#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dd0 s HIS 4 N 0.00 0.60 0.58 1.57 5.04 -1.26 -5.15 115.29 116.67 3dd0 s HIS 4 Ca 0.00 -1.02 -0.16 0.00 -1.54 0.00 0.00 55.06 52.33 3dd0 s HIS 4 Cb 0.00 -0.33 -0.04 0.00 0.04 0.00 0.00 32.58 32.25 3dd0 s HIS 4 CO 0.00 -0.52 1.06 1.67 -2.34 0.00 0.00 174.74 174.61 3dd0 s TRP 5 N -3.98 2.98 0.00 3.88 1.48 -1.26 -4.86 118.94 117.19 3dd0 s TRP 5 Ca 0.16 1.52 0.00 0.00 -1.06 0.00 0.00 56.10 56.72 3dd0 s TRP 5 Cb 0.07 -3.02 0.00 0.00 -1.16 0.00 0.00 33.47 29.36 3dd0 s TRP 5 CO -0.03 -1.10 0.00 0.41 -4.06 0.00 0.00 176.95 172.16 3dd0 n GLY 6 N -0.89 2.67 0.04 3.67 0.00 -0.15 -5.03 105.19 105.50 3dd0 n GLY 6 Ca 0.09 -0.34 0.03 0.00 0.00 0.00 0.00 46.02 45.81 3dd0 n GLY 6 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3dd0 n TYR 7 N 0.00 0.00 -2.03 1.61 4.02 -1.26 -3.69 117.16 115.80 3dd0 n TYR 7 Ca 0.00 -0.62 -0.29 0.00 -0.01 0.00 0.00 57.90 56.98 3dd0 n TYR 7 Cb 0.00 -0.08 0.17 0.00 -0.02 0.00 0.00 39.34 39.41 3dd0 n TYR 7 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 3dd0 s GLY 8 N -1.59 1.77 0.32 2.72 0.00 -1.26 -4.67 107.32 104.60 3dd0 s GLY 8 Ca 0.11 -1.27 0.04 0.00 0.00 0.00 0.00 44.72 43.60 3dd0 s GLY 8 CO 0.01 -0.54 1.82 1.70 0.00 0.00 0.00 173.10 176.10 3dd0 h LYS 9 N -1.46 0.51 -0.01 2.90 3.11 -1.98 -1.33 116.57 118.31 3dd0 h LYS 9 Ca -0.43 -0.13 0.00 0.00 -2.81 0.00 0.00 60.65 57.27 3dd0 h LYS 9 Cb 1.24 -0.06 0.00 0.00 -1.00 0.00 0.00 32.23 32.41 3dd0 h LYS 9 CO 0.39 0.60 -0.58 0.72 -2.81 0.00 0.00 179.45 177.77 3dd0 n HIS 10 N -4.23 0.00 -1.76 1.91 -0.00 -1.26 -4.42 115.22 105.46 3dd0 n HIS 10 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.73 3dd0 n HIS 10 Cb 0.30 -0.05 0.01 0.00 -0.00 0.00 0.00 29.99 30.25 3dd0 n HIS 10 CO 0.00 0.00 0.00 0.27 -0.00 0.00 0.00 176.34 176.61 3dd0 n ASN 11 N -0.69 0.12 -2.88 0.41 6.94 -1.17 -4.99 115.26 113.00 3dd0 n ASN 11 Ca 0.08 -1.87 -0.13 0.00 -0.02 0.00 0.00 54.58 52.63 3dd0 n ASN 11 Cb 0.40 -0.17 0.10 0.00 -2.36 0.00 0.00 39.78 37.74 3dd0 n ASN 11 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3dd0 n GLY 12 N -0.07 -1.52 0.44 4.83 0.00 -0.51 -0.98 105.19 107.38 3dd0 n GLY 12 Ca 0.01 -1.65 0.25 0.00 0.00 0.00 0.00 46.02 44.63 3dd0 n GLY 12 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3dd0 h PRO 13 N 0.00 0.26 0.00 1.61 0.11 -1.86 0.85 132.00 132.96 3dd0 h PRO 13 Ca -0.19 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.90 3dd0 h PRO 13 Cb 0.54 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.60 3dd0 h PRO 13 CO 0.14 0.17 0.00 -0.85 -0.21 0.00 0.00 178.00 177.25 3dd0 n GLU 14 N -4.46 0.12 -0.00 1.05 0.00 -1.26 -2.72 120.64 113.37 3dd0 n GLU 14 Ca 0.23 0.39 0.10 0.00 0.00 0.00 0.00 57.16 57.88 3dd0 n GLU 14 Cb 0.92 -1.75 -0.12 0.00 0.00 0.00 0.00 31.44 30.49 3dd0 n GLU 14 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 3dd0 n HIS 15 N -1.98 0.03 0.07 -1.84 8.25 0.29 -4.56 115.22 115.47 3dd0 n HIS 15 Ca 0.02 0.01 0.05 0.00 -0.26 0.00 0.00 57.72 57.54 3dd0 n HIS 15 Cb 0.19 -0.22 0.47 0.00 1.12 0.00 0.00 29.99 31.55 3dd0 n HIS 15 CO 0.00 0.00 0.00 -1.49 0.64 0.00 0.00 176.34 175.49 3dd0 h TRP 16 N 0.00 0.38 0.00 4.41 6.55 -1.52 -2.21 115.95 123.56 3dd0 h TRP 16 Ca 0.00 0.01 -0.00 0.00 0.95 0.00 0.00 58.89 59.85 3dd0 h TRP 16 Cb 0.70 -0.13 -0.00 0.00 -0.86 0.00 0.00 29.16 28.87 3dd0 h TRP 16 CO 0.00 0.25 -0.01 1.12 -1.05 0.00 0.00 178.44 178.75 3dd0 h HIS 17 N 0.41 0.00 -0.03 0.49 2.07 -1.79 -0.43 115.15 115.87 3dd0 h HIS 17 Ca 0.11 0.00 -0.11 0.00 -2.85 0.00 0.00 60.37 57.52 3dd0 h HIS 17 Cb -0.03 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 29.93 3dd0 h HIS 17 CO 0.00 0.01 -0.48 0.87 -3.07 0.00 0.00 177.93 175.26 3dd0 h LYS 18 N 0.00 0.07 0.00 5.12 1.57 -1.74 -2.93 116.57 118.66 3dd0 h LYS 18 Ca -0.00 -0.04 -0.12 0.00 -1.87 0.00 0.00 60.65 58.63 3dd0 h LYS 18 Cb 0.04 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.33 3dd0 h LYS 18 CO 0.00 0.54 -2.07 -0.25 -0.57 0.00 0.00 179.45 177.10 3dd0 n ASP 19 N -3.97 0.25 -3.62 0.86 8.00 -0.90 -4.75 116.55 112.43 3dd0 n ASP 19 Ca -0.02 0.00 -0.27 0.00 0.71 0.00 0.00 54.79 55.21 3dd0 n ASP 19 Cb 0.51 1.63 -0.11 0.00 -0.02 0.00 0.00 41.12 43.13 3dd0 n ASP 19 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3dd0 n PHE 20 N -2.38 1.26 0.30 1.24 3.72 -0.22 -5.00 117.46 116.37 3dd0 n PHE 20 Ca -0.13 -3.83 0.20 0.00 -0.05 0.00 0.00 57.45 53.64 3dd0 n PHE 20 Cb 0.73 -0.22 1.02 0.00 -0.94 0.00 0.00 39.48 40.08 3dd0 n PHE 20 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 3dd0 h PRO 21 N 5.35 0.00 0.00 -1.08 0.13 -1.76 -0.52 132.00 134.12 3dd0 h PRO 21 Ca 0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.33 3dd0 h PRO 21 Cb 0.82 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.95 3dd0 h PRO 21 CO 0.56 0.00 0.00 1.51 -0.23 0.00 0.00 178.00 179.84 3dd0 n ILE 22 N -2.87 1.64 0.08 -3.56 3.06 -1.26 -2.11 119.36 114.34 3dd0 n ILE 22 Ca -0.02 0.41 0.19 0.00 -2.50 0.00 0.00 62.75 60.83 3dd0 n ILE 22 Cb 0.08 -1.33 0.73 0.00 0.54 0.00 0.00 39.64 39.67 3dd0 n ILE 22 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 3dd0 h ALA 23 N 2.17 2.24 -0.68 1.51 0.00 -1.41 0.26 119.26 123.35 3dd0 h ALA 23 Ca 0.00 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.72 3dd0 h ALA 23 Cb 0.09 0.03 -0.10 0.00 0.00 0.00 0.00 17.79 17.81 3dd0 h ALA 23 CO 0.00 -0.55 0.21 1.63 0.00 0.00 0.00 179.25 180.54 3dd0 n LYS 24 N -4.10 3.79 -0.79 0.00 5.02 -0.90 -4.96 118.16 116.22 3dd0 n LYS 24 Ca 0.07 -3.10 -0.30 0.00 -2.02 0.00 0.00 58.31 52.96 3dd0 n LYS 24 Cb 0.53 -2.19 0.25 0.00 -0.02 0.00 0.00 35.03 33.59 3dd0 n LYS 24 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 3dd0 s GLY 25 N -1.11 1.52 0.10 0.72 0.00 0.08 -4.99 107.32 103.63 3dd0 s GLY 25 Ca 0.54 -0.66 0.25 0.00 0.00 0.00 0.00 44.72 44.85 3dd0 s GLY 25 CO 0.13 0.19 1.46 1.18 0.00 0.00 0.00 173.10 176.06 3dd0 n GLU 26 N -4.96 0.20 -2.80 2.90 -0.58 -1.26 -4.29 120.64 109.86 3dd0 n GLU 26 Ca 0.09 0.08 -0.15 0.00 -0.42 0.00 0.00 57.16 56.77 3dd0 n GLU 26 Cb 0.58 -1.65 0.01 0.00 -0.57 0.00 0.00 31.44 29.81 3dd0 n GLU 26 CO 0.00 0.00 0.00 2.89 -0.48 0.00 0.00 177.13 179.54 3dd0 n ARG 27 N -1.96 1.51 -2.78 3.49 1.85 -1.26 -4.63 116.66 112.88 3dd0 n ARG 27 Ca 0.04 -3.54 -0.30 0.00 -1.00 0.00 0.00 57.85 53.05 3dd0 n ARG 27 Cb 0.41 -1.56 -0.03 0.00 -1.05 0.00 0.00 32.46 30.24 3dd0 n ARG 27 CO 0.00 0.00 0.00 -0.65 -0.01 0.00 0.00 177.63 176.97 3dd0 s GLN 28 N -3.01 3.76 0.20 2.89 -1.52 -1.26 -2.67 119.66 118.05 3dd0 s GLN 28 Ca 0.35 0.48 0.08 0.00 -1.95 0.00 0.00 55.36 54.32 3dd0 s GLN 28 Cb 0.41 -2.36 -0.05 0.00 -0.22 0.00 0.00 33.01 30.79 3dd0 s GLN 28 CO -0.03 -0.08 -0.15 -1.12 -0.25 0.00 0.00 175.29 173.66 3dd0 s SER 29 N -3.26 2.57 0.99 5.90 0.01 -1.26 -4.69 113.70 113.96 3dd0 s SER 29 Ca 0.51 -0.98 -0.17 0.00 1.31 0.00 0.00 55.95 56.62 3dd0 s SER 29 Cb -0.10 -0.14 0.22 0.00 0.21 0.00 0.00 66.02 66.21 3dd0 s SER 29 CO 0.33 -0.14 1.33 -2.16 0.41 0.00 0.00 173.24 173.01 3dd0 s PRO 30 N -3.46 0.41 0.14 12.44 0.04 -1.26 -4.63 135.00 138.69 3dd0 s PRO 30 Ca 0.21 -0.46 0.01 0.00 0.04 0.00 0.00 61.00 60.79 3dd0 s PRO 30 Cb -0.02 -1.82 -0.04 0.00 0.04 0.00 0.00 34.50 32.65 3dd0 s PRO 30 CO 0.07 -2.56 -0.00 0.14 0.04 0.00 0.00 177.00 174.68 3dd0 s VAL 31 N -3.90 0.52 -0.01 -0.36 -7.23 -1.26 -0.78 120.40 107.38 3dd0 s VAL 31 Ca 0.75 -1.94 -0.28 0.00 -1.81 0.00 0.00 61.98 58.69 3dd0 s VAL 31 Cb -0.03 -1.98 -0.03 0.00 0.56 0.00 0.00 36.38 34.89 3dd0 s VAL 31 CO 0.54 -0.58 0.91 -0.62 -0.31 0.00 0.00 175.10 175.04 3dd0 s ASP 32 N -3.10 7.28 -0.46 4.85 2.15 -1.26 -3.14 116.67 122.99 3dd0 s ASP 32 Ca 0.21 1.55 -0.21 0.00 0.43 0.00 0.00 52.55 54.53 3dd0 s ASP 32 Cb 0.06 -2.53 0.03 0.00 -0.30 0.00 0.00 42.92 40.18 3dd0 s ASP 32 CO 0.01 -0.22 0.66 -0.63 -0.17 0.00 0.00 175.17 174.82 3dd0 s ILE 33 N 0.93 4.81 -0.43 4.11 1.01 0.40 -4.95 121.20 127.08 3dd0 s ILE 33 Ca 0.48 0.02 -0.21 0.00 0.00 0.00 0.00 60.65 60.94 3dd0 s ILE 33 Cb -0.20 -4.24 0.02 0.00 0.01 0.00 0.00 42.46 38.05 3dd0 s ILE 33 CO 0.26 -0.66 0.67 -0.62 0.00 0.00 0.00 174.94 174.59 3dd0 s ASP 34 N 2.16 6.35 0.42 3.58 2.15 -1.26 -0.47 116.67 129.60 3dd0 s ASP 34 Ca 0.22 -0.26 0.20 0.00 0.43 0.00 0.00 52.55 53.14 3dd0 s ASP 34 Cb -0.15 -2.33 0.93 0.00 -0.30 0.00 0.00 42.92 41.07 3dd0 s ASP 34 CO 0.18 -0.79 1.86 0.71 -0.17 0.00 0.00 175.17 176.96 3dd0 h THR 35 N 5.88 0.87 0.00 1.71 1.35 -1.95 -2.23 112.91 118.55 3dd0 h THR 35 Ca -0.25 -1.13 -0.11 0.00 -0.55 0.00 0.00 66.41 64.36 3dd0 h THR 35 Cb 1.09 1.68 -0.02 0.00 -1.73 0.00 0.00 68.15 69.18 3dd0 h THR 35 CO 0.90 0.28 -0.54 0.45 -0.25 0.00 0.00 175.52 176.37 3dd0 h HIS 36 N 0.00 0.00 0.00 4.73 3.86 -2.04 -3.30 115.15 118.40 3dd0 h HIS 36 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 3dd0 h HIS 36 Cb 0.65 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.12 3dd0 h HIS 36 CO 0.00 0.54 -0.99 0.25 0.86 0.00 0.00 177.93 178.58 3dd0 n THR 37 N -3.26 0.01 -1.73 2.45 -2.24 -1.08 -4.92 114.28 103.51 3dd0 n THR 37 Ca 0.02 -0.05 -0.42 0.00 -2.27 0.00 0.00 64.05 61.33 3dd0 n THR 37 Cb 0.74 0.77 -0.02 0.00 -2.10 0.00 0.00 70.33 69.72 3dd0 n THR 37 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3dd0 n ALA 38 N -1.57 2.33 -2.60 6.98 0.00 -0.86 -4.84 120.51 119.95 3dd0 n ALA 38 Ca 0.04 0.38 -0.40 0.00 0.00 0.00 0.00 53.44 53.46 3dd0 n ALA 38 Cb 0.35 -2.43 -0.08 0.00 0.00 0.00 0.00 19.45 17.28 3dd0 n ALA 38 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 3dd0 s LYS 39 N -0.50 3.98 0.20 0.00 2.47 -0.62 -4.85 119.74 120.43 3dd0 s LYS 39 Ca 0.65 0.11 -0.32 0.00 -1.56 0.00 0.00 55.97 54.85 3dd0 s LYS 39 Cb -0.52 -3.67 -0.11 0.00 -1.46 0.00 0.00 37.83 32.07 3dd0 s LYS 39 CO 0.49 -0.35 1.63 -0.47 0.16 0.00 0.00 175.35 176.81 3dd0 s TYR 40 N 2.19 2.97 -0.31 4.03 5.04 -1.26 -0.80 117.35 129.21 3dd0 s TYR 40 Ca 0.17 0.54 0.03 0.00 -2.44 0.00 0.00 57.07 55.37 3dd0 s TYR 40 Cb -0.16 -4.02 0.09 0.00 0.35 0.00 0.00 41.96 38.21 3dd0 s TYR 40 CO 0.10 -3.78 0.00 0.34 -1.34 0.00 0.00 175.55 170.87 3dd0 s ASP 41 N 1.07 4.55 0.00 4.32 -1.08 -0.59 -4.87 116.67 120.07 3dd0 s ASP 41 Ca 0.71 -1.83 0.20 0.00 -0.52 0.00 0.00 52.55 51.11 3dd0 s ASP 41 Cb -0.47 -1.51 1.09 0.00 -1.46 0.00 0.00 42.92 40.57 3dd0 s ASP 41 CO 0.33 -0.32 1.60 -2.65 0.52 0.00 0.00 175.17 174.66 3dd0 n PRO 42 N 4.38 0.44 0.13 4.34 -0.02 -1.26 -1.97 135.00 141.04 3dd0 n PRO 42 Ca -0.03 0.06 0.13 0.00 -2.02 0.00 0.00 63.50 61.64 3dd0 n PRO 42 Cb 0.42 -1.50 0.41 0.00 -0.02 0.00 0.00 33.50 32.81 3dd0 n PRO 42 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3dd0 h SER 43 N 0.00 0.00 -3.60 2.55 4.64 -1.96 -3.46 113.55 111.73 3dd0 h SER 43 Ca 0.00 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.81 3dd0 h SER 43 Cb 0.10 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.19 3dd0 h SER 43 CO 0.00 0.00 0.43 -0.76 -0.87 0.00 0.00 176.83 175.63 3dd0 s LEU 44 N -4.83 4.51 0.54 5.97 1.43 -0.83 -5.03 118.68 120.45 3dd0 s LEU 44 Ca 0.08 2.01 -0.03 0.00 -1.03 0.00 0.00 54.13 55.16 3dd0 s LEU 44 Cb 0.11 -3.60 0.01 0.00 0.03 0.00 0.00 46.19 42.73 3dd0 s LEU 44 CO 0.56 -0.14 0.81 -0.54 0.23 0.00 0.00 176.35 177.27 3dd0 s LYS 45 N -0.41 2.89 0.62 1.70 1.02 -1.24 -5.00 119.74 119.31 3dd0 s LYS 45 Ca 0.48 -0.28 -0.19 0.00 0.02 0.00 0.00 55.97 56.00 3dd0 s LYS 45 Cb -0.28 -2.39 -0.02 0.00 -0.52 0.00 0.00 37.83 34.62 3dd0 s LYS 45 CO 0.34 -0.57 1.27 -2.14 -0.92 0.00 0.00 175.35 173.32 3dd0 s PRO 46 N -4.82 2.74 0.53 -1.68 0.02 -1.26 -3.38 135.00 127.15 3dd0 s PRO 46 Ca 0.53 2.01 -0.22 0.00 0.02 0.00 0.00 61.00 63.34 3dd0 s PRO 46 Cb -0.10 -1.91 -0.05 0.00 0.02 0.00 0.00 34.50 32.45 3dd0 s PRO 46 CO 0.42 -1.43 1.27 -0.51 -0.33 0.00 0.00 177.00 176.41 3dd0 s LEU 47 N -4.19 3.87 -0.26 -5.54 1.43 -1.26 -1.30 118.68 111.43 3dd0 s LEU 47 Ca 0.80 2.54 0.02 0.00 -1.03 0.00 0.00 54.13 56.46 3dd0 s LEU 47 Cb -0.36 -4.33 0.06 0.00 0.03 0.00 0.00 46.19 41.60 3dd0 s LEU 47 CO 0.38 -1.37 -0.08 -0.55 0.23 0.00 0.00 176.35 174.97 3dd0 s SER 48 N -1.21 4.26 -0.31 2.29 0.15 0.34 -4.83 113.70 114.38 3dd0 s SER 48 Ca 0.70 -1.36 -0.08 0.00 0.70 0.00 0.00 55.95 55.91 3dd0 s SER 48 Cb -0.35 -1.42 0.01 0.00 -1.71 0.00 0.00 66.02 62.55 3dd0 s SER 48 CO 0.41 -0.22 0.11 -0.69 1.20 0.00 0.00 173.24 174.05 3dd0 s VAL 49 N 1.20 4.16 -0.44 4.45 1.01 -1.26 -1.10 120.40 128.42 3dd0 s VAL 49 Ca -0.07 -0.69 0.03 0.00 0.00 0.00 0.00 61.98 61.25 3dd0 s VAL 49 Cb -0.20 -3.18 0.12 0.00 0.00 0.00 0.00 36.38 33.12 3dd0 s VAL 49 CO -0.06 0.02 0.17 -0.44 0.00 0.00 0.00 175.10 174.79 3dd0 s SER 50 N 1.52 4.65 -0.01 3.32 0.01 0.10 -4.90 113.70 118.40 3dd0 s SER 50 Ca 0.03 -2.54 0.06 0.00 1.31 0.00 0.00 55.95 54.80 3dd0 s SER 50 Cb -0.18 -1.66 0.15 0.00 0.21 0.00 0.00 66.02 64.54 3dd0 s SER 50 CO 0.04 -0.33 1.12 -1.22 0.41 0.00 0.00 173.24 173.26 3dd0 n TYR 51 N 3.76 0.22 -0.06 2.43 4.01 -1.26 -1.17 117.16 125.09 3dd0 n TYR 51 Ca 0.04 -0.53 0.01 0.00 -0.16 0.00 0.00 57.90 57.27 3dd0 n TYR 51 Cb 0.38 -0.05 0.32 0.00 -0.31 0.00 0.00 39.34 39.68 3dd0 n TYR 51 CO 0.00 0.00 0.00 0.38 -0.46 0.00 0.00 176.86 176.78 3dd0 h ASP 52 N 0.91 0.60 -0.59 7.72 2.03 -1.91 -2.49 116.42 122.68 3dd0 h ASP 52 Ca 0.00 -0.05 0.00 0.00 -0.73 0.00 0.00 57.03 56.25 3dd0 h ASP 52 Cb 0.64 -0.15 0.00 0.00 -0.83 0.00 0.00 39.33 38.99 3dd0 h ASP 52 CO 0.01 0.51 0.00 0.00 -1.03 0.00 0.00 179.24 178.73 3dd0 n GLN 53 N -4.39 3.68 -1.70 4.15 1.13 -1.26 -5.00 117.38 113.99 3dd0 n GLN 53 Ca 0.04 -2.68 -0.40 0.00 -1.94 0.00 0.00 57.00 52.01 3dd0 n GLN 53 Cb 0.12 -1.90 0.02 0.00 0.11 0.00 0.00 30.24 28.59 3dd0 n GLN 53 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3dd0 n ALA 54 N 0.98 1.25 -3.92 -1.58 0.00 -0.94 -4.63 120.51 111.67 3dd0 n ALA 54 Ca 0.24 0.20 -0.31 0.00 0.00 0.00 0.00 53.44 53.58 3dd0 n ALA 54 Cb 0.88 -2.27 -0.15 0.00 0.00 0.00 0.00 19.45 17.90 3dd0 n ALA 54 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3dd0 s THR 55 N -1.25 1.75 0.47 0.00 2.01 -1.26 -4.94 115.64 112.41 3dd0 s THR 55 Ca 0.65 -1.95 -0.20 0.00 0.31 0.00 0.00 61.69 60.50 3dd0 s THR 55 Cb -0.48 -2.28 -0.09 0.00 0.01 0.00 0.00 72.50 69.66 3dd0 s THR 55 CO 0.55 -0.60 0.99 -0.94 -0.69 0.00 0.00 174.62 173.93 3dd0 s SER 56 N 1.18 6.62 -0.00 3.53 1.04 -1.26 -1.26 113.70 123.54 3dd0 s SER 56 Ca 0.09 1.77 -0.00 0.00 0.48 0.00 0.00 55.95 58.29 3dd0 s SER 56 Cb -0.18 -2.54 -0.00 0.00 0.10 0.00 0.00 66.02 63.39 3dd0 s SER 56 CO -0.14 -0.58 -0.01 0.18 0.98 0.00 0.00 173.24 173.67 3dd0 n LEU 57 N -0.94 1.12 -3.63 2.42 4.77 0.18 -4.13 117.00 116.78 3dd0 n LEU 57 Ca 0.08 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.94 3dd0 n LEU 57 Cb 0.53 -0.01 -0.05 0.00 -2.33 0.00 0.00 43.42 41.56 3dd0 n LEU 57 CO 0.40 0.19 0.18 -0.60 -1.33 0.00 0.00 177.39 176.23 3dd0 s ARG 58 N -2.01 1.00 -0.06 3.23 3.52 -1.22 -1.74 118.95 121.67 3dd0 s ARG 58 Ca -0.01 -0.46 0.05 0.00 -0.13 0.00 0.00 55.73 55.18 3dd0 s ARG 58 Cb 0.00 0.44 -0.00 0.00 -1.56 0.00 0.00 34.95 33.83 3dd0 s ARG 58 CO 0.01 -0.37 -0.21 -1.50 -0.81 0.00 0.00 175.30 172.43 3dd0 s ILE 59 N -2.96 1.73 -0.03 4.11 2.07 -0.50 -0.98 121.20 124.65 3dd0 s ILE 59 Ca -0.02 -0.87 0.02 0.00 -1.41 0.00 0.00 60.65 58.36 3dd0 s ILE 59 Cb 0.00 -1.49 0.01 0.00 0.13 0.00 0.00 42.46 41.11 3dd0 s ILE 59 CO -0.06 0.49 -0.07 -0.22 -1.91 0.00 0.00 174.94 173.17 3dd0 s LEU 60 N 0.09 1.65 -0.47 8.50 2.96 -0.44 -1.10 118.68 129.87 3dd0 s LEU 60 Ca -0.08 -0.15 -0.23 0.00 -0.22 0.00 0.00 54.13 53.46 3dd0 s LEU 60 Cb -0.14 -0.47 0.03 0.00 0.50 0.00 0.00 46.19 46.11 3dd0 s LEU 60 CO 0.04 0.02 0.77 0.21 -1.32 0.00 0.00 176.35 176.07 3dd0 s ASN 61 N 0.42 6.37 -0.04 3.68 3.84 -0.49 -1.00 114.94 127.72 3dd0 s ASN 61 Ca -0.06 -0.25 0.19 0.00 0.21 0.00 0.00 52.86 52.95 3dd0 s ASN 61 Cb -0.10 -2.37 0.62 0.00 -0.55 0.00 0.00 41.25 38.85 3dd0 s ASN 61 CO 0.00 -0.93 1.52 -0.46 -2.79 0.00 0.00 177.10 174.44 3dd0 n ASN 62 N 6.70 3.91 0.00 -4.21 0.23 -0.98 -0.53 115.26 120.38 3dd0 n ASN 62 Ca 0.01 -2.16 0.00 0.00 -0.53 0.00 0.00 54.58 51.90 3dd0 n ASN 62 Cb 0.48 -0.49 0.00 0.00 -2.08 0.00 0.00 39.78 37.69 3dd0 n ASN 62 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3dd0 n GLY 63 N 1.38 1.55 0.00 4.83 0.00 -1.26 -4.80 105.19 106.89 3dd0 n GLY 63 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.25 3dd0 n GLY 63 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 3dd0 n HIS 64 N -2.00 0.00 -3.36 1.61 1.44 -1.26 -4.72 115.22 106.93 3dd0 n HIS 64 Ca 0.00 0.00 -0.01 0.00 -2.01 0.00 0.00 57.72 55.70 3dd0 n HIS 64 Cb 0.00 0.00 0.01 0.00 0.12 0.00 0.00 29.99 30.12 3dd0 n HIS 64 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3dd0 n ALA 65 N -0.76 -0.51 -2.47 1.59 0.00 -1.26 -4.88 120.51 112.21 3dd0 n ALA 65 Ca 0.00 -0.26 -0.32 0.00 0.00 0.00 0.00 53.44 52.86 3dd0 n ALA 65 Cb 0.00 0.18 -0.15 0.00 0.00 0.00 0.00 19.45 19.48 3dd0 n ALA 65 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 3dd0 s PHE 66 N -6.25 2.49 -0.13 0.00 -0.12 -1.26 -2.33 117.98 110.38 3dd0 s PHE 66 Ca 0.04 -0.41 -0.02 0.00 -0.05 0.00 0.00 56.93 56.50 3dd0 s PHE 66 Cb -0.01 -1.57 -0.03 0.00 -0.63 0.00 0.00 43.02 40.78 3dd0 s PHE 66 CO 0.02 -0.01 -0.06 -0.80 -0.05 0.00 0.00 175.22 174.32 3dd0 s ASN 67 N -0.53 4.64 -0.26 1.98 0.01 -0.17 -4.23 114.94 116.38 3dd0 s ASN 67 Ca 0.07 -0.13 -0.16 0.00 -0.71 0.00 0.00 52.86 51.93 3dd0 s ASN 67 Cb -0.11 -1.60 -0.03 0.00 0.41 0.00 0.00 41.25 39.91 3dd0 s ASN 67 CO 0.01 0.22 0.43 -0.69 -1.51 0.00 0.00 177.10 175.56 3dd0 s VAL 68 N 0.06 5.14 -0.02 1.60 1.01 -0.04 -1.33 120.40 126.81 3dd0 s VAL 68 Ca -0.01 0.71 -0.01 0.00 0.00 0.00 0.00 61.98 62.66 3dd0 s VAL 68 Cb -0.14 -3.75 -0.04 0.00 0.00 0.00 0.00 36.38 32.45 3dd0 s VAL 68 CO 0.03 0.14 0.10 -1.61 0.00 0.00 0.00 175.10 173.76 3dd0 s GLU 69 N 2.06 3.15 0.19 2.72 2.02 -0.15 -1.32 118.70 127.36 3dd0 s GLU 69 Ca 0.18 -0.42 0.11 0.00 0.02 0.00 0.00 54.97 54.86 3dd0 s GLU 69 Cb -0.16 -2.92 -0.04 0.00 0.10 0.00 0.00 34.13 31.11 3dd0 s GLU 69 CO 0.09 0.67 -0.23 -0.06 0.02 0.00 0.00 175.26 175.75 3dd0 s PHE 70 N -1.17 2.22 -0.26 1.61 0.40 -0.33 -0.65 117.98 119.79 3dd0 s PHE 70 Ca 0.22 -0.38 -0.29 0.00 -0.60 0.00 0.00 56.93 55.88 3dd0 s PHE 70 Cb -0.12 -1.10 -0.01 0.00 0.51 0.00 0.00 43.02 42.30 3dd0 s PHE 70 CO 0.13 0.47 1.47 0.34 0.70 0.00 0.00 175.22 178.33 3dd0 s ASP 71 N -2.68 6.51 -0.28 1.36 2.15 -0.39 -4.83 116.67 118.51 3dd0 s ASP 71 Ca 0.20 1.42 0.09 0.00 0.43 0.00 0.00 52.55 54.69 3dd0 s ASP 71 Cb -0.08 -2.54 0.49 0.00 -0.30 0.00 0.00 42.92 40.50 3dd0 s ASP 71 CO 0.09 -1.18 1.42 -0.90 -0.17 0.00 0.00 175.17 174.43 3dd0 n ASP 72 N 8.10 2.36 -0.29 -0.34 5.75 -1.26 -4.65 116.55 126.20 3dd0 n ASP 72 Ca 0.17 -3.82 0.15 0.00 -0.01 0.00 0.00 54.79 51.27 3dd0 n ASP 72 Cb 0.46 -0.62 0.69 0.00 -1.03 0.00 0.00 41.12 40.62 3dd0 n ASP 72 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 3dd0 n SER 73 N -1.12 0.92 -3.75 -1.12 3.41 -1.26 -4.88 113.62 105.81 3dd0 n SER 73 Ca 0.31 -1.31 -0.09 0.00 -0.26 0.00 0.00 58.87 57.52 3dd0 n SER 73 Cb 0.98 -0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.89 3dd0 n SER 73 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 3dd0 s GLN 74 N -2.00 1.40 -1.16 4.33 -0.21 -1.26 -5.07 119.66 115.69 3dd0 s GLN 74 Ca 0.42 -0.89 -0.20 0.00 0.02 0.00 0.00 55.36 54.71 3dd0 s GLN 74 Cb 0.21 0.52 -0.04 0.00 1.00 0.00 0.00 33.01 34.70 3dd0 s GLN 74 CO 0.35 -0.59 1.93 -0.25 -2.12 0.00 0.00 175.29 174.61 3dd0 n ASP 75 N -0.35 3.58 -0.08 5.90 8.00 -1.26 -4.63 116.55 127.72 3dd0 n ASP 75 Ca -0.09 -2.78 -0.07 0.00 0.71 0.00 0.00 54.79 52.56 3dd0 n ASP 75 Cb 0.62 -1.57 -0.03 0.00 -0.02 0.00 0.00 41.12 40.12 3dd0 n ASP 75 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3dd0 n LYS 76 N 7.59 0.47 -3.98 -1.24 5.02 -1.26 -4.89 118.16 119.87 3dd0 n LYS 76 Ca 0.48 0.50 -0.31 0.00 -2.02 0.00 0.00 58.31 56.97 3dd0 n LYS 76 Cb 0.43 -1.67 -0.15 0.00 -0.02 0.00 0.00 35.03 33.62 3dd0 n LYS 76 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3dd0 s ALA 77 N -2.71 2.40 0.07 7.82 0.00 -1.26 -4.02 121.76 124.07 3dd0 s ALA 77 Ca -0.18 -1.91 0.03 0.00 0.00 0.00 0.00 51.96 49.90 3dd0 s ALA 77 Cb 0.03 -1.68 -0.03 0.00 0.00 0.00 0.00 23.12 21.43 3dd0 s ALA 77 CO 0.28 -1.42 -0.09 0.14 0.00 0.00 0.00 175.76 174.67 3dd0 s VAL 78 N 1.17 0.74 -0.11 0.00 -7.23 -0.32 -0.86 120.40 113.79 3dd0 s VAL 78 Ca 0.01 -1.46 0.03 0.00 -1.81 0.00 0.00 61.98 58.74 3dd0 s VAL 78 Cb -0.19 -1.11 -0.01 0.00 0.56 0.00 0.00 36.38 35.63 3dd0 s VAL 78 CO -0.09 -0.54 -0.20 -0.22 -0.31 0.00 0.00 175.10 173.75 3dd0 s LEU 79 N -2.19 2.34 0.25 1.32 2.96 0.17 -0.72 118.68 122.81 3dd0 s LEU 79 Ca 0.00 -0.46 -0.01 0.00 -0.22 0.00 0.00 54.13 53.44 3dd0 s LEU 79 Cb -0.04 -1.49 -0.03 0.00 0.50 0.00 0.00 46.19 45.13 3dd0 s LEU 79 CO -0.01 0.17 0.23 -0.54 -1.32 0.00 0.00 176.35 174.89 3dd0 s LYS 80 N 0.29 1.43 2.57 1.98 1.02 -0.26 -1.78 119.74 124.99 3dd0 s LYS 80 Ca -0.14 -1.68 0.00 0.00 0.02 0.00 0.00 55.97 54.17 3dd0 s LYS 80 Cb -0.17 0.32 0.00 0.00 -0.52 0.00 0.00 37.83 37.46 3dd0 s LYS 80 CO 0.07 -0.51 0.00 0.41 -0.92 0.00 0.00 175.35 174.40 3dd0 n GLY 81 N -0.39 -0.87 7.00 -3.33 0.00 -1.26 -0.50 105.19 105.84 3dd0 n GLY 81 Ca 0.03 -1.20 0.00 0.00 0.00 0.00 0.00 46.02 44.84 3dd0 n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dd0 n GLY 82 N 0.00 2.84 0.54 -0.02 0.00 -0.42 -0.95 105.19 107.18 3dd0 n GLY 82 Ca 0.00 -0.10 0.09 0.00 0.00 0.00 0.00 46.02 46.01 3dd0 n GLY 82 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3dd0 n PRO 83 N 14.00 1.70 -3.30 1.61 -0.04 -1.26 -3.60 135.00 144.11 3dd0 n PRO 83 Ca 0.00 -1.06 -0.33 0.00 -0.04 0.00 0.00 63.50 62.07 3dd0 n PRO 83 Cb 0.00 -1.35 -0.06 0.00 -0.04 0.00 0.00 33.50 32.06 3dd0 n PRO 83 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3dd0 s LEU 84 N -1.39 4.16 -0.18 1.53 1.43 -0.12 -5.07 118.68 119.03 3dd0 s LEU 84 Ca 0.29 1.09 -0.02 0.00 -1.03 0.00 0.00 54.13 54.46 3dd0 s LEU 84 Cb 0.15 -3.76 -0.00 0.00 0.03 0.00 0.00 46.19 42.60 3dd0 s LEU 84 CO 0.22 -0.09 -0.10 -1.81 0.23 0.00 0.00 176.35 174.80 3dd0 s ASP 85 N -2.22 3.96 0.00 2.29 1.01 -1.26 -4.36 116.67 116.09 3dd0 s ASP 85 Ca 0.48 -0.43 0.00 0.00 0.71 0.00 0.00 52.55 53.32 3dd0 s ASP 85 Cb -0.12 -1.64 0.00 0.00 1.01 0.00 0.00 42.92 42.17 3dd0 s ASP 85 CO 0.20 0.04 0.00 0.61 0.21 0.00 0.00 175.17 176.23 3dd0 n GLY 86 N 4.36 -2.56 3.56 0.21 0.00 -1.26 -4.97 105.19 104.52 3dd0 n GLY 86 Ca -0.19 -1.88 -0.35 0.00 0.00 0.00 0.00 46.02 43.60 3dd0 n GLY 86 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dd0 s THR 87 N -0.40 4.62 -0.13 2.61 2.01 -1.26 -4.54 115.64 118.55 3dd0 s THR 87 Ca 0.00 -0.08 0.02 0.00 0.31 0.00 0.00 61.69 61.93 3dd0 s THR 87 Cb 0.00 -3.12 0.00 0.00 0.01 0.00 0.00 72.50 69.39 3dd0 s THR 87 CO 0.00 0.40 -0.19 -0.31 -0.69 0.00 0.00 174.62 173.83 3dd0 s TYR 88 N 0.94 2.70 -0.07 4.92 1.51 -0.73 -1.50 117.35 125.12 3dd0 s TYR 88 Ca 0.04 -1.07 -0.17 0.00 -1.01 0.00 0.00 57.07 54.85 3dd0 s TYR 88 Cb -0.14 -1.82 -0.05 0.00 -0.11 0.00 0.00 41.96 39.84 3dd0 s TYR 88 CO 0.03 -0.46 0.46 1.03 -1.11 0.00 0.00 175.55 175.49 3dd0 s ARG 89 N 0.64 4.21 0.16 -0.62 0.52 0.31 -0.66 118.95 123.51 3dd0 s ARG 89 Ca -0.10 0.46 -0.31 0.00 -0.52 0.00 0.00 55.73 55.26 3dd0 s ARG 89 Cb -0.16 -3.36 -0.09 0.00 0.52 0.00 0.00 34.95 31.86 3dd0 s ARG 89 CO 0.02 0.36 1.47 -1.17 0.02 0.00 0.00 175.30 176.00 3dd0 s LEU 90 N -0.03 4.37 -0.08 2.53 2.96 -0.04 -1.19 118.68 127.20 3dd0 s LEU 90 Ca 0.25 2.51 0.01 0.00 -0.22 0.00 0.00 54.13 56.68 3dd0 s LEU 90 Cb -0.16 -3.60 -0.06 0.00 0.50 0.00 0.00 46.19 42.88 3dd0 s LEU 90 CO 0.12 -0.73 -0.06 0.00 -1.32 0.00 0.00 176.35 174.35 3dd0 n ILE 91 N 3.65 0.47 -3.44 6.68 3.06 -0.39 -4.51 119.36 124.88 3dd0 n ILE 91 Ca 0.12 -0.19 -0.11 0.00 -2.50 0.00 0.00 62.75 60.06 3dd0 n ILE 91 Cb 0.40 -0.80 -0.02 0.00 0.54 0.00 0.00 39.64 39.77 3dd0 n ILE 91 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 3dd0 s GLN 92 N -2.17 1.17 0.19 9.51 1.03 -1.22 -1.19 119.66 126.99 3dd0 s GLN 92 Ca -0.10 -0.43 0.06 0.00 0.04 0.00 0.00 55.36 54.93 3dd0 s GLN 92 Cb 0.03 0.54 -0.05 0.00 0.03 0.00 0.00 33.01 33.56 3dd0 s GLN 92 CO 0.20 -0.51 -0.12 -0.59 -2.54 0.00 0.00 175.29 171.73 3dd0 s PHE 93 N -3.60 1.58 0.28 9.60 -0.12 -0.44 -1.09 117.98 124.19 3dd0 s PHE 93 Ca 0.02 -0.65 -0.18 0.00 -0.05 0.00 0.00 56.93 56.07 3dd0 s PHE 93 Cb -0.01 -0.77 0.01 0.00 -0.63 0.00 0.00 43.02 41.62 3dd0 s PHE 93 CO -0.12 0.25 0.64 -3.38 -0.05 0.00 0.00 175.22 172.56 3dd0 s HIS 94 N -3.11 0.04 0.26 3.49 -3.43 -0.83 -0.86 115.29 110.85 3dd0 s HIS 94 Ca 0.21 -0.48 0.09 0.00 -0.80 0.00 0.00 55.06 54.09 3dd0 s HIS 94 Cb 0.01 0.53 -0.05 0.00 -1.43 0.00 0.00 32.58 31.64 3dd0 s HIS 94 CO 0.05 -1.18 -0.13 -0.06 -2.00 0.00 0.00 174.74 171.42 3dd0 s PHE 95 N -3.82 2.01 -0.03 0.38 0.40 -1.26 -0.79 117.98 114.87 3dd0 s PHE 95 Ca 0.15 -0.53 0.06 0.00 -0.60 0.00 0.00 56.93 56.02 3dd0 s PHE 95 Cb -0.04 -0.99 -0.01 0.00 0.51 0.00 0.00 43.02 42.48 3dd0 s PHE 95 CO 0.08 0.46 -0.22 -1.01 0.70 0.00 0.00 175.22 175.24 3dd0 s HIS 96 N -2.82 2.03 0.25 0.36 3.76 -0.10 -4.75 115.29 114.03 3dd0 s HIS 96 Ca 0.27 -0.46 -0.10 0.00 -0.15 0.00 0.00 55.06 54.62 3dd0 s HIS 96 Cb -0.00 -1.32 -0.01 0.00 1.11 0.00 0.00 32.58 32.36 3dd0 s HIS 96 CO 0.11 -0.09 0.43 1.67 -0.85 0.00 0.00 174.74 176.02 3dd0 s TRP 97 N -0.36 0.53 0.41 1.40 -2.14 -1.22 -0.97 118.94 116.60 3dd0 s TRP 97 Ca 0.04 -0.87 0.08 0.00 2.66 0.00 0.00 56.10 58.01 3dd0 s TRP 97 Cb -0.10 0.07 -0.02 0.00 -3.10 0.00 0.00 33.47 30.32 3dd0 s TRP 97 CO 0.01 -0.97 0.39 0.20 -2.66 0.00 0.00 176.95 173.92 3dd0 s GLY 98 N -3.06 2.08 0.32 3.67 0.00 -1.19 -0.71 107.32 108.43 3dd0 s GLY 98 Ca 0.25 -1.84 0.24 0.00 0.00 0.00 0.00 44.72 43.38 3dd0 s GLY 98 CO 0.11 -1.66 1.63 1.48 0.00 0.00 0.00 173.10 174.65 3dd0 h SER 99 N 1.00 0.00 -5.09 1.64 4.64 -1.89 -3.40 113.55 110.45 3dd0 h SER 99 Ca -0.42 -0.01 -0.15 0.00 -0.47 0.00 0.00 61.79 60.74 3dd0 h SER 99 Cb 1.27 0.00 -0.18 0.00 -0.31 0.00 0.00 62.40 63.18 3dd0 h SER 99 CO 0.56 0.01 -0.69 -0.76 -0.87 0.00 0.00 176.83 175.07 3dd0 s LEU 100 N -5.41 2.37 0.50 5.97 1.43 -1.26 -5.06 118.68 117.22 3dd0 s LEU 100 Ca 0.08 -0.77 0.33 0.00 -1.03 0.00 0.00 54.13 52.74 3dd0 s LEU 100 Cb 0.09 0.14 1.45 0.00 0.03 0.00 0.00 46.19 47.90 3dd0 s LEU 100 CO 0.65 -0.45 1.98 0.44 0.23 0.00 0.00 176.35 179.20 3dd0 h ASP 101 N 3.85 0.00 -0.31 2.29 3.32 -1.93 -2.73 116.42 120.91 3dd0 h ASP 101 Ca -0.33 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.72 3dd0 h ASP 101 Cb 1.17 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.72 3dd0 h ASP 101 CO 0.54 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 178.67 3dd0 n GLY 102 N -0.20 0.51 3.34 2.75 0.00 -1.26 -3.67 105.19 106.65 3dd0 n GLY 102 Ca 0.00 -0.37 -0.09 0.00 0.00 0.00 0.00 46.02 45.56 3dd0 n GLY 102 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3dd0 s GLN 103 N -1.59 1.13 0.00 1.61 -2.07 -1.03 -4.66 119.66 113.05 3dd0 s GLN 103 Ca 0.24 -1.10 0.00 0.00 -1.82 0.00 0.00 55.36 52.67 3dd0 s GLN 103 Cb 0.12 0.39 0.00 0.00 -1.09 0.00 0.00 33.01 32.43 3dd0 s GLN 103 CO 0.17 -0.42 0.00 0.41 -1.32 0.00 0.00 175.29 174.13 3dd0 n GLY 104 N -0.20 1.34 3.83 2.60 0.00 -1.01 -3.39 105.19 108.36 3dd0 n GLY 104 Ca -0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.62 3dd0 n GLY 104 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3dd0 s SER 105 N 0.00 5.31 -0.16 1.61 1.04 -0.41 -3.39 113.70 117.70 3dd0 s SER 105 Ca 0.00 1.48 -0.13 0.00 0.48 0.00 0.00 55.95 57.78 3dd0 s SER 105 Cb 0.00 -2.34 -0.05 0.00 0.10 0.00 0.00 66.02 63.72 3dd0 s SER 105 CO 0.00 -1.47 -0.23 -0.62 0.98 0.00 0.00 173.24 171.90 3dd0 n GLU 106 N -3.13 0.49 -1.70 4.02 1.02 -1.26 -4.85 120.64 115.22 3dd0 n GLU 106 Ca 0.07 0.40 -0.33 0.00 -0.02 0.00 0.00 57.16 57.28 3dd0 n GLU 106 Cb 0.54 -1.59 0.05 0.00 -0.02 0.00 0.00 31.44 30.43 3dd0 n GLU 106 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 3dd0 s HIS 107 N -2.51 2.54 0.17 -0.32 3.76 -1.26 -4.40 115.29 113.28 3dd0 s HIS 107 Ca -0.22 1.56 0.06 0.00 -0.15 0.00 0.00 55.06 56.31 3dd0 s HIS 107 Cb 0.03 -3.20 -0.04 0.00 1.11 0.00 0.00 32.58 30.48 3dd0 s HIS 107 CO 0.33 -1.81 -0.12 0.95 -0.85 0.00 0.00 174.74 173.24 3dd0 s THR 108 N -2.31 1.45 -0.23 1.30 -4.23 -1.19 -4.71 115.64 105.73 3dd0 s THR 108 Ca 0.68 -2.10 0.01 0.00 -1.18 0.00 0.00 61.69 59.10 3dd0 s THR 108 Cb -0.21 -1.91 0.05 0.00 1.34 0.00 0.00 72.50 71.77 3dd0 s THR 108 CO 0.42 -0.65 -0.09 -0.69 -0.54 0.00 0.00 174.62 173.07 3dd0 s VAL 109 N -3.06 1.78 -1.53 2.29 1.01 -0.80 -0.45 120.40 119.64 3dd0 s VAL 109 Ca 0.19 -1.27 -0.08 0.00 0.00 0.00 0.00 61.98 60.81 3dd0 s VAL 109 Cb 0.00 -1.92 0.07 0.00 0.00 0.00 0.00 36.38 34.53 3dd0 s VAL 109 CO 0.04 0.03 0.60 0.47 0.00 0.00 0.00 175.10 176.24 3dd0 n ASP 110 N 4.60 -1.84 0.00 3.32 8.00 0.38 -0.79 116.55 130.22 3dd0 n ASP 110 Ca -0.14 -0.99 0.00 0.00 0.71 0.00 0.00 54.79 54.37 3dd0 n ASP 110 Cb 0.44 -3.00 0.00 0.00 -0.02 0.00 0.00 41.12 38.55 3dd0 n ASP 110 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3dd0 n LYS 111 N -4.42 -0.14 -2.31 -1.24 4.76 -1.26 -4.99 118.16 108.55 3dd0 n LYS 111 Ca -0.13 0.04 -0.42 0.00 -2.87 0.00 0.00 58.31 54.92 3dd0 n LYS 111 Cb 0.60 -3.52 -0.03 0.00 -1.84 0.00 0.00 35.03 30.24 3dd0 n LYS 111 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 3dd0 s LYS 112 N -0.54 4.39 -0.02 1.97 2.20 0.03 -5.01 119.74 122.75 3dd0 s LYS 112 Ca 0.00 1.91 -0.03 0.00 -0.36 0.00 0.00 55.97 57.49 3dd0 s LYS 112 Cb 0.00 -3.29 -0.04 0.00 -1.51 0.00 0.00 37.83 32.99 3dd0 s LYS 112 CO 0.00 -0.31 0.17 0.15 -0.36 0.00 0.00 175.35 175.00 3dd0 s LYS 113 N 0.90 3.40 0.42 4.03 1.02 -1.26 -1.90 119.74 126.35 3dd0 s LYS 113 Ca 0.60 -0.31 0.08 0.00 0.02 0.00 0.00 55.97 56.36 3dd0 s LYS 113 Cb -0.33 -3.08 -0.03 0.00 -0.52 0.00 0.00 37.83 33.87 3dd0 s LYS 113 CO 0.31 0.69 0.35 0.71 -0.92 0.00 0.00 175.35 176.48 3dd0 s TYR 114 N -1.27 2.69 0.21 3.18 2.02 -1.26 -4.74 117.35 118.18 3dd0 s TYR 114 Ca 0.25 -0.51 0.18 0.00 -0.37 0.00 0.00 57.07 56.62 3dd0 s TYR 114 Cb -0.12 -2.14 0.71 0.00 -0.40 0.00 0.00 41.96 40.00 3dd0 s TYR 114 CO 0.16 -0.07 1.75 0.00 -1.57 0.00 0.00 175.55 175.82 3dd0 h ALA 115 N 1.09 1.05 -2.47 3.71 0.00 -1.44 -0.99 119.26 120.21 3dd0 h ALA 115 Ca -0.42 -0.34 0.14 0.00 0.00 0.00 0.00 54.91 54.30 3dd0 h ALA 115 Cb 1.26 -0.06 -0.09 0.00 0.00 0.00 0.00 17.79 18.91 3dd0 h ALA 115 CO 0.59 0.47 0.43 0.00 0.00 0.00 0.00 179.25 180.75 3dd0 s ALA 116 N -3.70 -1.60 -0.04 0.00 0.00 -1.17 -3.17 121.76 112.08 3dd0 s ALA 116 Ca -0.00 0.17 -0.01 0.00 0.00 0.00 0.00 51.96 52.12 3dd0 s ALA 116 Cb 0.12 0.66 0.03 0.00 0.00 0.00 0.00 23.12 23.93 3dd0 s ALA 116 CO 0.69 -0.99 0.07 -2.00 0.00 0.00 0.00 175.76 173.53 3dd0 s GLU 117 N -3.39 -0.00 -0.14 0.00 2.12 -0.14 -1.28 118.70 115.87 3dd0 s GLU 117 Ca 0.11 0.27 -0.17 0.00 0.36 0.00 0.00 54.97 55.54 3dd0 s GLU 117 Cb -0.02 -0.25 -0.04 0.00 0.26 0.00 0.00 34.13 34.08 3dd0 s GLU 117 CO 0.01 -0.18 0.41 -1.17 -0.54 0.00 0.00 175.26 173.79 3dd0 s LEU 118 N 1.22 4.26 -0.21 2.70 2.96 0.15 -0.93 118.68 128.82 3dd0 s LEU 118 Ca -0.08 0.69 -0.01 0.00 -0.22 0.00 0.00 54.13 54.52 3dd0 s LEU 118 Cb -0.13 -2.58 0.02 0.00 0.50 0.00 0.00 46.19 44.00 3dd0 s LEU 118 CO -0.04 0.02 -0.12 -1.00 -1.32 0.00 0.00 176.35 173.89 3dd0 s HIS 119 N 0.63 2.93 -0.37 5.38 3.76 0.03 -1.26 115.29 126.39 3dd0 s HIS 119 Ca 0.22 -1.53 -0.12 0.00 -0.15 0.00 0.00 55.06 53.48 3dd0 s HIS 119 Cb -0.14 -2.00 0.01 0.00 1.11 0.00 0.00 32.58 31.56 3dd0 s HIS 119 CO 0.08 -0.74 0.24 -0.51 -0.85 0.00 0.00 174.74 172.96 3dd0 s LEU 120 N 1.32 4.74 -0.19 0.89 1.43 -0.21 -1.96 118.68 124.71 3dd0 s LEU 120 Ca 0.03 -0.81 -0.11 0.00 -1.03 0.00 0.00 54.13 52.20 3dd0 s LEU 120 Cb -0.15 -2.08 -0.05 0.00 0.03 0.00 0.00 46.19 43.94 3dd0 s LEU 120 CO -0.08 -0.36 0.19 -0.69 0.23 0.00 0.00 176.35 175.64 3dd0 s VAL 121 N 1.63 5.36 0.06 -1.59 1.01 -0.25 -1.38 120.40 125.24 3dd0 s VAL 121 Ca 0.04 0.32 0.05 0.00 0.00 0.00 0.00 61.98 62.39 3dd0 s VAL 121 Cb -0.19 -3.53 -0.03 0.00 0.00 0.00 0.00 36.38 32.63 3dd0 s VAL 121 CO 0.08 0.41 -0.14 -1.00 0.00 0.00 0.00 175.10 174.45 3dd0 s HIS 122 N 0.51 1.17 0.08 5.22 3.76 -0.39 -1.26 115.29 124.37 3dd0 s HIS 122 Ca 0.11 -0.44 0.07 0.00 -0.15 0.00 0.00 55.06 54.65 3dd0 s HIS 122 Cb -0.12 -0.66 -0.03 0.00 1.11 0.00 0.00 32.58 32.87 3dd0 s HIS 122 CO 0.01 0.04 -0.18 1.67 -0.85 0.00 0.00 174.74 175.43 3dd0 s TRP 123 N -1.20 1.54 -0.22 1.40 1.48 -0.34 -1.09 118.94 120.51 3dd0 s TRP 123 Ca -0.02 -0.42 -0.29 0.00 -1.06 0.00 0.00 56.10 54.31 3dd0 s TRP 123 Cb -0.10 -0.87 -0.00 0.00 -1.16 0.00 0.00 33.47 31.34 3dd0 s TRP 123 CO 0.02 0.12 1.24 1.21 -4.06 0.00 0.00 176.95 175.49 3dd0 s ASN 124 N -1.68 6.87 0.45 -2.66 3.84 0.46 -0.53 114.94 121.68 3dd0 s ASN 124 Ca 0.03 1.47 0.31 0.00 0.21 0.00 0.00 52.86 54.87 3dd0 s ASN 124 Cb -0.10 -2.54 1.45 0.00 -0.55 0.00 0.00 41.25 39.51 3dd0 s ASN 124 CO 0.03 -0.87 1.92 0.71 -2.79 0.00 0.00 177.10 176.11 3dd0 h THR 125 N 5.66 0.00 -0.14 -5.21 1.35 -1.61 -1.81 112.91 111.15 3dd0 h THR 125 Ca -0.25 -0.22 0.04 0.00 -0.55 0.00 0.00 66.41 65.43 3dd0 h THR 125 Cb 1.09 1.04 -0.01 0.00 -1.73 0.00 0.00 68.15 68.55 3dd0 h THR 125 CO 1.00 0.00 0.18 0.07 -0.25 0.00 0.00 175.52 176.52 3dd0 h LYS 127 N 0.00 0.00 -0.02 4.72 2.10 -1.91 -2.27 116.57 119.19 3dd0 h LYS 127 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3dd0 h LYS 127 Cb 0.26 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.59 3dd0 h LYS 127 CO 0.00 0.00 -0.09 0.66 -2.00 0.00 0.00 179.45 178.02 3dd0 n TYR 128 N -3.64 0.00 0.00 0.07 4.01 -0.68 -4.97 117.16 111.94 3dd0 n TYR 128 Ca 0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.75 3dd0 n TYR 128 Cb 0.29 -0.02 0.00 0.00 -0.31 0.00 0.00 39.34 39.30 3dd0 n TYR 128 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3dd0 n GLY 129 N 1.28 1.31 3.31 2.72 0.00 -0.86 -4.58 105.19 108.37 3dd0 n GLY 129 Ca 0.15 -0.01 -0.09 0.00 0.00 0.00 0.00 46.02 46.08 3dd0 n GLY 129 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3dd0 s ASP 130 N 0.00 0.03 0.15 1.61 1.47 -1.26 -5.06 116.67 113.60 3dd0 s ASP 130 Ca 0.00 -0.75 -0.14 0.00 1.18 0.00 0.00 52.55 52.84 3dd0 s ASP 130 Cb 0.00 0.42 0.02 0.00 -0.34 0.00 0.00 42.92 43.02 3dd0 s ASP 130 CO 0.00 -0.86 1.68 0.15 0.68 0.00 0.00 175.17 176.83 3dd0 h PHE 131 N 2.57 0.74 -0.51 2.11 3.57 -1.95 -1.96 116.94 121.51 3dd0 h PHE 131 Ca -0.32 -0.07 0.06 0.00 3.53 0.00 0.00 57.97 61.17 3dd0 h PHE 131 Cb 1.22 -0.22 -0.03 0.00 2.79 0.00 0.00 35.95 39.72 3dd0 h PHE 131 CO 0.40 0.65 0.34 0.78 -2.23 0.00 0.00 178.31 178.25 3dd0 h GLY 132 N 0.62 0.56 0.94 2.40 0.00 -1.97 -1.96 103.07 103.67 3dd0 h GLY 132 Ca 0.15 -0.18 -0.17 0.00 0.00 0.00 0.00 47.33 47.13 3dd0 h GLY 132 CO -0.01 0.14 -0.62 0.50 0.00 0.00 0.00 176.54 176.55 3dd0 h LYS 133 N 0.45 0.56 -0.46 4.80 1.79 -1.76 -3.32 116.57 118.63 3dd0 h LYS 133 Ca 0.22 -0.50 0.03 0.00 -2.18 0.00 0.00 60.65 58.23 3dd0 h LYS 133 Cb 0.30 0.11 -0.02 0.00 -1.58 0.00 0.00 32.23 31.04 3dd0 h LYS 133 CO -0.06 1.12 0.30 0.00 -1.08 0.00 0.00 179.45 179.74 3dd0 h ALA 134 N 0.45 1.80 0.00 3.86 0.00 -0.66 -1.78 119.26 122.93 3dd0 h ALA 134 Ca -0.05 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3dd0 h ALA 134 Cb 1.27 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.92 3dd0 h ALA 134 CO 0.13 0.15 0.00 1.33 0.00 0.00 0.00 179.25 180.86 3dd0 n VAL 135 N -4.48 0.70 0.74 0.00 0.24 -0.80 -2.11 118.33 112.63 3dd0 n VAL 135 Ca 0.05 0.18 0.09 0.00 -2.04 0.00 0.00 64.34 62.61 3dd0 n VAL 135 Cb 0.15 -0.87 0.25 0.00 -1.47 0.00 0.00 33.84 31.90 3dd0 n VAL 135 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3dd0 n GLN 136 N -1.46 2.00 -4.69 7.34 1.13 -0.67 -4.66 117.38 116.37 3dd0 n GLN 136 Ca 0.05 -1.53 -0.28 0.00 -1.94 0.00 0.00 57.00 53.31 3dd0 n GLN 136 Cb 0.20 -1.38 -0.14 0.00 0.11 0.00 0.00 30.24 29.03 3dd0 n GLN 136 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 3dd0 s GLN 137 N -1.53 1.53 0.55 -1.09 -1.52 -0.90 -5.03 119.66 111.67 3dd0 s GLN 137 Ca 0.32 -1.07 0.34 0.00 -1.95 0.00 0.00 55.36 53.00 3dd0 s GLN 137 Cb 0.17 -1.72 1.46 0.00 -0.22 0.00 0.00 33.01 32.70 3dd0 s GLN 137 CO 0.23 0.44 2.01 -1.00 -0.25 0.00 0.00 175.29 176.72 3dd0 h PRO 138 N 4.67 0.00 -0.12 2.91 0.13 -1.86 -2.34 132.00 135.38 3dd0 h PRO 138 Ca -0.45 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.61 3dd0 h PRO 138 Cb 1.16 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.24 3dd0 h PRO 138 CO 0.43 0.00 -0.40 -0.40 -0.23 0.00 0.00 178.00 177.39 3dd0 n ASP 139 N -3.06 2.04 0.08 1.44 5.75 -1.26 -4.26 116.55 117.28 3dd0 n ASP 139 Ca 0.00 -3.88 -0.08 0.00 -0.01 0.00 0.00 54.79 50.83 3dd0 n ASP 139 Cb 0.28 -0.55 -0.05 0.00 -1.03 0.00 0.00 41.12 39.76 3dd0 n ASP 139 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 3dd0 h GLY 140 N 1.05 0.10 -3.92 6.12 0.00 -1.27 -3.43 103.07 101.72 3dd0 h GLY 140 Ca 0.07 -0.21 -0.52 0.00 0.00 0.00 0.00 47.33 46.66 3dd0 h GLY 140 CO 0.13 0.19 -0.81 1.08 0.00 0.00 0.00 176.54 177.14 3dd0 s LEU 141 N -7.08 2.34 -0.12 3.11 1.43 -0.33 -0.40 118.68 117.63 3dd0 s LEU 141 Ca -0.01 -0.74 -0.00 0.00 -1.03 0.00 0.00 54.13 52.35 3dd0 s LEU 141 Cb 0.10 -0.81 0.03 0.00 0.03 0.00 0.00 46.19 45.53 3dd0 s LEU 141 CO 0.82 0.01 -0.08 0.00 0.23 0.00 0.00 176.35 177.33 3dd0 s ALA 142 N -1.49 1.34 -0.19 4.21 0.00 -0.25 -0.73 121.76 124.66 3dd0 s ALA 142 Ca 0.08 -0.56 -0.03 0.00 0.00 0.00 0.00 51.96 51.46 3dd0 s ALA 142 Cb -0.08 -0.92 -0.01 0.00 0.00 0.00 0.00 23.12 22.10 3dd0 s ALA 142 CO 0.05 -0.43 -0.06 0.08 0.00 0.00 0.00 175.76 175.39 3dd0 s VAL 143 N 1.71 3.36 -0.31 0.00 1.01 -0.98 -1.26 120.40 123.93 3dd0 s VAL 143 Ca 0.05 -0.52 -0.21 0.00 0.00 0.00 0.00 61.98 61.30 3dd0 s VAL 143 Cb -0.13 -2.49 -0.01 0.00 0.00 0.00 0.00 36.38 33.76 3dd0 s VAL 143 CO -0.08 0.46 0.68 -0.22 0.00 0.00 0.00 175.10 175.94 3dd0 s LEU 144 N 1.02 4.13 -0.17 3.92 2.96 -0.48 -1.54 118.68 128.53 3dd0 s LEU 144 Ca 0.00 0.49 -0.06 0.00 -0.22 0.00 0.00 54.13 54.34 3dd0 s LEU 144 Cb -0.15 -2.90 -0.04 0.00 0.50 0.00 0.00 46.19 43.61 3dd0 s LEU 144 CO -0.00 -0.52 0.04 -0.83 -1.32 0.00 0.00 176.35 173.71 3dd0 s GLY 145 N 1.64 1.87 -0.07 7.98 0.00 0.07 -1.04 107.32 117.77 3dd0 s GLY 145 Ca 0.27 -0.76 0.02 0.00 0.00 0.00 0.00 44.72 44.25 3dd0 s GLY 145 CO 0.12 -0.02 -0.11 -0.42 0.00 0.00 0.00 173.10 172.68 3dd0 s ILE 146 N 0.26 1.04 0.28 0.90 1.01 -0.39 -0.84 121.20 123.47 3dd0 s ILE 146 Ca 0.02 -0.41 -0.19 0.00 0.00 0.00 0.00 60.65 60.07 3dd0 s ILE 146 Cb -0.13 -0.97 -0.09 0.00 0.01 0.00 0.00 42.46 41.29 3dd0 s ILE 146 CO 0.01 0.34 0.76 -0.36 0.00 0.00 0.00 174.94 175.69 3dd0 s PHE 147 N 0.77 3.53 -0.16 3.97 0.08 -1.26 -0.68 117.98 124.24 3dd0 s PHE 147 Ca -0.13 1.38 -0.01 0.00 0.12 0.00 0.00 56.93 58.29 3dd0 s PHE 147 Cb -0.15 -2.63 -0.01 0.00 -0.57 0.00 0.00 43.02 39.65 3dd0 s PHE 147 CO 0.02 0.21 -0.11 -0.51 -0.10 0.00 0.00 175.22 174.73 3dd0 s LEU 148 N -2.41 2.75 0.16 -0.37 1.02 -0.41 -0.61 118.68 118.81 3dd0 s LEU 148 Ca 0.49 -0.35 0.08 0.00 0.02 0.00 0.00 54.13 54.37 3dd0 s LEU 148 Cb -0.14 -1.64 -0.04 0.00 0.02 0.00 0.00 46.19 44.39 3dd0 s LEU 148 CO 0.19 0.11 -0.09 -1.59 0.02 0.00 0.00 176.35 175.00 3dd0 s LYS 149 N 0.67 2.11 -0.10 1.70 -2.85 -0.17 -1.86 119.74 119.23 3dd0 s LYS 149 Ca -0.06 -1.18 -0.23 0.00 -1.00 0.00 0.00 55.97 53.50 3dd0 s LYS 149 Cb -0.15 -2.22 -0.03 0.00 -2.06 0.00 0.00 37.83 33.37 3dd0 s LYS 149 CO 0.02 0.46 0.71 0.08 0.10 0.00 0.00 175.35 176.72 3dd0 s VAL 150 N -1.55 5.02 0.00 1.79 1.01 -1.26 -1.09 120.40 124.31 3dd0 s VAL 150 Ca 0.24 1.44 0.00 0.00 0.00 0.00 0.00 61.98 63.66 3dd0 s VAL 150 Cb -0.10 -4.04 0.00 0.00 0.00 0.00 0.00 36.38 32.24 3dd0 s VAL 150 CO 0.15 0.20 0.00 0.61 0.00 0.00 0.00 175.10 176.06 3dd0 n GLY 151 N 3.25 0.17 3.81 4.51 0.00 0.31 -4.90 105.19 112.34 3dd0 n GLY 151 Ca -0.00 0.53 -0.34 0.00 0.00 0.00 0.00 46.02 46.20 3dd0 n GLY 151 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3dd0 s SER 152 N 2.00 6.87 0.67 1.61 0.01 -1.26 -4.03 113.70 119.57 3dd0 s SER 152 Ca 0.00 1.79 -0.17 0.00 1.31 0.00 0.00 55.95 58.89 3dd0 s SER 152 Cb 0.00 -2.55 0.01 0.00 0.21 0.00 0.00 66.02 63.68 3dd0 s SER 152 CO 0.00 -0.41 1.21 0.00 0.41 0.00 0.00 173.24 174.45 3dd0 s ALA 153 N -2.00 2.32 -0.42 1.44 0.00 -1.26 -2.63 121.76 119.21 3dd0 s ALA 153 Ca 0.61 0.92 -0.11 0.00 0.00 0.00 0.00 51.96 53.39 3dd0 s ALA 153 Cb -0.13 -3.46 0.07 0.00 0.00 0.00 0.00 23.12 19.60 3dd0 s ALA 153 CO 0.17 -1.56 0.27 0.21 0.00 0.00 0.00 175.76 174.86 3dd0 s LYS 154 N -3.69 2.71 0.26 0.00 2.47 -1.24 -4.78 119.74 115.47 3dd0 s LYS 154 Ca 0.75 -1.38 -0.03 0.00 -1.56 0.00 0.00 55.97 53.75 3dd0 s LYS 154 Cb -0.30 -3.83 0.36 0.00 -1.46 0.00 0.00 37.83 32.61 3dd0 s LYS 154 CO 0.40 -0.92 1.90 -1.35 0.16 0.00 0.00 175.35 175.54 3dd0 h PRO 155 N 8.47 1.21 0.00 4.03 0.11 -1.92 -1.87 132.00 142.02 3dd0 h PRO 155 Ca -0.24 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.80 3dd0 h PRO 155 Cb 1.09 -0.27 0.00 0.00 0.11 0.00 0.00 31.00 31.93 3dd0 h PRO 155 CO 0.76 0.80 0.00 0.41 -0.21 0.00 0.00 178.00 179.76 3dd0 n GLY 156 N -1.37 -0.79 0.07 -0.55 0.00 -1.26 -2.07 105.19 99.21 3dd0 n GLY 156 Ca 0.14 0.01 0.11 0.00 0.00 0.00 0.00 46.02 46.28 3dd0 n GLY 156 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3dd0 n LEU 157 N -1.63 0.63 -0.12 0.99 7.94 -0.70 -4.53 117.00 119.58 3dd0 n LEU 157 Ca 0.01 0.16 -0.01 0.00 -1.11 0.00 0.00 56.01 55.06 3dd0 n LEU 157 Cb 0.09 -0.08 0.24 0.00 0.53 0.00 0.00 43.42 44.20 3dd0 n LEU 157 CO 0.08 -0.07 1.03 -0.61 -1.11 0.00 0.00 177.39 176.71 3dd0 h GLN 158 N 0.00 0.79 -0.67 1.96 5.75 -1.47 -1.03 115.11 120.45 3dd0 h GLN 158 Ca 0.00 -0.13 0.08 0.00 -0.15 0.00 0.00 58.65 58.45 3dd0 h GLN 158 Cb 0.88 -0.14 -0.04 0.00 1.07 0.00 0.00 27.48 29.26 3dd0 h GLN 158 CO 0.00 0.67 0.44 0.87 -2.65 0.00 0.00 178.83 178.16 3dd0 h LYS 159 N 0.77 0.60 -0.09 1.69 1.57 -1.80 0.06 116.57 119.37 3dd0 h LYS 159 Ca 0.18 -0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 58.89 3dd0 h LYS 159 Cb 0.19 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.37 3dd0 h LYS 159 CO -0.01 0.39 -0.07 0.28 -0.57 0.00 0.00 179.45 179.47 3dd0 h VAL 160 N 0.61 1.35 -0.67 0.50 2.07 -1.50 -3.19 116.25 115.42 3dd0 h VAL 160 Ca 0.30 -1.19 0.03 0.00 0.82 0.00 0.00 66.70 66.66 3dd0 h VAL 160 Cb 0.37 1.94 -0.04 0.00 -1.52 0.00 0.00 31.29 32.04 3dd0 h VAL 160 CO -0.10 0.33 0.44 0.58 0.02 0.00 0.00 177.57 178.85 3dd0 h VAL 161 N -0.19 1.10 0.00 2.57 2.07 -0.70 -2.60 116.25 118.50 3dd0 h VAL 161 Ca 0.02 -0.28 -0.01 0.00 0.82 0.00 0.00 66.70 67.25 3dd0 h VAL 161 Cb 0.57 0.22 -0.00 0.00 -1.52 0.00 0.00 31.29 30.55 3dd0 h VAL 161 CO 0.02 0.15 -0.04 0.44 0.02 0.00 0.00 177.57 178.16 3dd0 h ASP 162 N 0.81 0.00 0.22 0.57 3.32 -1.00 -3.05 116.42 117.29 3dd0 h ASP 162 Ca 0.27 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.32 3dd0 h ASP 162 Cb 0.06 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.61 3dd0 h ASP 162 CO -0.07 0.04 -0.65 0.55 -1.72 0.00 0.00 179.24 177.39 3dd0 n VAL 163 N -3.14 0.00 0.26 -1.35 3.14 -0.98 -4.35 118.33 111.92 3dd0 n VAL 163 Ca 0.01 -0.05 0.12 0.00 -2.96 0.00 0.00 64.34 61.46 3dd0 n VAL 163 Cb 0.37 0.67 0.73 0.00 -1.06 0.00 0.00 33.84 34.55 3dd0 n VAL 163 CO 0.00 0.00 0.00 -0.07 -6.46 0.00 0.00 176.83 170.30 3dd0 h LEU 164 N 0.45 0.00 -1.93 6.55 3.38 -1.52 -0.76 115.31 121.49 3dd0 h LEU 164 Ca 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 3dd0 h LEU 164 Cb 0.53 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.28 3dd0 h LEU 164 CO 0.00 0.09 -0.12 0.44 0.09 0.00 0.00 178.44 178.94 3dd0 h ASP 165 N 0.00 0.00 0.79 -0.43 3.32 -1.80 -2.13 116.42 116.18 3dd0 h ASP 165 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3dd0 h ASP 165 Cb 0.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.76 3dd0 h ASP 165 CO 0.01 0.12 -0.14 -1.54 -1.72 0.00 0.00 179.24 175.97 3dd0 n SER 166 N -3.71 0.17 -2.45 6.45 3.41 -0.29 -3.84 113.62 113.35 3dd0 n SER 166 Ca -0.02 0.18 -0.13 0.00 -0.26 0.00 0.00 58.87 58.64 3dd0 n SER 166 Cb 0.23 -0.26 0.03 0.00 -0.26 0.00 0.00 64.21 63.95 3dd0 n SER 166 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 3dd0 n ILE 167 N -1.44 1.87 0.02 -1.33 -5.35 -0.81 -4.72 119.36 107.60 3dd0 n ILE 167 Ca 0.08 -3.67 0.01 0.00 -0.27 0.00 0.00 62.75 58.90 3dd0 n ILE 167 Cb 0.33 -0.01 0.33 0.00 -1.74 0.00 0.00 39.64 38.54 3dd0 n ILE 167 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 3dd0 h LYS 168 N 2.47 0.48 -6.26 6.28 3.64 -1.64 -3.42 116.57 118.11 3dd0 h LYS 168 Ca 0.12 -0.09 -0.58 0.00 -1.27 0.00 0.00 60.65 58.82 3dd0 h LYS 168 Cb 1.34 -0.07 -0.11 0.00 -0.41 0.00 0.00 32.23 32.97 3dd0 h LYS 168 CO 0.52 0.50 -0.69 0.95 -2.27 0.00 0.00 179.45 178.46 3dd0 s THR 169 N -5.00 3.19 0.24 1.00 -4.23 -1.26 -0.54 115.64 109.04 3dd0 s THR 169 Ca -0.07 -1.97 -0.31 0.00 -1.18 0.00 0.00 61.69 58.16 3dd0 s THR 169 Cb 0.16 -2.67 -0.13 0.00 1.34 0.00 0.00 72.50 71.20 3dd0 s THR 169 CO 0.75 -0.32 1.51 1.17 -0.54 0.00 0.00 174.62 177.19 3dd0 n LYS 170 N -0.64 2.28 0.00 3.99 4.81 -0.13 -2.29 118.16 126.17 3dd0 n LYS 170 Ca -0.07 0.81 0.00 0.00 -0.87 0.00 0.00 58.31 58.18 3dd0 n LYS 170 Cb 0.58 -2.53 0.00 0.00 0.02 0.00 0.00 35.03 33.10 3dd0 n LYS 170 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3dd0 n GLY 171 N 2.48 1.41 3.76 3.14 0.00 0.31 -4.55 105.19 111.74 3dd0 n GLY 171 Ca 0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.75 3dd0 n GLY 171 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dd0 s LYS 172 N -0.68 4.69 0.08 1.61 -0.14 -0.97 -4.90 119.74 119.44 3dd0 s LYS 172 Ca 0.00 1.51 0.01 0.00 -1.36 0.00 0.00 55.97 56.13 3dd0 s LYS 172 Cb 0.00 -3.08 -0.04 0.00 -1.68 0.00 0.00 37.83 33.03 3dd0 s LYS 172 CO 0.00 0.35 -0.06 -1.54 -0.76 0.00 0.00 175.35 173.34 3dd0 s SER 173 N -1.27 0.96 -0.01 2.83 1.04 -1.26 -1.40 113.70 114.60 3dd0 s SER 173 Ca 0.45 -1.00 -0.04 0.00 0.48 0.00 0.00 55.95 55.84 3dd0 s SER 173 Cb -0.25 0.12 -0.00 0.00 0.10 0.00 0.00 66.02 65.99 3dd0 s SER 173 CO 0.31 -0.50 0.08 0.00 0.98 0.00 0.00 173.24 174.11 3dd0 s ALA 174 N -3.69 -0.18 0.32 5.32 0.00 -0.26 -4.94 121.76 118.34 3dd0 s ALA 174 Ca 0.10 -0.11 -0.29 0.00 0.00 0.00 0.00 51.96 51.67 3dd0 s ALA 174 Cb 0.06 0.02 -0.12 0.00 0.00 0.00 0.00 23.12 23.08 3dd0 s ALA 174 CO -0.06 -0.14 1.36 -0.25 0.00 0.00 0.00 175.76 176.67 3dd0 n ASP 175 N 2.05 2.95 -3.10 0.00 8.00 -1.26 -1.40 116.55 123.79 3dd0 n ASP 175 Ca -0.19 1.19 -0.16 0.00 0.71 0.00 0.00 54.79 56.33 3dd0 n ASP 175 Cb 0.57 -1.49 -0.05 0.00 -0.02 0.00 0.00 41.12 40.12 3dd0 n ASP 175 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 3dd0 n PHE 176 N 0.82 -2.27 -4.01 1.24 7.35 -0.71 -4.74 117.46 115.13 3dd0 n PHE 176 Ca 0.06 -2.42 -0.24 0.00 -0.76 0.00 0.00 57.45 54.10 3dd0 n PHE 176 Cb 0.35 0.82 -0.03 0.00 0.35 0.00 0.00 39.48 40.97 3dd0 n PHE 176 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 3dd0 s THR 177 N 0.42 4.98 -1.61 -2.13 -4.23 -1.26 -3.05 115.64 108.75 3dd0 s THR 177 Ca 0.32 -0.99 -0.00 0.00 -1.18 0.00 0.00 61.69 59.83 3dd0 s THR 177 Cb 0.02 -3.63 0.00 0.00 1.34 0.00 0.00 72.50 70.24 3dd0 s THR 177 CO -0.13 -0.22 0.05 0.59 -0.54 0.00 0.00 174.62 174.37 3dd0 n ASN 178 N -0.89 -5.51 -4.71 3.99 3.02 -1.26 -4.98 115.26 104.92 3dd0 n ASN 178 Ca -0.08 -0.04 -0.40 0.00 -0.03 0.00 0.00 54.58 54.03 3dd0 n ASN 178 Cb 0.56 -4.54 -0.04 0.00 -0.61 0.00 0.00 39.78 35.15 3dd0 n ASN 178 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 3dd0 s PHE 179 N -2.97 3.58 -0.39 3.10 5.36 -1.26 -5.02 117.98 120.39 3dd0 s PHE 179 Ca 0.03 1.32 -0.10 0.00 -0.96 0.00 0.00 56.93 57.21 3dd0 s PHE 179 Cb -0.01 -2.86 0.05 0.00 -0.34 0.00 0.00 43.02 39.85 3dd0 s PHE 179 CO 0.03 0.06 0.22 0.34 -1.46 0.00 0.00 175.22 174.41 3dd0 s ASP 180 N 0.84 5.68 0.00 6.13 -1.08 -1.26 -4.43 116.67 122.55 3dd0 s ASP 180 Ca 0.40 -1.17 0.21 0.00 -0.52 0.00 0.00 52.55 51.47 3dd0 s ASP 180 Cb -0.18 -2.00 1.11 0.00 -1.46 0.00 0.00 42.92 40.38 3dd0 s ASP 180 CO 0.19 -0.43 1.69 -0.81 0.52 0.00 0.00 175.17 176.33 3dd0 n PRO 181 N 4.96 0.35 0.26 4.34 -0.04 -1.26 -2.71 135.00 140.90 3dd0 n PRO 181 Ca -0.11 0.07 0.10 0.00 -0.04 0.00 0.00 63.50 63.53 3dd0 n PRO 181 Cb 0.45 -1.50 0.69 0.00 -0.04 0.00 0.00 33.50 33.10 3dd0 n PRO 181 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3dd0 h ARG 182 N 0.00 0.00 0.00 0.54 3.08 -1.93 -1.47 114.38 114.60 3dd0 h ARG 182 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3dd0 h ARG 182 Cb 0.18 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.23 3dd0 h ARG 182 CO 0.00 0.10 0.00 0.41 -1.07 0.00 0.00 179.97 179.41 3dd0 n GLY 183 N -1.02 -0.51 0.53 0.04 0.00 -1.10 -2.58 105.19 100.55 3dd0 n GLY 183 Ca -0.02 -0.06 0.07 0.00 0.00 0.00 0.00 46.02 46.00 3dd0 n GLY 183 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3dd0 n LEU 184 N -1.15 2.11 -4.82 0.99 4.77 -0.55 -4.29 117.00 114.05 3dd0 n LEU 184 Ca 0.07 -1.02 -0.35 0.00 -0.03 0.00 0.00 56.01 54.68 3dd0 n LEU 184 Cb 0.07 -0.01 -0.06 0.00 -2.33 0.00 0.00 43.42 41.09 3dd0 n LEU 184 CO 0.08 0.39 0.40 -0.76 -1.33 0.00 0.00 177.39 176.17 3dd0 s LEU 185 N -1.09 4.29 1.02 2.23 1.43 -1.06 -4.95 118.68 120.55 3dd0 s LEU 185 Ca 0.16 1.35 -0.16 0.00 -1.03 0.00 0.00 54.13 54.45 3dd0 s LEU 185 Cb 0.11 -3.65 0.21 0.00 0.03 0.00 0.00 46.19 42.89 3dd0 s LEU 185 CO 0.16 -0.01 1.20 -2.16 0.23 0.00 0.00 176.35 175.78 3dd0 s PRO 186 N -2.17 0.19 0.09 1.29 0.04 -1.26 -4.99 135.00 128.19 3dd0 s PRO 186 Ca 0.45 -0.09 -0.18 0.00 0.04 0.00 0.00 61.00 61.22 3dd0 s PRO 186 Cb -0.15 -1.76 -0.08 0.00 0.04 0.00 0.00 34.50 32.55 3dd0 s PRO 186 CO 0.20 -2.77 1.51 0.93 0.04 0.00 0.00 177.00 176.91 3dd0 h GLU 187 N -1.90 0.49 -5.81 4.56 5.08 -1.93 -3.44 114.58 111.63 3dd0 h GLU 187 Ca -0.46 -0.17 -0.64 0.00 -1.00 0.00 0.00 59.36 57.09 3dd0 h GLU 187 Cb 1.28 -0.04 -0.06 0.00 0.50 0.00 0.00 28.75 30.44 3dd0 h GLU 187 CO 0.44 0.67 -0.45 0.45 -1.00 0.00 0.00 179.01 179.12 3dd0 s SER 188 N -6.02 6.42 -0.23 1.42 0.15 -1.26 -5.01 113.70 109.17 3dd0 s SER 188 Ca -0.13 0.44 0.14 0.00 0.70 0.00 0.00 55.95 57.10 3dd0 s SER 188 Cb 0.08 -2.05 0.55 0.00 -1.71 0.00 0.00 66.02 62.89 3dd0 s SER 188 CO 0.76 0.29 1.48 0.18 1.20 0.00 0.00 173.24 177.14 3dd0 n LEU 189 N 1.20 4.20 -4.77 3.45 4.77 -1.26 -4.72 117.00 119.87 3dd0 n LEU 189 Ca -0.13 -3.24 -0.41 0.00 -0.03 0.00 0.00 56.01 52.21 3dd0 n LEU 189 Cb 0.53 -0.59 -0.01 0.00 -2.33 0.00 0.00 43.42 41.01 3dd0 n LEU 189 CO 0.41 0.84 1.04 -1.81 -1.33 0.00 0.00 177.39 176.54 3dd0 s ASP 190 N -2.00 6.61 0.20 -1.43 1.01 -1.26 -4.73 116.67 115.08 3dd0 s ASP 190 Ca 0.44 2.81 -0.10 0.00 0.71 0.00 0.00 52.55 56.42 3dd0 s ASP 190 Cb 0.37 -2.65 -0.01 0.00 1.01 0.00 0.00 42.92 41.64 3dd0 s ASP 190 CO 0.07 -0.67 0.34 -0.72 0.21 0.00 0.00 175.17 174.41 3dd0 s TYR 191 N -1.05 0.48 0.06 4.23 -0.85 -1.26 -1.72 117.35 117.24 3dd0 s TYR 191 Ca 0.51 -0.82 0.03 0.00 -0.52 0.00 0.00 57.07 56.27 3dd0 s TYR 191 Cb -0.42 -0.02 -0.04 0.00 0.38 0.00 0.00 41.96 41.85 3dd0 s TYR 191 CO 0.56 -0.82 0.03 -1.58 -1.52 0.00 0.00 175.55 172.22 3dd0 s TRP 192 N -4.01 3.09 -0.00 -3.49 0.51 -0.37 -0.90 118.94 113.78 3dd0 s TRP 192 Ca 0.22 0.05 -0.02 0.00 -2.12 0.00 0.00 56.10 54.23 3dd0 s TRP 192 Cb 0.02 -1.61 -0.00 0.00 -0.81 0.00 0.00 33.47 31.07 3dd0 s TRP 192 CO 0.05 0.49 0.04 -0.08 -0.51 0.00 0.00 176.95 176.95 3dd0 s THR 193 N -1.27 0.05 0.09 2.01 -1.32 -0.06 -0.61 115.64 114.52 3dd0 s THR 193 Ca 0.25 -0.43 -0.22 0.00 -1.21 0.00 0.00 61.69 60.08 3dd0 s THR 193 Cb -0.12 -0.21 0.06 0.00 -1.51 0.00 0.00 72.50 70.72 3dd0 s THR 193 CO 0.17 -0.24 0.54 -0.72 -2.21 0.00 0.00 174.62 172.17 3dd0 s TYR 194 N -0.73 -0.45 0.01 9.09 1.13 -1.08 -1.57 117.35 123.74 3dd0 s TYR 194 Ca -0.08 0.40 -0.29 0.00 -1.41 0.00 0.00 57.07 55.69 3dd0 s TYR 194 Cb -0.05 0.41 -0.04 0.00 -1.10 0.00 0.00 41.96 41.18 3dd0 s TYR 194 CO -0.00 -0.72 0.93 -1.25 -2.51 0.00 0.00 175.55 172.01 3dd0 s PRO 195 N -2.95 4.56 0.00 -3.49 0.04 -1.26 -1.52 135.00 130.38 3dd0 s PRO 195 Ca -0.03 1.34 0.00 0.00 0.04 0.00 0.00 61.00 62.36 3dd0 s PRO 195 Cb -0.00 -3.44 0.00 0.00 0.04 0.00 0.00 34.50 31.09 3dd0 s PRO 195 CO -0.06 0.01 0.00 0.41 0.04 0.00 0.00 177.00 177.41 3dd0 n GLY 196 N 2.81 4.46 3.26 0.56 0.00 0.41 -4.85 105.19 111.84 3dd0 n GLY 196 Ca 0.04 -0.72 -0.14 0.00 0.00 0.00 0.00 46.02 45.19 3dd0 n GLY 196 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3dd0 s SER 197 N 1.52 0.78 0.56 1.61 1.04 -1.09 -2.49 113.70 115.62 3dd0 s SER 197 Ca 0.00 -1.37 -0.21 0.00 0.48 0.00 0.00 55.95 54.85 3dd0 s SER 197 Cb 0.00 0.24 -0.04 0.00 0.10 0.00 0.00 66.02 66.32 3dd0 s SER 197 CO 0.00 -0.76 1.30 -0.76 0.98 0.00 0.00 173.24 174.00 3dd0 s LEU 198 N -3.24 3.81 0.00 2.42 1.43 -0.48 -4.52 118.68 118.10 3dd0 s LEU 198 Ca 0.37 2.63 0.24 0.00 -1.03 0.00 0.00 54.13 56.34 3dd0 s LEU 198 Cb 0.07 -4.36 0.19 0.00 0.03 0.00 0.00 46.19 42.12 3dd0 s LEU 198 CO 0.12 -1.55 1.25 0.35 0.23 0.00 0.00 176.35 176.75 3dd0 n THR 199 N -1.16 0.00 -4.41 5.49 -2.24 -1.26 -4.40 114.28 106.30 3dd0 n THR 199 Ca 0.11 -0.47 -0.22 0.00 -2.27 0.00 0.00 64.05 61.20 3dd0 n THR 199 Cb 0.46 1.46 -0.10 0.00 -2.10 0.00 0.00 70.33 70.05 3dd0 n THR 199 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3dd0 s THR 200 N -2.05 2.15 0.24 4.28 -4.23 -1.26 -4.76 115.64 110.02 3dd0 s THR 200 Ca 0.27 -2.26 -0.30 0.00 -1.18 0.00 0.00 61.69 58.23 3dd0 s THR 200 Cb 0.20 -2.15 -0.15 0.00 1.34 0.00 0.00 72.50 71.74 3dd0 s THR 200 CO 0.33 -0.43 1.05 -2.65 -0.54 0.00 0.00 174.62 172.38 3dd0 n PRO 201 N -0.36 1.23 -0.26 3.99 -0.02 -1.26 -1.10 135.00 137.22 3dd0 n PRO 201 Ca -0.08 0.43 0.04 0.00 -2.02 0.00 0.00 63.50 61.88 3dd0 n PRO 201 Cb 0.59 -1.84 0.15 0.00 -0.02 0.00 0.00 33.50 32.38 3dd0 n PRO 201 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 3dd0 n PRO 202 N 1.16 2.14 -1.98 0.52 -0.04 -1.26 -5.01 135.00 130.53 3dd0 n PRO 202 Ca 0.12 -1.17 -0.18 0.00 -0.04 0.00 0.00 63.50 62.22 3dd0 n PRO 202 Cb 0.29 -1.53 -0.04 0.00 -0.04 0.00 0.00 33.50 32.18 3dd0 n PRO 202 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3dd0 n LEU 203 N 0.31 -1.62 -4.76 1.53 4.77 -0.26 -4.92 117.00 112.05 3dd0 n LEU 203 Ca 0.11 0.20 -0.38 0.00 -0.03 0.00 0.00 56.01 55.91 3dd0 n LEU 203 Cb 0.45 -2.63 0.00 0.00 -2.33 0.00 0.00 43.42 38.91 3dd0 n LEU 203 CO 0.10 -0.54 0.88 -0.76 -1.33 0.00 0.00 177.39 175.74 3dd0 s LEU 204 N -4.82 3.99 -1.22 2.23 1.43 -1.26 -4.39 118.68 114.64 3dd0 s LEU 204 Ca 0.00 2.46 -0.07 0.00 -1.03 0.00 0.00 54.13 55.49 3dd0 s LEU 204 Cb 0.00 -4.21 0.21 0.00 0.03 0.00 0.00 46.19 42.22 3dd0 s LEU 204 CO 0.00 -1.07 1.84 -0.62 0.23 0.00 0.00 176.35 176.73 3dd0 n GLU 205 N -0.55 4.11 -0.05 1.70 1.02 -1.26 -1.39 120.64 124.21 3dd0 n GLU 205 Ca 0.08 -3.86 0.02 0.00 -0.02 0.00 0.00 57.16 53.37 3dd0 n GLU 205 Cb 0.47 -2.74 0.03 0.00 -0.02 0.00 0.00 31.44 29.17 3dd0 n GLU 205 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3dd0 s VAL 207 N -1.16 3.33 -0.40 0.00 1.01 -1.04 -1.18 120.40 120.95 3dd0 s VAL 207 Ca 0.07 -0.56 -0.20 0.00 0.00 0.00 0.00 61.98 61.28 3dd0 s VAL 207 Cb 0.06 -2.42 0.01 0.00 0.00 0.00 0.00 36.38 34.04 3dd0 s VAL 207 CO 0.01 0.52 0.62 -0.89 0.00 0.00 0.00 175.10 175.35 3dd0 s THR 208 N 0.28 4.88 0.06 3.92 2.01 0.09 -0.44 115.64 126.44 3dd0 s THR 208 Ca -0.07 0.25 -0.24 0.00 0.31 0.00 0.00 61.69 61.93 3dd0 s THR 208 Cb -0.15 -4.14 -0.06 0.00 0.01 0.00 0.00 72.50 68.16 3dd0 s THR 208 CO 0.05 -0.47 0.74 0.26 -0.69 0.00 0.00 174.62 174.51 3dd0 s TRP 209 N 2.71 3.76 -0.27 4.92 0.52 -0.57 -2.31 118.94 127.70 3dd0 s TRP 209 Ca 0.22 1.46 0.01 0.00 0.02 0.00 0.00 56.10 57.81 3dd0 s TRP 209 Cb -0.14 -2.77 0.08 0.00 -1.15 0.00 0.00 33.47 29.48 3dd0 s TRP 209 CO 0.17 0.34 0.01 0.42 0.02 0.00 0.00 176.95 177.91 3dd0 s ILE 210 N -0.31 1.43 -0.22 2.03 1.01 -0.59 -2.65 121.20 121.90 3dd0 s ILE 210 Ca 0.37 -1.43 -0.04 0.00 0.00 0.00 0.00 60.65 59.54 3dd0 s ILE 210 Cb -0.21 -1.88 -0.01 0.00 0.01 0.00 0.00 42.46 40.38 3dd0 s ILE 210 CO 0.23 -0.35 -0.04 -0.69 0.00 0.00 0.00 174.94 174.09 3dd0 s VAL 211 N 1.39 3.43 0.29 2.92 1.01 0.22 -0.75 120.40 128.91 3dd0 s VAL 211 Ca 0.02 -0.48 -0.28 0.00 0.00 0.00 0.00 61.98 61.24 3dd0 s VAL 211 Cb -0.18 -2.57 -0.09 0.00 0.00 0.00 0.00 36.38 33.54 3dd0 s VAL 211 CO -0.12 0.41 0.99 -0.76 0.00 0.00 0.00 175.10 175.63 3dd0 s LEU 212 N 1.49 4.47 0.19 3.92 1.43 -0.02 -1.23 118.68 128.93 3dd0 s LEU 212 Ca 0.06 2.01 -0.08 0.00 -1.03 0.00 0.00 54.13 55.09 3dd0 s LEU 212 Cb -0.14 -3.80 0.09 0.00 0.03 0.00 0.00 46.19 42.37 3dd0 s LEU 212 CO -0.03 -0.07 1.64 0.50 0.23 0.00 0.00 176.35 178.62 3dd0 h LYS 213 N 3.57 1.01 -5.59 1.70 3.64 -1.68 -3.43 116.57 115.80 3dd0 h LYS 213 Ca -0.46 -0.34 -0.61 0.00 -1.27 0.00 0.00 60.65 57.96 3dd0 h LYS 213 Cb 1.20 -0.08 -0.11 0.00 -0.41 0.00 0.00 32.23 32.83 3dd0 h LYS 213 CO 0.66 1.03 0.24 -2.00 -2.27 0.00 0.00 179.45 177.11 3dd0 s GLU 214 N -4.92 4.04 0.65 1.90 2.12 -1.26 -5.02 118.70 116.21 3dd0 s GLU 214 Ca -0.11 0.54 -0.13 0.00 0.36 0.00 0.00 54.97 55.63 3dd0 s GLU 214 Cb 0.13 -3.68 -0.01 0.00 0.26 0.00 0.00 34.13 30.83 3dd0 s GLU 214 CO 0.86 -0.51 1.05 -2.14 -0.54 0.00 0.00 175.26 173.98 3dd0 s PRO 215 N 2.65 3.15 0.12 4.30 0.02 -1.26 -4.66 135.00 139.32 3dd0 s PRO 215 Ca 0.28 1.02 0.00 0.00 0.02 0.00 0.00 61.00 62.33 3dd0 s PRO 215 Cb -0.15 -2.02 -0.04 0.00 0.02 0.00 0.00 34.50 32.31 3dd0 s PRO 215 CO 0.10 -0.93 0.28 0.96 -0.33 0.00 0.00 177.00 177.07 3dd0 s ILE 216 N -2.84 5.32 -0.11 2.83 -4.36 0.22 -4.90 121.20 117.36 3dd0 s ILE 216 Ca 0.60 -0.46 -0.06 0.00 -0.26 0.00 0.00 60.65 60.47 3dd0 s ILE 216 Cb -0.14 -3.69 -0.04 0.00 1.25 0.00 0.00 42.46 39.84 3dd0 s ILE 216 CO 0.48 0.00 0.10 -0.94 0.24 0.00 0.00 174.94 174.82 3dd0 s SER 217 N -2.87 6.05 0.18 4.36 1.04 -1.26 -1.00 113.70 120.20 3dd0 s SER 217 Ca 0.36 0.37 0.08 0.00 0.48 0.00 0.00 55.95 57.24 3dd0 s SER 217 Cb -0.12 -1.90 -0.04 0.00 0.10 0.00 0.00 66.02 64.06 3dd0 s SER 217 CO 0.28 0.40 -0.16 0.68 0.98 0.00 0.00 173.24 175.42 3dd0 s VAL 218 N -0.97 1.68 0.59 5.02 -7.23 -0.25 -3.60 120.40 115.64 3dd0 s VAL 218 Ca 0.14 -2.02 -0.10 0.00 -1.81 0.00 0.00 61.98 58.19 3dd0 s VAL 218 Cb -0.12 -1.88 -0.04 0.00 0.56 0.00 0.00 36.38 34.90 3dd0 s VAL 218 CO 0.03 -0.47 0.98 -0.94 -0.31 0.00 0.00 175.10 174.39 3dd0 s SER 219 N -2.94 6.26 0.36 4.85 1.04 -1.16 -0.53 113.70 121.57 3dd0 s SER 219 Ca 0.18 1.34 0.06 0.00 0.48 0.00 0.00 55.95 58.00 3dd0 s SER 219 Cb -0.03 -2.43 0.73 0.00 0.10 0.00 0.00 66.02 64.39 3dd0 s SER 219 CO 0.06 -0.80 1.94 0.77 0.98 0.00 0.00 173.24 176.19 3dd0 h SER 220 N -0.14 0.68 -0.60 7.02 4.64 -1.93 -2.18 113.55 121.03 3dd0 h SER 220 Ca -0.45 0.01 -0.08 0.00 -0.47 0.00 0.00 61.79 60.80 3dd0 h SER 220 Cb 1.19 -0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 63.12 3dd0 h SER 220 CO 0.62 0.43 0.07 -0.33 -0.87 0.00 0.00 176.83 176.75 3dd0 h GLU 221 N 0.77 1.01 -0.07 4.77 3.07 -1.95 -0.59 114.58 121.59 3dd0 h GLU 221 Ca 0.33 -0.29 0.00 0.00 -0.50 0.00 0.00 59.36 58.91 3dd0 h GLU 221 Cb 0.31 -0.11 -0.00 0.00 -0.84 0.00 0.00 28.75 28.10 3dd0 h GLU 221 CO -0.12 0.97 0.04 1.96 -1.40 0.00 0.00 179.01 180.46 3dd0 h GLN 222 N 0.92 0.09 0.00 2.33 4.20 -1.79 -2.86 115.11 118.00 3dd0 h GLN 222 Ca 0.18 -0.01 -0.07 0.00 0.06 0.00 0.00 58.65 58.81 3dd0 h GLN 222 Cb 0.46 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.21 3dd0 h GLN 222 CO 0.02 0.09 -0.33 -0.24 -0.67 0.00 0.00 178.83 177.69 3dd0 h VAL 223 N 0.07 0.86 -0.69 -0.54 3.04 -1.27 -2.22 116.25 115.50 3dd0 h VAL 223 Ca 0.02 -1.35 0.06 0.00 -1.01 0.00 0.00 66.70 64.42 3dd0 h VAL 223 Cb 0.02 1.82 -0.04 0.00 -2.01 0.00 0.00 31.29 31.08 3dd0 h VAL 223 CO -0.00 0.33 0.46 -0.07 -1.01 0.00 0.00 177.57 177.27 3dd0 h LEU 224 N 0.00 0.65 -0.99 3.16 3.38 -1.02 -1.73 115.31 118.75 3dd0 h LEU 224 Ca -0.00 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.86 3dd0 h LEU 224 Cb 0.80 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.39 3dd0 h LEU 224 CO 0.04 0.43 -0.44 0.11 0.09 0.00 0.00 178.44 178.67 3dd0 h LYS 225 N 0.74 0.14 -0.79 1.13 1.57 -1.17 -2.32 116.57 115.87 3dd0 h LYS 225 Ca 0.29 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 59.01 3dd0 h LYS 225 Cb 0.21 -0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.49 3dd0 h LYS 225 CO -0.09 0.55 0.51 0.74 -0.57 0.00 0.00 179.45 180.60 3dd0 h PHE 226 N 0.12 1.01 0.00 -1.35 -1.00 -1.31 -2.76 116.94 111.63 3dd0 h PHE 226 Ca 0.01 0.02 0.00 0.00 2.81 0.00 0.00 57.97 60.81 3dd0 h PHE 226 Cb 0.82 -0.34 0.00 0.00 3.61 0.00 0.00 35.95 40.04 3dd0 h PHE 226 CO 0.01 0.64 0.00 0.54 -1.61 0.00 0.00 178.31 177.89 3dd0 n ARG 227 N -4.41 0.77 0.00 1.51 1.74 -0.88 -2.49 116.66 112.91 3dd0 n ARG 227 Ca 0.09 0.01 0.12 0.00 -0.77 0.00 0.00 57.85 57.29 3dd0 n ARG 227 Cb 0.04 -1.50 0.23 0.00 -1.02 0.00 0.00 32.46 30.21 3dd0 n ARG 227 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 3dd0 n LYS 228 N -1.03 0.80 -1.32 5.56 5.02 -1.04 -4.48 118.16 121.67 3dd0 n LYS 228 Ca 0.19 -0.55 -0.30 0.00 -2.02 0.00 0.00 58.31 55.63 3dd0 n LYS 228 Cb 0.10 -1.49 0.11 0.00 -0.02 0.00 0.00 35.03 33.74 3dd0 n LYS 228 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3dd0 s LEU 229 N -2.58 2.52 -0.04 -0.35 1.43 -1.04 -4.87 118.68 113.75 3dd0 s LEU 229 Ca 0.20 1.50 0.06 0.00 -1.03 0.00 0.00 54.13 54.87 3dd0 s LEU 229 Cb 0.19 -4.04 -0.02 0.00 0.03 0.00 0.00 46.19 42.34 3dd0 s LEU 229 CO 0.58 -2.31 -0.21 0.20 0.23 0.00 0.00 176.35 174.83 3dd0 s ASN 230 N -3.55 3.44 0.23 2.29 0.02 0.30 -0.26 114.94 117.41 3dd0 s ASN 230 Ca 0.62 -0.37 0.04 0.00 -1.02 0.00 0.00 52.86 52.13 3dd0 s ASN 230 Cb -0.17 -0.63 0.24 0.00 0.02 0.00 0.00 41.25 40.72 3dd0 s ASN 230 CO 0.56 0.32 1.56 -0.26 0.02 0.00 0.00 177.10 179.29 3dd0 h PHE 231 N 5.55 0.32 -4.23 2.20 0.04 -1.45 -3.36 116.94 116.00 3dd0 h PHE 231 Ca -0.42 -0.12 -0.50 0.00 2.80 0.00 0.00 57.97 59.72 3dd0 h PHE 231 Cb 1.14 -0.06 0.06 0.00 2.20 0.00 0.00 35.95 39.30 3dd0 h PHE 231 CO 0.44 0.79 0.36 0.54 -0.60 0.00 0.00 178.31 179.83 3dd0 s ASN 232 N -6.90 5.97 0.62 2.17 4.22 -1.26 -4.40 114.94 115.36 3dd0 s ASN 232 Ca -0.04 1.22 -0.11 0.00 -2.14 0.00 0.00 52.86 51.79 3dd0 s ASN 232 Cb 0.12 -2.23 -0.04 0.00 1.28 0.00 0.00 41.25 40.38 3dd0 s ASN 232 CO 0.80 -0.98 1.03 -0.83 -2.04 0.00 0.00 177.10 175.08 3dd0 s GLY 233 N -4.23 1.67 0.37 0.45 0.00 -1.26 -0.96 107.32 103.36 3dd0 s GLY 233 Ca 0.55 -0.08 -0.26 0.00 0.00 0.00 0.00 44.72 44.93 3dd0 s GLY 233 CO 0.51 0.19 1.08 -2.21 0.00 0.00 0.00 173.10 172.67 3dd0 n GLU 234 N -2.73 1.53 0.00 2.90 2.13 -1.26 -2.05 120.64 121.17 3dd0 n GLU 234 Ca 0.06 0.54 0.00 0.00 0.66 0.00 0.00 57.16 58.42 3dd0 n GLU 234 Cb 0.54 -2.06 0.00 0.00 0.27 0.00 0.00 31.44 30.19 3dd0 n GLU 234 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3dd0 n GLY 235 N 1.09 2.86 3.88 8.31 0.00 -1.26 -5.01 105.19 115.06 3dd0 n GLY 235 Ca 0.08 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 3dd0 n GLY 235 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dd0 s GLU 236 N -0.08 3.71 0.14 1.61 2.02 -0.87 -5.04 118.70 120.20 3dd0 s GLU 236 Ca 0.00 0.47 -0.34 0.00 0.02 0.00 0.00 54.97 55.11 3dd0 s GLU 236 Cb 0.00 -2.34 -0.15 0.00 0.10 0.00 0.00 34.13 31.75 3dd0 s GLU 236 CO 0.00 -0.15 1.47 -2.30 0.02 0.00 0.00 175.26 174.30 3dd0 n PRO 237 N -1.71 1.79 -2.25 0.39 -0.02 -1.26 -4.89 135.00 127.04 3dd0 n PRO 237 Ca 0.03 0.64 -0.43 0.00 -2.02 0.00 0.00 63.50 61.72 3dd0 n PRO 237 Cb 0.54 -2.35 -0.02 0.00 -0.02 0.00 0.00 33.50 31.65 3dd0 n PRO 237 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 3dd0 s GLU 238 N 0.61 4.08 -0.19 -0.52 2.12 -1.26 -4.77 118.70 118.77 3dd0 s GLU 238 Ca 0.79 1.74 0.01 0.00 0.36 0.00 0.00 54.97 57.87 3dd0 s GLU 238 Cb -0.77 -3.89 0.03 0.00 0.26 0.00 0.00 34.13 29.76 3dd0 s GLU 238 CO 0.42 -0.92 -0.13 -2.00 -0.54 0.00 0.00 175.26 172.09 3dd0 s GLU 239 N 3.97 2.33 0.32 4.30 2.56 -1.26 -5.07 118.70 125.85 3dd0 s GLU 239 Ca 0.63 -0.84 -0.29 0.00 0.00 0.00 0.00 54.97 54.48 3dd0 s GLU 239 Cb -0.25 -2.44 -0.10 0.00 2.00 0.00 0.00 34.13 33.35 3dd0 s GLU 239 CO 0.22 -0.35 1.28 -0.51 -0.56 0.00 0.00 175.26 175.34 3dd0 s LEU 240 N 1.36 4.45 -0.90 2.70 1.43 -1.26 -1.27 118.68 125.18 3dd0 s LEU 240 Ca 0.01 2.61 -0.23 0.00 -1.03 0.00 0.00 54.13 55.49 3dd0 s LEU 240 Cb -0.15 -3.64 0.06 0.00 0.03 0.00 0.00 46.19 42.49 3dd0 s LEU 240 CO -0.09 -0.48 1.30 -0.32 0.23 0.00 0.00 176.35 176.99 3dd0 s MET 241 N -1.65 3.45 0.03 1.70 -2.45 0.63 -4.64 119.30 116.37 3dd0 s MET 241 Ca 0.49 -1.00 -0.01 0.00 -1.25 0.00 0.00 55.69 53.92 3dd0 s MET 241 Cb -0.38 -4.89 -0.02 0.00 1.25 0.00 0.00 34.83 30.79 3dd0 s MET 241 CO 0.50 -2.08 -0.01 0.14 1.05 0.00 0.00 175.02 174.63 3dd0 s VAL 242 N 4.66 0.14 -1.22 10.11 -7.23 -1.26 -4.47 120.40 121.13 3dd0 s VAL 242 Ca 0.39 -1.13 -0.00 0.00 -1.81 0.00 0.00 61.98 59.42 3dd0 s VAL 242 Cb -0.05 -0.63 -0.00 0.00 0.56 0.00 0.00 36.38 36.27 3dd0 s VAL 242 CO -0.02 -0.62 0.95 0.47 -0.31 0.00 0.00 175.10 175.57 3dd0 n ASP 243 N 1.16 -1.92 -2.83 4.85 8.00 0.11 -4.86 116.55 121.05 3dd0 n ASP 243 Ca -0.21 -0.65 -0.38 0.00 0.71 0.00 0.00 54.79 54.26 3dd0 n ASP 243 Cb 0.57 -4.97 0.03 0.00 -0.02 0.00 0.00 41.12 36.73 3dd0 n ASP 243 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 3dd0 n ASN 244 N -3.12 7.37 -4.32 -2.24 6.94 -1.05 -4.90 115.26 113.93 3dd0 n ASN 244 Ca -0.29 -3.73 -0.28 0.00 -0.02 0.00 0.00 54.58 50.25 3dd0 n ASN 244 Cb 0.67 -1.09 -0.14 0.00 -2.36 0.00 0.00 39.78 36.86 3dd0 n ASN 244 CO 0.00 0.00 0.00 -1.66 -1.03 0.00 0.00 177.26 174.57 3dd0 s TRP 245 N -3.69 2.13 -0.02 -2.53 1.48 -1.26 -4.61 118.94 110.44 3dd0 s TRP 245 Ca 0.53 -0.40 -0.13 0.00 -1.06 0.00 0.00 56.10 55.05 3dd0 s TRP 245 Cb 0.43 -1.25 -0.05 0.00 -1.16 0.00 0.00 33.47 31.44 3dd0 s TRP 245 CO -0.38 0.16 0.34 0.50 -4.06 0.00 0.00 176.95 173.51 3dd0 s ARG 246 N -1.40 3.79 0.77 3.25 3.52 -1.26 -4.97 118.95 122.65 3dd0 s ARG 246 Ca 0.10 0.27 -0.11 0.00 -0.13 0.00 0.00 55.73 55.86 3dd0 s ARG 246 Cb -0.10 -3.20 0.06 0.00 -1.56 0.00 0.00 34.95 30.15 3dd0 s ARG 246 CO 0.03 0.71 1.08 -1.25 -0.81 0.00 0.00 175.30 175.06 3dd0 s PRO 247 N -1.12 2.27 0.35 5.12 0.04 -1.26 -4.68 135.00 135.72 3dd0 s PRO 247 Ca 0.22 0.81 -0.28 0.00 0.04 0.00 0.00 61.00 61.79 3dd0 s PRO 247 Cb -0.15 -1.93 -0.12 0.00 0.04 0.00 0.00 34.50 32.34 3dd0 s PRO 247 CO 0.11 -1.53 1.44 0.00 0.04 0.00 0.00 177.00 177.06 3dd0 n ALA 248 N -3.40 1.98 -2.81 8.56 0.00 -1.26 -4.39 120.51 119.19 3dd0 n ALA 248 Ca 0.07 0.36 -0.24 0.00 0.00 0.00 0.00 53.44 53.63 3dd0 n ALA 248 Cb 0.55 -2.36 -0.05 0.00 0.00 0.00 0.00 19.45 17.59 3dd0 n ALA 248 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 3dd0 s GLN 249 N -1.72 2.90 0.41 0.00 -1.52 0.04 -4.96 119.66 114.81 3dd0 s GLN 249 Ca 0.56 -0.99 -0.25 0.00 -1.95 0.00 0.00 55.36 52.72 3dd0 s GLN 249 Cb -0.52 -2.58 -0.08 0.00 -0.22 0.00 0.00 33.01 29.61 3dd0 s GLN 249 CO 0.60 0.43 1.24 -1.25 -0.25 0.00 0.00 175.29 176.07 3dd0 s PRO 250 N -3.56 3.97 0.23 2.91 0.04 -1.26 -4.59 135.00 132.75 3dd0 s PRO 250 Ca 0.32 2.01 0.05 0.00 0.04 0.00 0.00 61.00 63.42 3dd0 s PRO 250 Cb -0.09 -2.70 0.24 0.00 0.04 0.00 0.00 34.50 31.99 3dd0 s PRO 250 CO 0.24 -0.44 1.55 1.25 0.04 0.00 0.00 177.00 179.64 3dd0 h LEU 251 N 2.61 0.24 0.00 -3.56 5.85 -1.95 -3.44 115.31 115.06 3dd0 h LEU 251 Ca -0.49 -0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.08 3dd0 h LEU 251 Cb 1.24 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 42.20 3dd0 h LEU 251 CO 0.62 0.81 0.00 0.29 -0.34 0.00 0.00 178.44 179.82 3dd0 n LYS 252 N -3.85 0.00 -2.12 1.25 5.02 -1.26 -2.78 118.16 114.42 3dd0 n LYS 252 Ca -0.02 0.00 -0.39 0.00 -2.02 0.00 0.00 58.31 55.88 3dd0 n LYS 252 Cb 0.63 0.00 0.02 0.00 -0.02 0.00 0.00 35.03 35.66 3dd0 n LYS 252 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3dd0 n ASN 253 N 3.46 7.40 -4.30 4.39 4.13 -1.26 -4.92 115.26 124.15 3dd0 n ASN 253 Ca 0.00 -3.66 -0.22 0.00 1.68 0.00 0.00 54.58 52.38 3dd0 n ASN 253 Cb 0.00 -1.15 -0.12 0.00 -1.54 0.00 0.00 39.78 36.98 3dd0 n ASN 253 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 3dd0 s ARG 254 N -3.66 1.18 -0.13 3.52 0.52 -1.12 -5.14 118.95 114.13 3dd0 s ARG 254 Ca 0.49 -1.28 0.02 0.00 -0.52 0.00 0.00 55.73 54.44 3dd0 s ARG 254 Cb 0.33 -1.31 0.00 0.00 0.52 0.00 0.00 34.95 34.49 3dd0 s ARG 254 CO -0.27 0.28 -0.21 -1.14 0.02 0.00 0.00 175.30 173.98 3dd0 s GLN 255 N -2.40 3.10 -0.07 3.54 0.74 -1.26 -5.02 119.66 118.29 3dd0 s GLN 255 Ca 0.11 -0.83 -0.22 0.00 0.05 0.00 0.00 55.36 54.47 3dd0 s GLN 255 Cb -0.07 -2.44 -0.04 0.00 1.10 0.00 0.00 33.01 31.56 3dd0 s GLN 255 CO 0.05 0.09 0.63 0.42 -0.55 0.00 0.00 175.29 175.93 3dd0 s ILE 256 N 0.59 5.05 0.02 -2.34 1.01 -1.26 -4.71 121.20 119.56 3dd0 s ILE 256 Ca -0.12 1.30 0.02 0.00 0.00 0.00 0.00 60.65 61.86 3dd0 s ILE 256 Cb -0.16 -3.97 -0.04 0.00 0.01 0.00 0.00 42.46 38.30 3dd0 s ILE 256 CO 0.03 0.30 -0.00 -0.54 0.00 0.00 0.00 174.94 174.73 3dd0 s LYS 257 N 0.58 2.73 0.04 2.79 1.02 -0.61 -1.59 119.74 124.70 3dd0 s LYS 257 Ca 0.34 -0.66 0.07 0.00 0.02 0.00 0.00 55.97 55.74 3dd0 s LYS 257 Cb -0.17 -2.64 -0.03 0.00 -0.52 0.00 0.00 37.83 34.47 3dd0 s LYS 257 CO 0.16 0.60 -0.19 0.00 -0.92 0.00 0.00 175.35 175.01 3dd0 s ALA 258 N -1.13 2.56 -2.55 5.17 0.00 0.02 -0.88 121.76 124.94 3dd0 s ALA 258 Ca 0.21 -1.20 0.25 0.00 0.00 0.00 0.00 51.96 51.23 3dd0 s ALA 258 Cb -0.12 -0.71 0.77 0.00 0.00 0.00 0.00 23.12 23.06 3dd0 s ALA 258 CO 0.12 0.57 1.58 -1.13 0.00 0.00 0.00 175.76 176.90 3dd0 n SER 259 N 1.60 1.99 -4.10 0.00 3.41 -0.07 -1.54 113.62 114.91 3dd0 n SER 259 Ca -0.16 -1.68 -0.08 0.00 -0.26 0.00 0.00 58.87 56.69 3dd0 n SER 259 Cb 0.52 -0.04 -0.10 0.00 -0.26 0.00 0.00 64.21 64.33 3dd0 n SER 259 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 3dd0 s PHE 260 N -1.92 0.60 0.00 7.33 -0.71 -1.26 -4.90 117.98 117.12 3dd0 s PHE 260 Ca 0.35 -1.11 0.00 0.00 -1.04 0.00 0.00 56.93 55.13 3dd0 s PHE 260 Cb 0.20 -0.41 0.00 0.00 -1.21 0.00 0.00 43.02 41.60 3dd0 s PHE 260 CO 0.31 -0.41 0.28 0.36 -1.34 0.00 0.00 175.22 174.42