#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nuu h HIS -1 N 0.00 0.47 -0.07 1.57 -0.00 -2.12 -2.37 115.15 112.63 2nuu h HIS -1 Ca 0.00 0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.38 2nuu h HIS -1 Cb 0.00 -0.15 0.00 0.00 -0.00 0.00 0.00 27.41 27.26 2nuu h HIS -1 CO 0.00 0.18 0.00 -2.39 -0.00 0.00 0.00 177.93 175.72 2nuu n HIS 0 N -4.48 0.09 -2.43 6.12 -0.00 -1.26 -4.87 115.22 108.40 2nuu n HIS 0 Ca 0.14 -0.04 -0.38 0.00 -0.00 0.00 0.00 57.72 57.44 2nuu n HIS 0 Cb 0.52 0.00 -0.03 0.00 -0.00 0.00 0.00 29.99 30.48 2nuu n HIS 0 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 2nuu s HIS 1 N -1.91 3.24 0.05 -1.40 5.65 -0.90 -5.05 115.29 114.97 2nuu s HIS 1 Ca 0.26 1.62 -0.11 0.00 0.25 0.00 0.00 55.06 57.08 2nuu s HIS 1 Cb 0.13 -3.26 0.01 0.00 -1.18 0.00 0.00 32.58 28.27 2nuu s HIS 1 CO 0.20 -0.90 0.23 -3.38 -0.65 0.00 0.00 174.74 170.24 2nuu s HIS 2 N -1.48 0.03 0.64 3.88 -0.00 -1.26 -5.13 115.29 111.96 2nuu s HIS 2 Ca 0.55 -0.27 -0.11 0.00 -0.00 0.00 0.00 55.06 55.23 2nuu s HIS 2 Cb -0.27 0.00 -0.03 0.00 -0.00 0.00 0.00 32.58 32.29 2nuu s HIS 2 CO 0.34 -0.48 1.04 0.00 -0.00 0.00 0.00 174.74 175.64 2nuu s ALA 3 N -2.83 2.96 -0.03 -1.38 0.00 -1.26 -5.07 121.76 114.15 2nuu s ALA 3 Ca -0.03 -0.02 0.04 0.00 0.00 0.00 0.00 51.96 51.95 2nuu s ALA 3 Cb 0.00 -3.11 -0.03 0.00 0.00 0.00 0.00 23.12 19.98 2nuu s ALA 3 CO -0.05 -0.84 -0.13 0.54 0.00 0.00 0.00 175.76 175.28 2nuu s VAL 4 N -3.10 3.14 0.37 0.00 0.11 -1.26 -4.73 120.40 114.94 2nuu s VAL 4 Ca 0.56 -0.80 -0.24 0.00 -2.93 0.00 0.00 61.98 58.57 2nuu s VAL 4 Cb -0.12 -2.27 -0.10 0.00 -1.53 0.00 0.00 36.38 32.36 2nuu s VAL 4 CO 0.53 0.52 0.99 0.00 -3.33 0.00 0.00 175.10 173.81 2nuu s ALA 5 N -0.81 3.13 -0.32 1.54 0.00 -1.26 -4.81 121.76 119.23 2nuu s ALA 5 Ca 0.13 0.58 -0.10 0.00 0.00 0.00 0.00 51.96 52.57 2nuu s ALA 5 Cb -0.11 -3.22 -0.01 0.00 0.00 0.00 0.00 23.12 19.79 2nuu s ALA 5 CO 0.02 -0.01 0.17 0.34 0.00 0.00 0.00 175.76 176.29 2nuu s ASP 6 N -1.69 5.68 0.49 0.00 -1.08 -0.57 -4.98 116.67 114.53 2nuu s ASP 6 Ca 0.56 -0.48 0.21 0.00 -0.52 0.00 0.00 52.55 52.31 2nuu s ASP 6 Cb -0.18 -2.04 1.26 0.00 -1.46 0.00 0.00 42.92 40.50 2nuu s ASP 6 CO 0.24 -0.20 1.99 0.11 0.52 0.00 0.00 175.17 177.83 2nuu h LYS 7 N 8.38 0.14 0.02 4.34 1.57 -1.96 -0.33 116.57 128.74 2nuu h LYS 7 Ca -0.32 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.45 2nuu h LYS 7 Cb 1.15 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.43 2nuu h LYS 7 CO 0.62 0.09 -0.01 0.00 -0.57 0.00 0.00 179.45 179.58 2nuu h ALA 8 N 1.73 -0.03 -0.51 3.86 0.00 -1.95 -0.77 119.26 121.59 2nuu h ALA 8 Ca 0.26 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 2nuu h ALA 8 Cb 0.84 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.61 2nuu h ALA 8 CO -0.04 -0.41 0.15 -0.44 0.00 0.00 0.00 179.25 178.52 2nuu h ASP 9 N -0.25 0.70 -0.11 0.00 3.32 -1.63 0.14 116.42 118.59 2nuu h ASP 9 Ca -0.00 -0.11 -0.00 0.00 0.02 0.00 0.00 57.03 56.94 2nuu h ASP 9 Cb 0.24 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 2nuu h ASP 9 CO 0.01 0.67 0.06 0.78 -1.72 0.00 0.00 179.24 179.04 2nuu h ASN 10 N 0.74 0.13 -0.00 6.45 2.35 -0.85 -0.27 115.58 124.13 2nuu h ASN 10 Ca 0.17 -0.06 -0.00 0.00 -0.55 0.00 0.00 56.30 55.85 2nuu h ASN 10 Cb 0.23 -0.03 -0.00 0.00 0.05 0.00 0.00 38.32 38.57 2nuu h ASN 10 CO -0.01 0.16 0.00 0.00 -1.65 0.00 0.00 177.43 175.93 2nuu h ALA 11 N 0.98 0.00 -0.27 -0.83 0.00 -0.78 -1.32 119.26 117.04 2nuu h ALA 11 Ca 0.04 -0.15 0.07 0.00 0.00 0.00 0.00 54.91 54.86 2nuu h ALA 11 Cb 0.05 -0.00 -0.07 0.00 0.00 0.00 0.00 17.79 17.77 2nuu h ALA 11 CO -0.01 -0.34 -0.25 0.35 0.00 0.00 0.00 179.25 179.00 2nuu h PHE 12 N -0.31 -0.66 -0.20 0.00 3.57 -0.68 -0.70 116.94 117.97 2nuu h PHE 12 Ca 0.00 0.04 -0.06 0.00 3.53 0.00 0.00 57.97 61.48 2nuu h PHE 12 Cb 0.31 0.33 -0.01 0.00 2.79 0.00 0.00 35.95 39.37 2nuu h PHE 12 CO 0.03 -0.32 -0.15 0.52 -2.23 0.00 0.00 178.31 176.15 2nuu h MET 13 N -0.24 0.33 -0.21 1.11 2.86 -1.02 -0.33 114.93 117.42 2nuu h MET 13 Ca 0.15 -0.09 -0.20 0.00 -2.06 0.00 0.00 59.70 57.50 2nuu h MET 13 Cb 0.47 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 32.09 2nuu h MET 13 CO -0.41 0.48 -0.64 0.52 1.06 0.00 0.00 176.91 177.92 2nuu h MET 14 N 0.30 0.78 -0.53 1.72 2.86 -0.63 -0.39 114.93 119.05 2nuu h MET 14 Ca 0.06 -0.55 -0.10 0.00 -2.06 0.00 0.00 59.70 57.05 2nuu h MET 14 Cb 0.46 0.09 -0.02 0.00 0.06 0.00 0.00 31.60 32.19 2nuu h MET 14 CO 0.03 1.17 -0.07 0.82 1.06 0.00 0.00 176.91 179.92 2nuu h ILE 15 N 0.57 1.26 -0.34 -1.22 1.08 -0.92 -1.67 117.51 116.27 2nuu h ILE 15 Ca -0.01 -1.19 -0.01 0.00 -0.39 0.00 0.00 64.86 63.26 2nuu h ILE 15 Cb 1.25 0.93 -0.02 0.00 -3.07 0.00 0.00 36.82 35.91 2nuu h ILE 15 CO 0.13 0.42 0.16 0.00 -0.69 0.00 0.00 178.15 178.17 2nuu h THR 17 N 0.41 0.83 -0.95 0.00 2.02 -0.81 0.15 112.91 114.57 2nuu h THR 17 Ca 0.12 -0.11 0.01 0.00 0.77 0.00 0.00 66.41 67.19 2nuu h THR 17 Cb 0.14 0.49 -0.05 0.00 -1.74 0.00 0.00 68.15 66.99 2nuu h THR 17 CO -0.01 0.06 0.62 0.00 0.37 0.00 0.00 175.52 176.55 2nuu h ALA 18 N 1.31 1.20 -0.61 6.16 0.00 -0.93 -0.78 119.26 125.61 2nuu h ALA 18 Ca 0.22 -0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.97 2nuu h ALA 18 Cb 0.23 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 2nuu h ALA 18 CO -0.24 0.61 0.02 -0.07 0.00 0.00 0.00 179.25 179.57 2nuu h LEU 19 N 1.29 1.03 -0.95 0.00 3.38 0.48 -1.96 115.31 118.57 2nuu h LEU 19 Ca 0.35 -0.28 -0.10 0.00 0.09 0.00 0.00 57.88 57.93 2nuu h LEU 19 Cb -0.13 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.33 2nuu h LEU 19 CO -0.07 1.07 -0.34 0.58 0.09 0.00 0.00 178.44 179.77 2nuu h VAL 20 N 0.97 1.28 -0.00 1.22 2.07 -0.19 -2.78 116.25 118.83 2nuu h VAL 20 Ca 0.18 -1.38 -0.15 0.00 0.82 0.00 0.00 66.70 66.17 2nuu h VAL 20 Cb 0.53 1.53 -0.02 0.00 -1.52 0.00 0.00 31.29 31.80 2nuu h VAL 20 CO 0.03 0.42 -0.70 -0.07 0.02 0.00 0.00 177.57 177.27 2nuu h LEU 21 N 0.30 0.00 -1.53 2.57 3.38 -1.00 -2.99 115.31 116.04 2nuu h LEU 21 Ca 0.04 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 2nuu h LEU 21 Cb 0.74 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.47 2nuu h LEU 21 CO 0.06 0.70 0.22 0.15 0.09 0.00 0.00 178.44 179.66 2nuu h PHE 22 N 0.00 0.51 -0.52 1.13 3.57 -1.08 0.20 116.94 120.76 2nuu h PHE 22 Ca -0.01 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.48 2nuu h PHE 22 Cb 1.24 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 39.79 2nuu h PHE 22 CO 0.00 0.36 0.28 0.52 -2.23 0.00 0.00 178.31 177.24 2nuu h MET 23 N 0.54 0.72 0.00 1.11 2.86 -1.39 -2.23 114.93 116.54 2nuu h MET 23 Ca 0.14 -0.07 -0.21 0.00 -2.06 0.00 0.00 59.70 57.50 2nuu h MET 23 Cb 0.01 -0.15 -0.03 0.00 0.06 0.00 0.00 31.60 31.50 2nuu h MET 23 CO -0.02 0.54 -1.13 1.15 1.06 0.00 0.00 176.91 178.50 2nuu h THR 24 N 0.72 0.97 -3.51 2.22 2.02 -1.48 0.54 112.91 114.39 2nuu h THR 24 Ca 0.18 -2.17 -0.71 0.00 0.77 0.00 0.00 66.41 64.49 2nuu h THR 24 Cb 0.04 2.27 -0.33 0.00 -1.74 0.00 0.00 68.15 68.39 2nuu h THR 24 CO -0.03 0.33 -0.36 -0.63 0.37 0.00 0.00 175.52 175.20 2nuu s ILE 25 N -2.35 3.91 -0.39 3.11 -1.09 0.64 -3.47 121.20 121.58 2nuu s ILE 25 Ca -0.28 -2.50 0.03 0.00 -2.23 0.00 0.00 60.65 55.67 2nuu s ILE 25 Cb 0.05 -3.56 0.04 0.00 -1.58 0.00 0.00 42.46 37.40 2nuu s ILE 25 CO 0.59 -0.84 0.68 -0.81 -1.23 0.00 0.00 174.94 173.33 2nuu n PRO 26 N 4.03 -0.01 0.00 2.79 -0.04 -0.93 -4.03 135.00 136.80 2nuu n PRO 26 Ca 0.03 -0.84 0.00 0.00 -0.04 0.00 0.00 63.50 62.65 2nuu n PRO 26 Cb 0.40 -1.07 0.00 0.00 -0.04 0.00 0.00 33.50 32.79 2nuu n PRO 26 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2nuu n GLY 27 N 0.13 -0.80 0.20 0.55 0.00 -0.88 -1.48 105.19 102.91 2nuu n GLY 27 Ca 0.02 0.16 0.05 0.00 0.00 0.00 0.00 46.02 46.25 2nuu n GLY 27 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2nuu h ILE 28 N 0.00 1.06 -0.27 -0.61 6.09 -0.00 -1.75 117.51 122.02 2nuu h ILE 28 Ca 0.00 -1.21 -0.08 0.00 -1.37 0.00 0.00 64.86 62.20 2nuu h ILE 28 Cb 0.00 1.68 -0.01 0.00 0.47 0.00 0.00 36.82 38.97 2nuu h ILE 28 CO 0.00 0.32 -0.14 0.00 -3.07 0.00 0.00 178.15 175.26 2nuu h ALA 29 N 1.67 0.39 -0.19 0.18 0.00 -1.45 -0.36 119.26 119.50 2nuu h ALA 29 Ca -0.00 -0.32 -0.08 0.00 0.00 0.00 0.00 54.91 54.51 2nuu h ALA 29 Cb 0.66 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 2nuu h ALA 29 CO 0.04 0.27 -0.18 -0.07 0.00 0.00 0.00 179.25 179.32 2nuu h LEU 30 N 0.32 0.49 0.27 0.00 3.38 -1.13 0.42 115.31 119.06 2nuu h LEU 30 Ca 0.06 -0.47 0.00 0.00 0.09 0.00 0.00 57.88 57.56 2nuu h LEU 30 Cb 0.66 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.23 2nuu h LEU 30 CO 0.04 0.86 -0.52 0.15 0.09 0.00 0.00 178.44 179.06 2nuu h PHE 31 N 0.13 -1.49 -0.16 1.13 3.57 -1.30 0.15 116.94 118.96 2nuu h PHE 31 Ca 0.03 0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.48 2nuu h PHE 31 Cb 0.72 0.62 -0.01 0.00 2.79 0.00 0.00 35.95 40.06 2nuu h PHE 31 CO 0.08 -0.63 -0.27 1.88 -2.23 0.00 0.00 178.31 177.14 2nuu h TYR 32 N -0.85 0.34 -0.62 0.41 0.05 -1.08 -2.98 116.97 112.22 2nuu h TYR 32 Ca -0.03 -0.07 0.01 0.00 0.05 0.00 0.00 58.73 58.69 2nuu h TYR 32 Cb 0.81 -0.08 -0.03 0.00 1.01 0.00 0.00 36.73 38.43 2nuu h TYR 32 CO -0.38 0.55 0.41 0.78 -1.05 0.00 0.00 178.16 178.47 2nuu h GLY 33 N 1.01 0.88 2.00 3.88 0.00 0.48 -2.77 103.07 108.55 2nuu h GLY 33 Ca 0.04 -0.33 -0.07 0.00 0.00 0.00 0.00 47.33 46.98 2nuu h GLY 33 CO 0.05 0.32 -0.31 -1.33 0.00 0.00 0.00 176.54 175.26 2nuu h GLY 34 N 0.84 0.00 2.00 4.60 0.00 -0.58 -3.22 103.07 106.72 2nuu h GLY 34 Ca 0.23 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.44 2nuu h GLY 34 CO -0.05 0.00 -0.58 1.41 0.00 0.00 0.00 176.54 177.32 2nuu h LEU 35 N 0.00 0.00-10.54 3.11 3.38 -1.41 -2.40 115.31 107.45 2nuu h LEU 35 Ca -0.00 0.00 -0.45 0.00 0.09 0.00 0.00 57.88 57.52 2nuu h LEU 35 Cb 0.82 0.00 0.04 0.00 0.09 0.00 0.00 40.66 41.61 2nuu h LEU 35 CO 0.04 0.58 -0.10 0.27 0.09 0.00 0.00 178.44 179.32 2nuu s ILE 36 N -3.33 2.60 0.81 1.22 -4.36 -1.16 -3.95 121.20 113.03 2nuu s ILE 36 Ca 0.01 -0.83 -0.10 0.00 -0.26 0.00 0.00 60.65 59.46 2nuu s ILE 36 Cb 0.11 -2.77 0.08 0.00 1.25 0.00 0.00 42.46 41.12 2nuu s ILE 36 CO 0.74 0.00 1.11 -0.13 0.24 0.00 0.00 174.94 176.90 2nuu s ARG 37 N -4.66 1.94 0.45 0.37 0.52 -1.26 -2.60 118.95 113.70 2nuu s ARG 37 Ca 0.59 1.26 0.17 0.00 -0.52 0.00 0.00 55.73 57.23 2nuu s ARG 37 Cb -0.09 -1.85 1.06 0.00 0.52 0.00 0.00 34.95 34.59 2nuu s ARG 37 CO 0.38 -1.90 1.99 0.78 0.02 0.00 0.00 175.30 176.57 2nuu h GLY 38 N -1.32 0.00 1.70 -3.53 0.00 -1.92 -2.61 103.07 95.39 2nuu h GLY 38 Ca -0.43 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.90 2nuu h GLY 38 CO 0.49 0.00 0.00 0.58 0.00 0.00 0.00 176.54 177.61 2nuu n LYS 39 N -4.18 0.21 0.00 4.80 2.85 -1.26 -3.43 118.16 117.15 2nuu n LYS 39 Ca -0.02 0.10 0.00 0.00 -1.05 0.00 0.00 58.31 57.34 2nuu n LYS 39 Cb 0.26 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 33.14 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 -1.35 0.31 -0.32 -5.58 3.02 -1.01 -2.56 115.26 107.76 2nuu n ASN 40 Ca 0.09 -0.63 0.13 0.00 -0.03 0.00 0.00 54.58 54.13 2nuu n ASN 40 Cb 0.19 0.52 0.31 0.00 -0.61 0.00 0.00 39.78 40.19 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 0.06 0.61 -0.26 2.41 3.04 -1.50 -1.38 116.25 119.23 2nuu h VAL 41 Ca 0.00 -0.20 -0.05 0.00 -1.01 0.00 0.00 66.70 65.43 2nuu h VAL 41 Cb 0.03 -0.03 -0.01 0.00 -2.01 0.00 0.00 31.29 29.26 2nuu h VAL 41 CO 0.00 0.11 -0.08 -0.07 -1.01 0.00 0.00 177.57 176.52 2nuu h LEU 42 N 0.59 0.39 -0.85 3.16 3.38 -1.87 -2.32 115.31 117.78 2nuu h LEU 42 Ca 0.56 -0.08 -0.08 0.00 0.09 0.00 0.00 57.88 58.37 2nuu h LEU 42 Cb 0.96 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.58 2nuu h LEU 42 CO -0.44 0.52 0.03 0.77 0.09 0.00 0.00 178.44 179.40 2nuu h SER 43 N 0.39 0.85 -0.36 -0.43 4.64 -1.58 0.32 113.55 117.38 2nuu h SER 43 Ca 0.08 -0.21 -0.04 0.00 -0.47 0.00 0.00 61.79 61.16 2nuu h SER 43 Cb 0.39 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 62.24 2nuu h SER 43 CO 0.02 0.89 0.08 -0.03 -0.87 0.00 0.00 176.83 176.92 2nuu h MET 44 N 0.82 0.57 -0.58 4.77 1.85 -1.24 -0.81 114.93 120.31 2nuu h MET 44 Ca 0.16 -0.14 -0.08 0.00 -0.61 0.00 0.00 59.70 59.02 2nuu h MET 44 Cb 0.45 -0.07 -0.02 0.00 0.43 0.00 0.00 31.60 32.39 2nuu h MET 44 CO 0.02 0.63 0.03 -0.07 -0.40 0.00 0.00 176.91 177.11 2nuu h LEU 45 N 0.42 0.96 -0.45 3.39 3.38 -1.02 -2.12 115.31 119.87 2nuu h LEU 45 Ca 0.11 -0.25 -0.16 0.00 0.09 0.00 0.00 57.88 57.67 2nuu h LEU 45 Cb 0.32 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 2nuu h LEU 45 CO 0.00 1.00 -0.44 0.74 0.09 0.00 0.00 178.44 179.83 2nuu h THR 46 N 0.91 1.28 -0.40 0.22 2.02 -0.86 -1.38 112.91 114.70 2nuu h THR 46 Ca 0.17 -1.62 -0.02 0.00 0.77 0.00 0.00 66.41 65.71 2nuu h THR 46 Cb 0.50 1.50 -0.02 0.00 -1.74 0.00 0.00 68.15 68.39 2nuu h THR 46 CO 0.02 0.53 0.18 1.56 0.37 0.00 0.00 175.52 178.18 2nuu h GLN 47 N 0.65 0.58 -0.28 6.66 4.20 -1.03 0.17 115.11 126.06 2nuu h GLN 47 Ca 0.04 -0.09 -0.07 0.00 0.06 0.00 0.00 58.65 58.59 2nuu h GLN 47 Cb 1.01 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.68 2nuu h GLN 47 CO 0.10 0.53 -0.11 0.28 -0.67 0.00 0.00 178.83 178.95 2nuu h VAL 48 N 0.50 1.29 -0.02 -0.54 2.07 -1.34 -0.46 116.25 117.75 2nuu h VAL 48 Ca 0.13 -1.18 -0.00 0.00 0.82 0.00 0.00 66.70 66.47 2nuu h VAL 48 Cb 0.15 1.48 -0.00 0.00 -1.52 0.00 0.00 31.29 31.40 2nuu h VAL 48 CO -0.01 0.37 0.01 0.74 0.02 0.00 0.00 177.57 178.70 2nuu h THR 49 N 0.31 1.14 -0.15 2.57 2.02 -1.15 -1.64 112.91 116.01 2nuu h THR 49 Ca 0.06 -0.41 -0.15 0.00 0.77 0.00 0.00 66.41 66.68 2nuu h THR 49 Cb 0.62 1.39 -0.01 0.00 -1.74 0.00 0.00 68.15 68.40 2nuu h THR 49 CO 0.04 0.11 -0.55 0.58 0.37 0.00 0.00 175.52 176.06 2nuu h VAL 50 N -0.14 1.34 -0.10 3.16 2.07 -0.71 -2.32 116.25 119.55 2nuu h VAL 50 Ca 0.01 -1.83 -0.13 0.00 0.82 0.00 0.00 66.70 65.57 2nuu h VAL 50 Cb 0.17 1.83 -0.01 0.00 -1.52 0.00 0.00 31.29 31.76 2nuu h VAL 50 CO -0.00 0.56 -0.50 0.71 0.02 0.00 0.00 177.57 178.36 2nuu h THR 51 N 0.34 1.34 0.47 2.57 1.35 -1.07 -2.39 112.91 115.52 2nuu h THR 51 Ca 0.01 -1.73 -0.02 0.00 -0.55 0.00 0.00 66.41 64.12 2nuu h THR 51 Cb 1.07 1.82 -0.00 0.00 -1.73 0.00 0.00 68.15 69.31 2nuu h THR 51 CO 0.10 0.52 -0.27 0.15 -0.25 0.00 0.00 175.52 175.76 2nuu h PHE 52 N 0.21 -0.71 -0.25 4.73 3.57 -1.17 0.26 116.94 123.59 2nuu h PHE 52 Ca 0.01 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.55 2nuu h PHE 52 Cb 0.95 0.25 -0.06 0.00 2.79 0.00 0.00 35.95 39.88 2nuu h PHE 52 CO 0.02 -0.42 -0.12 0.00 -2.23 0.00 0.00 178.31 175.56 2nuu h ALA 53 N -0.20 0.09 -0.44 2.41 0.00 -1.36 -1.27 119.26 118.48 2nuu h ALA 53 Ca -0.06 0.09 0.06 0.00 0.00 0.00 0.00 54.91 55.01 2nuu h ALA 53 Cb 0.56 0.28 -0.05 0.00 0.00 0.00 0.00 17.79 18.58 2nuu h ALA 53 CO 0.07 -0.53 0.12 1.25 0.00 0.00 0.00 179.25 180.16 2nuu h LEU 54 N -0.08 0.07 -1.20 0.00 5.85 -1.29 -2.18 115.31 116.48 2nuu h LEU 54 Ca 0.13 0.06 -0.05 0.00 0.84 0.00 0.00 57.88 58.87 2nuu h LEU 54 Cb 0.28 0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.36 2nuu h LEU 54 CO -0.30 0.07 0.02 0.58 -0.34 0.00 0.00 178.44 178.48 2nuu h VAL 55 N 0.26 1.20 -0.15 1.05 2.07 -0.30 -2.04 116.25 118.35 2nuu h VAL 55 Ca 0.21 -0.78 -0.02 0.00 0.82 0.00 0.00 66.70 66.93 2nuu h VAL 55 Cb 0.24 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 30.90 2nuu h VAL 55 CO -0.25 0.27 0.03 0.00 0.02 0.00 0.00 177.57 177.64 2nuu h ILE 57 N 0.03 1.19 -0.52 0.00 1.08 -1.20 -2.54 117.51 115.54 2nuu h ILE 57 Ca 0.05 -0.58 -0.03 0.00 -0.39 0.00 0.00 64.86 63.90 2nuu h ILE 57 Cb 0.27 1.27 -0.03 0.00 -3.07 0.00 0.00 36.82 35.27 2nuu h ILE 57 CO 0.00 0.18 0.21 -0.07 -0.69 0.00 0.00 178.15 177.77 2nuu h LEU 58 N 0.08 0.68 0.35 1.44 3.38 -1.40 -1.50 115.31 118.33 2nuu h LEU 58 Ca 0.05 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 2nuu h LEU 58 Cb 0.23 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.81 2nuu h LEU 58 CO -0.00 0.62 -0.18 -0.25 0.09 0.00 0.00 178.44 178.71 2nuu h TRP 59 N 0.74 -0.47 0.00 1.13 2.91 -0.90 -1.24 115.95 118.12 2nuu h TRP 59 Ca 0.18 -0.01 -0.08 0.00 1.13 0.00 0.00 58.89 60.11 2nuu h TRP 59 Cb 0.15 0.16 -0.01 0.00 -0.51 0.00 0.00 29.16 28.95 2nuu h TRP 59 CO 0.01 -0.29 -0.38 -0.39 -1.03 0.00 0.00 178.44 176.36 2nuu h VAL 60 N -0.49 0.91 -0.08 2.65 -1.51 -1.31 0.68 116.25 117.11 2nuu h VAL 60 Ca -0.04 -1.51 -0.12 0.00 -1.23 0.00 0.00 66.70 63.80 2nuu h VAL 60 Cb 0.39 1.91 0.01 0.00 -2.13 0.00 0.00 31.29 31.46 2nuu h VAL 60 CO 0.06 0.37 -0.43 0.58 -1.23 0.00 0.00 177.57 176.93 2nuu h VAL 61 N 0.00 1.40 0.00 7.19 2.07 -1.16 -2.68 116.25 123.07 2nuu h VAL 61 Ca -0.00 -1.81 0.00 0.00 0.82 0.00 0.00 66.70 65.71 2nuu h VAL 61 Cb 0.88 2.31 0.00 0.00 -1.52 0.00 0.00 31.29 32.96 2nuu h VAL 61 CO 0.05 0.53 0.00 0.00 0.02 0.00 0.00 177.57 178.17 2nuu n TYR 62 N -4.32 0.00 -0.08 1.57 0.18 -0.93 -1.57 117.16 112.02 2nuu n TYR 62 Ca -0.08 0.00 -0.09 0.00 1.88 0.00 0.00 57.90 59.60 2nuu n TYR 62 Cb 0.56 0.00 -0.03 0.00 -0.38 0.00 0.00 39.34 39.49 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 -0.38 0.99 -7.48 0.00 -0.77 -0.44 103.07 94.99 2nuu h GLY 63 Ca 0.00 0.44 0.01 0.00 0.00 0.00 0.00 47.33 47.77 2nuu h GLY 63 CO 0.00 -0.21 0.34 -1.82 0.00 0.00 0.00 176.54 174.85 2nuu h TYR 64 N -0.32 0.64 -0.61 5.60 3.20 -1.13 -1.62 116.97 122.73 2nuu h TYR 64 Ca 0.14 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.03 2nuu h TYR 64 Cb 0.55 -0.22 -0.03 0.00 1.54 0.00 0.00 36.73 38.58 2nuu h TYR 64 CO -0.51 0.40 0.38 1.03 -1.64 0.00 0.00 178.16 177.82 2nuu h SER 65 N 0.69 0.71 0.69 -2.11 0.87 -1.68 0.33 113.55 113.05 2nuu h SER 65 Ca 0.19 -0.04 -0.12 0.00 -1.23 0.00 0.00 61.79 60.59 2nuu h SER 65 Cb -0.07 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 61.70 2nuu h SER 65 CO -0.05 0.54 -0.57 -0.07 -0.53 0.00 0.00 176.83 176.15 2nuu h LEU 66 N 0.82 0.00 0.14 2.23 3.38 -0.89 -1.76 115.31 119.23 2nuu h LEU 66 Ca 0.22 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.85 2nuu h LEU 66 Cb -0.06 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.69 2nuu h LEU 66 CO -0.04 0.57 -1.77 0.00 0.09 0.00 0.00 178.44 177.28 2nuu h ALA 67 N 1.43 0.27 0.00 1.53 0.00 -1.03 1.27 119.26 122.73 2nuu h ALA 67 Ca -0.01 -1.23 -0.11 0.00 0.00 0.00 0.00 54.91 53.56 2nuu h ALA 67 Cb 1.07 0.57 -0.02 0.00 0.00 0.00 0.00 17.79 19.41 2nuu h ALA 67 CO 0.07 1.09 -1.98 1.19 0.00 0.00 0.00 179.25 179.62 2nuu n PHE 68 N -3.64 0.00 -0.81 0.00 3.72 0.12 -4.11 117.46 112.73 2nuu n PHE 68 Ca -0.28 0.00 -0.29 0.00 -0.05 0.00 0.00 57.45 56.83 2nuu n PHE 68 Cb 1.02 -0.58 0.19 0.00 -0.94 0.00 0.00 39.48 39.17 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 -4.52 1.60 0.06 1.37 0.00 -0.68 -4.98 107.32 100.18 2nuu s GLY 69 Ca -0.08 0.06 -0.20 0.00 0.00 0.00 0.00 44.72 44.51 2nuu s GLY 69 CO 0.76 0.63 0.59 1.85 0.00 0.00 0.00 173.10 176.93 2nuu s GLU 70 N -4.67 4.25 0.00 2.90 2.12 -1.26 -4.16 118.70 117.88 2nuu s GLU 70 Ca 0.66 0.76 0.00 0.00 0.36 0.00 0.00 54.97 56.75 2nuu s GLU 70 Cb -0.22 -3.27 0.00 0.00 0.26 0.00 0.00 34.13 30.90 2nuu s GLU 70 CO 0.60 0.57 0.00 0.41 -0.54 0.00 0.00 175.26 176.30 2nuu n GLY 71 N 1.90 1.14 0.00 -1.50 0.00 -1.26 -3.96 105.19 101.52 2nuu n GLY 71 Ca -0.09 0.30 0.00 0.00 0.00 0.00 0.00 46.02 46.23 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 1.95 0.00 1.61 0.23 -1.01 -5.03 115.26 113.01 2nuu n ASN 72 Ca 0.00 -0.21 0.12 0.00 -0.53 0.00 0.00 54.58 53.96 2nuu n ASN 72 Cb 0.00 0.00 0.55 0.00 -2.08 0.00 0.00 39.78 38.25 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 -0.21 0.00 -0.11 0.53 3.02 -1.26 -4.07 115.26 113.15 2nuu n ASN 73 Ca 0.00 0.30 -0.21 0.00 -0.03 0.00 0.00 54.58 54.64 2nuu n ASN 73 Cb 0.00 -0.42 -0.09 0.00 -0.61 0.00 0.00 39.78 38.66 2nuu n ASN 73 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 2nuu n PHE 74 N -1.42 0.00 -3.83 3.10 7.35 -1.26 -0.96 117.46 120.44 2nuu n PHE 74 Ca 0.08 0.00 -0.10 0.00 -0.76 0.00 0.00 57.45 56.67 2nuu n PHE 74 Cb 0.25 -0.80 -0.06 0.00 0.35 0.00 0.00 39.48 39.22 2nuu n PHE 74 CO 0.00 0.00 0.00 -0.59 -0.76 0.00 0.00 176.76 175.41 2nuu s PHE 75 N -2.41 0.11 0.00 -5.13 -0.12 -1.26 -4.49 117.98 104.68 2nuu s PHE 75 Ca -0.30 -0.46 0.00 0.00 -0.05 0.00 0.00 56.93 56.11 2nuu s PHE 75 Cb 0.10 0.14 0.00 0.00 -0.63 0.00 0.00 43.02 42.64 2nuu s PHE 75 CO 0.42 -0.77 0.00 0.41 -0.05 0.00 0.00 175.22 175.24 2nuu n GLY 76 N -0.24 -0.20 2.91 1.99 0.00 0.44 -2.41 105.19 107.67 2nuu n GLY 76 Ca -0.10 -0.15 -0.20 0.00 0.00 0.00 0.00 46.02 45.57 2nuu n GLY 76 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2nuu n ASN 77 N 0.00 0.29 -0.87 1.61 0.23 -1.14 -4.14 115.26 111.24 2nuu n ASN 77 Ca 0.00 -2.93 0.09 0.00 -0.53 0.00 0.00 54.58 51.20 2nuu n ASN 77 Cb 0.00 1.20 0.18 0.00 -2.08 0.00 0.00 39.78 39.07 2nuu n ASN 77 CO 0.00 0.00 0.00 -0.38 -0.93 0.00 0.00 177.26 175.95 2nuu n ILE 78 N -0.69 0.65 0.31 1.53 2.08 -1.26 -3.51 119.36 118.46 2nuu n ILE 78 Ca 0.01 -0.82 0.16 0.00 0.56 0.00 0.00 62.75 62.65 2nuu n ILE 78 Cb 0.54 0.80 0.61 0.00 -0.75 0.00 0.00 39.64 40.85 2nuu n ILE 78 CO 0.00 0.00 0.00 0.78 0.56 0.00 0.00 176.55 177.89 2nuu h ASN 79 N 3.19 0.00 -1.55 4.38 -0.26 -1.94 -3.29 115.58 116.11 2nuu h ASN 79 Ca 0.00 0.00 -0.66 0.00 -0.56 0.00 0.00 56.30 55.08 2nuu h ASN 79 Cb 0.80 0.00 -0.35 0.00 -1.06 0.00 0.00 38.32 37.71 2nuu h ASN 79 CO 0.00 0.00 0.12 0.79 -1.06 0.00 0.00 177.43 177.28 2nuu n TRP 80 N -2.91 3.15 -2.54 1.19 8.01 -1.26 -4.43 117.44 118.65 2nuu n TRP 80 Ca 0.01 -2.70 -0.43 0.00 -1.31 0.00 0.00 57.50 53.07 2nuu n TRP 80 Cb 0.31 -0.69 -0.02 0.00 -2.01 0.00 0.00 31.31 28.90 2nuu n TRP 80 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.69 176.17 2nuu s LEU 81 N -3.78 4.03 -1.14 -0.99 2.01 -1.24 -2.68 118.68 114.88 2nuu s LEU 81 Ca 0.52 1.33 -0.00 0.00 0.01 0.00 0.00 54.13 55.99 2nuu s LEU 81 Cb 0.43 -3.54 0.00 0.00 0.01 0.00 0.00 46.19 43.09 2nuu s LEU 81 CO -0.23 -0.84 0.03 0.23 1.01 0.00 0.00 176.35 176.56 2nuu n MET 82 N 6.75 -1.25 -1.41 1.70 2.81 -0.61 -2.28 117.12 122.83 2nuu n MET 82 Ca 0.13 0.65 -0.14 0.00 -1.81 0.00 0.00 57.70 56.53 2nuu n MET 82 Cb 0.46 -4.90 -0.06 0.00 -0.71 0.00 0.00 33.22 28.01 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 -2.00 -0.79 -4.77 4.03 4.77 -1.09 -4.97 117.00 112.18 2nuu n LEU 83 Ca -0.15 0.35 -0.35 0.00 -0.03 0.00 0.00 56.01 55.83 2nuu n LEU 83 Cb 0.62 -2.61 0.02 0.00 -2.33 0.00 0.00 43.42 39.12 2nuu n LEU 83 CO 0.20 -0.99 0.79 -1.59 -1.33 0.00 0.00 177.39 174.46 2nuu s LYS 84 N -3.17 3.13 0.00 3.23 -2.85 -0.97 -2.18 119.74 116.94 2nuu s LYS 84 Ca 0.00 1.63 0.00 0.00 -1.00 0.00 0.00 55.97 56.60 2nuu s LYS 84 Cb 0.00 -1.97 0.00 0.00 -2.06 0.00 0.00 37.83 33.80 2nuu s LYS 84 CO 0.00 -1.03 0.00 0.09 0.10 0.00 0.00 175.35 174.51 2nuu n ASN 85 N -1.60 0.00 -4.35 0.03 3.02 -1.26 -4.11 115.26 106.98 2nuu n ASN 85 Ca 0.12 0.00 -0.39 0.00 -0.03 0.00 0.00 54.58 54.28 2nuu n ASN 85 Cb 0.51 0.00 -0.12 0.00 -0.61 0.00 0.00 39.78 39.56 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 -3.48 4.28 0.37 2.41 1.01 -0.93 -5.04 121.20 119.83 2nuu s ILE 86 Ca 0.00 -0.87 -0.26 0.00 0.00 0.00 0.00 60.65 59.52 2nuu s ILE 86 Cb 0.00 -3.36 -0.09 0.00 0.01 0.00 0.00 42.46 39.02 2nuu s ILE 86 CO 0.00 -0.15 1.12 -1.61 0.00 0.00 0.00 174.94 174.29 2nuu s GLU 87 N 1.51 4.22 0.53 2.79 0.41 -1.26 -4.91 118.70 121.99 2nuu s GLU 87 Ca 0.01 1.73 0.23 0.00 -0.41 0.00 0.00 54.97 56.53 2nuu s GLU 87 Cb -0.19 -2.75 1.39 0.00 -1.78 0.00 0.00 34.13 30.81 2nuu s GLU 87 CO 0.05 -0.15 2.06 1.25 -0.49 0.00 0.00 175.26 177.98 2nuu h LEU 88 N 2.85 0.00 -1.45 1.80 5.85 -1.97 -0.68 115.31 121.70 2nuu h LEU 88 Ca -0.48 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.24 2nuu h LEU 88 Cb 1.22 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.25 2nuu h LEU 88 CO 0.63 0.00 0.00 0.35 -0.34 0.00 0.00 178.44 179.08 2nuu n THR 89 N -4.36 0.23 -1.99 1.05 -2.24 -1.26 -4.74 114.28 100.97 2nuu n THR 89 Ca 0.05 -0.44 -0.42 0.00 -2.27 0.00 0.00 64.05 60.97 2nuu n THR 89 Cb 0.42 0.63 -0.03 0.00 -2.10 0.00 0.00 70.33 69.26 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 -1.77 3.67 -0.14 6.98 0.00 -0.27 -4.90 121.76 125.33 2nuu s ALA 90 Ca 0.34 1.33 -0.05 0.00 0.00 0.00 0.00 51.96 53.59 2nuu s ALA 90 Cb 0.19 -3.58 -0.04 0.00 0.00 0.00 0.00 23.12 19.70 2nuu s ALA 90 CO 0.29 -0.75 0.03 0.08 0.00 0.00 0.00 175.76 175.41 2nuu s VAL 91 N 0.39 4.52 -0.30 0.00 1.01 -1.26 0.31 120.40 125.07 2nuu s VAL 91 Ca 0.63 -0.15 0.03 0.00 0.00 0.00 0.00 61.98 62.49 2nuu s VAL 91 Cb -0.42 -2.98 0.08 0.00 0.00 0.00 0.00 36.38 33.06 2nuu s VAL 91 CO 0.39 0.53 -0.02 -0.32 0.00 0.00 0.00 175.10 175.68 2nuu s MET 92 N -0.15 1.76 5.30 2.72 0.00 0.13 -4.74 119.30 124.31 2nuu s MET 92 Ca 0.06 -1.60 0.00 0.00 0.00 0.00 0.00 55.69 54.15 2nuu s MET 92 Cb -0.12 -3.01 0.00 0.00 0.00 0.00 0.00 34.83 31.69 2nuu s MET 92 CO 0.02 -0.78 0.00 0.41 0.00 0.00 0.00 175.02 174.67 2nuu n GLY 93 N 4.36 1.76 0.20 2.11 0.00 -1.26 -2.46 105.19 109.91 2nuu n GLY 93 Ca -0.04 -0.16 0.03 0.00 0.00 0.00 0.00 46.02 45.85 2nuu n GLY 93 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2nuu n SER 94 N 9.08 1.02 -4.28 1.61 3.41 -1.26 -4.88 113.62 118.32 2nuu n SER 94 Ca 0.00 -2.16 -0.19 0.00 -0.26 0.00 0.00 58.87 56.27 2nuu n SER 94 Cb 0.00 -0.20 -0.11 0.00 -0.26 0.00 0.00 64.21 63.64 2nuu n SER 94 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 2nuu s ILE 95 N -1.03 1.51 0.24 -1.33 -4.36 -1.03 -1.51 121.20 113.69 2nuu s ILE 95 Ca 0.10 -1.86 -0.30 0.00 -0.26 0.00 0.00 60.65 58.32 2nuu s ILE 95 Cb 0.09 -1.71 -0.10 0.00 1.25 0.00 0.00 42.46 41.99 2nuu s ILE 95 CO 0.01 -0.43 1.46 -0.31 0.24 0.00 0.00 174.94 175.91 2nuu s TYR 96 N -2.30 3.02 0.50 1.37 2.02 -1.26 0.22 117.35 120.92 2nuu s TYR 96 Ca 0.13 0.96 0.24 0.00 -0.37 0.00 0.00 57.07 58.04 2nuu s TYR 96 Cb -0.04 -3.84 1.33 0.00 -0.40 0.00 0.00 41.96 39.00 2nuu s TYR 96 CO 0.04 -2.80 1.94 0.37 -1.57 0.00 0.00 175.55 173.53 2nuu h GLN 97 N 5.29 0.11 -0.31 -0.62 4.15 -0.44 0.87 115.11 124.16 2nuu h GLN 97 Ca -0.45 -0.01 0.09 0.00 0.77 0.00 0.00 58.65 59.05 2nuu h GLN 97 Cb 1.22 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.87 2nuu h GLN 97 CO 0.80 0.07 0.22 1.88 -1.93 0.00 0.00 178.83 179.87 2nuu h TYR 98 N 0.11 0.01 -0.07 3.99 -1.99 -1.85 0.08 116.97 117.26 2nuu h TYR 98 Ca 0.34 0.00 -0.24 0.00 2.00 0.00 0.00 58.73 60.83 2nuu h TYR 98 Cb 1.18 -0.00 0.01 0.00 2.00 0.00 0.00 36.73 39.91 2nuu h TYR 98 CO -0.00 0.01 -0.89 0.82 -0.00 0.00 0.00 178.16 178.09 2nuu h ILE 99 N 0.01 1.31 -0.47 -2.88 2.04 -1.18 -2.87 117.51 113.46 2nuu h ILE 99 Ca 0.15 -2.16 0.00 0.00 1.00 0.00 0.00 64.86 63.85 2nuu h ILE 99 Cb 0.57 2.20 -0.02 0.00 -0.74 0.00 0.00 36.82 38.83 2nuu h ILE 99 CO -0.00 0.67 0.31 -0.74 0.00 0.00 0.00 178.15 178.38 2nuu h HIS 100 N 0.42 0.60 -0.70 1.37 2.76 -0.98 -0.06 115.15 118.55 2nuu h HIS 100 Ca -0.08 0.01 0.10 0.00 -2.20 0.00 0.00 60.37 58.20 2nuu h HIS 100 Cb 1.53 -0.20 -0.07 0.00 1.55 0.00 0.00 27.41 30.21 2nuu h HIS 100 CO 0.08 0.39 0.33 0.28 -1.30 0.00 0.00 177.93 177.71 2nuu h VAL 101 N 0.63 0.81 -0.02 5.26 2.07 -1.14 -0.33 116.25 123.53 2nuu h VAL 101 Ca 0.17 -0.19 -0.00 0.00 0.82 0.00 0.00 66.70 67.50 2nuu h VAL 101 Cb -0.06 0.21 -0.00 0.00 -1.52 0.00 0.00 31.29 29.92 2nuu h VAL 101 CO -0.04 0.10 -0.00 0.00 0.02 0.00 0.00 177.57 177.65 2nuu h ALA 102 N 1.44 0.03 0.01 1.67 0.00 -1.16 -1.57 119.26 119.68 2nuu h ALA 102 Ca 0.35 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 55.11 2nuu h ALA 102 Cb 0.41 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 2nuu h ALA 102 CO -0.29 -0.30 -0.18 0.35 0.00 0.00 0.00 179.25 178.83 2nuu h PHE 103 N -0.29 -0.46 -0.48 0.00 3.57 -0.70 -1.42 116.94 117.15 2nuu h PHE 103 Ca 0.01 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.45 2nuu h PHE 103 Cb 0.34 0.20 -0.02 0.00 2.79 0.00 0.00 35.95 39.27 2nuu h PHE 103 CO 0.04 -0.26 0.02 1.96 -2.23 0.00 0.00 178.31 177.84 2nuu h GLN 104 N -0.30 0.79 -0.23 1.11 1.08 -1.12 -2.45 115.11 113.99 2nuu h GLN 104 Ca 0.05 -0.20 -0.02 0.00 -1.45 0.00 0.00 58.65 57.03 2nuu h GLN 104 Cb 0.36 -0.10 -0.01 0.00 -0.05 0.00 0.00 27.48 27.68 2nuu h GLN 104 CO -0.16 0.78 0.04 0.78 -0.95 0.00 0.00 178.83 179.32 2nuu h GLY 105 N 0.97 0.35 1.65 3.46 0.00 -0.95 -1.88 103.07 106.67 2nuu h GLY 105 Ca 0.15 -0.16 -0.11 0.00 0.00 0.00 0.00 47.33 47.20 2nuu h GLY 105 CO 0.02 0.16 -0.36 1.48 0.00 0.00 0.00 176.54 177.83 2nuu h SER 106 N 0.32 0.41 -0.28 0.19 4.64 -0.77 -2.46 113.55 115.60 2nuu h SER 106 Ca 0.08 -0.17 -0.07 0.00 -0.47 0.00 0.00 61.79 61.16 2nuu h SER 106 Cb 0.15 -0.11 -0.02 0.00 -0.31 0.00 0.00 62.40 62.11 2nuu h SER 106 CO -0.00 0.75 -0.05 -0.26 -0.87 0.00 0.00 176.83 176.39 2nuu h PHE 107 N 0.34 0.70 -0.55 4.77 -1.00 -1.22 -2.28 116.94 117.69 2nuu h PHE 107 Ca 0.04 -0.10 -0.08 0.00 2.81 0.00 0.00 57.97 60.64 2nuu h PHE 107 Cb 0.80 -0.19 -0.02 0.00 3.61 0.00 0.00 35.95 40.15 2nuu h PHE 107 CO 0.02 0.69 0.04 0.00 -1.61 0.00 0.00 178.31 177.45 2nuu h ALA 108 N 1.34 1.02 0.81 2.45 0.00 -1.18 -2.64 119.26 121.05 2nuu h ALA 108 Ca 0.12 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.72 2nuu h ALA 108 Cb 0.46 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 18.04 2nuu h ALA 108 CO 0.02 0.61 -0.39 0.00 0.00 0.00 0.00 179.25 179.50 2nuu h ILE 110 N -1.26 0.94 -0.49 0.00 6.09 -1.48 -0.11 117.51 121.19 2nuu h ILE 110 Ca -0.11 -0.31 0.05 0.00 -1.37 0.00 0.00 64.86 63.11 2nuu h ILE 110 Cb 0.84 -0.05 -0.04 0.00 0.47 0.00 0.00 36.82 38.03 2nuu h ILE 110 CO 0.18 0.17 0.24 0.74 -3.07 0.00 0.00 178.15 176.41 2nuu h THR 111 N 0.91 0.95 -0.37 2.19 2.02 -1.49 0.23 112.91 117.35 2nuu h THR 111 Ca 0.43 -0.16 -0.11 0.00 0.77 0.00 0.00 66.41 67.34 2nuu h THR 111 Cb 0.38 0.43 -0.01 0.00 -1.74 0.00 0.00 68.15 67.20 2nuu h THR 111 CO -0.24 0.09 -0.23 0.58 0.37 0.00 0.00 175.52 176.08 2nuu h VAL 112 N 0.48 1.27 -0.32 3.16 2.07 -1.09 -2.99 116.25 118.82 2nuu h VAL 112 Ca 0.22 -1.33 0.00 0.00 0.82 0.00 0.00 66.70 66.41 2nuu h VAL 112 Cb 0.14 1.23 -0.02 0.00 -1.52 0.00 0.00 31.29 31.13 2nuu h VAL 112 CO -0.16 0.44 0.20 1.23 0.02 0.00 0.00 177.57 179.30 2nuu h GLY 113 N 0.97 0.46 0.54 2.17 0.00 -0.14 -2.80 103.07 104.28 2nuu h GLY 113 Ca 0.09 -0.18 0.10 0.00 0.00 0.00 0.00 47.33 47.34 2nuu h GLY 113 CO 0.06 0.18 0.63 1.41 0.00 0.00 0.00 176.54 178.81 2nuu h LEU 114 N 0.42 0.94 -0.74 3.11 3.38 -0.85 -2.61 115.31 118.97 2nuu h LEU 114 Ca 0.12 0.04 0.06 0.00 0.09 0.00 0.00 57.88 58.19 2nuu h LEU 114 Cb -0.02 -0.15 -0.06 0.00 0.09 0.00 0.00 40.66 40.52 2nuu h LEU 114 CO -0.02 0.53 0.43 0.40 0.09 0.00 0.00 178.44 179.87 2nuu h ILE 115 N 1.03 0.98 -0.07 1.22 2.04 -1.37 -3.11 117.51 118.23 2nuu h ILE 115 Ca 0.47 -0.27 0.02 0.00 1.00 0.00 0.00 64.86 66.09 2nuu h ILE 115 Cb 0.39 0.14 -0.00 0.00 -0.74 0.00 0.00 36.82 36.61 2nuu h ILE 115 CO -0.24 0.14 0.27 1.62 0.00 0.00 0.00 178.15 179.94 2nuu h VAL 116 N 0.77 0.11 0.00 1.67 3.04 -1.45 -2.70 116.25 117.69 2nuu h VAL 116 Ca 0.33 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 66.02 2nuu h VAL 116 Cb 0.21 0.75 0.00 0.00 -2.01 0.00 0.00 31.29 30.24 2nuu h VAL 116 CO -0.19 0.00 0.00 0.61 -1.01 0.00 0.00 177.57 176.98 2nuu n GLY 117 N -1.25 -0.98 0.00 3.17 0.00 -1.18 -3.09 105.19 101.87 2nuu n GLY 117 Ca -0.01 -0.15 0.09 0.00 0.00 0.00 0.00 46.02 45.95 2nuu n GLY 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nuu n ALA 118 N -1.12 4.16 0.78 4.61 0.00 -1.02 -2.02 120.51 125.89 2nuu n ALA 118 Ca 0.17 -0.50 0.08 0.00 0.00 0.00 0.00 53.44 53.19 2nuu n ALA 118 Cb 0.14 -0.65 -0.07 0.00 0.00 0.00 0.00 19.45 18.88 2nuu n ALA 118 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2nuu n LEU 119 N -1.51 1.06 -4.49 0.00 4.77 -1.18 -4.20 117.00 111.46 2nuu n LEU 119 Ca 0.03 -0.58 -0.41 0.00 -0.03 0.00 0.00 56.01 55.02 2nuu n LEU 119 Cb 0.30 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.41 2nuu n LEU 119 CO 0.37 0.23 0.18 0.00 -1.33 0.00 0.00 177.39 176.84 2nuu n ALA 120 N -1.01 -1.05 0.00 -1.18 0.00 -1.20 -2.92 120.51 113.15 2nuu n ALA 120 Ca 0.04 0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.61 2nuu n ALA 120 Cb 0.29 -1.85 0.00 0.00 0.00 0.00 0.00 19.45 17.89 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 0.30 0.00 0.00 0.00 1.02 -1.26 -4.70 120.64 116.00 2nuu n GLU 121 Ca 0.11 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.25 2nuu n GLU 121 Cb 0.42 -1.83 0.00 0.00 -0.02 0.00 0.00 31.44 30.00 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 -1.99 0.00 -3.49 3.49 0.00 -1.22 -4.81 116.66 108.64 2nuu n ARG 122 Ca 0.00 -0.01 -0.33 0.00 -0.00 0.00 0.00 57.85 57.51 2nuu n ARG 122 Cb 0.00 -0.38 -0.05 0.00 -0.00 0.00 0.00 32.46 32.03 2nuu n ARG 122 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.63 176.13 2nuu s ILE 123 N 0.00 5.00 -0.03 8.89 2.07 -1.15 -2.26 121.20 133.72 2nuu s ILE 123 Ca 0.00 0.41 -0.29 0.00 -1.41 0.00 0.00 60.65 59.36 2nuu s ILE 123 Cb 0.00 -3.64 -0.03 0.00 0.13 0.00 0.00 42.46 38.93 2nuu s ILE 123 CO 0.00 0.04 0.94 -0.60 -1.91 0.00 0.00 174.94 173.41 2nuu s ARG 124 N -2.55 4.52 0.23 3.50 3.52 0.30 -4.75 118.95 123.72 2nuu s ARG 124 Ca 0.43 1.33 -0.09 0.00 -0.13 0.00 0.00 55.73 57.27 2nuu s ARG 124 Cb -0.12 -3.47 0.36 0.00 -1.56 0.00 0.00 34.95 30.16 2nuu s ARG 124 CO 0.21 -0.07 1.67 0.35 -0.81 0.00 0.00 175.30 176.65 2nuu h PHE 125 N 6.85 0.08 -0.15 5.12 3.04 -1.94 -0.71 116.94 129.22 2nuu h PHE 125 Ca -0.39 0.04 -0.06 0.00 3.98 0.00 0.00 57.97 61.54 2nuu h PHE 125 Cb 1.21 0.07 -0.01 0.00 2.56 0.00 0.00 35.95 39.77 2nuu h PHE 125 CO 0.68 -0.13 -0.18 0.66 -2.02 0.00 0.00 178.31 177.32 2nuu h SER 126 N 0.18 0.24 -0.34 0.41 4.64 -1.95 -2.43 113.55 114.31 2nuu h SER 126 Ca 0.36 -0.06 -0.06 0.00 -0.47 0.00 0.00 61.79 61.56 2nuu h SER 126 Cb 0.59 -0.06 -0.02 0.00 -0.31 0.00 0.00 62.40 62.60 2nuu h SER 126 CO -0.52 0.44 0.03 0.00 -0.87 0.00 0.00 176.83 175.91 2nuu h ALA 127 N 1.59 1.26 -0.50 5.18 0.00 -1.42 -2.30 119.26 123.07 2nuu h ALA 127 Ca 0.04 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.67 2nuu h ALA 127 Cb 0.46 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 2nuu h ALA 127 CO 0.03 0.50 0.04 0.28 0.00 0.00 0.00 179.25 180.10 2nuu h VAL 128 N 0.64 1.26 -0.00 0.00 2.07 -0.97 -2.02 116.25 117.22 2nuu h VAL 128 Ca 0.14 -1.00 -0.00 0.00 0.82 0.00 0.00 66.70 66.65 2nuu h VAL 128 Cb 0.35 0.93 -0.00 0.00 -1.52 0.00 0.00 31.29 31.05 2nuu h VAL 128 CO 0.01 0.36 0.00 -0.07 0.02 0.00 0.00 177.57 177.88 2nuu h LEU 129 N 0.72 0.00 -0.18 2.57 3.38 -1.27 -0.61 115.31 119.92 2nuu h LEU 129 Ca 0.15 -0.06 0.03 0.00 0.09 0.00 0.00 57.88 58.09 2nuu h LEU 129 Cb 0.46 -0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.18 2nuu h LEU 129 CO 0.02 0.06 0.01 0.40 0.09 0.00 0.00 178.44 179.01 2nuu h ILE 130 N -0.06 0.89 -0.28 1.22 2.04 -1.39 -2.45 117.51 117.48 2nuu h ILE 130 Ca 0.00 -0.02 0.06 0.00 1.00 0.00 0.00 64.86 65.89 2nuu h ILE 130 Cb 0.06 0.81 -0.05 0.00 -0.74 0.00 0.00 36.82 36.89 2nuu h ILE 130 CO -0.00 0.01 -0.08 0.15 0.00 0.00 0.00 178.15 178.23 2nuu h PHE 131 N 0.07 -0.17 -0.63 1.37 3.57 -1.14 -2.37 116.94 117.64 2nuu h PHE 131 Ca 0.08 0.03 0.10 0.00 3.53 0.00 0.00 57.97 61.70 2nuu h PHE 131 Cb 0.10 0.12 -0.07 0.00 2.79 0.00 0.00 35.95 38.88 2nuu h PHE 131 CO -0.16 -0.13 0.24 0.28 -2.23 0.00 0.00 178.31 176.31 2nuu h VAL 132 N -0.01 0.77 -0.43 1.41 2.07 -0.78 0.33 116.25 119.61 2nuu h VAL 132 Ca 0.14 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.51 2nuu h VAL 132 Cb 0.22 0.31 -0.02 0.00 -1.52 0.00 0.00 31.29 30.27 2nuu h VAL 132 CO -0.29 0.08 0.27 0.58 0.02 0.00 0.00 177.57 178.23 2nuu h VAL 133 N 0.42 1.12 0.23 2.57 2.07 -0.99 -0.66 116.25 121.02 2nuu h VAL 133 Ca 0.32 -0.25 -0.01 0.00 0.82 0.00 0.00 66.70 67.58 2nuu h VAL 133 Cb 0.39 0.52 0.00 0.00 -1.52 0.00 0.00 31.29 30.68 2nuu h VAL 133 CO -0.31 0.12 -0.11 0.58 0.02 0.00 0.00 177.57 177.87 2nuu h VAL 134 N 0.57 0.81 -0.06 2.57 2.07 -0.91 -2.99 116.25 118.32 2nuu h VAL 134 Ca 0.16 -0.81 0.01 0.00 0.82 0.00 0.00 66.70 66.88 2nuu h VAL 134 Cb -0.04 1.24 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 2nuu h VAL 134 CO -0.03 0.16 -0.01 -0.25 0.02 0.00 0.00 177.57 177.46 2nuu h TRP 135 N -0.75 -0.02 0.22 1.57 7.01 -0.33 -0.48 115.95 123.17 2nuu h TRP 135 Ca -0.03 0.01 0.00 0.00 2.11 0.00 0.00 58.89 60.97 2nuu h TRP 135 Cb 0.50 0.02 -0.01 0.00 -2.10 0.00 0.00 29.16 27.57 2nuu h TRP 135 CO 0.05 -0.02 -0.19 1.25 -2.79 0.00 0.00 178.44 176.73 2nuu h LEU 136 N 0.01 -0.51 -0.16 0.65 5.85 -1.25 0.85 115.31 120.75 2nuu h LEU 136 Ca 0.03 0.04 0.04 0.00 0.84 0.00 0.00 57.88 58.83 2nuu h LEU 136 Cb 0.04 0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.20 2nuu h LEU 136 CO -0.06 -0.29 -0.10 0.74 -0.34 0.00 0.00 178.44 178.38 2nuu h THR 137 N -0.44 0.69 0.00 1.05 2.02 -1.46 -2.24 112.91 112.53 2nuu h THR 137 Ca -0.01 0.00 -0.10 0.00 0.77 0.00 0.00 66.41 67.07 2nuu h THR 137 Cb 0.40 0.69 -0.02 0.00 -1.74 0.00 0.00 68.15 67.48 2nuu h THR 137 CO -0.03 0.00 -1.26 0.18 0.37 0.00 0.00 175.52 174.78 2nuu n LEU 138 N -5.25 0.86 -0.05 2.58 4.77 -0.20 -4.43 117.00 115.29 2nuu n LEU 138 Ca -0.03 0.36 -0.08 0.00 -0.03 0.00 0.00 56.01 56.23 2nuu n LEU 138 Cb 0.17 0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.26 2nuu n LEU 138 CO 0.23 0.02 -0.56 -0.24 -1.33 0.00 0.00 177.39 175.51 2nuu n SER 139 N -2.81 1.53 0.29 -1.43 2.88 0.29 -4.60 113.62 109.77 2nuu n SER 139 Ca -0.06 0.24 -0.17 0.00 -1.33 0.00 0.00 58.87 57.56 2nuu n SER 139 Cb 0.73 -0.56 -0.08 0.00 -0.75 0.00 0.00 64.21 63.54 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 -0.61 -0.95 -0.34 0.66 5.03 -1.21 -2.60 116.97 116.95 2nuu h TYR 140 Ca -0.09 -0.00 0.07 0.00 2.58 0.00 0.00 58.73 61.28 2nuu h TYR 140 Cb 0.77 0.35 -0.08 0.00 1.55 0.00 0.00 36.73 39.32 2nuu h TYR 140 CO -0.22 -0.53 -0.41 0.82 -1.32 0.00 0.00 178.16 176.51 2nuu h ILE 141 N -0.83 0.14 -0.89 1.81 2.04 -1.63 0.20 117.51 118.35 2nuu h ILE 141 Ca -0.05 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.81 2nuu h ILE 141 Cb 0.70 0.14 -0.04 0.00 -0.74 0.00 0.00 36.82 36.87 2nuu h ILE 141 CO 0.02 0.00 0.57 -0.65 0.00 0.00 0.00 178.15 178.09 2nuu h PRO 142 N -0.35 1.18 -0.44 2.37 0.11 -1.78 -0.58 132.00 132.51 2nuu h PRO 142 Ca 0.13 -0.08 -0.07 0.00 0.11 0.00 0.00 66.00 66.09 2nuu h PRO 142 Cb 0.58 -0.26 -0.02 0.00 0.11 0.00 0.00 31.00 31.42 2nuu h PRO 142 CO -0.53 0.80 0.00 0.82 -0.21 0.00 0.00 178.00 178.88 2nuu h ILE 143 N 1.21 1.26 -0.88 4.15 2.04 -0.99 -0.15 117.51 124.16 2nuu h ILE 143 Ca 0.32 -1.03 0.00 0.00 1.00 0.00 0.00 64.86 65.15 2nuu h ILE 143 Cb -0.11 1.06 -0.04 0.00 -0.74 0.00 0.00 36.82 36.99 2nuu h ILE 143 CO -0.07 0.35 0.56 0.00 0.00 0.00 0.00 178.15 179.00 2nuu h ALA 144 N 0.91 1.11 -0.18 1.87 0.00 -0.44 -1.83 119.26 120.70 2nuu h ALA 144 Ca 0.12 -0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 2nuu h ALA 144 Cb 0.49 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2nuu h ALA 144 CO 0.02 0.54 -0.26 1.25 0.00 0.00 0.00 179.25 180.79 2nuu h HIS 145 N 1.19 0.37 0.00 0.00 -0.00 -0.72 -0.25 115.15 115.75 2nuu h HIS 145 Ca 0.32 -0.07 -0.15 0.00 -0.00 0.00 0.00 60.37 60.47 2nuu h HIS 145 Cb -0.11 -0.09 -0.02 0.00 -0.00 0.00 0.00 27.41 27.19 2nuu h HIS 145 CO -0.01 0.57 -0.69 0.52 -0.00 0.00 0.00 177.93 178.32 2nuu h MET 146 N 0.30 0.00 0.00 5.26 2.07 -0.38 -0.30 114.93 121.88 2nuu h MET 146 Ca 0.05 0.00 -0.29 0.00 -2.07 0.00 0.00 59.70 57.39 2nuu h MET 146 Cb 0.63 0.00 -0.04 0.00 -1.87 0.00 0.00 31.60 30.31 2nuu h MET 146 CO 0.05 0.69 -1.84 0.28 1.07 0.00 0.00 176.91 177.16 2nuu n VAL 147 N -3.41 1.52 0.70 -2.22 0.31 -0.75 0.27 118.33 114.75 2nuu n VAL 147 Ca 0.00 -0.16 0.08 0.00 -0.01 0.00 0.00 64.34 64.25 2nuu n VAL 147 Cb 0.76 -2.05 0.05 0.00 -0.91 0.00 0.00 33.84 31.69 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 -4.35 0.00 -1.29 3.52 8.01 -0.15 -4.31 117.44 118.88 2nuu n TRP 148 Ca -0.38 0.00 -0.06 0.00 -1.31 0.00 0.00 57.50 55.74 2nuu n TRP 148 Cb 0.73 0.00 0.22 0.00 -2.01 0.00 0.00 31.31 30.24 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 1.00 4.54 2.47 6.99 0.00 -0.94 -4.91 105.19 114.33 2nuu n GLY 149 Ca 0.09 -1.14 -0.18 0.00 0.00 0.00 0.00 46.02 44.79 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 -0.92 1.17 0.00 -0.02 0.00 -1.23 -4.84 105.19 99.35 2nuu n GLY 150 Ca 0.38 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.24 2nuu n GLY 150 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nuu n GLY 151 N -0.84 -0.24 0.35 -0.02 0.00 -0.17 -4.62 105.19 99.65 2nuu n GLY 151 Ca -0.19 -1.57 -0.11 0.00 0.00 0.00 0.00 46.02 44.15 2nuu n GLY 151 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2nuu h LEU 152 N 0.00 -1.29 -0.83 0.99 5.85 -1.11 -0.92 115.31 118.00 2nuu h LEU 152 Ca 0.00 0.15 -0.08 0.00 0.84 0.00 0.00 57.88 58.79 2nuu h LEU 152 Cb 0.00 0.51 -0.02 0.00 0.37 0.00 0.00 40.66 41.51 2nuu h LEU 152 CO 0.00 -0.36 0.00 -0.07 -0.34 0.00 0.00 178.44 177.68 2nuu h LEU 153 N -0.43 0.85 -0.32 2.25 3.38 -1.67 -2.80 115.31 116.58 2nuu h LEU 153 Ca 0.03 -0.21 -0.00 0.00 0.09 0.00 0.00 57.88 57.78 2nuu h LEU 153 Cb 0.50 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 2nuu h LEU 153 CO -0.33 0.91 0.19 0.00 0.09 0.00 0.00 178.44 179.30 2nuu h ALA 154 N 1.18 0.41 0.00 1.53 0.00 -0.08 -2.00 119.26 120.30 2nuu h ALA 154 Ca 0.15 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2nuu h ALA 154 Cb 0.48 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.14 2nuu h ALA 154 CO 0.02 -0.10 0.00 -1.13 0.00 0.00 0.00 179.25 178.05 2nuu n SER 155 N -4.83 0.54 -1.15 0.00 3.41 -0.36 -1.37 113.62 109.87 2nuu n SER 155 Ca -0.01 0.72 0.11 0.00 -0.26 0.00 0.00 58.87 59.43 2nuu n SER 155 Cb 0.05 -0.80 0.23 0.00 -0.26 0.00 0.00 64.21 63.43 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 -2.19 0.59 -2.03 7.33 -0.00 -0.77 -4.97 115.22 113.17 2nuu n HIS 156 Ca -0.01 -0.31 -0.03 0.00 -0.00 0.00 0.00 57.72 57.37 2nuu n HIS 156 Cb 0.08 -0.00 -0.00 0.00 -0.00 0.00 0.00 29.99 30.06 2nuu n HIS 156 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2nuu n GLY 157 N 1.44 0.26 3.75 -1.41 0.00 -0.47 -5.01 105.19 103.76 2nuu n GLY 157 Ca 0.20 -0.77 -0.36 0.00 0.00 0.00 0.00 46.02 45.08 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 -2.15 2.62 -0.40 4.61 0.00 -1.09 -4.99 121.76 120.37 2nuu s ALA 158 Ca 0.00 1.05 -0.02 0.00 0.00 0.00 0.00 51.96 52.99 2nuu s ALA 158 Cb 0.00 -3.46 0.11 0.00 0.00 0.00 0.00 23.12 19.77 2nuu s ALA 158 CO 0.00 -1.14 0.18 -0.51 0.00 0.00 0.00 175.76 174.29 2nuu s LEU 159 N -3.89 5.17 -0.34 0.00 1.43 -1.26 -4.91 118.68 114.88 2nuu s LEU 159 Ca 0.75 -2.03 -0.00 0.00 -1.03 0.00 0.00 54.13 51.82 2nuu s LEU 159 Cb -0.31 -1.80 0.14 0.00 0.03 0.00 0.00 46.19 44.24 2nuu s LEU 159 CO 0.35 -0.52 0.23 -0.62 0.23 0.00 0.00 176.35 176.02 2nuu s ASP 160 N 1.70 2.71 0.07 2.29 -1.08 -1.26 -4.89 116.67 116.21 2nuu s ASP 160 Ca 0.08 -1.93 -0.24 0.00 -0.52 0.00 0.00 52.55 49.95 2nuu s ASP 160 Cb -0.22 -0.21 -0.16 0.00 -1.46 0.00 0.00 42.92 40.87 2nuu s ASP 160 CO -0.05 -0.32 1.64 0.15 0.52 0.00 0.00 175.17 177.11 2nuu h PHE 161 N 7.24 -0.01 0.00 -5.34 3.57 -1.53 -3.39 116.94 117.49 2nuu h PHE 161 Ca 0.02 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.52 2nuu h PHE 161 Cb 0.99 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.73 2nuu h PHE 161 CO 0.40 0.10 0.00 0.00 -2.23 0.00 0.00 178.31 176.57 2nuu n ALA 162 N -2.15 1.72 0.00 2.41 0.00 -0.71 -4.89 120.51 116.90 2nuu n ALA 162 Ca -0.07 -0.61 0.00 0.00 0.00 0.00 0.00 53.44 52.76 2nuu n ALA 162 Cb 0.08 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.53 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 -0.18 1.14 0.23 0.00 0.00 -1.26 -4.83 105.19 100.29 2nuu n GLY 163 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 2nuu n GLY 163 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2nuu h GLY 164 N 0.00 0.79 0.00 -0.02 0.00 -1.90 -1.15 103.07 100.80 2nuu h GLY 164 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 47.33 46.94 2nuu h GLY 164 CO 0.00 0.37 -0.21 -0.91 0.00 0.00 0.00 176.54 175.79 2nuu h THR 165 N 0.69 0.00 -0.72 4.70 1.35 -1.95 0.33 112.91 117.32 2nuu h THR 165 Ca 0.18 -0.71 0.14 0.00 -0.55 0.00 0.00 66.41 65.46 2nuu h THR 165 Cb 0.11 0.00 -0.14 0.00 -1.73 0.00 0.00 68.15 66.39 2nuu h THR 165 CO -0.02 0.00 -0.22 0.58 -0.25 0.00 0.00 175.52 175.61 2nuu h VAL 166 N -0.71 0.24 0.00 6.82 2.07 -1.92 -1.35 116.25 121.40 2nuu h VAL 166 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2nuu h VAL 166 Cb 0.21 0.24 0.00 0.00 -1.52 0.00 0.00 31.29 30.22 2nuu h VAL 166 CO 0.00 0.00 0.00 0.52 0.02 0.00 0.00 177.57 178.11 2nuu n VAL 167 N -5.48 0.00 0.28 2.57 0.31 -0.53 -4.51 118.33 110.98 2nuu n VAL 167 Ca 0.09 0.44 -0.11 0.00 -0.01 0.00 0.00 64.34 64.75 2nuu n VAL 167 Cb 0.37 -1.39 -0.05 0.00 -0.91 0.00 0.00 33.84 31.86 2nuu n VAL 167 CO 0.00 0.00 0.00 0.45 -1.32 0.00 0.00 176.83 175.96 2nuu h HIS 168 N 0.00 -0.67 -0.89 3.52 3.86 -1.36 -2.28 115.15 117.33 2nuu h HIS 168 Ca 0.00 -0.02 0.01 0.00 -1.16 0.00 0.00 60.37 59.20 2nuu h HIS 168 Cb 0.00 0.22 -0.04 0.00 1.06 0.00 0.00 27.41 28.65 2nuu h HIS 168 CO 0.00 -0.42 0.58 0.82 0.86 0.00 0.00 177.93 179.78 2nuu h ILE 169 N -0.73 1.23 0.22 2.45 2.04 -0.95 -0.68 117.51 121.09 2nuu h ILE 169 Ca -0.07 -0.44 0.01 0.00 1.00 0.00 0.00 64.86 65.35 2nuu h ILE 169 Cb 0.55 -0.07 -0.03 0.00 -0.74 0.00 0.00 36.82 36.53 2nuu h ILE 169 CO 0.12 0.23 -0.37 -1.13 0.00 0.00 0.00 178.15 177.00 2nuu h ASN 170 N 1.22 -1.04 -0.44 1.72 -1.24 -1.32 -2.45 115.58 112.04 2nuu h ASN 170 Ca 0.33 0.11 -0.03 0.00 0.71 0.00 0.00 56.30 57.42 2nuu h ASN 170 Cb -0.12 0.37 -0.02 0.00 0.73 0.00 0.00 38.32 39.28 2nuu h ASN 170 CO -0.07 -0.47 0.17 0.00 -1.29 0.00 0.00 177.43 175.77 2nuu h ALA 171 N -0.15 0.57 -0.37 1.57 0.00 -1.23 -2.65 119.26 117.01 2nuu h ALA 171 Ca 0.00 -0.15 0.08 0.00 0.00 0.00 0.00 54.91 54.84 2nuu h ALA 171 Cb 0.65 -0.17 -0.07 0.00 0.00 0.00 0.00 17.79 18.19 2nuu h ALA 171 CO -0.15 0.18 -0.11 0.00 0.00 0.00 0.00 179.25 179.17 2nuu h ALA 172 N 1.02 0.21 -0.27 0.00 0.00 -1.01 0.50 119.26 119.71 2nuu h ALA 172 Ca 0.15 0.14 -0.02 0.00 0.00 0.00 0.00 54.91 55.18 2nuu h ALA 172 Cb 0.20 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 2nuu h ALA 172 CO -0.01 -0.48 0.09 0.82 0.00 0.00 0.00 179.25 179.67 2nuu h ILE 173 N -0.03 1.19 -0.96 0.00 1.08 -1.41 0.13 117.51 117.51 2nuu h ILE 173 Ca 0.18 -0.61 0.13 0.00 -0.39 0.00 0.00 64.86 64.17 2nuu h ILE 173 Cb 0.30 1.08 -0.09 0.00 -3.07 0.00 0.00 36.82 35.05 2nuu h ILE 173 CO -0.39 0.20 0.59 0.00 -0.69 0.00 0.00 178.15 177.85 2nuu h ALA 174 N 0.93 1.45 -0.04 1.87 0.00 -1.02 -0.65 119.26 121.80 2nuu h ALA 174 Ca 0.09 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 2nuu h ALA 174 Cb 0.22 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 2nuu h ALA 174 CO -0.00 0.15 -0.03 0.78 0.00 0.00 0.00 179.25 180.15 2nuu h GLY 175 N 0.91 0.10 0.48 0.00 0.00 -0.50 -2.08 103.07 101.98 2nuu h GLY 175 Ca 0.49 -0.10 0.09 0.00 0.00 0.00 0.00 47.33 47.81 2nuu h GLY 175 CO -0.28 0.09 0.32 -2.00 0.00 0.00 0.00 176.54 174.66 2nuu h LEU 176 N -0.32 0.41 -0.26 3.11 6.46 -0.22 0.50 115.31 125.00 2nuu h LEU 176 Ca 0.01 0.06 -0.00 0.00 -0.12 0.00 0.00 57.88 57.83 2nuu h LEU 176 Cb 0.48 -0.01 -0.01 0.00 -0.73 0.00 0.00 40.66 40.39 2nuu h LEU 176 CO 0.01 0.24 0.15 0.58 -0.62 0.00 0.00 178.44 178.80 2nuu h VAL 177 N 0.56 1.10 -0.45 1.05 2.07 -1.14 -2.06 116.25 117.37 2nuu h VAL 177 Ca 0.33 -0.23 0.01 0.00 0.82 0.00 0.00 66.70 67.63 2nuu h VAL 177 Cb 0.34 0.79 -0.03 0.00 -1.52 0.00 0.00 31.29 30.88 2nuu h VAL 177 CO -0.26 0.09 0.29 1.23 0.02 0.00 0.00 177.57 178.94 2nuu h GLY 178 N 0.32 0.64 1.74 2.17 0.00 -0.53 -1.60 103.07 105.82 2nuu h GLY 178 Ca 0.09 -0.23 -0.06 0.00 0.00 0.00 0.00 47.33 47.14 2nuu h GLY 178 CO -0.02 0.21 -0.15 0.00 0.00 0.00 0.00 176.54 176.59 2nuu h ALA 179 N 1.18 1.40 -0.01 3.60 0.00 -0.80 -2.25 119.26 122.37 2nuu h ALA 179 Ca 0.17 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 2nuu h ALA 179 Cb -0.04 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 2nuu h ALA 179 CO -0.05 0.41 -0.02 1.88 0.00 0.00 0.00 179.25 181.48 2nuu h TYR 180 N 0.29 0.04 -0.33 0.00 0.99 -1.05 -2.93 116.97 114.00 2nuu h TYR 180 Ca 0.06 -0.01 -0.02 0.00 2.00 0.00 0.00 58.73 60.76 2nuu h TYR 180 Cb 0.44 -0.01 -0.01 0.00 1.00 0.00 0.00 36.73 38.15 2nuu h TYR 180 CO 0.01 0.53 0.14 -0.07 -0.00 0.00 0.00 178.16 178.76 2nuu h LEU 181 N -0.45 0.45 -0.78 3.88 3.38 -1.14 -3.09 115.31 117.56 2nuu h LEU 181 Ca 0.00 -0.15 -0.04 0.00 0.09 0.00 0.00 57.88 57.78 2nuu h LEU 181 Cb 0.52 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 2nuu h LEU 181 CO 0.00 0.48 -0.17 0.16 0.09 0.00 0.00 178.44 179.00 2nuu h ILE 182 N 0.39 0.36 0.00 1.22 3.07 -1.54 -3.50 117.51 117.51 2nuu h ILE 182 Ca 0.11 -1.13 0.00 0.00 1.55 0.00 0.00 64.86 65.39 2nuu h ILE 182 Cb 0.16 1.86 0.00 0.00 -0.27 0.00 0.00 36.82 38.58 2nuu h ILE 182 CO -0.01 0.17 0.00 0.61 -1.05 0.00 0.00 178.15 177.87 2nuu n GLY 183 N 0.50 -1.04 3.76 0.16 0.00 -1.10 -4.94 105.19 102.52 2nuu n GLY 183 Ca 0.01 -1.63 -0.38 0.00 0.00 0.00 0.00 46.02 44.02 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 -2.11 3.37 0.54 1.61 1.02 -1.26 -4.89 119.74 118.01 2nuu s LYS 184 Ca 0.00 2.07 -0.20 0.00 0.02 0.00 0.00 55.97 57.85 2nuu s LYS 184 Cb 0.00 -2.31 -0.05 0.00 -0.52 0.00 0.00 37.83 34.94 2nuu s LYS 184 CO 0.00 -0.95 1.18 1.03 -0.92 0.00 0.00 175.35 175.69 2nuu s ARG 185 N -2.83 3.32 0.34 1.68 0.52 -1.26 -4.93 118.95 115.80 2nuu s ARG 185 Ca 0.69 1.78 -0.29 0.00 -0.52 0.00 0.00 55.73 57.39 2nuu s ARG 185 Cb -0.36 -2.11 -0.11 0.00 0.52 0.00 0.00 34.95 32.89 2nuu s ARG 185 CO 0.43 -0.91 1.50 1.33 0.02 0.00 0.00 175.30 177.66 2nuu n VAL 186 N -1.15 1.66 -0.38 3.52 0.24 -1.26 -1.57 118.33 119.39 2nuu n VAL 186 Ca 0.11 -0.41 0.00 0.00 -2.04 0.00 0.00 64.34 62.00 2nuu n VAL 186 Cb 0.49 -1.91 0.00 0.00 -1.47 0.00 0.00 33.84 30.95 2nuu n VAL 186 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2nuu n GLY 187 N 1.08 1.38 3.57 7.63 0.00 -1.26 -5.00 105.19 112.60 2nuu n GLY 187 Ca 0.04 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.63 2nuu n GLY 187 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2nuu n PHE 188 N -2.00 1.85 0.00 1.61 7.35 -0.61 -1.03 117.46 124.64 2nuu n PHE 188 Ca 0.00 -0.04 0.00 0.00 -0.76 0.00 0.00 57.45 56.65 2nuu n PHE 188 Cb 0.00 -2.69 0.00 0.00 0.35 0.00 0.00 39.48 37.14 2nuu n PHE 188 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2nuu n GLY 189 N 5.93 1.83 0.00 7.13 0.00 -1.26 -4.88 105.19 113.93 2nuu n GLY 189 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.35 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 -0.91 3.07 -4.26 1.61 -0.00 -0.55 -5.06 118.16 112.05 2nuu n LYS 190 Ca 0.00 0.00 -0.29 0.00 -0.00 0.00 0.00 58.31 58.02 2nuu n LYS 190 Cb 0.00 -0.66 -0.10 0.00 -0.00 0.00 0.00 35.03 34.26 2nuu n LYS 190 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.40 175.40 2nuu s GLU 191 N -1.17 1.96 0.03 -1.58 2.12 -0.19 -5.11 118.70 114.75 2nuu s GLU 191 Ca 0.00 -1.11 -0.30 0.00 0.36 0.00 0.00 54.97 53.91 2nuu s GLU 191 Cb 0.00 -2.20 -0.04 0.00 0.26 0.00 0.00 34.13 32.15 2nuu s GLU 191 CO 0.00 0.49 1.00 0.00 -0.54 0.00 0.00 175.26 176.21 2nuu s ALA 192 N -1.21 3.20 -0.61 6.30 0.00 -1.26 -4.85 121.76 123.32 2nuu s ALA 192 Ca 0.20 0.59 0.06 0.00 0.00 0.00 0.00 51.96 52.81 2nuu s ALA 192 Cb -0.11 -3.34 0.23 0.00 0.00 0.00 0.00 23.12 19.90 2nuu s ALA 192 CO 0.12 -0.22 0.67 1.19 0.00 0.00 0.00 175.76 177.51 2nuu n PHE 193 N 3.72 2.92 -2.66 0.00 3.01 -1.26 -5.10 117.46 118.09 2nuu n PHE 193 Ca 0.06 -4.08 -0.33 0.00 1.01 0.00 0.00 57.45 54.11 2nuu n PHE 193 Cb 0.50 -0.52 -0.06 0.00 -0.01 0.00 0.00 39.48 39.40 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 -2.07 4.13 0.31 -1.08 1.02 -1.26 -5.03 119.74 115.75 2nuu s LYS 194 Ca 0.37 1.06 -0.29 0.00 0.02 0.00 0.00 55.97 57.13 2nuu s LYS 194 Cb 0.12 -2.16 -0.10 0.00 -0.52 0.00 0.00 37.83 35.16 2nuu s LYS 194 CO -0.06 -0.12 1.34 -2.14 -0.92 0.00 0.00 175.35 173.46 2nuu s PRO 195 N -3.51 4.33 0.17 -1.68 0.02 -1.25 -4.47 135.00 128.61 2nuu s PRO 195 Ca 0.61 2.24 0.08 0.00 0.02 0.00 0.00 61.00 63.95 2nuu s PRO 195 Cb -0.09 -3.08 -0.01 0.00 0.02 0.00 0.00 34.50 31.34 2nuu s PRO 195 CO 0.20 -0.26 1.40 1.12 -0.33 0.00 0.00 177.00 179.12 2nuu h HIS 196 N 3.84 0.03 -2.42 6.54 2.07 -1.18 -3.42 115.15 120.61 2nuu h HIS 196 Ca -0.48 -0.02 -0.50 0.00 -2.85 0.00 0.00 60.37 56.52 2nuu h HIS 196 Cb 1.22 -0.00 -0.37 0.00 2.57 0.00 0.00 27.41 30.83 2nuu h HIS 196 CO 0.57 0.87 -0.79 1.21 -3.07 0.00 0.00 177.93 176.73 2nuu s ASN 197 N -6.78 2.51 0.29 3.10 3.84 -1.10 -4.97 114.94 111.83 2nuu s ASN 197 Ca -0.00 -1.82 0.06 0.00 0.21 0.00 0.00 52.86 51.30 2nuu s ASN 197 Cb 0.11 -0.09 0.42 0.00 -0.55 0.00 0.00 41.25 41.14 2nuu s ASN 197 CO 0.80 -0.32 1.69 -0.07 -2.79 0.00 0.00 177.10 176.41 2nuu h LEU 198 N 7.30 0.28 -1.39 3.21 3.38 -1.82 -2.49 115.31 123.78 2nuu h LEU 198 Ca 0.01 -0.12 0.03 0.00 0.09 0.00 0.00 57.88 57.89 2nuu h LEU 198 Cb 1.00 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 41.64 2nuu h LEU 198 CO 0.27 0.67 0.44 -0.65 0.09 0.00 0.00 178.44 179.27 2nuu h PRO 199 N 0.23 0.78 -0.41 1.13 0.11 -1.96 -0.46 132.00 131.41 2nuu h PRO 199 Ca 0.02 -0.05 -0.08 0.00 0.11 0.00 0.00 66.00 66.00 2nuu h PRO 199 Cb 0.83 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 31.75 2nuu h PRO 199 CO 0.07 0.51 -0.07 1.98 -0.21 0.00 0.00 178.00 180.28 2nuu h MET 200 N 0.80 0.70 -0.43 1.05 -1.53 -1.83 0.54 114.93 114.23 2nuu h MET 200 Ca 0.27 -0.21 -0.13 0.00 -3.44 0.00 0.00 59.70 56.20 2nuu h MET 200 Cb 0.08 -0.07 -0.01 0.00 -0.55 0.00 0.00 31.60 31.04 2nuu h MET 200 CO -0.08 0.77 -0.24 0.28 0.14 0.00 0.00 176.91 177.78 2nuu h VAL 201 N 0.65 1.27 -0.40 -5.77 2.07 -0.96 -1.64 116.25 111.46 2nuu h VAL 201 Ca 0.12 -1.39 -0.10 0.00 0.82 0.00 0.00 66.70 66.15 2nuu h VAL 201 Cb 0.51 1.20 -0.01 0.00 -1.52 0.00 0.00 31.29 31.46 2nuu h VAL 201 CO 0.03 0.47 -0.15 0.15 0.02 0.00 0.00 177.57 178.09 2nuu h PHE 202 N 0.76 0.92 -0.18 1.57 3.57 -0.67 -1.89 116.94 121.02 2nuu h PHE 202 Ca 0.10 -0.21 0.03 0.00 3.53 0.00 0.00 57.97 61.41 2nuu h PHE 202 Cb 0.79 -0.22 -0.03 0.00 2.79 0.00 0.00 35.95 39.28 2nuu h PHE 202 CO 0.05 0.96 -0.00 1.15 -2.23 0.00 0.00 178.31 178.23 2nuu h THR 203 N 0.62 0.87 -0.72 4.41 2.02 -0.68 0.29 112.91 119.72 2nuu h THR 203 Ca 0.10 -0.02 -0.01 0.00 0.77 0.00 0.00 66.41 67.25 2nuu h THR 203 Cb 0.69 0.81 -0.03 0.00 -1.74 0.00 0.00 68.15 67.87 2nuu h THR 203 CO 0.05 0.01 0.41 1.23 0.37 0.00 0.00 175.52 177.59 2nuu h GLY 204 N 0.06 1.06 0.73 2.16 0.00 -1.26 -1.54 103.07 104.28 2nuu h GLY 204 Ca 0.09 -0.46 0.01 0.00 0.00 0.00 0.00 47.33 46.96 2nuu h GLY 204 CO -0.15 0.45 -0.15 -0.84 0.00 0.00 0.00 176.54 175.85 2nuu h THR 205 N 0.99 0.65 -0.48 4.70 2.02 -0.84 0.10 112.91 120.05 2nuu h THR 205 Ca 0.26 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.49 2nuu h THR 205 Cb 0.00 0.65 -0.05 0.00 -1.74 0.00 0.00 68.15 67.02 2nuu h THR 205 CO -0.04 0.00 0.20 0.00 0.37 0.00 0.00 175.52 176.05 2nuu h ALA 206 N 0.58 0.59 -0.57 6.16 0.00 -0.67 0.24 119.26 125.60 2nuu h ALA 206 Ca 0.02 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2nuu h ALA 206 Cb 0.31 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 2nuu h ALA 206 CO -0.09 -0.18 0.36 0.82 0.00 0.00 0.00 179.25 180.17 2nuu h ILE 207 N 0.40 1.16 -0.44 0.00 2.04 -0.89 -0.72 117.51 119.06 2nuu h ILE 207 Ca 0.22 -0.32 0.03 0.00 1.00 0.00 0.00 64.86 65.79 2nuu h ILE 207 Cb 0.19 0.35 -0.03 0.00 -0.74 0.00 0.00 36.82 36.59 2nuu h ILE 207 CO -0.20 0.16 0.23 -0.07 0.00 0.00 0.00 178.15 178.27 2nuu h LEU 208 N 0.77 0.35 -0.33 1.44 3.38 -0.16 0.19 115.31 120.95 2nuu h LEU 208 Ca 0.21 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.18 2nuu h LEU 208 Cb -0.05 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 2nuu h LEU 208 CO -0.04 0.25 0.16 0.22 0.09 0.00 0.00 178.44 179.12 2nuu h TYR 209 N 0.46 0.46 -0.20 1.13 3.20 -0.44 0.03 116.97 121.61 2nuu h TYR 209 Ca 0.18 -0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.99 2nuu h TYR 209 Cb 0.07 -0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.19 2nuu h TYR 209 CO -0.09 0.40 -0.05 0.82 -1.64 0.00 0.00 178.16 177.59 2nuu h ILE 210 N 0.40 1.29 0.00 1.81 1.08 -0.91 -2.77 117.51 118.41 2nuu h ILE 210 Ca 0.11 -1.04 -0.02 0.00 -0.39 0.00 0.00 64.86 63.52 2nuu h ILE 210 Cb 0.10 1.56 -0.00 0.00 -3.07 0.00 0.00 36.82 35.41 2nuu h ILE 210 CO -0.02 0.32 -0.12 1.23 -0.69 0.00 0.00 178.15 178.87 2nuu h GLY 211 N 0.11 0.00 2.00 5.37 0.00 -0.54 -2.53 103.07 107.48 2nuu h GLY 211 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.38 2nuu h GLY 211 CO 0.02 0.00 0.00 1.87 0.00 0.00 0.00 176.54 178.43 2nuu n TRP 212 N -3.98 0.79 -0.06 5.60 -0.00 -0.01 -2.23 117.44 117.55 2nuu n TRP 212 Ca -0.02 0.35 -0.12 0.00 -0.00 0.00 0.00 57.50 57.71 2nuu n TRP 212 Cb 0.20 -1.07 0.01 0.00 -0.00 0.00 0.00 31.31 30.46 2nuu n TRP 212 CO 0.00 0.00 0.00 0.74 -0.00 0.00 0.00 177.69 178.43 2nuu h PHE 213 N 0.00 0.95 0.00 5.87 0.04 -1.52 0.64 116.94 122.92 2nuu h PHE 213 Ca 0.00 -0.32 -0.12 0.00 2.80 0.00 0.00 57.97 60.33 2nuu h PHE 213 Cb 0.20 -0.19 -0.02 0.00 2.20 0.00 0.00 35.95 38.15 2nuu h PHE 213 CO 0.00 1.10 -0.58 0.78 -0.60 0.00 0.00 178.31 179.01 2nuu h GLY 214 N 0.86 0.00 0.65 -1.45 0.00 -1.63 -0.39 103.07 101.11 2nuu h GLY 214 Ca 0.03 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.34 2nuu h GLY 214 CO 0.10 0.00 -0.21 -2.75 0.00 0.00 0.00 176.54 173.68 2nuu h PHE 215 N 0.00 -0.55 0.24 5.60 3.57 -1.37 -1.90 116.94 122.53 2nuu h PHE 215 Ca -0.01 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.47 2nuu h PHE 215 Cb 1.07 0.18 0.00 0.00 2.79 0.00 0.00 35.95 40.00 2nuu h PHE 215 CO 0.00 -0.23 -0.12 -0.91 -2.23 0.00 0.00 178.31 174.82 2nuu h ASN 216 N -0.96 -0.28 -0.11 0.41 2.35 -0.91 -3.16 115.58 112.92 2nuu h ASN 216 Ca -0.06 -0.11 -0.06 0.00 -0.55 0.00 0.00 56.30 55.52 2nuu h ASN 216 Cb 0.57 0.07 -0.02 0.00 0.05 0.00 0.00 38.32 39.00 2nuu h ASN 216 CO 0.10 0.22 -0.11 0.00 -1.65 0.00 0.00 177.43 175.98 2nuu h ALA 217 N -0.88 1.32 -0.42 -0.83 0.00 -1.25 -2.42 119.26 114.77 2nuu h ALA 217 Ca -0.03 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 2nuu h ALA 217 Cb 0.37 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 2nuu h ALA 217 CO 0.06 0.46 0.23 0.78 0.00 0.00 0.00 179.25 180.77 2nuu h GLY 218 N 0.88 0.61 1.69 0.00 0.00 -1.39 -1.86 103.07 102.99 2nuu h GLY 218 Ca 0.08 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 47.16 2nuu h GLY 218 CO 0.03 0.25 0.02 1.44 0.00 0.00 0.00 176.54 178.27 2nuu n SER 219 N -4.43 0.00 0.17 0.19 7.64 -0.91 -0.77 113.62 115.51 2nuu n SER 219 Ca 0.03 0.37 0.05 0.00 1.01 0.00 0.00 58.87 60.33 2nuu n SER 219 Cb 0.10 -0.37 0.13 0.00 -1.01 0.00 0.00 64.21 63.05 2nuu n SER 219 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2nuu h ALA 220 N 1.89 0.79 0.00 -0.43 0.00 -1.49 -3.47 119.26 116.55 2nuu h ALA 220 Ca 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.56 2nuu h ALA 220 Cb 0.04 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2nuu h ALA 220 CO 0.00 0.48 0.00 0.41 0.00 0.00 0.00 179.25 180.14 2nuu n GLY 221 N 0.99 2.48 3.41 0.00 0.00 0.05 -4.96 105.19 107.17 2nuu n GLY 221 Ca 0.02 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.90 2nuu n GLY 221 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2nuu s THR 222 N -2.67 0.02 -1.48 2.61 -1.32 -1.26 -4.80 115.64 106.74 2nuu s THR 222 Ca 0.00 -0.19 -0.11 0.00 -1.21 0.00 0.00 61.69 60.19 2nuu s THR 222 Cb 0.00 -0.99 0.02 0.00 -1.51 0.00 0.00 72.50 70.02 2nuu s THR 222 CO 0.00 -0.10 2.50 0.00 -2.21 0.00 0.00 174.62 174.81 2nuu n ALA 223 N 0.33 6.52 -2.97 11.08 0.00 -1.26 -4.39 120.51 129.83 2nuu n ALA 223 Ca -0.18 -3.83 0.00 0.00 0.00 0.00 0.00 53.44 49.43 2nuu n ALA 223 Cb 0.61 -3.29 0.00 0.00 0.00 0.00 0.00 19.45 16.77 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 4.15 1.12 0.22 0.00 6.94 -1.26 -4.98 115.26 121.44 2nuu n ASN 224 Ca 0.63 -0.41 0.09 0.00 -0.02 0.00 0.00 54.58 54.86 2nuu n ASN 224 Cb 0.30 0.00 0.52 0.00 -2.36 0.00 0.00 39.78 38.25 2nuu n ASN 224 CO 0.00 0.00 0.00 1.05 -1.03 0.00 0.00 177.26 177.28 2nuu h GLU 225 N 0.00 0.00 -0.20 -3.83 9.09 -2.00 -2.63 114.58 115.01 2nuu h GLU 225 Ca 0.00 0.00 -0.18 0.00 0.05 0.00 0.00 59.36 59.23 2nuu h GLU 225 Cb 0.00 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.10 2nuu h GLU 225 CO 0.00 0.24 -0.59 0.82 0.05 0.00 0.00 179.01 179.52 2nuu h ILE 226 N 0.00 1.31 -0.40 -1.06 1.08 -1.95 -1.69 117.51 114.80 2nuu h ILE 226 Ca -0.00 -1.84 0.00 0.00 -0.39 0.00 0.00 64.86 62.63 2nuu h ILE 226 Cb 0.58 1.80 -0.02 0.00 -3.07 0.00 0.00 36.82 36.11 2nuu h ILE 226 CO 0.03 0.58 0.26 0.00 -0.69 0.00 0.00 178.15 178.33 2nuu h ALA 227 N 0.85 0.50 -0.65 1.87 0.00 -1.68 -1.45 119.26 118.71 2nuu h ALA 227 Ca -0.00 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 2nuu h ALA 227 Cb 1.17 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.77 2nuu h ALA 227 CO 0.12 -0.03 0.18 0.00 0.00 0.00 0.00 179.25 179.52 2nuu h ALA 228 N 1.14 1.09 -0.13 0.00 0.00 -1.37 -1.74 119.26 118.25 2nuu h ALA 228 Ca 0.15 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 2nuu h ALA 228 Cb -0.05 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 2nuu h ALA 228 CO -0.03 0.61 0.07 1.25 0.00 0.00 0.00 179.25 181.15 2nuu h LEU 229 N 0.97 0.16 -1.69 0.00 5.85 -0.85 -1.80 115.31 117.96 2nuu h LEU 229 Ca 0.21 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.85 2nuu h LEU 229 Cb 0.31 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.28 2nuu h LEU 229 CO -0.00 0.20 0.20 0.00 -0.34 0.00 0.00 178.44 178.50 2nuu h ALA 230 N 0.97 1.77 0.61 1.25 0.00 -1.06 -0.95 119.26 121.86 2nuu h ALA 230 Ca 0.05 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 2nuu h ALA 230 Cb 0.07 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 17.74 2nuu h ALA 230 CO -0.01 0.21 -0.29 0.35 0.00 0.00 0.00 179.25 179.51 2nuu h PHE 231 N 0.42 -0.76 -0.75 0.00 3.04 -0.89 -2.39 116.94 115.61 2nuu h PHE 231 Ca 0.11 -0.02 0.08 0.00 3.98 0.00 0.00 57.97 62.12 2nuu h PHE 231 Cb -0.04 0.25 -0.07 0.00 2.56 0.00 0.00 35.95 38.65 2nuu h PHE 231 CO 0.00 -0.44 0.42 0.28 -2.02 0.00 0.00 178.31 176.55 2nuu h VAL 232 N -1.16 0.93 -0.43 1.41 2.07 -1.14 -1.40 116.25 116.53 2nuu h VAL 232 Ca -0.08 -0.25 -0.01 0.00 0.82 0.00 0.00 66.70 67.18 2nuu h VAL 232 Cb 0.66 0.13 -0.02 0.00 -1.52 0.00 0.00 31.29 30.54 2nuu h VAL 232 CO 0.14 0.13 0.23 0.78 0.02 0.00 0.00 177.57 178.87 2nuu h ASN 233 N 0.73 0.51 -0.44 0.57 2.35 -1.21 -0.62 115.58 117.48 2nuu h ASN 233 Ca 0.35 -0.03 -0.14 0.00 -0.55 0.00 0.00 56.30 55.92 2nuu h ASN 233 Cb 0.28 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.51 2nuu h ASN 233 CO -0.22 0.42 -0.28 0.74 -1.65 0.00 0.00 177.43 176.44 2nuu h THR 234 N 0.59 1.27 0.06 2.81 2.02 -0.74 -0.44 112.91 118.49 2nuu h THR 234 Ca 0.15 -1.45 -0.00 0.00 0.77 0.00 0.00 66.41 65.88 2nuu h THR 234 Cb 0.03 1.24 0.00 0.00 -1.74 0.00 0.00 68.15 67.67 2nuu h THR 234 CO -0.02 0.49 -0.03 0.58 0.37 0.00 0.00 175.52 176.91 2nuu h VAL 235 N 0.81 1.09 0.72 3.16 2.07 -0.67 -2.83 116.25 120.60 2nuu h VAL 235 Ca 0.09 -0.53 -0.04 0.00 0.82 0.00 0.00 66.70 67.04 2nuu h VAL 235 Cb 0.87 1.44 0.01 0.00 -1.52 0.00 0.00 31.29 32.09 2nuu h VAL 235 CO 0.08 0.13 -0.34 0.58 0.02 0.00 0.00 177.57 178.04 2nuu h VAL 236 N -0.32 0.28 -0.99 2.57 2.07 -1.08 -2.51 116.25 116.28 2nuu h VAL 236 Ca -0.01 -0.04 0.10 0.00 0.82 0.00 0.00 66.70 67.57 2nuu h VAL 236 Cb 0.28 0.29 -0.08 0.00 -1.52 0.00 0.00 31.29 30.27 2nuu h VAL 236 CO 0.01 0.01 0.62 0.00 0.02 0.00 0.00 177.57 178.23 2nuu h ALA 237 N -0.72 1.45 -0.37 1.67 0.00 -1.17 0.10 119.26 120.23 2nuu h ALA 237 Ca -0.10 0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.75 2nuu h ALA 237 Cb 0.75 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 2nuu h ALA 237 CO 0.16 0.28 -0.06 1.15 0.00 0.00 0.00 179.25 180.78 2nuu h THR 238 N 1.03 1.27 -0.40 0.00 2.02 -1.51 -0.06 112.91 115.27 2nuu h THR 238 Ca 0.47 -1.12 -0.04 0.00 0.77 0.00 0.00 66.41 66.49 2nuu h THR 238 Cb 0.38 1.25 -0.02 0.00 -1.74 0.00 0.00 68.15 68.02 2nuu h THR 238 CO -0.24 0.37 0.08 0.00 0.37 0.00 0.00 175.52 176.11 2nuu h ALA 239 N 0.84 0.53 -0.52 6.16 0.00 -0.95 -1.25 119.26 124.07 2nuu h ALA 239 Ca 0.10 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 2nuu h ALA 239 Cb 0.56 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 2nuu h ALA 239 CO 0.03 0.23 0.32 0.00 0.00 0.00 0.00 179.25 179.82 2nuu h ALA 240 N 0.94 0.66 -0.25 0.00 0.00 -0.71 -2.21 119.26 117.69 2nuu h ALA 240 Ca 0.12 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 2nuu h ALA 240 Cb 0.34 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2nuu h ALA 240 CO 0.00 0.15 -0.22 0.00 0.00 0.00 0.00 179.25 179.18 2nuu h ALA 241 N 1.16 1.15 -0.29 0.00 0.00 -0.86 0.11 119.26 120.52 2nuu h ALA 241 Ca 0.19 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 2nuu h ALA 241 Cb -0.02 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 2nuu h ALA 241 CO -0.04 0.54 0.15 0.82 0.00 0.00 0.00 179.25 180.72 2nuu h ILE 242 N 0.42 1.14 -0.23 0.00 2.04 -0.90 -1.66 117.51 118.32 2nuu h ILE 242 Ca 0.07 -0.38 -0.13 0.00 1.00 0.00 0.00 64.86 65.42 2nuu h ILE 242 Cb 0.62 0.86 -0.01 0.00 -0.74 0.00 0.00 36.82 37.55 2nuu h ILE 242 CO 0.04 0.14 -0.39 -0.07 0.00 0.00 0.00 178.15 177.88 2nuu h LEU 243 N 0.34 0.54 0.13 1.44 3.38 -1.13 -1.04 115.31 118.98 2nuu h LEU 243 Ca 0.10 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 2nuu h LEU 243 Cb 0.09 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.69 2nuu h LEU 243 CO -0.01 0.88 -0.06 1.23 0.09 0.00 0.00 178.44 180.56 2nuu h GLY 244 N 1.08 -0.18 0.77 0.83 0.00 -0.57 -1.58 103.07 103.42 2nuu h GLY 244 Ca 0.04 0.07 -0.01 0.00 0.00 0.00 0.00 47.33 47.43 2nuu h GLY 244 CO 0.07 -0.07 -0.10 -0.25 0.00 0.00 0.00 176.54 176.20 2nuu h TRP 245 N -0.33 -0.25 -0.35 5.60 2.91 -1.32 -1.43 115.95 120.79 2nuu h TRP 245 Ca -0.02 -0.01 0.08 0.00 1.13 0.00 0.00 58.89 60.07 2nuu h TRP 245 Cb 0.27 0.08 -0.08 0.00 -0.51 0.00 0.00 29.16 28.92 2nuu h TRP 245 CO -0.02 0.02 -0.21 0.82 -1.03 0.00 0.00 178.44 178.02 2nuu h ILE 246 N -0.50 0.41 -0.27 2.65 1.08 -1.21 0.15 117.51 119.81 2nuu h ILE 246 Ca -0.03 0.00 -0.13 0.00 -0.39 0.00 0.00 64.86 64.31 2nuu h ILE 246 Cb 0.38 0.41 -0.01 0.00 -3.07 0.00 0.00 36.82 34.53 2nuu h ILE 246 CO 0.05 0.00 -0.38 -0.26 -0.69 0.00 0.00 178.15 176.86 2nuu h PHE 247 N -0.16 0.73 -0.35 1.37 0.04 -1.32 0.90 116.94 118.15 2nuu h PHE 247 Ca 0.17 -0.21 -0.02 0.00 2.80 0.00 0.00 57.97 60.72 2nuu h PHE 247 Cb 0.43 -0.16 -0.02 0.00 2.20 0.00 0.00 35.95 38.41 2nuu h PHE 247 CO -0.42 0.91 0.14 0.78 -0.60 0.00 0.00 178.31 179.12 2nuu h GLY 248 N 1.02 0.57 1.24 -1.45 0.00 -0.80 0.71 103.07 104.34 2nuu h GLY 248 Ca 0.05 -0.31 -0.11 0.00 0.00 0.00 0.00 47.33 46.96 2nuu h GLY 248 CO 0.08 0.29 -0.15 -2.09 0.00 0.00 0.00 176.54 174.67 2nuu h GLU 249 N 0.43 0.89 -0.66 4.80 4.81 -0.62 -0.80 114.58 123.43 2nuu h GLU 249 Ca 0.12 -0.33 -0.05 0.00 -0.13 0.00 0.00 59.36 58.97 2nuu h GLU 249 Cb 0.18 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.47 2nuu h GLU 249 CO -0.01 0.97 0.21 2.35 -0.73 0.00 0.00 179.01 181.80 2nuu h TRP 250 N 0.79 1.05 -0.09 0.92 2.91 -0.48 0.26 115.95 121.31 2nuu h TRP 250 Ca 0.12 -0.11 -0.10 0.00 1.13 0.00 0.00 58.89 59.93 2nuu h TRP 250 Cb 0.67 -0.31 0.00 0.00 -0.51 0.00 0.00 29.16 29.02 2nuu h TRP 250 CO 0.04 0.85 -0.34 0.00 -1.03 0.00 0.00 178.44 177.96 2nuu h ALA 251 N 1.08 0.17 0.07 2.65 0.00 -0.71 -2.44 119.26 120.09 2nuu h ALA 251 Ca 0.21 -0.44 -0.09 0.00 0.00 0.00 0.00 54.91 54.59 2nuu h ALA 251 Cb 0.29 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.08 2nuu h ALA 251 CO -0.01 0.23 -0.41 -0.07 0.00 0.00 0.00 179.25 178.99 2nuu h LEU 252 N -0.05 0.24 0.00 0.00 3.38 -1.12 -3.39 115.31 114.37 2nuu h LEU 252 Ca -0.02 -0.97 0.00 0.00 0.09 0.00 0.00 57.88 56.98 2nuu h LEU 252 Cb 0.97 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.65 2nuu h LEU 252 CO 0.07 1.20 -1.23 0.54 0.09 0.00 0.00 178.44 179.11 2nuu n ARG 253 N -4.36 0.44 -0.10 1.13 3.00 0.90 -4.99 116.66 112.67 2nuu n ARG 253 Ca -0.12 -0.01 0.00 0.00 -0.01 0.00 0.00 57.85 57.71 2nuu n ARG 253 Cb 0.65 -1.63 0.00 0.00 0.00 0.00 0.00 32.46 31.48 2nuu n ARG 253 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2nuu n GLY 254 N 1.30 0.76 3.10 -0.13 0.00 -0.92 -5.01 105.19 104.29 2nuu n GLY 254 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.72 0.27 -0.49 1.61 1.02 -1.25 -4.95 119.74 115.23 2nuu s LYS 255 Ca 0.00 0.24 -0.21 0.00 0.02 0.00 0.00 55.97 56.02 2nuu s LYS 255 Cb 0.00 0.13 0.04 0.00 -0.52 0.00 0.00 37.83 37.48 2nuu s LYS 255 CO 0.00 -0.04 0.73 -1.25 -0.92 0.00 0.00 175.35 173.87 2nuu s PRO 256 N -0.02 3.26 0.38 -1.68 0.04 -1.26 -3.89 135.00 131.83 2nuu s PRO 256 Ca -0.01 -0.46 -0.02 0.00 0.04 0.00 0.00 61.00 60.55 2nuu s PRO 256 Cb -0.02 -4.02 -0.04 0.00 0.04 0.00 0.00 34.50 30.47 2nuu s PRO 256 CO 0.00 -1.20 0.62 -1.54 0.04 0.00 0.00 177.00 174.93 2nuu s SER 257 N 2.42 6.32 0.15 6.66 1.04 -1.26 -5.01 113.70 124.02 2nuu s SER 257 Ca 0.23 0.65 -0.12 0.00 0.48 0.00 0.00 55.95 57.20 2nuu s SER 257 Cb -0.15 -2.12 0.01 0.00 0.10 0.00 0.00 66.02 63.86 2nuu s SER 257 CO 0.18 -0.36 1.59 0.25 0.98 0.00 0.00 173.24 175.87 2nuu h LEU 258 N 0.78 0.87 -0.79 2.42 5.85 -1.99 -1.36 115.31 121.09 2nuu h LEU 258 Ca -0.48 -0.32 0.02 0.00 0.84 0.00 0.00 57.88 57.93 2nuu h LEU 258 Cb 1.21 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.96 2nuu h LEU 258 CO 0.62 0.98 0.51 0.25 -0.34 0.00 0.00 178.44 180.47 2nuu h LEU 259 N 0.74 0.87 -0.36 2.25 5.85 -1.96 0.13 115.31 122.83 2nuu h LEU 259 Ca 0.13 -0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.90 2nuu h LEU 259 Cb 0.55 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 41.33 2nuu h LEU 259 CO 0.03 0.61 0.04 1.23 -0.34 0.00 0.00 178.44 180.01 2nuu h GLY 260 N 1.02 0.39 0.98 3.75 0.00 -1.85 0.17 103.07 107.53 2nuu h GLY 260 Ca 0.30 0.01 -0.00 0.00 0.00 0.00 0.00 47.33 47.64 2nuu h GLY 260 CO -0.09 -0.05 0.24 0.00 0.00 0.00 0.00 176.54 176.64 2nuu h ALA 261 N 1.29 0.52 -0.05 3.60 0.00 -0.12 -0.41 119.26 124.09 2nuu h ALA 261 Ca 0.17 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 2nuu h ALA 261 Cb 0.22 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 2nuu h ALA 261 CO -0.26 0.02 0.02 0.00 0.00 0.00 0.00 179.25 179.04 2nuu h SER 263 N -0.03 0.81 -0.32 0.00 0.02 -0.58 -1.99 113.55 111.45 2nuu h SER 263 Ca 0.02 -0.00 0.01 0.00 -0.84 0.00 0.00 61.79 60.97 2nuu h SER 263 Cb 0.10 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.45 2nuu h SER 263 CO -0.00 0.56 0.20 1.23 -1.14 0.00 0.00 176.83 177.67 2nuu h GLY 264 N 0.96 0.44 0.40 -3.77 0.00 -0.86 -0.67 103.07 99.58 2nuu h GLY 264 Ca 0.31 -0.15 0.06 0.00 0.00 0.00 0.00 47.33 47.55 2nuu h GLY 264 CO -0.11 0.14 -0.02 0.00 0.00 0.00 0.00 176.54 176.55 2nuu h ALA 265 N 1.13 0.29 -0.52 3.60 0.00 -0.56 -1.95 119.26 121.25 2nuu h ALA 265 Ca 0.12 0.11 -0.06 0.00 0.00 0.00 0.00 54.91 55.08 2nuu h ALA 265 Cb -0.02 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 2nuu h ALA 265 CO -0.04 -0.42 0.10 0.82 0.00 0.00 0.00 179.25 179.71 2nuu h ILE 266 N 0.07 1.25 -0.98 0.00 1.08 -1.11 -2.53 117.51 115.28 2nuu h ILE 266 Ca 0.17 -0.93 0.13 0.00 -0.39 0.00 0.00 64.86 63.85 2nuu h ILE 266 Cb 0.24 0.84 -0.09 0.00 -3.07 0.00 0.00 36.82 34.74 2nuu h ILE 266 CO -0.31 0.33 0.60 0.00 -0.69 0.00 0.00 178.15 178.09 2nuu h ALA 267 N 0.99 1.50 -0.12 1.87 0.00 -0.60 0.84 119.26 123.72 2nuu h ALA 267 Ca 0.16 0.04 -0.18 0.00 0.00 0.00 0.00 54.91 54.93 2nuu h ALA 267 Cb 0.39 -0.17 0.01 0.00 0.00 0.00 0.00 17.79 18.02 2nuu h ALA 267 CO 0.01 0.15 -0.61 0.78 0.00 0.00 0.00 179.25 179.58 2nuu h GLY 268 N 0.92 0.70 0.68 0.00 0.00 -1.23 -1.42 103.07 102.71 2nuu h GLY 268 Ca 0.50 -0.99 0.03 0.00 0.00 0.00 0.00 47.33 46.88 2nuu h GLY 268 CO -0.29 0.88 -0.01 1.41 0.00 0.00 0.00 176.54 178.53 2nuu h LEU 269 N 0.29 -0.10 0.55 3.11 3.38 -0.91 0.90 115.31 122.54 2nuu h LEU 269 Ca -0.04 0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 2nuu h LEU 269 Cb 1.25 0.09 0.01 0.00 0.09 0.00 0.00 40.66 42.10 2nuu h LEU 269 CO 0.13 -0.03 -0.27 0.58 0.09 0.00 0.00 178.44 178.94 2nuu h VAL 270 N 0.04 0.45 -0.89 1.22 2.07 -0.89 -0.52 116.25 117.73 2nuu h VAL 270 Ca 0.09 -0.06 0.23 0.00 0.82 0.00 0.00 66.70 67.78 2nuu h VAL 270 Cb 0.12 0.47 -0.13 0.00 -1.52 0.00 0.00 31.29 30.24 2nuu h VAL 270 CO -0.17 0.01 0.37 1.23 0.02 0.00 0.00 177.57 179.03 2nuu h GLY 271 N -0.78 1.52 0.79 2.17 0.00 -0.91 -0.23 103.07 105.63 2nuu h GLY 271 Ca -0.08 -0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.11 2nuu h GLY 271 CO 0.13 -0.30 -0.24 1.55 0.00 0.00 0.00 176.54 177.67 2nuu n VAL 272 N -5.09 0.00 -0.02 4.60 3.14 0.28 -4.30 118.33 116.94 2nuu n VAL 272 Ca 0.22 -0.06 -0.09 0.00 -2.96 0.00 0.00 64.34 61.45 2nuu n VAL 272 Cb 0.68 0.12 -0.02 0.00 -1.06 0.00 0.00 33.84 33.56 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 0.61 0.64 -0.00 1.55 2.02 0.65 0.22 112.91 118.60 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 0.46 0.64 0.00 0.00 -1.74 0.00 0.00 68.15 67.50 2nuu h THR 273 CO 0.00 0.00 -0.07 -0.81 0.37 0.00 0.00 175.52 175.01 2nuu n PRO 274 N -5.28 0.34 -0.05 6.66 -0.04 -1.26 -1.74 135.00 133.62 2nuu n PRO 274 Ca -0.02 -0.06 -0.05 0.00 -0.04 0.00 0.00 63.50 63.33 2nuu n PRO 274 Cb 0.20 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.06 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 -1.28 1.78 -0.32 0.55 0.00 -0.92 -1.72 120.51 118.59 2nuu n ALA 275 Ca 0.12 -0.74 0.32 0.00 0.00 0.00 0.00 53.44 53.13 2nuu n ALA 275 Cb 0.29 -0.04 0.57 0.00 0.00 0.00 0.00 19.45 20.27 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 -1.28 -1.49 0.04 0.00 0.00 -1.26 -3.15 105.19 98.04 2nuu n GLY 277 Ca 0.37 -0.18 -0.01 0.00 0.00 0.00 0.00 46.02 46.20 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 -1.97 0.00 -3.17 1.61 4.01 0.82 -4.87 117.16 113.58 2nuu n TYR 278 Ca 0.05 0.00 -0.20 0.00 -0.16 0.00 0.00 57.90 57.59 2nuu n TYR 278 Cb 0.41 -0.46 0.01 0.00 -0.31 0.00 0.00 39.34 38.99 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 -2.54 3.73 0.64 -0.72 -4.36 -0.64 -1.38 121.20 115.93 2nuu s ILE 279 Ca -0.05 -0.82 -0.03 0.00 -0.26 0.00 0.00 60.65 59.49 2nuu s ILE 279 Cb 0.05 -3.32 0.05 0.00 1.25 0.00 0.00 42.46 40.50 2nuu s ILE 279 CO 0.50 -0.16 0.92 -0.83 0.24 0.00 0.00 174.94 175.61 2nuu s GLY 280 N -4.24 1.75 0.49 6.27 0.00 -1.18 -4.82 107.32 105.59 2nuu s GLY 280 Ca 0.49 -1.11 0.16 0.00 0.00 0.00 0.00 44.72 44.25 2nuu s GLY 280 CO 0.34 -0.75 2.07 -0.24 0.00 0.00 0.00 173.10 174.53 2nuu h VAL 281 N -0.33 0.95 -0.03 1.40 3.04 -1.94 -1.64 116.25 117.70 2nuu h VAL 281 Ca -0.43 -0.06 -0.16 0.00 -1.01 0.00 0.00 66.70 65.04 2nuu h VAL 281 Cb 1.31 0.76 -0.01 0.00 -2.01 0.00 0.00 31.29 31.33 2nuu h VAL 281 CO 0.56 0.03 -0.70 1.23 -1.01 0.00 0.00 177.57 177.69 2nuu h GLY 282 N 0.17 0.17 1.22 3.17 0.00 -1.94 -2.67 103.07 103.19 2nuu h GLY 282 Ca 0.12 -0.24 -0.18 0.00 0.00 0.00 0.00 47.33 47.03 2nuu h GLY 282 CO -0.02 0.21 -0.55 -1.33 0.00 0.00 0.00 176.54 174.85 2nuu h GLY 283 N 1.75 0.90 1.43 4.60 0.00 -1.58 -2.71 103.07 107.45 2nuu h GLY 283 Ca -0.02 -1.05 -0.03 0.00 0.00 0.00 0.00 47.33 46.23 2nuu h GLY 283 CO 0.10 0.95 0.19 0.00 0.00 0.00 0.00 176.54 177.78 2nuu h ALA 284 N 0.74 1.38 0.47 3.60 0.00 -1.31 0.91 119.26 125.05 2nuu h ALA 284 Ca 0.01 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 2nuu h ALA 284 Cb 1.15 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.74 2nuu h ALA 284 CO 0.12 0.46 -0.23 1.25 0.00 0.00 0.00 179.25 180.86 2nuu h LEU 285 N 0.73 -0.54 -0.24 0.00 6.46 -1.37 -0.53 115.31 119.83 2nuu h LEU 285 Ca 0.17 -0.08 0.01 0.00 -0.12 0.00 0.00 57.88 57.86 2nuu h LEU 285 Cb 0.16 0.14 -0.02 0.00 -0.73 0.00 0.00 40.66 40.21 2nuu h LEU 285 CO -0.01 -0.18 0.12 0.40 -0.62 0.00 0.00 178.44 178.15 2nuu h ILE 286 N -0.94 1.01 -0.73 4.05 2.04 -1.37 -0.73 117.51 120.84 2nuu h ILE 286 Ca -0.06 -0.09 0.06 0.00 1.00 0.00 0.00 64.86 65.76 2nuu h ILE 286 Cb 0.59 0.72 -0.06 0.00 -0.74 0.00 0.00 36.82 37.33 2nuu h ILE 286 CO 0.11 0.05 0.43 0.40 0.00 0.00 0.00 178.15 179.13 2nuu h ILE 287 N 0.26 1.00 0.49 -0.67 2.04 -0.87 -1.60 117.51 118.16 2nuu h ILE 287 Ca 0.09 -0.27 -0.02 0.00 1.00 0.00 0.00 64.86 65.67 2nuu h ILE 287 Cb 0.02 0.14 -0.00 0.00 -0.74 0.00 0.00 36.82 36.24 2nuu h ILE 287 CO -0.06 0.14 -0.29 1.23 0.00 0.00 0.00 178.15 179.17 2nuu h GLY 288 N 0.78 -0.78 0.28 5.37 0.00 -0.34 0.12 103.07 108.50 2nuu h GLY 288 Ca 0.32 0.32 0.04 0.00 0.00 0.00 0.00 47.33 48.02 2nuu h GLY 288 CO -0.18 -0.29 -0.26 -2.08 0.00 0.00 0.00 176.54 173.73 2nuu h VAL 289 N -0.74 0.39 -0.38 4.60 2.07 -0.88 -0.69 116.25 120.61 2nuu h VAL 289 Ca -0.06 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.50 2nuu h VAL 289 Cb 0.60 0.39 -0.04 0.00 -1.52 0.00 0.00 31.29 30.72 2nuu h VAL 289 CO 0.06 0.00 0.15 0.58 0.02 0.00 0.00 177.57 178.38 2nuu h VAL 290 N -0.34 0.91 -0.77 2.57 2.07 -1.22 -2.01 116.25 117.47 2nuu h VAL 290 Ca 0.09 -0.11 0.06 0.00 0.82 0.00 0.00 66.70 67.56 2nuu h VAL 290 Cb 0.48 0.57 -0.06 0.00 -1.52 0.00 0.00 31.29 30.76 2nuu h VAL 290 CO -0.31 0.06 0.46 0.00 0.02 0.00 0.00 177.57 177.80 2nuu h ALA 291 N 1.23 1.04 -0.51 1.67 0.00 -0.23 0.13 119.26 122.59 2nuu h ALA 291 Ca 0.17 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 2nuu h ALA 291 Cb 0.13 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 2nuu h ALA 291 CO -0.16 0.18 0.23 0.78 0.00 0.00 0.00 179.25 180.28 2nuu h GLY 292 N 0.85 0.81 1.75 0.00 0.00 -0.69 -1.30 103.07 104.48 2nuu h GLY 292 Ca 0.33 -0.42 -0.16 0.00 0.00 0.00 0.00 47.33 47.08 2nuu h GLY 292 CO -0.17 0.40 -0.69 1.41 0.00 0.00 0.00 176.54 177.49 2nuu h LEU 293 N 0.68 0.29 -1.10 3.11 3.38 -0.92 -2.58 115.31 118.18 2nuu h LEU 293 Ca 0.17 -0.19 -0.09 0.00 0.09 0.00 0.00 57.88 57.86 2nuu h LEU 293 Cb 0.16 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 2nuu h LEU 293 CO -0.02 0.89 -0.44 0.00 0.09 0.00 0.00 178.44 178.96 2nuu h ALA 294 N 1.11 1.21 0.02 1.53 0.00 -0.53 -1.74 119.26 120.85 2nuu h ALA 294 Ca -0.02 -0.40 -0.22 0.00 0.00 0.00 0.00 54.91 54.27 2nuu h ALA 294 Cb 1.23 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.92 2nuu h ALA 294 CO 0.11 0.55 -1.05 0.78 0.00 0.00 0.00 179.25 179.64 2nuu h GLY 295 N 1.44 0.04 0.71 0.00 0.00 -1.18 -0.09 103.07 103.99 2nuu h GLY 295 Ca -0.00 -0.11 -0.01 0.00 0.00 0.00 0.00 47.33 47.20 2nuu h GLY 295 CO 0.06 0.10 -0.12 -2.00 0.00 0.00 0.00 176.54 174.58 2nuu h LEU 296 N 0.01 -0.28 -1.63 3.11 5.85 -1.21 -1.46 115.31 119.70 2nuu h LEU 296 Ca -0.03 -0.19 -0.01 0.00 0.84 0.00 0.00 57.88 58.49 2nuu h LEU 296 Cb 1.80 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 42.89 2nuu h LEU 296 CO 0.14 0.05 0.11 -0.25 -0.34 0.00 0.00 178.44 178.15 2nuu h TRP 297 N -0.63 0.34 -0.41 1.25 7.01 -1.37 -2.61 115.95 119.53 2nuu h TRP 297 Ca -0.03 -0.00 0.03 0.00 2.11 0.00 0.00 58.89 60.99 2nuu h TRP 297 Cb 0.45 -0.11 -0.03 0.00 -2.10 0.00 0.00 29.16 27.36 2nuu h TRP 297 CO 0.02 0.27 0.22 0.78 -2.79 0.00 0.00 178.44 176.94 2nuu h GLY 298 N 0.47 0.57 0.19 2.65 0.00 -0.54 -2.41 103.07 104.01 2nuu h GLY 298 Ca 0.09 -0.16 0.00 0.00 0.00 0.00 0.00 47.33 47.26 2nuu h GLY 298 CO -0.01 0.13 -0.27 3.33 0.00 0.00 0.00 176.54 179.72 2nuu n VAL 299 N -4.89 0.00 0.00 4.60 0.24 -0.59 -2.94 118.33 114.74 2nuu n VAL 299 Ca 0.02 -0.13 0.00 0.00 -2.04 0.00 0.00 64.34 62.19 2nuu n VAL 299 Cb 0.08 0.43 0.00 0.00 -1.47 0.00 0.00 33.84 32.89 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 -0.63 0.00 0.01 3.34 -1.04 -1.01 -4.60 114.28 110.35 2nuu n THR 300 Ca 0.12 0.00 -0.11 0.00 -2.04 0.00 0.00 64.05 62.01 2nuu n THR 300 Cb 0.35 -0.44 -0.06 0.00 -1.82 0.00 0.00 70.33 68.36 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 0.08 -0.55 -2.82 2.07 -1.75 -2.41 114.93 109.55 2nuu h MET 301 Ca 0.00 -0.01 -0.02 0.00 -2.07 0.00 0.00 59.70 57.60 2nuu h MET 301 Cb 0.00 -0.02 -0.02 0.00 -1.87 0.00 0.00 31.60 29.69 2nuu h MET 301 CO 0.00 0.08 0.26 1.25 1.07 0.00 0.00 176.91 179.56 2nuu h LEU 302 N 0.06 0.72 -0.91 1.22 7.12 -1.60 -0.35 115.31 121.57 2nuu h LEU 302 Ca 0.02 -0.14 -0.01 0.00 0.13 0.00 0.00 57.88 57.89 2nuu h LEU 302 Cb 0.02 -0.18 -0.04 0.00 -0.53 0.00 0.00 40.66 39.92 2nuu h LEU 302 CO -0.00 0.65 0.53 0.50 -0.13 0.00 0.00 178.44 179.99 2nuu h LYS 303 N 0.73 1.25 0.00 1.25 3.64 -1.50 -0.25 116.57 121.70 2nuu h LYS 303 Ca 0.19 -0.13 -0.08 0.00 -1.27 0.00 0.00 60.65 59.37 2nuu h LYS 303 Cb 0.13 -0.26 -0.01 0.00 -0.41 0.00 0.00 32.23 31.68 2nuu h LYS 303 CO -0.02 0.89 -0.36 -0.09 -2.27 0.00 0.00 179.45 177.60 2nuu h ARG 304 N 1.26 0.00 0.11 1.90 2.43 -1.04 -2.77 114.38 116.27 2nuu h ARG 304 Ca 0.32 0.00 -0.19 0.00 -0.81 0.00 0.00 59.98 59.30 2nuu h ARG 304 Cb -0.02 0.00 0.02 0.00 -0.42 0.00 0.00 29.97 29.55 2nuu h ARG 304 CO -0.06 0.36 -0.81 1.25 -1.51 0.00 0.00 179.97 179.20 2nuu h LEU 305 N 0.00 0.53 -1.51 3.80 6.46 -0.39 -3.32 115.31 120.88 2nuu h LEU 305 Ca -0.00 -0.89 -0.02 0.00 -0.12 0.00 0.00 57.88 56.84 2nuu h LEU 305 Cb 0.83 -0.17 -0.00 0.00 -0.73 0.00 0.00 40.66 40.58 2nuu h LEU 305 CO 0.05 1.37 -0.10 -0.07 -0.62 0.00 0.00 178.44 179.07 2nuu h LEU 306 N -0.24 0.00 0.27 2.25 3.38 -1.05 -3.47 115.31 116.46 2nuu h LEU 306 Ca -0.13 0.00 -0.41 0.00 0.09 0.00 0.00 57.88 57.43 2nuu h LEU 306 Cb 1.60 0.00 0.08 0.00 0.09 0.00 0.00 40.66 42.43 2nuu h LEU 306 CO 0.15 0.10 -0.64 0.54 0.09 0.00 0.00 178.44 178.69 2nuu n ARG 307 N -3.28 -6.02 -4.33 1.13 5.12 -1.05 -5.00 116.66 103.23 2nuu n ARG 307 Ca -0.00 0.87 -0.33 0.00 -1.93 0.00 0.00 57.85 56.45 2nuu n ARG 307 Cb 0.32 -5.80 -0.09 0.00 -1.16 0.00 0.00 32.46 25.73 2nuu n ARG 307 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 2nuu s VAL 308 N -3.23 4.14 -0.97 1.55 1.01 -1.25 -5.03 120.40 116.62 2nuu s VAL 308 Ca 0.42 -0.52 -0.09 0.00 0.00 0.00 0.00 61.98 61.79 2nuu s VAL 308 Cb -0.19 -2.81 0.25 0.00 0.00 0.00 0.00 36.38 33.63 2nuu s VAL 308 CO 0.52 0.44 0.93 -0.62 0.00 0.00 0.00 175.10 176.37 2nuu s ASP 309 N -1.35 6.83 -0.82 3.32 2.15 -1.26 -4.94 116.67 120.61 2nuu s ASP 309 Ca 0.18 -3.33 -0.05 0.00 0.43 0.00 0.00 52.55 49.77 2nuu s ASP 309 Cb -0.11 -2.14 0.21 0.00 -0.30 0.00 0.00 42.92 40.57 2nuu s ASP 309 CO 0.08 -0.35 0.70 -0.62 -0.17 0.00 0.00 175.17 174.81 2nuu s ASP 310 N 1.27 6.01 0.21 -0.34 2.15 -1.26 -4.83 116.67 119.87 2nuu s ASP 310 Ca 0.26 -3.26 -0.10 0.00 0.43 0.00 0.00 52.55 49.88 2nuu s ASP 310 Cb -0.10 -1.97 0.29 0.00 -0.30 0.00 0.00 42.92 40.84 2nuu s ASP 310 CO -0.09 -0.32 1.70 -0.65 -0.17 0.00 0.00 175.17 175.64 2nuu h PRO 311 N 6.70 0.23 -0.66 4.34 0.11 -1.76 0.15 132.00 141.11 2nuu h PRO 311 Ca 0.10 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.19 2nuu h PRO 311 Cb 0.90 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.96 2nuu h PRO 311 CO 0.81 0.15 0.00 0.00 -0.21 0.00 0.00 178.00 178.75 2nuu n ASP 313 N 0.48 -0.07 0.05 0.00 8.00 0.51 -4.88 116.55 120.64 2nuu n ASP 313 Ca 0.15 -1.15 -0.12 0.00 0.71 0.00 0.00 54.79 54.38 2nuu n ASP 313 Cb 0.66 -2.29 -0.08 0.00 -0.02 0.00 0.00 41.12 39.39 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 -1.86 1.02 0.04 2.53 2.07 -1.86 -2.67 116.25 115.53 2nuu h VAL 314 Ca -0.65 -0.17 -0.00 0.00 0.82 0.00 0.00 66.70 66.70 2nuu h VAL 314 Cb 1.39 1.14 0.00 0.00 -1.52 0.00 0.00 31.29 32.30 2nuu h VAL 314 CO 0.65 0.04 -0.02 0.15 0.02 0.00 0.00 177.57 178.42 2nuu h PHE 315 N -0.12 -0.05 -0.87 1.57 3.57 -1.90 0.70 116.94 119.84 2nuu h PHE 315 Ca -0.00 -0.00 0.25 0.00 3.53 0.00 0.00 57.97 61.75 2nuu h PHE 315 Cb 0.10 0.02 -0.03 0.00 2.79 0.00 0.00 35.95 38.83 2nuu h PHE 315 CO -0.05 0.32 0.82 0.78 -2.23 0.00 0.00 178.31 177.95 2nuu h GLY 316 N -0.43 0.00 0.00 2.40 0.00 -1.79 -0.81 103.07 102.44 2nuu h GLY 316 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.32 2nuu h GLY 316 CO 0.01 0.00 -0.57 -0.62 0.00 0.00 0.00 176.54 175.36 2nuu n VAL 317 N -3.72 1.33 0.15 4.60 0.31 -1.01 -4.29 118.33 115.69 2nuu n VAL 317 Ca 0.19 0.25 -0.00 0.00 -0.01 0.00 0.00 64.34 64.76 2nuu n VAL 317 Cb 1.11 -2.01 0.25 0.00 -0.91 0.00 0.00 33.84 32.28 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 -0.57 0.05 0.09 3.52 3.86 -0.87 -1.43 115.15 119.81 2nuu h HIS 318 Ca 0.00 -0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.19 2nuu h HIS 318 Cb 0.57 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 29.03 2nuu h HIS 318 CO -0.25 0.53 -0.05 0.78 0.86 0.00 0.00 177.93 179.81 2nuu h GLY 319 N 1.45 -0.13 0.74 2.45 0.00 -1.21 -2.29 103.07 104.08 2nuu h GLY 319 Ca -0.00 0.05 -0.01 0.00 0.00 0.00 0.00 47.33 47.36 2nuu h GLY 319 CO 0.07 -0.05 -0.35 -2.08 0.00 0.00 0.00 176.54 174.13 2nuu h VAL 320 N -1.02 0.28 0.00 4.60 2.07 -1.53 0.45 116.25 121.11 2nuu h VAL 320 Ca -0.01 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.46 2nuu h VAL 320 Cb 0.24 0.28 -0.01 0.00 -1.52 0.00 0.00 31.29 30.29 2nuu h VAL 320 CO 0.02 0.00 -0.22 0.00 0.02 0.00 0.00 177.57 177.39 2nuu h GLY 322 N 0.73 -0.10 0.94 0.00 0.00 -0.99 0.72 103.07 104.37 2nuu h GLY 322 Ca -0.00 0.04 -0.01 0.00 0.00 0.00 0.00 47.33 47.35 2nuu h GLY 322 CO 0.03 -0.04 0.15 -2.22 0.00 0.00 0.00 176.54 174.47 2nuu h ILE 323 N -0.37 1.16 -0.37 2.60 2.04 -0.56 -0.11 117.51 121.90 2nuu h ILE 323 Ca -0.01 -0.44 0.04 0.00 1.00 0.00 0.00 64.86 65.45 2nuu h ILE 323 Cb 0.32 0.87 -0.04 0.00 -0.74 0.00 0.00 36.82 37.23 2nuu h ILE 323 CO 0.02 0.16 0.14 0.58 0.00 0.00 0.00 178.15 179.05 2nuu h VAL 324 N 0.38 0.91 -0.37 1.67 2.07 -0.76 -1.72 116.25 118.43 2nuu h VAL 324 Ca 0.11 -0.10 -0.02 0.00 0.82 0.00 0.00 66.70 67.50 2nuu h VAL 324 Cb 0.12 0.58 -0.02 0.00 -1.52 0.00 0.00 31.29 30.45 2nuu h VAL 324 CO -0.01 0.06 0.13 1.23 0.02 0.00 0.00 177.57 179.00 2nuu h GLY 325 N 0.31 0.60 1.01 2.17 0.00 -0.63 -0.76 103.07 105.77 2nuu h GLY 325 Ca 0.17 -0.34 0.00 0.00 0.00 0.00 0.00 47.33 47.16 2nuu h GLY 325 CO -0.16 0.32 0.62 0.00 0.00 0.00 0.00 176.54 177.32 2nuu h ILE 327 N 1.31 0.98 0.00 0.00 2.04 -1.19 -3.19 117.51 117.47 2nuu h ILE 327 Ca 0.35 -0.85 0.00 0.00 1.00 0.00 0.00 64.86 65.36 2nuu h ILE 327 Cb -0.12 1.49 0.00 0.00 -0.74 0.00 0.00 36.82 37.45 2nuu h ILE 327 CO -0.07 0.19 0.00 0.24 0.00 0.00 0.00 178.15 178.51 2nuu h MET 328 N -0.64 0.00 -0.26 2.37 2.86 -0.96 -1.75 114.93 116.55 2nuu h MET 328 Ca -0.02 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.52 2nuu h MET 328 Cb 0.47 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.13 2nuu h MET 328 CO 0.04 0.00 -0.22 1.15 1.06 0.00 0.00 176.91 178.94 2nuu h THR 329 N 0.00 1.31 0.00 2.22 2.02 -1.13 -1.89 112.91 115.44 2nuu h THR 329 Ca 0.00 -1.36 0.00 0.00 0.77 0.00 0.00 66.41 65.82 2nuu h THR 329 Cb 0.09 1.60 0.00 0.00 -1.74 0.00 0.00 68.15 68.10 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 0.11 -0.76 0.06 2.16 0.00 -0.66 -1.82 105.19 104.27 2nuu n GLY 330 Ca -0.04 0.10 -0.05 0.00 0.00 0.00 0.00 46.02 46.03 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 -1.93 1.00 1.13 -0.61 5.41 -1.04 -4.61 119.36 118.71 2nuu n ILE 331 Ca -0.00 0.27 0.06 0.00 1.00 0.00 0.00 62.75 64.08 2nuu n ILE 331 Cb 0.04 -2.08 0.38 0.00 -0.71 0.00 0.00 39.64 37.27 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 -3.82 0.00 0.16 1.39 3.72 -0.74 -2.57 117.46 115.60 2nuu n PHE 332 Ca -0.08 0.00 0.08 0.00 -0.05 0.00 0.00 57.45 57.40 2nuu n PHE 332 Cb 0.31 0.00 0.07 0.00 -0.94 0.00 0.00 39.48 38.93 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 2.84 0.79 -2.59 4.37 0.00 -1.61 -3.28 119.26 119.78 2nuu h ALA 333 Ca 0.00 -0.21 -0.58 0.00 0.00 0.00 0.00 54.91 54.12 2nuu h ALA 333 Cb 0.00 0.00 0.15 0.00 0.00 0.00 0.00 17.79 17.94 2nuu h ALA 333 CO 0.00 0.27 0.10 0.00 0.00 0.00 0.00 179.25 179.62 2nuu n ALA 334 N -2.18 0.09 -0.16 0.00 0.00 -1.06 0.35 120.51 117.55 2nuu n ALA 334 Ca 0.01 0.12 -0.09 0.00 0.00 0.00 0.00 53.44 53.49 2nuu n ALA 334 Cb 0.62 -2.07 0.00 0.00 0.00 0.00 0.00 19.45 18.00 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 1.05 0.68 0.00 0.00 0.02 -1.90 -1.36 113.55 112.04 2nuu h SER 335 Ca -0.46 -0.21 0.00 0.00 -0.84 0.00 0.00 61.79 60.27 2nuu h SER 335 Cb 1.35 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 63.71 2nuu h SER 335 CO 0.54 0.71 0.00 -1.54 -1.14 0.00 0.00 176.83 175.40 2nuu n SER 336 N -4.53 0.00 -0.26 3.07 3.41 -1.26 -2.38 113.62 111.67 2nuu n SER 336 Ca 0.01 -0.52 0.07 0.00 -0.26 0.00 0.00 58.87 58.17 2nuu n SER 336 Cb 0.20 0.00 0.10 0.00 -0.26 0.00 0.00 64.21 64.25 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 -0.87 1.68 0.00 1.04 4.77 -1.11 -4.97 117.00 117.54 2nuu n LEU 337 Ca 0.07 -2.53 0.00 0.00 -0.03 0.00 0.00 56.01 53.53 2nuu n LEU 337 Cb 0.03 -0.30 0.00 0.00 -2.33 0.00 0.00 43.42 40.82 2nuu n LEU 337 CO 0.06 0.62 0.00 0.61 -1.33 0.00 0.00 177.39 177.34 2nuu n GLY 338 N -0.97 1.19 3.82 -0.72 0.00 -1.00 -4.63 105.19 102.89 2nuu n GLY 338 Ca 0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.84 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 -1.76 1.69 0.00 -0.02 0.00 -0.53 -3.09 107.32 103.61 2nuu s GLY 339 Ca 0.00 -1.02 0.29 0.00 0.00 0.00 0.00 44.72 43.98 2nuu s GLY 339 CO 0.00 -0.26 1.93 1.55 0.00 0.00 0.00 173.10 176.32 2nuu n VAL 340 N -4.00 0.04 0.00 1.40 3.14 -0.48 -4.34 118.33 114.09 2nuu n VAL 340 Ca 0.13 0.01 0.00 0.00 -2.96 0.00 0.00 64.34 61.52 2nuu n VAL 340 Cb 0.60 -0.52 0.00 0.00 -1.06 0.00 0.00 33.84 32.85 2nuu n VAL 340 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2nuu n GLY 341 N 1.38 0.22 3.94 7.55 0.00 0.16 -4.87 105.19 113.57 2nuu n GLY 341 Ca 0.08 -1.72 -0.27 0.00 0.00 0.00 0.00 46.02 44.12 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 -2.94 2.44 0.72 1.61 0.08 -1.26 -4.82 117.98 113.81 2nuu s PHE 342 Ca 0.00 0.35 -0.11 0.00 0.12 0.00 0.00 56.93 57.29 2nuu s PHE 342 Cb 0.00 -3.41 0.02 0.00 -0.57 0.00 0.00 43.02 39.06 2nuu s PHE 342 CO 0.00 -1.78 1.07 0.00 -0.10 0.00 0.00 175.22 174.42 2nuu s ALA 343 N -3.42 2.52 -0.40 5.36 0.00 -1.26 -4.89 121.76 119.67 2nuu s ALA 343 Ca 0.64 0.18 -0.41 0.00 0.00 0.00 0.00 51.96 52.37 2nuu s ALA 343 Cb -0.08 -3.22 -0.16 0.00 0.00 0.00 0.00 23.12 19.66 2nuu s ALA 343 CO 0.47 -1.41 1.96 0.39 0.00 0.00 0.00 175.76 177.17 2nuu n GLU 344 N -3.21 0.60 -2.78 0.00 1.02 -1.26 -2.44 120.64 112.57 2nuu n GLU 344 Ca 0.08 0.19 -0.09 0.00 -0.02 0.00 0.00 57.16 57.33 2nuu n GLU 344 Cb 0.53 -1.92 0.04 0.00 -0.02 0.00 0.00 31.44 30.07 2nuu n GLU 344 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2nuu n GLY 345 N 5.79 0.21 2.90 0.62 0.00 -1.26 -5.06 105.19 108.40 2nuu n GLY 345 Ca 0.40 -0.26 -0.26 0.00 0.00 0.00 0.00 46.02 45.90 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 -3.14 0.94 0.65 1.61 1.01 -1.02 -5.14 120.40 115.30 2nuu s VAL 346 Ca 0.12 -0.25 -0.04 0.00 0.00 0.00 0.00 61.98 61.81 2nuu s VAL 346 Cb -0.05 -0.96 0.05 0.00 0.00 0.00 0.00 36.38 35.41 2nuu s VAL 346 CO 0.31 0.35 0.93 0.42 0.00 0.00 0.00 175.10 177.11 2nuu s THR 347 N 1.59 2.52 0.14 3.92 -4.23 -1.26 -4.78 115.64 113.53 2nuu s THR 347 Ca 0.02 -0.37 -0.12 0.00 -1.18 0.00 0.00 61.69 60.04 2nuu s THR 347 Cb -0.13 -3.04 -0.02 0.00 1.34 0.00 0.00 72.50 70.65 2nuu s THR 347 CO -0.06 -0.04 1.53 -0.03 -0.54 0.00 0.00 174.62 175.47 2nuu h MET 348 N -0.36 0.90 -0.73 3.99 4.05 -2.00 -2.30 114.93 118.48 2nuu h MET 348 Ca -0.44 -0.38 0.04 0.00 -0.28 0.00 0.00 59.70 58.64 2nuu h MET 348 Cb 1.31 -0.03 -0.05 0.00 -0.80 0.00 0.00 31.60 32.03 2nuu h MET 348 CO 0.58 1.04 0.45 0.78 0.23 0.00 0.00 176.91 179.98 2nuu h GLY 349 N 0.73 1.07 1.37 1.39 0.00 -1.95 -1.56 103.07 104.12 2nuu h GLY 349 Ca 0.10 -0.33 -0.13 0.00 0.00 0.00 0.00 47.33 46.97 2nuu h GLY 349 CO 0.06 0.26 -0.30 0.84 0.00 0.00 0.00 176.54 177.40 2nuu h HIS 350 N 0.86 0.82 -0.31 5.60 6.17 -1.93 -2.99 115.15 123.37 2nuu h HIS 350 Ca 0.30 -0.21 -0.15 0.00 0.71 0.00 0.00 60.37 61.03 2nuu h HIS 350 Cb 0.08 -0.19 -0.01 0.00 2.52 0.00 0.00 27.41 29.81 2nuu h HIS 350 CO -0.05 0.93 -0.40 0.37 0.71 0.00 0.00 177.93 179.49 2nuu h GLN 351 N 0.61 0.74 -0.46 5.26 5.75 -0.98 -2.80 115.11 123.23 2nuu h GLN 351 Ca 0.07 -0.39 -0.06 0.00 -0.15 0.00 0.00 58.65 58.12 2nuu h GLN 351 Cb 0.82 0.01 -0.02 0.00 1.07 0.00 0.00 27.48 29.36 2nuu h GLN 351 CO 0.07 1.01 0.02 -0.07 -2.65 0.00 0.00 178.83 177.21 2nuu h LEU 352 N 0.60 0.70 -0.57 -2.39 3.38 -1.29 -0.89 115.31 114.85 2nuu h LEU 352 Ca 0.05 -0.15 -0.08 0.00 0.09 0.00 0.00 57.88 57.78 2nuu h LEU 352 Cb 0.95 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.50 2nuu h LEU 352 CO 0.09 0.75 0.03 0.25 0.09 0.00 0.00 178.44 179.64 2nuu h LEU 353 N 0.70 0.97 -0.52 1.67 6.46 -1.44 -1.95 115.31 121.19 2nuu h LEU 353 Ca 0.14 -0.29 -0.05 0.00 -0.12 0.00 0.00 57.88 57.56 2nuu h LEU 353 Cb 0.39 -0.26 -0.02 0.00 -0.73 0.00 0.00 40.66 40.04 2nuu h LEU 353 CO 0.01 1.02 0.14 0.58 -0.62 0.00 0.00 178.44 179.58 2nuu h VAL 354 N 0.88 1.24 -0.62 1.05 2.07 -1.16 -1.44 116.25 118.26 2nuu h VAL 354 Ca 0.16 -0.82 0.00 0.00 0.82 0.00 0.00 66.70 66.86 2nuu h VAL 354 Cb 0.51 0.79 -0.03 0.00 -1.52 0.00 0.00 31.29 31.04 2nuu h VAL 354 CO 0.02 0.30 0.39 1.56 0.02 0.00 0.00 177.57 179.87 2nuu h GLN 355 N 0.71 0.84 -0.20 1.57 1.08 -0.96 0.55 115.11 118.70 2nuu h GLN 355 Ca 0.16 -0.07 -0.06 0.00 -1.45 0.00 0.00 58.65 57.24 2nuu h GLN 355 Cb 0.31 -0.18 -0.01 0.00 -0.05 0.00 0.00 27.48 27.54 2nuu h GLN 355 CO -0.00 0.58 -0.15 -0.07 -0.95 0.00 0.00 178.83 178.24 2nuu h LEU 356 N 0.85 0.32 -0.41 1.46 4.07 -1.21 -0.10 115.31 120.29 2nuu h LEU 356 Ca 0.23 -0.07 -0.16 0.00 0.08 0.00 0.00 57.88 57.95 2nuu h LEU 356 Cb -0.05 -0.08 -0.01 0.00 1.08 0.00 0.00 40.66 41.60 2nuu h LEU 356 CO -0.04 0.49 -0.39 -0.08 -1.08 0.00 0.00 178.44 177.34 2nuu h GLU 357 N 0.31 0.92 -0.24 1.13 4.81 -0.38 0.13 114.58 121.27 2nuu h GLU 357 Ca 0.06 -0.49 -0.15 0.00 -0.13 0.00 0.00 59.36 58.65 2nuu h GLU 357 Cb 0.45 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.84 2nuu h GLU 357 CO 0.03 1.14 -0.47 0.77 -0.73 0.00 0.00 179.01 179.75 2nuu h SER 358 N 0.75 0.69 -0.22 1.04 0.02 -0.45 -1.62 113.55 113.78 2nuu h SER 358 Ca 0.06 -0.34 -0.08 0.00 -0.84 0.00 0.00 61.79 60.60 2nuu h SER 358 Cb 0.98 -0.20 -0.00 0.00 0.14 0.00 0.00 62.40 63.32 2nuu h SER 358 CO 0.09 1.05 -0.16 0.40 -1.14 0.00 0.00 176.83 177.08 2nuu h ILE 359 N 0.51 1.32 -0.19 3.27 2.04 -0.88 -2.18 117.51 121.40 2nuu h ILE 359 Ca 0.03 -1.29 0.00 0.00 1.00 0.00 0.00 64.86 64.60 2nuu h ILE 359 Cb 1.01 1.68 -0.01 0.00 -0.74 0.00 0.00 36.82 38.76 2nuu h ILE 359 CO 0.09 0.39 0.12 0.00 0.00 0.00 0.00 178.15 178.76 2nuu h ALA 360 N 0.68 0.24 -0.37 1.87 0.00 -0.90 -1.16 119.26 119.62 2nuu h ALA 360 Ca 0.04 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 2nuu h ALA 360 Cb 0.69 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 2nuu h ALA 360 CO 0.04 -0.28 -0.09 0.82 0.00 0.00 0.00 179.25 179.75 2nuu h ILE 361 N 0.25 1.24 -0.10 0.00 2.04 -1.34 -1.44 117.51 118.16 2nuu h ILE 361 Ca 0.07 -1.05 -0.07 0.00 1.00 0.00 0.00 64.86 64.81 2nuu h ILE 361 Cb -0.02 1.06 0.00 0.00 -0.74 0.00 0.00 36.82 37.12 2nuu h ILE 361 CO -0.01 0.35 -0.21 0.74 0.00 0.00 0.00 178.15 179.02 2nuu h THR 362 N 0.59 1.40 -0.75 -0.27 2.02 -1.18 -1.80 112.91 112.91 2nuu h THR 362 Ca 0.11 -1.51 -0.02 0.00 0.77 0.00 0.00 66.41 65.77 2nuu h THR 362 Cb 0.51 2.14 -0.04 0.00 -1.74 0.00 0.00 68.15 69.02 2nuu h THR 362 CO 0.03 0.43 0.41 0.40 0.37 0.00 0.00 175.52 177.16 2nuu h ILE 363 N -0.14 1.23 -0.21 3.11 2.04 -1.16 -2.44 117.51 119.93 2nuu h ILE 363 Ca 0.00 -0.57 -0.06 0.00 1.00 0.00 0.00 64.86 65.23 2nuu h ILE 363 Cb 0.80 0.24 -0.01 0.00 -0.74 0.00 0.00 36.82 37.12 2nuu h ILE 363 CO 0.05 0.25 -0.12 0.58 0.00 0.00 0.00 178.15 178.91 2nuu h VAL 364 N 1.03 1.31 -0.00 1.67 2.07 -1.28 -2.78 116.25 118.26 2nuu h VAL 364 Ca 0.26 -1.20 -0.00 0.00 0.82 0.00 0.00 66.70 66.58 2nuu h VAL 364 Cb 0.04 1.65 -0.00 0.00 -1.52 0.00 0.00 31.29 31.46 2nuu h VAL 364 CO -0.04 0.36 -0.00 -0.25 0.02 0.00 0.00 177.57 177.66 2nuu h TRP 365 N 0.14 0.00 -0.74 1.57 -0.00 -1.30 -2.88 115.95 112.74 2nuu h TRP 365 Ca 0.04 -0.00 0.04 0.00 -0.00 0.00 0.00 58.89 58.97 2nuu h TRP 365 Cb 0.62 -0.00 -0.05 0.00 -0.00 0.00 0.00 29.16 29.73 2nuu h TRP 365 CO 0.07 0.45 0.46 1.03 -0.00 0.00 0.00 178.44 180.45 2nuu h SER 366 N -0.45 0.75 -0.13 2.65 0.87 -1.56 -1.63 113.55 114.07 2nuu h SER 366 Ca 0.00 0.00 0.01 0.00 -1.23 0.00 0.00 61.79 60.57 2nuu h SER 366 Cb 0.45 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.24 2nuu h SER 366 CO 0.00 0.51 0.06 1.23 -0.53 0.00 0.00 176.83 178.10 2nuu h GLY 367 N 0.89 0.16 1.00 5.77 0.00 -1.51 0.32 103.07 109.70 2nuu h GLY 367 Ca 0.31 -0.04 -0.11 0.00 0.00 0.00 0.00 47.33 47.48 2nuu h GLY 367 CO -0.13 0.04 -0.20 -2.08 0.00 0.00 0.00 176.54 174.17 2nuu h VAL 368 N 0.13 1.28 -0.32 4.60 2.07 -1.31 -2.03 116.25 120.67 2nuu h VAL 368 Ca 0.05 -1.33 -0.03 0.00 0.82 0.00 0.00 66.70 66.21 2nuu h VAL 368 Cb 0.01 1.36 -0.01 0.00 -1.52 0.00 0.00 31.29 31.13 2nuu h VAL 368 CO -0.04 0.44 0.10 0.58 0.02 0.00 0.00 177.57 178.67 2nuu h VAL 369 N 0.57 1.21 -0.97 2.57 2.07 -1.19 -2.41 116.25 118.09 2nuu h VAL 369 Ca 0.08 -0.68 0.09 0.00 0.82 0.00 0.00 66.70 67.02 2nuu h VAL 369 Cb 0.75 1.05 -0.07 0.00 -1.52 0.00 0.00 31.29 31.49 2nuu h VAL 369 CO 0.06 0.23 0.62 0.00 0.02 0.00 0.00 177.57 178.50 2nuu h ALA 370 N 0.93 1.51 0.11 1.67 0.00 -0.27 -2.13 119.26 121.08 2nuu h ALA 370 Ca 0.10 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 2nuu h ALA 370 Cb 0.26 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2nuu h ALA 370 CO -0.00 0.29 -0.05 0.35 0.00 0.00 0.00 179.25 179.84 2nuu h PHE 371 N 1.03 -0.14 -0.82 0.00 3.57 -0.90 -1.71 116.94 117.97 2nuu h PHE 371 Ca 0.45 -0.00 0.09 0.00 3.53 0.00 0.00 57.97 62.04 2nuu h PHE 371 Cb 0.35 0.05 -0.07 0.00 2.79 0.00 0.00 35.95 39.07 2nuu h PHE 371 CO -0.00 -0.08 0.48 0.82 -2.23 0.00 0.00 178.31 177.29 2nuu h ILE 372 N -0.15 0.93 0.51 1.41 2.04 -1.01 -1.78 117.51 119.46 2nuu h ILE 372 Ca -0.01 -0.28 -0.02 0.00 1.00 0.00 0.00 64.86 65.54 2nuu h ILE 372 Cb 0.11 0.05 0.00 0.00 -0.74 0.00 0.00 36.82 36.25 2nuu h ILE 372 CO 0.02 0.15 -0.24 1.23 0.00 0.00 0.00 178.15 179.31 2nuu h GLY 373 N 0.81 -0.71 1.79 5.37 0.00 -1.12 0.60 103.07 109.81 2nuu h GLY 373 Ca 0.39 0.26 -0.02 0.00 0.00 0.00 0.00 47.33 47.96 2nuu h GLY 373 CO -0.23 -0.26 0.03 -0.97 0.00 0.00 0.00 176.54 175.11 2nuu h TYR 374 N -0.72 0.28 -0.17 5.60 0.05 -1.16 -1.31 116.97 119.54 2nuu h TYR 374 Ca -0.07 -0.01 -0.20 0.00 0.05 0.00 0.00 58.73 58.50 2nuu h TYR 374 Cb 0.54 -0.09 0.00 0.00 1.01 0.00 0.00 36.73 38.20 2nuu h TYR 374 CO -0.03 0.27 -0.69 0.87 -1.05 0.00 0.00 178.16 177.53 2nuu h LYS 375 N 0.28 0.70 -0.45 4.88 1.79 -1.17 -0.54 116.57 122.06 2nuu h LYS 375 Ca 0.07 -0.52 -0.07 0.00 -2.18 0.00 0.00 60.65 57.95 2nuu h LYS 375 Cb 0.15 0.09 -0.02 0.00 -1.58 0.00 0.00 32.23 30.87 2nuu h LYS 375 CO -0.00 1.14 0.01 1.25 -1.08 0.00 0.00 179.45 180.78 2nuu h LEU 376 N 0.50 0.70 -0.51 2.94 6.46 -0.28 -1.12 115.31 124.00 2nuu h LEU 376 Ca -0.02 -0.16 -0.16 0.00 -0.12 0.00 0.00 57.88 57.42 2nuu h LEU 376 Cb 1.29 -0.18 -0.01 0.00 -0.73 0.00 0.00 40.66 41.03 2nuu h LEU 376 CO 0.14 0.76 -0.50 0.00 -0.62 0.00 0.00 178.44 178.22 2nuu h ALA 377 N 1.32 0.68 0.00 1.25 0.00 -1.09 -2.86 119.26 118.56 2nuu h ALA 377 Ca 0.14 -0.49 -0.11 0.00 0.00 0.00 0.00 54.91 54.46 2nuu h ALA 377 Cb 0.41 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2nuu h ALA 377 CO 0.02 0.68 -0.50 0.22 0.00 0.00 0.00 179.25 179.66 2nuu h ASP 378 N 0.51 0.00 0.65 0.00 -0.00 -0.73 0.50 116.42 117.34 2nuu h ASP 378 Ca 0.02 0.00 -0.19 0.00 -0.00 0.00 0.00 57.03 56.86 2nuu h ASP 378 Cb 1.05 0.00 -0.01 0.00 -0.00 0.00 0.00 39.33 40.36 2nuu h ASP 378 CO 0.10 0.50 -0.88 -0.07 -0.00 0.00 0.00 179.24 178.89 2nuu h LEU 379 N 0.00 0.20 0.00 2.28 3.38 -1.15 -3.22 115.31 116.80 2nuu h LEU 379 Ca -0.01 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.80 2nuu h LEU 379 Cb 1.15 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.84 2nuu h LEU 379 CO 0.07 0.98 -0.74 0.35 0.09 0.00 0.00 178.44 179.18 2nuu n THR 380 N -3.63 1.38 -0.04 0.22 -2.24 -1.09 -4.85 114.28 104.03 2nuu n THR 380 Ca -0.03 0.19 0.01 0.00 -2.27 0.00 0.00 64.05 61.96 2nuu n THR 380 Cb 0.81 -2.32 -0.13 0.00 -2.10 0.00 0.00 70.33 66.59 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 -4.41 0.50 0.00 2.28 0.24 -0.02 -5.10 118.33 111.82 2nuu n VAL 381 Ca -0.10 -0.53 0.00 0.00 -2.04 0.00 0.00 64.34 61.67 2nuu n VAL 381 Cb 0.38 -0.20 0.00 0.00 -1.47 0.00 0.00 33.84 32.55 2nuu n VAL 381 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2nuu n GLY 382 N 1.74 0.13 0.15 7.63 0.00 -0.14 -4.98 105.19 109.72 2nuu n GLY 382 Ca -0.14 -1.28 -0.17 0.00 0.00 0.00 0.00 46.02 44.43 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 0.58 -9.65 0.99 3.38 -1.84 -3.43 115.31 105.34 2nuu h LEU 383 Ca 0.00 -0.74 -0.66 0.00 0.09 0.00 0.00 57.88 56.57 2nuu h LEU 383 Cb 0.00 -0.18 -0.07 0.00 0.09 0.00 0.00 40.66 40.51 2nuu h LEU 383 CO 0.00 1.24 -0.45 -0.60 0.09 0.00 0.00 178.44 178.72 2nuu s ARG 384 N -3.30 3.49 0.44 1.13 3.52 -1.26 -0.53 118.95 122.43 2nuu s ARG 384 Ca -0.13 -0.08 -0.21 0.00 -0.13 0.00 0.00 55.73 55.18 2nuu s ARG 384 Cb 0.04 -3.19 -0.10 0.00 -1.56 0.00 0.00 34.95 30.14 2nuu s ARG 384 CO 0.83 0.77 0.97 0.14 -0.81 0.00 0.00 175.30 177.20 2nuu s VAL 385 N -1.05 4.22 0.65 7.11 -7.23 -0.96 -4.83 120.40 118.31 2nuu s VAL 385 Ca 0.17 1.40 -0.18 0.00 -1.81 0.00 0.00 61.98 61.56 2nuu s VAL 385 Cb -0.12 -3.57 -0.01 0.00 0.56 0.00 0.00 36.38 33.24 2nuu s VAL 385 CO 0.06 -0.28 1.26 -2.16 -0.31 0.00 0.00 175.10 173.66 2nuu s PRO 386 N -3.16 2.54 0.31 4.82 0.04 -1.26 -4.77 135.00 133.53 2nuu s PRO 386 Ca 0.63 1.96 0.02 0.00 0.04 0.00 0.00 61.00 63.65 2nuu s PRO 386 Cb -0.11 -1.86 0.76 0.00 0.04 0.00 0.00 34.50 33.33 2nuu s PRO 386 CO 0.15 -1.58 1.56 -1.91 0.04 0.00 0.00 177.00 175.26 2nuu n GLU 387 N -2.01 -0.08 0.21 4.56 2.13 -1.26 -1.01 120.64 123.18 2nuu n GLU 387 Ca 0.15 1.49 0.05 0.00 0.66 0.00 0.00 57.16 59.51 2nuu n GLU 387 Cb 0.49 -2.37 0.46 0.00 0.27 0.00 0.00 31.44 30.29 2nuu n GLU 387 CO 0.00 0.00 0.00 1.05 -0.41 0.00 0.00 177.13 177.77 2nuu h GLU 388 N 0.00 0.00 -0.07 5.31 9.09 -2.00 -1.50 114.58 125.41 2nuu h GLU 388 Ca 0.61 0.00 -0.20 0.00 0.05 0.00 0.00 59.36 59.81 2nuu h GLU 388 Cb 1.25 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 28.35 2nuu h GLU 388 CO -0.94 0.27 -0.79 1.96 0.05 0.00 0.00 179.01 179.56 2nuu h GLN 389 N 0.00 0.48 -0.14 1.06 4.20 -1.42 -2.56 115.11 116.73 2nuu h GLN 389 Ca -0.00 -0.42 -0.03 0.00 0.06 0.00 0.00 58.65 58.25 2nuu h GLN 389 Cb 0.49 0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.36 2nuu h GLN 389 CO 0.03 1.06 -0.07 1.49 -0.67 0.00 0.00 178.83 180.68 2nuu h GLU 390 N 0.32 0.21 0.00 1.46 4.81 -0.89 0.20 114.58 120.68 2nuu h GLU 390 Ca -0.05 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.13 2nuu h GLU 390 Cb 1.39 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.73 2nuu h GLU 390 CO 0.14 0.29 -0.07 0.00 -0.73 0.00 0.00 179.01 178.64 2nuu h ARG 391 N 0.20 0.04 -0.65 1.92 2.47 -1.13 -3.33 114.38 113.91 2nuu h ARG 391 Ca 0.05 -0.05 -0.06 0.00 -1.26 0.00 0.00 59.98 58.66 2nuu h ARG 391 Cb 0.25 0.01 -0.03 0.00 -1.65 0.00 0.00 29.97 28.56 2nuu h ARG 391 CO 0.01 0.87 0.16 0.93 0.56 0.00 0.00 179.97 182.50 2nuu h GLU 392 N -0.77 1.03 0.00 0.04 5.08 -1.39 -3.49 114.58 115.08 2nuu h GLU 392 Ca -0.01 -0.25 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 2nuu h GLU 392 Cb 0.90 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 30.01 2nuu h GLU 392 CO 0.01 0.93 0.00 0.41 -1.00 0.00 0.00 179.01 179.36 2nuu n GLY 393 N -0.65 3.66 0.20 -3.84 0.00 0.05 -4.91 105.19 99.70 2nuu n GLY 393 Ca 0.04 -1.62 0.07 0.00 0.00 0.00 0.00 46.02 44.51 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 -0.15 0.99 3.38 -1.69 -3.13 115.31 114.70 2nuu h LEU 394 Ca 0.00 0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.01 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 0.31 -0.11 0.44 0.09 0.00 0.00 178.44 179.17 2nuu h ASP 395 N 0.00 -0.35 0.53 -0.43 5.19 -1.77 0.21 116.42 119.81 2nuu h ASP 395 Ca -0.00 0.07 -0.29 0.00 -0.62 0.00 0.00 57.03 56.20 2nuu h ASP 395 Cb 0.79 0.18 -0.04 0.00 0.18 0.00 0.00 39.33 40.43 2nuu h ASP 395 CO 0.04 -0.14 -1.63 -0.37 -3.12 0.00 0.00 179.24 174.02 2nuu h VAL 396 N -0.11 0.95 -0.03 -1.35 -1.51 -1.64 -0.63 116.25 111.93 2nuu h VAL 396 Ca 0.09 -2.78 -0.08 0.00 -1.23 0.00 0.00 66.70 62.71 2nuu h VAL 396 Cb 0.25 2.49 0.00 0.00 -2.13 0.00 0.00 31.29 31.90 2nuu h VAL 396 CO -0.22 0.58 -0.29 0.78 -1.23 0.00 0.00 177.57 177.18 2nuu h ASN 397 N 0.01 0.31 0.31 4.19 2.35 -1.54 -2.68 115.58 118.53 2nuu h ASN 397 Ca -0.26 -0.71 -0.14 0.00 -0.55 0.00 0.00 56.30 54.64 2nuu h ASN 397 Cb 1.98 -0.09 -0.03 0.00 0.05 0.00 0.00 38.32 40.24 2nuu h ASN 397 CO 0.09 0.97 -1.82 -1.20 -1.65 0.00 0.00 177.43 173.81 2nuu n SER 398 N -4.47 0.34 0.00 5.81 7.64 0.72 -4.60 113.62 119.06 2nuu n SER 398 Ca -0.09 0.14 0.00 0.00 1.01 0.00 0.00 58.87 59.93 2nuu n SER 398 Cb 0.50 1.05 0.00 0.00 -1.01 0.00 0.00 64.21 64.76 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 -2.61 0.00 -4.09 1.43 8.25 -1.00 -5.00 115.22 112.19 2nuu n HIS 399 Ca -0.13 -0.04 -0.30 0.00 -0.26 0.00 0.00 57.72 56.99 2nuu n HIS 399 Cb 0.79 -0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.87 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 -0.04 -0.31 3.22 -1.41 0.00 -0.34 -4.88 105.19 101.43 2nuu n GLY 400 Ca 0.00 0.15 -0.11 0.00 0.00 0.00 0.00 46.02 46.05 2nuu n GLY 400 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2nuu s GLU 401 N -6.78 0.75 -0.16 1.61 2.02 -0.61 -4.92 118.70 110.62 2nuu s GLU 401 Ca 0.31 -0.52 0.02 0.00 0.02 0.00 0.00 54.97 54.80 2nuu s GLU 401 Cb -0.17 0.32 0.02 0.00 0.10 0.00 0.00 34.13 34.40 2nuu s GLU 401 CO 0.91 -0.23 -0.20 1.21 0.02 0.00 0.00 175.26 176.97 2nuu s ASN 402 N -2.00 3.05 0.18 -0.19 3.84 -1.26 -3.12 114.94 115.45 2nuu s ASN 402 Ca -0.06 -0.61 -0.13 0.00 0.21 0.00 0.00 52.86 52.27 2nuu s ASN 402 Cb -0.01 -1.42 0.17 0.00 -0.55 0.00 0.00 41.25 39.44 2nuu s ASN 402 CO -0.03 0.03 1.74 0.00 -2.79 0.00 0.00 177.10 176.05 2nuu h ALA 403 N 7.70 0.58 -3.12 1.71 0.00 -1.96 -3.42 119.26 120.75 2nuu h ALA 403 Ca -0.40 0.08 -0.64 0.00 0.00 0.00 0.00 54.91 53.95 2nuu h ALA 403 Cb 1.16 0.07 -0.35 0.00 0.00 0.00 0.00 17.79 18.67 2nuu h ALA 403 CO 0.59 -0.25 -0.85 0.71 0.00 0.00 0.00 179.25 179.45 2nuu s TYR 404 N -6.13 2.46 0.07 0.00 2.02 -1.26 -5.12 117.35 109.39 2nuu s TYR 404 Ca -0.13 -1.38 0.01 0.00 -0.37 0.00 0.00 57.07 55.19 2nuu s TYR 404 Cb 0.15 -1.74 -0.00 0.00 -0.40 0.00 0.00 41.96 39.97 2nuu s TYR 404 CO 0.73 -0.70 0.02 0.09 -1.57 0.00 0.00 175.55 174.12 2nuu n ASN 405 N 4.56 1.29 0.00 2.29 3.02 -1.26 -5.22 115.26 119.94 2nuu n ASN 405 Ca -0.19 -1.38 0.00 0.00 -0.03 0.00 0.00 54.58 52.98 2nuu n ASN 405 Cb 0.50 0.15 0.00 0.00 -0.61 0.00 0.00 39.78 39.82 2nuu n ASN 405 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64