.50 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.22 2nuu h LEU 88 Cb 1.26 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.29 2nuu h LEU 88 CO 0.59 0.00 -0.02 0.35 -0.34 0.00 0.00 178.44 179.02 2nuu n THR 89 N -4.27 0.00 -1.73 1.05 -2.24 -1.26 -4.82 114.28 101.01 2nuu n THR 89 Ca 0.03 -0.25 -0.42 0.00 -2.27 0.00 0.00 64.05 61.13 2nuu n THR 89 Cb 0.33 0.54 -0.02 0.00 -2.10 0.00 0.00 70.33 69.09 2nuu n THR 89 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2nuu n ALA 90 N 0.17 2.27 -3.06 6.98 0.00 -0.35 -4.91 120.51 121.62 2nuu n ALA 90 Ca 0.18 0.38 -0.33 0.00 0.00 0.00 0.00 53.44 53.67 2nuu n ALA 90 Cb 0.37 -2.43 -0.13 0.00 0.00 0.00 0.00 19.45 17.26 2nuu n ALA 90 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2nuu s VAL 91 N -0.02 3.46 -0.34 0.00 1.01 -1.26 -0.69 120.40 122.56 2nuu s VAL 91 Ca 0.65 -0.51 -0.02 0.00 0.00 0.00 0.00 61.98 62.09 2nuu s VAL 91 Cb -0.53 -2.49 0.07 0.00 0.00 0.00 0.00 36.38 33.43 2nuu s VAL 91 CO 0.49 0.50 0.07 -0.32 0.00 0.00 0.00 175.10 175.84 2nuu s MET 92 N 0.45 2.29 5.31 2.72 0.00 0.12 -4.79 119.30 125.39 2nuu s MET 92 Ca -0.06 -1.44 0.00 0.00 0.00 0.00 0.00 55.69 54.19 2nuu s MET 92 Cb -0.15 -3.32 0.00 0.00 0.00 0.00 0.00 34.83 31.36 2nuu s MET 92 CO 0.04 -0.76 0.00 0.41 0.00 0.00 0.00 175.02 174.70 2nuu n GLY 93 N 4.62 1.69 0.11 2.11 0.00 -1.26 -2.42 105.19 110.05 2nuu n GLY 93 Ca -0.09 -0.11 0.03 0.00 0.00 0.00 0.00 46.02 45.85 2nuu n GLY 93 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2nuu n SER 94 N 9.21 1.33 -4.33 1.61 3.41 -1.26 -4.86 113.62 118.74 2nuu n SER 94 Ca 0.00 -2.13 -0.17 0.00 -0.26 0.00 0.00 58.87 56.31 2nuu n SER 94 Cb 0.00 -0.17 -0.10 0.00 -0.26 0.00 0.00 64.21 63.68 2nuu n SER 94 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 2nuu s ILE 95 N -1.18 1.25 0.19 -1.33 -4.36 -1.02 -0.09 121.20 114.67 2nuu s ILE 95 Ca 0.10 -2.08 -0.30 0.00 -0.26 0.00 0.00 60.65 58.11 2nuu s ILE 95 Cb 0.08 -2.20 -0.08 0.00 1.25 0.00 0.00 42.46 41.51 2nuu s ILE 95 CO 0.01 -0.46 1.25 -0.31 0.24 0.00 0.00 174.94 175.67 2nuu s TYR 96 N -3.28 3.35 0.37 1.37 2.02 -1.26 0.14 117.35 120.06 2nuu s TYR 96 Ca 0.25 1.33 0.15 0.00 -0.37 0.00 0.00 57.07 58.43 2nuu s TYR 96 Cb 0.04 -3.50 1.01 0.00 -0.40 0.00 0.00 41.96 39.11 2nuu s TYR 96 CO 0.07 -1.50 1.77 0.37 -1.57 0.00 0.00 175.55 174.69 2nuu h GLN 97 N 5.33 0.47 -0.80 -0.62 4.15 -1.21 0.72 115.11 123.14 2nuu h GLN 97 Ca -0.45 -0.03 0.15 0.00 0.77 0.00 0.00 58.65 59.09 2nuu h GLN 97 Cb 1.21 -0.11 -0.06 0.00 0.21 0.00 0.00 27.48 28.74 2nuu h GLN 97 CO 0.76 0.31 0.53 1.88 -1.93 0.00 0.00 178.83 180.38 2nuu h TYR 98 N 0.48 0.60 -0.31 3.99 -1.99 -1.88 0.59 116.97 118.45 2nuu h TYR 98 Ca 0.60 0.02 -0.18 0.00 2.00 0.00 0.00 58.73 61.16 2nuu h TYR 98 Cb 1.36 -0.19 -0.00 0.00 2.00 0.00 0.00 36.73 39.89 2nuu h TYR 98 CO -0.00 0.23 -0.51 0.82 -0.00 0.00 0.00 178.16 178.69 2nuu h ILE 99 N 0.51 1.27 -0.77 -2.88 2.04 -1.23 -2.55 117.51 113.91 2nuu h ILE 99 Ca 0.40 -1.69 -0.03 0.00 1.00 0.00 0.00 64.86 64.54 2nuu h ILE 99 Cb 0.80 1.57 -0.04 0.00 -0.74 0.00 0.00 36.82 38.42 2nuu h ILE 99 CO -0.15 0.56 0.38 -0.74 0.00 0.00 0.00 178.15 178.19 2nuu h HIS 100 N 0.70 1.10 0.35 1.37 2.76 -0.87 0.13 115.15 120.69 2nuu h HIS 100 Ca 0.02 -0.05 -0.01 0.00 -2.20 0.00 0.00 60.37 58.14 2nuu h HIS 100 Cb 1.12 -0.34 -0.01 0.00 1.55 0.00 0.00 27.41 29.73 2nuu h HIS 100 CO 0.07 0.80 -0.24 0.28 -1.30 0.00 0.00 177.93 177.54 2nuu h VAL 101 N 1.08 0.49 -0.56 5.26 2.07 -0.93 -0.02 116.25 123.64 2nuu h VAL 101 Ca 0.27 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.78 2nuu h VAL 101 Cb 0.11 0.49 -0.03 0.00 -1.52 0.00 0.00 31.29 30.34 2nuu h VAL 101 CO -0.03 0.00 0.34 0.00 0.02 0.00 0.00 177.57 177.90 2nuu h ALA 102 N 0.02 0.72 0.45 1.67 0.00 -1.28 0.07 119.26 120.90 2nuu h ALA 102 Ca -0.03 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 2nuu h ALA 102 Cb 0.50 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 2nuu h ALA 102 CO 0.02 0.20 -0.25 0.35 0.00 0.00 0.00 179.25 179.56 2nuu h PHE 103 N 0.76 -0.65 0.00 0.00 3.57 -0.51 -0.83 116.94 119.28 2nuu h PHE 103 Ca 0.20 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.68 2nuu h PHE 103 Cb -0.02 0.22 -0.00 0.00 2.79 0.00 0.00 35.95 38.94 2nuu h PHE 103 CO -0.02 -0.39 -0.06 1.96 -2.23 0.00 0.00 178.31 177.57 2nuu h GLN 104 N -0.65 0.00 -0.39 1.11 1.08 -0.92 -1.46 115.11 113.88 2nuu h GLN 104 Ca -0.05 0.00 -0.14 0.00 -1.45 0.00 0.00 58.65 57.01 2nuu h GLN 104 Cb 0.52 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.94 2nuu h GLN 104 CO 0.07 0.06 -0.31 0.78 -0.95 0.00 0.00 178.83 178.48 2nuu h GLY 105 N 0.41 0.92 2.00 3.46 0.00 -0.13 -2.81 103.07 106.92 2nuu h GLY 105 Ca -0.00 -0.87 -0.05 0.00 0.00 0.00 0.00 47.33 46.41 2nuu h GLY 105 CO 0.01 0.79 -0.24 1.48 0.00 0.00 0.00 176.54 178.58 2nuu h SER 106 N 0.72 0.00 0.02 0.19 4.64 -0.07 -2.17 113.55 116.87 2nuu h SER 106 Ca 0.08 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.27 2nuu h SER 106 Cb 0.86 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.94 2nuu h SER 106 CO 0.08 0.24 -0.41 -0.26 -0.87 0.00 0.00 176.83 175.61 2nuu h PHE 107 N 0.00 0.59 -0.14 4.77 -1.00 -1.39 -2.81 116.94 116.96 2nuu h PHE 107 Ca -0.00 -0.17 -0.04 0.00 2.81 0.00 0.00 57.97 60.57 2nuu h PHE 107 Cb 0.42 -0.13 -0.00 0.00 3.61 0.00 0.00 35.95 39.85 2nuu h PHE 107 CO 0.00 0.83 -0.09 0.00 -1.61 0.00 0.00 178.31 177.44 2nuu h ALA 108 N 1.15 0.19 -0.27 2.45 0.00 -1.23 -2.73 119.26 118.84 2nuu h ALA 108 Ca 0.04 -0.28 0.06 0.00 0.00 0.00 0.00 54.91 54.73 2nuu h ALA 108 Cb 0.89 -0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.57 2nuu h ALA 108 CO 0.08 0.01 -0.17 0.00 0.00 0.00 0.00 179.25 179.17 2nuu h ILE 110 N -0.15 1.26 -0.75 0.00 6.09 -1.57 -1.40 117.51 120.99 2nuu h ILE 110 Ca 0.15 -1.09 0.06 0.00 -1.37 0.00 0.00 64.86 62.60 2nuu h ILE 110 Cb 0.37 0.81 -0.06 0.00 0.47 0.00 0.00 36.82 38.41 2nuu h ILE 110 CO -0.36 0.39 0.45 0.74 -3.07 0.00 0.00 178.15 176.30 2nuu h THR 111 N 0.90 1.00 -0.02 2.19 2.02 -1.11 0.29 112.91 118.18 2nuu h THR 111 Ca 0.17 -0.28 -0.16 0.00 0.77 0.00 0.00 66.41 66.91 2nuu h THR 111 Cb 0.51 0.11 -0.02 0.00 -1.74 0.00 0.00 68.15 67.02 2nuu h THR 111 CO 0.02 0.15 -0.72 0.58 0.37 0.00 0.00 175.52 175.93 2nuu h VAL 112 N 0.82 1.46 -0.21 3.16 2.07 -1.14 -3.10 116.25 119.31 2nuu h VAL 112 Ca 0.33 -2.32 -0.10 0.00 0.82 0.00 0.00 66.70 65.43 2nuu h VAL 112 Cb 0.18 2.25 -0.01 0.00 -1.52 0.00 0.00 31.29 32.18 2nuu h VAL 112 CO -0.18 0.67 -0.30 1.23 0.02 0.00 0.00 177.57 179.02 2nuu h GLY 113 N 1.83 0.46 1.11 2.17 0.00 -0.20 -2.96 103.07 105.47 2nuu h GLY 113 Ca -0.02 -0.39 -0.04 0.00 0.00 0.00 0.00 47.33 46.89 2nuu h GLY 113 CO 0.10 0.35 0.34 1.41 0.00 0.00 0.00 176.54 178.75 2nuu h LEU 114 N 0.37 1.04 -0.70 3.11 3.38 -0.90 -3.03 115.31 118.57 2nuu h LEU 114 Ca 0.05 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 2nuu h LEU 114 Cb 0.71 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.16 2nuu h LEU 114 CO 0.05 0.90 0.40 0.40 0.09 0.00 0.00 178.44 180.28 2nuu h ILE 115 N 1.12 1.21 -0.95 1.22 2.04 -1.53 -3.23 117.51 117.39 2nuu h ILE 115 Ca 0.26 -0.51 0.29 0.00 1.00 0.00 0.00 64.86 65.90 2nuu h ILE 115 Cb 0.16 0.28 -0.15 0.00 -0.74 0.00 0.00 36.82 36.37 2nuu h ILE 115 CO -0.03 0.23 0.41 0.58 0.00 0.00 0.00 178.15 179.34 2nuu h VAL 116 N 0.96 0.28 0.00 1.67 2.07 -1.54 -1.84 116.25 117.85 2nuu h VAL 116 Ca 0.25 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 67.68 2nuu h VAL 116 Cb 0.02 0.01 0.00 0.00 -1.52 0.00 0.00 31.29 29.79 2nuu h VAL 116 CO -0.04 0.05 0.12 1.23 0.02 0.00 0.00 177.57 178.94 2nuu h GLY 117 N 0.26 0.00 1.06 2.17 0.00 -1.70 -1.88 103.07 102.97 2nuu h GLY 117 Ca 0.66 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.99 2nuu h GLY 117 CO -0.64 0.00 -0.74 0.00 0.00 0.00 0.00 176.54 175.16 2nuu h ALA 118 N 1.75 0.53 -0.00 3.60 0.00 -1.56 -3.02 119.26 120.56 2nuu h ALA 118 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2nuu h ALA 118 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2nuu h ALA 118 CO 0.00 0.00 -0.93 1.28 0.00 0.00 0.00 179.25 179.60 2nuu n LEU 119 N -2.19 1.02 -4.38 0.00 4.77 -0.72 -4.35 117.00 111.15 2nuu n LEU 119 Ca 0.03 -0.47 -0.43 0.00 -0.03 0.00 0.00 56.01 55.10 2nuu n LEU 119 Cb 0.46 -0.02 -0.01 0.00 -2.33 0.00 0.00 43.42 41.52 2nuu n LEU 119 CO 0.37 0.25 -0.16 0.00 -1.33 0.00 0.00 177.39 176.52 2nuu n ALA 120 N -1.42 -2.42 -0.50 -1.18 0.00 -1.14 -3.21 120.51 110.64 2nuu n ALA 120 Ca 0.04 0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.68 2nuu n ALA 120 Cb 0.34 -1.61 0.00 0.00 0.00 0.00 0.00 19.45 18.18 2nuu n ALA 120 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2nuu n GLU 121 N 1.02 0.00 0.00 0.00 1.02 -1.26 -4.67 120.64 116.75 2nuu n GLU 121 Ca 0.13 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.27 2nuu n GLU 121 Cb 0.37 -3.32 0.00 0.00 -0.02 0.00 0.00 31.44 28.47 2nuu n GLU 121 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 2nuu n ARG 122 N -2.00 0.00 -3.43 3.49 0.00 -1.22 -4.88 116.66 108.62 2nuu n ARG 122 Ca 0.00 0.00 -0.33 0.00 -0.00 0.00 0.00 57.85 57.52 2nuu n ARG 122 Cb 0.00 -0.33 -0.05 0.00 -0.00 0.00 0.00 32.46 32.07 2nuu n ARG 122 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.63 176.13 2nuu s ILE 123 N 0.00 4.94 -0.00 8.89 2.07 -1.20 -1.62 121.20 134.28 2nuu s ILE 123 Ca 0.00 0.56 -0.30 0.00 -1.41 0.00 0.00 60.65 59.50 2nuu s ILE 123 Cb 0.00 -3.66 -0.03 0.00 0.13 0.00 0.00 42.46 38.90 2nuu s ILE 123 CO 0.00 0.09 0.98 -0.60 -1.91 0.00 0.00 174.94 173.49 2nuu s ARG 124 N -2.41 4.55 0.18 3.50 3.52 -0.04 -4.74 118.95 123.51 2nuu s ARG 124 Ca 0.42 1.41 -0.20 0.00 -0.13 0.00 0.00 55.73 57.23 2nuu s ARG 124 Cb -0.13 -3.46 0.11 0.00 -1.56 0.00 0.00 34.95 29.91 2nuu s ARG 124 CO 0.20 -0.06 1.61 0.35 -0.81 0.00 0.00 175.30 176.59 2nuu h PHE 125 N 6.81 -0.71 -0.19 5.12 3.04 -1.94 -1.86 116.94 127.21 2nuu h PHE 125 Ca -0.41 0.06 0.05 0.00 3.98 0.00 0.00 57.97 61.65 2nuu h PHE 125 Cb 1.22 0.39 -0.01 0.00 2.56 0.00 0.00 35.95 40.10 2nuu h PHE 125 CO 0.68 -0.34 0.13 0.66 -2.02 0.00 0.00 178.31 177.42 2nuu h SER 126 N -0.16 0.04 -0.17 0.41 4.64 -1.95 -1.88 113.55 114.47 2nuu h SER 126 Ca 0.21 -0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.38 2nuu h SER 126 Cb 0.51 -0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 62.58 2nuu h SER 126 CO -0.57 0.03 -0.46 0.00 -0.87 0.00 0.00 176.83 174.95 2nuu h ALA 127 N 1.90 0.65 -0.88 5.18 0.00 -1.61 -2.81 119.26 121.69 2nuu h ALA 127 Ca 0.09 -0.48 0.04 0.00 0.00 0.00 0.00 54.91 54.56 2nuu h ALA 127 Cb 0.29 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 17.93 2nuu h ALA 127 CO -0.01 0.67 0.56 0.28 0.00 0.00 0.00 179.25 180.76 2nuu h VAL 128 N 0.59 1.11 -0.36 0.00 2.07 -1.06 -2.03 116.25 116.57 2nuu h VAL 128 Ca 0.03 -0.36 -0.14 0.00 0.82 0.00 0.00 66.70 67.05 2nuu h VAL 128 Cb 1.02 -0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.74 2nuu h VAL 128 CO 0.10 0.19 -0.32 -0.07 0.02 0.00 0.00 177.57 177.49 2nuu h LEU 129 N 1.06 0.83 -0.40 2.57 3.38 -1.44 -2.42 115.31 118.91 2nuu h LEU 129 Ca 0.36 -0.35 -0.06 0.00 0.09 0.00 0.00 57.88 57.93 2nuu h LEU 129 Cb 0.07 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 2nuu h LEU 129 CO -0.14 1.08 0.02 0.40 0.09 0.00 0.00 178.44 179.90 2nuu h ILE 130 N 0.67 1.25 -0.40 1.22 2.04 -1.22 -3.02 117.51 118.06 2nuu h ILE 130 Ca 0.07 -0.97 0.00 0.00 1.00 0.00 0.00 64.86 64.97 2nuu h ILE 130 Cb 0.87 1.10 -0.02 0.00 -0.74 0.00 0.00 36.82 38.03 2nuu h ILE 130 CO 0.08 0.33 0.26 0.15 0.00 0.00 0.00 178.15 178.96 2nuu h PHE 131 N 0.52 0.49 0.09 1.37 3.57 -1.33 -2.95 116.94 118.71 2nuu h PHE 131 Ca 0.11 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.65 2nuu h PHE 131 Cb 0.44 -0.17 -0.04 0.00 2.79 0.00 0.00 35.95 38.98 2nuu h PHE 131 CO 0.03 0.31 -0.27 0.28 -2.23 0.00 0.00 178.31 176.43 2nuu h VAL 132 N 0.53 0.40 -0.57 1.41 2.07 -1.37 0.11 116.25 118.83 2nuu h VAL 132 Ca 0.15 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.78 2nuu h VAL 132 Cb -0.06 0.40 -0.10 0.00 -1.52 0.00 0.00 31.29 30.02 2nuu h VAL 132 CO -0.03 0.00 -0.00 0.58 0.02 0.00 0.00 177.57 178.13 2nuu h VAL 133 N -0.47 0.54 0.03 2.57 2.07 -1.49 0.61 116.25 120.10 2nuu h VAL 133 Ca 0.04 -0.04 -0.00 0.00 0.82 0.00 0.00 66.70 67.52 2nuu h VAL 133 Cb 0.51 0.41 0.00 0.00 -1.52 0.00 0.00 31.29 30.69 2nuu h VAL 133 CO -0.18 0.02 -0.01 0.58 0.02 0.00 0.00 177.57 178.00 2nuu h VAL 134 N 0.12 1.17 -0.26 2.57 2.07 -1.28 -2.78 116.25 117.85 2nuu h VAL 134 Ca 0.29 -0.61 -0.05 0.00 0.82 0.00 0.00 66.70 67.15 2nuu h VAL 134 Cb 0.46 1.58 -0.01 0.00 -1.52 0.00 0.00 31.29 31.80 2nuu h VAL 134 CO -0.49 0.16 -0.04 -0.25 0.02 0.00 0.00 177.57 176.97 2nuu h TRP 135 N -0.30 0.54 -0.76 1.57 7.01 -0.38 -0.02 115.95 123.61 2nuu h TRP 135 Ca -0.00 -0.11 -0.03 0.00 2.11 0.00 0.00 58.89 60.86 2nuu h TRP 135 Cb 0.28 -0.14 -0.04 0.00 -2.10 0.00 0.00 29.16 27.17 2nuu h TRP 135 CO 0.02 0.68 0.35 1.25 -2.79 0.00 0.00 178.44 177.94 2nuu h LEU 136 N 0.25 1.00 0.05 0.65 5.85 -1.00 0.45 115.31 122.56 2nuu h LEU 136 Ca 0.07 -0.13 -0.00 0.00 0.84 0.00 0.00 57.88 58.66 2nuu h LEU 136 Cb 0.49 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.26 2nuu h LEU 136 CO 0.02 0.86 -0.02 0.74 -0.34 0.00 0.00 178.44 179.70 2nuu h THR 137 N 1.09 1.30 0.00 1.05 2.02 -1.43 -1.69 112.91 115.25 2nuu h THR 137 Ca 0.26 -1.24 0.00 0.00 0.77 0.00 0.00 66.41 66.20 2nuu h THR 137 Cb 0.14 2.10 0.00 0.00 -1.74 0.00 0.00 68.15 68.65 2nuu h THR 137 CO -0.03 0.31 -0.77 0.18 0.37 0.00 0.00 175.52 175.57 2nuu n LEU 138 N -4.86 0.62 0.02 2.58 4.77 -0.03 -4.38 117.00 115.72 2nuu n LEU 138 Ca -0.09 0.03 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 2nuu n LEU 138 Cb 0.28 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 2nuu n LEU 138 CO 0.32 0.05 -0.29 -0.24 -1.33 0.00 0.00 177.39 175.90 2nuu n SER 139 N -1.85 0.35 0.19 -1.43 2.88 0.15 -4.64 113.62 109.27 2nuu n SER 139 Ca 0.03 0.06 -0.15 0.00 -1.33 0.00 0.00 58.87 57.49 2nuu n SER 139 Cb 0.40 -0.09 -0.08 0.00 -0.75 0.00 0.00 64.21 63.69 2nuu n SER 139 CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 2nuu h TYR 140 N 0.00 -0.40 0.23 0.66 5.03 -1.28 -2.01 116.97 119.20 2nuu h TYR 140 Ca 0.00 -0.01 0.01 0.00 2.58 0.00 0.00 58.73 61.31 2nuu h TYR 140 Cb 0.59 0.13 -0.03 0.00 1.55 0.00 0.00 36.73 38.97 2nuu h TYR 140 CO 0.00 -0.22 -0.33 0.82 -1.32 0.00 0.00 178.16 177.12 2nuu h ILE 141 N -0.48 0.32 -0.83 1.81 2.04 -1.51 0.72 117.51 119.59 2nuu h ILE 141 Ca -0.04 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.86 2nuu h ILE 141 Cb 0.36 0.32 -0.05 0.00 -0.74 0.00 0.00 36.82 36.71 2nuu h ILE 141 CO 0.07 0.00 0.52 -0.65 0.00 0.00 0.00 178.15 178.10 2nuu h PRO 142 N -0.62 0.98 -0.53 2.37 0.11 -1.76 -0.76 132.00 131.78 2nuu h PRO 142 Ca 0.00 -0.06 -0.08 0.00 0.11 0.00 0.00 66.00 65.97 2nuu h PRO 142 Cb 0.60 -0.22 -0.02 0.00 0.11 0.00 0.00 31.00 31.47 2nuu h PRO 142 CO -0.12 0.65 0.00 0.82 -0.21 0.00 0.00 178.00 179.14 2nuu h ILE 143 N 1.01 1.26 -0.61 4.15 2.04 -1.09 0.11 117.51 124.39 2nuu h ILE 143 Ca 0.34 -1.10 -0.07 0.00 1.00 0.00 0.00 64.86 65.03 2nuu h ILE 143 Cb 0.05 0.91 -0.03 0.00 -0.74 0.00 0.00 36.82 37.01 2nuu h ILE 143 CO -0.13 0.39 0.11 0.00 0.00 0.00 0.00 178.15 178.52 2nuu h ALA 144 N 0.95 1.05 -0.55 1.87 0.00 -0.67 -1.64 119.26 120.27 2nuu h ALA 144 Ca 0.15 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.76 2nuu h ALA 144 Cb 0.53 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 2nuu h ALA 144 CO 0.03 0.61 0.10 1.25 0.00 0.00 0.00 179.25 181.24 2nuu h HIS 145 N 0.92 0.96 -0.63 0.00 -0.00 -0.75 0.25 115.15 115.90 2nuu h HIS 145 Ca 0.19 -0.13 -0.03 0.00 -0.00 0.00 0.00 60.37 60.40 2nuu h HIS 145 Cb 0.38 -0.27 -0.03 0.00 -0.00 0.00 0.00 27.41 27.49 2nuu h HIS 145 CO 0.03 0.85 0.26 0.52 -0.00 0.00 0.00 177.93 179.58 2nuu h MET 146 N 0.80 0.92 0.04 5.26 2.07 -0.59 -1.47 114.93 121.95 2nuu h MET 146 Ca 0.17 -0.14 -0.35 0.00 -2.07 0.00 0.00 59.70 57.30 2nuu h MET 146 Cb 0.39 -0.16 -0.04 0.00 -1.87 0.00 0.00 31.60 29.92 2nuu h MET 146 CO 0.01 0.74 -2.00 0.28 1.07 0.00 0.00 176.91 177.01 2nuu n VAL 147 N -4.32 1.60 0.00 -2.22 0.31 -0.65 -1.82 118.33 111.23 2nuu n VAL 147 Ca 0.06 -0.40 0.05 0.00 -0.01 0.00 0.00 64.34 64.03 2nuu n VAL 147 Cb 0.16 -1.79 0.10 0.00 -0.91 0.00 0.00 33.84 31.40 2nuu n VAL 147 CO 0.00 0.00 0.00 0.79 -1.32 0.00 0.00 176.83 176.30 2nuu n TRP 148 N -3.88 0.28 -2.19 3.52 8.01 0.86 -4.27 117.44 119.77 2nuu n TRP 148 Ca -0.40 -0.36 -0.24 0.00 -1.31 0.00 0.00 57.50 55.20 2nuu n TRP 148 Cb 0.90 -0.02 0.02 0.00 -2.01 0.00 0.00 31.31 30.19 2nuu n TRP 148 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2nuu n GLY 149 N 0.41 6.03 2.18 6.99 0.00 -0.58 -4.93 105.19 115.29 2nuu n GLY 149 Ca 0.09 -2.61 -0.14 0.00 0.00 0.00 0.00 46.02 43.36 2nuu n GLY 149 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nuu n GLY 150 N -0.63 0.70 0.00 -0.02 0.00 -1.25 -4.84 105.19 99.15 2nuu n GLY 150 Ca 0.41 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.43 2nuu n GLY 150 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nuu n GLY 151 N -0.45 -1.00 0.42 -0.02 0.00 -1.07 -4.54 105.19 98.52 2nuu n GLY 151 Ca -0.15 -1.60 -0.11 0.00 0.00 0.00 0.00 46.02 44.17 2nuu n GLY 151 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2nuu h LEU 152 N 0.00 -1.61 -0.75 0.99 5.85 -1.58 0.92 115.31 119.13 2nuu h LEU 152 Ca 0.00 0.24 -0.12 0.00 0.84 0.00 0.00 57.88 58.83 2nuu h LEU 152 Cb 0.00 0.69 -0.01 0.00 0.37 0.00 0.00 40.66 41.71 2nuu h LEU 152 CO 0.00 -0.37 -0.37 -0.07 -0.34 0.00 0.00 178.44 177.29 2nuu h LEU 153 N -0.33 0.54 -0.89 2.25 3.38 -1.69 -2.80 115.31 115.77 2nuu h LEU 153 Ca 0.13 -0.23 -0.09 0.00 0.09 0.00 0.00 57.88 57.78 2nuu h LEU 153 Cb 0.58 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 2nuu h LEU 153 CO -0.61 0.86 -0.42 0.00 0.09 0.00 0.00 178.44 178.36 2nuu h ALA 154 N 1.17 0.99 -0.00 1.53 0.00 -1.05 -2.04 119.26 119.85 2nuu h ALA 154 Ca 0.04 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.57 2nuu h ALA 154 Cb 0.84 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.56 2nuu h ALA 154 CO 0.07 0.52 -0.03 -1.13 0.00 0.00 0.00 179.25 178.68 2nuu n SER 155 N -3.58 0.26 -0.30 0.00 3.41 0.29 -2.77 113.62 110.92 2nuu n SER 155 Ca -0.00 -0.66 0.07 0.00 -0.26 0.00 0.00 58.87 58.02 2nuu n SER 155 Cb 0.53 -0.11 -0.01 0.00 -0.26 0.00 0.00 64.21 64.37 2nuu n SER 155 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 2nuu n HIS 156 N -0.98 0.00 -0.55 7.33 -0.00 -0.94 -5.00 115.22 115.08 2nuu n HIS 156 Ca 0.18 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.90 2nuu n HIS 156 Cb 0.22 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.21 2nuu n HIS 156 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2nuu n GLY 157 N 1.08 0.68 3.55 -1.41 0.00 -1.10 -4.97 105.19 103.01 2nuu n GLY 157 Ca 0.06 -0.47 -0.45 0.00 0.00 0.00 0.00 46.02 45.17 2nuu n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nuu n ALA 158 N -0.36 -0.76 -3.56 4.61 0.00 -0.81 -4.97 120.51 114.65 2nuu n ALA 158 Ca 0.00 0.36 -0.39 0.00 0.00 0.00 0.00 53.44 53.42 2nuu n ALA 158 Cb 0.00 -1.93 -0.10 0.00 0.00 0.00 0.00 19.45 17.42 2nuu n ALA 158 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2nuu s LEU 159 N 0.93 5.25 -0.43 0.00 1.43 -1.26 -4.90 118.68 119.71 2nuu s LEU 159 Ca 0.60 -1.79 0.05 0.00 -1.03 0.00 0.00 54.13 51.96 2nuu s LEU 159 Cb -0.72 -1.92 0.19 0.00 0.03 0.00 0.00 46.19 43.78 2nuu s LEU 159 CO 0.59 -0.56 0.47 -0.67 0.23 0.00 0.00 176.35 176.40 2nuu n ASP 160 N 4.78 -1.05 -0.16 2.29 -0.08 -1.26 -4.86 116.55 116.21 2nuu n ASP 160 Ca -0.07 -2.57 -0.03 0.00 -1.51 0.00 0.00 54.79 50.61 2nuu n ASP 160 Cb 0.42 -0.02 0.03 0.00 2.34 0.00 0.00 41.12 43.89 2nuu n ASP 160 CO 0.00 0.00 0.00 0.15 0.12 0.00 0.00 177.20 177.47 2nuu h PHE 161 N 5.15 -0.34 0.00 -0.67 3.57 -1.11 -3.33 116.94 120.21 2nuu h PHE 161 Ca 0.18 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.72 2nuu h PHE 161 Cb 0.95 0.23 0.00 0.00 2.79 0.00 0.00 35.95 39.91 2nuu h PHE 161 CO 0.24 -0.24 -0.04 0.00 -2.23 0.00 0.00 178.31 176.04 2nuu n ALA 162 N -2.89 1.81 0.00 2.41 0.00 -1.00 -4.89 120.51 115.95 2nuu n ALA 162 Ca 0.04 -1.17 0.00 0.00 0.00 0.00 0.00 53.44 52.31 2nuu n ALA 162 Cb 0.28 -0.11 0.00 0.00 0.00 0.00 0.00 19.45 19.62 2nuu n ALA 162 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2nuu n GLY 163 N -0.51 0.82 0.20 0.00 0.00 -1.25 -4.86 105.19 99.59 2nuu n GLY 163 Ca 0.03 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.91 2nuu n GLY 163 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2nuu h GLY 164 N 0.00 0.71 0.00 -0.02 0.00 -1.87 -2.03 103.07 99.86 2nuu h GLY 164 Ca 0.00 -0.76 -0.02 0.00 0.00 0.00 0.00 47.33 46.55 2nuu h GLY 164 CO 0.00 0.69 -0.48 -0.91 0.00 0.00 0.00 176.54 175.84 2nuu h THR 165 N 0.36 0.11 -0.76 4.70 1.35 -1.95 -0.13 112.91 116.59 2nuu h THR 165 Ca 0.03 -1.13 0.15 0.00 -0.55 0.00 0.00 66.41 64.92 2nuu h THR 165 Cb 0.89 0.25 -0.10 0.00 -1.73 0.00 0.00 68.15 67.46 2nuu h THR 165 CO 0.07 0.04 0.27 0.58 -0.25 0.00 0.00 175.52 176.23 2nuu h VAL 166 N -1.00 0.60 0.00 6.82 2.07 -1.92 -1.53 116.25 121.29 2nuu h VAL 166 Ca -0.03 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 67.36 2nuu h VAL 166 Cb 0.50 0.18 0.00 0.00 -1.52 0.00 0.00 31.29 30.45 2nuu h VAL 166 CO -0.02 0.07 0.00 0.52 0.02 0.00 0.00 177.57 178.16 2nuu n VAL 167 N -5.05 0.00 0.30 2.57 0.31 -1.00 -4.55 118.33 110.91 2nuu n VAL 167 Ca 0.15 0.48 -0.17 0.00 -0.01 0.00 0.00 64.34 64.79 2nuu n VAL 167 Cb 0.45 -1.47 -0.08 0.00 -0.91 0.00 0.00 33.84 31.83 2nuu n VAL 167 CO 0.00 0.00 0.00 0.45 -1.32 0.00 0.00 176.83 175.96 2nuu h HIS 168 N 0.00 -0.84 -0.37 3.52 3.86 -1.41 -2.16 115.15 117.75 2nuu h HIS 168 Ca 0.00 -0.01 -0.12 0.00 -1.16 0.00 0.00 60.37 59.08 2nuu h HIS 168 Cb 0.00 0.30 -0.01 0.00 1.06 0.00 0.00 27.41 28.76 2nuu h HIS 168 CO 0.00 -0.49 -0.22 0.82 0.86 0.00 0.00 177.93 178.90 2nuu h ILE 169 N -0.80 1.28 -0.10 2.45 2.04 -1.02 -2.27 117.51 119.09 2nuu h ILE 169 Ca -0.06 -1.37 0.04 0.00 1.00 0.00 0.00 64.86 64.47 2nuu h ILE 169 Cb 0.65 1.37 -0.06 0.00 -0.74 0.00 0.00 36.82 38.04 2nuu h ILE 169 CO 0.07 0.45 -0.29 -1.13 0.00 0.00 0.00 178.15 177.25 2nuu h ASN 170 N 0.59 -0.90 -0.32 1.72 -0.73 -1.32 -1.92 115.58 112.70 2nuu h ASN 170 Ca 0.08 0.13 -0.04 0.00 1.87 0.00 0.00 56.30 58.33 2nuu h ASN 170 Cb 0.79 0.38 -0.01 0.00 0.27 0.00 0.00 38.32 39.75 2nuu h ASN 170 CO 0.06 -0.34 0.03 0.00 -0.37 0.00 0.00 177.43 176.81 2nuu h ALA 171 N 0.45 0.43 -0.65 1.57 0.00 -1.43 -2.83 119.26 116.79 2nuu h ALA 171 Ca 0.09 -0.21 0.13 0.00 0.00 0.00 0.00 54.91 54.91 2nuu h ALA 171 Cb 0.52 -0.12 -0.10 0.00 0.00 0.00 0.00 17.79 18.09 2nuu h ALA 171 CO -0.31 0.15 0.13 0.00 0.00 0.00 0.00 179.25 179.21 2nuu h ALA 172 N 0.87 0.78 0.08 0.00 0.00 -1.16 0.18 119.26 120.00 2nuu h ALA 172 Ca 0.10 0.15 -0.00 0.00 0.00 0.00 0.00 54.91 55.15 2nuu h ALA 172 Cb 0.39 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.39 2nuu h ALA 172 CO 0.01 -0.33 -0.04 0.82 0.00 0.00 0.00 179.25 179.72 2nuu h ILE 173 N 0.24 1.12 -0.98 0.00 1.08 -1.32 0.02 117.51 117.68 2nuu h ILE 173 Ca 0.35 -0.74 0.20 0.00 -0.39 0.00 0.00 64.86 64.28 2nuu h ILE 173 Cb 0.55 1.60 -0.11 0.00 -3.07 0.00 0.00 36.82 35.79 2nuu h ILE 173 CO -0.46 0.18 0.57 0.00 -0.69 0.00 0.00 178.15 177.76 2nuu h ALA 174 N 0.44 1.62 -0.26 1.87 0.00 -1.18 0.42 119.26 122.17 2nuu h ALA 174 Ca -0.01 0.09 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 2nuu h ALA 174 Cb 0.38 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 2nuu h ALA 174 CO 0.02 -0.11 -0.24 0.78 0.00 0.00 0.00 179.25 179.71 2nuu h GLY 175 N 0.69 0.68 0.96 0.00 0.00 -0.46 -2.72 103.07 102.23 2nuu h GLY 175 Ca 0.57 -0.68 -0.05 0.00 0.00 0.00 0.00 47.33 47.17 2nuu h GLY 175 CO -0.41 0.62 0.10 -2.00 0.00 0.00 0.00 176.54 174.86 2nuu h LEU 176 N 0.35 0.71 -0.23 3.11 6.46 0.70 -2.51 115.31 123.90 2nuu h LEU 176 Ca 0.05 -0.24 -0.01 0.00 -0.12 0.00 0.00 57.88 57.56 2nuu h LEU 176 Cb 0.79 -0.19 -0.01 0.00 -0.73 0.00 0.00 40.66 40.52 2nuu h LEU 176 CO 0.06 0.76 0.12 0.58 -0.62 0.00 0.00 178.44 179.35 2nuu h VAL 177 N 0.62 1.13 -0.15 1.05 2.07 -1.06 -2.54 116.25 117.37 2nuu h VAL 177 Ca 0.14 -0.35 0.04 0.00 0.82 0.00 0.00 66.70 67.36 2nuu h VAL 177 Cb 0.34 0.93 -0.04 0.00 -1.52 0.00 0.00 31.29 31.00 2nuu h VAL 177 CO 0.00 0.12 -0.11 1.23 0.02 0.00 0.00 177.57 178.84 2nuu h GLY 178 N 0.26 0.01 1.64 2.17 0.00 -1.41 -1.32 103.07 104.42 2nuu h GLY 178 Ca 0.08 0.13 -0.02 0.00 0.00 0.00 0.00 47.33 47.53 2nuu h GLY 178 CO -0.01 -0.12 0.14 0.00 0.00 0.00 0.00 176.54 176.55 2nuu h ALA 179 N 1.00 1.61 -0.03 3.60 0.00 -1.42 -1.28 119.26 122.73 2nuu h ALA 179 Ca 0.09 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2nuu h ALA 179 Cb 0.25 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 2nuu h ALA 179 CO -0.22 0.31 0.01 1.88 0.00 0.00 0.00 179.25 181.23 2nuu h TYR 180 N 0.48 0.06 -0.15 0.00 0.05 -0.94 -1.48 116.97 114.99 2nuu h TYR 180 Ca 0.12 -0.01 -0.04 0.00 0.05 0.00 0.00 58.73 58.86 2nuu h TYR 180 Cb 0.10 -0.02 -0.00 0.00 1.01 0.00 0.00 36.73 37.82 2nuu h TYR 180 CO 0.00 0.26 -0.05 -0.07 -1.05 0.00 0.00 178.16 177.26 2nuu h LEU 181 N -0.16 0.31 -0.71 3.88 3.38 -0.93 -3.19 115.31 117.89 2nuu h LEU 181 Ca 0.01 -0.38 0.00 0.00 0.09 0.00 0.00 57.88 57.60 2nuu h LEU 181 Cb 0.23 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.90 2nuu h LEU 181 CO 0.00 0.62 0.00 0.16 0.09 0.00 0.00 178.44 179.31 2nuu h ILE 182 N -0.01 0.00 -0.11 1.22 3.07 -1.32 -3.50 117.51 116.86 2nuu h ILE 182 Ca 0.04 -0.66 0.01 0.00 1.55 0.00 0.00 64.86 65.81 2nuu h ILE 182 Cb 0.49 1.63 -0.00 0.00 -0.27 0.00 0.00 36.82 38.66 2nuu h ILE 182 CO 0.02 0.00 -0.02 0.61 -1.05 0.00 0.00 178.15 177.71 2nuu n GLY 183 N 0.54 -1.29 3.79 0.16 0.00 -0.56 -4.94 105.19 102.89 2nuu n GLY 183 Ca 0.02 -1.53 -0.34 0.00 0.00 0.00 0.00 46.02 44.18 2nuu n GLY 183 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2nuu s LYS 184 N -1.05 3.41 0.72 1.61 1.02 -1.26 -4.85 119.74 119.34 2nuu s LYS 184 Ca 0.00 1.37 -0.14 0.00 0.02 0.00 0.00 55.97 57.22 2nuu s LYS 184 Cb 0.00 -2.04 0.03 0.00 -0.52 0.00 0.00 37.83 35.30 2nuu s LYS 184 CO 0.00 -0.75 1.13 1.03 -0.92 0.00 0.00 175.35 175.84 2nuu s ARG 185 N -3.64 2.40 0.04 1.68 0.52 -1.26 -4.94 118.95 113.75 2nuu s ARG 185 Ca 0.67 1.46 -0.30 0.00 -0.52 0.00 0.00 55.73 57.04 2nuu s ARG 185 Cb -0.18 -1.89 -0.07 0.00 0.52 0.00 0.00 34.95 33.32 2nuu s ARG 185 CO 0.30 -1.58 1.50 0.08 0.02 0.00 0.00 175.30 175.62 2nuu s VAL 186 N -2.36 3.41 0.00 3.52 1.01 -1.26 -2.47 120.40 122.25 2nuu s VAL 186 Ca 0.68 0.84 0.00 0.00 0.00 0.00 0.00 61.98 63.50 2nuu s VAL 186 Cb -0.22 -3.54 0.00 0.00 0.00 0.00 0.00 36.38 32.62 2nuu s VAL 186 CO 0.46 0.00 0.00 0.61 0.00 0.00 0.00 175.10 176.17 2nuu n GLY 187 N 3.77 0.29 3.69 4.51 0.00 -1.26 -4.97 105.19 111.21 2nuu n GLY 187 Ca 0.14 0.00 -0.53 0.00 0.00 0.00 0.00 46.02 45.63 2nuu n GLY 187 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2nuu n PHE 188 N -2.00 2.15 0.00 1.61 7.35 -1.03 -0.81 117.46 124.73 2nuu n PHE 188 Ca 0.00 0.30 0.00 0.00 -0.76 0.00 0.00 57.45 56.99 2nuu n PHE 188 Cb 0.00 -2.54 0.00 0.00 0.35 0.00 0.00 39.48 37.29 2nuu n PHE 188 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2nuu n GLY 189 N 4.14 0.64 0.00 7.13 0.00 -1.26 -4.83 105.19 111.01 2nuu n GLY 189 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.26 2nuu n GLY 189 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2nuu n LYS 190 N -1.17 0.97 -3.16 1.61 2.85 -0.58 -5.12 118.16 113.56 2nuu n LYS 190 Ca 0.00 0.00 -0.31 0.00 -1.05 0.00 0.00 58.31 56.95 2nuu n LYS 190 Cb 0.00 -0.23 -0.05 0.00 -0.65 0.00 0.00 35.03 34.11 2nuu n LYS 190 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 177.40 175.35 2nuu s GLU 191 N -0.64 3.82 -0.01 -1.58 2.56 0.00 -5.06 118.70 117.80 2nuu s GLU 191 Ca 0.00 0.40 -0.23 0.00 0.00 0.00 0.00 54.97 55.14 2nuu s GLU 191 Cb 0.00 -2.51 -0.05 0.00 2.00 0.00 0.00 34.13 33.57 2nuu s GLU 191 CO 0.00 0.15 0.69 0.00 -0.56 0.00 0.00 175.26 175.54 2nuu s ALA 192 N -2.07 3.40 -0.45 6.30 0.00 -1.26 -4.84 121.76 122.83 2nuu s ALA 192 Ca 0.50 0.15 0.07 0.00 0.00 0.00 0.00 51.96 52.68 2nuu s ALA 192 Cb -0.11 -2.90 0.40 0.00 0.00 0.00 0.00 23.12 20.52 2nuu s ALA 192 CO 0.25 0.05 1.03 1.19 0.00 0.00 0.00 175.76 178.27 2nuu n PHE 193 N 3.07 3.07 -2.21 0.00 3.01 -1.26 -5.09 117.46 118.05 2nuu n PHE 193 Ca -0.04 -3.33 -0.38 0.00 1.01 0.00 0.00 57.45 54.72 2nuu n PHE 193 Cb 0.51 -0.24 -0.01 0.00 -0.01 0.00 0.00 39.48 39.73 2nuu n PHE 193 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 2nuu s LYS 194 N -3.40 3.85 0.18 -1.08 1.02 -1.26 -4.96 119.74 114.09 2nuu s LYS 194 Ca 0.45 1.88 -0.33 0.00 0.02 0.00 0.00 55.97 57.98 2nuu s LYS 194 Cb 0.38 -2.54 -0.14 0.00 -0.52 0.00 0.00 37.83 35.00 2nuu s LYS 194 CO -0.14 -0.50 1.44 -2.30 -0.92 0.00 0.00 175.35 172.93 2nuu n PRO 195 N -0.24 1.85 0.05 -1.68 -0.02 -1.23 -4.41 135.00 129.33 2nuu n PRO 195 Ca 0.06 0.66 -0.14 0.00 -2.02 0.00 0.00 63.50 62.06 2nuu n PRO 195 Cb 0.47 -2.35 -0.05 0.00 -0.02 0.00 0.00 33.50 31.56 2nuu n PRO 195 CO 0.00 0.00 0.00 1.12 1.98 0.00 0.00 175.50 178.60 2nuu h HIS 196 N 4.82 0.71 -2.84 6.00 2.07 -0.73 -3.42 115.15 121.75 2nuu h HIS 196 Ca -0.45 -0.37 -0.58 0.00 -2.85 0.00 0.00 60.37 56.12 2nuu h HIS 196 Cb 1.28 -0.09 -0.40 0.00 2.57 0.00 0.00 27.41 30.78 2nuu h HIS 196 CO 0.59 1.18 -0.79 1.21 -3.07 0.00 0.00 177.93 177.05 2nuu s ASN 197 N -7.10 3.48 0.12 3.10 3.84 -1.10 -4.98 114.94 112.29 2nuu s ASN 197 Ca -0.07 -1.95 -0.15 0.00 0.21 0.00 0.00 52.86 50.90 2nuu s ASN 197 Cb 0.09 -0.62 -0.04 0.00 -0.55 0.00 0.00 41.25 40.13 2nuu s ASN 197 CO 0.87 -0.35 1.54 -0.07 -2.79 0.00 0.00 177.10 176.30 2nuu h LEU 198 N 7.52 0.68 -2.01 3.21 3.38 -1.83 -2.13 115.31 124.13 2nuu h LEU 198 Ca -0.06 -0.33 0.14 0.00 0.09 0.00 0.00 57.88 57.71 2nuu h LEU 198 Cb 0.98 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.53 2nuu h LEU 198 CO 0.39 0.85 0.35 -0.65 0.09 0.00 0.00 178.44 179.47 2nuu h PRO 199 N 0.49 0.00 -0.26 1.13 0.11 -1.97 0.15 132.00 131.66 2nuu h PRO 199 Ca 0.10 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 66.06 2nuu h PRO 199 Cb 0.53 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.63 2nuu h PRO 199 CO 0.03 0.00 -0.47 1.98 -0.21 0.00 0.00 178.00 179.33 2nuu h MET 200 N 0.00 0.67 -0.57 1.05 1.85 -1.77 -0.59 114.93 115.57 2nuu h MET 200 Ca 0.22 -0.38 -0.10 0.00 -0.61 0.00 0.00 59.70 58.83 2nuu h MET 200 Cb 0.91 0.03 -0.02 0.00 0.43 0.00 0.00 31.60 32.95 2nuu h MET 200 CO -0.00 1.00 -0.03 0.28 -0.40 0.00 0.00 176.91 177.76 2nuu h VAL 201 N 0.54 1.27 -0.63 -5.77 2.07 -0.40 -1.96 116.25 111.36 2nuu h VAL 201 Ca 0.03 -1.17 -0.04 0.00 0.82 0.00 0.00 66.70 66.34 2nuu h VAL 201 Cb 1.01 0.88 -0.03 0.00 -1.52 0.00 0.00 31.29 31.64 2nuu h VAL 201 CO 0.10 0.42 0.24 0.15 0.02 0.00 0.00 177.57 178.49 2nuu h PHE 202 N 0.91 0.97 -0.67 1.57 3.57 -0.61 -1.42 116.94 121.27 2nuu h PHE 202 Ca 0.16 -0.08 -0.05 0.00 3.53 0.00 0.00 57.97 61.53 2nuu h PHE 202 Cb 0.58 -0.29 -0.03 0.00 2.79 0.00 0.00 35.95 39.00 2nuu h PHE 202 CO 0.04 0.78 0.24 1.15 -2.23 0.00 0.00 178.31 178.29 2nuu h THR 203 N 0.89 1.25 -0.53 4.41 2.02 -0.92 -0.50 112.91 119.53 2nuu h THR 203 Ca 0.21 -0.82 -0.06 0.00 0.77 0.00 0.00 66.41 66.50 2nuu h THR 203 Cb 0.23 0.52 -0.02 0.00 -1.74 0.00 0.00 68.15 67.14 2nuu h THR 203 CO -0.01 0.32 0.08 1.23 0.37 0.00 0.00 175.52 177.51 2nuu h GLY 204 N 0.97 0.95 0.96 2.16 0.00 -1.21 -1.05 103.07 105.84 2nuu h GLY 204 Ca 0.22 -0.64 0.01 0.00 0.00 0.00 0.00 47.33 46.92 2nuu h GLY 204 CO -0.01 0.59 0.19 -0.84 0.00 0.00 0.00 176.54 176.47 2nuu h THR 205 N 0.76 1.05 -0.38 4.70 2.02 -0.88 0.36 112.91 120.55 2nuu h THR 205 Ca 0.16 -0.13 -0.02 0.00 0.77 0.00 0.00 66.41 67.19 2nuu h THR 205 Cb 0.41 0.63 -0.02 0.00 -1.74 0.00 0.00 68.15 67.43 2nuu h THR 205 CO 0.01 0.07 0.18 0.00 0.37 0.00 0.00 175.52 176.15 2nuu h ALA 206 N 1.13 0.49 -0.51 6.16 0.00 -0.97 0.48 119.26 126.04 2nuu h ALA 206 Ca 0.12 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 2nuu h ALA 206 Cb -0.02 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 2nuu h ALA 206 CO -0.04 0.06 0.30 0.82 0.00 0.00 0.00 179.25 180.39 2nuu h ILE 207 N 0.48 1.16 -0.40 0.00 2.04 -0.93 -0.98 117.51 118.88 2nuu h ILE 207 Ca 0.13 -0.39 0.02 0.00 1.00 0.00 0.00 64.86 65.62 2nuu h ILE 207 Cb 0.13 0.49 -0.03 0.00 -0.74 0.00 0.00 36.82 36.68 2nuu h ILE 207 CO -0.02 0.17 0.23 -0.07 0.00 0.00 0.00 178.15 178.46 2nuu h LEU 208 N 0.69 0.36 0.09 1.44 3.38 -0.62 -0.15 115.31 120.49 2nuu h LEU 208 Ca 0.18 0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.18 2nuu h LEU 208 Cb 0.01 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 2nuu h LEU 208 CO -0.03 0.26 -0.24 0.22 0.09 0.00 0.00 178.44 178.73 2nuu h TYR 209 N 0.46 -0.65 -0.21 1.13 3.20 -0.45 -0.61 116.97 119.84 2nuu h TYR 209 Ca 0.16 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.05 2nuu h TYR 209 Cb 0.03 0.27 -0.01 0.00 1.54 0.00 0.00 36.73 38.56 2nuu h TYR 209 CO -0.08 -0.34 0.13 0.82 -1.64 0.00 0.00 178.16 177.05 2nuu h ILE 210 N -0.43 1.07 0.00 1.81 1.08 -0.88 -2.54 117.51 117.62 2nuu h ILE 210 Ca 0.04 -0.15 -0.01 0.00 -0.39 0.00 0.00 64.86 64.35 2nuu h ILE 210 Cb 0.47 0.79 -0.00 0.00 -3.07 0.00 0.00 36.82 35.01 2nuu h ILE 210 CO -0.16 0.06 -0.05 1.23 -0.69 0.00 0.00 178.15 178.55 2nuu h GLY 211 N 0.27 0.00 2.00 5.37 0.00 -0.89 -2.53 103.07 107.28 2nuu h GLY 211 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.40 2nuu h GLY 211 CO -0.02 0.00 0.00 1.87 0.00 0.00 0.00 176.54 178.39 2nuu n TRP 212 N -3.40 0.72 0.13 5.60 -0.00 -0.25 -1.99 117.44 118.25 2nuu n TRP 212 Ca -0.02 0.30 -0.01 0.00 -0.00 0.00 0.00 57.50 57.78 2nuu n TRP 212 Cb 0.18 -0.99 0.14 0.00 -0.00 0.00 0.00 31.31 30.64 2nuu n TRP 212 CO 0.00 0.00 0.00 0.74 -0.00 0.00 0.00 177.69 178.43 2nuu h PHE 213 N 0.00 0.00 0.12 5.87 0.04 -1.56 0.75 116.94 122.16 2nuu h PHE 213 Ca 0.00 0.00 -0.28 0.00 2.80 0.00 0.00 57.97 60.49 2nuu h PHE 213 Cb 0.27 0.00 0.03 0.00 2.20 0.00 0.00 35.95 38.45 2nuu h PHE 213 CO 0.00 0.64 -1.17 0.78 -0.60 0.00 0.00 178.31 177.95 2nuu h GLY 214 N 2.24 0.66 0.57 -1.45 0.00 -1.60 -1.82 103.07 101.68 2nuu h GLY 214 Ca -0.01 -1.39 -0.02 0.00 0.00 0.00 0.00 47.33 45.92 2nuu h GLY 214 CO 0.08 1.22 -0.51 -2.75 0.00 0.00 0.00 176.54 174.59 2nuu h PHE 215 N 0.19 -1.39 0.32 5.60 3.57 -1.31 0.62 116.94 124.54 2nuu h PHE 215 Ca -0.18 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.31 2nuu h PHE 215 Cb 1.86 0.53 0.00 0.00 2.79 0.00 0.00 35.95 41.14 2nuu h PHE 215 CO 0.13 -0.69 -0.15 -0.91 -2.23 0.00 0.00 178.31 174.45 2nuu h ASN 216 N -1.05 -0.37 -0.19 0.41 2.35 -0.96 -3.24 115.58 112.53 2nuu h ASN 216 Ca -0.07 -0.11 -0.12 0.00 -0.55 0.00 0.00 56.30 55.44 2nuu h ASN 216 Cb 0.90 0.09 -0.01 0.00 0.05 0.00 0.00 38.32 39.35 2nuu h ASN 216 CO -0.03 0.10 -0.29 0.00 -1.65 0.00 0.00 177.43 175.56 2nuu h ALA 217 N -0.82 0.88 -0.69 -0.83 0.00 -1.45 -2.87 119.26 113.48 2nuu h ALA 217 Ca -0.04 -0.39 0.13 0.00 0.00 0.00 0.00 54.91 54.60 2nuu h ALA 217 Cb 0.46 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 2nuu h ALA 217 CO 0.07 0.63 0.46 0.78 0.00 0.00 0.00 179.25 181.19 2nuu h GLY 218 N 0.99 0.62 1.56 0.00 0.00 -0.93 -1.18 103.07 104.12 2nuu h GLY 218 Ca 0.07 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.24 2nuu h GLY 218 CO 0.07 0.07 0.04 1.44 0.00 0.00 0.00 176.54 178.15 2nuu n SER 219 N -4.47 0.00 0.12 0.19 7.64 -1.08 0.53 113.62 116.55 2nuu n SER 219 Ca 0.12 0.33 0.04 0.00 1.01 0.00 0.00 58.87 60.38 2nuu n SER 219 Cb 0.48 -0.33 0.02 0.00 -1.01 0.00 0.00 64.21 63.37 2nuu n SER 219 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2nuu h ALA 220 N 1.81 0.70 0.00 -0.43 0.00 -1.40 -3.48 119.26 116.46 2nuu h ALA 220 Ca 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.49 2nuu h ALA 220 Cb 0.07 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2nuu h ALA 220 CO 0.00 0.53 0.00 0.41 0.00 0.00 0.00 179.25 180.19 2nuu n GLY 221 N 1.24 0.58 3.53 0.00 0.00 0.19 -4.96 105.19 105.77 2nuu n GLY 221 Ca -0.01 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 2nuu n GLY 221 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2nuu s THR 222 N -2.56 0.00 -1.20 2.61 -1.32 -1.26 -4.76 115.64 107.15 2nuu s THR 222 Ca 0.00 0.00 -0.08 0.00 -1.21 0.00 0.00 61.69 60.40 2nuu s THR 222 Cb 0.00 -1.00 -0.10 0.00 -1.51 0.00 0.00 72.50 69.89 2nuu s THR 222 CO 0.00 0.00 3.05 0.00 -2.21 0.00 0.00 174.62 175.46 2nuu n ALA 223 N 0.59 7.20 -2.88 11.08 0.00 -1.26 -4.48 120.51 130.77 2nuu n ALA 223 Ca -0.15 -3.20 0.00 0.00 0.00 0.00 0.00 53.44 50.10 2nuu n ALA 223 Cb 0.59 -3.04 0.00 0.00 0.00 0.00 0.00 19.45 17.00 2nuu n ALA 223 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2nuu n ASN 224 N 3.05 0.00 0.24 0.00 6.94 -1.26 -4.97 115.26 119.26 2nuu n ASN 224 Ca 0.68 -0.91 0.11 0.00 -0.02 0.00 0.00 54.58 54.44 2nuu n ASN 224 Cb 0.40 0.00 0.62 0.00 -2.36 0.00 0.00 39.78 38.43 2nuu n ASN 224 CO 0.00 0.00 0.00 1.05 -1.03 0.00 0.00 177.26 177.28 2nuu h GLU 225 N 0.00 0.00 -0.32 -3.83 9.09 -1.99 -2.27 114.58 115.27 2nuu h GLU 225 Ca 0.00 0.00 -0.15 0.00 0.05 0.00 0.00 59.36 59.26 2nuu h GLU 225 Cb 0.00 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.10 2nuu h GLU 225 CO 0.00 0.18 -0.41 0.82 0.05 0.00 0.00 179.01 179.65 2nuu h ILE 226 N 0.00 1.29 -0.29 -1.06 1.08 -1.95 0.19 117.51 116.77 2nuu h ILE 226 Ca -0.00 -1.59 -0.06 0.00 -0.39 0.00 0.00 64.86 62.82 2nuu h ILE 226 Cb 0.48 1.55 -0.02 0.00 -3.07 0.00 0.00 36.82 35.77 2nuu h ILE 226 CO 0.02 0.52 -0.08 0.00 -0.69 0.00 0.00 178.15 177.92 2nuu h ALA 227 N 0.71 1.33 0.14 1.87 0.00 -1.70 -0.08 119.26 121.53 2nuu h ALA 227 Ca 0.04 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 2nuu h ALA 227 Cb 1.00 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.66 2nuu h ALA 227 CO 0.10 0.45 -0.07 0.00 0.00 0.00 0.00 179.25 179.73 2nuu h ALA 228 N 1.48 -0.18 -0.27 0.00 0.00 -0.99 -1.81 119.26 117.49 2nuu h ALA 228 Ca 0.09 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 54.85 2nuu h ALA 228 Cb 0.42 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 2nuu h ALA 228 CO 0.02 -0.44 0.12 1.25 0.00 0.00 0.00 179.25 180.20 2nuu h LEU 229 N -0.51 0.16 -1.33 0.00 5.85 -0.67 -2.26 115.31 116.55 2nuu h LEU 229 Ca -0.02 0.02 0.01 0.00 0.84 0.00 0.00 57.88 58.73 2nuu h LEU 229 Cb 0.40 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.39 2nuu h LEU 229 CO 0.03 0.13 0.45 0.00 -0.34 0.00 0.00 178.44 178.71 2nuu h ALA 230 N 1.15 1.52 0.30 1.25 0.00 -1.03 -0.06 119.26 122.39 2nuu h ALA 230 Ca 0.12 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 2nuu h ALA 230 Cb 0.05 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.57 2nuu h ALA 230 CO -0.09 0.45 -0.14 0.35 0.00 0.00 0.00 179.25 179.81 2nuu h PHE 231 N 0.92 -0.37 -0.63 0.00 3.04 -0.95 -2.16 116.94 116.79 2nuu h PHE 231 Ca 0.25 -0.01 0.01 0.00 3.98 0.00 0.00 57.97 62.20 2nuu h PHE 231 Cb -0.10 0.12 -0.03 0.00 2.56 0.00 0.00 35.95 38.50 2nuu h PHE 231 CO -0.00 -0.17 0.41 0.28 -2.02 0.00 0.00 178.31 176.81 2nuu h VAL 232 N -0.49 1.15 0.00 1.41 2.07 -1.06 -2.20 116.25 117.13 2nuu h VAL 232 Ca -0.04 -0.29 -0.02 0.00 0.82 0.00 0.00 66.70 67.17 2nuu h VAL 232 Cb 0.36 0.23 -0.00 0.00 -1.52 0.00 0.00 31.29 30.37 2nuu h VAL 232 CO 0.07 0.15 -0.08 0.78 0.02 0.00 0.00 177.57 178.51 2nuu h ASN 233 N 0.84 0.00 0.02 0.57 2.35 -0.96 -1.20 115.58 117.20 2nuu h ASN 233 Ca 0.23 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.98 2nuu h ASN 233 Cb -0.08 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.29 2nuu h ASN 233 CO -0.06 0.08 -0.01 0.74 -1.65 0.00 0.00 177.43 176.53 2nuu h THR 234 N 0.00 1.27 0.19 2.81 2.02 -0.77 0.18 112.91 118.62 2nuu h THR 234 Ca -0.00 -0.92 0.01 0.00 0.77 0.00 0.00 66.41 66.27 2nuu h THR 234 Cb 0.15 1.89 -0.02 0.00 -1.74 0.00 0.00 68.15 68.42 2nuu h THR 234 CO 0.01 0.23 -0.24 0.58 0.37 0.00 0.00 175.52 176.48 2nuu h VAL 235 N -0.43 0.49 0.83 3.16 2.07 -1.13 -1.64 116.25 119.60 2nuu h VAL 235 Ca -0.00 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.48 2nuu h VAL 235 Cb 0.41 0.49 0.00 0.00 -1.52 0.00 0.00 31.29 30.67 2nuu h VAL 235 CO 0.00 0.00 -0.44 0.58 0.02 0.00 0.00 177.57 177.74 2nuu h VAL 236 N -0.48 0.11 -0.68 2.57 2.07 -1.23 -2.34 116.25 116.28 2nuu h VAL 236 Ca 0.01 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.63 2nuu h VAL 236 Cb 0.46 0.11 -0.07 0.00 -1.52 0.00 0.00 31.29 30.27 2nuu h VAL 236 CO -0.08 0.00 0.30 0.00 0.02 0.00 0.00 177.57 177.81 2nuu h ALA 237 N -1.03 0.92 -0.50 1.67 0.00 -0.64 0.31 119.26 119.99 2nuu h ALA 237 Ca -0.11 0.07 0.03 0.00 0.00 0.00 0.00 54.91 54.90 2nuu h ALA 237 Cb 0.91 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.67 2nuu h ALA 237 CO 0.16 -0.12 0.28 1.15 0.00 0.00 0.00 179.25 180.72 2nuu h THR 238 N 0.51 1.02 0.09 0.00 2.02 -1.28 -0.20 112.91 115.07 2nuu h THR 238 Ca 0.34 -0.19 -0.00 0.00 0.77 0.00 0.00 66.41 67.33 2nuu h THR 238 Cb 0.41 0.41 0.00 0.00 -1.74 0.00 0.00 68.15 67.23 2nuu h THR 238 CO -0.30 0.10 -0.04 0.00 0.37 0.00 0.00 175.52 175.65 2nuu h ALA 239 N 1.24 -0.12 -0.68 6.16 0.00 -0.82 -1.39 119.26 123.65 2nuu h ALA 239 Ca 0.21 -0.09 0.10 0.00 0.00 0.00 0.00 54.91 55.13 2nuu h ALA 239 Cb 0.06 0.05 -0.07 0.00 0.00 0.00 0.00 17.79 17.82 2nuu h ALA 239 CO -0.11 -0.49 0.30 0.00 0.00 0.00 0.00 179.25 178.94 2nuu h ALA 240 N 0.63 0.92 -0.34 0.00 0.00 -0.67 -1.98 119.26 117.82 2nuu h ALA 240 Ca -0.01 0.07 -0.11 0.00 0.00 0.00 0.00 54.91 54.86 2nuu h ALA 240 Cb 0.22 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2nuu h ALA 240 CO 0.02 -0.12 -0.24 0.00 0.00 0.00 0.00 179.25 178.91 2nuu h ALA 241 N 1.44 0.95 -0.27 0.00 0.00 -0.90 -1.48 119.26 118.99 2nuu h ALA 241 Ca 0.34 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2nuu h ALA 241 Cb 0.41 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2nuu h ALA 241 CO -0.30 0.61 0.13 0.82 0.00 0.00 0.00 179.25 180.51 2nuu h ILE 242 N 0.58 1.15 -0.32 0.00 2.04 -0.64 -1.87 117.51 118.45 2nuu h ILE 242 Ca 0.08 -0.42 -0.02 0.00 1.00 0.00 0.00 64.86 65.50 2nuu h ILE 242 Cb 0.72 0.93 -0.01 0.00 -0.74 0.00 0.00 36.82 37.71 2nuu h ILE 242 CO 0.06 0.15 0.12 -0.07 0.00 0.00 0.00 178.15 178.40 2nuu h LEU 243 N 0.31 0.45 -0.10 1.44 3.38 -1.25 0.22 115.31 119.76 2nuu h LEU 243 Ca 0.09 -0.18 0.03 0.00 0.09 0.00 0.00 57.88 57.91 2nuu h LEU 243 Cb 0.12 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 2nuu h LEU 243 CO -0.01 0.51 -0.07 1.23 0.09 0.00 0.00 178.44 180.19 2nuu h GLY 244 N 0.36 0.01 0.84 0.83 0.00 -1.19 0.21 103.07 104.14 2nuu h GLY 244 Ca 0.10 0.09 -0.01 0.00 0.00 0.00 0.00 47.33 47.51 2nuu h GLY 244 CO -0.01 -0.09 -0.13 -0.25 0.00 0.00 0.00 176.54 176.07 2nuu h TRP 245 N -0.08 -0.33 0.04 5.60 2.91 -1.29 -0.27 115.95 122.53 2nuu h TRP 245 Ca 0.06 -0.01 0.03 0.00 1.13 0.00 0.00 58.89 60.10 2nuu h TRP 245 Cb 0.17 0.11 -0.05 0.00 -0.51 0.00 0.00 29.16 28.88 2nuu h TRP 245 CO -0.19 -0.09 -0.39 0.82 -1.03 0.00 0.00 178.44 177.56 2nuu h ILE 246 N -0.52 0.20 -0.72 2.65 1.08 -0.73 0.44 117.51 119.90 2nuu h ILE 246 Ca -0.04 0.00 -0.05 0.00 -0.39 0.00 0.00 64.86 64.39 2nuu h ILE 246 Cb 0.38 0.20 -0.03 0.00 -3.07 0.00 0.00 36.82 34.30 2nuu h ILE 246 CO 0.06 0.00 0.26 -0.26 -0.69 0.00 0.00 178.15 177.52 2nuu h PHE 247 N -0.57 1.12 -0.42 1.37 0.04 -0.63 0.38 116.94 118.23 2nuu h PHE 247 Ca 0.04 -0.09 -0.04 0.00 2.80 0.00 0.00 57.97 60.69 2nuu h PHE 247 Cb 0.64 -0.33 -0.02 0.00 2.20 0.00 0.00 35.95 38.44 2nuu h PHE 247 CO -0.38 0.87 0.12 0.78 -0.60 0.00 0.00 178.31 179.09 2nuu h GLY 248 N 1.11 0.71 1.84 -1.45 0.00 -0.59 0.50 103.07 105.19 2nuu h GLY 248 Ca 0.24 -0.43 -0.11 0.00 0.00 0.00 0.00 47.33 47.03 2nuu h GLY 248 CO -0.02 0.40 -0.46 -2.09 0.00 0.00 0.00 176.54 174.38 2nuu h GLU 249 N 0.54 0.18 0.41 4.80 4.81 0.09 -1.68 114.58 123.73 2nuu h GLU 249 Ca 0.13 -0.09 -0.02 0.00 -0.13 0.00 0.00 59.36 59.25 2nuu h GLU 249 Cb 0.28 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.67 2nuu h GLU 249 CO -0.00 0.61 -0.20 2.35 -0.73 0.00 0.00 179.01 181.04 2nuu h TRP 250 N 0.15 -0.51 -0.02 0.92 2.91 -0.67 -1.00 115.95 117.73 2nuu h TRP 250 Ca 0.01 -0.01 0.01 0.00 1.13 0.00 0.00 58.89 60.02 2nuu h TRP 250 Cb 0.87 0.17 -0.00 0.00 -0.51 0.00 0.00 29.16 29.69 2nuu h TRP 250 CO 0.01 -0.32 0.06 0.00 -1.03 0.00 0.00 178.44 177.16 2nuu h ALA 251 N -1.37 1.21 0.00 2.65 0.00 -0.92 0.41 119.26 121.25 2nuu h ALA 251 Ca -0.06 -0.00 -0.32 0.00 0.00 0.00 0.00 54.91 54.54 2nuu h ALA 251 Cb 0.42 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.16 2nuu h ALA 251 CO 0.09 -0.07 -2.19 -0.11 0.00 0.00 0.00 179.25 176.97 2nuu n LEU 252 N -3.26 0.00 -0.00 0.00 0.00 -0.63 -4.72 117.00 108.38 2nuu n LEU 252 Ca -0.02 0.00 0.02 0.00 0.00 0.00 0.00 56.01 56.00 2nuu n LEU 252 Cb 0.14 0.43 -0.02 0.00 0.00 0.00 0.00 43.42 43.96 2nuu n LEU 252 CO 0.21 0.43 -0.37 0.54 0.00 0.00 0.00 177.39 178.20 2nuu n ARG 253 N -2.64 2.01 0.00 1.96 1.74 -0.38 -5.05 116.66 114.30 2nuu n ARG 253 Ca -0.28 -0.02 0.00 0.00 -0.77 0.00 0.00 57.85 56.78 2nuu n ARG 253 Cb 1.06 -0.94 0.00 0.00 -1.02 0.00 0.00 32.46 31.56 2nuu n ARG 253 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2nuu n GLY 254 N 1.91 2.86 2.91 -0.13 0.00 0.14 -5.02 105.19 107.86 2nuu n GLY 254 Ca -0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 2nuu n GLY 254 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2nuu s LYS 255 N -0.52 0.29 -0.33 1.61 1.02 -1.25 -4.92 119.74 115.63 2nuu s LYS 255 Ca 0.00 -0.09 -0.26 0.00 0.02 0.00 0.00 55.97 55.64 2nuu s LYS 255 Cb 0.00 -0.31 0.01 0.00 -0.52 0.00 0.00 37.83 37.01 2nuu s LYS 255 CO 0.00 0.04 0.91 -1.25 -0.92 0.00 0.00 175.35 174.14 2nuu s PRO 256 N 0.09 3.96 0.37 -1.68 0.04 -1.26 -3.97 135.00 132.55 2nuu s PRO 256 Ca -0.01 0.73 0.01 0.00 0.04 0.00 0.00 61.00 61.78 2nuu s PRO 256 Cb -0.03 -3.75 -0.02 0.00 0.04 0.00 0.00 34.50 30.73 2nuu s PRO 256 CO -0.00 -0.82 0.57 -1.54 0.04 0.00 0.00 177.00 175.25 2nuu s SER 257 N 1.69 6.14 0.12 6.66 1.04 -1.26 -5.02 113.70 123.07 2nuu s SER 257 Ca 0.38 0.35 -0.14 0.00 0.48 0.00 0.00 55.95 57.02 2nuu s SER 257 Cb -0.13 -1.83 -0.05 0.00 0.10 0.00 0.00 66.02 64.11 2nuu s SER 257 CO 0.15 -0.42 1.48 0.25 0.98 0.00 0.00 173.24 175.68 2nuu h LEU 258 N 0.67 0.80 -1.21 2.42 6.46 -1.99 -1.97 115.31 120.49 2nuu h LEU 258 Ca -0.48 -0.42 -0.04 0.00 -0.12 0.00 0.00 57.88 56.81 2nuu h LEU 258 Cb 1.23 -0.22 -0.02 0.00 -0.73 0.00 0.00 40.66 40.92 2nuu h LEU 258 CO 0.60 1.05 0.10 0.25 -0.62 0.00 0.00 178.44 179.82 2nuu h LEU 259 N 0.56 0.60 -0.56 2.25 5.85 -1.97 -1.13 115.31 120.92 2nuu h LEU 259 Ca 0.07 -0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.67 2nuu h LEU 259 Cb 0.77 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.62 2nuu h LEU 259 CO 0.06 0.60 0.22 1.23 -0.34 0.00 0.00 178.44 180.22 2nuu h GLY 260 N 0.86 0.90 0.97 3.75 0.00 -1.91 0.52 103.07 108.15 2nuu h GLY 260 Ca 0.15 -0.49 -0.06 0.00 0.00 0.00 0.00 47.33 46.92 2nuu h GLY 260 CO -0.00 0.46 0.04 0.00 0.00 0.00 0.00 176.54 177.04 2nuu h ALA 261 N 1.07 0.60 -0.55 3.60 0.00 -0.85 -0.57 119.26 122.56 2nuu h ALA 261 Ca 0.19 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 2nuu h ALA 261 Cb 0.20 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 2nuu h ALA 261 CO -0.02 0.35 0.18 0.00 0.00 0.00 0.00 179.25 179.77 2nuu h SER 263 N 0.76 0.00 -0.38 0.00 0.02 -0.81 -2.66 113.55 110.49 2nuu h SER 263 Ca 0.18 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 61.08 2nuu h SER 263 Cb 0.26 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.78 2nuu h SER 263 CO -0.01 0.54 0.03 1.23 -1.14 0.00 0.00 176.83 177.49 2nuu h GLY 264 N 1.65 0.70 0.41 -3.77 0.00 -0.86 -0.89 103.07 100.32 2nuu h GLY 264 Ca -0.01 -0.49 0.04 0.00 0.00 0.00 0.00 47.33 46.87 2nuu h GLY 264 CO 0.07 0.46 -0.22 0.00 0.00 0.00 0.00 176.54 176.85 2nuu h ALA 265 N 0.89 -0.24 -0.72 3.60 0.00 -1.12 -0.86 119.26 120.81 2nuu h ALA 265 Ca 0.11 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 2nuu h ALA 265 Cb 0.42 0.41 -0.03 0.00 0.00 0.00 0.00 17.79 18.58 2nuu h ALA 265 CO 0.01 -0.70 0.27 0.82 0.00 0.00 0.00 179.25 179.66 2nuu h ILE 266 N -0.31 1.25 -0.76 0.00 1.08 -1.36 -1.58 117.51 115.82 2nuu h ILE 266 Ca 0.08 -0.80 0.02 0.00 -0.39 0.00 0.00 64.86 63.77 2nuu h ILE 266 Cb 0.43 0.40 -0.04 0.00 -3.07 0.00 0.00 36.82 34.53 2nuu h ILE 266 CO -0.24 0.32 0.49 0.00 -0.69 0.00 0.00 178.15 178.03 2nuu h ALA 267 N 1.24 0.98 0.00 1.87 0.00 -0.58 0.37 119.26 123.15 2nuu h ALA 267 Ca 0.24 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 2nuu h ALA 267 Cb 0.22 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2nuu h ALA 267 CO -0.02 0.32 -0.00 0.78 0.00 0.00 0.00 179.25 180.33 2nuu h GLY 268 N 0.98 -0.00 0.38 0.00 0.00 -0.87 -0.71 103.07 102.84 2nuu h GLY 268 Ca 0.29 0.00 0.12 0.00 0.00 0.00 0.00 47.33 47.75 2nuu h GLY 268 CO -0.09 -0.00 0.47 1.41 0.00 0.00 0.00 176.54 178.33 2nuu h LEU 269 N -0.39 0.64 -0.37 3.11 3.38 -1.05 0.17 115.31 120.80 2nuu h LEU 269 Ca -0.00 0.07 -0.14 0.00 0.09 0.00 0.00 57.88 57.90 2nuu h LEU 269 Cb 0.39 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 2nuu h LEU 269 CO 0.00 0.32 -0.32 0.58 0.09 0.00 0.00 178.44 179.11 2nuu h VAL 270 N 0.73 1.28 -0.78 1.22 2.07 -0.89 -2.18 116.25 117.71 2nuu h VAL 270 Ca 0.44 -1.49 -0.05 0.00 0.82 0.00 0.00 66.70 66.42 2nuu h VAL 270 Cb 0.52 1.41 -0.03 0.00 -1.52 0.00 0.00 31.29 31.66 2nuu h VAL 270 CO -0.30 0.49 0.29 1.23 0.02 0.00 0.00 177.57 179.30 2nuu h GLY 271 N 0.67 1.27 1.44 2.17 0.00 0.24 -2.91 103.07 105.95 2nuu h GLY 271 Ca 0.06 -0.72 0.00 0.00 0.00 0.00 0.00 47.33 46.68 2nuu h GLY 271 CO 0.08 0.67 -0.44 -0.24 0.00 0.00 0.00 176.54 176.61 2nuu h VAL 272 N 1.15 0.00 -0.60 4.60 3.04 -1.04 -3.38 116.25 120.02 2nuu h VAL 272 Ca 0.26 -0.59 0.06 0.00 -1.01 0.00 0.00 66.70 65.42 2nuu h VAL 272 Cb 0.25 1.31 -0.09 0.00 -2.01 0.00 0.00 31.29 30.76 2nuu h VAL 272 CO -0.02 0.00 -0.50 0.74 -1.01 0.00 0.00 177.57 176.78 2nuu h THR 273 N 0.00 0.00 0.00 3.17 2.02 -1.18 0.72 112.91 117.65 2nuu h THR 273 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 2nuu h THR 273 Cb 0.79 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.20 2nuu h THR 273 CO 0.00 0.00 0.00 1.55 0.37 0.00 0.00 175.52 177.44 2nuu h PRO 274 N -0.19 0.00 0.01 6.66 0.13 -1.75 -2.67 132.00 134.19 2nuu h PRO 274 Ca 0.10 0.00 -0.35 0.00 -0.87 0.00 0.00 66.00 64.88 2nuu h PRO 274 Cb 0.45 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 31.52 2nuu h PRO 274 CO -0.66 0.00 -2.14 0.00 -0.23 0.00 0.00 178.00 174.96 2nuu n ALA 275 N -1.98 1.44 -0.20 -0.56 0.00 0.00 -0.68 120.51 118.53 2nuu n ALA 275 Ca 0.02 -1.06 0.18 0.00 0.00 0.00 0.00 53.44 52.58 2nuu n ALA 275 Cb 0.34 -0.43 0.33 0.00 0.00 0.00 0.00 19.45 19.69 2nuu n ALA 275 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2nuu n GLY 277 N -1.19 -0.01 0.01 0.00 0.00 -1.26 -3.43 105.19 99.32 2nuu n GLY 277 Ca 0.22 -0.50 0.05 0.00 0.00 0.00 0.00 46.02 45.78 2nuu n GLY 277 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2nuu n TYR 278 N 0.10 0.00 -3.58 1.61 4.01 0.10 -4.89 117.16 114.51 2nuu n TYR 278 Ca 0.15 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.65 2nuu n TYR 278 Cb 0.41 -0.32 0.01 0.00 -0.31 0.00 0.00 39.34 39.13 2nuu n TYR 278 CO 0.00 0.00 0.00 0.96 -0.46 0.00 0.00 176.86 177.36 2nuu s ILE 279 N -2.79 1.98 0.51 -0.72 -4.36 -1.08 -0.22 121.20 114.52 2nuu s ILE 279 Ca -0.05 -1.32 0.07 0.00 -0.26 0.00 0.00 60.65 59.09 2nuu s ILE 279 Cb 0.07 -2.30 0.03 0.00 1.25 0.00 0.00 42.46 41.51 2nuu s ILE 279 CO 0.51 0.00 0.47 -0.83 0.24 0.00 0.00 174.94 175.33 2nuu s GLY 280 N -4.36 2.16 0.46 6.27 0.00 -1.19 -4.72 107.32 105.94 2nuu s GLY 280 Ca 0.44 -1.65 0.17 0.00 0.00 0.00 0.00 44.72 43.68 2nuu s GLY 280 CO 0.27 -1.81 1.97 -0.24 0.00 0.00 0.00 173.10 173.29 2nuu h VAL 281 N 0.73 0.83 -0.61 1.40 3.04 -1.95 -2.11 116.25 117.57 2nuu h VAL 281 Ca -0.37 -0.11 -0.10 0.00 -1.01 0.00 0.00 66.70 65.12 2nuu h VAL 281 Cb 1.29 0.49 -0.02 0.00 -2.01 0.00 0.00 31.29 31.04 2nuu h VAL 281 CO 0.54 0.06 0.00 1.23 -1.01 0.00 0.00 177.57 178.39 2nuu h GLY 282 N 0.31 1.16 1.47 3.17 0.00 -1.93 -2.48 103.07 104.77 2nuu h GLY 282 Ca 0.30 -0.85 -0.20 0.00 0.00 0.00 0.00 47.33 46.57 2nuu h GLY 282 CO -0.07 0.79 -0.78 -1.33 0.00 0.00 0.00 176.54 175.15 2nuu h GLY 283 N 0.98 0.56 0.83 4.60 0.00 -1.67 -2.88 103.07 105.50 2nuu h GLY 283 Ca 0.17 -0.82 0.03 0.00 0.00 0.00 0.00 47.33 46.71 2nuu h GLY 283 CO 0.03 0.73 0.30 0.00 0.00 0.00 0.00 176.54 177.60 2nuu h ALA 284 N 0.80 0.67 -0.26 3.60 0.00 -1.32 0.24 119.26 122.99 2nuu h ALA 284 Ca -0.05 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.88 2nuu h ALA 284 Cb 1.38 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 19.01 2nuu h ALA 284 CO 0.14 -0.01 0.12 1.25 0.00 0.00 0.00 179.25 180.75 2nuu h LEU 285 N 0.59 0.17 -0.13 0.00 6.46 -1.43 0.12 115.31 121.10 2nuu h LEU 285 Ca 0.22 0.02 -0.02 0.00 -0.12 0.00 0.00 57.88 57.97 2nuu h LEU 285 Cb 0.06 -0.02 -0.00 0.00 -0.73 0.00 0.00 40.66 39.97 2nuu h LEU 285 CO -0.11 0.13 0.01 0.40 -0.62 0.00 0.00 178.44 178.25 2nuu h ILE 286 N 0.26 1.24 -0.95 4.05 2.04 -1.20 -2.18 117.51 120.76 2nuu h ILE 286 Ca 0.11 -0.76 -0.00 0.00 1.00 0.00 0.00 64.86 65.21 2nuu h ILE 286 Cb 0.05 1.48 -0.05 0.00 -0.74 0.00 0.00 36.82 37.56 2nuu h ILE 286 CO -0.09 0.22 0.60 0.40 0.00 0.00 0.00 178.15 179.28 2nuu h ILE 287 N -0.02 1.26 0.48 -0.67 2.04 -0.42 -1.42 117.51 118.75 2nuu h ILE 287 Ca 0.04 -0.53 -0.02 0.00 1.00 0.00 0.00 64.86 65.35 2nuu h ILE 287 Cb 0.33 -0.11 -0.00 0.00 -0.74 0.00 0.00 36.82 36.30 2nuu h ILE 287 CO 0.00 0.26 -0.28 1.23 0.00 0.00 0.00 178.15 179.36 2nuu h GLY 288 N 1.31 -0.89 -0.15 5.37 0.00 -0.65 0.84 103.07 108.90 2nuu h GLY 288 Ca 0.35 0.36 0.08 0.00 0.00 0.00 0.00 47.33 48.12 2nuu h GLY 288 CO -0.07 -0.31 -0.31 -2.08 0.00 0.00 0.00 176.54 173.78 2nuu h VAL 289 N -0.71 0.25 -0.56 4.60 2.07 -1.33 -0.50 116.25 120.06 2nuu h VAL 289 Ca -0.07 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.49 2nuu h VAL 289 Cb 0.57 0.25 -0.04 0.00 -1.52 0.00 0.00 31.29 30.55 2nuu h VAL 289 CO 0.07 0.00 0.32 0.58 0.02 0.00 0.00 177.57 178.56 2nuu h VAL 290 N -0.23 1.02 -0.59 2.57 2.07 -1.24 -2.38 116.25 117.46 2nuu h VAL 290 Ca 0.18 -0.21 -0.04 0.00 0.82 0.00 0.00 66.70 67.45 2nuu h VAL 290 Cb 0.53 0.34 -0.03 0.00 -1.52 0.00 0.00 31.29 30.61 2nuu h VAL 290 CO -0.53 0.11 0.22 0.00 0.02 0.00 0.00 177.57 177.39 2nuu h ALA 291 N 1.27 1.27 -0.55 1.67 0.00 0.02 0.15 119.26 123.08 2nuu h ALA 291 Ca 0.24 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 2nuu h ALA 291 Cb 0.08 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 2nuu h ALA 291 CO -0.13 0.53 0.13 0.78 0.00 0.00 0.00 179.25 180.56 2nuu h GLY 292 N 0.98 0.96 1.50 0.00 0.00 -0.76 0.37 103.07 106.11 2nuu h GLY 292 Ca 0.20 -0.61 -0.21 0.00 0.00 0.00 0.00 47.33 46.72 2nuu h GLY 292 CO -0.01 0.56 -0.82 1.41 0.00 0.00 0.00 176.54 177.68 2nuu h LEU 293 N 0.79 0.59 -0.94 3.11 3.38 -1.16 -2.56 115.31 118.52 2nuu h LEU 293 Ca 0.17 -0.42 -0.08 0.00 0.09 0.00 0.00 57.88 57.64 2nuu h LEU 293 Cb 0.35 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 2nuu h LEU 293 CO 0.00 1.19 -0.10 0.00 0.09 0.00 0.00 178.44 179.62 2nuu h ALA 294 N 0.79 1.11 -0.48 1.53 0.00 -0.52 -0.39 119.26 121.30 2nuu h ALA 294 Ca -0.05 -0.29 -0.11 0.00 0.00 0.00 0.00 54.91 54.45 2nuu h ALA 294 Cb 1.43 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 2nuu h ALA 294 CO 0.15 0.55 -0.14 0.78 0.00 0.00 0.00 179.25 180.59 2nuu h GLY 295 N 0.96 0.99 0.98 0.00 0.00 -0.89 0.13 103.07 105.23 2nuu h GLY 295 Ca 0.11 -0.80 -0.09 0.00 0.00 0.00 0.00 47.33 46.56 2nuu h GLY 295 CO 0.03 0.73 -0.09 -2.00 0.00 0.00 0.00 176.54 175.21 2nuu h LEU 296 N 0.81 0.77 -0.90 3.11 5.85 -1.08 -1.94 115.31 121.92 2nuu h LEU 296 Ca 0.13 -0.36 -0.07 0.00 0.84 0.00 0.00 57.88 58.41 2nuu h LEU 296 Cb 0.67 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.47 2nuu h LEU 296 CO 0.05 0.95 -0.00 -0.25 -0.34 0.00 0.00 178.44 178.84 2nuu h TRP 297 N 0.57 0.85 -0.49 1.25 7.01 -0.88 -2.92 115.95 121.34 2nuu h TRP 297 Ca 0.10 -0.12 0.01 0.00 2.11 0.00 0.00 58.89 60.99 2nuu h TRP 297 Cb 0.61 -0.23 -0.03 0.00 -2.10 0.00 0.00 29.16 27.41 2nuu h TRP 297 CO 0.05 0.79 0.32 0.78 -2.79 0.00 0.00 178.44 177.59 2nuu h GLY 298 N 0.97 0.69 -0.49 2.65 0.00 -0.33 -1.12 103.07 105.44 2nuu h GLY 298 Ca 0.14 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 47.23 2nuu h GLY 298 CO 0.02 0.23 -0.02 3.33 0.00 0.00 0.00 176.54 180.11 2nuu n VAL 299 N -4.76 0.00 0.01 4.60 0.24 -0.77 -2.65 118.33 115.00 2nuu n VAL 299 Ca 0.02 -0.25 -0.01 0.00 -2.04 0.00 0.00 64.34 62.06 2nuu n VAL 299 Cb 0.04 0.54 -0.00 0.00 -1.47 0.00 0.00 33.84 32.94 2nuu n VAL 299 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 2nuu n THR 300 N 0.18 0.72 -0.07 3.34 -1.04 -1.11 -4.64 114.28 111.67 2nuu n THR 300 Ca 0.18 0.24 -0.13 0.00 -2.04 0.00 0.00 64.05 62.31 2nuu n THR 300 Cb 0.37 -1.48 -0.12 0.00 -1.82 0.00 0.00 70.33 67.28 2nuu n THR 300 CO 0.00 0.00 0.00 0.24 -0.64 0.00 0.00 175.07 174.67 2nuu h MET 301 N -0.13 0.00 -0.99 -2.82 2.07 -1.46 -3.30 114.93 108.31 2nuu h MET 301 Ca 0.00 0.00 0.03 0.00 -2.07 0.00 0.00 59.70 57.66 2nuu h MET 301 Cb 0.13 0.00 -0.06 0.00 -1.87 0.00 0.00 31.60 29.80 2nuu h MET 301 CO 0.00 0.90 0.65 1.25 1.07 0.00 0.00 176.91 180.78 2nuu h LEU 302 N -1.00 1.09 -0.27 1.22 7.12 -1.53 -2.47 115.31 119.46 2nuu h LEU 302 Ca -0.02 -0.01 -0.00 0.00 0.13 0.00 0.00 57.88 57.97 2nuu h LEU 302 Cb 0.93 -0.25 -0.01 0.00 -0.53 0.00 0.00 40.66 40.79 2nuu h LEU 302 CO -0.01 0.75 0.16 0.50 -0.13 0.00 0.00 178.44 179.71 2nuu h LYS 303 N 1.26 0.37 0.00 1.25 3.64 -1.66 -0.53 116.57 120.90 2nuu h LYS 303 Ca 0.39 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.70 2nuu h LYS 303 Cb -0.02 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.72 2nuu h LYS 303 CO -0.12 0.29 -0.17 0.07 -2.27 0.00 0.00 179.45 177.25 2nuu h ARG 304 N 0.34 0.00 -0.07 1.90 0.11 -1.60 -2.62 114.38 112.43 2nuu h ARG 304 Ca 0.10 0.00 -0.20 0.00 0.10 0.00 0.00 59.98 59.98 2nuu h ARG 304 Cb 0.01 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.11 2nuu h ARG 304 CO -0.02 0.17 -0.74 -0.07 0.10 0.00 0.00 179.97 179.41 2nuu h LEU 305 N 0.00 0.78 -0.86 0.08 4.07 -1.02 -3.23 115.31 115.13 2nuu h LEU 305 Ca -0.00 -0.68 -0.04 0.00 0.08 0.00 0.00 57.88 57.23 2nuu h LEU 305 Cb 0.72 -0.23 -0.01 0.00 1.08 0.00 0.00 40.66 42.22 2nuu h LEU 305 CO 0.02 1.35 -0.21 -0.07 -1.08 0.00 0.00 178.44 178.45 2nuu h LEU 306 N 0.27 0.00 -1.02 1.67 3.38 -1.00 -3.47 115.31 115.14 2nuu h LEU 306 Ca -0.07 0.00 -0.45 0.00 0.09 0.00 0.00 57.88 57.45 2nuu h LEU 306 Cb 1.39 0.00 0.02 0.00 0.09 0.00 0.00 40.66 42.17 2nuu h LEU 306 CO 0.15 0.21 -0.74 0.54 0.09 0.00 0.00 178.44 178.69 2nuu n ARG 307 N -3.29 -6.22 -5.24 1.13 1.74 -1.00 -4.99 116.66 98.79 2nuu n ARG 307 Ca 0.01 0.67 -0.32 0.00 -0.77 0.00 0.00 57.85 57.44 2nuu n ARG 307 Cb 0.47 -5.59 -0.17 0.00 -1.02 0.00 0.00 32.46 26.15 2nuu n ARG 307 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2nuu s VAL 308 N -3.33 2.05 -1.07 1.55 1.01 -1.26 -5.04 120.40 114.30 2nuu s VAL 308 Ca 0.58 -1.04 -0.16 0.00 0.00 0.00 0.00 61.98 61.36 2nuu s VAL 308 Cb -0.28 -1.74 0.15 0.00 0.00 0.00 0.00 36.38 34.51 2nuu s VAL 308 CO 0.80 0.56 1.28 -0.62 0.00 0.00 0.00 175.10 177.12 2nuu s ASP 309 N 0.04 6.86 -0.60 3.32 2.15 -1.26 -4.93 116.67 122.25 2nuu s ASP 309 Ca -0.10 -2.55 -0.10 0.00 0.43 0.00 0.00 52.55 50.24 2nuu s ASP 309 Cb -0.15 -2.40 0.15 0.00 -0.30 0.00 0.00 42.92 40.22 2nuu s ASP 309 CO 0.06 -0.89 0.49 -0.62 -0.17 0.00 0.00 175.17 174.04 2nuu s ASP 310 N 3.19 5.95 0.47 -0.34 -1.08 -1.26 -4.88 116.67 118.73 2nuu s ASP 310 Ca 0.38 -2.27 0.18 0.00 -0.52 0.00 0.00 52.55 50.32 2nuu s ASP 310 Cb -0.04 -2.06 1.16 0.00 -1.46 0.00 0.00 42.92 40.52 2nuu s ASP 310 CO -0.05 -0.63 2.02 -0.65 0.52 0.00 0.00 175.17 176.39 2nuu h PRO 311 N 8.08 0.00 -0.46 4.34 0.11 -1.77 -1.39 132.00 140.91 2nuu h PRO 311 Ca -0.11 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.00 2nuu h PRO 311 Cb 1.05 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.16 2nuu h PRO 311 CO 0.83 0.16 0.00 0.00 -0.21 0.00 0.00 178.00 178.78 2nuu n ASP 313 N 0.47 -0.41 -0.04 0.00 8.00 -0.52 -4.90 116.55 119.15 2nuu n ASP 313 Ca 0.21 -1.03 -0.10 0.00 0.71 0.00 0.00 54.79 54.58 2nuu n ASP 313 Cb 0.78 -2.92 -0.04 0.00 -0.02 0.00 0.00 41.12 38.93 2nuu n ASP 313 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 2nuu h VAL 314 N -1.81 1.04 -0.23 2.53 2.07 -1.90 -2.84 116.25 115.11 2nuu h VAL 314 Ca -0.63 -0.08 -0.10 0.00 0.82 0.00 0.00 66.70 66.70 2nuu h VAL 314 Cb 1.38 0.78 -0.00 0.00 -1.52 0.00 0.00 31.29 31.92 2nuu h VAL 314 CO 0.64 0.04 -0.27 0.15 0.02 0.00 0.00 177.57 178.16 2nuu h PHE 315 N 0.24 0.71 -0.55 1.57 3.57 -1.91 -0.65 116.94 119.92 2nuu h PHE 315 Ca 0.07 -0.22 0.16 0.00 3.53 0.00 0.00 57.97 61.50 2nuu h PHE 315 Cb -0.02 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 38.55 2nuu h PHE 315 CO -0.07 0.94 0.40 0.78 -2.23 0.00 0.00 178.31 178.12 2nuu h GLY 316 N 0.28 0.01 0.00 2.40 0.00 -1.78 -1.11 103.07 102.87 2nuu h GLY 316 Ca 0.03 -0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.36 2nuu h GLY 316 CO 0.06 0.00 -0.30 -0.62 0.00 0.00 0.00 176.54 175.69 2nuu n VAL 317 N -4.38 0.54 -0.21 4.60 0.31 -1.08 -4.26 118.33 113.86 2nuu n VAL 317 Ca 0.10 0.32 -0.06 0.00 -0.01 0.00 0.00 64.34 64.69 2nuu n VAL 317 Cb 0.62 -1.69 0.03 0.00 -0.91 0.00 0.00 33.84 31.89 2nuu n VAL 317 CO 0.00 0.00 0.00 0.45 -1.32 0.00 0.00 176.83 175.96 2nuu h HIS 318 N -0.30 0.78 0.61 3.52 3.86 -1.23 -0.80 115.15 121.60 2nuu h HIS 318 Ca 0.00 -0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.18 2nuu h HIS 318 Cb 0.30 -0.26 0.01 0.00 1.06 0.00 0.00 27.41 28.52 2nuu h HIS 318 CO -0.13 0.54 -0.29 0.78 0.86 0.00 0.00 177.93 179.68 2nuu h GLY 319 N 0.80 -0.86 0.78 2.45 0.00 -1.28 -0.75 103.07 104.21 2nuu h GLY 319 Ca 0.21 0.32 0.02 0.00 0.00 0.00 0.00 47.33 47.88 2nuu h GLY 319 CO -0.04 -0.31 -0.04 -2.08 0.00 0.00 0.00 176.54 174.07 2nuu h VAL 320 N -1.20 0.87 0.00 4.60 2.07 -1.30 -1.41 116.25 119.89 2nuu h VAL 320 Ca -0.08 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 67.33 2nuu h VAL 320 Cb 0.63 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 31.26 2nuu h VAL 320 CO 0.14 0.00 -0.52 0.00 0.02 0.00 0.00 177.57 177.21 2nuu h GLY 322 N 1.82 -0.15 0.57 0.00 0.00 -0.93 0.19 103.07 104.58 2nuu h GLY 322 Ca -0.01 0.05 0.05 0.00 0.00 0.00 0.00 47.33 47.42 2nuu h GLY 322 CO 0.07 -0.05 -0.03 -2.22 0.00 0.00 0.00 176.54 174.30 2nuu h ILE 323 N -0.44 0.79 0.06 2.60 2.04 -1.17 -0.66 117.51 120.73 2nuu h ILE 323 Ca -0.01 -0.01 -0.00 0.00 1.00 0.00 0.00 64.86 65.83 2nuu h ILE 323 Cb 0.37 0.75 0.00 0.00 -0.74 0.00 0.00 36.82 37.20 2nuu h ILE 323 CO 0.02 0.01 -0.03 0.58 0.00 0.00 0.00 178.15 178.73 2nuu h VAL 324 N 0.04 1.01 -0.86 1.67 2.07 -1.21 -2.56 116.25 116.40 2nuu h VAL 324 Ca 0.12 -0.21 0.10 0.00 0.82 0.00 0.00 66.70 67.52 2nuu h VAL 324 Cb 0.16 1.14 -0.06 0.00 -1.52 0.00 0.00 31.29 31.02 2nuu h VAL 324 CO -0.22 0.05 0.56 1.23 0.02 0.00 0.00 177.57 179.21 2nuu h GLY 325 N -0.17 1.22 0.92 2.17 0.00 -0.30 -0.77 103.07 106.13 2nuu h GLY 325 Ca -0.01 -0.35 -0.10 0.00 0.00 0.00 0.00 47.33 46.87 2nuu h GLY 325 CO 0.01 0.20 -0.22 0.00 0.00 0.00 0.00 176.54 176.53 2nuu h ILE 327 N 0.35 1.20 0.00 0.00 2.04 -1.02 -2.98 117.51 117.10 2nuu h ILE 327 Ca 0.05 -0.60 0.00 0.00 1.00 0.00 0.00 64.86 65.31 2nuu h ILE 327 Cb 0.77 1.58 0.00 0.00 -0.74 0.00 0.00 36.82 38.42 2nuu h ILE 327 CO 0.06 0.16 0.00 0.24 0.00 0.00 0.00 178.15 178.60 2nuu h MET 328 N -0.22 0.00 -0.06 2.37 2.86 -1.21 -0.12 114.93 118.55 2nuu h MET 328 Ca 0.00 0.00 -0.19 0.00 -2.06 0.00 0.00 59.70 57.45 2nuu h MET 328 Cb 0.25 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.91 2nuu h MET 328 CO 0.00 0.00 -0.77 1.15 1.06 0.00 0.00 176.91 178.35 2nuu h THR 329 N 0.00 1.39 0.00 2.22 2.02 -1.32 -1.87 112.91 115.35 2nuu h THR 329 Ca 0.00 -2.21 0.00 0.00 0.77 0.00 0.00 66.41 64.97 2nuu h THR 329 Cb 0.12 2.18 0.00 0.00 -1.74 0.00 0.00 68.15 68.71 2nuu h THR 329 CO 0.00 0.66 0.00 0.61 0.37 0.00 0.00 175.52 177.16 2nuu n GLY 330 N 0.64 -1.05 0.27 2.16 0.00 -0.06 -2.57 105.19 104.58 2nuu n GLY 330 Ca -0.05 -0.01 -0.08 0.00 0.00 0.00 0.00 46.02 45.89 2nuu n GLY 330 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2nuu n ILE 331 N -1.70 1.45 1.14 -0.61 5.41 -1.09 -4.47 119.36 119.48 2nuu n ILE 331 Ca 0.03 0.18 0.09 0.00 1.00 0.00 0.00 62.75 64.05 2nuu n ILE 331 Cb 0.18 -2.20 0.54 0.00 -0.71 0.00 0.00 39.64 37.44 2nuu n ILE 331 CO 0.00 0.00 0.00 0.49 0.00 0.00 0.00 176.55 177.04 2nuu n PHE 332 N -4.28 0.00 0.20 1.39 3.72 -0.72 -2.60 117.46 115.16 2nuu n PHE 332 Ca -0.12 0.00 0.09 0.00 -0.05 0.00 0.00 57.45 57.36 2nuu n PHE 332 Cb 0.43 -0.01 0.19 0.00 -0.94 0.00 0.00 39.48 39.15 2nuu n PHE 332 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2nuu h ALA 333 N 3.14 0.88 -2.17 4.37 0.00 -1.71 -3.26 119.26 120.51 2nuu h ALA 333 Ca 0.00 -0.19 -0.59 0.00 0.00 0.00 0.00 54.91 54.13 2nuu h ALA 333 Cb 0.01 -0.03 0.11 0.00 0.00 0.00 0.00 17.79 17.87 2nuu h ALA 333 CO 0.00 0.26 0.26 0.00 0.00 0.00 0.00 179.25 179.77 2nuu n ALA 334 N -2.16 0.29 -0.23 0.00 0.00 -1.07 0.93 120.51 118.27 2nuu n ALA 334 Ca 0.03 0.38 -0.01 0.00 0.00 0.00 0.00 53.44 53.84 2nuu n ALA 334 Cb 0.58 -2.10 0.21 0.00 0.00 0.00 0.00 19.45 18.14 2nuu n ALA 334 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2nuu h SER 335 N 2.17 0.90 0.56 0.00 0.02 -1.89 0.63 113.55 115.93 2nuu h SER 335 Ca -0.42 -0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.49 2nuu h SER 335 Cb 1.32 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 63.63 2nuu h SER 335 CO 0.61 0.69 0.00 0.77 -1.14 0.00 0.00 176.83 177.76 2nuu h SER 336 N 1.04 0.00 -0.35 3.07 4.64 -1.90 -2.18 113.55 117.87 2nuu h SER 336 Ca 0.27 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.56 2nuu h SER 336 Cb -0.05 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.02 2nuu h SER 336 CO -0.05 0.00 0.02 0.18 -0.87 0.00 0.00 176.83 176.10 2nuu n LEU 337 N -2.60 4.33 -0.00 5.97 4.77 -0.94 -4.92 117.00 123.60 2nuu n LEU 337 Ca 0.00 -3.10 -0.00 0.00 -0.03 0.00 0.00 56.01 52.88 2nuu n LEU 337 Cb 0.19 -0.59 -0.00 0.00 -2.33 0.00 0.00 43.42 40.69 2nuu n LEU 337 CO 0.20 0.73 -0.00 0.61 -1.33 0.00 0.00 177.39 177.60 2nuu n GLY 338 N -0.41 0.48 3.96 -0.72 0.00 -0.82 -4.64 105.19 103.04 2nuu n GLY 338 Ca 0.25 -0.18 -0.27 0.00 0.00 0.00 0.00 46.02 45.82 2nuu n GLY 338 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2nuu s GLY 339 N -2.17 1.76 0.03 -0.02 0.00 0.17 -3.16 107.32 103.93 2nuu s GLY 339 Ca 0.00 -1.38 0.16 0.00 0.00 0.00 0.00 44.72 43.51 2nuu s GLY 339 CO 0.00 -0.75 1.52 1.55 0.00 0.00 0.00 173.10 175.42 2nuu n VAL 340 N -3.24 0.93 0.00 1.40 3.14 0.69 -4.06 118.33 117.19 2nuu n VAL 340 Ca 0.14 0.23 0.00 0.00 -2.96 0.00 0.00 64.34 61.75 2nuu n VAL 340 Cb 0.60 -0.99 0.00 0.00 -1.06 0.00 0.00 33.84 32.39 2nuu n VAL 340 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2nuu n GLY 341 N 0.08 -1.04 3.86 7.55 0.00 0.27 -4.84 105.19 111.07 2nuu n GLY 341 Ca 0.04 -1.43 -0.30 0.00 0.00 0.00 0.00 46.02 44.32 2nuu n GLY 341 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2nuu s PHE 342 N -3.03 1.53 0.45 1.61 0.08 -1.26 -4.86 117.98 112.50 2nuu s PHE 342 Ca 0.00 0.40 -0.23 0.00 0.12 0.00 0.00 56.93 57.22 2nuu s PHE 342 Cb 0.00 -3.93 -0.08 0.00 -0.57 0.00 0.00 43.02 38.45 2nuu s PHE 342 CO 0.00 -2.80 1.15 0.00 -0.10 0.00 0.00 175.22 173.47 2nuu s ALA 343 N -3.68 3.00 0.14 5.36 0.00 -1.26 -4.91 121.76 120.41 2nuu s ALA 343 Ca 0.72 0.90 -0.33 0.00 0.00 0.00 0.00 51.96 53.25 2nuu s ALA 343 Cb -0.06 -3.37 -0.18 0.00 0.00 0.00 0.00 23.12 19.52 2nuu s ALA 343 CO 0.53 -0.58 0.85 -1.91 0.00 0.00 0.00 175.76 174.65 2nuu n GLU 344 N -0.39 0.31 -0.92 0.00 2.13 -1.26 -1.49 120.64 119.01 2nuu n GLU 344 Ca 0.07 0.11 0.00 0.00 0.66 0.00 0.00 57.16 58.00 2nuu n GLU 344 Cb 0.48 -1.39 0.00 0.00 0.27 0.00 0.00 31.44 30.80 2nuu n GLU 344 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2nuu n GLY 345 N 1.80 0.67 3.69 8.31 0.00 -1.26 -5.02 105.19 113.39 2nuu n GLY 345 Ca 0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 2nuu n GLY 345 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2nuu s VAL 346 N -2.90 4.66 0.42 1.61 1.01 -0.56 -5.11 120.40 119.54 2nuu s VAL 346 Ca 0.00 -0.10 0.08 0.00 0.00 0.00 0.00 61.98 61.96 2nuu s VAL 346 Cb 0.00 -3.02 -0.02 0.00 0.00 0.00 0.00 36.38 33.34 2nuu s VAL 346 CO 0.00 0.56 0.38 0.42 0.00 0.00 0.00 175.10 176.46 2nuu s THR 347 N -0.45 2.63 0.11 3.92 -4.23 -1.26 -4.76 115.64 111.60 2nuu s THR 347 Ca 0.09 -1.34 -0.22 0.00 -1.18 0.00 0.00 61.69 59.04 2nuu s THR 347 Cb -0.12 -2.97 -0.08 0.00 1.34 0.00 0.00 72.50 70.68 2nuu s THR 347 CO 0.02 0.00 1.70 -0.03 -0.54 0.00 0.00 174.62 175.77 2nuu h MET 348 N 1.01 -0.09 -0.37 3.99 4.05 -1.98 -1.47 114.93 120.08 2nuu h MET 348 Ca -0.41 0.01 0.08 0.00 -0.28 0.00 0.00 59.70 59.09 2nuu h MET 348 Cb 1.27 0.02 -0.08 0.00 -0.80 0.00 0.00 31.60 32.00 2nuu h MET 348 CO 0.57 -0.06 -0.22 0.78 0.23 0.00 0.00 176.91 178.21 2nuu h GLY 349 N -0.09 0.01 0.11 1.39 0.00 -1.96 -1.29 103.07 101.24 2nuu h GLY 349 Ca 0.05 0.28 0.03 0.00 0.00 0.00 0.00 47.33 47.70 2nuu h GLY 349 CO -0.13 -0.20 -0.42 0.84 0.00 0.00 0.00 176.54 176.64 2nuu h HIS 350 N -0.16 -1.19 -0.99 5.60 6.17 -1.88 -2.62 115.15 120.07 2nuu h HIS 350 Ca 0.18 0.04 0.06 0.00 0.71 0.00 0.00 60.37 61.36 2nuu h HIS 350 Cb 0.45 0.53 -0.06 0.00 2.52 0.00 0.00 27.41 30.84 2nuu h HIS 350 CO -0.44 -0.49 0.65 0.37 0.71 0.00 0.00 177.93 178.73 2nuu h GLN 351 N -0.54 1.16 -0.45 5.26 5.75 -0.78 -2.23 115.11 123.28 2nuu h GLN 351 Ca 0.06 -0.07 -0.00 0.00 -0.15 0.00 0.00 58.65 58.48 2nuu h GLN 351 Cb 0.64 -0.26 -0.02 0.00 1.07 0.00 0.00 27.48 28.91 2nuu h GLN 351 CO -0.34 0.77 0.27 -0.07 -2.65 0.00 0.00 178.83 176.80 2nuu h LEU 352 N 1.19 0.53 -0.37 -2.39 3.38 -0.90 -0.41 115.31 116.34 2nuu h LEU 352 Ca 0.42 -0.02 -0.16 0.00 0.09 0.00 0.00 57.88 58.20 2nuu h LEU 352 Cb 0.11 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 2nuu h LEU 352 CO -0.15 0.41 -0.39 -0.07 0.09 0.00 0.00 178.44 178.33 2nuu h LEU 353 N 0.61 0.99 -0.60 1.67 3.38 -1.10 -2.19 115.31 118.07 2nuu h LEU 353 Ca 0.16 -0.47 -0.09 0.00 0.09 0.00 0.00 57.88 57.57 2nuu h LEU 353 Cb -0.02 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.43 2nuu h LEU 353 CO -0.03 1.25 0.00 0.58 0.09 0.00 0.00 178.44 180.33 2nuu h VAL 354 N 0.74 1.27 -0.39 1.22 2.07 -1.14 -0.72 116.25 119.30 2nuu h VAL 354 Ca 0.06 -1.15 -0.01 0.00 0.82 0.00 0.00 66.70 66.43 2nuu h VAL 354 Cb 0.98 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 31.55 2nuu h VAL 354 CO 0.10 0.42 0.22 1.56 0.02 0.00 0.00 177.57 179.88 2nuu h GLN 355 N 0.95 0.53 -0.44 1.57 1.08 -1.04 -1.71 115.11 116.05 2nuu h GLN 355 Ca 0.17 -0.06 -0.09 0.00 -1.45 0.00 0.00 58.65 57.22 2nuu h GLN 355 Cb 0.56 -0.11 -0.02 0.00 -0.05 0.00 0.00 27.48 27.86 2nuu h GLN 355 CO 0.03 0.43 -0.08 -0.07 -0.95 0.00 0.00 178.83 178.19 2nuu h LEU 356 N 0.50 0.76 -0.49 1.46 3.38 -1.22 -2.58 115.31 117.11 2nuu h LEU 356 Ca 0.14 -0.21 -0.03 0.00 0.09 0.00 0.00 57.88 57.86 2nuu h LEU 356 Cb 0.04 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 2nuu h LEU 356 CO -0.02 0.87 0.18 -0.08 0.09 0.00 0.00 178.44 179.48 2nuu h GLU 357 N 0.71 0.75 -0.83 1.13 4.81 -0.87 -1.93 114.58 118.36 2nuu h GLU 357 Ca 0.13 -0.15 -0.04 0.00 -0.13 0.00 0.00 59.36 59.17 2nuu h GLU 357 Cb 0.54 -0.12 -0.04 0.00 0.63 0.00 0.00 28.75 29.77 2nuu h GLU 357 CO 0.03 0.69 0.38 0.77 -0.73 0.00 0.00 179.01 180.15 2nuu h SER 358 N 0.66 1.10 0.02 1.04 0.02 -1.20 -2.13 113.55 113.06 2nuu h SER 358 Ca 0.16 -0.15 -0.00 0.00 -0.84 0.00 0.00 61.79 60.96 2nuu h SER 358 Cb 0.23 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 62.49 2nuu h SER 358 CO -0.01 0.94 -0.01 0.40 -1.14 0.00 0.00 176.83 177.01 2nuu h ILE 359 N 1.19 1.13 -0.76 3.27 2.04 -1.28 -1.78 117.51 121.31 2nuu h ILE 359 Ca 0.28 -0.44 0.01 0.00 1.00 0.00 0.00 64.86 65.71 2nuu h ILE 359 Cb 0.15 1.43 -0.04 0.00 -0.74 0.00 0.00 36.82 37.62 2nuu h ILE 359 CO -0.03 0.11 0.50 0.00 0.00 0.00 0.00 178.15 178.74 2nuu h ALA 360 N 0.77 1.47 -0.17 1.87 0.00 -1.19 -0.50 119.26 121.51 2nuu h ALA 360 Ca -0.00 -0.05 -0.19 0.00 0.00 0.00 0.00 54.91 54.67 2nuu h ALA 360 Cb 0.20 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 2nuu h ALA 360 CO 0.00 0.48 -0.65 0.82 0.00 0.00 0.00 179.25 179.91 2nuu h ILE 361 N 1.02 1.31 0.10 0.00 2.04 -1.35 -2.51 117.51 118.12 2nuu h ILE 361 Ca 0.28 -1.91 -0.00 0.00 1.00 0.00 0.00 64.86 64.23 2nuu h ILE 361 Cb -0.09 1.88 0.00 0.00 -0.74 0.00 0.00 36.82 37.87 2nuu h ILE 361 CO -0.07 0.60 -0.05 0.74 0.00 0.00 0.00 178.15 179.38 2nuu h THR 362 N 0.46 1.03 -0.02 -0.27 2.02 -0.67 0.71 112.91 116.17 2nuu h THR 362 Ca -0.02 -0.48 0.03 0.00 0.77 0.00 0.00 66.41 66.72 2nuu h THR 362 Cb 1.24 1.34 -0.05 0.00 -1.74 0.00 0.00 68.15 68.93 2nuu h THR 362 CO 0.13 0.12 -0.36 0.40 0.37 0.00 0.00 175.52 176.17 2nuu h ILE 363 N -0.35 0.23 0.06 3.11 2.04 -1.14 -0.90 117.51 120.57 2nuu h ILE 363 Ca -0.01 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.84 2nuu h ILE 363 Cb 0.29 0.23 0.00 0.00 -0.74 0.00 0.00 36.82 36.61 2nuu h ILE 363 CO 0.02 0.00 -0.03 0.58 0.00 0.00 0.00 178.15 178.72 2nuu h VAL 364 N -0.50 0.97 0.67 1.67 2.07 -1.44 0.08 116.25 119.77 2nuu h VAL 364 Ca 0.06 -0.08 -0.03 0.00 0.82 0.00 0.00 66.70 67.47 2nuu h VAL 364 Cb 0.60 1.02 -0.00 0.00 -1.52 0.00 0.00 31.29 31.39 2nuu h VAL 364 CO -0.30 0.02 -0.43 -0.25 0.02 0.00 0.00 177.57 176.63 2nuu h TRP 365 N -0.12 -1.14 -0.95 1.57 2.91 -0.73 -1.43 115.95 116.06 2nuu h TRP 365 Ca -0.01 -0.01 0.07 0.00 1.13 0.00 0.00 58.89 60.08 2nuu h TRP 365 Cb 0.10 0.41 -0.06 0.00 -0.51 0.00 0.00 29.16 29.09 2nuu h TRP 365 CO -0.06 -0.63 0.62 1.03 -1.03 0.00 0.00 178.44 178.36 2nuu h SER 366 N -1.03 0.95 -0.18 2.65 0.87 -1.22 -2.08 113.55 113.51 2nuu h SER 366 Ca -0.09 0.01 0.01 0.00 -1.23 0.00 0.00 61.79 60.49 2nuu h SER 366 Cb 0.83 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.59 2nuu h SER 366 CO 0.08 0.59 0.09 1.23 -0.53 0.00 0.00 176.83 178.29 2nuu h GLY 367 N 1.07 0.24 0.65 5.77 0.00 -0.77 0.16 103.07 110.19 2nuu h GLY 367 Ca 0.42 -0.06 -0.00 0.00 0.00 0.00 0.00 47.33 47.68 2nuu h GLY 367 CO -0.17 0.05 -0.03 -2.08 0.00 0.00 0.00 176.54 174.31 2nuu h VAL 368 N 0.19 1.17 -0.56 4.60 2.07 -0.96 -2.54 116.25 120.21 2nuu h VAL 368 Ca 0.07 -0.78 0.07 0.00 0.82 0.00 0.00 66.70 66.89 2nuu h VAL 368 Cb 0.02 1.67 -0.06 0.00 -1.52 0.00 0.00 31.29 31.40 2nuu h VAL 368 CO -0.06 0.19 0.24 0.58 0.02 0.00 0.00 177.57 178.55 2nuu h VAL 369 N -0.43 0.85 -0.57 2.57 2.07 -1.35 -1.75 116.25 117.65 2nuu h VAL 369 Ca -0.01 -0.15 0.10 0.00 0.82 0.00 0.00 66.70 67.46 2nuu h VAL 369 Cb 0.38 0.36 -0.08 0.00 -1.52 0.00 0.00 31.29 30.44 2nuu h VAL 369 CO 0.01 0.08 0.15 0.00 0.02 0.00 0.00 177.57 177.84 2nuu h ALA 370 N 1.36 0.69 -0.96 1.67 0.00 -0.61 0.16 119.26 121.56 2nuu h ALA 370 Ca 0.27 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.29 2nuu h ALA 370 Cb 0.27 0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.14 2nuu h ALA 370 CO -0.24 -0.27 0.62 0.35 0.00 0.00 0.00 179.25 179.71 2nuu h PHE 371 N 0.30 1.23 -0.52 0.00 3.57 -0.91 0.14 116.94 120.76 2nuu h PHE 371 Ca 0.29 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.73 2nuu h PHE 371 Cb 0.39 -0.41 -0.02 0.00 2.79 0.00 0.00 35.95 38.70 2nuu h PHE 371 CO -0.21 0.79 0.02 0.82 -2.23 0.00 0.00 178.31 177.51 2nuu h ILE 372 N 1.32 1.26 -0.32 1.41 2.04 -0.39 -2.32 117.51 120.51 2nuu h ILE 372 Ca 0.35 -1.05 -0.03 0.00 1.00 0.00 0.00 64.86 65.13 2nuu h ILE 372 Cb -0.12 0.92 -0.01 0.00 -0.74 0.00 0.00 36.82 36.87 2nuu h ILE 372 CO -0.07 0.37 0.09 1.23 0.00 0.00 0.00 178.15 179.77 2nuu h GLY 373 N 0.77 0.53 1.07 5.37 0.00 -0.27 -1.63 103.07 108.91 2nuu h GLY 373 Ca 0.15 -0.32 -0.10 0.00 0.00 0.00 0.00 47.33 47.05 2nuu h GLY 373 CO 0.02 0.30 -0.07 -0.97 0.00 0.00 0.00 176.54 175.83 2nuu h TYR 374 N 0.35 1.10 -0.24 5.60 0.05 -0.98 -2.19 116.97 120.67 2nuu h TYR 374 Ca 0.10 -0.22 -0.13 0.00 0.05 0.00 0.00 58.73 58.54 2nuu h TYR 374 Cb 0.27 -0.28 -0.01 0.00 1.01 0.00 0.00 36.73 37.72 2nuu h TYR 374 CO 0.01 1.02 -0.39 0.87 -1.05 0.00 0.00 178.16 178.62 2nuu h LYS 375 N 0.87 0.56 -0.44 4.88 1.79 -1.40 0.23 116.57 123.07 2nuu h LYS 375 Ca 0.14 -0.28 -0.03 0.00 -2.18 0.00 0.00 60.65 58.31 2nuu h LYS 375 Cb 0.62 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.25 2nuu h LYS 375 CO 0.04 0.86 0.17 1.25 -1.08 0.00 0.00 179.45 180.69 2nuu h LEU 376 N 0.47 0.61 -0.79 2.94 5.85 -1.22 -0.36 115.31 122.81 2nuu h LEU 376 Ca 0.04 -0.17 -0.10 0.00 0.84 0.00 0.00 57.88 58.49 2nuu h LEU 376 Cb 0.88 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.74 2nuu h LEU 376 CO 0.08 0.61 -0.17 0.00 -0.34 0.00 0.00 178.44 178.62 2nuu h ALA 377 N 1.02 0.97 -0.02 1.25 0.00 -1.14 -2.03 119.26 119.29 2nuu h ALA 377 Ca 0.14 -0.34 -0.11 0.00 0.00 0.00 0.00 54.91 54.60 2nuu h ALA 377 Cb 0.20 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2nuu h ALA 377 CO -0.01 0.61 -0.50 0.22 0.00 0.00 0.00 179.25 179.56 2nuu h ASP 378 N 0.65 0.07 0.64 0.00 -0.00 -0.14 -0.26 116.42 117.39 2nuu h ASP 378 Ca 0.10 -0.03 -0.27 0.00 -0.00 0.00 0.00 57.03 56.83 2nuu h ASP 378 Cb 0.65 -0.02 0.00 0.00 -0.00 0.00 0.00 39.33 39.97 2nuu h ASP 378 CO 0.05 0.56 -1.24 -0.07 -0.00 0.00 0.00 179.24 178.53 2nuu h LEU 379 N 0.05 0.40 0.00 2.28 3.38 -0.91 -3.17 115.31 117.34 2nuu h LEU 379 Ca -0.00 -0.44 -0.00 0.00 0.09 0.00 0.00 57.88 57.53 2nuu h LEU 379 Cb 0.90 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.52 2nuu h LEU 379 CO 0.07 1.34 -0.19 0.71 0.09 0.00 0.00 178.44 180.46 2nuu h THR 380 N 0.07 0.03 0.00 0.22 1.35 -1.35 -3.44 112.91 109.79 2nuu h THR 380 Ca -0.13 -1.03 0.00 0.00 -0.55 0.00 0.00 66.41 64.70 2nuu h THR 380 Cb 1.97 0.07 0.00 0.00 -1.73 0.00 0.00 68.15 68.45 2nuu h THR 380 CO 0.20 0.01 -0.77 1.33 -0.25 0.00 0.00 175.52 176.04 2nuu n VAL 381 N -4.72 0.00 0.00 6.82 0.24 -0.88 -5.11 118.33 114.69 2nuu n VAL 381 Ca -0.03 -0.25 0.00 0.00 -2.04 0.00 0.00 64.34 62.02 2nuu n VAL 381 Cb 0.10 0.69 0.00 0.00 -1.47 0.00 0.00 33.84 33.16 2nuu n VAL 381 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2nuu n GLY 382 N 1.64 -0.21 0.07 7.63 0.00 -0.16 -4.99 105.19 109.18 2nuu n GLY 382 Ca 0.00 -1.28 -0.12 0.00 0.00 0.00 0.00 46.02 44.62 2nuu n GLY 382 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2nuu h LEU 383 N 0.00 -0.03 -9.60 0.99 3.38 -1.79 -3.43 115.31 104.83 2nuu h LEU 383 Ca 0.00 -0.70 -0.61 0.00 0.09 0.00 0.00 57.88 56.66 2nuu h LEU 383 Cb 0.00 0.01 -0.06 0.00 0.09 0.00 0.00 40.66 40.70 2nuu h LEU 383 CO 0.00 0.73 -0.24 -0.60 0.09 0.00 0.00 178.44 178.43 2nuu s ARG 384 N -2.95 3.95 0.33 1.13 3.52 -1.26 -0.86 118.95 122.80 2nuu s ARG 384 Ca -0.16 0.33 -0.27 0.00 -0.13 0.00 0.00 55.73 55.50 2nuu s ARG 384 Cb -0.01 -3.26 -0.09 0.00 -1.56 0.00 0.00 34.95 30.03 2nuu s ARG 384 CO 0.62 0.60 1.05 0.54 -0.81 0.00 0.00 175.30 177.29 2nuu s VAL 385 N -0.75 3.71 0.50 7.11 0.11 -0.64 -4.83 120.40 125.62 2nuu s VAL 385 Ca 0.22 1.53 -0.23 0.00 -2.93 0.00 0.00 61.98 60.57 2nuu s VAL 385 Cb -0.16 -3.90 -0.06 0.00 -1.53 0.00 0.00 36.38 30.73 2nuu s VAL 385 CO 0.11 0.22 1.40 -2.16 -3.33 0.00 0.00 175.10 171.34 2nuu s PRO 386 N -1.88 3.39 0.30 1.54 0.04 -1.26 -4.78 135.00 132.35 2nuu s PRO 386 Ca 0.50 2.34 0.00 0.00 0.04 0.00 0.00 61.00 63.87 2nuu s PRO 386 Cb -0.26 -2.45 0.69 0.00 0.04 0.00 0.00 34.50 32.53 2nuu s PRO 386 CO 0.33 -1.03 1.58 0.93 0.04 0.00 0.00 177.00 178.86 2nuu h GLU 387 N 1.86 0.03 -0.82 4.56 5.08 -1.99 -1.05 114.58 122.25 2nuu h GLU 387 Ca -0.51 -0.00 0.03 0.00 -1.00 0.00 0.00 59.36 57.87 2nuu h GLU 387 Cb 1.28 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 30.48 2nuu h GLU 387 CO 0.59 0.02 0.53 0.93 -1.00 0.00 0.00 179.01 180.08 2nuu h GLU 388 N 0.03 1.01 0.00 2.33 4.39 -2.00 -1.38 114.58 118.97 2nuu h GLU 388 Ca 0.56 -0.06 -0.06 0.00 0.34 0.00 0.00 59.36 60.15 2nuu h GLU 388 Cb 1.13 -0.23 -0.01 0.00 -0.10 0.00 0.00 28.75 29.54 2nuu h GLU 388 CO -0.87 0.67 -0.27 1.96 -1.16 0.00 0.00 179.01 179.34 2nuu h GLN 389 N 1.05 0.00 -0.16 2.33 4.20 -1.56 -2.72 115.11 118.25 2nuu h GLN 389 Ca 0.32 0.00 -0.21 0.00 0.06 0.00 0.00 58.65 58.82 2nuu h GLN 389 Cb -0.03 0.00 0.01 0.00 0.30 0.00 0.00 27.48 27.76 2nuu h GLN 389 CO -0.10 0.27 -0.72 1.49 -0.67 0.00 0.00 178.83 179.10 2nuu h GLU 390 N 0.00 0.77 -0.12 1.46 4.81 -0.93 -2.54 114.58 118.03 2nuu h GLU 390 Ca -0.00 -0.61 -0.12 0.00 -0.13 0.00 0.00 59.36 58.49 2nuu h GLU 390 Cb 0.67 0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.16 2nuu h GLU 390 CO 0.04 1.22 -0.46 0.00 -0.73 0.00 0.00 179.01 179.08 2nuu h ARG 391 N 0.49 0.29 0.00 1.92 3.08 -1.21 -3.00 114.38 115.95 2nuu h ARG 391 Ca -0.05 -0.15 -0.03 0.00 0.07 0.00 0.00 59.98 59.82 2nuu h ARG 391 Cb 1.35 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 31.40 2nuu h ARG 391 CO 0.15 0.70 -0.16 0.93 -1.07 0.00 0.00 179.97 180.51 2nuu h GLU 392 N 0.24 0.00 0.00 0.04 5.08 -1.53 -3.50 114.58 114.91 2nuu h GLU 392 Ca 0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 2nuu h GLU 392 Cb 0.90 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.15 2nuu h GLU 392 CO 0.07 0.12 0.00 0.41 -1.00 0.00 0.00 179.01 178.61 2nuu n GLY 393 N 1.13 2.67 0.13 -3.84 0.00 -0.96 -4.83 105.19 99.49 2nuu n GLY 393 Ca 0.03 -1.66 0.01 0.00 0.00 0.00 0.00 46.02 44.41 2nuu n GLY 393 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2nuu h LEU 394 N 0.00 0.00 -0.06 0.99 3.38 -1.67 -3.24 115.31 114.70 2nuu h LEU 394 Ca 0.00 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.98 2nuu h LEU 394 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2nuu h LEU 394 CO 0.00 0.57 0.01 0.44 0.09 0.00 0.00 178.44 179.55 2nuu h ASP 395 N 0.00 -0.01 0.48 -0.43 3.32 -1.78 0.17 116.42 118.17 2nuu h ASP 395 Ca -0.01 0.01 -0.23 0.00 0.02 0.00 0.00 57.03 56.83 2nuu h ASP 395 Cb 1.43 0.02 -0.00 0.00 0.22 0.00 0.00 39.33 41.00 2nuu h ASP 395 CO 0.07 0.00 -0.99 -0.37 -1.72 0.00 0.00 179.24 176.24 2nuu h VAL 396 N 0.03 1.45 -0.08 -1.35 -1.51 -1.69 -1.23 116.25 111.86 2nuu h VAL 396 Ca 0.03 -2.64 -0.17 0.00 -1.23 0.00 0.00 66.70 62.69 2nuu h VAL 396 Cb 0.03 2.55 0.01 0.00 -2.13 0.00 0.00 31.29 31.75 2nuu h VAL 396 CO -0.04 0.78 -0.63 0.78 -1.23 0.00 0.00 177.57 177.23 2nuu h ASN 397 N 0.16 0.69 0.03 4.19 2.35 -1.56 -2.72 115.58 118.72 2nuu h ASN 397 Ca -0.08 -0.67 -0.24 0.00 -0.55 0.00 0.00 56.30 54.75 2nuu h ASN 397 Cb 1.64 -0.21 -0.05 0.00 0.05 0.00 0.00 38.32 39.76 2nuu h ASN 397 CO 0.16 1.26 -2.23 -1.20 -1.65 0.00 0.00 177.43 173.78 2nuu n SER 398 N -4.14 0.04 0.00 5.81 7.64 0.61 -4.66 113.62 118.91 2nuu n SER 398 Ca -0.09 0.02 0.00 0.00 1.01 0.00 0.00 58.87 59.81 2nuu n SER 398 Cb 0.67 1.29 0.00 0.00 -1.01 0.00 0.00 64.21 65.16 2nuu n SER 398 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 2nuu n HIS 399 N -2.60 0.00 -4.00 1.43 8.25 -0.72 -5.03 115.22 112.55 2nuu n HIS 399 Ca -0.23 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 56.92 2nuu n HIS 399 Cb 0.96 0.00 0.01 0.00 1.12 0.00 0.00 29.99 32.07 2nuu n HIS 399 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2nuu n GLY 400 N 0.07 -0.43 3.13 -1.41 0.00 -0.55 -4.93 105.19 101.07 2nuu n GLY 400 Ca 0.00 0.17 -0.12 0.00 0.00 0.00 0.00 46.02 46.07 2nuu n GLY 400 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2nuu s GLU 401 N -6.65 0.45 -0.12 1.61 2.02 -1.01 -4.95 118.70 110.06 2nuu s GLU 401 Ca 0.56 -0.16 -0.01 0.00 0.02 0.00 0.00 54.97 55.38 2nuu s GLU 401 Cb -0.29 0.20 -0.02 0.00 0.10 0.00 0.00 34.13 34.11 2nuu s GLU 401 CO 0.87 -0.10 -0.09 1.21 0.02 0.00 0.00 175.26 177.16 2nuu s ASN 402 N -0.95 4.42 0.06 -0.19 2.47 -1.26 -3.28 114.94 116.21 2nuu s ASN 402 Ca -0.10 -0.18 -0.20 0.00 0.42 0.00 0.00 52.86 52.80 2nuu s ASN 402 Cb -0.05 -1.50 -0.11 0.00 -1.45 0.00 0.00 41.25 38.14 2nuu s ASN 402 CO 0.02 0.23 1.45 0.00 -3.72 0.00 0.00 177.10 175.08 2nuu h ALA 403 N 6.24 0.27 -3.26 1.71 0.00 -1.98 -3.43 119.26 118.82 2nuu h ALA 403 Ca -0.35 -0.25 -0.67 0.00 0.00 0.00 0.00 54.91 53.65 2nuu h ALA 403 Cb 1.19 -0.07 -0.33 0.00 0.00 0.00 0.00 17.79 18.58 2nuu h ALA 403 CO 0.57 0.04 -0.79 0.71 0.00 0.00 0.00 179.25 179.78 2nuu s TYR 404 N -4.76 2.99 0.35 0.00 2.02 -1.26 -5.11 117.35 111.58 2nuu s TYR 404 Ca -0.14 -1.63 0.07 0.00 -0.37 0.00 0.00 57.07 55.00 2nuu s TYR 404 Cb 0.06 -2.00 -0.07 0.00 -0.40 0.00 0.00 41.96 39.56 2nuu s TYR 404 CO 0.74 -0.76 -0.02 -0.80 -1.57 0.00 0.00 175.55 173.14 2nuu s ASN 405 N 1.30 3.25 0.00 2.29 0.01 -1.26 -5.23 114.94 115.30 2nuu s ASN 405 Ca 0.01 -1.29 0.00 0.00 -0.71 0.00 0.00 52.86 50.87 2nuu s ASN 405 Cb -0.16 -0.27 0.00 0.00 0.41 0.00 0.00 41.25 41.24 2nuu s ASN 405 CO -0.07 -0.40 0.00 0.00 -1.51 0.00 0.00 177.10 175.12