#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dt6 s PRO 31 N 0.00 0.38 0.68 0.54 0.04 -1.25 -4.00 135.00 131.39 1dt6 s PRO 31 Ca 0.00 0.05 -0.17 0.00 0.04 0.00 0.00 61.00 60.92 1dt6 s PRO 31 Cb 0.00 -1.77 0.01 0.00 0.04 0.00 0.00 34.50 32.77 1dt6 s PRO 31 CO 0.00 -2.66 1.21 0.41 0.04 0.00 0.00 177.00 176.00 1dt6 n GLY 32 N -2.19 0.26 2.87 0.56 0.00 -1.26 -4.97 105.19 100.47 1dt6 n GLY 32 Ca 0.10 -0.24 -0.13 0.00 0.00 0.00 0.00 46.02 45.76 1dt6 n GLY 32 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1dt6 n PRO 33 N -2.10 -0.90 -3.54 1.61 -0.02 -1.26 -3.44 135.00 125.36 1dt6 n PRO 33 Ca 0.15 -0.61 -0.08 0.00 -2.02 0.00 0.00 63.50 60.94 1dt6 n PRO 33 Cb 0.49 -1.36 -0.03 0.00 -0.02 0.00 0.00 33.50 32.58 1dt6 n PRO 33 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 1dt6 s THR 34 N -2.01 0.00 -1.44 3.45 -1.32 -1.26 0.86 115.64 113.93 1dt6 s THR 34 Ca 0.28 0.00 -0.11 0.00 -1.21 0.00 0.00 61.69 60.65 1dt6 s THR 34 Cb -0.05 -1.00 -0.06 0.00 -1.51 0.00 0.00 72.50 69.89 1dt6 s THR 34 CO 0.23 0.00 2.60 -2.65 -2.21 0.00 0.00 174.62 172.60 1dt6 n PRO 35 N 0.05 3.14 0.00 7.08 -0.02 -1.26 -4.88 135.00 139.11 1dt6 n PRO 35 Ca -0.08 -2.18 0.00 0.00 -2.02 0.00 0.00 63.50 59.22 1dt6 n PRO 35 Cb 0.60 -2.88 0.00 0.00 -0.02 0.00 0.00 33.50 31.20 1dt6 n PRO 35 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1dt6 n PHE 36 N 4.54 0.00 0.00 6.00 3.01 -1.26 -4.92 117.46 124.83 1dt6 n PHE 36 Ca 0.66 0.00 0.00 0.00 1.01 0.00 0.00 57.45 59.12 1dt6 n PHE 36 Cb 0.27 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.74 1dt6 n PHE 36 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 1dt6 n PRO 37 N 0.78 0.64 0.00 -1.08 -0.04 -1.26 -4.99 135.00 129.06 1dt6 n PRO 37 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1dt6 n PRO 37 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 1dt6 n PRO 37 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1dt6 n ILE 38 N -1.36 0.00 0.00 0.52 5.41 0.02 -4.95 119.36 119.00 1dt6 n ILE 38 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 1dt6 n ILE 38 Cb 0.00 -0.01 0.00 0.00 -0.71 0.00 0.00 39.64 38.92 1dt6 n ILE 38 CO 0.00 0.00 0.00 2.30 0.00 0.00 0.00 176.55 178.85 1dt6 n ILE 39 N -0.80 0.00 -0.13 1.39 -5.35 -1.26 -4.91 119.36 108.31 1dt6 n ILE 39 Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.48 1dt6 n ILE 39 Cb 0.00 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 37.90 1dt6 n ILE 39 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1dt6 n GLY 40 N 0.00 0.82 0.00 3.28 0.00 -1.26 -5.04 105.19 102.99 1dt6 n GLY 40 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1dt6 n GLY 40 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1dt6 n ASN 41 N 0.00 0.00 0.00 1.61 0.23 -1.00 -4.63 115.26 111.46 1dt6 n ASN 41 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.05 1dt6 n ASN 41 Cb 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.70 1dt6 n ASN 41 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1dt6 n ILE 42 N -0.47 0.08 0.00 1.53 3.06 -0.76 -0.80 119.36 122.00 1dt6 n ILE 42 Ca 0.00 -0.12 0.00 0.00 -2.50 0.00 0.00 62.75 60.13 1dt6 n ILE 42 Cb 0.00 1.39 0.00 0.00 0.54 0.00 0.00 39.64 41.57 1dt6 n ILE 42 CO 0.00 0.00 0.00 0.18 -2.50 0.00 0.00 176.55 174.23 1dt6 n LEU 43 N -0.04 0.00 -0.37 9.51 4.32 -1.26 -3.06 117.00 126.10 1dt6 n LEU 43 Ca 0.00 0.04 -0.01 0.00 -0.02 0.00 0.00 56.01 56.02 1dt6 n LEU 43 Cb 0.34 -0.04 0.05 0.00 -1.62 0.00 0.00 43.42 42.14 1dt6 n LEU 43 CO 0.00 -0.04 0.58 0.00 -1.22 0.00 0.00 177.39 176.71 1dt6 n GLN 44 N -1.01 -0.22 -3.66 3.23 10.64 -1.26 -3.68 117.38 121.42 1dt6 n GLN 44 Ca 0.00 1.50 -0.28 0.00 -1.83 0.00 0.00 57.00 56.39 1dt6 n GLN 44 Cb 0.00 -2.23 -0.11 0.00 -0.86 0.00 0.00 30.24 27.04 1dt6 n GLN 44 CO 0.00 0.00 0.00 -1.50 -1.83 0.00 0.00 177.06 173.73 1dt6 s ILE 45 N -5.94 1.55 -0.15 -0.39 2.07 -1.17 -5.04 121.20 112.13 1dt6 s ILE 45 Ca -0.14 -3.26 -0.13 0.00 -1.41 0.00 0.00 60.65 55.71 1dt6 s ILE 45 Cb 0.20 -2.05 0.04 0.00 0.13 0.00 0.00 42.46 40.79 1dt6 s ILE 45 CO 0.70 -1.07 0.39 -1.81 -1.91 0.00 0.00 174.94 171.23 1dt6 s ASP 46 N -0.46 -0.41 0.00 4.50 1.01 -1.24 -4.92 116.67 115.15 1dt6 s ASP 46 Ca 0.26 0.78 0.00 0.00 0.71 0.00 0.00 52.55 54.31 1dt6 s ASP 46 Cb -0.05 0.79 0.00 0.00 1.01 0.00 0.00 42.92 44.66 1dt6 s ASP 46 CO -0.14 -0.14 0.00 0.00 0.21 0.00 0.00 175.17 175.10 1dt6 n ALA 47 N 2.93 0.00 -1.01 5.23 0.00 -1.26 -4.94 120.51 121.45 1dt6 n ALA 47 Ca -0.14 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.36 1dt6 n ALA 47 Cb 0.57 0.00 0.30 0.00 0.00 0.00 0.00 19.45 20.33 1dt6 n ALA 47 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1dt6 n LYS 48 N 0.00 3.52 -2.91 0.00 2.85 -1.26 -4.23 118.16 116.13 1dt6 n LYS 48 Ca 0.00 -2.99 -0.13 0.00 -1.05 0.00 0.00 58.31 54.14 1dt6 n LYS 48 Cb 0.00 -2.01 0.04 0.00 -0.65 0.00 0.00 35.03 32.41 1dt6 n LYS 48 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 1dt6 n ASP 49 N -0.19 -1.09 -0.34 -5.58 2.03 -1.26 -4.40 116.55 105.71 1dt6 n ASP 49 Ca 0.27 -3.43 0.18 0.00 0.52 0.00 0.00 54.79 52.33 1dt6 n ASP 49 Cb 1.06 0.92 0.35 0.00 -0.72 0.00 0.00 41.12 42.73 1dt6 n ASP 49 CO 0.00 0.00 0.00 -0.29 -1.92 0.00 0.00 177.20 174.99 1dt6 h ILE 50 N 2.21 0.01 -0.08 5.18 2.10 -1.94 1.14 117.51 126.14 1dt6 h ILE 50 Ca -0.02 -0.00 0.02 0.00 1.08 0.00 0.00 64.86 65.94 1dt6 h ILE 50 Cb 1.05 0.00 -0.00 0.00 -1.09 0.00 0.00 36.82 36.78 1dt6 h ILE 50 CO 0.28 0.00 0.08 -1.28 -1.08 0.00 0.00 178.15 176.15 1dt6 h SER 51 N 0.01 0.00 0.35 2.19 0.87 -1.96 0.23 113.55 115.24 1dt6 h SER 51 Ca 0.65 0.00 -0.14 0.00 -1.23 0.00 0.00 61.79 61.07 1dt6 h SER 51 Cb 1.44 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.39 1dt6 h SER 51 CO -0.90 0.00 -0.57 0.50 -0.53 0.00 0.00 176.83 175.33 1dt6 h LYS 52 N 0.00 0.23 0.00 2.24 3.11 0.92 -2.97 116.57 120.10 1dt6 h LYS 52 Ca 0.04 -0.15 0.00 0.00 -2.81 0.00 0.00 60.65 57.73 1dt6 h LYS 52 Cb 0.19 0.02 0.00 0.00 -1.00 0.00 0.00 32.23 31.44 1dt6 h LYS 52 CO -0.00 0.74 -1.67 -1.13 -2.81 0.00 0.00 179.45 174.58 1dt6 n SER 53 N -3.89 0.27 0.26 4.20 3.41 -0.49 -3.12 113.62 114.25 1dt6 n SER 53 Ca -0.02 -0.01 0.14 0.00 -0.26 0.00 0.00 58.87 58.71 1dt6 n SER 53 Cb 0.60 1.55 0.66 0.00 -0.26 0.00 0.00 64.21 66.75 1dt6 n SER 53 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1dt6 h LEU 54 N 0.00 0.00 0.00 1.04 3.38 -0.58 -0.49 115.31 118.67 1dt6 h LEU 54 Ca 0.00 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.78 1dt6 h LEU 54 Cb 0.95 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.67 1dt6 h LEU 54 CO 0.00 0.11 -1.25 0.74 0.09 0.00 0.00 178.44 178.14 1dt6 h THR 55 N 0.00 0.85 -0.17 0.22 2.02 -1.61 -1.82 112.91 112.41 1dt6 h THR 55 Ca -0.00 -2.45 -0.02 0.00 0.77 0.00 0.00 66.41 64.71 1dt6 h THR 55 Cb 0.51 2.34 -0.01 0.00 -1.74 0.00 0.00 68.15 69.25 1dt6 h THR 55 CO 0.01 0.49 0.04 0.11 0.37 0.00 0.00 175.52 176.54 1dt6 h LYS 56 N 0.00 0.27 -0.36 6.66 1.57 -1.26 -2.27 116.57 121.18 1dt6 h LYS 56 Ca -0.14 -0.07 0.03 0.00 -1.87 0.00 0.00 60.65 58.60 1dt6 h LYS 56 Cb 1.69 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 33.93 1dt6 h LYS 56 CO 0.07 0.41 0.17 0.74 -0.57 0.00 0.00 179.45 180.28 1dt6 h PHE 57 N 0.08 0.32 -0.54 -1.35 0.04 -1.15 -1.47 116.94 112.87 1dt6 h PHE 57 Ca 0.05 0.02 0.11 0.00 2.80 0.00 0.00 57.97 60.95 1dt6 h PHE 57 Cb 0.27 -0.09 -0.03 0.00 2.20 0.00 0.00 35.95 38.30 1dt6 h PHE 57 CO 0.01 0.17 0.37 0.66 -0.60 0.00 0.00 178.31 178.92 1dt6 h SER 58 N 0.36 0.22 0.00 2.17 4.64 -1.16 -0.13 113.55 119.65 1dt6 h SER 58 Ca 0.15 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 1dt6 h SER 58 Cb 0.07 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 1dt6 h SER 58 CO -0.11 0.13 0.00 -0.62 -0.87 0.00 0.00 176.83 175.36 1dt6 n GLU 59 N -4.45 0.15 0.00 4.77 1.02 -0.55 -1.84 120.64 119.74 1dt6 n GLU 59 Ca 0.09 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.23 1dt6 n GLU 59 Cb 0.44 -1.40 0.00 0.00 -0.02 0.00 0.00 31.44 30.46 1dt6 n GLU 59 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1dt6 h TYR 61 N 0.00 0.00 0.00 0.00 0.05 -1.64 -3.47 116.97 111.92 1dt6 h TYR 61 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1dt6 h TYR 61 Cb 0.00 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.74 1dt6 h TYR 61 CO 0.00 0.00 0.00 0.41 -1.05 0.00 0.00 178.16 177.52 1dt6 n GLY 62 N -1.86 -1.49 0.37 3.88 0.00 -0.76 -4.59 105.19 100.74 1dt6 n GLY 62 Ca 0.37 -2.08 0.19 0.00 0.00 0.00 0.00 46.02 44.51 1dt6 n GLY 62 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1dt6 h PRO 63 N 0.85 0.00 -4.03 1.61 0.13 -1.91 -3.38 132.00 125.27 1dt6 h PRO 63 Ca 0.00 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.60 1dt6 h PRO 63 Cb 0.00 0.00 -0.38 0.00 0.13 0.00 0.00 31.00 30.75 1dt6 h PRO 63 CO 0.00 0.00 -0.79 0.08 -0.23 0.00 0.00 178.00 177.06 1dt6 s VAL 64 N -4.87 0.94 0.22 1.56 1.01 -1.26 -0.09 120.40 117.92 1dt6 s VAL 64 Ca -0.05 -0.51 -0.03 0.00 0.00 0.00 0.00 61.98 61.39 1dt6 s VAL 64 Cb 0.18 -1.15 -0.03 0.00 0.00 0.00 0.00 36.38 35.38 1dt6 s VAL 64 CO 0.66 0.12 0.23 0.72 0.00 0.00 0.00 175.10 176.82 1dt6 s PHE 65 N 1.71 1.04 0.10 5.22 -0.12 -1.13 -4.31 117.98 120.48 1dt6 s PHE 65 Ca 0.01 -1.26 0.05 0.00 -0.05 0.00 0.00 56.93 55.67 1dt6 s PHE 65 Cb -0.15 -0.40 -0.03 0.00 -0.63 0.00 0.00 43.02 41.81 1dt6 s PHE 65 CO -0.07 -0.75 -0.12 0.95 -0.05 0.00 0.00 175.22 175.18 1dt6 s THR 66 N -4.04 1.07 0.30 -4.49 -4.23 0.25 0.78 115.64 105.28 1dt6 s THR 66 Ca 0.35 -1.56 0.02 0.00 -1.18 0.00 0.00 61.69 59.33 1dt6 s THR 66 Cb 0.05 -1.30 -0.04 0.00 1.34 0.00 0.00 72.50 72.54 1dt6 s THR 66 CO 0.13 -0.43 0.12 0.68 -0.54 0.00 0.00 174.62 174.58 1dt6 s VAL 67 N -2.03 0.51 -0.46 2.29 -7.23 -0.41 -4.06 120.40 109.00 1dt6 s VAL 67 Ca 0.04 -2.00 0.04 0.00 -1.81 0.00 0.00 61.98 58.25 1dt6 s VAL 67 Cb -0.05 -2.57 0.12 0.00 0.56 0.00 0.00 36.38 34.44 1dt6 s VAL 67 CO 0.01 0.00 0.19 -0.31 -0.31 0.00 0.00 175.10 174.68 1dt6 s TYR 68 N -3.61 3.39 -0.40 2.82 1.51 -1.26 -1.74 117.35 118.05 1dt6 s TYR 68 Ca 0.36 -3.10 -0.06 0.00 -1.01 0.00 0.00 57.07 53.25 1dt6 s TYR 68 Cb 0.06 -2.87 -0.18 0.00 -0.11 0.00 0.00 41.96 38.86 1dt6 s TYR 68 CO 0.15 -0.82 2.95 1.28 -1.11 0.00 0.00 175.55 178.01 1dt6 n LEU 69 N 3.52 5.22 0.00 -1.29 4.77 -1.23 -1.82 117.00 126.16 1dt6 n LEU 69 Ca 0.05 -3.04 0.00 0.00 -0.03 0.00 0.00 56.01 52.99 1dt6 n LEU 69 Cb 0.36 -1.24 0.00 0.00 -2.33 0.00 0.00 43.42 40.21 1dt6 n LEU 69 CO 0.30 1.38 0.00 0.61 -1.33 0.00 0.00 177.39 178.34 1dt6 n GLY 70 N 2.91 0.99 0.00 -0.72 0.00 -1.26 -4.68 105.19 102.43 1dt6 n GLY 70 Ca 0.45 -0.85 0.02 0.00 0.00 0.00 0.00 46.02 45.64 1dt6 n GLY 70 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1dt6 n MET 71 N 0.00 5.08 -4.00 1.61 2.81 -1.26 -2.39 117.12 118.98 1dt6 n MET 71 Ca 0.00 -0.00 -0.34 0.00 -1.81 0.00 0.00 57.70 55.55 1dt6 n MET 71 Cb 0.00 -0.75 -0.06 0.00 -0.71 0.00 0.00 33.22 31.70 1dt6 n MET 71 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 1dt6 s LYS 72 N -1.50 3.27 0.39 0.03 1.02 -1.26 -5.08 119.74 116.62 1dt6 s LYS 72 Ca 0.01 -0.36 -0.21 0.00 0.02 0.00 0.00 55.97 55.43 1dt6 s LYS 72 Cb 0.03 -3.01 -0.10 0.00 -0.52 0.00 0.00 37.83 34.23 1dt6 s LYS 72 CO 0.19 0.68 0.91 -1.25 -0.92 0.00 0.00 175.35 174.96 1dt6 s PRO 73 N -1.68 4.27 -0.23 -1.68 0.04 -1.26 -3.56 135.00 130.89 1dt6 s PRO 73 Ca 0.23 1.09 -0.03 0.00 0.04 0.00 0.00 61.00 62.33 1dt6 s PRO 73 Cb -0.12 -2.36 0.12 0.00 0.04 0.00 0.00 34.50 32.18 1dt6 s PRO 73 CO 0.14 0.07 0.29 -0.08 0.04 0.00 0.00 177.00 177.46 1dt6 s THR 74 N -2.02 -0.44 0.25 1.26 -1.32 -0.71 -3.45 115.64 109.21 1dt6 s THR 74 Ca 0.58 -0.17 -0.29 0.00 -1.21 0.00 0.00 61.69 60.59 1dt6 s THR 74 Cb -0.11 -0.79 -0.09 0.00 -1.51 0.00 0.00 72.50 70.00 1dt6 s THR 74 CO 0.16 -0.23 0.93 0.54 -2.21 0.00 0.00 174.62 173.81 1dt6 s VAL 75 N 2.41 4.11 -0.13 5.08 0.11 -0.67 -1.29 120.40 130.02 1dt6 s VAL 75 Ca 0.09 2.03 -0.04 0.00 -2.93 0.00 0.00 61.98 61.13 1dt6 s VAL 75 Cb -0.15 -4.27 -0.03 0.00 -1.53 0.00 0.00 36.38 30.40 1dt6 s VAL 75 CO -0.18 0.44 -0.01 -0.69 -3.33 0.00 0.00 175.10 171.34 1dt6 s VAL 76 N -1.25 4.21 -0.27 2.04 1.01 0.23 -2.77 120.40 123.60 1dt6 s VAL 76 Ca 0.42 -0.26 -0.08 0.00 0.00 0.00 0.00 61.98 62.06 1dt6 s VAL 76 Cb -0.25 -2.82 -0.02 0.00 0.00 0.00 0.00 36.38 33.29 1dt6 s VAL 76 CO 0.30 0.53 0.10 -0.76 0.00 0.00 0.00 175.10 175.28 1dt6 s LEU 77 N -0.13 3.71 -0.10 3.92 1.43 -0.81 -2.82 118.68 123.88 1dt6 s LEU 77 Ca 0.04 -0.34 -0.05 0.00 -1.03 0.00 0.00 54.13 52.74 1dt6 s LEU 77 Cb -0.13 -1.95 -0.04 0.00 0.03 0.00 0.00 46.19 44.10 1dt6 s LEU 77 CO 0.02 -0.10 -0.13 1.57 0.23 0.00 0.00 176.35 177.94 1dt6 n HIS 78 N 4.94 0.00 -0.49 0.29 -0.00 0.87 -1.54 115.22 119.29 1dt6 n HIS 78 Ca -0.15 0.00 -0.29 0.00 0.46 0.00 0.00 57.72 57.74 1dt6 n HIS 78 Cb 0.50 -0.36 0.24 0.00 -0.12 0.00 0.00 29.99 30.26 1dt6 n HIS 78 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1dt6 n GLY 79 N 2.38 -2.47 0.18 1.57 0.00 -1.26 -4.64 105.19 100.95 1dt6 n GLY 79 Ca -0.19 -1.14 -0.16 0.00 0.00 0.00 0.00 46.02 44.52 1dt6 n GLY 79 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1dt6 h TYR 80 N -2.69 0.79 -0.50 1.61 3.20 -1.95 -2.67 116.97 114.76 1dt6 h TYR 80 Ca -0.57 -0.35 0.02 0.00 3.14 0.00 0.00 58.73 60.97 1dt6 h TYR 80 Cb 1.33 -0.12 -0.03 0.00 1.54 0.00 0.00 36.73 39.44 1dt6 h TYR 80 CO -0.33 1.14 0.29 1.05 -1.64 0.00 0.00 178.16 178.67 1dt6 h GLU 81 N 0.21 0.57 -0.94 1.82 4.11 -1.99 0.08 114.58 118.43 1dt6 h GLU 81 Ca -0.04 -0.03 0.03 0.00 0.07 0.00 0.00 59.36 59.38 1dt6 h GLU 81 Cb 1.22 -0.13 -0.05 0.00 0.50 0.00 0.00 28.75 30.28 1dt6 h GLU 81 CO 0.12 0.37 0.62 0.00 0.07 0.00 0.00 179.01 180.19 1dt6 h ALA 82 N 1.22 1.23 0.10 1.06 0.00 -1.89 -1.15 119.26 119.82 1dt6 h ALA 82 Ca 0.20 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 1dt6 h ALA 82 Cb 0.03 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.47 1dt6 h ALA 82 CO -0.10 0.52 -0.05 0.28 0.00 0.00 0.00 179.25 179.91 1dt6 h VAL 83 N 1.22 1.14 0.32 0.00 2.07 -1.01 -2.24 116.25 117.75 1dt6 h VAL 83 Ca 0.37 -1.14 -0.01 0.00 0.82 0.00 0.00 66.70 66.74 1dt6 h VAL 83 Cb -0.05 1.84 -0.01 0.00 -1.52 0.00 0.00 31.29 31.55 1dt6 h VAL 83 CO -0.11 0.27 -0.23 0.50 0.02 0.00 0.00 177.57 178.02 1dt6 h LYS 84 N -0.68 -0.53 -0.87 1.57 1.63 -0.96 0.84 116.57 117.58 1dt6 h LYS 84 Ca -0.01 0.04 0.22 0.00 -0.85 0.00 0.00 60.65 60.04 1dt6 h LYS 84 Cb 0.53 0.12 -0.13 0.00 -0.60 0.00 0.00 32.23 32.15 1dt6 h LYS 84 CO 0.02 -0.35 0.29 1.49 -3.45 0.00 0.00 179.45 177.45 1dt6 h GLU 85 N -0.55 0.27 0.00 1.90 4.81 -1.30 1.30 114.58 121.02 1dt6 h GLU 85 Ca -0.03 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 1dt6 h GLU 85 Cb 0.47 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.79 1dt6 h GLU 85 CO 0.00 0.18 0.00 0.00 -0.73 0.00 0.00 179.01 178.47 1dt6 n ALA 86 N -2.62 -0.11 -0.33 2.92 0.00 -0.84 -2.01 120.51 117.52 1dt6 n ALA 86 Ca 0.21 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.78 1dt6 n ALA 86 Cb 0.65 0.00 0.32 0.00 0.00 0.00 0.00 19.45 20.42 1dt6 n ALA 86 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1dt6 h LEU 87 N 0.00 0.64 0.00 0.00 4.07 -0.67 -2.00 115.31 117.35 1dt6 h LEU 87 Ca 0.00 0.12 -0.03 0.00 0.08 0.00 0.00 57.88 58.05 1dt6 h LEU 87 Cb 0.00 0.02 -0.00 0.00 1.08 0.00 0.00 40.66 41.75 1dt6 h LEU 87 CO 0.00 0.17 -0.77 0.52 -1.08 0.00 0.00 178.44 177.27 1dt6 n VAL 88 N -4.87 1.45 -0.02 1.22 0.31 0.45 -4.18 118.33 112.69 1dt6 n VAL 88 Ca 0.23 0.16 -0.11 0.00 -0.01 0.00 0.00 64.34 64.62 1dt6 n VAL 88 Cb 0.62 -2.34 -0.05 0.00 -0.91 0.00 0.00 33.84 31.16 1dt6 n VAL 88 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 1dt6 h ASP 89 N -1.00 0.17 -2.01 4.52 3.45 -1.28 -3.06 116.42 117.21 1dt6 h ASP 89 Ca -0.04 -0.06 -0.75 0.00 0.43 0.00 0.00 57.03 56.61 1dt6 h ASP 89 Cb 0.75 -0.04 -0.30 0.00 -0.56 0.00 0.00 39.33 39.18 1dt6 h ASP 89 CO -0.02 0.18 0.76 0.18 -1.57 0.00 0.00 179.24 178.77 1dt6 n LEU 90 N -4.96 7.01 -0.24 1.55 4.32 -0.75 -4.88 117.00 119.05 1dt6 n LEU 90 Ca -0.05 -5.05 -0.09 0.00 -0.02 0.00 0.00 56.01 50.81 1dt6 n LEU 90 Cb 0.06 -0.99 -0.05 0.00 -1.62 0.00 0.00 43.42 40.82 1dt6 n LEU 90 CO 0.34 1.91 0.55 1.23 -1.22 0.00 0.00 177.39 180.20 1dt6 h GLY 91 N 3.22 -0.54 2.00 -0.72 0.00 -1.61 -1.13 103.07 104.28 1dt6 h GLY 91 Ca 0.51 0.61 -0.06 0.00 0.00 0.00 0.00 47.33 48.39 1dt6 h GLY 91 CO 1.28 -0.13 -0.29 0.83 0.00 0.00 0.00 176.54 178.23 1dt6 h GLU 92 N -0.20 0.00 0.21 4.80 4.39 -1.90 -3.24 114.58 118.65 1dt6 h GLU 92 Ca 0.18 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.87 1dt6 h GLU 92 Cb 0.55 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.20 1dt6 h GLU 92 CO -0.74 0.29 -0.10 0.93 -1.16 0.00 0.00 179.01 178.23 1dt6 h GLU 93 N 0.00 -0.28 -1.26 2.33 5.08 -1.75 -3.26 114.58 115.44 1dt6 h GLU 93 Ca -0.00 0.02 -0.48 0.00 -1.00 0.00 0.00 59.36 57.89 1dt6 h GLU 93 Cb 1.14 0.06 -0.21 0.00 0.50 0.00 0.00 28.75 30.24 1dt6 h GLU 93 CO 0.04 -0.04 0.63 1.19 -1.00 0.00 0.00 179.01 179.82 1dt6 n PHE 94 N -5.13 2.34 -2.71 4.33 3.72 -0.50 -1.77 117.46 117.74 1dt6 n PHE 94 Ca -0.09 -2.42 -0.33 0.00 -0.05 0.00 0.00 57.45 54.57 1dt6 n PHE 94 Cb 0.20 -1.17 -0.01 0.00 -0.94 0.00 0.00 39.48 37.56 1dt6 n PHE 94 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1dt6 n ALA 95 N -0.28 5.34 -3.00 4.37 0.00 -1.22 -4.69 120.51 121.03 1dt6 n ALA 95 Ca 0.45 -4.59 0.00 0.00 0.00 0.00 0.00 53.44 49.31 1dt6 n ALA 95 Cb 0.66 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.82 1dt6 n ALA 95 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dt6 n GLY 96 N -0.24 7.41 2.03 0.00 0.00 -0.13 -4.83 105.19 109.42 1dt6 n GLY 96 Ca 0.39 -1.94 0.00 0.00 0.00 0.00 0.00 46.02 44.47 1dt6 n GLY 96 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dt6 n ARG 97 N 0.00 0.00 -1.66 1.61 3.00 -1.25 -2.87 116.66 115.49 1dt6 n ARG 97 Ca 0.00 0.00 -0.00 0.00 -0.01 0.00 0.00 57.85 57.84 1dt6 n ARG 97 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 32.46 32.46 1dt6 n ARG 97 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1dt6 n GLY 98 N -0.55 -3.03 3.63 -0.13 0.00 -1.26 -3.94 105.19 99.91 1dt6 n GLY 98 Ca 0.00 -0.15 -0.07 0.00 0.00 0.00 0.00 46.02 45.80 1dt6 n GLY 98 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1dt6 s SER 99 N -0.21 -0.30 0.09 1.61 0.15 -1.26 -5.04 113.70 108.74 1dt6 s SER 99 Ca -0.00 -0.23 0.00 0.00 0.70 0.00 0.00 55.95 56.42 1dt6 s SER 99 Cb 0.00 0.48 0.00 0.00 -1.71 0.00 0.00 66.02 64.79 1dt6 s SER 99 CO 0.10 -0.84 0.00 1.33 1.20 0.00 0.00 173.24 175.03 1dt6 n VAL 100 N -0.38 0.51 0.00 4.45 0.24 -1.26 -4.95 118.33 116.94 1dt6 n VAL 100 Ca -0.08 0.17 0.00 0.00 -2.04 0.00 0.00 64.34 62.39 1dt6 n VAL 100 Cb 0.61 -1.26 0.00 0.00 -1.47 0.00 0.00 33.84 31.72 1dt6 n VAL 100 CO 0.00 0.00 0.00 -2.65 -2.14 0.00 0.00 176.83 172.04 1dt6 n PRO 101 N -3.22 0.00 -0.14 7.34 -0.02 -1.26 -0.74 135.00 136.96 1dt6 n PRO 101 Ca 0.00 0.25 0.13 0.00 -2.02 0.00 0.00 63.50 61.86 1dt6 n PRO 101 Cb 0.16 -0.43 0.21 0.00 -0.02 0.00 0.00 33.50 33.41 1dt6 n PRO 101 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 1dt6 n ILE 102 N -1.27 0.00 -2.98 4.25 2.08 -1.26 -1.26 119.36 118.92 1dt6 n ILE 102 Ca 0.00 0.49 -0.42 0.00 0.56 0.00 0.00 62.75 63.38 1dt6 n ILE 102 Cb 0.00 -0.85 0.01 0.00 -0.75 0.00 0.00 39.64 38.05 1dt6 n ILE 102 CO 0.00 0.00 0.00 0.18 0.56 0.00 0.00 176.55 177.29 1dt6 n LEU 103 N -2.24 6.39 -0.02 1.39 4.77 0.08 -4.73 117.00 122.65 1dt6 n LEU 103 Ca 0.11 -5.26 -0.03 0.00 -0.03 0.00 0.00 56.01 50.80 1dt6 n LEU 103 Cb 0.62 -1.21 -0.01 0.00 -2.33 0.00 0.00 43.42 40.48 1dt6 n LEU 103 CO 0.11 1.78 -0.62 -1.84 -1.33 0.00 0.00 177.39 175.49 1dt6 n GLU 104 N 1.07 0.08 -3.43 3.23 0.28 -0.39 -4.78 120.64 116.70 1dt6 n GLU 104 Ca 0.29 0.03 -0.44 0.00 -0.16 0.00 0.00 57.16 56.88 1dt6 n GLU 104 Cb 0.33 -0.75 -0.08 0.00 1.43 0.00 0.00 31.44 32.36 1dt6 n GLU 104 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 177.13 177.18 1dt6 s LYS 105 N -2.07 2.91 -0.36 3.44 2.47 -1.26 -4.58 119.74 120.30 1dt6 s LYS 105 Ca -0.05 -1.36 -0.05 0.00 -1.56 0.00 0.00 55.97 52.96 1dt6 s LYS 105 Cb 0.02 -4.06 0.05 0.00 -1.46 0.00 0.00 37.83 32.37 1dt6 s LYS 105 CO 0.07 -1.00 0.11 1.33 0.16 0.00 0.00 175.35 176.02 1dt6 n VAL 106 N 5.15 0.00 -3.28 4.02 0.24 -1.26 -4.79 118.33 118.41 1dt6 n VAL 106 Ca -0.12 0.00 -0.45 0.00 -2.04 0.00 0.00 64.34 61.73 1dt6 n VAL 106 Cb 0.44 -0.10 -0.01 0.00 -1.47 0.00 0.00 33.84 32.71 1dt6 n VAL 106 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1dt6 s SER 107 N -1.65 7.17 0.68 -1.34 0.15 -1.26 -5.05 113.70 112.39 1dt6 s SER 107 Ca 0.16 -3.31 -0.17 0.00 0.70 0.00 0.00 55.95 53.34 1dt6 s SER 107 Cb -0.09 -2.24 0.00 0.00 -1.71 0.00 0.00 66.02 61.98 1dt6 s SER 107 CO 0.20 -0.42 1.20 0.29 1.20 0.00 0.00 173.24 175.71 1dt6 n LYS 108 N 3.41 0.87 -0.59 5.44 4.76 -1.26 -4.30 118.16 126.48 1dt6 n LYS 108 Ca 0.23 0.35 -0.13 0.00 -2.87 0.00 0.00 58.31 55.89 1dt6 n LYS 108 Cb 0.41 -2.44 -0.05 0.00 -1.84 0.00 0.00 35.03 31.12 1dt6 n LYS 108 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1dt6 n GLY 109 N 0.94 2.53 3.81 0.72 0.00 -1.26 -4.78 105.19 107.14 1dt6 n GLY 109 Ca 0.15 -0.69 -0.29 0.00 0.00 0.00 0.00 46.02 45.18 1dt6 n GLY 109 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1dt6 s LEU 110 N 0.05 2.59 0.00 0.99 1.43 -1.26 -4.35 118.68 118.12 1dt6 s LEU 110 Ca 0.35 -1.41 0.00 0.00 -1.03 0.00 0.00 54.13 52.04 1dt6 s LEU 110 Cb 0.13 -1.01 0.00 0.00 0.03 0.00 0.00 46.19 45.33 1dt6 s LEU 110 CO -0.02 -0.89 0.00 0.61 0.23 0.00 0.00 176.35 176.29 1dt6 n GLY 111 N -1.44 -0.57 0.10 -3.19 0.00 -1.26 -4.81 105.19 94.02 1dt6 n GLY 111 Ca -0.10 -2.18 -0.12 0.00 0.00 0.00 0.00 46.02 43.62 1dt6 n GLY 111 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1dt6 n ILE 112 N 0.00 1.50 -3.05 -0.61 5.41 -1.26 -4.40 119.36 116.95 1dt6 n ILE 112 Ca 0.00 0.06 -0.40 0.00 1.00 0.00 0.00 62.75 63.41 1dt6 n ILE 112 Cb 0.00 -2.27 -0.05 0.00 -0.71 0.00 0.00 39.64 36.61 1dt6 n ILE 112 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1dt6 s ALA 113 N -2.83 3.40 0.09 -1.39 0.00 -1.26 -4.79 121.76 114.97 1dt6 s ALA 113 Ca -0.30 0.20 0.00 0.00 0.00 0.00 0.00 51.96 51.87 1dt6 s ALA 113 Cb 0.06 -2.92 0.00 0.00 0.00 0.00 0.00 23.12 20.25 1dt6 s ALA 113 CO 0.43 0.08 0.00 1.19 0.00 0.00 0.00 175.76 177.47 1dt6 n PHE 114 N 2.83 -1.72 0.00 0.00 0.99 -1.26 -5.04 117.46 113.26 1dt6 n PHE 114 Ca -0.04 1.00 0.00 0.00 -0.00 0.00 0.00 57.45 58.41 1dt6 n PHE 114 Cb 0.50 -2.51 0.00 0.00 -1.00 0.00 0.00 39.48 36.48 1dt6 n PHE 114 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.76 177.19 1dt6 n SER 115 N 0.45 0.00 -4.74 4.37 7.64 -1.26 -4.77 113.62 115.32 1dt6 n SER 115 Ca 0.00 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.47 1dt6 n SER 115 Cb 0.00 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.17 1dt6 n SER 115 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1dt6 s ASN 116 N 0.00 7.06 0.45 6.43 0.01 -1.26 -4.76 114.94 122.87 1dt6 s ASN 116 Ca 0.00 2.24 0.32 0.00 -0.71 0.00 0.00 52.86 54.71 1dt6 s ASN 116 Cb 0.00 -2.60 1.47 0.00 0.41 0.00 0.00 41.25 40.52 1dt6 s ASN 116 CO 0.00 -0.40 1.61 0.00 -1.51 0.00 0.00 177.10 176.80 1dt6 h ALA 117 N 5.39 2.85 -0.95 0.60 0.00 -1.94 0.26 119.26 125.47 1dt6 h ALA 117 Ca -0.44 0.10 0.26 0.00 0.00 0.00 0.00 54.91 54.83 1dt6 h ALA 117 Cb 1.21 0.21 -0.17 0.00 0.00 0.00 0.00 17.79 19.04 1dt6 h ALA 117 CO 0.75 -1.49 0.09 1.57 0.00 0.00 0.00 179.25 180.18 1dt6 h LYS 118 N 0.06 0.05 0.00 0.00 2.10 -1.97 -0.65 116.57 116.16 1dt6 h LYS 118 Ca 0.84 -0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 59.45 1dt6 h LYS 118 Cb 2.72 -0.01 -0.01 0.00 -0.90 0.00 0.00 32.23 34.03 1dt6 h LYS 118 CO -0.39 0.03 -1.67 2.41 -2.00 0.00 0.00 179.45 177.83 1dt6 n THR 119 N -5.42 0.13 0.00 0.07 -1.04 0.59 -4.56 114.28 104.05 1dt6 n THR 119 Ca 0.23 -0.35 0.00 0.00 -2.04 0.00 0.00 64.05 61.89 1dt6 n THR 119 Cb 0.75 0.06 0.00 0.00 -1.82 0.00 0.00 70.33 69.32 1dt6 n THR 119 CO 0.00 0.00 0.00 1.87 -0.64 0.00 0.00 175.07 176.30 1dt6 n TRP 120 N -2.05 0.00 -0.15 -1.42 -0.00 0.55 -0.66 117.44 113.70 1dt6 n TRP 120 Ca -0.05 0.00 0.10 0.00 -0.00 0.00 0.00 57.50 57.55 1dt6 n TRP 120 Cb 0.44 0.00 0.19 0.00 -0.00 0.00 0.00 31.31 31.94 1dt6 n TRP 120 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 177.69 179.32 1dt6 n LYS 121 N -0.19 -0.03 0.17 5.87 4.76 -0.85 0.33 118.16 128.21 1dt6 n LYS 121 Ca 0.00 0.65 -0.09 0.00 -2.87 0.00 0.00 58.31 56.00 1dt6 n LYS 121 Cb 0.00 -1.09 -0.05 0.00 -1.84 0.00 0.00 35.03 32.05 1dt6 n LYS 121 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 1dt6 h GLU 122 N 0.00 -0.48 0.00 1.97 4.39 -1.70 -1.47 114.58 117.29 1dt6 h GLU 122 Ca 0.32 0.03 -0.00 0.00 0.34 0.00 0.00 59.36 60.05 1dt6 h GLU 122 Cb 0.76 0.11 -0.00 0.00 -0.10 0.00 0.00 28.75 29.52 1dt6 h GLU 122 CO -0.39 -0.25 -0.01 0.52 -1.16 0.00 0.00 179.01 177.73 1dt6 h MET 123 N -1.08 0.00 0.13 2.33 2.86 0.20 -1.53 114.93 117.84 1dt6 h MET 123 Ca -0.05 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.58 1dt6 h MET 123 Cb 0.46 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.12 1dt6 h MET 123 CO 0.08 0.01 -0.06 -0.09 1.06 0.00 0.00 176.91 177.91 1dt6 h ARG 124 N 0.00 -0.16 -0.58 1.72 2.43 -0.15 -2.82 114.38 114.82 1dt6 h ARG 124 Ca -0.00 0.01 0.08 0.00 -0.81 0.00 0.00 59.98 59.26 1dt6 h ARG 124 Cb 0.19 0.04 -0.10 0.00 -0.42 0.00 0.00 29.97 29.67 1dt6 h ARG 124 CO 0.00 0.01 -0.49 -0.09 -1.51 0.00 0.00 179.97 177.89 1dt6 h ARG 125 N -1.03 -0.25 -0.84 0.20 1.12 -1.00 0.46 114.38 113.05 1dt6 h ARG 125 Ca -0.02 0.02 0.16 0.00 -1.11 0.00 0.00 59.98 59.03 1dt6 h ARG 125 Cb 0.25 0.06 -0.06 0.00 -0.01 0.00 0.00 29.97 30.20 1dt6 h ARG 125 CO 0.03 -0.16 0.55 0.35 -3.11 0.00 0.00 179.97 177.63 1dt6 h PHE 126 N -0.25 0.61 -0.03 2.20 3.04 -1.42 -1.95 116.94 119.14 1dt6 h PHE 126 Ca 0.15 0.02 -0.02 0.00 3.98 0.00 0.00 57.97 62.10 1dt6 h PHE 126 Cb 0.56 -0.19 0.00 0.00 2.56 0.00 0.00 35.95 38.88 1dt6 h PHE 126 CO -0.75 0.21 -0.05 0.77 -2.02 0.00 0.00 178.31 176.47 1dt6 h SER 127 N 0.50 0.09 -0.72 0.41 0.02 0.02 -2.37 113.55 111.50 1dt6 h SER 127 Ca 0.42 -0.56 0.08 0.00 -0.84 0.00 0.00 61.79 60.90 1dt6 h SER 127 Cb 0.89 -0.03 -0.05 0.00 0.14 0.00 0.00 62.40 63.36 1dt6 h SER 127 CO -0.16 0.64 0.47 -0.07 -1.14 0.00 0.00 176.83 176.57 1dt6 h LEU 128 N -0.45 0.59 0.00 5.07 3.38 0.01 -0.85 115.31 123.06 1dt6 h LEU 128 Ca 0.00 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 1dt6 h LEU 128 Cb 0.62 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.25 1dt6 h LEU 128 CO 0.01 0.37 -0.01 0.24 0.09 0.00 0.00 178.44 179.14 1dt6 h MET 129 N 0.66 0.00 0.00 1.13 2.86 -1.42 -3.33 114.93 114.82 1dt6 h MET 129 Ca 0.32 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.96 1dt6 h MET 129 Cb 0.40 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.06 1dt6 h MET 129 CO -0.11 0.09 0.00 1.79 1.06 0.00 0.00 176.91 179.74 1dt6 h THR 130 N -1.00 0.00 -0.32 2.22 1.35 -1.43 -1.15 112.91 112.58 1dt6 h THR 130 Ca -0.00 -0.14 -0.01 0.00 -0.55 0.00 0.00 66.41 65.71 1dt6 h THR 130 Cb 0.10 1.13 -0.01 0.00 -1.73 0.00 0.00 68.15 67.65 1dt6 h THR 130 CO -0.00 0.00 0.01 0.18 -0.25 0.00 0.00 175.52 175.46 1dt6 n LEU 131 N -3.07 3.63 -4.82 3.87 4.77 -0.33 -4.28 117.00 116.77 1dt6 n LEU 131 Ca -0.02 -1.84 -0.33 0.00 -0.03 0.00 0.00 56.01 53.79 1dt6 n LEU 131 Cb 0.13 -0.61 -0.07 0.00 -2.33 0.00 0.00 43.42 40.55 1dt6 n LEU 131 CO 0.22 0.47 0.61 -0.13 -1.33 0.00 0.00 177.39 177.22 1dt6 s ARG 132 N -1.95 4.21 0.42 3.23 0.52 -0.44 -4.80 118.95 120.15 1dt6 s ARG 132 Ca 0.30 1.05 0.28 0.00 -0.52 0.00 0.00 55.73 56.84 1dt6 s ARG 132 Cb 0.23 -2.27 1.41 0.00 0.52 0.00 0.00 34.95 34.84 1dt6 s ARG 132 CO 0.08 0.03 1.60 -0.97 0.02 0.00 0.00 175.30 176.06 1dt6 h ASN 133 N 2.07 0.26 -0.08 0.23 -0.00 -1.89 0.23 115.58 116.40 1dt6 h ASN 133 Ca -0.49 0.17 -0.05 0.00 -0.00 0.00 0.00 56.30 55.94 1dt6 h ASN 133 Cb 1.18 0.17 -0.03 0.00 -0.00 0.00 0.00 38.32 39.63 1dt6 h ASN 133 CO 0.62 -0.26 -0.47 0.49 -0.00 0.00 0.00 177.43 177.82 1dt6 n PHE 134 N -4.85 0.26 0.16 0.67 3.72 -1.26 -0.63 117.46 115.54 1dt6 n PHE 134 Ca 0.38 -1.55 -0.01 0.00 -0.05 0.00 0.00 57.45 56.22 1dt6 n PHE 134 Cb 1.42 -0.28 0.14 0.00 -0.94 0.00 0.00 39.48 39.82 1dt6 n PHE 134 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1dt6 n GLY 135 N -1.10 2.39 2.69 1.37 0.00 0.81 -4.08 105.19 107.27 1dt6 n GLY 135 Ca 0.22 -0.41 -0.07 0.00 0.00 0.00 0.00 46.02 45.76 1dt6 n GLY 135 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1dt6 n MET 136 N 0.14 1.21 0.00 1.61 2.81 -1.26 -4.65 117.12 116.98 1dt6 n MET 136 Ca 0.15 -2.29 0.00 0.00 -1.81 0.00 0.00 57.70 53.76 1dt6 n MET 136 Cb 0.75 -0.44 0.00 0.00 -0.71 0.00 0.00 33.22 32.82 1dt6 n MET 136 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1dt6 n GLY 137 N -0.49 -1.99 0.27 3.03 0.00 -1.24 -4.36 105.19 100.41 1dt6 n GLY 137 Ca 0.00 -1.40 0.11 0.00 0.00 0.00 0.00 46.02 44.74 1dt6 n GLY 137 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1dt6 h LYS 138 N 0.00 0.00 -5.26 1.61 1.57 -1.91 -3.37 116.57 109.21 1dt6 h LYS 138 Ca 0.00 0.00 -0.67 0.00 -1.87 0.00 0.00 60.65 58.11 1dt6 h LYS 138 Cb 0.00 0.00 -0.16 0.00 0.08 0.00 0.00 32.23 32.15 1dt6 h LYS 138 CO 0.00 0.07 1.02 0.50 -0.57 0.00 0.00 179.45 180.46 1dt6 s ARG 139 N -4.59 3.62 0.96 3.15 3.52 -1.26 -5.00 118.95 119.35 1dt6 s ARG 139 Ca -0.04 -1.66 -0.12 0.00 -0.13 0.00 0.00 55.73 53.78 1dt6 s ARG 139 Cb 0.15 -5.03 0.12 0.00 -1.56 0.00 0.00 34.95 28.64 1dt6 s ARG 139 CO 0.60 -1.87 0.83 -1.13 -0.81 0.00 0.00 175.30 172.93 1dt6 n SER 140 N 7.04 -0.79 0.18 -2.12 3.41 -1.26 -4.83 113.62 115.25 1dt6 n SER 140 Ca 0.27 0.31 0.03 0.00 -0.26 0.00 0.00 58.87 59.22 1dt6 n SER 140 Cb 0.49 -1.34 0.41 0.00 -0.26 0.00 0.00 64.21 63.51 1dt6 n SER 140 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 1dt6 h ILE 141 N -1.88 1.20 -0.78 -1.33 2.04 -1.16 -2.19 117.51 113.40 1dt6 h ILE 141 Ca -0.45 -0.95 -0.05 0.00 1.00 0.00 0.00 64.86 64.41 1dt6 h ILE 141 Cb 1.28 1.47 -0.03 0.00 -0.74 0.00 0.00 36.82 38.80 1dt6 h ILE 141 CO 0.39 0.28 0.31 -0.08 0.00 0.00 0.00 178.15 179.05 1dt6 h GLU 142 N 0.05 1.18 -0.79 2.37 4.81 -1.91 0.24 114.58 120.53 1dt6 h GLU 142 Ca 0.01 -0.22 -0.03 0.00 -0.13 0.00 0.00 59.36 58.99 1dt6 h GLU 142 Cb 0.49 -0.19 -0.04 0.00 0.63 0.00 0.00 28.75 29.64 1dt6 h GLU 142 CO 0.04 0.96 0.36 -0.44 -0.73 0.00 0.00 179.01 179.19 1dt6 h ASP 143 N 1.14 1.04 -0.65 1.04 3.32 -1.75 0.58 116.42 121.14 1dt6 h ASP 143 Ca 0.26 -0.14 -0.08 0.00 0.02 0.00 0.00 57.03 57.08 1dt6 h ASP 143 Cb 0.22 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.48 1dt6 h ASP 143 CO -0.02 0.90 0.08 0.03 -1.72 0.00 0.00 179.24 178.51 1dt6 h ARG 144 N 1.12 1.10 -0.56 3.56 3.08 -0.83 0.08 114.38 121.92 1dt6 h ARG 144 Ca 0.27 -0.31 -0.09 0.00 0.07 0.00 0.00 59.98 59.93 1dt6 h ARG 144 Cb 0.14 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.05 1dt6 h ARG 144 CO -0.03 1.02 0.01 0.82 -1.07 0.00 0.00 179.97 180.72 1dt6 h ILE 145 N 1.01 1.26 -0.49 2.04 1.08 -0.15 -2.79 117.51 119.47 1dt6 h ILE 145 Ca 0.20 -1.09 -0.06 0.00 -0.39 0.00 0.00 64.86 63.51 1dt6 h ILE 145 Cb 0.47 0.81 -0.02 0.00 -3.07 0.00 0.00 36.82 35.01 1dt6 h ILE 145 CO 0.02 0.39 0.05 1.56 -0.69 0.00 0.00 178.15 179.48 1dt6 h GLN 146 N 0.89 0.78 -0.06 2.37 4.20 -0.28 -0.99 115.11 122.02 1dt6 h GLN 146 Ca 0.16 -0.18 -0.01 0.00 0.06 0.00 0.00 58.65 58.68 1dt6 h GLN 146 Cb 0.51 -0.10 -0.00 0.00 0.30 0.00 0.00 27.48 28.18 1dt6 h GLN 146 CO 0.02 0.75 -0.02 1.49 -0.67 0.00 0.00 178.83 180.41 1dt6 h GLU 147 N 0.74 0.11 -0.97 1.46 4.81 -0.77 -2.75 114.58 117.21 1dt6 h GLU 147 Ca 0.15 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.35 1dt6 h GLU 147 Cb 0.37 -0.01 -0.05 0.00 0.63 0.00 0.00 28.75 29.70 1dt6 h GLU 147 CO 0.01 0.46 0.63 1.49 -0.73 0.00 0.00 179.01 180.87 1dt6 h GLU 148 N -0.25 1.29 -0.81 1.92 4.57 -1.41 -1.63 114.58 118.25 1dt6 h GLU 148 Ca 0.01 -0.09 0.14 0.00 -1.18 0.00 0.00 59.36 58.25 1dt6 h GLU 148 Cb 0.42 -0.29 -0.06 0.00 -0.16 0.00 0.00 28.75 28.66 1dt6 h GLU 148 CO 0.01 0.87 0.53 0.00 -1.18 0.00 0.00 179.01 179.24 1dt6 h ALA 149 N 1.37 1.95 -0.06 2.92 0.00 -1.02 0.65 119.26 125.08 1dt6 h ALA 149 Ca 0.35 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.24 1dt6 h ALA 149 Cb -0.13 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 1dt6 h ALA 149 CO -0.07 -0.17 -0.09 0.00 0.00 0.00 0.00 179.25 178.92 1dt6 h ARG 150 N 0.57 0.16 -0.69 0.00 3.08 -1.02 -1.78 114.38 114.70 1dt6 h ARG 150 Ca 0.40 -0.10 0.07 0.00 0.07 0.00 0.00 59.98 60.42 1dt6 h ARG 150 Cb 0.74 0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.76 1dt6 h ARG 150 CO -0.16 0.66 0.46 0.00 -1.07 0.00 0.00 179.97 179.86 1dt6 h LEU 152 N 0.68 0.62 -0.52 0.00 5.85 0.38 -2.19 115.31 120.13 1dt6 h LEU 152 Ca 0.30 -0.40 -0.04 0.00 0.84 0.00 0.00 57.88 58.58 1dt6 h LEU 152 Cb 0.32 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.15 1dt6 h LEU 152 CO -0.10 0.88 0.16 0.58 -0.34 0.00 0.00 178.44 179.62 1dt6 h VAL 153 N 0.36 1.23 0.51 1.05 2.07 -0.60 -1.50 116.25 119.37 1dt6 h VAL 153 Ca 0.07 -0.78 -0.02 0.00 0.82 0.00 0.00 66.70 66.79 1dt6 h VAL 153 Cb 0.63 0.76 -0.01 0.00 -1.52 0.00 0.00 31.29 31.15 1dt6 h VAL 153 CO 0.04 0.29 -0.37 -0.08 0.02 0.00 0.00 177.57 177.47 1dt6 h GLU 154 N 0.71 -0.81 0.00 1.57 4.57 -0.98 -1.50 114.58 118.14 1dt6 h GLU 154 Ca 0.17 0.06 -0.00 0.00 -1.18 0.00 0.00 59.36 58.40 1dt6 h GLU 154 Cb 0.28 0.18 -0.00 0.00 -0.16 0.00 0.00 28.75 29.05 1dt6 h GLU 154 CO -0.01 -0.54 -0.00 0.93 -1.18 0.00 0.00 179.01 178.21 1dt6 h GLU 155 N -0.84 0.00 -0.00 1.92 4.39 -1.42 0.73 114.58 119.35 1dt6 h GLU 155 Ca -0.07 0.00 -0.15 0.00 0.34 0.00 0.00 59.36 59.48 1dt6 h GLU 155 Cb 0.69 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.32 1dt6 h GLU 155 CO 0.03 0.00 -0.72 -0.07 -1.16 0.00 0.00 179.01 177.10 1dt6 h LEU 156 N 0.00 0.03 -0.35 1.33 3.38 -0.83 -3.05 115.31 115.82 1dt6 h LEU 156 Ca -0.00 -0.02 -0.06 0.00 0.09 0.00 0.00 57.88 57.89 1dt6 h LEU 156 Cb 0.06 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1dt6 h LEU 156 CO 0.00 0.73 -0.03 0.03 0.09 0.00 0.00 178.44 179.27 1dt6 h ARG 157 N 0.02 0.63 0.00 1.13 3.08 0.15 -2.50 114.38 116.88 1dt6 h ARG 157 Ca -0.01 -0.22 0.00 0.00 0.07 0.00 0.00 59.98 59.83 1dt6 h ARG 157 Cb 1.27 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 31.27 1dt6 h ARG 157 CO 0.10 0.77 0.00 1.63 -1.07 0.00 0.00 179.97 181.39 1dt6 n LYS 158 N -4.48 0.00 0.00 0.04 5.02 -0.75 -0.67 118.16 117.32 1dt6 n LYS 158 Ca -0.02 0.05 0.12 0.00 -2.02 0.00 0.00 58.31 56.44 1dt6 n LYS 158 Cb 0.30 -1.50 0.56 0.00 -0.02 0.00 0.00 35.03 34.36 1dt6 n LYS 158 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 1dt6 n THR 159 N -1.02 0.28 -2.08 -0.18 -1.04 -0.94 -4.88 114.28 104.42 1dt6 n THR 159 Ca 0.00 0.07 -0.10 0.00 -2.04 0.00 0.00 64.05 61.99 1dt6 n THR 159 Cb 0.00 -0.66 -0.02 0.00 -1.82 0.00 0.00 70.33 67.84 1dt6 n THR 159 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1dt6 n ASN 160 N -1.41 -3.01 -2.62 8.00 3.02 0.15 -1.63 115.26 117.75 1dt6 n ASN 160 Ca 0.08 0.25 -0.21 0.00 -0.03 0.00 0.00 54.58 54.68 1dt6 n ASN 160 Cb 0.25 -2.70 0.02 0.00 -0.61 0.00 0.00 39.78 36.74 1dt6 n ASN 160 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1dt6 n ALA 161 N -1.52 -0.79 -2.54 5.41 0.00 -1.26 -5.01 120.51 114.80 1dt6 n ALA 161 Ca -0.11 0.23 -0.20 0.00 0.00 0.00 0.00 53.44 53.36 1dt6 n ALA 161 Cb 0.50 -3.09 -0.02 0.00 0.00 0.00 0.00 19.45 16.84 1dt6 n ALA 161 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1dt6 s SER 162 N -2.47 5.64 0.77 0.00 0.15 -0.65 -4.73 113.70 112.42 1dt6 s SER 162 Ca 0.17 -0.32 -0.15 0.00 0.70 0.00 0.00 55.95 56.35 1dt6 s SER 162 Cb -0.08 -1.16 0.02 0.00 -1.71 0.00 0.00 66.02 63.09 1dt6 s SER 162 CO 0.21 -0.35 0.86 -2.65 1.20 0.00 0.00 173.24 172.51 1dt6 n PRO 163 N -1.47 0.28 -3.49 5.44 -0.02 -1.26 -4.20 135.00 130.28 1dt6 n PRO 163 Ca -0.02 0.15 -0.09 0.00 -2.02 0.00 0.00 63.50 61.52 1dt6 n PRO 163 Cb 0.59 -2.14 -0.02 0.00 -0.02 0.00 0.00 33.50 31.91 1dt6 n PRO 163 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1dt6 s ASP 165 N -2.50 5.38 0.39 0.00 3.68 -1.26 0.26 116.67 122.62 1dt6 s ASP 165 Ca 0.04 -1.42 0.28 0.00 2.13 0.00 0.00 52.55 53.58 1dt6 s ASP 165 Cb -0.01 -1.89 1.35 0.00 -1.45 0.00 0.00 42.92 40.92 1dt6 s ASP 165 CO -0.09 -0.43 1.85 1.55 0.13 0.00 0.00 175.17 178.18 1dt6 h PRO 166 N 8.23 0.00 -1.12 4.34 0.14 -1.92 -3.30 132.00 138.38 1dt6 h PRO 166 Ca -0.21 0.00 0.36 0.00 0.14 0.00 0.00 66.00 66.29 1dt6 h PRO 166 Cb 1.07 0.00 -0.14 0.00 0.14 0.00 0.00 31.00 32.08 1dt6 h PRO 166 CO 0.66 0.00 0.68 1.15 0.14 0.00 0.00 178.00 180.63 1dt6 h THR 167 N 0.00 0.25 0.00 1.56 2.02 -1.93 -1.23 112.91 113.58 1dt6 h THR 167 Ca 0.00 -0.08 0.00 0.00 0.77 0.00 0.00 66.41 67.10 1dt6 h THR 167 Cb 0.21 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.62 1dt6 h THR 167 CO 0.00 0.04 0.00 0.33 0.37 0.00 0.00 175.52 176.26 1dt6 n PHE 168 N -4.88 0.00 -0.26 3.16 -0.00 -1.24 -3.46 117.46 110.78 1dt6 n PHE 168 Ca 0.33 0.00 0.27 0.00 -0.00 0.00 0.00 57.45 58.05 1dt6 n PHE 168 Cb 1.14 -0.23 0.63 0.00 -0.00 0.00 0.00 39.48 41.03 1dt6 n PHE 168 CO 0.00 0.00 0.00 0.97 -0.00 0.00 0.00 176.76 177.73 1dt6 h ILE 169 N 0.00 0.54 0.00 -2.13 2.10 -1.82 0.34 117.51 116.53 1dt6 h ILE 169 Ca 0.00 -0.06 0.00 0.00 1.08 0.00 0.00 64.86 65.88 1dt6 h ILE 169 Cb 0.00 0.34 0.00 0.00 -1.09 0.00 0.00 36.82 36.07 1dt6 h ILE 169 CO 0.00 0.03 0.00 0.25 -1.08 0.00 0.00 178.15 177.35 1dt6 h LEU 170 N 0.18 0.00 0.00 2.19 5.85 -1.36 -1.24 115.31 120.92 1dt6 h LEU 170 Ca 0.51 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.23 1dt6 h LEU 170 Cb 1.68 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.71 1dt6 h LEU 170 CO -0.12 0.00 -1.57 0.61 -0.34 0.00 0.00 178.44 177.03 1dt6 n GLY 171 N 0.07 -1.01 0.09 3.75 0.00 0.11 -4.28 105.19 103.92 1dt6 n GLY 171 Ca 0.02 -0.55 -0.12 0.00 0.00 0.00 0.00 46.02 45.37 1dt6 n GLY 171 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dt6 h ALA 173 N 0.09 -0.34 -0.58 0.00 0.00 -1.61 -1.64 119.26 115.19 1dt6 h ALA 173 Ca -0.01 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 1dt6 h ALA 173 Cb 0.60 0.58 -0.03 0.00 0.00 0.00 0.00 17.79 18.94 1dt6 h ALA 173 CO 0.01 -0.78 0.26 -1.35 0.00 0.00 0.00 179.25 177.40 1dt6 h PRO 174 N -0.38 0.82 -0.61 0.00 0.11 -1.75 -1.47 132.00 128.73 1dt6 h PRO 174 Ca 0.10 -0.11 -0.08 0.00 0.11 0.00 0.00 66.00 66.02 1dt6 h PRO 174 Cb 0.53 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 31.46 1dt6 h PRO 174 CO -0.35 0.65 0.06 0.00 -0.21 0.00 0.00 178.00 178.15 1dt6 h ASN 176 N 0.94 0.55 -0.07 0.00 2.35 -0.91 -0.44 115.58 118.00 1dt6 h ASN 176 Ca 0.18 -0.21 0.01 0.00 -0.55 0.00 0.00 56.30 55.73 1dt6 h ASN 176 Cb 0.47 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.68 1dt6 h ASN 176 CO 0.02 0.83 0.01 0.58 -1.65 0.00 0.00 177.43 177.22 1dt6 h VAL 177 N 0.46 0.97 0.00 2.81 2.07 -1.01 0.86 116.25 122.41 1dt6 h VAL 177 Ca 0.06 -0.02 -0.07 0.00 0.82 0.00 0.00 66.70 67.49 1dt6 h VAL 177 Cb 0.76 0.92 -0.01 0.00 -1.52 0.00 0.00 31.29 31.44 1dt6 h VAL 177 CO 0.06 0.01 -0.32 0.40 0.02 0.00 0.00 177.57 177.74 1dt6 h ILE 178 N 0.05 1.01 -0.39 4.57 2.04 -1.40 0.08 117.51 123.47 1dt6 h ILE 178 Ca 0.03 -1.20 -0.06 0.00 1.00 0.00 0.00 64.86 64.64 1dt6 h ILE 178 Cb 0.02 1.69 -0.01 0.00 -0.74 0.00 0.00 36.82 37.78 1dt6 h ILE 178 CO -0.04 0.32 0.01 0.00 0.00 0.00 0.00 178.15 178.44 1dt6 h SER 180 N 0.51 0.86 0.45 0.00 0.87 0.17 0.39 113.55 116.80 1dt6 h SER 180 Ca 0.11 -0.21 0.00 0.00 -1.23 0.00 0.00 61.79 60.46 1dt6 h SER 180 Cb 0.45 -0.23 0.00 0.00 -0.44 0.00 0.00 62.40 62.18 1dt6 h SER 180 CO 0.02 0.85 -0.04 1.33 -0.53 0.00 0.00 176.83 178.46 1dt6 n VAL 181 N -4.40 0.00 -0.01 2.23 0.24 -0.08 -2.34 118.33 113.97 1dt6 n VAL 181 Ca 0.03 -0.02 0.01 0.00 -2.04 0.00 0.00 64.34 62.32 1dt6 n VAL 181 Cb 0.21 -0.37 -0.03 0.00 -1.47 0.00 0.00 33.84 32.19 1dt6 n VAL 181 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 1dt6 n ILE 182 N -1.16 0.08 -0.01 1.34 5.41 -0.88 -1.84 119.36 122.29 1dt6 n ILE 182 Ca 0.15 -0.10 -0.01 0.00 1.00 0.00 0.00 62.75 63.79 1dt6 n ILE 182 Cb 0.24 -0.04 -0.01 0.00 -0.71 0.00 0.00 39.64 39.12 1dt6 n ILE 182 CO 0.00 0.00 0.00 0.49 0.00 0.00 0.00 176.55 177.04 1dt6 n PHE 183 N -1.79 0.00 0.00 1.39 0.99 0.11 -3.65 117.46 114.51 1dt6 n PHE 183 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.43 1dt6 n PHE 183 Cb 0.27 -0.07 0.00 0.00 -1.00 0.00 0.00 39.48 38.68 1dt6 n PHE 183 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.76 178.34 1dt6 n HIS 184 N -2.33 0.00 -3.64 1.38 -0.00 -0.99 -4.98 115.22 104.67 1dt6 n HIS 184 Ca -0.03 0.00 -0.20 0.00 -0.00 0.00 0.00 57.72 57.49 1dt6 n HIS 184 Cb 0.54 0.00 -0.03 0.00 -0.00 0.00 0.00 29.99 30.51 1dt6 n HIS 184 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 1dt6 s ASN 185 N -1.91 5.40 0.11 0.26 2.47 -1.26 -4.86 114.94 115.15 1dt6 s ASN 185 Ca 0.00 -0.48 0.02 0.00 0.42 0.00 0.00 52.86 52.82 1dt6 s ASN 185 Cb 0.00 -0.92 -0.04 0.00 -1.45 0.00 0.00 41.25 38.84 1dt6 s ASN 185 CO 0.00 -0.46 -0.06 0.00 -3.72 0.00 0.00 177.10 172.86 1dt6 s ARG 186 N -4.08 0.88 0.34 0.43 1.70 -1.26 -2.51 118.95 114.44 1dt6 s ARG 186 Ca 0.44 -1.37 0.09 0.00 -0.47 0.00 0.00 55.73 54.43 1dt6 s ARG 186 Cb -0.06 -0.24 -0.06 0.00 -0.57 0.00 0.00 34.95 34.02 1dt6 s ARG 186 CO 0.28 -0.03 -0.06 -0.06 -1.08 0.00 0.00 175.30 174.36 1dt6 s PHE 187 N -3.61 2.46 0.35 5.89 0.40 -1.26 -5.08 117.98 117.13 1dt6 s PHE 187 Ca 0.14 -0.45 -0.25 0.00 -0.60 0.00 0.00 56.93 55.76 1dt6 s PHE 187 Cb 0.05 -1.39 -0.10 0.00 0.51 0.00 0.00 43.02 42.09 1dt6 s PHE 187 CO -0.03 0.55 0.99 0.34 0.70 0.00 0.00 175.22 177.77 1dt6 s ASP 188 N -3.65 7.12 0.00 1.36 -1.08 -1.26 -4.91 116.67 114.25 1dt6 s ASP 188 Ca 0.33 1.92 0.15 0.00 -0.52 0.00 0.00 52.55 54.43 1dt6 s ASP 188 Cb 0.01 -2.58 0.74 0.00 -1.46 0.00 0.00 42.92 39.62 1dt6 s ASP 188 CO 0.18 -0.23 1.41 -1.22 0.52 0.00 0.00 175.17 175.83 1dt6 n TYR 189 N 0.31 0.00 0.38 -5.34 0.53 -1.26 -1.59 117.16 110.19 1dt6 n TYR 189 Ca 0.03 0.00 0.06 0.00 -1.02 0.00 0.00 57.90 56.97 1dt6 n TYR 189 Cb 0.50 -0.30 -0.08 0.00 -1.03 0.00 0.00 39.34 38.43 1dt6 n TYR 189 CO 0.00 0.00 0.00 1.63 -1.02 0.00 0.00 176.86 177.47 1dt6 n LYS 190 N -1.30 2.15 -1.67 -0.72 4.01 -1.26 -4.91 118.16 114.46 1dt6 n LYS 190 Ca 0.07 -0.04 -0.43 0.00 -0.51 0.00 0.00 58.31 57.40 1dt6 n LYS 190 Cb 0.12 -1.14 -0.03 0.00 -0.51 0.00 0.00 35.03 33.47 1dt6 n LYS 190 CO 0.00 0.00 0.00 0.34 -1.11 0.00 0.00 177.40 176.63 1dt6 s ASP 191 N -2.56 5.79 0.13 4.39 3.68 -0.62 -4.92 116.67 122.55 1dt6 s ASP 191 Ca 0.02 2.06 -0.30 0.00 2.13 0.00 0.00 52.55 56.46 1dt6 s ASP 191 Cb 0.09 -2.52 -0.09 0.00 -1.45 0.00 0.00 42.92 38.95 1dt6 s ASP 191 CO 0.50 -1.67 1.50 -0.08 0.13 0.00 0.00 175.17 175.56 1dt6 h GLU 192 N 13.55 -0.29 -0.97 4.34 4.57 -1.94 -0.66 114.58 133.19 1dt6 h GLU 192 Ca -0.43 0.02 0.21 0.00 -1.18 0.00 0.00 59.36 57.98 1dt6 h GLU 192 Cb 1.23 0.06 -0.09 0.00 -0.16 0.00 0.00 28.75 29.80 1dt6 h GLU 192 CO 0.96 -0.19 0.62 1.49 -1.18 0.00 0.00 179.01 180.71 1dt6 h GLU 193 N -0.30 0.54 0.50 1.92 4.81 -1.97 0.11 114.58 120.19 1dt6 h GLU 193 Ca 0.08 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.26 1dt6 h GLU 193 Cb 0.52 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.78 1dt6 h GLU 193 CO -0.62 0.36 -0.24 0.35 -0.73 0.00 0.00 179.01 178.13 1dt6 h PHE 194 N 0.56 -0.62 -0.91 0.92 -0.00 -1.50 -1.22 116.94 114.17 1dt6 h PHE 194 Ca 0.54 -0.01 0.25 0.00 -0.00 0.00 0.00 57.97 58.74 1dt6 h PHE 194 Cb 1.11 0.20 -0.05 0.00 -0.00 0.00 0.00 35.95 37.22 1dt6 h PHE 194 CO -0.00 -0.30 0.64 -0.07 -0.00 0.00 0.00 178.31 178.58 1dt6 h LEU 195 N -1.02 0.11 -0.10 0.59 3.38 -0.34 0.83 115.31 118.75 1dt6 h LEU 195 Ca -0.07 0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.86 1dt6 h LEU 195 Cb 0.60 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.34 1dt6 h LEU 195 CO 0.11 0.04 -0.14 0.50 0.09 0.00 0.00 178.44 179.04 1dt6 h LYS 196 N 0.10 0.27 -0.58 1.13 3.64 -0.61 0.42 116.57 120.95 1dt6 h LYS 196 Ca 0.45 -0.16 0.11 0.00 -1.27 0.00 0.00 60.65 59.78 1dt6 h LYS 196 Cb 1.61 0.01 -0.08 0.00 -0.41 0.00 0.00 32.23 33.36 1dt6 h LYS 196 CO -0.06 0.72 0.10 1.25 -2.27 0.00 0.00 179.45 179.20 1dt6 h LEU 197 N -0.16 -0.04 -0.06 5.20 6.46 0.38 -1.93 115.31 125.16 1dt6 h LEU 197 Ca 0.01 0.11 -0.01 0.00 -0.12 0.00 0.00 57.88 57.87 1dt6 h LEU 197 Cb 0.69 0.16 -0.00 0.00 -0.73 0.00 0.00 40.66 40.78 1dt6 h LEU 197 CO 0.03 -0.01 0.00 0.24 -0.62 0.00 0.00 178.44 178.09 1dt6 h MET 198 N 0.23 0.10 -0.92 1.25 2.86 -1.23 -2.45 114.93 114.77 1dt6 h MET 198 Ca 0.30 -0.03 0.27 0.00 -2.06 0.00 0.00 59.70 58.17 1dt6 h MET 198 Cb 0.44 -0.01 -0.16 0.00 0.06 0.00 0.00 31.60 31.94 1dt6 h MET 198 CO -0.40 0.37 0.24 1.49 1.06 0.00 0.00 176.91 179.67 1dt6 h GLU 199 N -0.18 0.14 0.08 1.72 4.22 -0.18 -1.55 114.58 118.83 1dt6 h GLU 199 Ca 0.02 -0.01 -0.00 0.00 0.08 0.00 0.00 59.36 59.44 1dt6 h GLU 199 Cb 0.32 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1dt6 h GLU 199 CO 0.00 0.09 -0.04 0.77 -2.18 0.00 0.00 179.01 177.66 1dt6 h SER 200 N 0.15 -0.09 -0.94 1.04 0.02 -1.25 -2.39 113.55 110.08 1dt6 h SER 200 Ca 0.60 0.00 0.29 0.00 -0.84 0.00 0.00 61.79 61.85 1dt6 h SER 200 Cb 1.29 0.02 -0.17 0.00 0.14 0.00 0.00 62.40 63.68 1dt6 h SER 200 CO -0.73 -0.05 0.15 0.18 -1.14 0.00 0.00 176.83 175.25 1dt6 n LEU 201 N -2.41 0.01 -0.02 5.07 4.77 -0.93 -1.62 117.00 121.87 1dt6 n LEU 201 Ca -0.01 1.58 -0.13 0.00 -0.03 0.00 0.00 56.01 57.42 1dt6 n LEU 201 Cb 0.04 -0.63 -0.10 0.00 -2.33 0.00 0.00 43.42 40.40 1dt6 n LEU 201 CO 0.03 -1.65 0.61 -0.74 -1.33 0.00 0.00 177.39 174.32 1dt6 h HIS 202 N 0.00 0.02 -0.36 -1.77 2.76 -1.37 -2.66 115.15 111.77 1dt6 h HIS 202 Ca 0.63 -0.01 0.04 0.00 -2.20 0.00 0.00 60.37 58.83 1dt6 h HIS 202 Cb 1.43 -0.00 -0.04 0.00 1.55 0.00 0.00 27.41 30.35 1dt6 h HIS 202 CO -0.35 0.55 0.14 0.93 -1.30 0.00 0.00 177.93 177.90 1dt6 h GLU 203 N -0.51 0.30 0.28 5.26 5.08 -0.75 -0.64 114.58 123.60 1dt6 h GLU 203 Ca 0.00 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1dt6 h GLU 203 Cb 0.54 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.69 1dt6 h GLU 203 CO 0.00 0.20 -0.39 -0.91 -1.00 0.00 0.00 179.01 176.91 1dt6 h ASN 204 N 0.31 -1.11 -0.99 1.42 -0.26 -1.46 0.40 115.58 113.90 1dt6 h ASN 204 Ca 0.16 0.11 0.11 0.00 -0.56 0.00 0.00 56.30 56.11 1dt6 h ASN 204 Cb 0.11 0.39 -0.08 0.00 -1.06 0.00 0.00 38.32 37.69 1dt6 h ASN 204 CO -0.15 -0.51 0.63 0.58 -1.06 0.00 0.00 177.43 176.92 1dt6 h VAL 205 N -0.74 0.96 -0.25 2.81 2.07 -1.28 -1.21 116.25 118.61 1dt6 h VAL 205 Ca -0.01 -0.35 -0.14 0.00 0.82 0.00 0.00 66.70 67.02 1dt6 h VAL 205 Cb 0.70 -0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 30.32 1dt6 h VAL 205 CO -0.13 0.18 -0.42 -0.08 0.02 0.00 0.00 177.57 177.14 1dt6 h GLU 206 N 1.01 0.61 -0.78 1.57 4.81 -0.42 -2.54 114.58 118.84 1dt6 h GLU 206 Ca 0.47 -0.32 0.00 0.00 -0.13 0.00 0.00 59.36 59.38 1dt6 h GLU 206 Cb 0.42 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.82 1dt6 h GLU 206 CO -0.23 0.92 0.00 1.28 -0.73 0.00 0.00 179.01 180.25 1dt6 n LEU 207 N -4.02 0.98 0.00 1.64 4.77 0.14 -3.68 117.00 116.82 1dt6 n LEU 207 Ca -0.02 -0.49 0.00 0.00 -0.03 0.00 0.00 56.01 55.47 1dt6 n LEU 207 Cb 0.53 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 1dt6 n LEU 207 CO 0.46 0.22 0.17 0.18 -1.33 0.00 0.00 177.39 177.08 1dt6 n LEU 208 N -0.07 0.67 0.00 2.23 4.77 -0.96 -5.02 117.00 118.62 1dt6 n LEU 208 Ca 0.01 -0.73 0.00 0.00 -0.03 0.00 0.00 56.01 55.26 1dt6 n LEU 208 Cb 0.23 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 1dt6 n LEU 208 CO 0.01 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 176.85 1dt6 n GLY 209 N 0.12 0.00 1.30 -0.72 0.00 -1.24 -4.92 105.19 99.72 1dt6 n GLY 209 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 1dt6 n GLY 209 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1dt6 n THR 210 N 0.00 0.00 -1.75 2.61 -1.04 -1.26 -4.52 114.28 108.32 1dt6 n THR 210 Ca 0.00 -0.21 -0.43 0.00 -2.04 0.00 0.00 64.05 61.37 1dt6 n THR 210 Cb 0.00 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.48 1dt6 n THR 210 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 1dt6 s PRO 211 N -0.71 3.35 0.00 -2.82 0.02 -1.26 -4.88 135.00 128.70 1dt6 s PRO 211 Ca 0.19 1.92 0.00 0.00 0.02 0.00 0.00 61.00 63.13 1dt6 s PRO 211 Cb -0.12 -4.28 0.00 0.00 0.02 0.00 0.00 34.50 30.12 1dt6 s PRO 211 CO 0.33 -1.84 0.00 1.28 -0.33 0.00 0.00 177.00 176.43 1dt6 n LEU 223 N 10.60 0.00 -1.20 -5.54 4.77 -1.26 -5.14 117.00 119.24 1dt6 n LEU 223 Ca 0.26 -0.01 -0.03 0.00 -0.03 0.00 0.00 56.01 56.21 1dt6 n LEU 223 Cb 0.45 0.00 0.21 0.00 -2.33 0.00 0.00 43.42 41.75 1dt6 n LEU 223 CO 0.67 -0.01 0.75 0.47 -1.33 0.00 0.00 177.39 177.94 1dt6 n ASP 224 N 0.04 2.95 -4.67 -1.43 10.43 -1.26 -5.02 116.55 117.60 1dt6 n ASP 224 Ca 0.00 -3.57 -0.42 0.00 2.57 0.00 0.00 54.79 53.37 1dt6 n ASP 224 Cb 0.00 -0.63 -0.03 0.00 1.84 0.00 0.00 41.12 42.30 1dt6 n ASP 224 CO 0.00 0.00 0.00 -0.72 -1.07 0.00 0.00 177.20 175.41 1dt6 s TYR 225 N -3.15 2.01 0.02 1.24 -0.85 -1.26 -4.90 117.35 110.47 1dt6 s TYR 225 Ca 0.45 0.16 0.10 0.00 -0.52 0.00 0.00 57.07 57.27 1dt6 s TYR 225 Cb 0.40 -3.96 -0.16 0.00 0.38 0.00 0.00 41.96 38.62 1dt6 s TYR 225 CO 0.03 -4.01 1.16 0.74 -1.52 0.00 0.00 175.55 171.95 1dt6 h PHE 226 N 9.35 0.00 0.00 -3.49 0.05 -2.00 -3.47 116.94 117.39 1dt6 h PHE 226 Ca -0.41 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.38 1dt6 h PHE 226 Cb 1.19 0.00 0.00 0.00 2.00 0.00 0.00 35.95 39.14 1dt6 h PHE 226 CO 0.87 0.88 0.00 -0.35 -0.18 0.00 0.00 178.31 179.52 1dt6 n PRO 227 N -3.23 0.49 0.21 1.51 -0.04 -1.26 -4.88 135.00 127.80 1dt6 n PRO 227 Ca -0.04 -0.62 0.13 0.00 -0.04 0.00 0.00 63.50 62.93 1dt6 n PRO 227 Cb 0.92 -0.74 0.45 0.00 -0.04 0.00 0.00 33.50 34.08 1dt6 n PRO 227 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1dt6 h GLY 228 N 0.00 0.00 1.30 0.55 0.00 -1.99 2.58 103.07 105.50 1dt6 h GLY 228 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 1dt6 h GLY 228 CO 0.00 0.00 0.28 -2.22 0.00 0.00 0.00 176.54 174.60 1dt6 h ILE 229 N 0.00 1.21 0.15 2.60 1.08 -1.99 -2.92 117.51 117.65 1dt6 h ILE 229 Ca 0.11 -0.63 -0.30 0.00 -0.39 0.00 0.00 64.86 63.65 1dt6 h ILE 229 Cb 1.57 0.43 0.02 0.00 -3.07 0.00 0.00 36.82 35.77 1dt6 h ILE 229 CO -0.00 0.26 -1.29 -0.74 -0.69 0.00 0.00 178.15 175.69 1dt6 h HIS 230 N 0.90 0.85 -0.04 1.37 2.76 0.41 -3.18 115.15 118.21 1dt6 h HIS 230 Ca 0.22 -0.57 -0.12 0.00 -2.20 0.00 0.00 60.37 57.70 1dt6 h HIS 230 Cb 0.13 -0.05 -0.01 0.00 1.55 0.00 0.00 27.41 29.02 1dt6 h HIS 230 CO 0.01 1.43 -0.54 -0.22 -1.30 0.00 0.00 177.93 177.31 1dt6 h LYS 231 N 0.19 0.11 -0.04 5.26 3.64 -1.52 -2.84 116.57 121.36 1dt6 h LYS 231 Ca -0.19 -0.07 -0.00 0.00 -1.27 0.00 0.00 60.65 59.12 1dt6 h LYS 231 Cb 1.97 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 33.80 1dt6 h LYS 231 CO 0.24 0.62 0.01 1.79 -2.27 0.00 0.00 179.45 179.84 1dt6 h THR 232 N 0.09 1.20 -0.09 1.00 1.35 -1.62 -1.70 112.91 113.14 1dt6 h THR 232 Ca -0.00 -0.61 0.02 0.00 -0.55 0.00 0.00 66.41 65.27 1dt6 h THR 232 Cb 0.98 1.54 -0.05 0.00 -1.73 0.00 0.00 68.15 68.89 1dt6 h THR 232 CO 0.08 0.17 -0.46 -0.07 -0.25 0.00 0.00 175.52 174.98 1dt6 h LEU 233 N -0.17 -1.45 -0.93 3.87 3.38 -1.52 0.23 115.31 118.71 1dt6 h LEU 233 Ca 0.01 0.17 0.24 0.00 0.09 0.00 0.00 57.88 58.40 1dt6 h LEU 233 Cb 0.26 0.56 -0.17 0.00 0.09 0.00 0.00 40.66 41.40 1dt6 h LEU 233 CO 0.00 -0.42 0.03 0.25 0.09 0.00 0.00 178.44 178.40 1dt6 h LEU 234 N -0.51 -0.43 0.04 1.67 7.12 -1.45 1.98 115.31 123.73 1dt6 h LEU 234 Ca 0.02 0.26 -0.00 0.00 0.13 0.00 0.00 57.88 58.29 1dt6 h LEU 234 Cb 0.58 0.44 -0.00 0.00 -0.53 0.00 0.00 40.66 41.16 1dt6 h LEU 234 CO -0.36 -0.30 -0.03 0.50 -0.13 0.00 0.00 178.44 178.13 1dt6 h LYS 235 N 0.05 -0.06 -0.30 1.25 1.63 0.11 0.83 116.57 120.07 1dt6 h LYS 235 Ca 0.55 0.00 0.07 0.00 -0.85 0.00 0.00 60.65 60.43 1dt6 h LYS 235 Cb 1.10 0.01 -0.08 0.00 -0.60 0.00 0.00 32.23 32.66 1dt6 h LYS 235 CO -0.85 -0.04 -0.26 -0.91 -3.45 0.00 0.00 179.45 173.94 1dt6 h ASN 236 N -0.06 -0.86 -0.70 4.20 -0.26 0.14 0.51 115.58 118.55 1dt6 h ASN 236 Ca -0.00 0.16 0.15 0.00 -0.56 0.00 0.00 56.30 56.04 1dt6 h ASN 236 Cb 0.05 0.41 -0.12 0.00 -1.06 0.00 0.00 38.32 37.60 1dt6 h ASN 236 CO 0.00 -0.29 0.05 0.00 -1.06 0.00 0.00 177.43 176.13 1dt6 h ALA 237 N 0.82 0.76 -0.61 -0.83 0.00 0.30 0.47 119.26 120.17 1dt6 h ALA 237 Ca 0.15 0.20 0.01 0.00 0.00 0.00 0.00 54.91 55.28 1dt6 h ALA 237 Cb 0.49 0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.58 1dt6 h ALA 237 CO -0.44 -0.39 0.40 -0.44 0.00 0.00 0.00 179.25 178.37 1dt6 h ASP 238 N 0.15 0.68 -0.22 0.00 3.45 0.12 -0.55 116.42 120.04 1dt6 h ASP 238 Ca 0.38 -0.01 -0.00 0.00 0.43 0.00 0.00 57.03 57.82 1dt6 h ASP 238 Cb 0.65 -0.17 -0.01 0.00 -0.56 0.00 0.00 39.33 39.24 1dt6 h ASP 238 CO -0.58 0.49 0.13 0.22 -1.57 0.00 0.00 179.24 177.93 1dt6 h TYR 239 N 0.81 0.30 0.32 4.55 3.20 0.93 -1.48 116.97 125.61 1dt6 h TYR 239 Ca 0.23 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.08 1dt6 h TYR 239 Cb -0.07 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.09 1dt6 h TYR 239 CO -0.04 0.26 -0.30 0.82 -1.64 0.00 0.00 178.16 177.26 1dt6 h ILE 240 N 0.26 0.00 -1.18 1.81 2.04 -0.91 -1.10 117.51 118.43 1dt6 h ILE 240 Ca 0.08 0.00 0.45 0.00 1.00 0.00 0.00 64.86 66.39 1dt6 h ILE 240 Cb 0.05 0.00 -0.16 0.00 -0.74 0.00 0.00 36.82 35.97 1dt6 h ILE 240 CO -0.01 0.00 0.70 0.50 0.00 0.00 0.00 178.15 179.34 1dt6 h LYS 241 N -0.61 0.01 0.05 2.37 3.64 -0.98 -0.76 116.57 120.29 1dt6 h LYS 241 Ca -0.04 -0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1dt6 h LYS 241 Cb 0.52 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.34 1dt6 h LYS 241 CO -0.03 0.00 -0.02 -0.91 -2.27 0.00 0.00 179.45 176.22 1dt6 h ASN 242 N 0.01 -0.06 -0.55 4.20 4.21 -0.73 -2.58 115.58 120.08 1dt6 h ASN 242 Ca 0.86 0.00 0.10 0.00 1.21 0.00 0.00 56.30 58.48 1dt6 h ASN 242 Cb 2.51 0.02 -0.10 0.00 -1.12 0.00 0.00 38.32 39.63 1dt6 h ASN 242 CO -0.63 -0.01 -0.17 0.33 -1.29 0.00 0.00 177.43 175.66 1dt6 n PHE 243 N -2.39 0.11 0.45 1.19 -0.00 -0.40 0.93 117.46 117.35 1dt6 n PHE 243 Ca -0.01 0.67 -0.20 0.00 -0.00 0.00 0.00 57.45 57.92 1dt6 n PHE 243 Cb 0.03 -0.77 -0.10 0.00 -0.00 0.00 0.00 39.48 38.64 1dt6 n PHE 243 CO 0.00 0.00 0.00 0.82 -0.00 0.00 0.00 176.76 177.58 1dt6 h ILE 244 N 0.00 0.08 -0.51 -2.13 2.04 -1.36 -2.84 117.51 112.80 1dt6 h ILE 244 Ca 0.23 0.00 0.13 0.00 1.00 0.00 0.00 64.86 66.22 1dt6 h ILE 244 Cb 0.37 0.08 -0.02 0.00 -0.74 0.00 0.00 36.82 36.50 1dt6 h ILE 244 CO -0.56 0.00 0.35 -0.03 0.00 0.00 0.00 178.15 177.92 1dt6 h MET 245 N -1.19 0.12 -0.40 2.37 4.05 0.97 0.18 114.93 121.04 1dt6 h MET 245 Ca -0.11 -0.01 -0.05 0.00 -0.28 0.00 0.00 59.70 59.25 1dt6 h MET 245 Cb 0.93 -0.03 -0.02 0.00 -0.80 0.00 0.00 31.60 31.69 1dt6 h MET 245 CO 0.15 0.08 0.03 1.49 0.23 0.00 0.00 176.91 178.88 1dt6 h GLU 246 N 0.12 0.62 0.03 0.39 4.81 -0.60 -0.38 114.58 119.58 1dt6 h GLU 246 Ca 0.24 -0.13 -0.22 0.00 -0.13 0.00 0.00 59.36 59.11 1dt6 h GLU 246 Cb 0.79 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 30.06 1dt6 h GLU 246 CO -0.03 0.62 -1.04 0.87 -0.73 0.00 0.00 179.01 178.71 1dt6 h LYS 247 N 0.60 0.09 -0.58 1.92 6.56 -0.55 -2.98 116.57 121.62 1dt6 h LYS 247 Ca 0.13 -0.14 -0.05 0.00 -1.06 0.00 0.00 60.65 59.53 1dt6 h LYS 247 Cb 0.33 0.05 -0.02 0.00 -0.57 0.00 0.00 32.23 32.02 1dt6 h LYS 247 CO 0.01 1.04 0.16 0.28 -2.06 0.00 0.00 179.45 178.88 1dt6 h VAL 248 N 0.03 1.24 0.31 0.50 2.07 -0.38 0.15 116.25 120.17 1dt6 h VAL 248 Ca -0.04 -0.85 -0.02 0.00 0.82 0.00 0.00 66.70 66.61 1dt6 h VAL 248 Cb 1.78 0.69 0.00 0.00 -1.52 0.00 0.00 31.29 32.24 1dt6 h VAL 248 CO 0.15 0.32 -0.15 0.11 0.02 0.00 0.00 177.57 178.02 1dt6 h LYS 249 N 0.83 -0.40 0.00 1.57 6.56 -1.13 -1.87 116.57 122.14 1dt6 h LYS 249 Ca 0.19 0.03 -0.01 0.00 -1.06 0.00 0.00 60.65 59.80 1dt6 h LYS 249 Cb 0.31 0.09 -0.00 0.00 -0.57 0.00 0.00 32.23 32.06 1dt6 h LYS 249 CO -0.00 -0.17 -0.04 1.05 -2.06 0.00 0.00 179.45 178.23 1dt6 h GLU 250 N -0.56 0.00 0.00 3.15 4.11 -1.43 -0.10 114.58 119.75 1dt6 h GLU 250 Ca -0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.39 1dt6 h GLU 250 Cb 0.41 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.66 1dt6 h GLU 250 CO 0.07 0.04 0.00 0.45 0.07 0.00 0.00 179.01 179.64 1dt6 h HIS 251 N 0.00 0.00 0.05 2.06 3.86 -0.19 -3.15 115.15 117.77 1dt6 h HIS 251 Ca -0.00 0.00 -0.24 0.00 -1.16 0.00 0.00 60.37 58.97 1dt6 h HIS 251 Cb 0.26 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.73 1dt6 h HIS 251 CO 0.00 0.00 -1.04 1.96 0.86 0.00 0.00 177.93 179.71 1dt6 h GLN 252 N 0.00 0.31 0.00 2.45 4.20 -0.20 -3.24 115.11 118.63 1dt6 h GLN 252 Ca 0.00 -0.40 0.00 0.00 0.06 0.00 0.00 58.65 58.31 1dt6 h GLN 252 Cb 0.76 0.13 0.00 0.00 0.30 0.00 0.00 27.48 28.67 1dt6 h GLN 252 CO 0.00 1.12 0.00 1.63 -0.67 0.00 0.00 178.83 180.91 1dt6 n LYS 253 N -3.64 0.54 -3.15 1.46 4.01 -1.19 -4.56 118.16 111.63 1dt6 n LYS 253 Ca -0.07 0.00 0.04 0.00 -0.51 0.00 0.00 58.31 57.78 1dt6 n LYS 253 Cb 0.90 -1.21 -0.00 0.00 -0.51 0.00 0.00 35.03 34.21 1dt6 n LYS 253 CO 0.00 0.00 0.00 -0.48 -1.11 0.00 0.00 177.40 175.81 1dt6 s LEU 254 N -1.42 -1.17 0.30 -0.35 0.05 -1.22 -5.15 118.68 109.72 1dt6 s LEU 254 Ca 0.11 0.12 0.00 0.00 0.05 0.00 0.00 54.13 54.41 1dt6 s LEU 254 Cb 0.05 1.74 -0.02 0.00 -2.05 0.00 0.00 46.19 45.91 1dt6 s LEU 254 CO 0.08 -0.21 0.34 -1.48 -0.55 0.00 0.00 176.35 174.53 1dt6 s LEU 255 N 2.85 1.23 0.00 1.48 2.34 -1.26 -4.95 118.68 120.37 1dt6 s LEU 255 Ca 0.17 -1.51 0.01 0.00 0.06 0.00 0.00 54.13 52.86 1dt6 s LEU 255 Cb -0.07 0.96 -0.00 0.00 -0.56 0.00 0.00 46.19 46.52 1dt6 s LEU 255 CO -0.24 -1.11 0.05 -0.67 -1.06 0.00 0.00 176.35 173.31 1dt6 n ASP 256 N -1.13 2.77 -4.59 1.48 -0.08 -1.25 -5.03 116.55 108.72 1dt6 n ASP 256 Ca 0.03 -3.28 -0.42 0.00 -1.51 0.00 0.00 54.79 49.61 1dt6 n ASP 256 Cb 0.63 0.58 -0.03 0.00 2.34 0.00 0.00 41.12 44.64 1dt6 n ASP 256 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 1dt6 s VAL 257 N -2.97 3.45 -0.11 5.18 1.01 -1.26 -3.63 120.40 122.07 1dt6 s VAL 257 Ca 0.07 0.43 -0.01 0.00 0.00 0.00 0.00 61.98 62.47 1dt6 s VAL 257 Cb 0.00 -3.66 0.01 0.00 0.00 0.00 0.00 36.38 32.73 1dt6 s VAL 257 CO 0.05 -0.46 0.02 -3.20 0.00 0.00 0.00 175.10 171.51 1dt6 n ASN 258 N 10.74 -0.05 -3.28 3.32 2.85 -1.26 -4.71 115.26 122.87 1dt6 n ASN 258 Ca 0.23 -0.08 -0.26 0.00 -0.11 0.00 0.00 54.58 54.36 1dt6 n ASN 258 Cb 0.48 -0.10 -0.07 0.00 1.24 0.00 0.00 39.78 41.33 1dt6 n ASN 258 CO 0.00 0.00 0.00 -3.20 -2.11 0.00 0.00 177.26 171.95 1dt6 n ASN 259 N 0.40 2.97 -4.84 1.20 5.15 -1.24 -5.02 115.26 113.89 1dt6 n ASN 259 Ca -0.00 -3.30 -0.35 0.00 -0.60 0.00 0.00 54.58 50.32 1dt6 n ASN 259 Cb 0.03 -0.64 -0.06 0.00 -0.53 0.00 0.00 39.78 38.58 1dt6 n ASN 259 CO 0.00 0.00 0.00 -2.84 1.40 0.00 0.00 177.26 175.82 1dt6 s PRO 260 N -2.37 4.07 -0.08 1.20 0.02 -1.26 -3.89 135.00 132.69 1dt6 s PRO 260 Ca 0.40 0.64 0.13 0.00 0.02 0.00 0.00 61.00 62.19 1dt6 s PRO 260 Cb 0.19 -2.82 0.35 0.00 0.02 0.00 0.00 34.50 32.24 1dt6 s PRO 260 CO -0.06 0.39 1.27 0.54 -0.33 0.00 0.00 177.00 178.81 1dt6 n ARG 261 N 0.53 2.72 0.00 5.54 1.74 -1.26 -3.62 116.66 122.30 1dt6 n ARG 261 Ca -0.02 -2.35 0.00 0.00 -0.77 0.00 0.00 57.85 54.71 1dt6 n ARG 261 Cb 0.52 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.47 1dt6 n ARG 261 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 1dt6 n ASP 262 N -0.24 0.00 -0.06 0.55 3.85 -1.26 -4.83 116.55 114.56 1dt6 n ASP 262 Ca 0.14 0.00 -0.02 0.00 -0.71 0.00 0.00 54.79 54.21 1dt6 n ASP 262 Cb 0.61 0.00 -0.01 0.00 -1.35 0.00 0.00 41.12 40.36 1dt6 n ASP 262 CO 0.00 0.00 0.00 0.33 -1.01 0.00 0.00 177.20 176.52 1dt6 n PHE 263 N -0.19 -0.07 -0.14 2.11 7.35 -0.77 -0.93 117.46 124.82 1dt6 n PHE 263 Ca 0.00 0.19 -0.13 0.00 -0.76 0.00 0.00 57.45 56.74 1dt6 n PHE 263 Cb 0.00 -0.34 -0.10 0.00 0.35 0.00 0.00 39.48 39.39 1dt6 n PHE 263 CO 0.00 0.00 0.00 0.82 -0.76 0.00 0.00 176.76 176.82 1dt6 h ILE 264 N 0.00 0.00 -1.02 -2.13 2.04 -1.85 0.97 117.51 115.51 1dt6 h ILE 264 Ca 0.02 0.00 0.27 0.00 1.00 0.00 0.00 64.86 66.16 1dt6 h ILE 264 Cb 0.06 0.00 -0.13 0.00 -0.74 0.00 0.00 36.82 36.02 1dt6 h ILE 264 CO -0.14 0.00 0.61 0.44 0.00 0.00 0.00 178.15 179.06 1dt6 h ASP 265 N -0.37 0.59 -0.19 1.72 5.19 -1.34 0.17 116.42 122.18 1dt6 h ASP 265 Ca 0.07 0.14 -0.06 0.00 -0.62 0.00 0.00 57.03 56.56 1dt6 h ASP 265 Cb 0.57 0.06 -0.00 0.00 0.18 0.00 0.00 39.33 40.13 1dt6 h ASP 265 CO -0.59 0.03 -0.12 0.00 -3.12 0.00 0.00 179.24 175.45 1dt6 h PHE 267 N 0.10 -0.61 -0.74 0.00 3.57 0.72 -3.11 116.94 116.86 1dt6 h PHE 267 Ca 0.04 -0.01 0.12 0.00 3.53 0.00 0.00 57.97 61.64 1dt6 h PHE 267 Cb 0.63 0.21 -0.12 0.00 2.79 0.00 0.00 35.95 39.46 1dt6 h PHE 267 CO 0.07 -0.37 -0.29 1.28 -2.23 0.00 0.00 178.31 176.78 1dt6 n LEU 268 N -3.76 -0.48 -2.61 0.59 4.32 0.42 0.08 117.00 115.56 1dt6 n LEU 268 Ca -0.08 1.30 -0.20 0.00 -0.02 0.00 0.00 56.01 57.01 1dt6 n LEU 268 Cb 0.25 -0.30 -0.09 0.00 -1.62 0.00 0.00 43.42 41.66 1dt6 n LEU 268 CO 0.18 -1.17 2.11 2.30 -1.22 0.00 0.00 177.39 179.60 1dt6 n ILE 269 N -5.10 2.94 -3.42 -0.08 -5.35 -0.97 -4.30 119.36 103.08 1dt6 n ILE 269 Ca 0.08 -1.62 -0.28 0.00 -0.27 0.00 0.00 62.75 60.66 1dt6 n ILE 269 Cb 0.30 -2.14 -0.11 0.00 -1.74 0.00 0.00 39.64 35.96 1dt6 n ILE 269 CO 0.00 0.00 0.00 -0.54 -1.76 0.00 0.00 176.55 174.25 1dt6 s LYS 270 N 1.95 0.76 -0.52 6.28 -0.14 0.11 -4.96 119.74 123.22 1dt6 s LYS 270 Ca 0.56 -1.80 0.06 0.00 -1.36 0.00 0.00 55.97 53.43 1dt6 s LYS 270 Cb 0.21 -1.36 0.21 0.00 -1.68 0.00 0.00 37.83 35.20 1dt6 s LYS 270 CO -0.02 -1.32 0.50 -1.33 -0.76 0.00 0.00 175.35 172.42 1dt6 n MET 271 N 3.31 1.13 -4.12 1.68 2.81 -1.26 -4.74 117.12 115.93 1dt6 n MET 271 Ca 0.23 -3.77 -0.15 0.00 -1.81 0.00 0.00 57.70 52.20 1dt6 n MET 271 Cb 0.44 -1.80 -0.12 0.00 -0.71 0.00 0.00 33.22 31.03 1dt6 n MET 271 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 1dt6 s GLU 272 N -1.08 0.69 -1.27 0.03 2.12 -1.26 -4.73 118.70 113.19 1dt6 s GLU 272 Ca 0.33 -0.89 -0.07 0.00 0.36 0.00 0.00 54.97 54.70 1dt6 s GLU 272 Cb 0.07 -0.55 0.01 0.00 0.26 0.00 0.00 34.13 33.92 1dt6 s GLU 272 CO -0.14 0.11 1.10 0.94 -0.54 0.00 0.00 175.26 176.74 1dt6 n GLN 273 N 1.27 -7.40 -0.44 4.30 7.27 -1.26 -4.44 117.38 116.67 1dt6 n GLN 273 Ca -0.21 0.80 0.03 0.00 0.07 0.00 0.00 57.00 57.70 1dt6 n GLN 273 Cb 0.55 -5.76 -0.02 0.00 2.41 0.00 0.00 30.24 27.42 1dt6 n GLN 273 CO 0.00 0.00 0.00 -1.91 0.07 0.00 0.00 177.06 175.22 1dt6 n GLU 274 N -4.65 -1.08 0.00 3.69 2.13 -1.26 -4.27 120.64 115.20 1dt6 n GLU 274 Ca -0.06 0.87 0.00 0.00 0.66 0.00 0.00 57.16 58.63 1dt6 n GLU 274 Cb 0.58 -1.18 0.00 0.00 0.27 0.00 0.00 31.44 31.12 1dt6 n GLU 274 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 1dt6 n ASN 275 N -2.40 0.00 0.00 4.31 2.85 -1.26 -3.64 115.26 115.12 1dt6 n ASN 275 Ca -0.02 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.45 1dt6 n ASN 275 Cb 0.18 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.20 1dt6 n ASN 275 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 1dt6 n ASN 276 N -1.33 0.00 0.00 1.20 3.02 -1.26 -4.34 115.26 112.55 1dt6 n ASN 276 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1dt6 n ASN 276 Cb 0.00 -0.17 0.00 0.00 -0.61 0.00 0.00 39.78 39.00 1dt6 n ASN 276 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 1dt6 n LEU 277 N -2.25 0.00 -0.09 3.41 7.94 -1.24 -3.23 117.00 121.54 1dt6 n LEU 277 Ca 0.00 0.00 -0.07 0.00 -1.11 0.00 0.00 56.01 54.83 1dt6 n LEU 277 Cb 0.00 0.00 -0.16 0.00 0.53 0.00 0.00 43.42 43.79 1dt6 n LEU 277 CO 0.00 0.00 -1.10 1.21 -1.11 0.00 0.00 177.39 176.39 1dt6 n GLU 278 N 3.18 0.71 -1.80 1.96 4.07 -1.26 -4.83 120.64 122.67 1dt6 n GLU 278 Ca 0.00 -0.03 -0.42 0.00 -0.06 0.00 0.00 57.16 56.65 1dt6 n GLU 278 Cb 0.00 -1.52 -0.03 0.00 -0.06 0.00 0.00 31.44 29.83 1dt6 n GLU 278 CO 0.00 0.00 0.00 0.12 -0.06 0.00 0.00 177.13 177.19 1dt6 s PHE 279 N -2.62 2.85 -0.27 4.31 5.36 -1.20 -4.77 117.98 121.64 1dt6 s PHE 279 Ca -0.10 0.39 -0.24 0.00 -0.96 0.00 0.00 56.93 56.02 1dt6 s PHE 279 Cb 0.07 -4.07 0.08 0.00 -0.34 0.00 0.00 43.02 38.76 1dt6 s PHE 279 CO 0.83 -4.07 0.79 0.95 -1.46 0.00 0.00 175.22 172.26 1dt6 s THR 280 N 1.41 0.00 0.62 0.12 -4.23 -1.26 -4.58 115.64 107.72 1dt6 s THR 280 Ca 0.74 0.00 0.25 0.00 -1.18 0.00 0.00 61.69 61.50 1dt6 s THR 280 Cb -0.47 -1.00 0.32 0.00 1.34 0.00 0.00 72.50 72.69 1dt6 s THR 280 CO 0.32 0.00 1.61 0.25 -0.54 0.00 0.00 174.62 176.26 1dt6 h LEU 281 N 4.96 0.00 0.04 4.79 5.85 -2.00 -0.30 115.31 128.66 1dt6 h LEU 281 Ca -0.29 0.00 -0.35 0.00 0.84 0.00 0.00 57.88 58.08 1dt6 h LEU 281 Cb 1.17 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 42.15 1dt6 h LEU 281 CO 0.07 0.00 -2.10 -1.84 -0.34 0.00 0.00 178.44 174.23 1dt6 n GLU 282 N -3.25 0.69 -0.15 1.25 0.28 -1.26 -3.70 120.64 114.49 1dt6 n GLU 282 Ca 0.10 0.20 -0.06 0.00 -0.16 0.00 0.00 57.16 57.24 1dt6 n GLU 282 Cb 0.92 -1.66 0.11 0.00 1.43 0.00 0.00 31.44 32.24 1dt6 n GLU 282 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 1dt6 h SER 283 N 0.02 0.88 0.00 -1.84 4.64 -1.44 -2.82 113.55 113.00 1dt6 h SER 283 Ca -0.44 -0.22 0.00 0.00 -0.47 0.00 0.00 61.79 60.65 1dt6 h SER 283 Cb 2.04 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 63.89 1dt6 h SER 283 CO 0.04 0.93 0.00 -0.11 -0.87 0.00 0.00 176.83 176.82 1dt6 n LEU 284 N -4.20 0.00 -0.28 5.97 7.94 -0.28 -2.35 117.00 123.80 1dt6 n LEU 284 Ca 0.03 0.82 -0.01 0.00 -1.11 0.00 0.00 56.01 55.74 1dt6 n LEU 284 Cb 0.31 -0.32 0.03 0.00 0.53 0.00 0.00 43.42 43.98 1dt6 n LEU 284 CO 0.42 -0.32 0.43 0.52 -1.11 0.00 0.00 177.39 177.34 1dt6 n VAL 285 N -1.90 -0.39 0.07 1.96 0.31 -1.19 0.11 118.33 117.30 1dt6 n VAL 285 Ca 0.00 1.73 0.19 0.00 -0.01 0.00 0.00 64.34 66.25 1dt6 n VAL 285 Cb 0.00 -2.29 0.72 0.00 -0.91 0.00 0.00 33.84 31.36 1dt6 n VAL 285 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 1dt6 h ILE 286 N 0.00 0.66 0.04 2.52 2.04 -1.25 0.11 117.51 121.63 1dt6 h ILE 286 Ca 0.26 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 66.12 1dt6 h ILE 286 Cb 0.45 0.77 0.00 0.00 -0.74 0.00 0.00 36.82 37.29 1dt6 h ILE 286 CO -0.73 0.00 -0.02 0.00 0.00 0.00 0.00 178.15 177.40 1dt6 h ALA 287 N 1.73 -0.05 -0.29 1.87 0.00 0.12 -2.48 119.26 120.16 1dt6 h ALA 287 Ca 0.19 -0.32 0.08 0.00 0.00 0.00 0.00 54.91 54.87 1dt6 h ALA 287 Cb 0.84 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 1dt6 h ALA 287 CO -0.00 -0.10 0.34 0.28 0.00 0.00 0.00 179.25 179.77 1dt6 h VAL 288 N -0.91 0.38 0.03 0.00 2.07 -0.77 0.52 116.25 117.57 1dt6 h VAL 288 Ca -0.01 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.45 1dt6 h VAL 288 Cb 0.66 0.72 0.01 0.00 -1.52 0.00 0.00 31.29 31.16 1dt6 h VAL 288 CO 0.01 0.00 -0.29 0.28 0.02 0.00 0.00 177.57 177.59 1dt6 h SER 289 N 0.00 0.20 0.01 0.57 0.02 -0.82 -1.72 113.55 111.82 1dt6 h SER 289 Ca 0.14 -0.88 -0.07 0.00 -0.84 0.00 0.00 61.79 60.14 1dt6 h SER 289 Cb 0.82 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 63.28 1dt6 h SER 289 CO -0.00 1.06 -0.18 0.44 -1.14 0.00 0.00 176.83 177.01 1dt6 h ASP 290 N -0.63 0.31 0.28 3.07 3.45 -0.45 0.42 116.42 122.87 1dt6 h ASP 290 Ca -0.04 -0.08 -0.01 0.00 0.43 0.00 0.00 57.03 57.32 1dt6 h ASP 290 Cb 1.13 -0.08 0.00 0.00 -0.56 0.00 0.00 39.33 39.82 1dt6 h ASP 290 CO 0.05 0.51 -0.13 -0.07 -1.57 0.00 0.00 179.24 178.03 1dt6 h LEU 291 N 0.29 -0.32 0.35 1.55 3.38 -0.12 -0.72 115.31 119.73 1dt6 h LEU 291 Ca 0.05 -0.19 -0.00 0.00 0.09 0.00 0.00 57.88 57.83 1dt6 h LEU 291 Cb 0.50 0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.30 1dt6 h LEU 291 CO 0.03 0.05 -0.52 -0.26 0.09 0.00 0.00 178.44 177.84 1dt6 h PHE 292 N -0.73 -1.47 0.07 1.13 0.04 -0.98 0.82 116.94 115.83 1dt6 h PHE 292 Ca -0.04 0.02 0.01 0.00 2.80 0.00 0.00 57.97 60.76 1dt6 h PHE 292 Cb 0.49 0.59 -0.04 0.00 2.20 0.00 0.00 35.95 39.20 1dt6 h PHE 292 CO 0.03 -0.65 -0.40 0.78 -0.60 0.00 0.00 178.31 177.47 1dt6 h GLY 293 N -0.91 -1.18 1.05 -1.45 0.00 -0.20 0.88 103.07 101.26 1dt6 h GLY 293 Ca -0.04 0.62 -0.09 0.00 0.00 0.00 0.00 47.33 47.82 1dt6 h GLY 293 CO -0.16 -0.32 -0.01 0.00 0.00 0.00 0.00 176.54 176.06 1dt6 h ALA 294 N -0.78 0.74 -0.07 3.60 0.00 -1.16 -3.02 119.26 118.57 1dt6 h ALA 294 Ca -0.00 -0.30 -0.11 0.00 0.00 0.00 0.00 54.91 54.50 1dt6 h ALA 294 Cb 0.56 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1dt6 h ALA 294 CO -0.23 0.58 -0.45 0.78 0.00 0.00 0.00 179.25 179.93 1dt6 h GLY 295 N 0.86 0.17 0.06 0.00 0.00 0.86 -3.27 103.07 101.75 1dt6 h GLY 295 Ca 0.15 -0.17 -0.10 0.00 0.00 0.00 0.00 47.33 47.22 1dt6 h GLY 295 CO 0.03 0.15 -0.52 0.00 0.00 0.00 0.00 176.54 176.20 1dt6 h THR 296 N 0.13 1.46 0.20 4.70 1.03 0.77 -3.36 112.91 117.84 1dt6 h THR 296 Ca 0.01 -2.31 -0.01 0.00 -0.01 0.00 0.00 66.41 64.09 1dt6 h THR 296 Cb 0.85 2.98 0.00 0.00 -1.07 0.00 0.00 68.15 70.90 1dt6 h THR 296 CO 0.07 0.52 -0.10 -0.08 -0.01 0.00 0.00 175.52 175.92 1dt6 h GLU 297 N -0.93 -0.26 -0.98 0.00 4.57 -1.66 -2.81 114.58 112.50 1dt6 h GLU 297 Ca -0.14 0.02 0.09 0.00 -1.18 0.00 0.00 59.36 58.15 1dt6 h GLU 297 Cb 1.17 0.06 -0.12 0.00 -0.16 0.00 0.00 28.75 29.70 1dt6 h GLU 297 CO -0.06 -0.17 -0.57 0.25 -1.18 0.00 0.00 179.01 177.28 1dt6 n THR 298 N -2.75 -0.66 -0.30 0.32 -2.24 -1.23 -1.13 114.28 106.29 1dt6 n THR 298 Ca -0.03 2.37 0.03 0.00 -2.27 0.00 0.00 64.05 64.15 1dt6 n THR 298 Cb 0.11 -2.94 0.17 0.00 -2.10 0.00 0.00 70.33 65.56 1dt6 n THR 298 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 1dt6 h THR 299 N 0.00 0.93 -0.01 4.28 2.02 -1.72 -2.14 112.91 116.27 1dt6 h THR 299 Ca 0.16 -0.28 -0.00 0.00 0.77 0.00 0.00 66.41 67.06 1dt6 h THR 299 Cb 0.41 0.03 -0.00 0.00 -1.74 0.00 0.00 68.15 66.85 1dt6 h THR 299 CO -0.93 0.15 -0.00 -1.28 0.37 0.00 0.00 175.52 173.83 1dt6 h SER 300 N 0.83 0.02 0.29 4.18 0.87 -0.86 -2.05 113.55 116.82 1dt6 h SER 300 Ca 0.40 -0.33 0.00 0.00 -1.23 0.00 0.00 61.79 60.62 1dt6 h SER 300 Cb 0.34 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.30 1dt6 h SER 300 CO -0.24 0.35 0.00 1.07 -0.53 0.00 0.00 176.83 177.48 1dt6 n THR 301 N -4.91 1.08 -0.02 2.23 5.66 -0.29 -1.21 114.28 116.82 1dt6 n THR 301 Ca -0.08 0.50 -0.21 0.00 -3.05 0.00 0.00 64.05 61.21 1dt6 n THR 301 Cb 0.18 -1.46 -0.13 0.00 -1.55 0.00 0.00 70.33 67.38 1dt6 n THR 301 CO 0.00 0.00 0.00 0.74 -3.05 0.00 0.00 175.07 172.76 1dt6 h THR 302 N 0.00 0.98 -0.80 1.09 2.02 -1.19 -2.74 112.91 112.28 1dt6 h THR 302 Ca 0.00 -2.33 -0.02 0.00 0.77 0.00 0.00 66.41 64.82 1dt6 h THR 302 Cb 0.14 2.60 -0.04 0.00 -1.74 0.00 0.00 68.15 69.12 1dt6 h THR 302 CO 0.00 0.63 0.40 -0.07 0.37 0.00 0.00 175.52 176.86 1dt6 h LEU 303 N -0.45 1.02 -1.15 2.58 3.38 -0.82 0.88 115.31 120.76 1dt6 h LEU 303 Ca -0.32 -0.12 -0.07 0.00 0.09 0.00 0.00 57.88 57.46 1dt6 h LEU 303 Cb 1.65 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 42.12 1dt6 h LEU 303 CO -0.01 0.86 -0.16 -0.09 0.09 0.00 0.00 178.44 179.14 1dt6 h ARG 304 N 1.12 0.40 0.01 1.13 2.43 -1.30 -2.45 114.38 115.73 1dt6 h ARG 304 Ca 0.28 -0.12 -0.20 0.00 -0.81 0.00 0.00 59.98 59.13 1dt6 h ARG 304 Cb 0.09 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.58 1dt6 h ARG 304 CO -0.04 0.56 -0.92 -0.92 -1.51 0.00 0.00 179.97 177.14 1dt6 h TYR 305 N 0.37 0.16 0.03 2.20 -0.00 -0.94 -3.21 116.97 115.59 1dt6 h TYR 305 Ca 0.07 -0.10 -0.00 0.00 -0.00 0.00 0.00 58.73 58.70 1dt6 h TYR 305 Cb 0.50 -0.01 0.00 0.00 -0.00 0.00 0.00 36.73 37.21 1dt6 h TYR 305 CO 0.01 0.96 -0.01 0.77 -0.00 0.00 0.00 178.16 179.89 1dt6 h SER 306 N 0.05 -0.03 -0.68 -2.11 0.02 0.12 -2.61 113.55 108.31 1dt6 h SER 306 Ca -0.04 -0.07 0.04 0.00 -0.84 0.00 0.00 61.79 60.88 1dt6 h SER 306 Cb 1.59 0.01 -0.05 0.00 0.14 0.00 0.00 62.40 64.09 1dt6 h SER 306 CO 0.13 0.05 0.40 -0.07 -1.14 0.00 0.00 176.83 176.21 1dt6 h LEU 307 N -0.11 0.64 -0.78 5.07 3.38 -1.57 -0.74 115.31 121.20 1dt6 h LEU 307 Ca -0.00 0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.05 1dt6 h LEU 307 Cb 0.10 -0.12 -0.06 0.00 0.09 0.00 0.00 40.66 40.67 1dt6 h LEU 307 CO 0.01 0.43 0.45 0.25 0.09 0.00 0.00 178.44 179.66 1dt6 h LEU 308 N 0.77 0.67 -0.86 1.67 5.85 -1.53 0.12 115.31 122.00 1dt6 h LEU 308 Ca 0.29 0.03 -0.10 0.00 0.84 0.00 0.00 57.88 58.95 1dt6 h LEU 308 Cb 0.10 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.02 1dt6 h LEU 308 CO -0.14 0.41 -0.19 -0.07 -0.34 0.00 0.00 178.44 178.11 1dt6 h LEU 309 N 0.80 0.63 -0.84 2.25 3.38 -0.91 0.32 115.31 120.93 1dt6 h LEU 309 Ca 0.36 -0.20 -0.08 0.00 0.09 0.00 0.00 57.88 58.05 1dt6 h LEU 309 Cb 0.25 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1dt6 h LEU 309 CO -0.21 0.82 -0.36 -0.07 0.09 0.00 0.00 178.44 178.72 1dt6 h LEU 310 N 0.56 0.00 0.16 1.67 3.38 0.07 0.21 115.31 121.36 1dt6 h LEU 310 Ca 0.09 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.76 1dt6 h LEU 310 Cb 0.64 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.41 1dt6 h LEU 310 CO 0.05 0.36 -1.32 -0.07 0.09 0.00 0.00 178.44 177.54 1dt6 h LEU 311 N 0.00 0.63 -0.86 1.67 3.38 -0.42 -2.54 115.31 117.17 1dt6 h LEU 311 Ca -0.00 -0.66 -0.09 0.00 0.09 0.00 0.00 57.88 57.22 1dt6 h LEU 311 Cb 0.93 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.46 1dt6 h LEU 311 CO 0.05 1.50 -0.13 0.50 0.09 0.00 0.00 178.44 180.45 1dt6 h LYS 312 N 0.13 0.71 -2.37 1.13 1.63 0.05 -3.35 116.57 114.49 1dt6 h LYS 312 Ca -0.18 -0.23 -0.59 0.00 -0.85 0.00 0.00 60.65 58.79 1dt6 h LYS 312 Cb 2.03 -0.06 -0.40 0.00 -0.60 0.00 0.00 32.23 33.20 1dt6 h LYS 312 CO 0.23 0.81 -0.89 0.72 -3.45 0.00 0.00 179.45 176.87 1dt6 n HIS 313 N -4.16 0.56 0.14 1.91 8.25 0.69 -4.85 115.22 117.76 1dt6 n HIS 313 Ca 0.01 -3.67 0.09 0.00 -0.26 0.00 0.00 57.72 53.89 1dt6 n HIS 313 Cb 0.36 -0.17 0.47 0.00 1.12 0.00 0.00 29.99 31.77 1dt6 n HIS 313 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 1dt6 n PRO 314 N 2.03 0.11 -0.07 -0.41 -0.04 -0.96 -1.71 135.00 133.96 1dt6 n PRO 314 Ca 0.26 0.61 -0.04 0.00 -0.04 0.00 0.00 63.50 64.28 1dt6 n PRO 314 Cb 0.46 -1.90 0.18 0.00 -0.04 0.00 0.00 33.50 32.20 1dt6 n PRO 314 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 1dt6 h GLU 315 N 0.00 0.71 0.07 0.54 9.09 -1.94 -1.05 114.58 122.00 1dt6 h GLU 315 Ca 0.00 -0.20 -0.00 0.00 0.05 0.00 0.00 59.36 59.20 1dt6 h GLU 315 Cb 0.06 -0.08 0.00 0.00 -1.65 0.00 0.00 28.75 27.09 1dt6 h GLU 315 CO 0.00 0.76 -0.03 0.28 0.05 0.00 0.00 179.01 180.07 1dt6 h VAL 316 N 0.66 1.03 -0.63 -1.06 2.07 -1.67 -1.93 116.25 114.72 1dt6 h VAL 316 Ca 0.12 -0.32 0.06 0.00 0.82 0.00 0.00 66.70 67.38 1dt6 h VAL 316 Cb 0.50 1.25 -0.04 0.00 -1.52 0.00 0.00 31.29 31.47 1dt6 h VAL 316 CO 0.03 0.08 0.42 0.00 0.02 0.00 0.00 177.57 178.11 1dt6 h ALA 317 N 0.69 1.79 -0.04 1.67 0.00 -1.54 -0.59 119.26 121.23 1dt6 h ALA 317 Ca -0.01 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1dt6 h ALA 317 Cb 0.20 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 1dt6 h ALA 317 CO 0.01 0.11 -0.01 0.00 0.00 0.00 0.00 179.25 179.36 1dt6 h ALA 318 N 1.66 0.06 -0.30 0.00 0.00 -0.92 -2.35 119.26 117.40 1dt6 h ALA 318 Ca 0.27 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 1dt6 h ALA 318 Cb 0.27 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1dt6 h ALA 318 CO -0.08 -0.22 -0.08 0.00 0.00 0.00 0.00 179.25 178.86 1dt6 h ARG 319 N -0.28 0.50 -0.79 0.00 3.08 -0.95 -0.21 114.38 115.72 1dt6 h ARG 319 Ca 0.01 -0.13 -0.02 0.00 0.07 0.00 0.00 59.98 59.91 1dt6 h ARG 319 Cb 0.42 -0.06 -0.04 0.00 0.08 0.00 0.00 29.97 30.37 1dt6 h ARG 319 CO 0.01 0.59 0.43 0.28 -1.07 0.00 0.00 179.97 180.20 1dt6 h VAL 320 N 0.47 1.24 -0.34 2.04 2.07 -1.04 -0.61 116.25 120.07 1dt6 h VAL 320 Ca 0.09 -0.60 -0.13 0.00 0.82 0.00 0.00 66.70 66.88 1dt6 h VAL 320 Cb 0.43 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 1dt6 h VAL 320 CO 0.02 0.27 -0.32 1.56 0.02 0.00 0.00 177.57 179.12 1dt6 h GLN 321 N 1.10 0.75 0.53 1.57 4.20 -0.85 0.29 115.11 122.71 1dt6 h GLN 321 Ca 0.28 -0.35 -0.02 0.00 0.06 0.00 0.00 58.65 58.62 1dt6 h GLN 321 Cb 0.04 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.80 1dt6 h GLN 321 CO -0.04 0.97 -0.45 1.49 -0.67 0.00 0.00 178.83 180.12 1dt6 h GLU 322 N 0.64 -0.94 -0.91 1.46 4.22 -0.61 0.21 114.58 118.65 1dt6 h GLU 322 Ca 0.07 0.06 0.18 0.00 0.08 0.00 0.00 59.36 59.75 1dt6 h GLU 322 Cb 0.85 0.21 -0.11 0.00 0.50 0.00 0.00 28.75 30.21 1dt6 h GLU 322 CO 0.07 -0.63 0.48 1.49 -2.18 0.00 0.00 179.01 178.25 1dt6 h GLU 323 N -0.97 0.59 0.46 1.92 4.81 -0.88 0.92 114.58 121.43 1dt6 h GLU 323 Ca -0.06 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.11 1dt6 h GLU 323 Cb 0.83 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.08 1dt6 h GLU 323 CO -0.02 0.39 -0.22 0.82 -0.73 0.00 0.00 179.01 179.25 1dt6 h ILE 324 N 0.61 0.50 -0.77 2.32 2.04 0.66 -2.21 117.51 120.67 1dt6 h ILE 324 Ca 0.52 -0.32 0.07 0.00 1.00 0.00 0.00 64.86 66.13 1dt6 h ILE 324 Cb 0.83 0.64 -0.06 0.00 -0.74 0.00 0.00 36.82 37.49 1dt6 h ILE 324 CO -0.41 0.05 0.44 -0.33 0.00 0.00 0.00 178.15 177.91 1dt6 h GLU 325 N -0.83 0.76 -0.92 2.37 3.07 -0.15 0.20 114.58 119.08 1dt6 h GLU 325 Ca -0.06 -0.05 -0.01 0.00 -0.50 0.00 0.00 59.36 58.74 1dt6 h GLU 325 Cb 0.57 -0.17 -0.04 0.00 -0.84 0.00 0.00 28.75 28.26 1dt6 h GLU 325 CO 0.10 0.50 0.53 -0.09 -1.40 0.00 0.00 179.01 178.66 1dt6 h ARG 326 N 0.78 1.27 0.00 2.33 2.43 -0.72 -3.36 114.38 117.12 1dt6 h ARG 326 Ca 0.35 -0.13 -0.18 0.00 -0.81 0.00 0.00 59.98 59.21 1dt6 h ARG 326 Cb 0.25 -0.26 -0.03 0.00 -0.42 0.00 0.00 29.97 29.51 1dt6 h ARG 326 CO -0.21 0.91 -1.66 1.33 -1.51 0.00 0.00 179.97 178.83 1dt6 n VAL 327 N -4.34 0.66 -4.03 0.20 0.24 -0.84 -4.98 118.33 105.23 1dt6 n VAL 327 Ca 0.10 -0.40 -0.30 0.00 -2.04 0.00 0.00 64.34 61.70 1dt6 n VAL 327 Cb 0.08 -0.75 -0.06 0.00 -1.47 0.00 0.00 33.84 31.64 1dt6 n VAL 327 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 1dt6 s ILE 328 N -2.23 4.66 0.00 1.34 1.01 0.69 -5.09 121.20 121.58 1dt6 s ILE 328 Ca -0.05 -0.76 0.00 0.00 0.00 0.00 0.00 60.65 59.84 1dt6 s ILE 328 Cb 0.03 -3.27 0.00 0.00 0.01 0.00 0.00 42.46 39.22 1dt6 s ILE 328 CO 0.39 0.09 0.00 0.61 0.00 0.00 0.00 174.94 176.03 1dt6 n GLY 329 N 0.28 -2.60 0.00 6.18 0.00 -1.26 -4.03 105.19 103.76 1dt6 n GLY 329 Ca -0.08 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.17 1dt6 n GLY 329 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dt6 n ARG 330 N 0.00 2.49 0.00 1.61 1.74 -1.26 -4.33 116.66 116.90 1dt6 n ARG 330 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1dt6 n ARG 330 Cb 0.00 -0.26 0.00 0.00 -1.02 0.00 0.00 32.46 31.18 1dt6 n ARG 330 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1dt6 n HIS 331 N -0.21 0.00 -1.23 -1.55 8.25 -1.26 -5.01 115.22 114.21 1dt6 n HIS 331 Ca 0.00 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.09 1dt6 n HIS 331 Cb 0.00 0.00 0.05 0.00 1.12 0.00 0.00 29.99 31.16 1dt6 n HIS 331 CO 0.00 0.00 0.00 2.89 0.64 0.00 0.00 176.34 179.87 1dt6 n ARG 332 N 0.00 0.21 -1.98 -0.41 1.85 -1.26 -4.98 116.66 110.09 1dt6 n ARG 332 Ca 0.00 0.10 -0.28 0.00 -1.00 0.00 0.00 57.85 56.66 1dt6 n ARG 332 Cb 0.00 -1.56 0.09 0.00 -1.05 0.00 0.00 32.46 29.94 1dt6 n ARG 332 CO 0.00 0.00 0.00 -1.54 -0.01 0.00 0.00 177.63 176.08 1dt6 s SER 333 N -1.31 4.49 0.52 2.89 1.04 -1.26 -4.47 113.70 115.60 1dt6 s SER 333 Ca 0.61 0.66 -0.13 0.00 0.48 0.00 0.00 55.95 57.57 1dt6 s SER 333 Cb -0.36 -1.16 -0.06 0.00 0.10 0.00 0.00 66.02 64.53 1dt6 s SER 333 CO 0.62 -1.88 0.93 -2.84 0.98 0.00 0.00 173.24 171.06 1dt6 s PRO 334 N -5.51 3.79 0.06 4.02 0.02 -1.26 -4.93 135.00 131.19 1dt6 s PRO 334 Ca 0.62 0.74 0.02 0.00 0.02 0.00 0.00 61.00 62.40 1dt6 s PRO 334 Cb -0.10 -2.20 -0.03 0.00 0.02 0.00 0.00 34.50 32.19 1dt6 s PRO 334 CO 0.48 -0.29 -0.08 0.00 -0.33 0.00 0.00 177.00 176.78 1dt6 h MET 336 N 3.91 0.49 -0.91 0.00 2.86 -1.98 -1.76 114.93 117.55 1dt6 h MET 336 Ca -0.36 -0.03 0.25 0.00 -2.06 0.00 0.00 59.70 57.50 1dt6 h MET 336 Cb 1.19 -0.11 -0.14 0.00 0.06 0.00 0.00 31.60 32.60 1dt6 h MET 336 CO 0.50 0.32 0.33 0.37 1.06 0.00 0.00 176.91 179.49 1dt6 h GLN 337 N 0.50 0.26 -0.63 1.72 5.75 -2.03 -1.72 115.11 118.96 1dt6 h GLN 337 Ca 0.54 -0.02 0.12 0.00 -0.15 0.00 0.00 58.65 59.14 1dt6 h GLN 337 Cb 1.20 -0.06 -0.09 0.00 1.07 0.00 0.00 27.48 29.60 1dt6 h GLN 337 CO -0.27 0.17 0.17 -0.44 -2.65 0.00 0.00 178.83 175.81 1dt6 h ASP 338 N 0.27 0.07 -0.89 -0.69 3.32 -1.74 -3.14 116.42 113.61 1dt6 h ASP 338 Ca 0.59 0.11 0.30 0.00 0.02 0.00 0.00 57.03 58.05 1dt6 h ASP 338 Cb 1.21 0.14 -0.16 0.00 0.22 0.00 0.00 39.33 40.74 1dt6 h ASP 338 CO -0.62 0.03 0.21 -1.14 -1.72 0.00 0.00 179.24 176.00 1dt6 n ARG 339 N -5.10 -0.06 0.30 3.56 0.63 -0.65 0.57 116.66 115.91 1dt6 n ARG 339 Ca 0.10 1.28 0.18 0.00 -0.92 0.00 0.00 57.85 58.49 1dt6 n ARG 339 Cb 0.34 -2.14 0.92 0.00 0.45 0.00 0.00 32.46 32.03 1dt6 n ARG 339 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 1dt6 h SER 340 N 0.00 0.00 -0.49 6.15 4.64 -1.74 -1.55 113.55 120.56 1dt6 h SER 340 Ca 0.63 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.95 1dt6 h SER 340 Cb 1.47 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.56 1dt6 h SER 340 CO -0.77 0.04 0.00 -1.14 -0.87 0.00 0.00 176.83 174.08 1dt6 n ARG 341 N -3.31 3.95 -3.20 4.77 0.63 0.19 -4.62 116.66 115.08 1dt6 n ARG 341 Ca -0.02 -2.95 -0.23 0.00 -0.92 0.00 0.00 57.85 53.74 1dt6 n ARG 341 Cb 0.18 -2.00 -0.06 0.00 0.45 0.00 0.00 32.46 31.03 1dt6 n ARG 341 CO 0.00 0.00 0.00 -1.33 -2.51 0.00 0.00 177.63 173.79 1dt6 n MET 342 N 0.41 1.28 -0.20 -0.14 2.81 -0.58 -4.96 117.12 115.75 1dt6 n MET 342 Ca 0.25 -3.63 -0.01 0.00 -1.81 0.00 0.00 57.70 52.50 1dt6 n MET 342 Cb 1.00 -1.60 0.09 0.00 -0.71 0.00 0.00 33.22 32.00 1dt6 n MET 342 CO 0.00 0.00 0.00 -1.00 1.51 0.00 0.00 175.97 176.48 1dt6 h PRO 343 N 3.64 0.44 -0.17 0.03 0.13 -1.82 -1.91 132.00 132.33 1dt6 h PRO 343 Ca 0.10 -0.03 -0.00 0.00 -0.87 0.00 0.00 66.00 65.21 1dt6 h PRO 343 Cb 0.84 -0.10 -0.01 0.00 0.13 0.00 0.00 31.00 31.86 1dt6 h PRO 343 CO 0.56 0.29 0.11 -0.92 -0.23 0.00 0.00 178.00 177.81 1dt6 h TYR 344 N 0.45 0.23 -0.58 1.56 3.20 -1.94 0.60 116.97 120.49 1dt6 h TYR 344 Ca 0.29 0.00 0.03 0.00 3.14 0.00 0.00 58.73 62.19 1dt6 h TYR 344 Cb 0.30 -0.07 -0.04 0.00 1.54 0.00 0.00 36.73 38.46 1dt6 h TYR 344 CO -0.14 0.17 0.35 1.15 -1.64 0.00 0.00 178.16 178.05 1dt6 h THR 345 N 0.21 1.04 -0.47 1.81 2.02 -1.86 0.15 112.91 115.82 1dt6 h THR 345 Ca 0.06 -0.23 -0.09 0.00 0.77 0.00 0.00 66.41 66.92 1dt6 h THR 345 Cb 0.01 0.31 -0.02 0.00 -1.74 0.00 0.00 68.15 66.71 1dt6 h THR 345 CO -0.01 0.12 -0.08 -0.78 0.37 0.00 0.00 175.52 175.14 1dt6 h ASP 346 N 0.68 0.82 -0.83 4.18 1.82 -0.94 -1.38 116.42 120.76 1dt6 h ASP 346 Ca 0.24 -0.24 0.01 0.00 -0.39 0.00 0.00 57.03 56.65 1dt6 h ASP 346 Cb 0.05 -0.22 -0.04 0.00 0.68 0.00 0.00 39.33 39.80 1dt6 h ASP 346 CO -0.11 0.93 0.55 0.00 -1.61 0.00 0.00 179.24 178.99 1dt6 h ALA 347 N 1.15 1.05 0.55 -0.78 0.00 0.11 -0.41 119.26 120.93 1dt6 h ALA 347 Ca 0.13 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 1dt6 h ALA 347 Cb 0.57 -0.33 0.01 0.00 0.00 0.00 0.00 17.79 18.03 1dt6 h ALA 347 CO 0.03 0.45 -0.26 0.28 0.00 0.00 0.00 179.25 179.76 1dt6 h VAL 348 N 1.12 0.38 -0.85 0.00 2.07 -0.30 0.31 116.25 118.97 1dt6 h VAL 348 Ca 0.30 -0.30 0.13 0.00 0.82 0.00 0.00 66.70 67.65 1dt6 h VAL 348 Cb -0.13 0.49 -0.06 0.00 -1.52 0.00 0.00 31.29 30.06 1dt6 h VAL 348 CO -0.07 0.04 0.55 0.40 0.02 0.00 0.00 177.57 178.52 1dt6 h ILE 349 N -0.94 0.87 0.25 4.57 2.04 -1.20 0.20 117.51 123.30 1dt6 h ILE 349 Ca -0.07 -0.24 -0.01 0.00 1.00 0.00 0.00 64.86 65.54 1dt6 h ILE 349 Cb 0.63 0.12 0.00 0.00 -0.74 0.00 0.00 36.82 36.83 1dt6 h ILE 349 CO 0.12 0.13 -0.12 0.45 0.00 0.00 0.00 178.15 178.73 1dt6 h HIS 350 N 0.69 -0.31 -0.60 1.37 3.86 -0.78 -2.75 115.15 116.63 1dt6 h HIS 350 Ca 0.42 -0.01 0.06 0.00 -1.16 0.00 0.00 60.37 59.68 1dt6 h HIS 350 Cb 0.64 0.10 -0.04 0.00 1.06 0.00 0.00 27.41 29.17 1dt6 h HIS 350 CO -0.00 -0.08 0.40 1.49 0.86 0.00 0.00 177.93 180.60 1dt6 h GLU 351 N -0.50 0.57 -0.51 2.45 4.57 0.12 -1.98 114.58 119.30 1dt6 h GLU 351 Ca -0.03 -0.03 -0.04 0.00 -1.18 0.00 0.00 59.36 58.07 1dt6 h GLU 351 Cb 0.37 -0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 28.81 1dt6 h GLU 351 CO 0.06 0.38 0.15 0.82 -1.18 0.00 0.00 179.01 179.23 1dt6 h ILE 352 N 0.58 1.23 -0.51 2.32 2.04 -0.51 0.11 117.51 122.78 1dt6 h ILE 352 Ca 0.26 -0.79 -0.13 0.00 1.00 0.00 0.00 64.86 65.20 1dt6 h ILE 352 Cb 0.28 0.79 -0.01 0.00 -0.74 0.00 0.00 36.82 37.13 1dt6 h ILE 352 CO -0.08 0.29 -0.18 1.56 0.00 0.00 0.00 178.15 179.74 1dt6 h GLN 353 N 0.69 1.02 -0.18 2.37 4.20 -1.14 -0.56 115.11 121.50 1dt6 h GLN 353 Ca 0.16 -0.42 -0.02 0.00 0.06 0.00 0.00 58.65 58.44 1dt6 h GLN 353 Cb 0.29 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.02 1dt6 h GLN 353 CO -0.00 1.10 0.05 -0.09 -0.67 0.00 0.00 178.83 179.22 1dt6 h ARG 354 N 0.88 0.29 -0.27 1.46 2.43 -1.19 -2.95 114.38 115.04 1dt6 h ARG 354 Ca 0.12 -0.07 -0.10 0.00 -0.81 0.00 0.00 59.98 59.12 1dt6 h ARG 354 Cb 0.76 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.26 1dt6 h ARG 354 CO 0.06 0.42 -0.22 0.35 -1.51 0.00 0.00 179.97 179.07 1dt6 h PHE 355 N 0.11 0.75 0.00 2.20 3.04 -0.73 -3.20 116.94 119.11 1dt6 h PHE 355 Ca 0.06 -0.21 0.00 0.00 3.98 0.00 0.00 57.97 61.80 1dt6 h PHE 355 Cb 0.26 -0.16 0.00 0.00 2.56 0.00 0.00 35.95 38.60 1dt6 h PHE 355 CO 0.01 0.92 0.00 -0.84 -2.02 0.00 0.00 178.31 176.37 1dt6 h ILE 356 N 0.36 0.00 -6.61 1.41 3.07 -1.16 -3.47 117.51 111.10 1dt6 h ILE 356 Ca 0.05 -0.46 -0.44 0.00 1.55 0.00 0.00 64.86 65.56 1dt6 h ILE 356 Cb 0.77 1.36 -0.00 0.00 -0.27 0.00 0.00 36.82 38.68 1dt6 h ILE 356 CO 0.06 0.00 -0.94 -0.67 -1.05 0.00 0.00 178.15 175.54 1dt6 n ASP 357 N -2.67 -3.99 -0.25 2.16 4.64 -1.11 -4.80 116.55 110.53 1dt6 n ASP 357 Ca 0.02 -0.89 0.10 0.00 -1.38 0.00 0.00 54.79 52.64 1dt6 n ASP 357 Cb 0.32 -1.36 0.37 0.00 -1.04 0.00 0.00 41.12 39.41 1dt6 n ASP 357 CO 0.00 0.00 0.00 0.25 -0.82 0.00 0.00 177.20 176.63 1dt6 h LEU 358 N -0.41 0.66 -6.49 -2.67 5.85 -1.88 -3.30 115.31 107.07 1dt6 h LEU 358 Ca -0.57 0.03 -0.60 0.00 0.84 0.00 0.00 57.88 57.58 1dt6 h LEU 358 Cb 1.21 -0.11 -0.40 0.00 0.37 0.00 0.00 40.66 41.72 1dt6 h LEU 358 CO 0.34 0.37 -0.77 0.18 -0.34 0.00 0.00 178.44 178.21 1dt6 n LEU 359 N -4.53 1.83 -0.35 2.25 4.32 -1.26 -1.18 117.00 118.09 1dt6 n LEU 359 Ca 0.15 -4.97 -0.06 0.00 -0.02 0.00 0.00 56.01 51.11 1dt6 n LEU 359 Cb 0.39 -0.16 -0.04 0.00 -1.62 0.00 0.00 43.42 41.99 1dt6 n LEU 359 CO 0.31 1.91 0.45 -2.65 -1.22 0.00 0.00 177.39 176.19 1dt6 n PRO 360 N 1.80 -0.30 -4.18 3.23 -0.01 -1.24 -3.12 135.00 131.18 1dt6 n PRO 360 Ca 0.25 1.30 -0.34 0.00 -0.01 0.00 0.00 63.50 64.70 1dt6 n PRO 360 Cb 0.43 -1.92 -0.13 0.00 -0.01 0.00 0.00 33.50 31.87 1dt6 n PRO 360 CO 0.00 0.00 0.00 0.95 -0.01 0.00 0.00 175.50 176.44 1dt6 s THR 361 N -5.59 3.77 0.00 3.45 -4.23 -1.26 -0.71 115.64 111.08 1dt6 s THR 361 Ca -0.11 -0.38 0.00 0.00 -1.18 0.00 0.00 61.69 60.02 1dt6 s THR 361 Cb 0.13 -2.69 0.00 0.00 1.34 0.00 0.00 72.50 71.28 1dt6 s THR 361 CO 0.56 0.45 0.00 -0.46 -0.54 0.00 0.00 174.62 174.63 1dt6 n ASN 362 N 4.12 0.00 -4.81 3.99 2.04 -1.18 -4.90 115.26 114.52 1dt6 n ASN 362 Ca -0.17 0.00 -0.35 0.00 -0.44 0.00 0.00 54.58 53.62 1dt6 n ASN 362 Cb 0.52 0.00 -0.06 0.00 -2.53 0.00 0.00 39.78 37.70 1dt6 n ASN 362 CO 0.00 0.00 0.00 -0.76 -0.44 0.00 0.00 177.26 176.06 1dt6 s LEU 363 N 0.00 4.20 0.32 -4.53 1.43 -1.26 -4.97 118.68 113.88 1dt6 s LEU 363 Ca 0.00 1.59 -0.29 0.00 -1.03 0.00 0.00 54.13 54.40 1dt6 s LEU 363 Cb 0.00 -4.02 -0.12 0.00 0.03 0.00 0.00 46.19 42.08 1dt6 s LEU 363 CO 0.00 -0.13 1.43 -0.81 0.23 0.00 0.00 176.35 177.07 1dt6 n PRO 364 N 0.18 2.37 -4.20 1.29 -0.04 -1.26 -4.85 135.00 128.49 1dt6 n PRO 364 Ca 0.02 0.84 -0.24 0.00 -0.04 0.00 0.00 63.50 64.08 1dt6 n PRO 364 Cb 0.52 -2.52 -0.07 0.00 -0.04 0.00 0.00 33.50 31.39 1dt6 n PRO 364 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 1dt6 s HIS 365 N -0.65 2.63 -0.22 0.54 3.76 0.29 -3.85 115.29 117.79 1dt6 s HIS 365 Ca 0.59 -0.42 -0.11 0.00 -0.15 0.00 0.00 55.06 54.97 1dt6 s HIS 365 Cb -0.54 -1.60 0.08 0.00 1.11 0.00 0.00 32.58 31.62 1dt6 s HIS 365 CO 0.57 0.38 0.52 0.00 -0.85 0.00 0.00 174.74 175.37 1dt6 s ALA 366 N -2.48 -1.42 0.64 -1.40 0.00 -1.14 0.68 121.76 116.64 1dt6 s ALA 366 Ca 0.37 1.88 -0.18 0.00 0.00 0.00 0.00 51.96 54.03 1dt6 s ALA 366 Cb -0.01 -1.24 -0.01 0.00 0.00 0.00 0.00 23.12 21.86 1dt6 s ALA 366 CO 0.21 -0.46 1.26 0.14 0.00 0.00 0.00 175.76 176.92 1dt6 s VAL 367 N 1.85 2.23 -0.70 0.00 -7.23 -0.95 -0.96 120.40 114.65 1dt6 s VAL 367 Ca -0.08 0.14 0.01 0.00 -1.81 0.00 0.00 61.98 60.24 1dt6 s VAL 367 Cb -0.08 -3.03 0.37 0.00 0.56 0.00 0.00 36.38 34.20 1dt6 s VAL 367 CO -0.16 -0.03 1.63 0.35 -0.31 0.00 0.00 175.10 176.58 1dt6 n THR 368 N -1.88 3.26 0.00 5.32 -2.24 -0.73 -2.17 114.28 115.85 1dt6 n THR 368 Ca 0.15 -4.69 0.00 0.00 -2.27 0.00 0.00 64.05 57.24 1dt6 n THR 368 Cb 0.49 -1.27 0.00 0.00 -2.10 0.00 0.00 70.33 67.44 1dt6 n THR 368 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1dt6 n ARG 369 N -0.48 0.00 -3.97 -0.78 3.00 -1.26 -4.99 116.66 108.17 1dt6 n ARG 369 Ca 0.47 0.00 -0.21 0.00 -0.00 0.00 0.00 57.85 58.11 1dt6 n ARG 369 Cb 0.40 0.00 -0.02 0.00 0.00 0.00 0.00 32.46 32.84 1dt6 n ARG 369 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1dt6 s ASP 370 N -4.00 6.11 -0.24 6.15 1.11 -1.26 0.48 116.67 125.02 1dt6 s ASP 370 Ca 0.00 -0.02 -0.16 0.00 0.18 0.00 0.00 52.55 52.55 1dt6 s ASP 370 Cb 0.00 -1.71 0.07 0.00 1.07 0.00 0.00 42.92 42.34 1dt6 s ASP 370 CO 0.00 -0.09 0.60 0.68 1.18 0.00 0.00 175.17 177.54 1dt6 s VAL 371 N -2.03 -0.01 -0.96 -1.27 -7.23 -0.48 -4.92 120.40 103.50 1dt6 s VAL 371 Ca 0.34 0.02 -0.01 0.00 -1.81 0.00 0.00 61.98 60.53 1dt6 s VAL 371 Cb -0.09 -0.86 0.31 0.00 0.56 0.00 0.00 36.38 36.31 1dt6 s VAL 371 CO 0.28 0.01 1.54 -2.11 -0.31 0.00 0.00 175.10 174.51 1dt6 n ARG 372 N 3.79 4.67 -1.64 4.82 1.85 -1.26 0.37 116.66 129.26 1dt6 n ARG 372 Ca -0.19 -4.66 -0.44 0.00 -1.00 0.00 0.00 57.85 51.56 1dt6 n ARG 372 Cb 0.57 -2.44 -0.04 0.00 -1.05 0.00 0.00 32.46 29.51 1dt6 n ARG 372 CO 0.00 0.00 0.00 0.34 -0.01 0.00 0.00 177.63 177.96 1dt6 n PHE 373 N 0.41 2.28 -2.74 2.89 7.35 -1.26 -4.64 117.46 121.76 1dt6 n PHE 373 Ca 0.37 -0.21 0.00 0.00 -0.76 0.00 0.00 57.45 56.85 1dt6 n PHE 373 Cb 0.31 -2.75 0.00 0.00 0.35 0.00 0.00 39.48 37.39 1dt6 n PHE 373 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 1dt6 n ARG 374 N 7.76 0.00 -2.29 -4.13 5.12 -1.26 -2.39 116.66 119.47 1dt6 n ARG 374 Ca 0.24 0.00 -0.43 0.00 -1.93 0.00 0.00 57.85 55.74 1dt6 n ARG 374 Cb 0.39 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.69 1dt6 n ARG 374 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 1dt6 n ASN 375 N -3.45 4.58 0.00 0.55 4.13 -1.26 -4.50 115.26 115.30 1dt6 n ASN 375 Ca 0.00 -2.90 0.00 0.00 1.68 0.00 0.00 54.58 53.36 1dt6 n ASN 375 Cb 0.00 -1.69 0.00 0.00 -1.54 0.00 0.00 39.78 36.55 1dt6 n ASN 375 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1dt6 n TYR 376 N 7.20 -0.13 -0.13 3.10 4.01 -1.00 -5.03 117.16 125.17 1dt6 n TYR 376 Ca 0.49 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 58.23 1dt6 n TYR 376 Cb 0.43 0.08 0.00 0.00 -0.31 0.00 0.00 39.34 39.54 1dt6 n TYR 376 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 1dt6 n PHE 377 N -1.24 0.00 -4.80 -0.72 -0.00 -1.25 -3.06 117.46 106.39 1dt6 n PHE 377 Ca 0.00 0.00 -0.33 0.00 -0.00 0.00 0.00 57.45 57.12 1dt6 n PHE 377 Cb 0.00 -0.28 -0.16 0.00 -0.00 0.00 0.00 39.48 39.04 1dt6 n PHE 377 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.76 177.18 1dt6 s ILE 378 N 0.00 2.49 0.32 -2.13 1.09 0.16 -3.96 121.20 119.17 1dt6 s ILE 378 Ca 0.00 -0.85 -0.23 0.00 -1.10 0.00 0.00 60.65 58.47 1dt6 s ILE 378 Cb 0.00 -2.02 -0.10 0.00 -1.06 0.00 0.00 42.46 39.29 1dt6 s ILE 378 CO 0.00 0.53 0.88 -2.16 -0.10 0.00 0.00 174.94 174.10 1dt6 s PRO 379 N 0.58 4.40 -0.06 2.79 0.04 -1.26 -1.38 135.00 140.10 1dt6 s PRO 379 Ca -0.11 1.14 -0.40 0.00 0.04 0.00 0.00 61.00 61.68 1dt6 s PRO 379 Cb -0.16 -2.67 -0.19 0.00 0.04 0.00 0.00 34.50 31.52 1dt6 s PRO 379 CO 0.03 0.24 1.26 1.17 0.04 0.00 0.00 177.00 179.74 1dt6 n LYS 380 N 0.30 0.39 -0.00 4.56 4.81 0.18 -1.94 118.16 126.45 1dt6 n LYS 380 Ca 0.02 0.14 0.00 0.00 -0.87 0.00 0.00 58.31 57.60 1dt6 n LYS 380 Cb 0.51 -1.70 0.00 0.00 0.02 0.00 0.00 35.03 33.87 1dt6 n LYS 380 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1dt6 n GLY 381 N 2.31 0.29 3.77 3.14 0.00 -0.92 -4.87 105.19 108.90 1dt6 n GLY 381 Ca 0.21 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 1dt6 n GLY 381 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1dt6 s THR 382 N -2.10 2.56 -0.03 2.61 2.01 -0.82 -4.76 115.64 115.11 1dt6 s THR 382 Ca 0.00 0.54 -0.25 0.00 0.31 0.00 0.00 61.69 62.29 1dt6 s THR 382 Cb 0.00 -3.33 -0.04 0.00 0.01 0.00 0.00 72.50 69.14 1dt6 s THR 382 CO 0.00 0.11 0.78 -1.81 -0.69 0.00 0.00 174.62 173.00 1dt6 s ASP 383 N -0.54 7.11 -0.07 3.53 1.01 -1.22 -2.23 116.67 124.26 1dt6 s ASP 383 Ca 0.53 1.34 0.03 0.00 0.71 0.00 0.00 52.55 55.16 1dt6 s ASP 383 Cb -0.40 -2.46 -0.02 0.00 1.01 0.00 0.00 42.92 41.05 1dt6 s ASP 383 CO 0.53 -0.12 -0.15 -0.63 0.21 0.00 0.00 175.17 175.00 1dt6 s ILE 384 N 0.69 2.95 -0.06 0.77 -1.09 0.22 -1.67 121.20 123.01 1dt6 s ILE 384 Ca 0.41 -0.74 0.01 0.00 -2.23 0.00 0.00 60.65 58.09 1dt6 s ILE 384 Cb -0.19 -2.17 0.02 0.00 -1.58 0.00 0.00 42.46 38.54 1dt6 s ILE 384 CO 0.21 0.57 -0.05 0.27 -1.23 0.00 0.00 174.94 174.71 1dt6 s ILE 385 N -0.34 0.62 -0.25 2.92 -4.36 -1.12 -0.55 121.20 118.12 1dt6 s ILE 385 Ca 0.03 -0.14 -0.08 0.00 -0.26 0.00 0.00 60.65 60.20 1dt6 s ILE 385 Cb -0.13 -0.65 -0.03 0.00 1.25 0.00 0.00 42.46 42.90 1dt6 s ILE 385 CO 0.02 0.26 0.09 0.42 0.24 0.00 0.00 174.94 175.97 1dt6 s THR 386 N 1.10 4.53 -0.97 8.37 -4.23 -1.26 -1.93 115.64 121.25 1dt6 s THR 386 Ca -0.08 -0.10 -0.24 0.00 -1.18 0.00 0.00 61.69 60.09 1dt6 s THR 386 Cb -0.14 -3.12 -0.03 0.00 1.34 0.00 0.00 72.50 70.55 1dt6 s THR 386 CO -0.01 0.33 1.84 -0.55 -0.54 0.00 0.00 174.62 175.69 1dt6 s SER 387 N 1.59 5.45 0.25 3.99 0.15 -0.59 -3.66 113.70 120.88 1dt6 s SER 387 Ca 0.06 -0.98 -0.00 0.00 0.70 0.00 0.00 55.95 55.73 1dt6 s SER 387 Cb -0.15 -2.57 0.31 0.00 -1.71 0.00 0.00 66.02 61.90 1dt6 s SER 387 CO 0.05 -2.48 1.67 -0.07 1.20 0.00 0.00 173.24 173.61 1dt6 h LEU 388 N 16.68 0.59 -0.88 3.45 3.38 -1.17 -1.81 115.31 135.54 1dt6 h LEU 388 Ca 0.14 -0.21 0.15 0.00 0.09 0.00 0.00 57.88 58.05 1dt6 h LEU 388 Cb 1.00 -0.16 -0.09 0.00 0.09 0.00 0.00 40.66 41.49 1dt6 h LEU 388 CO 1.26 0.84 0.48 0.00 0.09 0.00 0.00 178.44 181.11 1dt6 h THR 389 N 0.50 0.75 -0.27 0.22 1.03 -1.68 0.48 112.91 113.94 1dt6 h THR 389 Ca 0.07 -0.23 0.03 0.00 -0.01 0.00 0.00 66.41 66.27 1dt6 h THR 389 Cb 0.73 0.01 -0.01 0.00 -1.07 0.00 0.00 68.15 67.81 1dt6 h THR 389 CO 0.06 0.12 0.18 0.77 -0.01 0.00 0.00 175.52 176.65 1dt6 h SER 390 N 0.68 0.20 0.04 0.00 4.64 -1.61 0.27 113.55 117.76 1dt6 h SER 390 Ca 0.48 -0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.62 1dt6 h SER 390 Cb 0.67 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 62.70 1dt6 h SER 390 CO -0.35 0.13 -0.95 0.58 -0.87 0.00 0.00 176.83 175.37 1dt6 h VAL 391 N 0.23 1.21 -0.34 0.95 2.07 -0.22 -3.17 116.25 116.98 1dt6 h VAL 391 Ca 0.11 -2.31 0.07 0.00 0.82 0.00 0.00 66.70 65.39 1dt6 h VAL 391 Cb 0.18 2.73 -0.02 0.00 -1.52 0.00 0.00 31.29 32.66 1dt6 h VAL 391 CO -0.02 0.53 0.23 -0.07 0.02 0.00 0.00 177.57 178.26 1dt6 h LEU 392 N -0.76 0.15 -3.36 2.57 4.07 -0.10 -2.40 115.31 115.48 1dt6 h LEU 392 Ca -0.23 0.00 -0.12 0.00 0.08 0.00 0.00 57.88 57.61 1dt6 h LEU 392 Cb 1.38 -0.03 -0.07 0.00 1.08 0.00 0.00 40.66 43.02 1dt6 h LEU 392 CO -0.06 0.10 0.01 1.41 -1.08 0.00 0.00 178.44 178.82 1dt6 n HIS 393 N -4.47 1.18 -1.87 1.13 8.25 0.92 -4.82 115.22 115.53 1dt6 n HIS 393 Ca 0.04 -1.27 -0.42 0.00 -0.26 0.00 0.00 57.72 55.82 1dt6 n HIS 393 Cb 0.29 -0.44 -0.03 0.00 1.12 0.00 0.00 29.99 30.93 1dt6 n HIS 393 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1dt6 s ASP 394 N -2.14 6.53 0.00 0.41 -1.08 -0.91 -4.74 116.67 114.74 1dt6 s ASP 394 Ca 0.45 2.68 0.29 0.00 -0.52 0.00 0.00 52.55 55.44 1dt6 s ASP 394 Cb 0.38 -2.59 1.24 0.00 -1.46 0.00 0.00 42.92 40.49 1dt6 s ASP 394 CO 0.05 -0.87 1.93 -1.84 0.52 0.00 0.00 175.17 174.96 1dt6 n GLU 395 N 4.07 0.03 -0.04 4.34 0.28 -1.26 -1.43 120.64 126.63 1dt6 n GLU 395 Ca 0.15 0.01 -0.14 0.00 -0.16 0.00 0.00 57.16 57.01 1dt6 n GLU 395 Cb 0.38 -1.50 -0.14 0.00 1.43 0.00 0.00 31.44 31.61 1dt6 n GLU 395 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1dt6 n LYS 396 N -1.49 0.68 0.03 3.44 5.02 -1.26 -3.23 118.16 121.35 1dt6 n LYS 396 Ca 0.07 0.22 -0.19 0.00 -2.02 0.00 0.00 58.31 56.39 1dt6 n LYS 396 Cb 0.33 -1.69 -0.10 0.00 -0.02 0.00 0.00 35.03 33.56 1dt6 n LYS 396 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1dt6 h ALA 397 N 0.59 0.17 -2.46 7.82 0.00 -1.95 -3.38 119.26 120.05 1dt6 h ALA 397 Ca -0.41 -0.68 -0.59 0.00 0.00 0.00 0.00 54.91 53.23 1dt6 h ALA 397 Cb 2.05 0.04 -0.40 0.00 0.00 0.00 0.00 17.79 19.48 1dt6 h ALA 397 CO 0.05 0.69 -0.82 1.19 0.00 0.00 0.00 179.25 180.36 1dt6 n PHE 398 N -3.87 1.21 0.00 0.00 3.01 -0.51 -5.04 117.46 112.25 1dt6 n PHE 398 Ca -0.10 -3.80 0.00 0.00 1.01 0.00 0.00 57.45 54.56 1dt6 n PHE 398 Cb 0.85 -0.26 0.00 0.00 -0.01 0.00 0.00 39.48 40.06 1dt6 n PHE 398 CO 0.00 0.00 0.00 -2.30 1.01 0.00 0.00 176.76 175.47 1dt6 n PRO 399 N 1.93 0.00 -2.72 -1.08 -0.02 -1.20 -0.59 135.00 131.32 1dt6 n PRO 399 Ca 0.25 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 61.30 1dt6 n PRO 399 Cb 0.44 0.00 -0.01 0.00 -0.02 0.00 0.00 33.50 33.91 1dt6 n PRO 399 CO 0.00 0.00 0.00 -0.80 1.98 0.00 0.00 175.50 176.68 1dt6 s ASN 400 N 0.00 6.77 0.55 2.55 -0.87 -1.26 -4.57 114.94 118.10 1dt6 s ASN 400 Ca 0.00 -2.25 0.26 0.00 -1.57 0.00 0.00 52.86 49.29 1dt6 s ASN 400 Cb 0.00 -2.51 1.45 0.00 -0.02 0.00 0.00 41.25 40.17 1dt6 s ASN 400 CO 0.00 -1.14 2.02 -0.65 -2.57 0.00 0.00 177.10 174.75 1dt6 h PRO 401 N 8.25 0.00 -0.12 -0.60 0.11 -1.14 0.12 132.00 138.62 1dt6 h PRO 401 Ca 0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.42 1dt6 h PRO 401 Cb 0.93 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.04 1dt6 h PRO 401 CO 1.35 0.00 0.00 1.63 -0.21 0.00 0.00 178.00 180.77 1dt6 n LYS 402 N -4.20 1.33 -4.63 1.05 4.76 -1.26 -4.81 118.16 110.41 1dt6 n LYS 402 Ca 0.07 -0.51 -0.33 0.00 -2.87 0.00 0.00 58.31 54.67 1dt6 n LYS 402 Cb 0.52 -1.19 -0.13 0.00 -1.84 0.00 0.00 35.03 32.39 1dt6 n LYS 402 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1dt6 s VAL 403 N -1.84 3.39 -0.34 -0.18 1.01 0.40 -5.07 120.40 117.78 1dt6 s VAL 403 Ca 0.17 -0.54 -0.29 0.00 0.00 0.00 0.00 61.98 61.32 1dt6 s VAL 403 Cb 0.08 -2.45 0.02 0.00 0.00 0.00 0.00 36.38 34.03 1dt6 s VAL 403 CO 0.13 0.51 1.14 0.12 0.00 0.00 0.00 175.10 177.00 1dt6 s PHE 404 N 0.31 2.97 -0.25 5.22 5.36 -1.26 -4.95 117.98 125.39 1dt6 s PHE 404 Ca -0.08 1.03 -0.05 0.00 -0.96 0.00 0.00 56.93 56.87 1dt6 s PHE 404 Cb -0.15 -3.88 0.13 0.00 -0.34 0.00 0.00 43.02 38.78 1dt6 s PHE 404 CO 0.05 -1.09 0.48 0.34 -1.46 0.00 0.00 175.22 173.53 1dt6 s ASP 405 N 2.09 -0.46 0.43 6.13 3.68 -1.26 -5.00 116.67 122.28 1dt6 s ASP 405 Ca 0.49 0.81 0.28 0.00 2.13 0.00 0.00 52.55 56.26 1dt6 s ASP 405 Cb -0.12 1.58 1.54 0.00 -1.45 0.00 0.00 42.92 44.47 1dt6 s ASP 405 CO 0.20 -0.26 1.86 -0.65 0.13 0.00 0.00 175.17 176.46 1dt6 h PRO 406 N 8.12 0.00 -0.91 4.34 0.11 -1.92 -1.98 132.00 139.75 1dt6 h PRO 406 Ca -0.19 0.00 0.14 0.00 0.11 0.00 0.00 66.00 66.06 1dt6 h PRO 406 Cb 1.13 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 32.15 1dt6 h PRO 406 CO 0.19 0.00 0.52 0.78 -0.21 0.00 0.00 178.00 179.29 1dt6 h GLY 407 N 0.00 1.51 0.62 -0.55 0.00 -1.92 0.66 103.07 103.40 1dt6 h GLY 407 Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 47.33 47.00 1dt6 h GLY 407 CO 0.00 0.03 0.56 0.45 0.00 0.00 0.00 176.54 177.58 1dt6 h HIS 408 N 0.77 0.00 0.00 5.60 3.86 -1.75 0.33 115.15 123.96 1dt6 h HIS 408 Ca 0.48 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.68 1dt6 h HIS 408 Cb 0.61 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.06 1dt6 h HIS 408 CO -0.05 0.00 -0.24 1.19 0.86 0.00 0.00 177.93 179.69 1dt6 n PHE 409 N -2.10 0.00 -4.22 2.45 3.01 0.22 -4.81 117.46 112.01 1dt6 n PHE 409 Ca -0.01 -0.87 -0.17 0.00 1.01 0.00 0.00 57.45 57.42 1dt6 n PHE 409 Cb 0.57 -0.15 -0.11 0.00 -0.01 0.00 0.00 39.48 39.78 1dt6 n PHE 409 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1dt6 s LEU 410 N -2.23 2.40 -0.04 4.37 1.43 0.12 -3.82 118.68 120.91 1dt6 s LEU 410 Ca 0.27 -0.81 -0.02 0.00 -1.03 0.00 0.00 54.13 52.54 1dt6 s LEU 410 Cb 0.25 -0.49 -0.04 0.00 0.03 0.00 0.00 46.19 45.94 1dt6 s LEU 410 CO -0.00 -0.17 0.09 1.51 0.23 0.00 0.00 176.35 178.01 1dt6 s ASP 411 N -2.44 5.85 0.00 2.29 -4.77 -0.95 -4.91 116.67 111.73 1dt6 s ASP 411 Ca 0.08 0.24 0.00 0.00 -3.30 0.00 0.00 52.55 49.57 1dt6 s ASP 411 Cb -0.05 -1.75 0.00 0.00 -1.09 0.00 0.00 42.92 40.04 1dt6 s ASP 411 CO 0.02 0.32 0.10 1.21 0.70 0.00 0.00 175.17 177.52 1dt6 n GLU 412 N 1.48 0.06 -2.84 2.11 4.07 -1.26 -3.47 120.64 120.79 1dt6 n GLU 412 Ca -0.15 0.00 -0.11 0.00 -0.06 0.00 0.00 57.16 56.84 1dt6 n GLU 412 Cb 0.53 -1.47 0.04 0.00 -0.06 0.00 0.00 31.44 30.48 1dt6 n GLU 412 CO 0.00 0.00 0.00 0.45 -0.06 0.00 0.00 177.13 177.52 1dt6 n SER 413 N 1.74 -2.08 0.00 4.31 2.88 -1.26 -5.10 113.62 114.11 1dt6 n SER 413 Ca 0.00 -3.29 0.00 0.00 -1.33 0.00 0.00 58.87 54.25 1dt6 n SER 413 Cb 0.03 1.34 0.00 0.00 -0.75 0.00 0.00 64.21 64.83 1dt6 n SER 413 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1dt6 n GLY 414 N 1.23 -1.51 3.79 0.46 0.00 -1.23 -4.81 105.19 103.13 1dt6 n GLY 414 Ca 0.11 -1.57 -0.36 0.00 0.00 0.00 0.00 46.02 44.21 1dt6 n GLY 414 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1dt6 s ASN 415 N -3.78 6.82 -0.30 1.61 0.01 -1.26 -4.08 114.94 113.96 1dt6 s ASN 415 Ca 0.00 1.93 -0.16 0.00 -0.71 0.00 0.00 52.86 53.92 1dt6 s ASN 415 Cb 0.00 -2.57 0.19 0.00 0.41 0.00 0.00 41.25 39.27 1dt6 s ASN 415 CO 0.00 -0.45 1.16 -0.36 -1.51 0.00 0.00 177.10 175.95 1dt6 s PHE 416 N -1.79 -0.24 0.00 2.20 2.99 -1.26 -4.88 117.98 115.00 1dt6 s PHE 416 Ca 0.59 0.49 0.00 0.00 0.00 0.00 0.00 56.93 58.00 1dt6 s PHE 416 Cb -0.18 0.15 0.00 0.00 0.00 0.00 0.00 43.02 42.98 1dt6 s PHE 416 CO 0.23 -0.12 0.00 1.17 -0.00 0.00 0.00 175.22 176.50 1dt6 n LYS 417 N 3.29 -0.47 0.00 0.44 3.00 -1.25 -2.25 118.16 120.91 1dt6 n LYS 417 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.13 1dt6 n LYS 417 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.60 1dt6 n LYS 417 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 1dt6 n LYS 418 N -1.23 0.00 0.00 1.64 5.02 -1.25 -4.48 118.16 117.86 1dt6 n LYS 418 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1dt6 n LYS 418 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 1dt6 n LYS 418 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1dt6 n SER 419 N 0.00 -0.80 0.00 4.39 2.88 -1.26 -5.12 113.62 113.71 1dt6 n SER 419 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1dt6 n SER 419 Cb 0.00 0.64 0.00 0.00 -0.75 0.00 0.00 64.21 64.10 1dt6 n SER 419 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1dt6 n ASP 420 N -0.56 0.00 -1.47 -3.46 -0.08 -1.26 -4.89 116.55 104.82 1dt6 n ASP 420 Ca 0.00 0.00 0.06 0.00 -1.51 0.00 0.00 54.79 53.34 1dt6 n ASP 420 Cb 0.00 0.00 0.30 0.00 2.34 0.00 0.00 41.12 43.76 1dt6 n ASP 420 CO 0.00 0.00 0.00 -1.22 0.12 0.00 0.00 177.20 176.10 1dt6 n TYR 421 N -0.15 1.45 -2.76 -0.67 0.53 -1.26 -4.71 117.16 109.59 1dt6 n TYR 421 Ca 0.00 -0.52 -0.43 0.00 -1.02 0.00 0.00 57.90 55.93 1dt6 n TYR 421 Cb 0.00 -0.35 -0.00 0.00 -1.03 0.00 0.00 39.34 37.96 1dt6 n TYR 421 CO 0.00 0.00 0.00 0.12 -1.02 0.00 0.00 176.86 175.96 1dt6 s PHE 422 N -2.16 3.10 -0.35 -0.72 5.36 -1.26 -3.94 117.98 118.00 1dt6 s PHE 422 Ca 0.41 -1.79 0.06 0.00 -0.96 0.00 0.00 56.93 54.64 1dt6 s PHE 422 Cb 0.30 -4.54 0.46 0.00 -0.34 0.00 0.00 43.02 38.90 1dt6 s PHE 422 CO 0.14 -1.62 1.32 -1.33 -1.46 0.00 0.00 175.22 172.27 1dt6 n MET 423 N 7.14 3.47 0.21 10.12 2.81 -1.26 -4.78 117.12 134.83 1dt6 n MET 423 Ca 0.41 -4.03 0.15 0.00 -1.81 0.00 0.00 57.70 52.42 1dt6 n MET 423 Cb 0.45 -2.28 0.59 0.00 -0.71 0.00 0.00 33.22 31.28 1dt6 n MET 423 CO 0.00 0.00 0.00 -1.00 1.51 0.00 0.00 175.97 176.48 1dt6 h PRO 424 N 2.15 0.00 -0.63 0.03 0.13 -1.92 -1.31 132.00 130.46 1dt6 h PRO 424 Ca 0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.54 1dt6 h PRO 424 Cb 1.43 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.56 1dt6 h PRO 424 CO 0.89 0.00 0.00 1.19 -0.23 0.00 0.00 178.00 179.85 1dt6 n PHE 425 N -2.71 1.20 -4.35 1.56 3.01 -1.26 -4.90 117.46 110.01 1dt6 n PHE 425 Ca 0.01 -0.48 0.00 0.00 1.01 0.00 0.00 57.45 57.99 1dt6 n PHE 425 Cb 0.28 -0.20 0.00 0.00 -0.01 0.00 0.00 39.48 39.55 1dt6 n PHE 425 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1dt6 n SER 426 N 0.91 -0.89 0.00 4.37 2.88 -0.49 -1.24 113.62 119.16 1dt6 n SER 426 Ca 0.21 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.75 1dt6 n SER 426 Cb 0.74 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.20 1dt6 n SER 426 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1dt6 n ALA 427 N 2.45 0.66 -1.10 -1.46 0.00 -1.26 -4.76 120.51 115.05 1dt6 n ALA 427 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1dt6 n ALA 427 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1dt6 n ALA 427 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dt6 n GLY 428 N 0.00 0.98 0.75 0.00 0.00 -1.26 -4.48 105.19 101.18 1dt6 n GLY 428 Ca 0.00 -1.40 0.09 0.00 0.00 0.00 0.00 46.02 44.71 1dt6 n GLY 428 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1dt6 n LYS 429 N 0.00 1.62 -0.27 1.61 5.02 -1.26 -3.76 118.16 121.12 1dt6 n LYS 429 Ca 0.00 -1.65 0.09 0.00 -2.02 0.00 0.00 58.31 54.73 1dt6 n LYS 429 Cb 0.00 -1.35 0.20 0.00 -0.02 0.00 0.00 35.03 33.86 1dt6 n LYS 429 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1dt6 n ARG 430 N 1.02 2.13 -0.60 1.97 1.74 -1.26 -5.04 116.66 116.63 1dt6 n ARG 430 Ca 0.11 -2.72 -0.30 0.00 -0.77 0.00 0.00 57.85 54.17 1dt6 n ARG 430 Cb 0.46 -1.68 0.20 0.00 -1.02 0.00 0.00 32.46 30.42 1dt6 n ARG 430 CO 0.00 0.00 0.00 -0.12 -1.52 0.00 0.00 177.63 175.99 1dt6 n MET 431 N -0.96 -1.33 -1.32 5.56 1.56 -1.25 -4.88 117.12 114.51 1dt6 n MET 431 Ca 0.19 -0.34 -0.36 0.00 -0.27 0.00 0.00 57.70 56.92 1dt6 n MET 431 Cb 0.77 -2.24 0.07 0.00 2.15 0.00 0.00 33.22 33.98 1dt6 n MET 431 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1dt6 n VAL 433 N -2.38 1.13 0.95 0.00 0.31 -1.26 -4.32 118.33 112.76 1dt6 n VAL 433 Ca 0.11 -0.75 0.12 0.00 -0.01 0.00 0.00 64.34 63.82 1dt6 n VAL 433 Cb 0.49 -0.45 0.29 0.00 -0.91 0.00 0.00 33.84 33.26 1dt6 n VAL 433 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1dt6 n GLY 434 N 1.81 -1.30 0.08 2.92 0.00 -1.26 -4.49 105.19 102.95 1dt6 n GLY 434 Ca -0.27 -0.31 -0.02 0.00 0.00 0.00 0.00 46.02 45.42 1dt6 n GLY 434 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1dt6 n GLU 435 N -1.57 -0.08 0.00 1.61 2.13 -1.26 -0.02 120.64 121.44 1dt6 n GLU 435 Ca 0.05 0.31 0.00 0.00 0.66 0.00 0.00 57.16 58.18 1dt6 n GLU 435 Cb 0.35 -0.46 0.00 0.00 0.27 0.00 0.00 31.44 31.60 1dt6 n GLU 435 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1dt6 n GLY 436 N -1.06 -3.10 0.31 8.31 0.00 -1.26 -0.71 105.19 107.67 1dt6 n GLY 436 Ca 0.01 0.44 0.18 0.00 0.00 0.00 0.00 46.02 46.65 1dt6 n GLY 436 CO 0.00 0.00 0.00 0.17 0.00 0.00 0.00 173.32 173.49 1dt6 h LEU 437 N 0.00 0.00 -0.22 0.99 8.10 -0.75 -1.22 115.31 122.20 1dt6 h LEU 437 Ca 0.00 0.00 -0.06 0.00 0.11 0.00 0.00 57.88 57.93 1dt6 h LEU 437 Cb 0.00 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.21 1dt6 h LEU 437 CO 0.00 0.01 -0.09 0.00 -4.11 0.00 0.00 178.44 174.25 1dt6 h ALA 438 N 1.99 0.31 -0.07 0.17 0.00 -0.20 -1.66 119.26 119.79 1dt6 h ALA 438 Ca -0.00 -0.28 0.02 0.00 0.00 0.00 0.00 54.91 54.65 1dt6 h ALA 438 Cb 0.04 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 1dt6 h ALA 438 CO 0.00 0.13 0.05 0.00 0.00 0.00 0.00 179.25 179.43 1dt6 h ARG 439 N 0.16 0.00 0.14 0.00 3.08 0.32 -1.89 114.38 116.19 1dt6 h ARG 439 Ca 0.05 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.09 1dt6 h ARG 439 Cb 0.57 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.62 1dt6 h ARG 439 CO 0.03 0.00 -0.07 0.52 -1.07 0.00 0.00 179.97 179.38 1dt6 h MET 440 N 0.00 -0.18 -0.80 0.04 2.86 -1.22 -2.89 114.93 112.73 1dt6 h MET 440 Ca 0.03 0.01 0.25 0.00 -2.06 0.00 0.00 59.70 57.93 1dt6 h MET 440 Cb 0.13 0.04 -0.15 0.00 0.06 0.00 0.00 31.60 31.69 1dt6 h MET 440 CO -0.00 -0.12 0.12 0.39 1.06 0.00 0.00 176.91 178.36 1dt6 n GLU 441 N -3.31 -0.06 0.21 1.72 1.02 -0.65 0.55 120.64 120.12 1dt6 n GLU 441 Ca -0.02 1.18 -0.15 0.00 -0.02 0.00 0.00 57.16 58.15 1dt6 n GLU 441 Cb 0.07 -1.93 -0.08 0.00 -0.02 0.00 0.00 31.44 29.48 1dt6 n GLU 441 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1dt6 h LEU 442 N 0.00 -0.44 -0.25 -4.62 3.38 -1.43 0.12 115.31 112.07 1dt6 h LEU 442 Ca 0.53 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 58.40 1dt6 h LEU 442 Cb 1.20 0.11 -0.01 0.00 0.09 0.00 0.00 40.66 42.05 1dt6 h LEU 442 CO -0.72 -0.17 0.09 0.15 0.09 0.00 0.00 178.44 177.88 1dt6 h PHE 443 N -0.71 0.38 0.42 1.13 3.04 0.33 -1.91 116.94 119.63 1dt6 h PHE 443 Ca -0.05 -0.03 -0.02 0.00 3.98 0.00 0.00 57.97 61.84 1dt6 h PHE 443 Cb 0.50 -0.11 0.00 0.00 2.56 0.00 0.00 35.95 38.90 1dt6 h PHE 443 CO -0.01 0.41 -0.20 -0.07 -2.02 0.00 0.00 178.31 176.42 1dt6 h LEU 444 N 0.24 -0.47 0.15 0.59 3.38 -0.13 -2.02 115.31 117.05 1dt6 h LEU 444 Ca 0.08 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 1dt6 h LEU 444 Cb 0.20 0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 1dt6 h LEU 444 CO -0.01 -0.08 -0.26 -0.26 0.09 0.00 0.00 178.44 177.93 1dt6 h PHE 445 N -0.96 -0.73 -0.38 1.13 0.04 -0.83 -0.35 116.94 114.85 1dt6 h PHE 445 Ca -0.06 0.01 0.05 0.00 2.80 0.00 0.00 57.97 60.78 1dt6 h PHE 445 Cb 0.56 0.30 -0.08 0.00 2.20 0.00 0.00 35.95 38.92 1dt6 h PHE 445 CO 0.02 -0.32 -0.52 -0.07 -0.60 0.00 0.00 178.31 176.83 1dt6 h LEU 446 N -0.44 -1.72 -0.62 1.54 3.38 -1.48 -0.02 115.31 115.95 1dt6 h LEU 446 Ca -0.02 0.23 0.11 0.00 0.09 0.00 0.00 57.88 58.30 1dt6 h LEU 446 Cb 0.41 0.71 -0.08 0.00 0.09 0.00 0.00 40.66 41.79 1dt6 h LEU 446 CO -0.09 -0.40 0.17 0.74 0.09 0.00 0.00 178.44 178.95 1dt6 h THR 447 N -0.40 0.67 0.00 0.22 2.02 -1.31 -1.44 112.91 112.66 1dt6 h THR 447 Ca 0.09 -0.11 -0.10 0.00 0.77 0.00 0.00 66.41 67.06 1dt6 h THR 447 Cb 0.61 0.33 -0.01 0.00 -1.74 0.00 0.00 68.15 67.33 1dt6 h THR 447 CO -0.57 0.06 -0.50 0.77 0.37 0.00 0.00 175.52 175.65 1dt6 h SER 448 N 0.31 0.00 -0.34 4.18 4.64 0.04 -1.31 113.55 121.07 1dt6 h SER 448 Ca 0.33 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.48 1dt6 h SER 448 Cb 0.48 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.56 1dt6 h SER 448 CO -0.38 0.50 -0.45 0.16 -0.87 0.00 0.00 176.83 175.78 1dt6 h ILE 449 N 0.00 1.27 0.00 0.95 3.07 -0.09 -2.61 117.51 120.10 1dt6 h ILE 449 Ca -0.00 -1.63 0.00 0.00 1.55 0.00 0.00 64.86 64.78 1dt6 h ILE 449 Cb 0.91 1.50 0.00 0.00 -0.27 0.00 0.00 36.82 38.96 1dt6 h ILE 449 CO 0.06 0.54 0.00 -0.07 -1.05 0.00 0.00 178.15 177.63 1dt6 h LEU 450 N 0.71 0.00 0.01 0.16 3.38 -1.16 0.50 115.31 118.91 1dt6 h LEU 450 Ca 0.04 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.81 1dt6 h LEU 450 Cb 1.05 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.82 1dt6 h LEU 450 CO 0.11 0.00 -0.77 -0.61 0.09 0.00 0.00 178.44 177.26 1dt6 h GLN 451 N 0.00 0.51 0.00 1.13 4.15 -0.97 -3.34 115.11 116.59 1dt6 h GLN 451 Ca 0.00 -0.56 0.00 0.00 0.77 0.00 0.00 58.65 58.86 1dt6 h GLN 451 Cb 0.54 0.16 0.00 0.00 0.21 0.00 0.00 27.48 28.39 1dt6 h GLN 451 CO 0.00 1.19 -0.80 0.09 -1.93 0.00 0.00 178.83 177.38 1dt6 n ASN 452 N -4.09 0.63 -4.09 -0.69 3.02 -1.01 -4.91 115.26 104.12 1dt6 n ASN 452 Ca -0.11 -0.21 -0.11 0.00 -0.03 0.00 0.00 54.58 54.12 1dt6 n ASN 452 Cb 0.75 0.54 -0.11 0.00 -0.61 0.00 0.00 39.78 40.35 1dt6 n ASN 452 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1dt6 s PHE 453 N -3.12 0.68 -0.12 3.10 0.08 0.17 -2.66 117.98 116.11 1dt6 s PHE 453 Ca 0.06 -0.69 -0.03 0.00 0.12 0.00 0.00 56.93 56.39 1dt6 s PHE 453 Cb 0.15 -0.41 -0.03 0.00 -0.57 0.00 0.00 43.02 42.16 1dt6 s PHE 453 CO 0.76 -0.15 -0.01 0.15 -0.10 0.00 0.00 175.22 175.87 1dt6 s LYS 454 N -2.52 3.33 -0.30 0.44 1.02 0.55 -4.50 119.74 117.77 1dt6 s LYS 454 Ca -0.02 -0.46 -0.11 0.00 0.02 0.00 0.00 55.97 55.41 1dt6 s LYS 454 Cb -0.03 -2.87 -0.03 0.00 -0.52 0.00 0.00 37.83 34.38 1dt6 s LYS 454 CO -0.02 0.48 0.18 -0.51 -0.92 0.00 0.00 175.35 174.55 1dt6 s LEU 455 N -0.27 4.11 -0.12 3.17 1.43 -1.26 -1.64 118.68 124.10 1dt6 s LEU 455 Ca 0.05 -0.26 0.02 0.00 -1.03 0.00 0.00 54.13 52.91 1dt6 s LEU 455 Cb -0.12 -2.07 -0.01 0.00 0.03 0.00 0.00 46.19 44.02 1dt6 s LEU 455 CO 0.02 -0.13 -0.19 0.00 0.23 0.00 0.00 176.35 176.28 1dt6 s GLN 456 N 1.70 3.18 0.00 1.70 -2.07 -1.03 -4.94 119.66 118.20 1dt6 s GLN 456 Ca 0.06 -0.80 0.00 0.00 -1.82 0.00 0.00 55.36 52.80 1dt6 s GLN 456 Cb -0.16 -2.45 0.00 0.00 -1.09 0.00 0.00 33.01 29.31 1dt6 s GLN 456 CO 0.09 0.17 0.00 0.45 -1.32 0.00 0.00 175.29 174.68 1dt6 n SER 457 N 3.58 -0.02 0.00 12.60 2.88 -1.26 -1.75 113.62 129.66 1dt6 n SER 457 Ca -0.19 -0.57 0.00 0.00 -1.33 0.00 0.00 58.87 56.78 1dt6 n SER 457 Cb 0.53 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.99 1dt6 n SER 457 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1dt6 n LEU 458 N 0.00 0.79 -3.67 2.46 4.77 -1.26 -4.75 117.00 115.33 1dt6 n LEU 458 Ca 0.00 -0.79 -0.08 0.00 -0.03 0.00 0.00 56.01 55.11 1dt6 n LEU 458 Cb 0.00 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.00 1dt6 n LEU 458 CO 0.00 0.20 0.13 -0.69 -1.33 0.00 0.00 177.39 175.70 1dt6 s VAL 459 N -0.36 -0.24 0.13 4.08 1.01 -1.26 -5.14 120.40 118.62 1dt6 s VAL 459 Ca 0.00 0.08 -0.19 0.00 0.00 0.00 0.00 61.98 61.87 1dt6 s VAL 459 Cb 0.00 -0.74 -0.12 0.00 0.00 0.00 0.00 36.38 35.52 1dt6 s VAL 459 CO 0.00 0.03 0.36 -0.62 0.00 0.00 0.00 175.10 174.87 1dt6 n GLU 460 N 4.62 0.00 -0.10 2.72 -0.58 -1.26 -4.71 120.64 121.34 1dt6 n GLU 460 Ca -0.18 0.00 0.12 0.00 -0.42 0.00 0.00 57.16 56.67 1dt6 n GLU 460 Cb 0.54 -0.69 0.49 0.00 -0.57 0.00 0.00 31.44 31.21 1dt6 n GLU 460 CO 0.00 0.00 0.00 -1.35 -0.48 0.00 0.00 177.13 175.30 1dt6 h PRO 461 N 0.71 0.43 0.00 3.49 0.11 -1.89 0.19 132.00 135.04 1dt6 h PRO 461 Ca -0.19 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.89 1dt6 h PRO 461 Cb 0.98 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 31.99 1dt6 h PRO 461 CO 0.39 0.28 0.00 1.63 -0.21 0.00 0.00 178.00 180.09 1dt6 n LYS 462 N -4.47 0.52 -0.03 1.05 4.76 -1.26 -3.05 118.16 115.66 1dt6 n LYS 462 Ca 0.10 0.00 0.01 0.00 -2.87 0.00 0.00 58.31 55.55 1dt6 n LYS 462 Cb 0.37 -1.27 0.01 0.00 -1.84 0.00 0.00 35.03 32.30 1dt6 n LYS 462 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1dt6 n ASP 463 N -0.77 1.31 -4.29 4.39 10.43 0.66 -5.06 116.55 123.21 1dt6 n ASP 463 Ca 0.07 -1.80 -0.32 0.00 2.57 0.00 0.00 54.79 55.31 1dt6 n ASP 463 Cb 0.03 -0.05 -0.16 0.00 1.84 0.00 0.00 41.12 42.78 1dt6 n ASP 463 CO 0.00 0.00 0.00 -1.48 -1.07 0.00 0.00 177.20 174.65 1dt6 s LEU 464 N -0.82 2.15 0.04 0.64 0.05 -1.17 -4.94 118.68 114.62 1dt6 s LEU 464 Ca 0.03 -0.47 -0.30 0.00 0.05 0.00 0.00 54.13 53.43 1dt6 s LEU 464 Cb 0.03 -1.39 -0.06 0.00 -2.05 0.00 0.00 46.19 42.72 1dt6 s LEU 464 CO 0.00 0.26 1.27 -0.62 -0.55 0.00 0.00 176.35 176.71 1dt6 s ASP 465 N -0.24 6.99 -0.05 1.48 3.68 -1.26 -4.92 116.67 122.35 1dt6 s ASP 465 Ca -0.01 2.05 0.08 0.00 2.13 0.00 0.00 52.55 56.79 1dt6 s ASP 465 Cb -0.13 -2.57 0.12 0.00 -1.45 0.00 0.00 42.92 38.88 1dt6 s ASP 465 CO 0.03 -0.57 1.02 2.30 0.13 0.00 0.00 175.17 178.08 1dt6 n ILE 466 N 4.20 1.20 -2.47 4.11 -0.00 -1.26 -4.63 119.36 120.50 1dt6 n ILE 466 Ca 0.10 -1.35 -0.41 0.00 -0.00 0.00 0.00 62.75 61.09 1dt6 n ILE 466 Cb 0.45 0.25 -0.04 0.00 -0.00 0.00 0.00 39.64 40.30 1dt6 n ILE 466 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 176.55 175.66 1dt6 s THR 467 N -1.59 3.87 0.33 7.28 2.01 -1.26 -4.83 115.64 121.44 1dt6 s THR 467 Ca 0.13 1.54 -0.12 0.00 0.31 0.00 0.00 61.69 63.55 1dt6 s THR 467 Cb 0.11 -3.98 -0.08 0.00 0.01 0.00 0.00 72.50 68.56 1dt6 s THR 467 CO 0.01 0.23 0.71 0.00 -0.69 0.00 0.00 174.62 174.88 1dt6 s ALA 468 N 0.07 3.39 0.12 7.40 0.00 -1.26 -3.99 121.76 127.49 1dt6 s ALA 468 Ca 0.52 -0.13 0.07 0.00 0.00 0.00 0.00 51.96 52.42 1dt6 s ALA 468 Cb -0.30 -2.66 -0.04 0.00 0.00 0.00 0.00 23.12 20.12 1dt6 s ALA 468 CO 0.34 0.24 -0.10 0.14 0.00 0.00 0.00 175.76 176.37 1dt6 s VAL 469 N -2.10 3.31 -0.78 0.00 -7.23 -0.83 -4.95 120.40 107.82 1dt6 s VAL 469 Ca 0.51 -1.34 0.02 0.00 -1.81 0.00 0.00 61.98 59.36 1dt6 s VAL 469 Cb -0.10 -2.56 0.21 0.00 0.56 0.00 0.00 36.38 34.49 1dt6 s VAL 469 CO 0.24 0.08 0.70 0.52 -0.31 0.00 0.00 175.10 176.32 1dt6 n VAL 470 N 0.60 2.47 -0.58 1.32 0.31 -1.26 -0.51 118.33 120.68 1dt6 n VAL 470 Ca -0.13 -5.09 -0.13 0.00 -0.01 0.00 0.00 64.34 58.98 1dt6 n VAL 470 Cb 0.53 -2.23 -0.04 0.00 -0.91 0.00 0.00 33.84 31.19 1dt6 n VAL 470 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1dt6 n ASN 471 N 1.81 -0.04 0.00 4.52 5.03 -0.75 -4.52 115.26 121.31 1dt6 n ASN 471 Ca 0.23 -1.35 0.00 0.00 0.87 0.00 0.00 54.58 54.33 1dt6 n ASN 471 Cb 0.37 -0.23 0.00 0.00 -1.02 0.00 0.00 39.78 38.89 1dt6 n ASN 471 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1dt6 n GLY 472 N 3.84 1.61 0.00 7.41 0.00 -1.26 -4.09 105.19 112.69 1dt6 n GLY 472 Ca 0.14 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.78 1dt6 n GLY 472 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1dt6 n PHE 473 N 0.00 0.00 -1.52 1.61 3.01 -1.26 -4.25 117.46 115.04 1dt6 n PHE 473 Ca 0.00 0.00 -0.53 0.00 1.01 0.00 0.00 57.45 57.93 1dt6 n PHE 473 Cb 0.00 0.00 -0.06 0.00 -0.01 0.00 0.00 39.48 39.41 1dt6 n PHE 473 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 1dt6 n VAL 474 N -0.48 0.58 -3.19 -4.37 0.31 -1.24 -4.48 118.33 105.46 1dt6 n VAL 474 Ca 0.00 -0.15 -0.40 0.00 -0.01 0.00 0.00 64.34 63.78 1dt6 n VAL 474 Cb 0.00 -0.38 -0.07 0.00 -0.91 0.00 0.00 33.84 32.48 1dt6 n VAL 474 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1dt6 s SER 475 N -0.08 6.45 -0.14 4.52 0.01 -0.32 -1.80 113.70 122.33 1dt6 s SER 475 Ca 0.80 0.46 -0.06 0.00 1.31 0.00 0.00 55.95 58.47 1dt6 s SER 475 Cb -1.04 -2.30 -0.04 0.00 0.21 0.00 0.00 66.02 62.85 1dt6 s SER 475 CO 0.54 -0.36 0.06 0.68 0.41 0.00 0.00 173.24 174.56 1dt6 s VAL 476 N 2.42 4.79 0.96 3.43 -7.23 0.34 -4.83 120.40 120.27 1dt6 s VAL 476 Ca 0.22 -0.05 -0.12 0.00 -1.81 0.00 0.00 61.98 60.22 1dt6 s VAL 476 Cb -0.15 -3.10 0.17 0.00 0.56 0.00 0.00 36.38 33.85 1dt6 s VAL 476 CO 0.10 0.54 1.09 -2.16 -0.31 0.00 0.00 175.10 174.36 1dt6 s PRO 477 N -0.31 0.75 0.00 4.82 0.04 -1.26 -1.96 135.00 137.08 1dt6 s PRO 477 Ca 0.08 0.63 0.00 0.00 0.04 0.00 0.00 61.00 61.75 1dt6 s PRO 477 Cb -0.12 -1.77 0.00 0.00 0.04 0.00 0.00 34.50 32.65 1dt6 s PRO 477 CO 0.02 -2.54 0.00 -2.30 0.04 0.00 0.00 177.00 172.22 1dt6 n PRO 478 N -4.06 -0.93 -4.55 0.56 -0.02 -1.26 -4.83 135.00 119.91 1dt6 n PRO 478 Ca 0.06 0.00 -0.34 0.00 -2.02 0.00 0.00 63.50 61.20 1dt6 n PRO 478 Cb 0.56 0.00 -0.12 0.00 -0.02 0.00 0.00 33.50 33.93 1dt6 n PRO 478 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1dt6 s SER 479 N -1.87 4.64 0.06 2.55 0.15 -1.26 -5.10 113.70 112.86 1dt6 s SER 479 Ca 0.00 -0.10 -0.05 0.00 0.70 0.00 0.00 55.95 56.50 1dt6 s SER 479 Cb 0.00 -1.48 -0.02 0.00 -1.71 0.00 0.00 66.02 62.81 1dt6 s SER 479 CO 0.00 0.26 0.08 -0.72 1.20 0.00 0.00 173.24 174.06 1dt6 s TYR 480 N -0.19 0.32 0.14 3.44 -0.85 -1.26 -5.02 117.35 113.93 1dt6 s TYR 480 Ca 0.03 -0.78 0.09 0.00 -0.52 0.00 0.00 57.07 55.89 1dt6 s TYR 480 Cb -0.13 -0.21 -0.04 0.00 0.38 0.00 0.00 41.96 41.96 1dt6 s TYR 480 CO 0.03 -0.44 -0.21 -0.65 -1.52 0.00 0.00 175.55 172.76 1dt6 s GLN 481 N -3.65 1.26 0.21 -3.49 -0.21 -1.26 -4.60 119.66 107.92 1dt6 s GLN 481 Ca 0.04 -1.32 -0.22 0.00 0.02 0.00 0.00 55.36 53.88 1dt6 s GLN 481 Cb 0.05 -1.47 0.05 0.00 1.00 0.00 0.00 33.01 32.64 1dt6 s GLN 481 CO -0.09 0.32 0.66 -0.48 -2.12 0.00 0.00 175.29 173.58 1dt6 s LEU 482 N -2.31 -0.42 -0.10 2.90 2.34 0.14 -4.50 118.68 116.73 1dt6 s LEU 482 Ca 0.12 -0.29 0.01 0.00 0.06 0.00 0.00 54.13 54.03 1dt6 s LEU 482 Cb -0.08 2.65 -0.02 0.00 -0.56 0.00 0.00 46.19 48.18 1dt6 s LEU 482 CO 0.06 -1.14 -0.11 0.00 -1.06 0.00 0.00 176.35 174.10 1dt6 s PHE 484 N -0.21 3.94 -0.29 0.00 0.40 -1.26 -2.46 117.98 118.10 1dt6 s PHE 484 Ca 0.02 -2.25 -0.29 0.00 -0.60 0.00 0.00 56.93 53.81 1dt6 s PHE 484 Cb -0.13 -3.81 -0.00 0.00 0.51 0.00 0.00 43.02 39.58 1dt6 s PHE 484 CO 0.03 -0.97 1.35 0.42 0.70 0.00 0.00 175.22 176.75 1dt6 s ILE 485 N -0.33 4.07 0.47 0.64 1.01 -0.65 -4.35 121.20 122.05 1dt6 s ILE 485 Ca 0.22 1.21 -0.24 0.00 0.00 0.00 0.00 60.65 61.84 1dt6 s ILE 485 Cb -0.10 -4.08 -0.08 0.00 0.01 0.00 0.00 42.46 38.21 1dt6 s ILE 485 CO -0.09 -0.44 1.30 -2.65 0.00 0.00 0.00 174.94 173.06 1dt6 n PRO 486 N 7.36 1.87 -4.86 2.79 -0.02 -1.26 -0.33 135.00 140.54 1dt6 n PRO 486 Ca 0.15 0.67 -0.32 0.00 -2.02 0.00 0.00 63.50 61.98 1dt6 n PRO 486 Cb 0.46 -2.45 -0.13 0.00 -0.02 0.00 0.00 33.50 31.36 1dt6 n PRO 486 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1dt6 s ILE 487 N -1.24 2.96 -0.29 4.25 1.01 -1.09 -4.80 121.20 122.00 1dt6 s ILE 487 Ca 0.64 -0.84 -0.17 0.00 0.00 0.00 0.00 60.65 60.28 1dt6 s ILE 487 Cb -0.47 -2.17 0.18 0.00 0.01 0.00 0.00 42.46 40.01 1dt6 s ILE 487 CO 0.55 0.53 1.16 -2.28 0.00 0.00 0.00 174.94 174.91 1dt6 s HIS 488 N -0.77 -0.27 -2.28 3.97 2.46 -1.26 -4.94 115.29 112.19 1dt6 s HIS 488 Ca 0.12 0.55 0.30 0.00 0.47 0.00 0.00 55.06 56.50 1dt6 s HIS 488 Cb -0.11 0.20 1.42 0.00 -0.13 0.00 0.00 32.58 33.97 1dt6 s HIS 488 CO 0.02 -0.13 1.96 1.58 -2.47 0.00 0.00 174.74 175.69