#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nuu n HIS -2 N 0.00 0.00 0.05 -1.40 -0.00 -1.26 -4.56 115.22 108.04 2nuu n HIS -2 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 2nuu n HIS -2 Cb 0.00 -0.72 0.00 0.00 -0.00 0.00 0.00 29.99 29.27 2nuu n HIS -2 CO 0.00 0.00 0.00 -2.39 -0.00 0.00 0.00 176.34 173.95 2nuu n HIS -1 N -1.95 -0.17 1.25 4.41 -0.00 -1.26 -4.78 115.22 112.72 2nuu n HIS -1 Ca 0.00 0.03 0.12 0.00 -0.00 0.00 0.00 57.72 57.87 2nuu n HIS -1 Cb 0.00 0.04 0.40 0.00 -0.00 0.00 0.00 29.99 30.44 2nuu n HIS -1 CO 0.00 0.00 0.00 -2.39 -0.00 0.00 0.00 176.34 173.95 2nuu n HIS 0 N -3.42 0.15 -2.04 -1.40 1.44 -1.26 -4.90 115.22 103.79 2nuu n HIS 0 Ca 0.00 -0.08 -0.37 0.00 -2.01 0.00 0.00 57.72 55.26 2nuu n HIS 0 Cb 0.07 0.00 0.02 0.00 0.12 0.00 0.00 29.99 30.20 2nuu n HIS 0 CO 0.00 0.00 0.00 -1.58 -2.81 0.00 0.00 176.34 171.95 2nuu s HIS 1 N -1.85 2.56 -0.08 -1.40 5.04 -1.26 -5.03 115.29 113.27 2nuu s HIS 1 Ca 0.34 1.48 -0.09 0.00 -1.54 0.00 0.00 55.06 55.25 2nuu s HIS 1 Cb 0.19 -3.54 0.02 0.00 0.04 0.00 0.00 32.58 29.29 2nuu s HIS 1 CO 0.29 -2.14 0.24 -3.38 -2.34 0.00 0.00 174.74 167.42 2nuu s HIS 2 N -1.48 -0.24 0.28 3.88 -3.43 -1.26 -4.95 115.29 108.09 2nuu s HIS 2 Ca 0.69 0.57 -0.29 0.00 -0.80 0.00 0.00 55.06 55.23 2nuu s HIS 2 Cb -0.33 0.08 -0.10 0.00 -1.43 0.00 0.00 32.58 30.81 2nuu s HIS 2 CO 0.39 -0.16 1.21 0.00 -2.00 0.00 0.00 174.74 174.18 2nuu s ALA 3 N -0.10 3.46 0.04 -1.38 0.00 -1.26 -5.00 121.76 117.51 2nuu s ALA 3 Ca -0.02 1.07 -0.20 0.00 0.00 0.00 0.00 51.96 52.81 2nuu s ALA 3 Cb -0.02 -3.41 -0.06 0.00 0.00 0.00 0.00 23.12 19.62 2nuu s ALA 3 CO 0.01 -0.41 0.57 0.54 0.00 0.00 0.00 175.76 176.47 2nuu s VAL 4 N -0.88 4.82 0.19 0.00 0.11 -1.26 -4.69 120.40 118.68 2nuu s VAL 4 Ca 0.48 1.22 -0.30 0.00 -2.93 0.00 0.00 61.98 60.45 2nuu s VAL 4 Cb -0.36 -3.91 -0.08 0.00 -1.53 0.00 0.00 36.38 30.51 2nuu s VAL 4 CO 0.45 0.50 1.21 0.00 -3.33 0.00 0.00 175.10 173.93 2nuu s ALA 5 N -0.71 3.45 -0.33 1.54 0.00 -1.26 -4.82 121.76 119.63 2nuu s ALA 5 Ca 0.30 0.98 -0.16 0.00 0.00 0.00 0.00 51.96 53.07 2nuu s ALA 5 Cb -0.19 -3.42 -0.01 0.00 0.00 0.00 0.00 23.12 19.49 2nuu s ALA 5 CO 0.18 -0.40 0.42 0.34 0.00 0.00 0.00 175.76 176.30 2nuu s ASP 6 N 0.14 6.24 0.40 0.00 3.68 0.54 -4.96 116.67 122.71 2nuu s ASP 6 Ca 0.53 -0.05 0.15 0.00 2.13 0.00 0.00 52.55 55.32 2nuu s ASP 6 Cb -0.33 -2.22 1.02 0.00 -1.45 0.00 0.00 42.92 39.93 2nuu s ASP 6 CO 0.37 -0.35 1.85 0.11 0.13 0.00 0.00 175.17 177.28 2nuu h LYS 7 N 8.40 0.46 -0.59 4.34 1.57 -1.95 0.15 116.57 128.94 2nuu h LYS 7 Ca -0.29 -0.03 -0.10 0.00 -1.87 0.00 0.00 60.65 58.35 2nuu h LYS 7 Cb 1.14 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 33.33 2nuu h LYS 7 CO 0.71 0.30 -0.03 0.00 -0.57 0.00 0.00 179.45 179.86 2nuu h ALA 8 N 1.61 0.82 -0.29 3.86 0.00 -1.95 -0.65 119.26 122.67 2nuu h ALA 8 Ca 0.47 -0.33 -0.17 0.00 0.00 0.00 0.00 54.91 54.89 2nuu h ALA 8 Cb 1.08 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.66 2nuu h ALA 8 CO -0.20 0.67 -0.47 -0.44 0.00 0.00 0.00 179.25 178.82 2nuu h ASP 9 N 0.97 0.91 -0.08 0.00 3.32 -1.18 -0.89 116.42 119.46 2nuu h ASP 9 Ca 0.16 -0.52 0.03 0.00 0.02 0.00 0.00 57.03 56.73 2nuu h ASP 9 Cb 0.60 -0.26 -0.04 0.00 0.22 0.00 0.00 39.33 39.85 2nuu h ASP 9 CO 0.04 1.26 -0.13 0.78 -1.72 0.00 0.00 179.24 179.47 2nuu h ASN 10 N 0.60 -0.38 0.31 6.45 2.35 -0.65 0.16 115.58 124.41 2nuu h ASN 10 Ca 0.02 0.07 0.00 0.00 -0.55 0.00 0.00 56.30 55.84 2nuu h ASN 10 Cb 1.07 0.18 -0.03 0.00 0.05 0.00 0.00 38.32 39.60 2nuu h ASN 10 CO 0.11 -0.17 -0.37 0.00 -1.65 0.00 0.00 177.43 175.35 2nuu h ALA 11 N 0.87 -0.77 -0.24 -0.83 0.00 -1.06 0.00 119.26 117.23 2nuu h ALA 11 Ca 0.07 -0.11 0.06 0.00 0.00 0.00 0.00 54.91 54.93 2nuu h ALA 11 Cb 0.27 0.56 -0.06 0.00 0.00 0.00 0.00 17.79 18.56 2nuu h ALA 11 CO -0.19 -0.97 -0.12 0.35 0.00 0.00 0.00 179.25 178.31 2nuu h PHE 12 N -0.73 -0.30 -0.31 0.00 3.57 -0.96 -1.14 116.94 117.07 2nuu h PHE 12 Ca -0.01 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.49 2nuu h PHE 12 Cb 0.67 0.17 -0.02 0.00 2.79 0.00 0.00 35.95 39.57 2nuu h PHE 12 CO -0.24 -0.19 0.07 0.52 -2.23 0.00 0.00 178.31 176.25 2nuu h MET 13 N -0.10 0.45 -0.09 1.11 2.86 -0.44 0.68 114.93 119.41 2nuu h MET 13 Ca 0.13 -0.07 -0.21 0.00 -2.06 0.00 0.00 59.70 57.50 2nuu h MET 13 Cb 0.29 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 31.88 2nuu h MET 13 CO -0.31 0.42 -0.79 0.52 1.06 0.00 0.00 176.91 177.81 2nuu h MET 14 N 0.45 0.55 -0.44 1.72 2.86 -0.47 -0.47 114.93 119.13 2nuu h MET 14 Ca 0.11 -0.47 -0.12 0.00 -2.06 0.00 0.00 59.70 57.15 2nuu h MET 14 Cb 0.18 0.11 -0.01 0.00 0.06 0.00 0.00 31.60 31.93 2nuu h MET 14 CO -0.00 1.10 -0.20 0.82 1.06 0.00 0.00 176.91 179.69 2nuu h ILE 15 N 0.36 1.27 -0.71 -1.22 1.08 -0.75 -1.56 117.51 115.99 2nuu h ILE 15 Ca -0.05 -1.35 -0.04 0.00 -0.39 0.00 0.00 64.86 63.03 2nuu h ILE 15 Cb 1.40 1.21 -0.03 0.00 -3.07 0.00 0.00 36.82 36.33 2nuu h ILE 15 CO 0.15 0.46 0.27 0.00 -0.69 0.00 0.00 178.15 178.33 2nuu h THR 17 N 1.03 1.23 -0.46 0.00 2.02 -0.83 -0.99 112.91 114.91 2nuu h THR 17 Ca 0.24 -0.66 -0.04 0.00 0.77 0.00 0.00 66.41 66.72 2nuu h THR 17 Cb 0.22 0.45 -0.02 0.00 -1.74 0.00 0.00 68.15 67.06 2nuu h THR 17 CO -0.02 0.27 0.13 0.00 0.37 0.00 0.00 175.52 176.27 2nuu h ALA 18 N 1.13 1.37 -0.23 6.16 0.00 -0.53 -1.66 119.26 125.51 2nuu h ALA 18 Ca 0.22 -0.16 -0.15 0.00 0.00 0.00 0.00 54.91 54.82 2nuu h ALA 18 Cb 0.14 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2nuu h ALA 18 CO -0.03 0.46 -0.49 -0.07 0.00 0.00 0.00 179.25 179.12 2nuu h LEU 19 N 0.66 0.67 -0.54 0.00 3.38 -0.43 -1.56 115.31 117.50 2nuu h LEU 19 Ca 0.15 -0.33 -0.15 0.00 0.09 0.00 0.00 57.88 57.64 2nuu h LEU 19 Cb 0.22 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 2nuu h LEU 19 CO -0.01 1.04 -0.49 0.58 0.09 0.00 0.00 178.44 179.66 2nuu h VAL 20 N 0.48 1.31 -0.59 1.22 2.07 -0.84 -2.57 116.25 117.32 2nuu h VAL 20 Ca 0.02 -1.70 -0.04 0.00 0.82 0.00 0.00 66.70 65.81 2nuu h VAL 20 Cb 1.03 1.65 -0.03 0.00 -1.52 0.00 0.00 31.29 32.42 2nuu h VAL 20 CO 0.10 0.54 0.22 -0.07 0.02 0.00 0.00 177.57 178.37 2nuu h LEU 21 N 0.49 0.84 -1.55 2.57 3.38 -1.23 -1.57 115.31 118.23 2nuu h LEU 21 Ca 0.02 -0.19 0.20 0.00 0.09 0.00 0.00 57.88 58.01 2nuu h LEU 21 Cb 1.03 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 41.50 2nuu h LEU 21 CO 0.10 0.80 0.59 0.15 0.09 0.00 0.00 178.44 180.16 2nuu h PHE 22 N 0.83 0.49 -0.19 1.13 3.57 -1.02 0.26 116.94 122.00 2nuu h PHE 22 Ca 0.20 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.68 2nuu h PHE 22 Cb 0.24 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 38.81 2nuu h PHE 22 CO 0.01 0.13 -0.04 0.52 -2.23 0.00 0.00 178.31 176.71 2nuu h MET 23 N 0.37 0.29 0.00 1.11 2.86 -0.89 -2.50 114.93 116.17 2nuu h MET 23 Ca 0.46 -0.05 -0.28 0.00 -2.06 0.00 0.00 59.70 57.77 2nuu h MET 23 Cb 1.19 -0.05 -0.04 0.00 0.06 0.00 0.00 31.60 32.76 2nuu h MET 23 CO -0.16 0.34 -1.54 2.41 1.06 0.00 0.00 176.91 179.02 2nuu n THR 24 N -4.34 1.53 -3.71 2.22 -1.04 -0.26 -0.29 114.28 108.38 2nuu n THR 24 Ca -0.00 -0.10 -0.37 0.00 -2.04 0.00 0.00 64.05 61.53 2nuu n THR 24 Cb 0.21 -2.03 -0.11 0.00 -1.82 0.00 0.00 70.33 66.59 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 -2.40 3.56 -2.01 12.58 -1.09 -0.08 -3.04 121.20 128.71 2nuu s ILE 25 Ca -0.31 -2.05 0.18 0.00 -2.23 0.00 0.00 60.65 56.25 2nuu s ILE 25 Cb 0.08 -3.40 0.28 0.00 -1.58 0.00 0.00 42.46 37.83 2nuu s ILE 25 CO 0.54 -0.73 1.21 -0.81 -1.23 0.00 0.00 174.94 173.92 2nuu n PRO 26 N 4.60 2.00 0.00 2.79 -0.04 -1.17 -4.10 135.00 139.09 2nuu n PRO 26 Ca -0.03 -1.89 0.00 0.00 -0.04 0.00 0.00 63.50 61.54 2nuu n PRO 26 Cb 0.41 -1.39 0.00 0.00 -0.04 0.00 0.00 33.50 32.48 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 1.08 -0.48 0.35 0.55 0.00 -0.95 -1.18 105.19 104.56 2nuu n GLY 27 Ca 0.14 0.10 0.13 0.00 0.00 0.00 0.00 46.02 46.39 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 0.88 -0.62 -0.61 6.09 -0.73 -1.61 117.51 120.92 2nuu h ILE 28 Ca 0.00 -0.10 -0.06 0.00 -1.37 0.00 0.00 64.86 63.33 2nuu h ILE 28 Cb 0.00 0.56 -0.03 0.00 0.47 0.00 0.00 36.82 37.83 2nuu h ILE 28 CO 0.00 0.05 0.15 0.00 -3.07 0.00 0.00 178.15 175.28 2nuu h ALA 29 N 1.74 0.82 0.01 0.18 0.00 -1.45 -0.58 119.26 119.98 2nuu h ALA 29 Ca 0.24 -0.23 -0.25 0.00 0.00 0.00 0.00 54.91 54.67 2nuu h ALA 29 Cb 0.55 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 18.11 2nuu h ALA 29 CO -0.05 0.53 -1.01 -0.07 0.00 0.00 0.00 179.25 178.65 2nuu h LEU 30 N 0.91 0.69 0.26 0.00 3.38 -0.54 0.15 115.31 120.17 2nuu h LEU 30 Ca 0.19 -0.56 0.01 0.00 0.09 0.00 0.00 57.88 57.61 2nuu h LEU 30 Cb 0.36 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 2nuu h LEU 30 CO 0.00 1.37 -0.37 0.15 0.09 0.00 0.00 178.44 179.68 2nuu h PHE 31 N 0.29 -1.02 -0.35 1.13 3.57 -1.13 0.16 116.94 119.60 2nuu h PHE 31 Ca -0.11 0.01 -0.12 0.00 3.53 0.00 0.00 57.97 61.29 2nuu h PHE 31 Cb 1.66 0.41 -0.01 0.00 2.79 0.00 0.00 35.95 40.80 2nuu h PHE 31 CO 0.08 -0.50 -0.25 1.88 -2.23 0.00 0.00 178.31 177.29 2nuu h TYR 32 N -0.70 0.92 -0.94 0.41 0.05 -1.18 -3.13 116.97 112.41 2nuu h TYR 32 Ca -0.00 -0.25 0.07 0.00 0.05 0.00 0.00 58.73 58.59 2nuu h TYR 32 Cb 0.66 -0.20 -0.07 0.00 1.01 0.00 0.00 36.73 38.14 2nuu h TYR 32 CO -0.26 1.01 0.59 0.78 -1.05 0.00 0.00 178.16 179.23 2nuu h GLY 33 N 0.56 1.43 2.00 3.88 0.00 -0.46 -2.39 103.07 108.09 2nuu h GLY 33 Ca 0.07 -0.43 -0.08 0.00 0.00 0.00 0.00 47.33 46.89 2nuu h GLY 33 CO 0.07 0.28 -0.36 -1.33 0.00 0.00 0.00 176.54 175.20 2nuu h GLY 34 N 1.06 0.00 2.00 4.60 0.00 -0.66 -3.21 103.07 106.86 2nuu h GLY 34 Ca 0.41 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.74 2nuu h GLY 34 CO -0.18 0.00 0.00 1.41 0.00 0.00 0.00 176.54 177.77 2nuu h LEU 35 N 0.00 0.00-10.45 3.11 3.38 -1.37 -2.71 115.31 107.26 2nuu h LEU 35 Ca -0.00 0.00 -0.47 0.00 0.09 0.00 0.00 57.88 57.50 2nuu h LEU 35 Cb 0.79 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.55 2nuu h LEU 35 CO 0.05 0.00 -0.23 0.27 0.09 0.00 0.00 178.44 178.62 2nuu s ILE 36 N -3.22 2.55 0.54 1.22 -4.36 -1.16 -3.77 121.20 112.99 2nuu s ILE 36 Ca 0.07 -1.10 -0.19 0.00 -0.26 0.00 0.00 60.65 59.17 2nuu s ILE 36 Cb 0.07 -2.65 -0.06 0.00 1.25 0.00 0.00 42.46 41.08 2nuu s ILE 36 CO 0.63 0.00 1.09 -0.13 0.24 0.00 0.00 174.94 176.77 2nuu s ARG 37 N -4.41 3.46 0.56 0.37 0.52 -1.26 -2.15 118.95 116.03 2nuu s ARG 37 Ca 0.54 1.45 0.32 0.00 -0.52 0.00 0.00 55.73 57.52 2nuu s ARG 37 Cb -0.07 -2.04 1.47 0.00 0.52 0.00 0.00 34.95 34.84 2nuu s ARG 37 CO 0.33 -0.73 1.84 0.78 0.02 0.00 0.00 175.30 177.54 2nuu h GLY 38 N 1.13 0.00 1.41 -3.53 0.00 -1.91 -1.20 103.07 98.96 2nuu h GLY 38 Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.84 2nuu h GLY 38 CO 0.57 0.00 0.00 0.58 0.00 0.00 0.00 176.54 177.69 2nuu n LYS 39 N -4.06 0.51 0.00 4.80 2.85 -1.26 -3.62 118.16 117.39 2nuu n LYS 39 Ca 0.18 0.03 0.00 0.00 -1.05 0.00 0.00 58.31 57.47 2nuu n LYS 39 Cb 0.99 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 33.87 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 -1.21 0.73 -0.24 -5.58 3.02 -0.46 -2.72 115.26 108.81 2nuu n ASN 40 Ca 0.15 -1.11 0.00 0.00 -0.03 0.00 0.00 54.58 53.59 2nuu n ASN 40 Cb 0.18 0.00 0.12 0.00 -0.61 0.00 0.00 39.78 39.47 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 0.51 0.89 -0.78 2.41 3.04 -1.60 -2.31 116.25 118.42 2nuu h VAL 41 Ca 0.00 -0.21 -0.01 0.00 -1.01 0.00 0.00 66.70 65.46 2nuu h VAL 41 Cb 0.28 0.21 -0.04 0.00 -2.01 0.00 0.00 31.29 29.73 2nuu h VAL 41 CO 0.00 0.11 0.43 -0.07 -1.01 0.00 0.00 177.57 177.03 2nuu h LEU 42 N 0.62 0.96 -1.06 3.16 3.38 -1.88 -1.77 115.31 118.72 2nuu h LEU 42 Ca 0.33 -0.08 0.05 0.00 0.09 0.00 0.00 57.88 58.27 2nuu h LEU 42 Cb 0.30 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 40.74 2nuu h LEU 42 CO -0.24 0.77 0.63 0.77 0.09 0.00 0.00 178.44 180.46 2nuu h SER 43 N 1.08 1.02 0.54 -0.43 4.64 -1.75 0.15 113.55 118.80 2nuu h SER 43 Ca 0.27 -0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.56 2nuu h SER 43 Cb 0.02 -0.23 0.01 0.00 -0.31 0.00 0.00 62.40 61.89 2nuu h SER 43 CO -0.04 0.68 -0.26 -0.03 -0.87 0.00 0.00 176.83 176.31 2nuu h MET 44 N 1.18 -0.70 -0.76 4.77 1.85 -1.18 -1.85 114.93 118.25 2nuu h MET 44 Ca 0.40 0.05 0.12 0.00 -0.61 0.00 0.00 59.70 59.65 2nuu h MET 44 Cb 0.07 0.16 -0.08 0.00 0.43 0.00 0.00 31.60 32.18 2nuu h MET 44 CO -0.13 -0.39 0.36 -0.07 -0.40 0.00 0.00 176.91 176.28 2nuu h LEU 45 N -1.01 0.44 -0.43 3.39 3.38 -1.06 -1.65 115.31 118.36 2nuu h LEU 45 Ca -0.07 0.08 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 2nuu h LEU 45 Cb 0.63 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 2nuu h LEU 45 CO 0.12 0.22 -0.09 0.74 0.09 0.00 0.00 178.44 179.52 2nuu h THR 46 N 0.57 1.27 -0.59 0.22 2.02 -0.74 -2.20 112.91 113.46 2nuu h THR 46 Ca 0.39 -1.19 -0.02 0.00 0.77 0.00 0.00 66.41 66.37 2nuu h THR 46 Cb 0.50 1.15 -0.03 0.00 -1.74 0.00 0.00 68.15 68.03 2nuu h THR 46 CO -0.32 0.40 0.31 1.56 0.37 0.00 0.00 175.52 177.84 2nuu h GLN 47 N 0.65 0.84 -0.29 6.66 4.20 -0.79 -0.77 115.11 125.61 2nuu h GLN 47 Ca 0.11 -0.11 -0.06 0.00 0.06 0.00 0.00 58.65 58.65 2nuu h GLN 47 Cb 0.62 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 28.23 2nuu h GLN 47 CO 0.04 0.66 -0.07 0.28 -0.67 0.00 0.00 178.83 179.07 2nuu h VAL 48 N 0.80 1.28 -0.55 -0.54 2.07 -1.32 -1.62 116.25 116.37 2nuu h VAL 48 Ca 0.21 -1.10 -0.00 0.00 0.82 0.00 0.00 66.70 66.63 2nuu h VAL 48 Cb 0.08 1.40 -0.03 0.00 -1.52 0.00 0.00 31.29 31.22 2nuu h VAL 48 CO -0.03 0.35 0.34 0.74 0.02 0.00 0.00 177.57 178.99 2nuu h THR 49 N 0.32 1.16 0.09 2.57 2.02 -1.20 -0.62 112.91 117.25 2nuu h THR 49 Ca 0.07 -0.35 -0.26 0.00 0.77 0.00 0.00 66.41 66.65 2nuu h THR 49 Cb 0.55 0.41 0.00 0.00 -1.74 0.00 0.00 68.15 67.37 2nuu h THR 49 CO 0.03 0.16 -1.13 0.58 0.37 0.00 0.00 175.52 175.53 2nuu h VAL 50 N 0.74 1.46 -0.35 3.16 2.07 -1.16 -2.27 116.25 119.89 2nuu h VAL 50 Ca 0.20 -2.82 -0.06 0.00 0.82 0.00 0.00 66.70 64.84 2nuu h VAL 50 Cb -0.03 2.75 -0.01 0.00 -1.52 0.00 0.00 31.29 32.48 2nuu h VAL 50 CO -0.04 0.83 -0.02 0.71 0.02 0.00 0.00 177.57 179.07 2nuu h THR 51 N 0.13 1.26 -0.25 2.57 1.35 -1.24 0.16 112.91 116.90 2nuu h THR 51 Ca -0.12 -1.01 0.06 0.00 -0.55 0.00 0.00 66.41 64.79 2nuu h THR 51 Cb 1.83 1.23 -0.06 0.00 -1.73 0.00 0.00 68.15 69.41 2nuu h THR 51 CO 0.19 0.33 -0.16 0.15 -0.25 0.00 0.00 175.52 175.79 2nuu h PHE 52 N 0.43 -0.39 -0.33 4.73 3.57 -1.15 0.54 116.94 124.34 2nuu h PHE 52 Ca 0.10 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.64 2nuu h PHE 52 Cb 0.49 0.21 -0.02 0.00 2.79 0.00 0.00 35.95 39.42 2nuu h PHE 52 CO 0.04 -0.23 0.20 0.00 -2.23 0.00 0.00 178.31 176.10 2nuu h ALA 53 N 1.02 0.41 -0.64 2.41 0.00 -1.13 -0.72 119.26 120.62 2nuu h ALA 53 Ca 0.14 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.05 2nuu h ALA 53 Cb 0.35 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 2nuu h ALA 53 CO -0.33 -0.14 0.40 1.25 0.00 0.00 0.00 179.25 180.43 2nuu h LEU 54 N 0.42 0.67 -0.13 0.00 5.85 0.23 -2.65 115.31 119.70 2nuu h LEU 54 Ca 0.12 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 2nuu h LEU 54 Cb -0.03 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 40.85 2nuu h LEU 54 CO -0.04 0.47 0.05 0.58 -0.34 0.00 0.00 178.44 179.17 2nuu h VAL 55 N 0.80 1.15 -0.70 1.05 2.07 0.40 -2.26 116.25 118.77 2nuu h VAL 55 Ca 0.25 -0.44 0.13 0.00 0.82 0.00 0.00 66.70 67.46 2nuu h VAL 55 Cb -0.01 1.20 -0.09 0.00 -1.52 0.00 0.00 31.29 30.87 2nuu h VAL 55 CO -0.09 0.13 0.25 0.00 0.02 0.00 0.00 177.57 177.88 2nuu h ILE 57 N 0.40 1.23 -0.29 0.00 1.08 -1.33 -2.85 117.51 115.76 2nuu h ILE 57 Ca 0.37 -0.73 -0.06 0.00 -0.39 0.00 0.00 64.86 64.06 2nuu h ILE 57 Cb 0.55 1.53 -0.02 0.00 -3.07 0.00 0.00 36.82 35.81 2nuu h ILE 57 CO -0.39 0.21 -0.06 -0.07 -0.69 0.00 0.00 178.15 177.15 2nuu h LEU 58 N -0.08 0.43 0.01 1.44 3.38 -1.13 -1.91 115.31 117.46 2nuu h LEU 58 Ca 0.03 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 2nuu h LEU 58 Cb 0.31 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.95 2nuu h LEU 58 CO 0.00 0.54 -0.01 -0.25 0.09 0.00 0.00 178.44 178.82 2nuu h TRP 59 N 0.43 -0.02 -0.32 1.13 2.91 -1.05 0.11 115.95 119.14 2nuu h TRP 59 Ca 0.09 -0.00 -0.15 0.00 1.13 0.00 0.00 58.89 59.96 2nuu h TRP 59 Cb 0.38 0.01 -0.01 0.00 -0.51 0.00 0.00 29.16 29.03 2nuu h TRP 59 CO 0.01 0.10 -0.40 -0.39 -1.03 0.00 0.00 178.44 176.74 2nuu h VAL 60 N -0.14 1.28 0.45 2.65 -1.51 -1.39 0.55 116.25 118.15 2nuu h VAL 60 Ca -0.00 -1.57 -0.02 0.00 -1.23 0.00 0.00 66.70 63.88 2nuu h VAL 60 Cb 0.13 1.46 0.00 0.00 -2.13 0.00 0.00 31.29 30.75 2nuu h VAL 60 CO 0.00 0.51 -0.22 0.58 -1.23 0.00 0.00 177.57 177.22 2nuu h VAL 61 N 0.64 0.55 0.00 7.19 2.07 -1.26 -2.57 116.25 122.87 2nuu h VAL 61 Ca 0.05 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 67.45 2nuu h VAL 61 Cb 0.95 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 31.33 2nuu h VAL 61 CO 0.09 0.02 0.00 0.00 0.02 0.00 0.00 177.57 177.70 2nuu n TYR 62 N -5.32 0.00 0.39 1.57 0.18 -0.36 -1.40 117.16 112.23 2nuu n TYR 62 Ca -0.11 0.00 -0.19 0.00 1.88 0.00 0.00 57.90 59.48 2nuu n TYR 62 Cb 0.27 0.00 -0.09 0.00 -0.38 0.00 0.00 39.34 39.14 2nuu n TYR 62 CO 0.00 0.00 0.00 0.78 -2.08 0.00 0.00 176.86 175.56 2nuu h GLY 63 N 0.00 -1.13 0.40 -7.48 0.00 -0.20 -1.47 103.07 93.20 2nuu h GLY 63 Ca 0.00 0.45 0.09 0.00 0.00 0.00 0.00 47.33 47.87 2nuu h GLY 63 CO 0.00 -0.40 0.25 -1.82 0.00 0.00 0.00 176.54 174.57 2nuu h TYR 64 N -1.05 0.44 -0.51 5.60 3.20 -1.17 -1.94 116.97 121.55 2nuu h TYR 64 Ca -0.09 0.03 -0.08 0.00 3.14 0.00 0.00 58.73 61.73 2nuu h TYR 64 Cb 0.83 -0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.98 2nuu h TYR 64 CO -0.08 0.12 0.00 1.03 -1.64 0.00 0.00 178.16 177.60 2nuu h SER 65 N 0.45 0.88 1.65 -2.11 0.87 -1.79 -0.14 113.55 113.35 2nuu h SER 65 Ca 0.32 -0.31 0.00 0.00 -1.23 0.00 0.00 61.79 60.57 2nuu h SER 65 Cb 0.38 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 62.10 2nuu h SER 65 CO -0.30 0.97 0.00 -0.07 -0.53 0.00 0.00 176.83 176.91 2nuu h LEU 66 N 0.77 0.00 0.00 2.23 3.38 -0.99 -1.96 115.31 118.74 2nuu h LEU 66 Ca 0.15 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.87 2nuu h LEU 66 Cb 0.52 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.23 2nuu h LEU 66 CO 0.03 0.00 -1.42 0.00 0.09 0.00 0.00 178.44 177.14 2nuu n ALA 67 N -2.04 0.83 -0.23 1.53 0.00 -0.75 0.73 120.51 120.58 2nuu n ALA 67 Ca 0.03 -0.60 0.11 0.00 0.00 0.00 0.00 53.44 52.98 2nuu n ALA 67 Cb 0.45 -0.36 0.29 0.00 0.00 0.00 0.00 19.45 19.82 2nuu n ALA 67 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2nuu n PHE 68 N -4.42 0.84 -2.77 0.00 3.72 -0.08 -3.96 117.46 110.80 2nuu n PHE 68 Ca -0.33 -0.45 -0.25 0.00 -0.05 0.00 0.00 57.45 56.36 2nuu n PHE 68 Cb 0.68 -0.00 0.01 0.00 -0.94 0.00 0.00 39.48 39.23 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 -1.08 1.55 0.15 1.37 0.00 -0.75 -5.00 107.32 103.54 2nuu s GLY 69 Ca 0.45 -0.84 -0.30 0.00 0.00 0.00 0.00 44.72 44.03 2nuu s GLY 69 CO 0.31 -0.64 1.02 1.85 0.00 0.00 0.00 173.10 175.64 2nuu s GLU 70 N -4.70 4.67 0.00 2.90 2.12 -1.26 -4.24 118.70 118.18 2nuu s GLU 70 Ca 0.49 1.56 0.00 0.00 0.36 0.00 0.00 54.97 57.38 2nuu s GLU 70 Cb -0.10 -3.33 0.00 0.00 0.26 0.00 0.00 34.13 30.96 2nuu s GLU 70 CO 0.41 0.17 0.00 0.41 -0.54 0.00 0.00 175.26 175.72 2nuu n GLY 71 N 2.13 2.33 0.00 -1.50 0.00 -1.25 -3.70 105.19 103.21 2nuu n GLY 71 Ca 0.02 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.21 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 0.35 0.00 1.61 0.23 -0.86 -5.01 115.26 111.58 2nuu n ASN 72 Ca 0.00 0.00 0.13 0.00 -0.53 0.00 0.00 54.58 54.18 2nuu n ASN 72 Cb 0.00 0.00 0.62 0.00 -2.08 0.00 0.00 39.78 38.32 2nuu n ASN 72 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 2nuu n ASN 73 N 0.00 0.00 0.00 0.53 3.02 -1.26 -4.25 115.26 113.30 2nuu n ASN 73 Ca 0.00 0.13 0.00 0.00 -0.03 0.00 0.00 54.58 54.68 2nuu n ASN 73 Cb 0.00 -0.36 0.00 0.00 -0.61 0.00 0.00 39.78 38.81 2nuu n ASN 73 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 2nuu n PHE 74 N -1.36 0.00 -4.36 3.10 3.01 -1.26 -0.71 117.46 115.88 2nuu n PHE 74 Ca 0.10 0.00 -0.19 0.00 1.01 0.00 0.00 57.45 58.37 2nuu n PHE 74 Cb 0.24 0.00 -0.10 0.00 -0.01 0.00 0.00 39.48 39.61 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 -1.90 1.73 0.00 1.38 0.40 -1.26 -4.28 117.98 114.04 2nuu s PHE 75 Ca 0.00 -0.64 0.00 0.00 -0.60 0.00 0.00 56.93 55.69 2nuu s PHE 75 Cb 0.00 -0.86 0.00 0.00 0.51 0.00 0.00 43.02 42.67 2nuu s PHE 75 CO 0.00 0.30 0.00 0.41 0.70 0.00 0.00 175.22 176.63 2nuu n GLY 76 N -0.42 0.94 3.35 4.36 0.00 0.22 -2.03 105.19 111.61 2nuu n GLY 76 Ca -0.07 -0.52 -0.14 0.00 0.00 0.00 0.00 46.02 45.28 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 -1.00 0.64 -0.06 1.61 2.20 -1.11 -4.36 114.94 112.86 2nuu s ASN 77 Ca 0.00 -1.42 0.18 0.00 -0.94 0.00 0.00 52.86 50.67 2nuu s ASN 77 Cb 0.00 0.52 0.59 0.00 -2.00 0.00 0.00 41.25 40.36 2nuu s ASN 77 CO 0.00 -1.05 1.50 2.30 -2.94 0.00 0.00 177.10 176.91 2nuu n ILE 78 N -0.44 1.45 0.48 0.54 -6.64 -1.26 -3.05 119.36 110.44 2nuu n ILE 78 Ca 0.02 -1.16 0.05 0.00 -1.77 0.00 0.00 62.75 59.90 2nuu n ILE 78 Cb 0.63 0.29 0.26 0.00 -1.44 0.00 0.00 39.64 39.38 2nuu n ILE 78 CO 0.00 0.00 0.00 0.59 -1.77 0.00 0.00 176.55 175.37 2nuu n ASN 79 N 0.99 0.00 -1.44 7.28 5.03 -1.26 -1.68 115.26 124.17 2nuu n ASN 79 Ca 0.22 0.16 -0.11 0.00 0.87 0.00 0.00 54.58 55.72 2nuu n ASN 79 Cb 0.71 -0.30 0.15 0.00 -1.02 0.00 0.00 39.78 39.32 2nuu n ASN 79 CO 0.00 0.00 0.00 0.79 -1.83 0.00 0.00 177.26 176.22 2nuu n TRP 80 N -1.30 1.60 -1.91 3.10 8.01 -1.26 -4.45 117.44 121.23 2nuu n TRP 80 Ca 0.05 -1.88 -0.42 0.00 -1.31 0.00 0.00 57.50 53.94 2nuu n TRP 80 Cb 0.09 -0.56 -0.03 0.00 -2.01 0.00 0.00 31.31 28.80 2nuu n TRP 80 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.69 175.51 2nuu s LEU 81 N -3.38 4.37 -1.41 -0.99 1.98 -0.68 -1.83 118.68 116.74 2nuu s LEU 81 Ca 0.48 2.48 -0.07 0.00 -2.89 0.00 0.00 54.13 54.13 2nuu s LEU 81 Cb 0.42 -3.56 0.04 0.00 0.66 0.00 0.00 46.19 43.75 2nuu s LEU 81 CO 0.00 -0.91 0.55 0.23 -1.89 0.00 0.00 176.35 174.33 2nuu n MET 82 N 5.93 -4.14 -1.17 1.98 2.81 -0.49 -1.54 117.12 120.50 2nuu n MET 82 Ca 0.16 0.68 -0.06 0.00 -1.81 0.00 0.00 57.70 56.67 2nuu n MET 82 Cb 0.41 -5.46 -0.03 0.00 -0.71 0.00 0.00 33.22 27.43 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 -3.88 0.17 -4.76 4.03 4.77 -0.76 -4.98 117.00 111.59 2nuu n LEU 83 Ca -0.06 0.15 -0.35 0.00 -0.03 0.00 0.00 56.01 55.71 2nuu n LEU 83 Cb 0.58 -2.38 0.02 0.00 -2.33 0.00 0.00 43.42 39.31 2nuu n LEU 83 CO 0.49 -0.91 0.81 -1.59 -1.33 0.00 0.00 177.39 174.86 2nuu s LYS 84 N -2.35 3.10 0.00 3.23 -2.85 -0.59 -2.85 119.74 117.43 2nuu s LYS 84 Ca 0.00 1.72 0.00 0.00 -1.00 0.00 0.00 55.97 56.69 2nuu s LYS 84 Cb 0.00 -1.96 0.00 0.00 -2.06 0.00 0.00 37.83 33.81 2nuu s LYS 84 CO 0.00 -1.08 0.00 0.09 0.10 0.00 0.00 175.35 174.46 2nuu n ASN 85 N -1.53 0.00 -4.51 0.03 3.02 -1.26 -4.12 115.26 106.89 2nuu n ASN 85 Ca 0.13 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.26 2nuu n ASN 85 Cb 0.50 0.00 -0.10 0.00 -0.61 0.00 0.00 39.78 39.57 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 -3.25 5.21 0.22 2.41 1.01 -1.13 -5.06 121.20 120.61 2nuu s ILE 86 Ca 0.00 -0.27 -0.30 0.00 0.00 0.00 0.00 60.65 60.09 2nuu s ILE 86 Cb 0.00 -3.85 -0.08 0.00 0.01 0.00 0.00 42.46 38.53 2nuu s ILE 86 CO 0.00 -0.17 1.07 -1.61 0.00 0.00 0.00 174.94 174.23 2nuu s GLU 87 N 1.87 4.65 0.60 2.79 2.02 -1.26 -4.91 118.70 124.45 2nuu s GLU 87 Ca 0.08 1.71 0.29 0.00 0.02 0.00 0.00 54.97 57.07 2nuu s GLU 87 Cb -0.17 -3.25 1.45 0.00 0.10 0.00 0.00 34.13 32.26 2nuu s GLU 87 CO 0.11 0.19 1.86 1.25 0.02 0.00 0.00 175.26 178.70 2nuu h LEU 88 N 4.52 0.00 -2.41 1.80 5.85 -1.97 0.42 115.31 123.51 2nuu h LEU 88 Ca -0.45 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.27 2nuu h LEU 88 Cb 1.21 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.24 2nuu h LEU 88 CO 0.70 0.00 0.00 0.35 -0.34 0.00 0.00 178.44 179.15 2nuu n THR 89 N -3.60 1.24 -2.24 1.05 -2.24 -1.26 -4.81 114.28 102.42 2nuu n THR 89 Ca 0.08 -0.88 -0.42 0.00 -2.27 0.00 0.00 64.05 60.57 2nuu n THR 89 Cb 0.69 0.14 -0.03 0.00 -2.10 0.00 0.00 70.33 69.03 2nuu n THR 89 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2nuu s ALA 90 N -1.62 3.53 -0.17 6.98 0.00 0.15 -4.95 121.76 125.68 2nuu s ALA 90 Ca 0.40 1.06 -0.04 0.00 0.00 0.00 0.00 51.96 53.38 2nuu s ALA 90 Cb 0.24 -3.50 -0.02 0.00 0.00 0.00 0.00 23.12 19.84 2nuu s ALA 90 CO 0.21 -0.54 -0.04 0.08 0.00 0.00 0.00 175.76 175.48 2nuu s VAL 91 N 0.73 3.82 -0.41 0.00 1.01 -1.26 0.34 120.40 124.64 2nuu s VAL 91 Ca 0.60 -0.38 -0.03 0.00 0.00 0.00 0.00 61.98 62.18 2nuu s VAL 91 Cb -0.35 -2.69 0.11 0.00 0.00 0.00 0.00 36.38 33.45 2nuu s VAL 91 CO 0.33 0.48 0.20 -0.32 0.00 0.00 0.00 175.10 175.78 2nuu s MET 92 N 0.54 1.97 4.23 2.72 0.00 0.70 -4.81 119.30 124.67 2nuu s MET 92 Ca -0.03 -1.82 0.00 0.00 0.00 0.00 0.00 55.69 53.84 2nuu s MET 92 Cb -0.14 -3.57 0.00 0.00 0.00 0.00 0.00 34.83 31.12 2nuu s MET 92 CO 0.03 -1.07 0.00 0.41 0.00 0.00 0.00 175.02 174.39 2nuu n GLY 93 N 4.58 2.00 0.11 2.11 0.00 -1.26 -2.88 105.19 109.84 2nuu n GLY 93 Ca -0.02 -0.15 0.01 0.00 0.00 0.00 0.00 46.02 45.86 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 7.32 0.90 -4.42 1.61 3.41 -1.26 -4.86 113.62 116.32 2nuu n SER 94 Ca 0.00 -1.78 -0.21 0.00 -0.26 0.00 0.00 58.87 56.62 2nuu n SER 94 Cb 0.00 -0.10 -0.10 0.00 -0.26 0.00 0.00 64.21 63.74 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 -0.70 1.43 0.28 -1.33 -4.36 -1.14 -0.34 121.20 115.04 2nuu s ILE 95 Ca 0.05 -2.07 -0.29 0.00 -0.26 0.00 0.00 60.65 58.07 2nuu s ILE 95 Cb 0.04 -2.54 -0.10 0.00 1.25 0.00 0.00 42.46 41.12 2nuu s ILE 95 CO 0.00 -0.22 1.10 -0.31 0.24 0.00 0.00 174.94 175.76 2nuu s TYR 96 N -3.14 3.57 0.53 1.37 2.02 -1.26 -0.21 117.35 120.22 2nuu s TYR 96 Ca 0.31 1.70 0.24 0.00 -0.37 0.00 0.00 57.07 58.95 2nuu s TYR 96 Cb 0.06 -3.29 1.38 0.00 -0.40 0.00 0.00 41.96 39.70 2nuu s TYR 96 CO 0.12 -0.57 2.01 0.37 -1.57 0.00 0.00 175.55 175.91 2nuu h GLN 97 N 3.81 0.01 -0.54 -0.62 4.15 -0.42 -1.41 115.11 120.09 2nuu h GLN 97 Ca -0.47 -0.00 -0.00 0.00 0.77 0.00 0.00 58.65 58.95 2nuu h GLN 97 Cb 1.21 -0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.87 2nuu h GLN 97 CO 0.67 0.00 0.33 1.88 -1.93 0.00 0.00 178.83 179.78 2nuu h TYR 98 N 0.01 0.70 -0.31 3.99 -1.99 -1.88 -0.23 116.97 117.25 2nuu h TYR 98 Ca 0.23 0.01 -0.12 0.00 2.00 0.00 0.00 58.73 60.84 2nuu h TYR 98 Cb 0.91 -0.23 -0.01 0.00 2.00 0.00 0.00 36.73 39.39 2nuu h TYR 98 CO -0.00 0.46 -0.31 0.82 -0.00 0.00 0.00 178.16 179.14 2nuu h ILE 99 N 0.74 1.28 -0.59 -2.88 2.04 -1.64 -2.37 117.51 114.10 2nuu h ILE 99 Ca 0.20 -1.43 -0.01 0.00 1.00 0.00 0.00 64.86 64.62 2nuu h ILE 99 Cb -0.04 1.37 -0.03 0.00 -0.74 0.00 0.00 36.82 37.39 2nuu h ILE 99 CO -0.04 0.46 0.32 -0.74 0.00 0.00 0.00 178.15 178.15 2nuu h HIS 100 N 0.56 0.81 -0.07 1.37 2.76 -1.04 0.59 115.15 120.13 2nuu h HIS 100 Ca 0.07 -0.02 0.02 0.00 -2.20 0.00 0.00 60.37 58.23 2nuu h HIS 100 Cb 0.80 -0.26 -0.02 0.00 1.55 0.00 0.00 27.41 29.48 2nuu h HIS 100 CO 0.04 0.59 -0.04 0.28 -1.30 0.00 0.00 177.93 177.50 2nuu h VAL 101 N 0.80 0.87 -0.35 5.26 2.07 -0.94 0.01 116.25 123.97 2nuu h VAL 101 Ca 0.21 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.69 2nuu h VAL 101 Cb 0.05 0.87 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 2nuu h VAL 101 CO -0.03 0.00 0.08 0.00 0.02 0.00 0.00 177.57 177.64 2nuu h ALA 102 N 1.03 0.46 -0.07 1.67 0.00 -1.14 -0.81 119.26 120.40 2nuu h ALA 102 Ca 0.04 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2nuu h ALA 102 Cb 0.10 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 2nuu h ALA 102 CO -0.10 0.13 0.05 0.35 0.00 0.00 0.00 179.25 179.68 2nuu h PHE 103 N 0.41 0.09 0.00 0.00 3.57 -0.70 -1.74 116.94 118.57 2nuu h PHE 103 Ca 0.11 0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.53 2nuu h PHE 103 Cb 0.30 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.00 2nuu h PHE 103 CO 0.02 0.07 -0.37 1.96 -2.23 0.00 0.00 178.31 177.75 2nuu h GLN 104 N 0.09 0.00 -0.04 1.11 1.08 -0.98 -2.93 115.11 113.43 2nuu h GLN 104 Ca 0.03 0.00 -0.12 0.00 -1.45 0.00 0.00 58.65 57.11 2nuu h GLN 104 Cb -0.00 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.41 2nuu h GLN 104 CO -0.01 0.37 -0.52 0.78 -0.95 0.00 0.00 178.83 178.50 2nuu h GLY 105 N 1.70 0.13 2.00 3.46 0.00 -0.82 -2.71 103.07 106.83 2nuu h GLY 105 Ca -0.00 -0.15 -0.10 0.00 0.00 0.00 0.00 47.33 47.08 2nuu h GLY 105 CO 0.05 0.13 -0.46 1.48 0.00 0.00 0.00 176.54 177.74 2nuu h SER 106 N 0.10 0.00 -0.16 0.19 4.64 -1.13 -2.41 113.55 114.78 2nuu h SER 106 Ca 0.00 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.23 2nuu h SER 106 Cb 0.96 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.04 2nuu h SER 106 CO 0.07 0.46 -0.18 -0.26 -0.87 0.00 0.00 176.83 176.06 2nuu h PHE 107 N 0.00 0.62 -0.36 4.77 -1.00 -1.48 -2.00 116.94 117.49 2nuu h PHE 107 Ca -0.00 -0.12 -0.14 0.00 2.81 0.00 0.00 57.97 60.52 2nuu h PHE 107 Cb 0.90 -0.16 -0.01 0.00 3.61 0.00 0.00 35.95 40.30 2nuu h PHE 107 CO 0.00 0.71 -0.34 0.00 -1.61 0.00 0.00 178.31 177.07 2nuu h ALA 108 N 1.30 0.70 0.56 2.45 0.00 -1.37 -2.63 119.26 120.28 2nuu h ALA 108 Ca 0.08 -0.43 -0.03 0.00 0.00 0.00 0.00 54.91 54.54 2nuu h ALA 108 Cb 0.60 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.26 2nuu h ALA 108 CO 0.04 0.66 -0.27 0.00 0.00 0.00 0.00 179.25 179.69 2nuu h ILE 110 N -0.79 1.12 -0.28 0.00 6.09 -1.43 -0.67 117.51 121.55 2nuu h ILE 110 Ca -0.08 -0.27 -0.01 0.00 -1.37 0.00 0.00 64.86 63.13 2nuu h ILE 110 Cb 0.59 0.27 -0.01 0.00 0.47 0.00 0.00 36.82 38.14 2nuu h ILE 110 CO 0.13 0.14 0.12 0.74 -3.07 0.00 0.00 178.15 176.21 2nuu h THR 111 N 0.78 1.17 -0.58 2.19 2.02 -1.33 -0.84 112.91 116.32 2nuu h THR 111 Ca 0.24 -0.51 -0.10 0.00 0.77 0.00 0.00 66.41 66.82 2nuu h THR 111 Cb -0.00 0.98 -0.02 0.00 -1.74 0.00 0.00 68.15 67.36 2nuu h THR 111 CO -0.06 0.17 -0.02 0.58 0.37 0.00 0.00 175.52 176.57 2nuu h VAL 112 N 0.31 1.27 -0.85 3.16 2.07 -1.02 -2.84 116.25 118.35 2nuu h VAL 112 Ca 0.10 -1.16 0.08 0.00 0.82 0.00 0.00 66.70 66.54 2nuu h VAL 112 Cb 0.16 0.86 -0.06 0.00 -1.52 0.00 0.00 31.29 30.74 2nuu h VAL 112 CO -0.01 0.42 0.55 1.23 0.02 0.00 0.00 177.57 179.78 2nuu h GLY 113 N 0.92 1.19 1.03 2.17 0.00 -0.79 -2.49 103.07 105.09 2nuu h GLY 113 Ca 0.16 -0.36 -0.03 0.00 0.00 0.00 0.00 47.33 47.10 2nuu h GLY 113 CO 0.03 0.23 0.39 1.41 0.00 0.00 0.00 176.54 178.61 2nuu h LEU 114 N 0.88 1.07 -0.39 3.11 3.38 -0.91 -3.13 115.31 119.32 2nuu h LEU 114 Ca 0.38 -0.13 0.03 0.00 0.09 0.00 0.00 57.88 58.24 2nuu h LEU 114 Cb 0.32 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 2nuu h LEU 114 CO -0.15 0.91 0.20 0.40 0.09 0.00 0.00 178.44 179.89 2nuu h ILE 115 N 1.16 0.99 -0.26 1.22 2.04 -1.42 -3.07 117.51 118.18 2nuu h ILE 115 Ca 0.28 -0.14 0.07 0.00 1.00 0.00 0.00 64.86 66.07 2nuu h ILE 115 Cb 0.12 0.54 -0.01 0.00 -0.74 0.00 0.00 36.82 36.73 2nuu h ILE 115 CO -0.04 0.08 0.59 0.58 0.00 0.00 0.00 178.15 179.36 2nuu h VAL 116 N 0.42 0.11 0.00 1.67 2.07 -1.54 -1.13 116.25 117.85 2nuu h VAL 116 Ca 0.16 0.00 -0.12 0.00 0.82 0.00 0.00 66.70 67.56 2nuu h VAL 116 Cb 0.06 0.47 -0.02 0.00 -1.52 0.00 0.00 31.29 30.28 2nuu h VAL 116 CO -0.11 0.00 -0.58 1.23 0.02 0.00 0.00 177.57 178.14 2nuu h GLY 117 N 0.00 0.00 2.00 2.17 0.00 -1.69 -3.10 103.07 102.44 2nuu h GLY 117 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.45 2nuu h GLY 117 CO -0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.54 2nuu h ALA 118 N 1.42 1.00 -0.01 3.60 0.00 -1.41 -3.22 119.26 120.64 2nuu h ALA 118 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2nuu h ALA 118 Cb 1.05 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.84 2nuu h ALA 118 CO 0.08 0.00 -0.67 1.28 0.00 0.00 0.00 179.25 179.93 2nuu n LEU 119 N -2.48 1.47 -4.47 0.00 4.77 -1.18 -4.28 117.00 110.83 2nuu n LEU 119 Ca 0.04 -0.64 -0.45 0.00 -0.03 0.00 0.00 56.01 54.94 2nuu n LEU 119 Cb 0.39 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.47 2nuu n LEU 119 CO 0.28 0.30 0.17 0.00 -1.33 0.00 0.00 177.39 176.81 2nuu n ALA 120 N -0.71 -1.64 -0.32 -1.18 0.00 -1.20 -3.21 120.51 112.26 2nuu n ALA 120 Ca 0.06 0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.82 2nuu n ALA 120 Cb 0.38 -1.78 0.00 0.00 0.00 0.00 0.00 19.45 18.05 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 0.81 0.00 0.00 0.00 1.02 -1.26 -4.68 120.64 116.53 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 0.33 -2.57 0.00 0.00 -0.02 0.00 0.00 31.44 29.17 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 3.07 -2.49 3.49 0.00 -1.24 -4.83 116.66 112.65 2nuu n ARG 122 Ca 0.00 0.00 -0.37 0.00 -0.00 0.00 0.00 57.85 57.48 2nuu n ARG 122 Cb 0.00 -0.33 -0.04 0.00 -0.00 0.00 0.00 32.46 32.10 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 -0.24 3.59 -0.04 8.89 -1.16 -1.20 -1.28 121.20 129.77 2nuu s ILE 123 Ca 0.00 1.28 -0.22 0.00 -0.51 0.00 0.00 60.65 61.20 2nuu s ILE 123 Cb 0.00 -3.70 -0.04 0.00 0.61 0.00 0.00 42.46 39.33 2nuu s ILE 123 CO 0.00 0.07 0.66 0.00 -2.81 0.00 0.00 174.94 172.86 2nuu s ARG 124 N -2.32 4.40 0.17 3.50 1.70 -0.13 -4.73 118.95 121.54 2nuu s ARG 124 Ca 0.56 0.82 -0.30 0.00 -0.47 0.00 0.00 55.73 56.34 2nuu s ARG 124 Cb -0.25 -3.40 -0.04 0.00 -0.57 0.00 0.00 34.95 30.69 2nuu s ARG 124 CO 0.31 0.20 1.54 0.35 -1.08 0.00 0.00 175.30 176.62 2nuu h PHE 125 N 6.25 -1.78 -0.14 5.89 3.04 -1.94 -0.53 116.94 127.73 2nuu h PHE 125 Ca -0.43 0.12 0.04 0.00 3.98 0.00 0.00 57.97 61.69 2nuu h PHE 125 Cb 1.20 0.90 -0.01 0.00 2.56 0.00 0.00 35.95 40.60 2nuu h PHE 125 CO 0.65 -0.38 0.12 0.66 -2.02 0.00 0.00 178.31 177.33 2nuu h SER 126 N -0.04 0.00 -0.47 0.41 4.64 -1.95 -0.90 113.55 115.25 2nuu h SER 126 Ca 0.17 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.40 2nuu h SER 126 Cb 0.45 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.52 2nuu h SER 126 CO -0.91 0.00 -0.05 0.00 -0.87 0.00 0.00 176.83 175.00 2nuu h ALA 127 N 1.90 0.94 -0.65 5.18 0.00 -1.35 -2.60 119.26 122.67 2nuu h ALA 127 Ca 0.07 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 2nuu h ALA 127 Cb 0.30 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 2nuu h ALA 127 CO -0.00 0.63 0.36 0.28 0.00 0.00 0.00 179.25 180.52 2nuu h VAL 128 N 0.83 1.21 -0.33 0.00 2.07 -1.01 -1.80 116.25 117.22 2nuu h VAL 128 Ca 0.15 -0.52 -0.03 0.00 0.82 0.00 0.00 66.70 67.12 2nuu h VAL 128 Cb 0.56 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 2nuu h VAL 128 CO 0.03 0.23 0.09 -0.07 0.02 0.00 0.00 177.57 177.87 2nuu h LEU 129 N 0.89 0.48 -0.90 2.57 3.38 -1.36 -2.04 115.31 118.34 2nuu h LEU 129 Ca 0.23 -0.22 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 2nuu h LEU 129 Cb 0.04 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.62 2nuu h LEU 129 CO -0.04 0.57 0.55 0.40 0.09 0.00 0.00 178.44 180.02 2nuu h ILE 130 N 0.37 1.24 -0.49 1.22 2.04 -1.31 -2.63 117.51 117.96 2nuu h ILE 130 Ca 0.10 -0.51 -0.04 0.00 1.00 0.00 0.00 64.86 65.41 2nuu h ILE 130 Cb 0.27 -0.03 -0.02 0.00 -0.74 0.00 0.00 36.82 36.30 2nuu h ILE 130 CO -0.00 0.25 0.15 0.15 0.00 0.00 0.00 178.15 178.70 2nuu h PHE 131 N 1.23 0.79 -0.29 1.37 3.57 -1.16 -2.75 116.94 119.70 2nuu h PHE 131 Ca 0.32 -0.08 -0.05 0.00 3.53 0.00 0.00 57.97 61.69 2nuu h PHE 131 Cb -0.07 -0.23 -0.02 0.00 2.79 0.00 0.00 35.95 38.43 2nuu h PHE 131 CO -0.00 0.70 -0.03 0.28 -2.23 0.00 0.00 178.31 177.02 2nuu h VAL 132 N 0.66 1.19 -0.27 1.41 2.07 -1.08 0.28 116.25 120.51 2nuu h VAL 132 Ca 0.16 -0.77 -0.07 0.00 0.82 0.00 0.00 66.70 66.83 2nuu h VAL 132 Cb 0.28 1.01 -0.01 0.00 -1.52 0.00 0.00 31.29 31.06 2nuu h VAL 132 CO -0.00 0.26 -0.10 0.58 0.02 0.00 0.00 177.57 178.32 2nuu h VAL 133 N 0.43 1.29 0.40 2.57 2.07 -1.34 -1.46 116.25 120.21 2nuu h VAL 133 Ca 0.09 -1.16 -0.02 0.00 0.82 0.00 0.00 66.70 66.43 2nuu h VAL 133 Cb 0.34 1.49 0.00 0.00 -1.52 0.00 0.00 31.29 31.60 2nuu h VAL 133 CO 0.01 0.36 -0.19 0.58 0.02 0.00 0.00 177.57 178.36 2nuu h VAL 134 N 0.28 0.49 -0.71 2.57 2.07 -1.15 -3.12 116.25 116.68 2nuu h VAL 134 Ca 0.06 -0.57 -0.03 0.00 0.82 0.00 0.00 66.70 66.99 2nuu h VAL 134 Cb 0.60 0.71 -0.03 0.00 -1.52 0.00 0.00 31.29 31.05 2nuu h VAL 134 CO 0.03 0.09 0.34 -0.25 0.02 0.00 0.00 177.57 177.80 2nuu h TRP 135 N -0.91 1.02 -0.38 1.57 7.01 -0.51 -1.43 115.95 122.30 2nuu h TRP 135 Ca -0.05 -0.05 -0.03 0.00 2.11 0.00 0.00 58.89 60.87 2nuu h TRP 135 Cb 0.55 -0.32 -0.02 0.00 -2.10 0.00 0.00 29.16 27.28 2nuu h TRP 135 CO 0.02 0.75 0.13 1.25 -2.79 0.00 0.00 178.44 177.81 2nuu h LEU 136 N 0.99 0.54 -0.43 0.65 5.85 -1.39 0.18 115.31 121.70 2nuu h LEU 136 Ca 0.24 -0.19 -0.05 0.00 0.84 0.00 0.00 57.88 58.72 2nuu h LEU 136 Cb 0.12 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 2nuu h LEU 136 CO -0.03 0.59 0.07 0.74 -0.34 0.00 0.00 178.44 179.46 2nuu h THR 137 N 0.47 1.25 -0.01 1.05 2.02 -1.46 -1.82 112.91 114.41 2nuu h THR 137 Ca 0.13 -0.90 0.00 0.00 0.77 0.00 0.00 66.41 66.41 2nuu h THR 137 Cb 0.23 0.99 0.00 0.00 -1.74 0.00 0.00 68.15 67.63 2nuu h THR 137 CO -0.01 0.31 -0.59 0.18 0.37 0.00 0.00 175.52 175.78 2nuu n LEU 138 N -4.48 1.39 0.03 2.58 4.77 -0.55 -4.48 117.00 116.27 2nuu n LEU 138 Ca 0.00 -0.65 -0.00 0.00 -0.03 0.00 0.00 56.01 55.33 2nuu n LEU 138 Cb 0.25 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.33 2nuu n LEU 138 CO 0.40 0.29 -0.13 -0.24 -1.33 0.00 0.00 177.39 176.37 2nuu n SER 139 N -0.66 0.92 0.28 -1.43 2.88 0.60 -4.65 113.62 111.57 2nuu n SER 139 Ca 0.06 0.12 -0.16 0.00 -1.33 0.00 0.00 58.87 57.55 2nuu n SER 139 Cb 0.35 -0.29 -0.08 0.00 -0.75 0.00 0.00 64.21 63.44 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 -0.04 -0.74 -0.26 0.66 5.03 -1.19 -2.38 116.97 118.05 2nuu h TYR 140 Ca -0.01 -0.01 0.06 0.00 2.58 0.00 0.00 58.73 61.36 2nuu h TYR 140 Cb 0.24 0.26 -0.08 0.00 1.55 0.00 0.00 36.73 38.71 2nuu h TYR 140 CO -0.01 -0.44 -0.30 0.82 -1.32 0.00 0.00 178.16 176.91 2nuu h ILE 141 N -0.72 0.30 -0.52 1.81 2.04 -1.56 0.14 117.51 119.00 2nuu h ILE 141 Ca -0.06 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.73 2nuu h ILE 141 Cb 0.58 0.30 -0.02 0.00 -0.74 0.00 0.00 36.82 36.94 2nuu h ILE 141 CO 0.07 0.00 0.04 -0.65 0.00 0.00 0.00 178.15 177.61 2nuu h PRO 142 N -0.30 0.89 -0.59 2.37 0.11 -1.74 -1.04 132.00 131.69 2nuu h PRO 142 Ca 0.14 -0.26 -0.01 0.00 0.11 0.00 0.00 66.00 65.97 2nuu h PRO 142 Cb 0.52 -0.09 -0.03 0.00 0.11 0.00 0.00 31.00 31.51 2nuu h PRO 142 CO -0.43 0.90 0.33 0.82 -0.21 0.00 0.00 178.00 179.41 2nuu h ILE 143 N 0.76 1.19 -0.76 4.15 2.04 -1.13 0.34 117.51 124.09 2nuu h ILE 143 Ca 0.15 -0.46 0.03 0.00 1.00 0.00 0.00 64.86 65.58 2nuu h ILE 143 Cb 0.47 0.41 -0.05 0.00 -0.74 0.00 0.00 36.82 36.92 2nuu h ILE 143 CO 0.02 0.20 0.48 0.00 0.00 0.00 0.00 178.15 178.85 2nuu h ALA 144 N 1.16 0.99 -0.38 1.87 0.00 -0.56 -0.78 119.26 121.56 2nuu h ALA 144 Ca 0.21 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.98 2nuu h ALA 144 Cb 0.03 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 2nuu h ALA 144 CO -0.04 0.29 -0.20 1.25 0.00 0.00 0.00 179.25 180.55 2nuu h HIS 145 N 0.95 0.95 -0.36 0.00 -0.00 -0.56 0.27 115.15 116.40 2nuu h HIS 145 Ca 0.30 -0.24 -0.04 0.00 -0.00 0.00 0.00 60.37 60.39 2nuu h HIS 145 Cb -0.00 -0.22 -0.02 0.00 -0.00 0.00 0.00 27.41 27.17 2nuu h HIS 145 CO -0.03 1.00 0.05 0.52 -0.00 0.00 0.00 177.93 179.47 2nuu h MET 146 N 0.62 0.54 0.03 5.26 2.07 0.12 0.21 114.93 123.77 2nuu h MET 146 Ca 0.08 -0.10 -0.39 0.00 -2.07 0.00 0.00 59.70 57.23 2nuu h MET 146 Cb 0.76 -0.09 -0.06 0.00 -1.87 0.00 0.00 31.60 30.35 2nuu h MET 146 CO 0.06 0.53 -2.38 0.28 1.07 0.00 0.00 176.91 176.47 2nuu n VAL 147 N -4.31 1.55 0.11 -2.22 0.31 -0.34 -1.34 118.33 112.10 2nuu n VAL 147 Ca 0.02 -0.58 0.01 0.00 -0.01 0.00 0.00 64.34 63.78 2nuu n VAL 147 Cb 0.21 -1.49 0.01 0.00 -0.91 0.00 0.00 33.84 31.67 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 -3.32 0.00 -0.61 3.52 8.01 0.93 -4.43 117.44 121.54 2nuu n TRP 148 Ca -0.43 0.00 0.08 0.00 -1.31 0.00 0.00 57.50 55.83 2nuu n TRP 148 Cb 1.00 0.00 0.25 0.00 -2.01 0.00 0.00 31.31 30.55 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 0.17 3.26 2.05 6.99 0.00 -0.05 -4.94 105.19 112.67 2nuu n GLY 149 Ca 0.02 -0.75 -0.02 0.00 0.00 0.00 0.00 46.02 45.27 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 0.26 0.49 0.00 -0.02 0.00 -1.12 -4.90 105.19 99.90 2nuu n GLY 150 Ca 0.19 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 45.21 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 -2.67 0.20 0.20 -0.02 0.00 -0.55 -4.63 105.19 97.72 2nuu n GLY 151 Ca -0.02 -1.57 -0.06 0.00 0.00 0.00 0.00 46.02 44.38 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 -0.83 -1.68 0.99 5.85 -1.01 -2.36 115.31 116.28 2nuu h LEU 152 Ca 0.00 0.11 -0.02 0.00 0.84 0.00 0.00 57.88 58.81 2nuu h LEU 152 Cb 0.00 0.34 -0.01 0.00 0.37 0.00 0.00 40.66 41.37 2nuu h LEU 152 CO 0.00 -0.17 -0.05 -0.07 -0.34 0.00 0.00 178.44 177.81 2nuu h LEU 153 N -0.15 0.12 -0.46 2.25 3.38 -1.70 -2.67 115.31 116.07 2nuu h LEU 153 Ca 0.04 -0.01 -0.16 0.00 0.09 0.00 0.00 57.88 57.84 2nuu h LEU 153 Cb 0.25 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 2nuu h LEU 153 CO -0.28 0.20 -0.41 0.00 0.09 0.00 0.00 178.44 178.04 2nuu h ALA 154 N 1.82 0.64 0.00 1.53 0.00 -1.05 -2.02 119.26 120.18 2nuu h ALA 154 Ca 0.03 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2nuu h ALA 154 Cb 0.19 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2nuu h ALA 154 CO 0.01 0.67 0.00 -1.13 0.00 0.00 0.00 179.25 178.80 2nuu n SER 155 N -4.04 0.00 -0.28 0.00 3.41 -0.90 -2.28 113.62 109.53 2nuu n SER 155 Ca -0.02 -1.39 0.03 0.00 -0.26 0.00 0.00 58.87 57.23 2nuu n SER 155 Cb 0.55 0.00 0.04 0.00 -0.26 0.00 0.00 64.21 64.54 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 -0.72 0.05 -1.94 7.33 -0.00 -1.06 -5.00 115.22 113.88 2nuu n HIS 156 Ca 0.09 -0.10 -0.04 0.00 -0.00 0.00 0.00 57.72 57.68 2nuu n HIS 156 Cb 0.04 -0.01 -0.00 0.00 -0.00 0.00 0.00 29.99 30.02 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 0.31 0.28 3.76 -1.41 0.00 -0.96 -4.95 105.19 102.21 2nuu n GLY 157 Ca 0.04 -0.76 -0.39 0.00 0.00 0.00 0.00 46.02 44.91 2nuu n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nuu s ALA 158 N -2.17 3.17 -0.28 4.61 0.00 -0.79 -4.99 121.76 121.32 2nuu s ALA 158 Ca 0.00 1.28 -0.04 0.00 0.00 0.00 0.00 51.96 53.20 2nuu s ALA 158 Cb 0.00 -3.51 0.02 0.00 0.00 0.00 0.00 23.12 19.63 2nuu s ALA 158 CO 0.00 -0.98 0.02 -0.51 0.00 0.00 0.00 175.76 174.29 2nuu s LEU 159 N -2.70 3.59 -0.46 0.00 1.43 -1.26 -4.88 118.68 114.40 2nuu s LEU 159 Ca 0.60 -0.83 0.06 0.00 -1.03 0.00 0.00 54.13 52.94 2nuu s LEU 159 Cb -0.39 -1.78 0.18 0.00 0.03 0.00 0.00 46.19 44.23 2nuu s LEU 159 CO 0.49 -0.17 0.60 -0.62 0.23 0.00 0.00 176.35 176.88 2nuu s ASP 160 N 1.41 -0.68 0.09 2.29 -1.08 -1.26 -4.90 116.67 112.54 2nuu s ASP 160 Ca 0.01 -1.74 -0.30 0.00 -0.52 0.00 0.00 52.55 50.00 2nuu s ASP 160 Cb -0.17 1.37 -0.14 0.00 -1.46 0.00 0.00 42.92 42.52 2nuu s ASP 160 CO -0.01 -0.12 1.63 0.15 0.52 0.00 0.00 175.17 177.35 2nuu h PHE 161 N 5.77 -0.77 -0.05 -5.34 3.57 -1.53 -3.37 116.94 115.22 2nuu h PHE 161 Ca 0.09 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.59 2nuu h PHE 161 Cb 1.09 0.29 0.00 0.00 2.79 0.00 0.00 35.95 40.11 2nuu h PHE 161 CO 0.16 -0.43 0.00 0.00 -2.23 0.00 0.00 178.31 175.82 2nuu n ALA 162 N -2.54 2.31 0.00 2.41 0.00 -0.24 -4.91 120.51 117.55 2nuu n ALA 162 Ca -0.10 -0.75 0.00 0.00 0.00 0.00 0.00 53.44 52.59 2nuu n ALA 162 Cb 0.32 -0.14 0.00 0.00 0.00 0.00 0.00 19.45 19.63 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 0.06 0.99 0.31 0.00 0.00 -1.26 -4.88 105.19 100.41 2nuu n GLY 163 Ca 0.03 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.96 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 1.18 0.00 -0.02 0.00 -1.88 -2.06 103.07 100.29 2nuu h GLY 164 Ca 0.00 -0.83 -0.06 0.00 0.00 0.00 0.00 47.33 46.44 2nuu h GLY 164 CO 0.00 0.77 -0.84 -1.30 0.00 0.00 0.00 176.54 175.16 2nuu n THR 165 N -4.20 1.46 -0.31 4.70 -2.24 -1.26 -1.26 114.28 111.17 2nuu n THR 165 Ca 0.04 0.13 0.13 0.00 -2.27 0.00 0.00 64.05 62.07 2nuu n THR 165 Cb 0.32 -2.30 0.30 0.00 -2.10 0.00 0.00 70.33 66.56 2nuu n THR 165 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 2nuu h VAL 166 N -1.00 0.57 0.00 2.28 2.07 -1.92 -2.20 116.25 116.05 2nuu h VAL 166 Ca -0.10 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.25 2nuu h VAL 166 Cb 0.80 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.57 2nuu h VAL 166 CO -0.06 0.09 -0.47 0.52 0.02 0.00 0.00 177.57 177.68 2nuu n VAL 167 N -4.95 0.81 0.32 2.57 0.31 -0.83 -4.60 118.33 111.96 2nuu n VAL 167 Ca 0.22 0.29 -0.13 0.00 -0.01 0.00 0.00 64.34 64.71 2nuu n VAL 167 Cb 0.61 -1.87 -0.06 0.00 -0.91 0.00 0.00 33.84 31.61 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 -0.47 -0.78 -0.71 3.52 3.86 -1.41 -1.98 115.15 117.18 2nuu h HIS 168 Ca 0.00 -0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.19 2nuu h HIS 168 Cb 0.47 0.26 -0.03 0.00 1.06 0.00 0.00 27.41 29.16 2nuu h HIS 168 CO -0.20 -0.49 0.44 0.82 0.86 0.00 0.00 177.93 179.37 2nuu h ILE 169 N -1.02 1.20 -0.22 2.45 2.04 -1.26 -0.68 117.51 120.02 2nuu h ILE 169 Ca -0.09 -0.42 0.05 0.00 1.00 0.00 0.00 64.86 65.41 2nuu h ILE 169 Cb 0.64 0.19 -0.05 0.00 -0.74 0.00 0.00 36.82 36.86 2nuu h ILE 169 CO 0.14 0.20 -0.11 -1.13 0.00 0.00 0.00 178.15 177.25 2nuu h ASN 170 N 0.97 -0.38 -0.15 1.72 -1.24 -1.48 -2.03 115.58 113.00 2nuu h ASN 170 Ca 0.26 0.09 -0.10 0.00 0.71 0.00 0.00 56.30 57.26 2nuu h ASN 170 Cb -0.06 0.21 0.00 0.00 0.73 0.00 0.00 38.32 39.20 2nuu h ASN 170 CO -0.05 -0.15 -0.30 0.00 -1.29 0.00 0.00 177.43 175.64 2nuu h ALA 171 N 1.10 0.24 -0.81 1.57 0.00 -1.16 -3.05 119.26 117.15 2nuu h ALA 171 Ca 0.12 -0.41 0.13 0.00 0.00 0.00 0.00 54.91 54.74 2nuu h ALA 171 Cb 0.27 -0.04 -0.09 0.00 0.00 0.00 0.00 17.79 17.94 2nuu h ALA 171 CO -0.28 0.26 0.42 0.00 0.00 0.00 0.00 179.25 179.65 2nuu h ALA 172 N 0.56 1.19 -0.29 0.00 0.00 -0.96 -0.23 119.26 119.51 2nuu h ALA 172 Ca 0.00 0.07 -0.13 0.00 0.00 0.00 0.00 54.91 54.85 2nuu h ALA 172 Cb 0.90 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.65 2nuu h ALA 172 CO 0.07 -0.05 -0.33 0.82 0.00 0.00 0.00 179.25 179.75 2nuu h ILE 173 N 0.64 1.30 -0.67 0.00 1.08 -1.44 -0.31 117.51 118.11 2nuu h ILE 173 Ca 0.43 -1.51 0.06 0.00 -0.39 0.00 0.00 64.86 63.44 2nuu h ILE 173 Cb 0.54 1.59 -0.04 0.00 -3.07 0.00 0.00 36.82 35.83 2nuu h ILE 173 CO -0.32 0.49 0.44 0.00 -0.69 0.00 0.00 178.15 178.07 2nuu h ALA 174 N 0.70 1.72 0.14 1.87 0.00 -1.28 -0.24 119.26 122.17 2nuu h ALA 174 Ca 0.04 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2nuu h ALA 174 Cb 0.92 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.52 2nuu h ALA 174 CO 0.08 0.18 -0.07 0.78 0.00 0.00 0.00 179.25 180.23 2nuu h GLY 175 N 0.71 -0.19 0.20 0.00 0.00 -0.79 -2.39 103.07 100.60 2nuu h GLY 175 Ca 0.28 0.07 0.09 0.00 0.00 0.00 0.00 47.33 47.78 2nuu h GLY 175 CO -0.09 -0.07 -0.02 -2.00 0.00 0.00 0.00 176.54 174.36 2nuu h LEU 176 N -0.62 -0.25 -0.42 3.11 6.46 -0.30 0.18 115.31 123.47 2nuu h LEU 176 Ca -0.02 0.12 0.00 0.00 -0.12 0.00 0.00 57.88 57.86 2nuu h LEU 176 Cb 0.47 0.22 -0.02 0.00 -0.73 0.00 0.00 40.66 40.60 2nuu h LEU 176 CO 0.03 -0.08 0.26 0.58 -0.62 0.00 0.00 178.44 178.61 2nuu h VAL 177 N 0.09 1.12 0.24 1.05 2.07 -1.14 -2.08 116.25 117.61 2nuu h VAL 177 Ca 0.23 -0.26 0.01 0.00 0.82 0.00 0.00 66.70 67.50 2nuu h VAL 177 Cb 0.35 0.55 -0.03 0.00 -1.52 0.00 0.00 31.29 30.64 2nuu h VAL 177 CO -0.41 0.12 -0.34 1.23 0.02 0.00 0.00 177.57 178.20 2nuu h GLY 178 N 0.56 -0.73 0.31 2.17 0.00 -0.65 -1.03 103.07 103.70 2nuu h GLY 178 Ca 0.15 0.39 0.12 0.00 0.00 0.00 0.00 47.33 48.00 2nuu h GLY 178 CO -0.03 -0.27 0.35 0.00 0.00 0.00 0.00 176.54 176.59 2nuu h ALA 179 N -0.09 1.07 -0.44 3.60 0.00 -0.61 -1.39 119.26 121.41 2nuu h ALA 179 Ca 0.00 0.08 -0.11 0.00 0.00 0.00 0.00 54.91 54.88 2nuu h ALA 179 Cb 0.62 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 2nuu h ALA 179 CO -0.12 -0.11 -0.17 1.88 0.00 0.00 0.00 179.25 180.73 2nuu h TYR 180 N 0.56 0.93 -0.01 0.00 0.99 -1.04 -2.52 116.97 115.88 2nuu h TYR 180 Ca 0.40 -0.20 -0.17 0.00 2.00 0.00 0.00 58.73 60.76 2nuu h TYR 180 Cb 0.51 -0.23 -0.02 0.00 1.00 0.00 0.00 36.73 38.00 2nuu h TYR 180 CO -0.12 0.93 -0.77 -0.07 -0.00 0.00 0.00 178.16 178.13 2nuu h LEU 181 N 0.74 0.15 0.00 3.88 3.38 -0.54 -3.27 115.31 119.64 2nuu h LEU 181 Ca 0.11 -0.11 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 2nuu h LEU 181 Cb 0.68 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 2nuu h LEU 181 CO 0.05 0.86 -0.76 0.16 0.09 0.00 0.00 178.44 178.84 2nuu h ILE 182 N 0.08 0.18 0.00 1.22 3.07 -1.29 -3.50 117.51 117.26 2nuu h ILE 182 Ca -0.02 -1.31 0.00 0.00 1.55 0.00 0.00 64.86 65.08 2nuu h ILE 182 Cb 1.35 1.82 0.00 0.00 -0.27 0.00 0.00 36.82 39.72 2nuu h ILE 182 CO 0.11 0.10 0.00 0.61 -1.05 0.00 0.00 178.15 177.92 2nuu n GLY 183 N 1.20 -0.77 3.77 0.16 0.00 -0.95 -4.94 105.19 103.66 2nuu n GLY 183 Ca -0.00 -1.70 -0.34 0.00 0.00 0.00 0.00 46.02 43.98 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 -1.66 3.15 0.67 1.61 1.02 -1.26 -4.83 119.74 118.43 2nuu s LYS 184 Ca 0.00 1.56 -0.16 0.00 0.02 0.00 0.00 55.97 57.39 2nuu s LYS 184 Cb 0.00 -1.98 0.01 0.00 -0.52 0.00 0.00 37.83 35.33 2nuu s LYS 184 CO 0.00 -1.00 1.17 1.03 -0.92 0.00 0.00 175.35 175.63 2nuu s ARG 185 N -3.54 2.58 0.18 1.68 0.52 -1.26 -4.92 118.95 114.18 2nuu s ARG 185 Ca 0.71 1.65 -0.31 0.00 -0.52 0.00 0.00 55.73 57.26 2nuu s ARG 185 Cb -0.23 -1.90 -0.10 0.00 0.52 0.00 0.00 34.95 33.24 2nuu s ARG 185 CO 0.32 -1.47 1.55 0.08 0.02 0.00 0.00 175.30 175.80 2nuu s VAL 186 N -2.00 2.63 0.00 3.52 1.01 -1.26 -1.73 120.40 122.56 2nuu s VAL 186 Ca 0.73 0.46 0.00 0.00 0.00 0.00 0.00 61.98 63.16 2nuu s VAL 186 Cb -0.26 -3.29 0.00 0.00 0.00 0.00 0.00 36.38 32.82 2nuu s VAL 186 CO 0.40 0.04 0.00 0.61 0.00 0.00 0.00 175.10 176.15 2nuu n GLY 187 N 3.55 0.59 3.62 4.51 0.00 -1.26 -4.98 105.19 111.21 2nuu n GLY 187 Ca 0.13 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.72 2nuu n GLY 187 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2nuu s PHE 188 N -2.20 1.45 0.00 1.61 5.36 -0.71 -1.37 117.98 122.13 2nuu s PHE 188 Ca 0.00 0.38 0.00 0.00 -0.96 0.00 0.00 56.93 56.35 2nuu s PHE 188 Cb 0.00 -4.03 0.00 0.00 -0.34 0.00 0.00 43.02 38.65 2nuu s PHE 188 CO 0.00 -3.95 0.00 0.41 -1.46 0.00 0.00 175.22 170.22 2nuu n GLY 189 N 5.31 1.74 0.00 13.12 0.00 -1.26 -4.87 105.19 119.24 2nuu n GLY 189 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.27 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 -1.15 4.20 -4.48 1.61 2.85 -0.66 -5.08 118.16 115.44 2nuu n LYS 190 Ca 0.00 -0.05 -0.23 0.00 -1.05 0.00 0.00 58.31 56.97 2nuu n LYS 190 Cb 0.00 -0.43 -0.10 0.00 -0.65 0.00 0.00 35.03 33.85 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 -0.61 1.67 -0.11 -1.58 2.56 -0.47 -5.11 118.70 115.06 2nuu s GLU 191 Ca 0.00 -1.85 -0.21 0.00 0.00 0.00 0.00 54.97 52.91 2nuu s GLU 191 Cb 0.00 -1.43 -0.04 0.00 2.00 0.00 0.00 34.13 34.66 2nuu s GLU 191 CO 0.00 0.10 0.60 0.00 -0.56 0.00 0.00 175.26 175.40 2nuu s ALA 192 N -2.81 3.42 -0.40 6.30 0.00 -1.26 -4.90 121.76 122.11 2nuu s ALA 192 Ca 0.31 -0.06 0.06 0.00 0.00 0.00 0.00 51.96 52.27 2nuu s ALA 192 Cb 0.03 -2.83 0.43 0.00 0.00 0.00 0.00 23.12 20.75 2nuu s ALA 192 CO 0.14 -0.13 1.11 1.19 0.00 0.00 0.00 175.76 178.08 2nuu n PHE 193 N 3.92 3.14 -2.16 0.00 3.01 -1.26 -5.08 117.46 119.04 2nuu n PHE 193 Ca -0.04 -2.93 -0.36 0.00 1.01 0.00 0.00 57.45 55.13 2nuu n PHE 193 Cb 0.51 -0.14 0.01 0.00 -0.01 0.00 0.00 39.48 39.85 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 -3.53 3.39 0.01 -1.08 1.02 -1.26 -4.89 119.74 113.40 2nuu s LYS 194 Ca 0.47 1.78 -0.33 0.00 0.02 0.00 0.00 55.97 57.90 2nuu s LYS 194 Cb 0.40 -2.15 -0.12 0.00 -0.52 0.00 0.00 37.83 35.45 2nuu s LYS 194 CO -0.13 -0.86 1.82 -2.30 -0.92 0.00 0.00 175.35 172.96 2nuu n PRO 195 N -1.05 2.36 0.18 -1.68 -0.02 -1.25 -4.25 135.00 129.29 2nuu n PRO 195 Ca 0.10 0.86 0.03 0.00 -2.02 0.00 0.00 63.50 62.48 2nuu n PRO 195 Cb 0.49 -2.71 0.36 0.00 -0.02 0.00 0.00 33.50 31.61 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 8.60 0.00 -2.09 6.00 2.07 -1.12 -3.41 115.15 125.21 2nuu h HIS 196 Ca -0.48 0.00 -0.39 0.00 -2.85 0.00 0.00 60.37 56.65 2nuu h HIS 196 Cb 1.26 0.00 -0.33 0.00 2.57 0.00 0.00 27.41 30.91 2nuu h HIS 196 CO 0.82 0.39 -0.70 1.21 -3.07 0.00 0.00 177.93 176.59 2nuu s ASN 197 N -6.77 1.54 0.23 3.10 3.84 -1.09 -4.93 114.94 110.86 2nuu s ASN 197 Ca -0.02 -1.48 -0.03 0.00 0.21 0.00 0.00 52.86 51.54 2nuu s ASN 197 Cb 0.13 0.41 0.23 0.00 -0.55 0.00 0.00 41.25 41.48 2nuu s ASN 197 CO 0.71 -0.30 1.65 -0.07 -2.79 0.00 0.00 177.10 176.31 2nuu h LEU 198 N 7.33 0.75 -1.58 3.21 3.38 -1.79 -2.53 115.31 124.08 2nuu h LEU 198 Ca 0.01 -0.26 0.12 0.00 0.09 0.00 0.00 57.88 57.84 2nuu h LEU 198 Cb 1.05 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 41.55 2nuu h LEU 198 CO 0.24 0.94 0.47 -0.65 0.09 0.00 0.00 178.44 179.53 2nuu h PRO 199 N 0.66 0.43 -0.54 1.13 0.11 -1.96 -0.97 132.00 130.86 2nuu h PRO 199 Ca 0.10 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 66.11 2nuu h PRO 199 Cb 0.69 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 31.68 2nuu h PRO 199 CO 0.05 0.29 0.07 1.98 -0.21 0.00 0.00 178.00 180.18 2nuu h MET 200 N 0.45 0.91 -0.31 1.05 1.85 -1.82 0.59 114.93 117.64 2nuu h MET 200 Ca 0.33 -0.25 0.02 0.00 -0.61 0.00 0.00 59.70 59.19 2nuu h MET 200 Cb 0.69 -0.10 -0.02 0.00 0.43 0.00 0.00 31.60 32.59 2nuu h MET 200 CO -0.10 0.89 0.16 0.28 -0.40 0.00 0.00 176.91 177.73 2nuu h VAL 201 N 0.79 1.00 -0.51 -5.77 2.07 -1.07 0.13 116.25 112.89 2nuu h VAL 201 Ca 0.16 -0.11 0.01 0.00 0.82 0.00 0.00 66.70 67.58 2nuu h VAL 201 Cb 0.43 0.64 -0.03 0.00 -1.52 0.00 0.00 31.29 30.81 2nuu h VAL 201 CO 0.01 0.06 0.34 0.15 0.02 0.00 0.00 177.57 178.15 2nuu h PHE 202 N 0.33 0.64 -0.39 1.57 3.57 -0.89 0.15 116.94 121.92 2nuu h PHE 202 Ca 0.13 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.67 2nuu h PHE 202 Cb 0.04 -0.21 -0.03 0.00 2.79 0.00 0.00 35.95 38.53 2nuu h PHE 202 CO -0.09 0.40 0.20 1.15 -2.23 0.00 0.00 178.31 177.74 2nuu h THR 203 N 0.69 0.99 -0.79 4.41 2.02 -0.37 0.15 112.91 120.00 2nuu h THR 203 Ca 0.19 -0.14 -0.00 0.00 0.77 0.00 0.00 66.41 67.22 2nuu h THR 203 Cb -0.07 0.54 -0.04 0.00 -1.74 0.00 0.00 68.15 66.84 2nuu h THR 203 CO -0.04 0.08 0.49 1.23 0.37 0.00 0.00 175.52 177.64 2nuu h GLY 204 N 0.41 1.14 1.06 2.16 0.00 -0.40 -1.79 103.07 105.66 2nuu h GLY 204 Ca 0.16 -0.47 -0.05 0.00 0.00 0.00 0.00 47.33 46.98 2nuu h GLY 204 CO -0.10 0.45 0.30 -0.84 0.00 0.00 0.00 176.54 176.35 2nuu h THR 205 N 1.08 1.26 -0.44 4.70 2.02 0.09 -2.19 112.91 119.44 2nuu h THR 205 Ca 0.29 -0.84 -0.06 0.00 0.77 0.00 0.00 66.41 66.56 2nuu h THR 205 Cb -0.06 0.33 -0.02 0.00 -1.74 0.00 0.00 68.15 66.67 2nuu h THR 205 CO -0.06 0.34 0.03 0.00 0.37 0.00 0.00 175.52 176.20 2nuu h ALA 206 N 1.17 0.59 -0.36 6.16 0.00 -0.60 -1.16 119.26 125.07 2nuu h ALA 206 Ca 0.26 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 2nuu h ALA 206 Cb 0.23 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2nuu h ALA 206 CO -0.02 0.36 -0.10 0.82 0.00 0.00 0.00 179.25 180.31 2nuu h ILE 207 N 0.61 1.24 -0.35 0.00 2.04 -1.12 -0.74 117.51 119.19 2nuu h ILE 207 Ca 0.13 -1.05 -0.09 0.00 1.00 0.00 0.00 64.86 64.85 2nuu h ILE 207 Cb 0.45 1.07 -0.01 0.00 -0.74 0.00 0.00 36.82 37.60 2nuu h ILE 207 CO 0.02 0.35 -0.13 -0.07 0.00 0.00 0.00 178.15 178.32 2nuu h LEU 208 N 0.56 0.71 0.16 1.44 3.38 -1.28 -0.27 115.31 120.01 2nuu h LEU 208 Ca 0.10 -0.39 -0.00 0.00 0.09 0.00 0.00 57.88 57.69 2nuu h LEU 208 Cb 0.51 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 2nuu h LEU 208 CO 0.03 0.94 -0.13 0.22 0.09 0.00 0.00 178.44 179.59 2nuu h TYR 209 N 0.48 -0.33 -0.39 1.13 3.20 -0.77 0.35 116.97 120.65 2nuu h TYR 209 Ca 0.08 -0.00 -0.07 0.00 3.14 0.00 0.00 58.73 61.88 2nuu h TYR 209 Cb 0.65 0.12 -0.02 0.00 1.54 0.00 0.00 36.73 39.02 2nuu h TYR 209 CO 0.06 -0.20 -0.05 0.82 -1.64 0.00 0.00 178.16 177.15 2nuu h ILE 210 N -0.30 1.23 -0.11 1.81 1.08 -1.14 -2.75 117.51 117.33 2nuu h ILE 210 Ca -0.01 -0.99 -0.13 0.00 -0.39 0.00 0.00 64.86 63.35 2nuu h ILE 210 Cb 0.27 1.00 -0.01 0.00 -3.07 0.00 0.00 36.82 35.00 2nuu h ILE 210 CO -0.01 0.34 -0.50 1.23 -0.69 0.00 0.00 178.15 178.52 2nuu h GLY 211 N 0.94 0.32 1.81 5.37 0.00 -0.71 -3.14 103.07 107.65 2nuu h GLY 211 Ca 0.12 -0.35 0.01 0.00 0.00 0.00 0.00 47.33 47.11 2nuu h GLY 211 CO 0.02 0.31 0.09 -0.25 0.00 0.00 0.00 176.54 176.71 2nuu h TRP 212 N 0.23 0.00 -0.08 5.60 2.91 0.01 -0.89 115.95 123.74 2nuu h TRP 212 Ca 0.01 0.00 -0.12 0.00 1.13 0.00 0.00 58.89 59.91 2nuu h TRP 212 Cb 0.96 0.00 -0.01 0.00 -0.51 0.00 0.00 29.16 29.60 2nuu h TRP 212 CO 0.02 0.00 -0.47 0.74 -1.03 0.00 0.00 178.44 177.70 2nuu h PHE 213 N 0.00 0.25 -0.00 2.65 0.04 -1.63 0.56 116.94 118.80 2nuu h PHE 213 Ca 0.01 -0.07 -0.20 0.00 2.80 0.00 0.00 57.97 60.50 2nuu h PHE 213 Cb 0.19 -0.05 -0.01 0.00 2.20 0.00 0.00 35.95 38.28 2nuu h PHE 213 CO 0.00 0.64 -0.88 0.78 -0.60 0.00 0.00 178.31 178.26 2nuu h GLY 214 N 1.33 0.30 0.69 -1.45 0.00 -1.36 -1.89 103.07 100.69 2nuu h GLY 214 Ca 0.01 -0.53 -0.01 0.00 0.00 0.00 0.00 47.33 46.80 2nuu h GLY 214 CO 0.07 0.46 -0.12 -2.75 0.00 0.00 0.00 176.54 174.20 2nuu h PHE 215 N 0.16 -0.32 0.12 5.60 3.57 -1.06 -2.44 116.94 122.57 2nuu h PHE 215 Ca -0.05 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.43 2nuu h PHE 215 Cb 1.50 0.11 0.00 0.00 2.79 0.00 0.00 35.95 40.35 2nuu h PHE 215 CO 0.04 -0.00 -0.06 -0.91 -2.23 0.00 0.00 178.31 175.15 2nuu h ASN 216 N -0.66 -0.14 -0.85 0.41 2.35 0.03 -3.19 115.58 113.53 2nuu h ASN 216 Ca -0.04 -0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.70 2nuu h ASN 216 Cb 0.46 0.04 -0.04 0.00 0.05 0.00 0.00 38.32 38.83 2nuu h ASN 216 CO 0.06 0.35 0.49 0.00 -1.65 0.00 0.00 177.43 176.67 2nuu h ALA 217 N -1.03 1.25 -0.13 -0.83 0.00 -1.53 -1.59 119.26 115.40 2nuu h ALA 217 Ca -0.02 -0.11 0.04 0.00 0.00 0.00 0.00 54.91 54.82 2nuu h ALA 217 Cb 0.13 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 2nuu h ALA 217 CO 0.03 0.62 0.10 0.78 0.00 0.00 0.00 179.25 180.78 2nuu h GLY 218 N 1.20 0.00 1.97 0.00 0.00 -1.46 -0.76 103.07 104.03 2nuu h GLY 218 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.63 2nuu h GLY 218 CO -0.05 0.00 0.00 1.44 0.00 0.00 0.00 176.54 177.93 2nuu n SER 219 N -4.33 0.00 0.21 0.19 7.64 -0.60 -0.01 113.62 116.73 2nuu n SER 219 Ca 0.00 0.48 0.11 0.00 1.01 0.00 0.00 58.87 60.47 2nuu n SER 219 Cb 0.22 -0.49 0.23 0.00 -1.01 0.00 0.00 64.21 63.16 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 2.17 0.95 0.00 -0.43 0.00 -1.27 -3.47 119.26 117.20 2nuu h ALA 220 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2nuu h ALA 220 Cb 0.08 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2nuu h ALA 220 CO 0.00 0.12 0.00 0.41 0.00 0.00 0.00 179.25 179.78 2nuu n GLY 221 N 0.93 0.76 3.41 0.00 0.00 0.98 -4.94 105.19 106.33 2nuu n GLY 221 Ca 0.03 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.92 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 -3.27 0.02 -1.44 2.61 -1.32 -1.26 -4.75 115.64 106.24 2nuu s THR 222 Ca 0.00 -0.15 -0.09 0.00 -1.21 0.00 0.00 61.69 60.24 2nuu s THR 222 Cb 0.00 -1.01 0.05 0.00 -1.51 0.00 0.00 72.50 70.03 2nuu s THR 222 CO 0.00 -0.08 2.45 0.00 -2.21 0.00 0.00 174.62 174.77 2nuu n ALA 223 N 0.07 6.57 -2.89 11.08 0.00 -1.26 -4.48 120.51 129.60 2nuu n ALA 223 Ca -0.18 -3.92 0.00 0.00 0.00 0.00 0.00 53.44 49.35 2nuu n ALA 223 Cb 0.62 -3.14 0.00 0.00 0.00 0.00 0.00 19.45 16.93 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 3.47 1.03 0.19 0.00 2.04 -1.26 -4.98 115.26 115.76 2nuu n ASN 224 Ca 0.62 -0.37 0.06 0.00 -0.44 0.00 0.00 54.58 54.44 2nuu n ASN 224 Cb 0.29 0.00 0.36 0.00 -2.53 0.00 0.00 39.78 37.90 2nuu n ASN 224 CO 0.00 0.00 0.00 1.05 -0.44 0.00 0.00 177.26 177.87 2nuu h GLU 225 N 0.00 0.00 -0.14 -3.83 9.09 -1.99 -2.32 114.58 115.38 2nuu h GLU 225 Ca 0.00 0.00 -0.13 0.00 0.05 0.00 0.00 59.36 59.28 2nuu h GLU 225 Cb 0.00 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.09 2nuu h GLU 225 CO 0.00 0.37 -0.49 0.82 0.05 0.00 0.00 179.01 179.76 2nuu h ILE 226 N 0.00 1.33 -0.38 -1.06 1.08 -1.95 -1.44 117.51 115.09 2nuu h ILE 226 Ca -0.00 -1.72 -0.07 0.00 -0.39 0.00 0.00 64.86 62.68 2nuu h ILE 226 Cb 0.84 1.76 -0.01 0.00 -3.07 0.00 0.00 36.82 36.33 2nuu h ILE 226 CO 0.05 0.52 -0.02 0.00 -0.69 0.00 0.00 178.15 178.00 2nuu h ALA 227 N 1.18 0.52 -0.80 1.87 0.00 -1.69 -1.37 119.26 118.96 2nuu h ALA 227 Ca 0.01 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.62 2nuu h ALA 227 Cb 0.97 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.59 2nuu h ALA 227 CO 0.08 0.31 0.36 0.00 0.00 0.00 0.00 179.25 180.01 2nuu h ALA 228 N 0.86 1.13 0.23 0.00 0.00 -1.21 -0.26 119.26 120.01 2nuu h ALA 228 Ca 0.11 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 2nuu h ALA 228 Cb 0.51 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.98 2nuu h ALA 228 CO 0.02 0.65 -0.11 1.25 0.00 0.00 0.00 179.25 181.06 2nuu h LEU 229 N 1.15 -0.27 -0.79 0.00 5.85 -1.14 -1.55 115.31 118.56 2nuu h LEU 229 Ca 0.27 -0.18 0.08 0.00 0.84 0.00 0.00 57.88 58.89 2nuu h LEU 229 Cb 0.15 0.07 -0.07 0.00 0.37 0.00 0.00 40.66 41.18 2nuu h LEU 229 CO -0.03 0.05 0.46 0.00 -0.34 0.00 0.00 178.44 178.57 2nuu h ALA 230 N 0.09 1.11 0.34 1.25 0.00 -1.14 0.96 119.26 121.87 2nuu h ALA 230 Ca -0.03 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2nuu h ALA 230 Cb 0.43 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2nuu h ALA 230 CO 0.05 0.12 -0.22 0.35 0.00 0.00 0.00 179.25 179.55 2nuu h PHE 231 N 0.80 -0.58 -0.62 0.00 3.04 -0.95 -0.80 116.94 117.83 2nuu h PHE 231 Ca 0.37 -0.01 -0.00 0.00 3.98 0.00 0.00 57.97 62.31 2nuu h PHE 231 Cb 0.29 0.21 -0.03 0.00 2.56 0.00 0.00 35.95 38.97 2nuu h PHE 231 CO -0.06 -0.34 0.37 0.28 -2.02 0.00 0.00 178.31 176.54 2nuu h VAL 232 N -0.55 1.18 0.00 1.41 2.07 -0.66 -2.05 116.25 117.65 2nuu h VAL 232 Ca -0.03 -0.40 -0.03 0.00 0.82 0.00 0.00 66.70 67.05 2nuu h VAL 232 Cb 0.46 0.33 -0.00 0.00 -1.52 0.00 0.00 31.29 30.55 2nuu h VAL 232 CO 0.03 0.19 -0.15 0.78 0.02 0.00 0.00 177.57 178.43 2nuu h ASN 233 N 0.84 0.00 0.02 0.57 2.35 -0.71 -0.57 115.58 118.08 2nuu h ASN 233 Ca 0.22 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.97 2nuu h ASN 233 Cb -0.03 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.34 2nuu h ASN 233 CO -0.04 0.15 -0.01 0.74 -1.65 0.00 0.00 177.43 176.62 2nuu h THR 234 N 0.00 1.28 0.01 2.81 2.02 -0.48 -0.92 112.91 117.64 2nuu h THR 234 Ca -0.00 -0.94 0.02 0.00 0.77 0.00 0.00 66.41 66.25 2nuu h THR 234 Cb 0.29 1.91 -0.02 0.00 -1.74 0.00 0.00 68.15 68.59 2nuu h THR 234 CO 0.02 0.24 -0.11 0.58 0.37 0.00 0.00 175.52 176.62 2nuu h VAL 235 N -0.44 0.73 0.03 3.16 2.07 -0.88 -2.63 116.25 118.30 2nuu h VAL 235 Ca -0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2nuu h VAL 235 Cb 0.42 0.73 -0.00 0.00 -1.52 0.00 0.00 31.29 30.92 2nuu h VAL 235 CO 0.00 0.00 -0.02 0.58 0.02 0.00 0.00 177.57 178.15 2nuu h VAL 236 N -0.19 0.94 -0.75 2.57 2.07 -1.11 -2.26 116.25 117.52 2nuu h VAL 236 Ca 0.04 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.51 2nuu h VAL 236 Cb 0.24 0.94 -0.03 0.00 -1.52 0.00 0.00 31.29 30.92 2nuu h VAL 236 CO -0.10 0.00 0.30 0.00 0.02 0.00 0.00 177.57 177.79 2nuu h ALA 237 N 0.91 0.98 -0.37 1.67 0.00 -1.18 -0.92 119.26 120.35 2nuu h ALA 237 Ca -0.00 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 2nuu h ALA 237 Cb 0.05 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 2nuu h ALA 237 CO -0.00 0.60 0.21 1.15 0.00 0.00 0.00 179.25 181.21 2nuu h THR 238 N 1.09 1.14 -0.47 0.00 2.02 -1.41 0.20 112.91 115.47 2nuu h THR 238 Ca 0.25 -0.36 -0.04 0.00 0.77 0.00 0.00 66.41 67.03 2nuu h THR 238 Cb 0.21 0.70 -0.02 0.00 -1.74 0.00 0.00 68.15 67.30 2nuu h THR 238 CO -0.02 0.15 0.14 0.00 0.37 0.00 0.00 175.52 176.15 2nuu h ALA 239 N 1.07 0.62 -0.67 6.16 0.00 -1.20 -1.16 119.26 124.08 2nuu h ALA 239 Ca 0.13 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 2nuu h ALA 239 Cb 0.05 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 2nuu h ALA 239 CO -0.02 0.29 0.30 0.00 0.00 0.00 0.00 179.25 179.82 2nuu h ALA 240 N 1.00 0.86 -0.30 0.00 0.00 -0.86 -2.27 119.26 117.69 2nuu h ALA 240 Ca 0.15 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 2nuu h ALA 240 Cb 0.29 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2nuu h ALA 240 CO -0.00 0.45 0.03 0.00 0.00 0.00 0.00 179.25 179.72 2nuu h ALA 241 N 1.14 0.41 -0.08 0.00 0.00 -0.47 -0.31 119.26 119.94 2nuu h ALA 241 Ca 0.23 -0.21 0.04 0.00 0.00 0.00 0.00 54.91 54.96 2nuu h ALA 241 Cb 0.15 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 2nuu h ALA 241 CO -0.03 0.13 -0.15 0.82 0.00 0.00 0.00 179.25 180.02 2nuu h ILE 242 N 0.33 0.60 -0.38 0.00 2.04 -1.05 -0.17 117.51 118.87 2nuu h ILE 242 Ca 0.09 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.91 2nuu h ILE 242 Cb 0.39 0.60 -0.02 0.00 -0.74 0.00 0.00 36.82 37.05 2nuu h ILE 242 CO 0.01 0.00 0.06 -0.07 0.00 0.00 0.00 178.15 178.15 2nuu h LEU 243 N -0.21 0.53 0.16 1.44 3.38 -1.34 -1.09 115.31 118.18 2nuu h LEU 243 Ca 0.08 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 2nuu h LEU 243 Cb 0.33 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.94 2nuu h LEU 243 CO -0.21 0.56 -0.08 1.23 0.09 0.00 0.00 178.44 180.04 2nuu h GLY 244 N 0.82 -0.22 0.99 0.83 0.00 -0.20 -0.05 103.07 105.24 2nuu h GLY 244 Ca 0.13 0.08 -0.06 0.00 0.00 0.00 0.00 47.33 47.48 2nuu h GLY 244 CO 0.00 -0.08 0.10 -0.25 0.00 0.00 0.00 176.54 176.31 2nuu h TRP 245 N -0.38 0.90 -0.29 5.60 2.91 -0.95 0.62 115.95 124.37 2nuu h TRP 245 Ca -0.02 -0.12 -0.01 0.00 1.13 0.00 0.00 58.89 59.87 2nuu h TRP 245 Cb 0.30 -0.25 -0.01 0.00 -0.51 0.00 0.00 29.16 28.68 2nuu h TRP 245 CO -0.02 0.80 0.13 0.82 -1.03 0.00 0.00 178.44 179.15 2nuu h ILE 246 N 0.73 1.16 0.00 2.65 1.08 -1.16 0.32 117.51 122.30 2nuu h ILE 246 Ca 0.16 -0.47 -0.09 0.00 -0.39 0.00 0.00 64.86 64.07 2nuu h ILE 246 Cb 0.38 0.93 -0.01 0.00 -3.07 0.00 0.00 36.82 35.05 2nuu h ILE 246 CO 0.01 0.16 -0.45 -0.26 -0.69 0.00 0.00 178.15 176.92 2nuu h PHE 247 N 0.33 0.00 0.00 1.37 0.04 -0.93 -1.07 116.94 116.68 2nuu h PHE 247 Ca 0.10 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.87 2nuu h PHE 247 Cb 0.14 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.29 2nuu h PHE 247 CO -0.02 0.45 -0.00 0.78 -0.60 0.00 0.00 178.31 178.92 2nuu h GLY 248 N 2.19 -0.01 1.03 -1.45 0.00 -0.42 -2.29 103.07 102.13 2nuu h GLY 248 Ca -0.00 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 2nuu h GLY 248 CO 0.06 -0.00 0.39 0.83 0.00 0.00 0.00 176.54 177.82 2nuu h GLU 249 N -0.31 1.17 -0.94 4.80 5.08 -0.25 -2.01 114.58 122.13 2nuu h GLU 249 Ca -0.00 -0.17 0.03 0.00 -1.00 0.00 0.00 59.36 58.22 2nuu h GLU 249 Cb 0.30 -0.21 -0.05 0.00 0.50 0.00 0.00 28.75 29.29 2nuu h GLU 249 CO 0.00 0.90 0.61 2.35 -1.00 0.00 0.00 179.01 181.87 2nuu h TRP 250 N 1.16 1.14 0.00 4.33 2.91 -1.11 0.55 115.95 124.93 2nuu h TRP 250 Ca 0.28 0.03 -0.13 0.00 1.13 0.00 0.00 58.89 60.20 2nuu h TRP 250 Cb 0.12 -0.38 -0.02 0.00 -0.51 0.00 0.00 29.16 28.37 2nuu h TRP 250 CO 0.01 0.66 -0.61 0.00 -1.03 0.00 0.00 178.44 177.47 2nuu h ALA 251 N 1.38 0.80 0.00 2.65 0.00 -1.10 -1.15 119.26 121.84 2nuu h ALA 251 Ca 0.37 -0.56 -0.17 0.00 0.00 0.00 0.00 54.91 54.55 2nuu h ALA 251 Cb -0.00 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 2nuu h ALA 251 CO -0.12 0.76 -1.04 -0.07 0.00 0.00 0.00 179.25 178.78 2nuu h LEU 252 N 0.00 0.00 -1.29 0.00 4.07 -0.86 -3.42 115.31 113.81 2nuu h LEU 252 Ca -0.01 -0.43 0.00 0.00 0.08 0.00 0.00 57.88 57.53 2nuu h LEU 252 Cb 1.23 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.97 2nuu h LEU 252 CO 0.08 1.31 -0.09 -2.11 -1.08 0.00 0.00 178.44 176.56 2nuu n ARG 253 N -4.48 1.22 -0.52 1.13 1.85 0.14 -5.02 116.66 110.98 2nuu n ARG 253 Ca -0.26 -1.11 0.00 0.00 -1.00 0.00 0.00 57.85 55.48 2nuu n ARG 253 Cb 0.58 -1.23 0.00 0.00 -1.05 0.00 0.00 32.46 30.76 2nuu n ARG 253 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2nuu n GLY 254 N 0.85 1.04 3.02 2.89 0.00 -0.43 -5.01 105.19 107.54 2nuu n GLY 254 Ca 0.07 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.97 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 -0.35 0.17 -0.09 1.61 1.02 -1.26 -4.92 119.74 115.91 2nuu s LYS 255 Ca 0.00 0.21 -0.28 0.00 0.02 0.00 0.00 55.97 55.92 2nuu s LYS 255 Cb 0.00 0.07 -0.02 0.00 -0.52 0.00 0.00 37.83 37.36 2nuu s LYS 255 CO 0.00 -0.03 0.91 -1.25 -0.92 0.00 0.00 175.35 174.06 2nuu s PRO 256 N 0.13 4.43 0.27 -1.68 0.04 -1.26 -3.94 135.00 132.98 2nuu s PRO 256 Ca -0.00 1.22 0.09 0.00 0.04 0.00 0.00 61.00 62.34 2nuu s PRO 256 Cb -0.02 -3.52 -0.04 0.00 0.04 0.00 0.00 34.50 30.97 2nuu s PRO 256 CO -0.00 -0.19 0.06 -1.54 0.04 0.00 0.00 177.00 175.37 2nuu s SER 257 N 1.04 4.79 0.01 6.66 1.04 -1.26 -5.04 113.70 120.94 2nuu s SER 257 Ca 0.45 -0.57 -0.25 0.00 0.48 0.00 0.00 55.95 56.06 2nuu s SER 257 Cb -0.18 -0.96 -0.18 0.00 0.10 0.00 0.00 66.02 64.79 2nuu s SER 257 CO 0.19 -0.05 1.32 0.25 0.98 0.00 0.00 173.24 175.93 2nuu h LEU 258 N 1.75 -0.12 -1.96 2.42 5.85 -1.99 -1.12 115.31 120.14 2nuu h LEU 258 Ca -0.45 -0.30 0.13 0.00 0.84 0.00 0.00 57.88 58.10 2nuu h LEU 258 Cb 1.25 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 42.29 2nuu h LEU 258 CO 0.61 0.25 0.33 0.25 -0.34 0.00 0.00 178.44 179.54 2nuu h LEU 259 N -0.51 0.04 -0.34 2.25 5.85 -1.96 0.87 115.31 121.50 2nuu h LEU 259 Ca -0.01 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.64 2nuu h LEU 259 Cb 0.42 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.43 2nuu h LEU 259 CO 0.02 0.02 -0.05 1.23 -0.34 0.00 0.00 178.44 179.33 2nuu h GLY 260 N 0.04 0.68 1.19 3.75 0.00 -1.86 -1.34 103.07 105.54 2nuu h GLY 260 Ca 0.22 -0.54 -0.11 0.00 0.00 0.00 0.00 47.33 46.91 2nuu h GLY 260 CO -0.01 0.50 -0.10 0.00 0.00 0.00 0.00 176.54 176.92 2nuu h ALA 261 N 0.83 0.85 -0.34 3.60 0.00 0.38 -1.27 119.26 123.31 2nuu h ALA 261 Ca 0.09 -0.34 -0.08 0.00 0.00 0.00 0.00 54.91 54.58 2nuu h ALA 261 Cb 0.53 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 2nuu h ALA 261 CO 0.03 0.65 -0.11 0.00 0.00 0.00 0.00 179.25 179.81 2nuu h SER 263 N 0.45 1.10 -0.43 0.00 0.02 -1.15 -2.07 113.55 111.47 2nuu h SER 263 Ca 0.08 -0.13 0.00 0.00 -0.84 0.00 0.00 61.79 60.91 2nuu h SER 263 Cb 0.63 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.86 2nuu h SER 263 CO 0.04 0.92 0.29 1.23 -1.14 0.00 0.00 176.83 178.16 2nuu h GLY 264 N 1.21 0.61 0.69 -3.77 0.00 -1.04 -0.54 103.07 100.24 2nuu h GLY 264 Ca 0.29 -0.23 0.06 0.00 0.00 0.00 0.00 47.33 47.46 2nuu h GLY 264 CO -0.04 0.22 0.45 0.00 0.00 0.00 0.00 176.54 177.17 2nuu h ALA 265 N 1.16 1.03 -0.25 3.60 0.00 -0.66 -1.29 119.26 122.85 2nuu h ALA 265 Ca 0.16 0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.90 2nuu h ALA 265 Cb -0.07 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.55 2nuu h ALA 265 CO -0.03 0.15 -0.54 0.82 0.00 0.00 0.00 179.25 179.65 2nuu h ILE 266 N 0.82 1.29 -0.65 0.00 1.08 -1.03 -2.22 117.51 116.80 2nuu h ILE 266 Ca 0.34 -1.75 0.04 0.00 -0.39 0.00 0.00 64.86 63.10 2nuu h ILE 266 Cb 0.19 1.68 -0.05 0.00 -3.07 0.00 0.00 36.82 35.56 2nuu h ILE 266 CO -0.18 0.56 0.38 0.00 -0.69 0.00 0.00 178.15 178.22 2nuu h ALA 267 N 0.81 0.86 -0.49 1.87 0.00 -0.62 0.24 119.26 121.93 2nuu h ALA 267 Ca 0.01 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 2nuu h ALA 267 Cb 1.13 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 2nuu h ALA 267 CO 0.11 0.09 0.01 0.78 0.00 0.00 0.00 179.25 180.24 2nuu h GLY 268 N 0.72 0.92 1.54 0.00 0.00 -1.15 -0.82 103.07 104.28 2nuu h GLY 268 Ca 0.28 -0.67 -0.10 0.00 0.00 0.00 0.00 47.33 46.83 2nuu h GLY 268 CO -0.15 0.62 -0.26 1.41 0.00 0.00 0.00 176.54 178.17 2nuu h LEU 269 N 0.71 0.54 -0.14 3.11 3.38 -0.95 -0.60 115.31 121.37 2nuu h LEU 269 Ca 0.14 -0.19 -0.08 0.00 0.09 0.00 0.00 57.88 57.84 2nuu h LEU 269 Cb 0.50 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.10 2nuu h LEU 269 CO 0.02 0.79 -0.23 0.58 0.09 0.00 0.00 178.44 179.69 2nuu h VAL 270 N 0.47 1.37 -0.33 1.22 2.07 -0.85 -2.31 116.25 117.89 2nuu h VAL 270 Ca 0.07 -1.48 0.00 0.00 0.82 0.00 0.00 66.70 66.11 2nuu h VAL 270 Cb 0.70 2.00 -0.02 0.00 -1.52 0.00 0.00 31.29 32.45 2nuu h VAL 270 CO 0.05 0.44 0.21 1.23 0.02 0.00 0.00 177.57 179.52 2nuu h GLY 271 N -0.00 0.46 2.00 2.17 0.00 -0.97 -2.64 103.07 104.09 2nuu h GLY 271 Ca 0.01 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.17 2nuu h GLY 271 CO 0.05 0.16 0.00 1.55 0.00 0.00 0.00 176.54 178.31 2nuu n VAL 272 N -4.86 0.64 -0.07 4.60 3.14 -0.25 -4.22 118.33 117.32 2nuu n VAL 272 Ca -0.01 -0.13 -0.10 0.00 -2.96 0.00 0.00 64.34 61.15 2nuu n VAL 272 Cb 0.03 -0.75 -0.03 0.00 -1.06 0.00 0.00 33.84 32.02 2nuu n VAL 272 CO 0.00 0.00 0.00 0.74 -6.46 0.00 0.00 176.83 171.11 2nuu h THR 273 N 0.00 0.21 0.00 1.55 2.02 -1.02 0.70 112.91 116.37 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 0.62 0.21 0.00 0.00 -1.74 0.00 0.00 68.15 67.24 2nuu h THR 273 CO 0.00 0.00 0.00 -0.81 0.37 0.00 0.00 175.52 175.08 2nuu n PRO 274 N -5.42 0.12 -0.04 6.66 -0.04 -1.26 -1.08 135.00 133.95 2nuu n PRO 274 Ca -0.01 0.21 -0.00 0.00 -0.04 0.00 0.00 63.50 63.66 2nuu n PRO 274 Cb 0.34 -1.68 -0.12 0.00 -0.04 0.00 0.00 33.50 32.00 2nuu n PRO 274 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2nuu n ALA 275 N -1.65 2.09 -0.24 0.55 0.00 -0.54 -1.73 120.51 118.99 2nuu n ALA 275 Ca 0.05 -0.69 0.17 0.00 0.00 0.00 0.00 53.44 52.97 2nuu n ALA 275 Cb 0.31 -0.29 0.33 0.00 0.00 0.00 0.00 19.45 19.79 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 -1.27 -1.18 0.00 0.00 0.00 -1.26 -3.38 105.19 98.11 2nuu n GLY 277 Ca 0.23 -0.35 0.06 0.00 0.00 0.00 0.00 46.02 45.95 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 -1.40 0.00 -4.43 1.61 4.01 0.78 -4.89 117.16 112.84 2nuu n TYR 278 Ca 0.06 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.54 2nuu n TYR 278 Cb 0.34 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 39.27 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 -2.20 2.14 0.59 -0.72 -4.36 -0.98 -1.72 121.20 113.95 2nuu s ILE 279 Ca 0.05 -1.90 -0.01 0.00 -0.26 0.00 0.00 60.65 58.53 2nuu s ILE 279 Cb 0.10 -2.98 0.04 0.00 1.25 0.00 0.00 42.46 40.86 2nuu s ILE 279 CO 0.52 -0.01 0.84 -0.83 0.24 0.00 0.00 174.94 175.70 2nuu s GLY 280 N -3.78 1.77 0.29 6.27 0.00 -0.86 -4.82 107.32 106.19 2nuu s GLY 280 Ca 0.37 -1.19 0.01 0.00 0.00 0.00 0.00 44.72 43.91 2nuu s GLY 280 CO 0.20 -0.87 1.87 -0.24 0.00 0.00 0.00 173.10 174.05 2nuu h VAL 281 N -0.12 0.98 -0.72 1.40 3.04 -1.94 -1.25 116.25 117.64 2nuu h VAL 281 Ca -0.43 -0.35 -0.02 0.00 -1.01 0.00 0.00 66.70 64.90 2nuu h VAL 281 Cb 1.30 -0.12 -0.03 0.00 -2.01 0.00 0.00 31.29 30.42 2nuu h VAL 281 CO 0.55 0.19 0.39 1.23 -1.01 0.00 0.00 177.57 178.92 2nuu h GLY 282 N 1.02 1.08 1.83 3.17 0.00 -1.93 -1.86 103.07 106.38 2nuu h GLY 282 Ca 0.46 -0.50 -0.07 0.00 0.00 0.00 0.00 47.33 47.22 2nuu h GLY 282 CO -0.21 0.47 -0.27 -1.33 0.00 0.00 0.00 176.54 175.20 2nuu h GLY 283 N 1.00 0.21 1.06 4.60 0.00 -1.48 -2.56 103.07 105.90 2nuu h GLY 283 Ca 0.25 -0.16 -0.10 0.00 0.00 0.00 0.00 47.33 47.32 2nuu h GLY 283 CO -0.04 0.15 -0.07 0.00 0.00 0.00 0.00 176.54 176.58 2nuu h ALA 284 N 1.55 0.72 -0.38 3.60 0.00 -0.65 -0.27 119.26 123.84 2nuu h ALA 284 Ca 0.03 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 2nuu h ALA 284 Cb 0.58 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 2nuu h ALA 284 CO 0.04 0.60 0.21 1.25 0.00 0.00 0.00 179.25 181.35 2nuu h LEU 285 N 0.86 0.48 0.75 0.00 6.46 -1.07 -0.49 115.31 122.30 2nuu h LEU 285 Ca 0.14 -0.09 -0.04 0.00 -0.12 0.00 0.00 57.88 57.77 2nuu h LEU 285 Cb 0.62 -0.12 0.01 0.00 -0.73 0.00 0.00 40.66 40.44 2nuu h LEU 285 CO 0.04 0.44 -0.36 0.40 -0.62 0.00 0.00 178.44 178.34 2nuu h ILE 286 N 0.49 0.00 -0.87 4.05 2.04 -1.29 -2.10 117.51 119.82 2nuu h ILE 286 Ca 0.13 -0.18 0.21 0.00 1.00 0.00 0.00 64.86 66.03 2nuu h ILE 286 Cb 0.06 0.00 -0.12 0.00 -0.74 0.00 0.00 36.82 36.02 2nuu h ILE 286 CO -0.02 0.00 0.34 0.40 0.00 0.00 0.00 178.15 178.87 2nuu h ILE 287 N -1.18 0.47 -0.07 -0.67 2.04 -1.04 -0.31 117.51 116.75 2nuu h ILE 287 Ca -0.10 -0.13 0.02 0.00 1.00 0.00 0.00 64.86 65.65 2nuu h ILE 287 Cb 0.77 0.08 -0.02 0.00 -0.74 0.00 0.00 36.82 36.91 2nuu h ILE 287 CO 0.17 0.07 -0.03 1.23 0.00 0.00 0.00 178.15 179.59 2nuu h GLY 288 N 0.37 0.04 0.84 5.37 0.00 -1.01 0.13 103.07 108.80 2nuu h GLY 288 Ca 0.53 0.03 -0.00 0.00 0.00 0.00 0.00 47.33 47.89 2nuu h GLY 288 CO -0.53 -0.04 0.00 -2.08 0.00 0.00 0.00 176.54 173.89 2nuu h VAL 289 N -0.01 1.13 -0.20 4.60 2.07 -0.46 -1.41 116.25 121.96 2nuu h VAL 289 Ca 0.04 -0.39 0.05 0.00 0.82 0.00 0.00 66.70 67.21 2nuu h VAL 289 Cb 0.07 1.40 -0.05 0.00 -1.52 0.00 0.00 31.29 31.19 2nuu h VAL 289 CO -0.08 0.10 -0.09 0.58 0.02 0.00 0.00 177.57 178.11 2nuu h VAL 290 N -0.16 0.71 -0.97 2.57 2.07 -0.94 -1.73 116.25 117.80 2nuu h VAL 290 Ca 0.00 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.55 2nuu h VAL 290 Cb 0.17 0.71 -0.05 0.00 -1.52 0.00 0.00 31.29 30.60 2nuu h VAL 290 CO -0.00 0.00 0.64 0.00 0.02 0.00 0.00 177.57 178.23 2nuu h ALA 291 N 1.13 1.36 -0.30 1.67 0.00 -0.70 0.21 119.26 122.62 2nuu h ALA 291 Ca 0.11 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.98 2nuu h ALA 291 Cb 0.22 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2nuu h ALA 291 CO -0.24 0.55 0.18 0.78 0.00 0.00 0.00 179.25 180.52 2nuu h GLY 292 N 1.24 0.41 1.39 0.00 0.00 -0.56 -0.03 103.07 105.54 2nuu h GLY 292 Ca 0.38 -0.14 -0.21 0.00 0.00 0.00 0.00 47.33 47.36 2nuu h GLY 292 CO -0.11 0.12 -0.81 1.41 0.00 0.00 0.00 176.54 177.16 2nuu h LEU 293 N 0.37 0.71 -1.01 3.11 3.38 -0.84 -3.08 115.31 117.94 2nuu h LEU 293 Ca 0.12 -0.49 -0.03 0.00 0.09 0.00 0.00 57.88 57.57 2nuu h LEU 293 Cb -0.01 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.50 2nuu h LEU 293 CO -0.05 1.27 0.33 0.00 0.09 0.00 0.00 178.44 180.07 2nuu h ALA 294 N 0.71 1.23 -0.43 1.53 0.00 -0.30 -2.00 119.26 120.00 2nuu h ALA 294 Ca -0.05 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.64 2nuu h ALA 294 Cb 1.42 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.90 2nuu h ALA 294 CO 0.15 0.58 0.04 0.78 0.00 0.00 0.00 179.25 180.80 2nuu h GLY 295 N 1.08 0.79 0.78 0.00 0.00 -1.04 0.18 103.07 104.85 2nuu h GLY 295 Ca 0.25 -0.55 0.03 0.00 0.00 0.00 0.00 47.33 47.05 2nuu h GLY 295 CO -0.03 0.51 0.07 -2.00 0.00 0.00 0.00 176.54 175.09 2nuu h LEU 296 N 0.58 0.07 -0.90 3.11 5.85 -1.39 0.88 115.31 123.50 2nuu h LEU 296 Ca 0.13 0.03 -0.06 0.00 0.84 0.00 0.00 57.88 58.81 2nuu h LEU 296 Cb 0.43 0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.46 2nuu h LEU 296 CO 0.01 0.07 0.12 -0.25 -0.34 0.00 0.00 178.44 178.06 2nuu h TRP 297 N 0.18 0.97 -0.88 1.25 7.01 -1.27 -2.07 115.95 121.14 2nuu h TRP 297 Ca 0.11 -0.11 0.03 0.00 2.11 0.00 0.00 58.89 61.03 2nuu h TRP 297 Cb 0.09 -0.28 -0.05 0.00 -2.10 0.00 0.00 29.16 26.82 2nuu h TRP 297 CO -0.13 0.82 0.57 0.78 -2.79 0.00 0.00 178.44 177.68 2nuu h GLY 298 N 1.02 1.28 -0.63 2.65 0.00 0.84 -1.57 103.07 106.65 2nuu h GLY 298 Ca 0.19 -0.44 0.00 0.00 0.00 0.00 0.00 47.33 47.08 2nuu h GLY 298 CO 0.00 0.38 -0.08 3.33 0.00 0.00 0.00 176.54 180.18 2nuu n VAL 299 N -4.52 0.00 0.00 4.60 0.24 0.16 -2.78 118.33 116.03 2nuu n VAL 299 Ca 0.11 -0.27 0.00 0.00 -2.04 0.00 0.00 64.34 62.14 2nuu n VAL 299 Cb 0.08 0.71 0.00 0.00 -1.47 0.00 0.00 33.84 33.16 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 0.22 0.00 0.08 3.34 -1.04 -0.79 -4.67 114.28 111.41 2nuu n THR 300 Ca 0.16 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 62.05 2nuu n THR 300 Cb 0.41 -0.27 -0.06 0.00 -1.82 0.00 0.00 70.33 68.59 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 0.00 -0.18 -0.77 -2.82 2.07 -1.59 -2.94 114.93 108.69 2nuu h MET 301 Ca 0.00 0.01 -0.02 0.00 -2.07 0.00 0.00 59.70 57.62 2nuu h MET 301 Cb 0.00 0.04 -0.04 0.00 -1.87 0.00 0.00 31.60 29.74 2nuu h MET 301 CO 0.00 -0.12 0.39 1.25 1.07 0.00 0.00 176.91 179.50 2nuu h LEU 302 N -0.19 0.99 -0.24 1.22 5.85 -1.48 -2.55 115.31 118.92 2nuu h LEU 302 Ca 0.02 -0.12 0.02 0.00 0.84 0.00 0.00 57.88 58.63 2nuu h LEU 302 Cb 0.20 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 2nuu h LEU 302 CO -0.05 0.83 0.11 0.50 -0.34 0.00 0.00 178.44 179.49 2nuu h LYS 303 N 1.08 0.22 0.00 1.25 3.64 -1.42 -1.60 116.57 119.75 2nuu h LYS 303 Ca 0.27 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.59 2nuu h LYS 303 Cb 0.09 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.85 2nuu h LYS 303 CO -0.04 0.15 -0.19 0.07 -2.27 0.00 0.00 179.45 177.18 2nuu h ARG 304 N 0.23 0.00 -0.07 1.90 -0.00 -1.37 -1.84 114.38 113.22 2nuu h ARG 304 Ca 0.10 0.00 -0.21 0.00 -0.00 0.00 0.00 59.98 59.87 2nuu h ARG 304 Cb 0.04 0.00 0.01 0.00 -0.00 0.00 0.00 29.97 30.03 2nuu h ARG 304 CO -0.08 0.19 -0.77 1.25 -0.00 0.00 0.00 179.97 180.55 2nuu h LEU 305 N 0.00 0.80 -0.72 0.08 5.85 -1.14 -3.21 115.31 116.97 2nuu h LEU 305 Ca -0.00 -0.69 -0.01 0.00 0.84 0.00 0.00 57.88 58.02 2nuu h LEU 305 Cb 0.65 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 41.44 2nuu h LEU 305 CO 0.02 1.37 -0.04 -0.07 -0.34 0.00 0.00 178.44 179.39 2nuu h LEU 306 N 0.29 0.00 -1.64 2.25 3.38 -1.06 -3.48 115.31 115.05 2nuu h LEU 306 Ca -0.08 0.00 -0.42 0.00 0.09 0.00 0.00 57.88 57.47 2nuu h LEU 306 Cb 1.43 0.00 0.05 0.00 0.09 0.00 0.00 40.66 42.23 2nuu h LEU 306 CO 0.16 0.04 -0.81 0.54 0.09 0.00 0.00 178.44 178.45 2nuu n ARG 307 N -3.12 -5.16 -5.16 1.13 1.74 -0.71 -5.01 116.66 100.37 2nuu n ARG 307 Ca 0.02 0.63 -0.29 0.00 -0.77 0.00 0.00 57.85 57.44 2nuu n ARG 307 Cb 0.43 -5.27 -0.16 0.00 -1.02 0.00 0.00 32.46 26.44 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 -3.60 1.89 -0.83 1.55 1.01 -1.25 -5.05 120.40 114.13 2nuu s VAL 308 Ca 0.11 -1.04 -0.19 0.00 0.00 0.00 0.00 61.98 60.85 2nuu s VAL 308 Cb -0.05 -1.57 0.12 0.00 0.00 0.00 0.00 36.38 34.87 2nuu s VAL 308 CO 0.81 0.51 1.02 -0.62 0.00 0.00 0.00 175.10 176.82 2nuu s ASP 309 N -0.62 6.48 -0.74 3.32 2.15 -1.26 -4.93 116.67 121.08 2nuu s ASP 309 Ca 0.09 -1.78 -0.01 0.00 0.43 0.00 0.00 52.55 51.29 2nuu s ASP 309 Cb -0.09 -2.38 0.18 0.00 -0.30 0.00 0.00 42.92 40.33 2nuu s ASP 309 CO -0.01 -1.13 0.57 -0.62 -0.17 0.00 0.00 175.17 173.82 2nuu s ASP 310 N 3.57 5.39 0.56 -0.34 -1.08 -1.26 -4.81 116.67 118.69 2nuu s ASP 310 Ca 0.27 -3.38 0.26 0.00 -0.52 0.00 0.00 52.55 49.18 2nuu s ASP 310 Cb -0.10 -1.82 1.51 0.00 -1.46 0.00 0.00 42.92 41.05 2nuu s ASP 310 CO -0.03 -0.24 2.05 -0.65 0.52 0.00 0.00 175.17 176.82 2nuu h PRO 311 N 6.30 0.00 -0.31 4.34 0.11 -1.77 0.80 132.00 141.47 2nuu h PRO 311 Ca 0.08 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.19 2nuu h PRO 311 Cb 0.86 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.97 2nuu h PRO 311 CO 0.77 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.56 2nuu n ASP 313 N 0.62 -1.82 -0.13 0.00 8.00 0.27 -4.89 116.55 118.60 2nuu n ASP 313 Ca 0.12 -0.83 -0.05 0.00 0.71 0.00 0.00 54.79 54.73 2nuu n ASP 313 Cb 0.42 -3.91 0.14 0.00 -0.02 0.00 0.00 41.12 37.75 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 -1.91 1.25 0.05 2.53 2.07 -1.91 -2.69 116.25 115.65 2nuu h VAL 314 Ca -0.61 -1.02 -0.28 0.00 0.82 0.00 0.00 66.70 65.62 2nuu h VAL 314 Cb 1.36 0.84 0.03 0.00 -1.52 0.00 0.00 31.29 32.00 2nuu h VAL 314 CO 0.59 0.36 -1.13 0.15 0.02 0.00 0.00 177.57 177.56 2nuu h PHE 315 N 0.79 1.04 0.00 1.57 3.57 -1.90 0.14 116.94 122.14 2nuu h PHE 315 Ca 0.15 -0.60 -0.01 0.00 3.53 0.00 0.00 57.97 61.04 2nuu h PHE 315 Cb 0.46 -0.10 -0.00 0.00 2.79 0.00 0.00 35.95 39.09 2nuu h PHE 315 CO 0.03 1.44 -0.05 0.78 -2.23 0.00 0.00 178.31 178.28 2nuu h GLY 316 N 0.34 0.00 0.00 2.40 0.00 -1.78 -1.27 103.07 102.76 2nuu h GLY 316 Ca -0.16 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.04 2nuu h GLY 316 CO 0.22 0.00 -1.25 -0.62 0.00 0.00 0.00 176.54 174.90 2nuu n VAL 317 N -3.52 1.03 0.10 4.60 0.31 -1.02 -4.19 118.33 115.64 2nuu n VAL 317 Ca -0.02 0.00 -0.05 0.00 -0.01 0.00 0.00 64.34 64.26 2nuu n VAL 317 Cb 0.16 -1.81 0.04 0.00 -0.91 0.00 0.00 33.84 31.32 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 -0.50 0.12 0.00 3.52 3.86 -0.83 -2.59 115.15 118.73 2nuu h HIS 318 Ca -0.21 -0.06 -0.02 0.00 -1.16 0.00 0.00 60.37 58.92 2nuu h HIS 318 Cb 0.97 -0.02 -0.00 0.00 1.06 0.00 0.00 27.41 29.42 2nuu h HIS 318 CO -0.12 0.84 -0.15 0.78 0.86 0.00 0.00 177.93 180.14 2nuu h GLY 319 N 2.09 0.00 0.84 2.45 0.00 -1.24 -2.79 103.07 104.42 2nuu h GLY 319 Ca -0.02 0.00 0.02 0.00 0.00 0.00 0.00 47.33 47.33 2nuu h GLY 319 CO 0.11 0.00 0.01 -2.08 0.00 0.00 0.00 176.54 174.58 2nuu h VAL 320 N -1.00 0.93 0.00 4.60 2.07 -1.47 -1.11 116.25 120.28 2nuu h VAL 320 Ca -0.03 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.48 2nuu h VAL 320 Cb 0.47 0.87 0.00 0.00 -1.52 0.00 0.00 31.29 31.12 2nuu h VAL 320 CO -0.02 0.01 0.00 0.00 0.02 0.00 0.00 177.57 177.58 2nuu h GLY 322 N 3.12 0.10 0.83 0.00 0.00 -1.13 -1.43 103.07 104.56 2nuu h GLY 322 Ca 0.00 -0.20 -0.01 0.00 0.00 0.00 0.00 47.33 47.13 2nuu h GLY 322 CO 0.00 0.17 -0.25 -2.22 0.00 0.00 0.00 176.54 174.24 2nuu h ILE 323 N -0.67 0.48 -0.50 2.60 2.04 -1.12 -0.13 117.51 120.20 2nuu h ILE 323 Ca -0.02 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.94 2nuu h ILE 323 Cb 0.97 0.48 -0.09 0.00 -0.74 0.00 0.00 36.82 37.44 2nuu h ILE 323 CO 0.03 0.00 -0.04 0.58 0.00 0.00 0.00 178.15 178.72 2nuu h VAL 324 N -0.60 0.57 -0.15 1.67 2.07 -1.42 -0.76 116.25 117.62 2nuu h VAL 324 Ca -0.03 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.46 2nuu h VAL 324 Cb 0.51 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.76 2nuu h VAL 324 CO 0.01 0.01 0.10 1.23 0.02 0.00 0.00 177.57 178.94 2nuu h GLY 325 N 0.07 0.22 1.41 2.17 0.00 -0.93 -1.00 103.07 105.01 2nuu h GLY 325 Ca 0.25 -0.09 -0.03 0.00 0.00 0.00 0.00 47.33 47.47 2nuu h GLY 325 CO -0.45 0.08 0.21 0.00 0.00 0.00 0.00 176.54 176.38 2nuu h ILE 327 N 0.75 1.33 0.00 0.00 2.04 -0.85 -3.20 117.51 117.57 2nuu h ILE 327 Ca 0.18 -1.33 0.00 0.00 1.00 0.00 0.00 64.86 64.71 2nuu h ILE 327 Cb 0.15 1.74 0.00 0.00 -0.74 0.00 0.00 36.82 37.97 2nuu h ILE 327 CO -0.02 0.41 0.00 0.24 0.00 0.00 0.00 178.15 178.78 2nuu h MET 328 N 0.16 0.00 -0.51 2.37 2.86 -0.91 -2.85 114.93 116.05 2nuu h MET 328 Ca 0.03 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.57 2nuu h MET 328 Cb 0.72 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.36 2nuu h MET 328 CO 0.05 0.00 -0.10 1.15 1.06 0.00 0.00 176.91 179.06 2nuu h THR 329 N 0.00 1.26 0.00 2.22 2.02 -1.19 0.22 112.91 117.45 2nuu h THR 329 Ca 0.00 -1.23 0.00 0.00 0.77 0.00 0.00 66.41 65.95 2nuu h THR 329 Cb 0.69 0.98 0.00 0.00 -1.74 0.00 0.00 68.15 68.08 2nuu h THR 329 CO 0.00 0.43 0.00 0.61 0.37 0.00 0.00 175.52 176.93 2nuu n GLY 330 N -0.34 -1.00 0.22 2.16 0.00 -1.08 -2.14 105.19 103.02 2nuu n GLY 330 Ca 0.02 0.03 -0.10 0.00 0.00 0.00 0.00 46.02 45.97 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 -1.83 1.45 1.11 -0.61 5.41 -0.65 -4.53 119.36 119.71 2nuu n ILE 331 Ca 0.02 0.12 0.10 0.00 1.00 0.00 0.00 62.75 63.99 2nuu n ILE 331 Cb 0.15 -2.20 0.55 0.00 -0.71 0.00 0.00 39.64 37.43 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 -4.31 0.00 0.40 1.39 3.72 0.68 -2.70 117.46 116.64 2nuu n PHE 332 Ca -0.16 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.37 2nuu n PHE 332 Cb 0.49 -0.14 0.36 0.00 -0.94 0.00 0.00 39.48 39.25 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 3.11 1.00 -2.61 4.37 0.00 -1.63 -3.27 119.26 120.23 2nuu h ALA 333 Ca 0.00 0.00 -0.57 0.00 0.00 0.00 0.00 54.91 54.34 2nuu h ALA 333 Cb 0.09 0.00 0.13 0.00 0.00 0.00 0.00 17.79 18.01 2nuu h ALA 333 CO 0.00 0.00 0.36 0.00 0.00 0.00 0.00 179.25 179.61 2nuu n ALA 334 N -1.94 0.86 -0.11 0.00 0.00 -1.10 0.60 120.51 118.81 2nuu n ALA 334 Ca 0.04 0.24 -0.06 0.00 0.00 0.00 0.00 53.44 53.66 2nuu n ALA 334 Cb 0.43 -2.20 0.02 0.00 0.00 0.00 0.00 19.45 17.70 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 1.82 0.17 0.14 0.00 0.02 -1.89 -0.58 113.55 113.23 2nuu h SER 335 Ca -0.47 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.52 2nuu h SER 335 Cb 1.31 0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.86 2nuu h SER 335 CO 0.58 0.14 0.00 -1.54 -1.14 0.00 0.00 176.83 174.87 2nuu n SER 336 N -4.99 0.00 -0.73 3.07 3.41 -1.26 -2.24 113.62 110.87 2nuu n SER 336 Ca 0.02 0.30 0.09 0.00 -0.26 0.00 0.00 58.87 59.01 2nuu n SER 336 Cb 0.13 -0.36 0.23 0.00 -0.26 0.00 0.00 64.21 63.95 2nuu n SER 336 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2nuu n LEU 337 N -1.36 3.58 0.00 1.04 4.77 -0.82 -4.91 117.00 119.30 2nuu n LEU 337 Ca 0.02 -3.06 0.00 0.00 -0.03 0.00 0.00 56.01 52.94 2nuu n LEU 337 Cb 0.05 -0.53 0.00 0.00 -2.33 0.00 0.00 43.42 40.62 2nuu n LEU 337 CO 0.05 0.70 0.00 0.61 -1.33 0.00 0.00 177.39 177.42 2nuu n GLY 338 N -0.72 0.72 3.80 -0.72 0.00 -0.95 -4.48 105.19 102.84 2nuu n GLY 338 Ca 0.21 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.94 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 -1.92 1.58 0.10 -0.02 0.00 -0.29 -2.04 107.32 104.74 2nuu s GLY 339 Ca 0.00 -0.55 0.27 0.00 0.00 0.00 0.00 44.72 44.44 2nuu s GLY 339 CO 0.00 0.00 1.80 -0.62 0.00 0.00 0.00 173.10 174.29 2nuu n VAL 340 N -3.71 0.30 0.00 1.40 0.31 -0.70 -4.33 118.33 111.60 2nuu n VAL 340 Ca 0.07 -0.15 0.00 0.00 -0.01 0.00 0.00 64.34 64.25 2nuu n VAL 340 Cb 0.59 -0.49 0.00 0.00 -0.91 0.00 0.00 33.84 33.04 2nuu n VAL 340 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2nuu n GLY 341 N 1.40 0.51 3.88 2.92 0.00 0.20 -4.90 105.19 109.20 2nuu n GLY 341 Ca 0.06 -1.57 -0.30 0.00 0.00 0.00 0.00 46.02 44.21 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 -2.48 1.57 0.78 1.61 0.08 -1.26 -4.87 117.98 113.42 2nuu s PHE 342 Ca 0.00 0.39 -0.10 0.00 0.12 0.00 0.00 56.93 57.33 2nuu s PHE 342 Cb 0.00 -3.97 0.06 0.00 -0.57 0.00 0.00 43.02 38.54 2nuu s PHE 342 CO 0.00 -2.74 1.10 0.00 -0.10 0.00 0.00 175.22 173.47 2nuu s ALA 343 N -3.74 2.20 0.03 5.36 0.00 -1.26 -4.89 121.76 119.46 2nuu s ALA 343 Ca 0.72 0.29 -0.35 0.00 0.00 0.00 0.00 51.96 52.62 2nuu s ALA 343 Cb -0.05 -3.29 -0.14 0.00 0.00 0.00 0.00 23.12 19.64 2nuu s ALA 343 CO 0.53 -1.84 1.62 -1.91 0.00 0.00 0.00 175.76 174.15 2nuu n GLU 344 N -3.57 1.80 -1.17 0.00 4.07 -1.26 -1.71 120.64 118.79 2nuu n GLU 344 Ca 0.09 0.65 -0.06 0.00 -0.06 0.00 0.00 57.16 57.79 2nuu n GLU 344 Cb 0.53 -2.40 -0.03 0.00 -0.06 0.00 0.00 31.44 29.48 2nuu n GLU 344 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2nuu n GLY 345 N 3.54 0.82 3.71 8.31 0.00 -1.26 -5.03 105.19 115.28 2nuu n GLY 345 Ca 0.20 -0.49 -0.35 0.00 0.00 0.00 0.00 46.02 45.37 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 -2.12 4.79 0.30 1.61 1.01 -0.70 -5.11 120.40 120.18 2nuu s VAL 346 Ca 0.00 -0.05 0.07 0.00 0.00 0.00 0.00 61.98 62.00 2nuu s VAL 346 Cb 0.00 -3.09 -0.03 0.00 0.00 0.00 0.00 36.38 33.26 2nuu s VAL 346 CO 0.00 0.55 0.26 0.42 0.00 0.00 0.00 175.10 176.33 2nuu s THR 347 N -0.40 4.02 0.17 3.92 -4.23 -1.26 -4.77 115.64 113.09 2nuu s THR 347 Ca 0.09 -1.35 -0.13 0.00 -1.18 0.00 0.00 61.69 59.12 2nuu s THR 347 Cb -0.12 -3.32 0.06 0.00 1.34 0.00 0.00 72.50 70.47 2nuu s THR 347 CO 0.02 -0.26 1.77 -0.03 -0.54 0.00 0.00 174.62 175.58 2nuu h MET 348 N 1.34 0.78 -0.92 3.99 4.05 -1.98 -1.08 114.93 121.10 2nuu h MET 348 Ca -0.47 -0.10 0.10 0.00 -0.28 0.00 0.00 59.70 58.96 2nuu h MET 348 Cb 1.25 -0.15 -0.08 0.00 -0.80 0.00 0.00 31.60 31.82 2nuu h MET 348 CO 0.59 0.62 0.56 0.78 0.23 0.00 0.00 176.91 179.69 2nuu h GLY 349 N 0.74 1.47 0.63 1.39 0.00 -1.96 -0.42 103.07 104.93 2nuu h GLY 349 Ca 0.19 -0.38 -0.01 0.00 0.00 0.00 0.00 47.33 47.13 2nuu h GLY 349 CO -0.03 0.17 -0.15 0.84 0.00 0.00 0.00 176.54 177.37 2nuu h HIS 350 N 0.92 -0.38 -0.77 5.60 6.17 -1.85 -3.10 115.15 121.75 2nuu h HIS 350 Ca 0.45 -0.01 0.12 0.00 0.71 0.00 0.00 60.37 61.64 2nuu h HIS 350 Cb 0.40 0.13 -0.08 0.00 2.52 0.00 0.00 27.41 30.37 2nuu h HIS 350 CO -0.03 -0.04 0.38 0.37 0.71 0.00 0.00 177.93 179.32 2nuu h GLN 351 N -0.78 0.58 -0.62 5.26 5.75 -0.83 -1.46 115.11 123.01 2nuu h GLN 351 Ca -0.04 -0.03 0.07 0.00 -0.15 0.00 0.00 58.65 58.50 2nuu h GLN 351 Cb 0.51 -0.13 -0.04 0.00 1.07 0.00 0.00 27.48 28.89 2nuu h GLN 351 CO 0.07 0.38 0.41 -0.07 -2.65 0.00 0.00 178.83 176.97 2nuu h LEU 352 N 0.60 0.50 -0.75 -2.39 3.38 -1.12 0.85 115.31 116.37 2nuu h LEU 352 Ca 0.40 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 58.24 2nuu h LEU 352 Cb 0.50 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 2nuu h LEU 352 CO -0.32 0.32 -0.48 -0.07 0.09 0.00 0.00 178.44 177.98 2nuu h LEU 353 N 0.56 0.38 -0.35 1.67 3.38 -1.19 -1.15 115.31 118.61 2nuu h LEU 353 Ca 0.27 -0.18 -0.19 0.00 0.09 0.00 0.00 57.88 57.87 2nuu h LEU 353 Cb 0.35 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.99 2nuu h LEU 353 CO -0.08 0.80 -0.69 0.58 0.09 0.00 0.00 178.44 179.13 2nuu h VAL 354 N 0.28 1.33 -0.30 1.22 2.07 -0.86 -1.04 116.25 118.95 2nuu h VAL 354 Ca 0.02 -1.99 -0.05 0.00 0.82 0.00 0.00 66.70 65.50 2nuu h VAL 354 Cb 0.95 1.97 -0.01 0.00 -1.52 0.00 0.00 31.29 32.67 2nuu h VAL 354 CO 0.08 0.61 -0.01 1.56 0.02 0.00 0.00 177.57 179.84 2nuu h GLN 355 N 0.41 0.54 -0.62 1.57 1.08 -0.73 -0.16 115.11 117.21 2nuu h GLN 355 Ca -0.03 -0.18 -0.05 0.00 -1.45 0.00 0.00 58.65 56.95 2nuu h GLN 355 Cb 1.28 -0.05 -0.03 0.00 -0.05 0.00 0.00 27.48 28.63 2nuu h GLN 355 CO 0.13 0.69 0.19 -0.07 -0.95 0.00 0.00 178.83 178.81 2nuu h LEU 356 N 0.33 0.87 -0.19 1.46 3.38 -1.17 -1.42 115.31 118.58 2nuu h LEU 356 Ca 0.08 -0.15 -0.05 0.00 0.09 0.00 0.00 57.88 57.86 2nuu h LEU 356 Cb 0.45 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 2nuu h LEU 356 CO 0.02 0.82 -0.06 -0.08 0.09 0.00 0.00 178.44 179.23 2nuu h GLU 357 N 0.91 0.38 -0.58 1.13 4.81 -1.00 -1.34 114.58 118.88 2nuu h GLU 357 Ca 0.20 -0.15 0.06 0.00 -0.13 0.00 0.00 59.36 59.34 2nuu h GLU 357 Cb 0.27 -0.02 -0.05 0.00 0.63 0.00 0.00 28.75 29.58 2nuu h GLU 357 CO -0.01 0.65 0.29 0.77 -0.73 0.00 0.00 179.01 179.98 2nuu h SER 358 N 0.08 0.40 -0.12 1.04 0.02 -0.73 -1.10 113.55 113.15 2nuu h SER 358 Ca 0.05 0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 61.03 2nuu h SER 358 Cb 0.52 -0.03 -0.00 0.00 0.14 0.00 0.00 62.40 63.02 2nuu h SER 358 CO 0.02 0.26 0.03 0.40 -1.14 0.00 0.00 176.83 176.40 2nuu h ILE 359 N 0.54 1.18 -0.55 3.27 2.04 -1.20 -1.82 117.51 120.97 2nuu h ILE 359 Ca 0.27 -0.57 0.08 0.00 1.00 0.00 0.00 64.86 65.65 2nuu h ILE 359 Cb 0.21 1.34 -0.07 0.00 -0.74 0.00 0.00 36.82 37.57 2nuu h ILE 359 CO -0.20 0.17 0.18 0.00 0.00 0.00 0.00 178.15 178.29 2nuu h ALA 360 N 0.84 0.67 -0.18 1.87 0.00 -0.80 -0.48 119.26 121.19 2nuu h ALA 360 Ca 0.04 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2nuu h ALA 360 Cb 0.23 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2nuu h ALA 360 CO -0.00 -0.23 0.11 0.82 0.00 0.00 0.00 179.25 179.95 2nuu h ILE 361 N 0.34 1.06 -0.46 0.00 2.04 -1.11 -2.06 117.51 117.33 2nuu h ILE 361 Ca 0.27 -0.13 -0.01 0.00 1.00 0.00 0.00 64.86 65.99 2nuu h ILE 361 Cb 0.34 0.83 -0.02 0.00 -0.74 0.00 0.00 36.82 37.22 2nuu h ILE 361 CO -0.30 0.06 0.25 0.74 0.00 0.00 0.00 178.15 178.90 2nuu h THR 362 N 0.23 1.14 -0.20 -0.27 2.02 -0.62 0.15 112.91 115.36 2nuu h THR 362 Ca 0.07 -0.36 -0.20 0.00 0.77 0.00 0.00 66.41 66.68 2nuu h THR 362 Cb -0.00 0.53 0.01 0.00 -1.74 0.00 0.00 68.15 66.94 2nuu h THR 362 CO -0.01 0.16 -0.66 0.40 0.37 0.00 0.00 175.52 175.77 2nuu h ILE 363 N 0.63 1.28 -0.10 3.11 2.04 -0.86 -2.04 117.51 121.57 2nuu h ILE 363 Ca 0.16 -1.86 -0.17 0.00 1.00 0.00 0.00 64.86 63.99 2nuu h ILE 363 Cb 0.02 1.88 0.01 0.00 -0.74 0.00 0.00 36.82 37.99 2nuu h ILE 363 CO -0.03 0.59 -0.61 0.58 0.00 0.00 0.00 178.15 178.69 2nuu h VAL 364 N 0.54 1.34 0.56 1.67 2.07 -1.09 -2.18 116.25 119.16 2nuu h VAL 364 Ca -0.03 -1.91 -0.03 0.00 0.82 0.00 0.00 66.70 65.56 2nuu h VAL 364 Cb 1.29 2.18 0.01 0.00 -1.52 0.00 0.00 31.29 33.25 2nuu h VAL 364 CO 0.14 0.58 -0.27 -0.25 0.02 0.00 0.00 177.57 177.79 2nuu h TRP 365 N 0.22 -0.69 -0.84 1.57 2.91 -0.76 -1.77 115.95 116.59 2nuu h TRP 365 Ca -0.05 -0.02 -0.01 0.00 1.13 0.00 0.00 58.89 59.94 2nuu h TRP 365 Cb 1.26 0.23 -0.04 0.00 -0.51 0.00 0.00 29.16 30.10 2nuu h TRP 365 CO 0.11 -0.37 0.47 1.03 -1.03 0.00 0.00 178.44 178.64 2nuu h SER 366 N -0.92 1.04 -0.32 2.65 0.87 -1.49 -2.15 113.55 113.24 2nuu h SER 366 Ca -0.08 -0.09 -0.00 0.00 -1.23 0.00 0.00 61.79 60.39 2nuu h SER 366 Cb 0.63 -0.27 -0.02 0.00 -0.44 0.00 0.00 62.40 62.31 2nuu h SER 366 CO 0.13 0.84 0.19 1.23 -0.53 0.00 0.00 176.83 178.68 2nuu h GLY 367 N 1.17 0.46 0.78 5.77 0.00 -1.38 0.52 103.07 110.39 2nuu h GLY 367 Ca 0.30 -0.19 -0.00 0.00 0.00 0.00 0.00 47.33 47.43 2nuu h GLY 367 CO -0.05 0.19 0.00 -2.08 0.00 0.00 0.00 176.54 174.60 2nuu h VAL 368 N 0.41 1.18 -0.19 4.60 2.07 -1.22 -1.76 116.25 121.34 2nuu h VAL 368 Ca 0.11 -0.54 -0.01 0.00 0.82 0.00 0.00 66.70 67.09 2nuu h VAL 368 Cb 0.01 1.52 -0.01 0.00 -1.52 0.00 0.00 31.29 31.30 2nuu h VAL 368 CO -0.02 0.14 0.09 0.58 0.02 0.00 0.00 177.57 178.38 2nuu h VAL 369 N -0.20 1.13 -0.76 2.57 2.07 -1.35 -1.72 116.25 117.99 2nuu h VAL 369 Ca 0.00 -0.36 0.10 0.00 0.82 0.00 0.00 66.70 67.26 2nuu h VAL 369 Cb 0.23 1.02 -0.07 0.00 -1.52 0.00 0.00 31.29 30.95 2nuu h VAL 369 CO 0.00 0.12 0.40 0.00 0.02 0.00 0.00 177.57 178.11 2nuu h ALA 370 N 0.96 1.07 -0.47 1.67 0.00 -0.90 0.13 119.26 121.71 2nuu h ALA 370 Ca 0.06 0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.05 2nuu h ALA 370 Cb 0.11 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 2nuu h ALA 370 CO -0.01 -0.00 0.27 0.35 0.00 0.00 0.00 179.25 179.86 2nuu h PHE 371 N 0.66 0.51 -0.24 0.00 3.57 -0.95 -0.37 116.94 120.12 2nuu h PHE 371 Ca 0.37 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.90 2nuu h PHE 371 Cb 0.39 -0.16 -0.02 0.00 2.79 0.00 0.00 35.95 38.95 2nuu h PHE 371 CO -0.09 0.29 0.14 0.82 -2.23 0.00 0.00 178.31 177.24 2nuu h ILE 372 N 0.55 1.03 -0.56 1.41 2.04 -0.13 -2.27 117.51 119.57 2nuu h ILE 372 Ca 0.19 -0.10 0.03 0.00 1.00 0.00 0.00 64.86 65.98 2nuu h ILE 372 Cb 0.03 0.71 -0.04 0.00 -0.74 0.00 0.00 36.82 36.78 2nuu h ILE 372 CO -0.09 0.05 0.33 1.23 0.00 0.00 0.00 178.15 179.67 2nuu h GLY 373 N 0.29 0.80 1.01 5.37 0.00 -0.32 -1.72 103.07 108.50 2nuu h GLY 373 Ca 0.09 -0.24 -0.09 0.00 0.00 0.00 0.00 47.33 47.09 2nuu h GLY 373 CO -0.05 0.19 -0.05 -0.97 0.00 0.00 0.00 176.54 175.66 2nuu h TYR 374 N 0.65 0.94 -0.51 5.60 0.05 -0.90 -1.74 116.97 121.05 2nuu h TYR 374 Ca 0.23 -0.18 -0.12 0.00 0.05 0.00 0.00 58.73 58.71 2nuu h TYR 374 Cb 0.06 -0.24 -0.02 0.00 1.01 0.00 0.00 36.73 37.54 2nuu h TYR 374 CO -0.07 0.92 -0.15 0.87 -1.05 0.00 0.00 178.16 178.68 2nuu h LYS 375 N 0.69 1.00 -0.06 4.88 1.79 -1.31 0.17 116.57 123.73 2nuu h LYS 375 Ca 0.12 -0.39 -0.06 0.00 -2.18 0.00 0.00 60.65 58.15 2nuu h LYS 375 Cb 0.58 -0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 31.17 2nuu h LYS 375 CO 0.03 1.07 -0.22 1.25 -1.08 0.00 0.00 179.45 180.50 2nuu h LEU 376 N 0.88 0.10 -0.04 2.94 5.85 -1.26 0.15 115.31 123.93 2nuu h LEU 376 Ca 0.13 -0.02 -0.25 0.00 0.84 0.00 0.00 57.88 58.58 2nuu h LEU 376 Cb 0.72 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.72 2nuu h LEU 376 CO 0.05 0.33 -1.08 0.00 -0.34 0.00 0.00 178.44 177.40 2nuu h ALA 377 N 1.68 0.24 -0.38 1.25 0.00 -0.79 -2.88 119.26 118.38 2nuu h ALA 377 Ca 0.02 -0.78 -0.12 0.00 0.00 0.00 0.00 54.91 54.02 2nuu h ALA 377 Cb 0.45 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 2nuu h ALA 377 CO 0.03 0.88 -0.24 0.22 0.00 0.00 0.00 179.25 180.14 2nuu h ASP 378 N 0.16 0.79 1.59 0.00 -0.00 0.16 -0.89 116.42 118.22 2nuu h ASP 378 Ca -0.11 -0.29 -0.04 0.00 -0.00 0.00 0.00 57.03 56.60 2nuu h ASP 378 Cb 1.75 -0.22 -0.01 0.00 -0.00 0.00 0.00 39.33 40.86 2nuu h ASP 378 CO 0.18 0.99 -0.17 -0.07 -0.00 0.00 0.00 179.24 180.17 2nuu h LEU 379 N 0.67 0.00 0.00 2.28 3.38 -0.78 -2.93 115.31 117.93 2nuu h LEU 379 Ca 0.09 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.79 2nuu h LEU 379 Cb 0.75 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.46 2nuu h LEU 379 CO 0.06 0.17 -1.62 0.35 0.09 0.00 0.00 178.44 177.49 2nuu n THR 380 N -3.18 1.52 -0.00 0.22 -2.24 -1.09 -4.83 114.28 104.68 2nuu n THR 380 Ca 0.02 -0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.69 2nuu n THR 380 Cb 0.55 -2.05 -0.00 0.00 -2.10 0.00 0.00 70.33 66.72 2nuu n THR 380 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 2nuu n VAL 381 N -4.39 0.01 0.00 2.28 0.24 -0.41 -5.11 118.33 110.95 2nuu n VAL 381 Ca -0.36 -0.01 0.00 0.00 -2.04 0.00 0.00 64.34 61.93 2nuu n VAL 381 Cb 0.70 0.22 0.00 0.00 -1.47 0.00 0.00 33.84 33.29 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 2.56 1.23 0.13 7.63 0.00 -0.79 -4.97 105.19 110.98 2nuu n GLY 382 Ca -0.00 -1.37 -0.16 0.00 0.00 0.00 0.00 46.02 44.48 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 0.43 -9.52 0.99 3.38 -1.78 -3.43 115.31 105.38 2nuu h LEU 383 Ca 0.00 -0.73 -0.66 0.00 0.09 0.00 0.00 57.88 56.58 2nuu h LEU 383 Cb 0.00 -0.13 -0.09 0.00 0.09 0.00 0.00 40.66 40.53 2nuu h LEU 383 CO 0.00 1.10 -0.51 -0.60 0.09 0.00 0.00 178.44 178.52 2nuu s ARG 384 N -3.33 3.47 0.43 1.13 3.52 -1.26 -0.95 118.95 121.96 2nuu s ARG 384 Ca -0.14 -0.19 -0.23 0.00 -0.13 0.00 0.00 55.73 55.03 2nuu s ARG 384 Cb 0.03 -3.15 -0.08 0.00 -1.56 0.00 0.00 34.95 30.19 2nuu s ARG 384 CO 0.79 0.70 1.13 0.08 -0.81 0.00 0.00 175.30 177.18 2nuu s VAL 385 N -0.80 3.32 0.47 7.11 1.01 -0.40 -4.83 120.40 126.27 2nuu s VAL 385 Ca 0.13 1.01 -0.24 0.00 0.00 0.00 0.00 61.98 62.88 2nuu s VAL 385 Cb -0.12 -3.52 -0.08 0.00 0.00 0.00 0.00 36.38 32.67 2nuu s VAL 385 CO 0.03 0.00 1.38 -2.65 0.00 0.00 0.00 175.10 173.86 2nuu n PRO 386 N -0.30 2.03 -0.34 2.72 -0.02 -1.26 -4.80 135.00 133.03 2nuu n PRO 386 Ca 0.06 0.73 0.18 0.00 -2.02 0.00 0.00 63.50 62.45 2nuu n PRO 386 Cb 0.48 -2.57 0.39 0.00 -0.02 0.00 0.00 33.50 31.79 2nuu n PRO 386 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 2nuu h GLU 387 N 2.01 0.57 -0.42 -0.52 4.11 -1.99 -0.39 114.58 117.94 2nuu h GLU 387 Ca -0.50 -0.03 -0.04 0.00 0.07 0.00 0.00 59.36 58.85 2nuu h GLU 387 Cb 1.28 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 30.39 2nuu h GLU 387 CO 0.60 0.37 0.10 1.05 0.07 0.00 0.00 179.01 181.20 2nuu h GLU 388 N 0.58 0.63 0.02 1.06 9.09 -2.00 -1.57 114.58 122.38 2nuu h GLU 388 Ca 0.64 -0.11 -0.20 0.00 0.05 0.00 0.00 59.36 59.73 2nuu h GLU 388 Cb 1.22 -0.10 -0.02 0.00 -1.65 0.00 0.00 28.75 28.20 2nuu h GLU 388 CO -0.45 0.58 -0.93 1.96 0.05 0.00 0.00 179.01 180.22 2nuu h GLN 389 N 0.61 0.09 -0.57 1.06 4.20 -1.46 -3.07 115.11 115.97 2nuu h GLN 389 Ca 0.14 -0.12 -0.10 0.00 0.06 0.00 0.00 58.65 58.63 2nuu h GLN 389 Cb 0.24 0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.04 2nuu h GLN 389 CO -0.00 0.95 -0.04 1.49 -0.67 0.00 0.00 178.83 180.56 2nuu h GLU 390 N 0.04 1.04 -0.70 1.46 4.81 -0.82 -1.50 114.58 118.90 2nuu h GLU 390 Ca -0.03 -0.35 -0.04 0.00 -0.13 0.00 0.00 59.36 58.81 2nuu h GLU 390 Cb 1.61 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 30.88 2nuu h GLU 390 CO 0.13 1.04 0.28 0.00 -0.73 0.00 0.00 179.01 179.74 2nuu h ARG 391 N 0.93 1.05 -0.00 1.92 3.08 -1.30 -2.83 114.38 117.23 2nuu h ARG 391 Ca 0.16 -0.19 0.00 0.00 0.07 0.00 0.00 59.98 60.02 2nuu h ARG 391 Cb 0.60 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.48 2nuu h ARG 391 CO 0.04 0.87 -0.19 -0.85 -1.07 0.00 0.00 179.97 178.76 2nuu n GLU 392 N -4.37 0.05 0.00 0.04 0.28 -1.16 -5.03 120.64 110.44 2nuu n GLU 392 Ca 0.05 -0.01 0.00 0.00 -0.16 0.00 0.00 57.16 57.04 2nuu n GLU 392 Cb 0.18 -1.50 0.00 0.00 1.43 0.00 0.00 31.44 31.55 2nuu n GLU 392 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2nuu n GLY 393 N 1.48 2.23 0.15 -1.84 0.00 -0.57 -4.82 105.19 101.82 2nuu n GLY 393 Ca 0.07 -1.63 -0.00 0.00 0.00 0.00 0.00 46.02 44.46 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 0.17 0.99 3.38 -1.72 -3.24 115.31 114.89 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 -0.04 0.00 0.09 0.00 0.00 40.66 40.71 2nuu h LEU 394 CO 0.00 0.56 -0.42 0.44 0.09 0.00 0.00 178.44 179.11 2nuu h ASP 395 N 0.00 -1.22 -0.17 -0.43 5.19 -1.78 0.58 116.42 118.59 2nuu h ASP 395 Ca -0.01 0.13 -0.04 0.00 -0.62 0.00 0.00 57.03 56.50 2nuu h ASP 395 Cb 1.01 0.45 -0.01 0.00 0.18 0.00 0.00 39.33 40.97 2nuu h ASP 395 CO 0.07 -0.50 -0.04 -0.37 -3.12 0.00 0.00 179.24 175.28 2nuu h VAL 396 N -0.68 1.29 -0.32 -1.35 -1.51 -1.63 -1.65 116.25 110.39 2nuu h VAL 396 Ca 0.01 -1.01 -0.06 0.00 -1.23 0.00 0.00 66.70 64.41 2nuu h VAL 396 Cb 0.69 1.61 -0.01 0.00 -2.13 0.00 0.00 31.29 31.45 2nuu h VAL 396 CO -0.21 0.30 -0.04 0.78 -1.23 0.00 0.00 177.57 177.17 2nuu h ASN 397 N 0.03 0.58 0.51 4.19 2.35 -1.56 -1.66 115.58 120.02 2nuu h ASN 397 Ca 0.04 -0.34 -0.20 0.00 -0.55 0.00 0.00 56.30 55.25 2nuu h ASN 397 Cb 0.48 -0.16 -0.04 0.00 0.05 0.00 0.00 38.32 38.66 2nuu h ASN 397 CO 0.02 0.78 -1.65 -1.20 -1.65 0.00 0.00 177.43 173.73 2nuu n SER 398 N -4.50 0.66 0.00 5.81 7.64 0.20 -4.59 113.62 118.84 2nuu n SER 398 Ca -0.02 0.29 0.00 0.00 1.01 0.00 0.00 58.87 60.15 2nuu n SER 398 Cb 0.30 0.41 0.00 0.00 -1.01 0.00 0.00 64.21 63.91 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 -2.83 0.00 -2.58 1.43 8.25 -0.70 -5.03 115.22 113.77 2nuu n HIS 399 Ca -0.14 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.11 2nuu n HIS 399 Cb 0.89 0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.01 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 0.19 -0.50 3.03 -1.41 0.00 -0.62 -4.96 105.19 100.92 2nuu n GLY 400 Ca 0.00 0.03 -0.10 0.00 0.00 0.00 0.00 46.02 45.95 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 -5.23 0.44 -0.11 1.61 2.02 -1.08 -4.95 118.70 111.40 2nuu s GLU 401 Ca 0.09 -0.79 0.01 0.00 0.02 0.00 0.00 54.97 54.30 2nuu s GLU 401 Cb -0.04 0.02 -0.02 0.00 0.10 0.00 0.00 34.13 34.20 2nuu s GLU 401 CO 0.11 -0.04 -0.13 1.21 0.02 0.00 0.00 175.26 176.43 2nuu s ASN 402 N -1.83 4.03 0.13 -0.19 3.84 -1.26 -2.78 114.94 116.89 2nuu s ASN 402 Ca -0.09 -0.29 -0.16 0.00 0.21 0.00 0.00 52.86 52.53 2nuu s ASN 402 Cb -0.06 -1.42 -0.00 0.00 -0.55 0.00 0.00 41.25 39.21 2nuu s ASN 402 CO -0.02 0.21 1.67 0.00 -2.79 0.00 0.00 177.10 176.17 2nuu h ALA 403 N 6.36 0.54 -3.35 1.71 0.00 -1.96 -3.42 119.26 119.12 2nuu h ALA 403 Ca -0.31 -0.15 -0.65 0.00 0.00 0.00 0.00 54.91 53.80 2nuu h ALA 403 Cb 1.20 -0.16 -0.36 0.00 0.00 0.00 0.00 17.79 18.47 2nuu h ALA 403 CO 0.54 0.16 -0.83 0.71 0.00 0.00 0.00 179.25 179.83 2nuu s TYR 404 N -5.49 2.75 0.36 0.00 2.02 -1.26 -5.11 117.35 110.61 2nuu s TYR 404 Ca -0.13 -1.76 0.07 0.00 -0.37 0.00 0.00 57.07 54.88 2nuu s TYR 404 Cb 0.10 -1.82 -0.07 0.00 -0.40 0.00 0.00 41.96 39.77 2nuu s TYR 404 CO 0.76 -0.80 -0.01 -0.80 -1.57 0.00 0.00 175.55 173.13 2nuu s ASN 405 N 1.29 3.36 0.00 2.29 0.01 -1.26 -5.23 114.94 115.40 2nuu s ASN 405 Ca 0.00 -1.31 0.00 0.00 -0.71 0.00 0.00 52.86 50.84 2nuu s ASN 405 Cb -0.15 -0.29 0.00 0.00 0.41 0.00 0.00 41.25 41.22 2nuu s ASN 405 CO -0.10 -0.42 0.00 0.00 -1.51 0.00 0.00 177.10 175.07