#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hhs h ALA 4 N 0.00 0.86 -0.45 -1.67 0.00 -1.98 0.81 119.26 116.83 3hhs h ALA 4 Ca 0.00 0.13 0.09 0.00 0.00 0.00 0.00 54.91 55.13 3hhs h ALA 4 Cb 0.00 0.15 -0.10 0.00 0.00 0.00 0.00 17.79 17.84 3hhs h ALA 4 CO 0.00 -0.27 -0.25 -0.22 0.00 0.00 0.00 179.25 178.51 3hhs h LYS 5 N 0.33 -0.15 0.00 0.00 3.64 -1.93 -2.49 116.57 115.96 3hhs h LYS 5 Ca 0.36 0.01 -0.13 0.00 -1.27 0.00 0.00 60.65 59.62 3hhs h LYS 5 Cb 0.54 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.38 3hhs h LYS 5 CO -0.41 -0.10 -0.62 -0.91 -2.27 0.00 0.00 179.45 175.14 3hhs h ASN 6 N -0.15 0.00 -0.15 4.20 4.21 -1.48 -2.85 115.58 119.35 3hhs h ASN 6 Ca 0.21 0.00 0.04 0.00 1.21 0.00 0.00 56.30 57.76 3hhs h ASN 6 Cb 0.49 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.68 3hhs h ASN 6 CO -0.55 0.62 0.15 0.78 -1.29 0.00 0.00 177.43 177.14 3hhs h ASN 7 N 0.00 0.00 -0.21 5.81 2.35 0.10 -2.42 115.58 121.21 3hhs h ASN 7 Ca -0.01 0.00 0.06 0.00 -0.55 0.00 0.00 56.30 55.80 3hhs h ASN 7 Cb 1.13 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.50 3hhs h ASN 7 CO 0.08 0.00 0.16 -0.07 -1.65 0.00 0.00 177.43 175.95 3hhs h LEU 8 N 0.00 0.00 -2.28 1.61 3.38 -1.31 -1.97 115.31 114.75 3hhs h LEU 8 Ca 0.07 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 3hhs h LEU 8 Cb 0.37 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.12 3hhs h LEU 8 CO -0.00 0.00 -0.05 -0.07 0.09 0.00 0.00 178.44 178.41 3hhs h LEU 9 N 0.00 0.00 -2.27 1.67 3.38 -1.63 -1.54 115.31 114.92 3hhs h LEU 9 Ca 0.10 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 3hhs h LEU 9 Cb 0.41 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 3hhs h LEU 9 CO -0.00 0.05 -0.05 1.88 0.09 0.00 0.00 178.44 180.41 3hhs h TYR 10 N 0.00 0.00 0.00 1.13 0.05 -1.55 -2.13 116.97 114.47 3hhs h TYR 10 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 3hhs h TYR 10 Cb 0.16 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.90 3hhs h TYR 10 CO 0.00 0.05 0.00 1.19 -1.05 0.00 0.00 178.16 178.35 3hhs n PHE 11 N -3.69 0.00 0.31 4.88 3.72 -0.58 -1.99 117.46 120.10 3hhs n PHE 11 Ca -0.02 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.49 3hhs n PHE 11 Cb 0.15 -0.26 0.19 0.00 -0.94 0.00 0.00 39.48 38.62 3hhs n PHE 11 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 3hhs n PHE 12 N -1.26 0.45 -3.77 1.38 3.72 -0.80 -4.84 117.46 112.33 3hhs n PHE 12 Ca 0.08 -0.24 -0.36 0.00 -0.05 0.00 0.00 57.45 56.87 3hhs n PHE 12 Cb 0.12 -0.00 -0.10 0.00 -0.94 0.00 0.00 39.48 38.55 3hhs n PHE 12 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 3hhs s ASP 13 N -1.44 5.84 -0.90 4.37 2.15 -0.84 -4.65 116.67 121.20 3hhs s ASP 13 Ca 0.36 0.06 -0.07 0.00 0.43 0.00 0.00 52.55 53.32 3hhs s ASP 13 Cb 0.21 -2.04 -0.00 0.00 -0.30 0.00 0.00 42.92 40.79 3hhs s ASP 13 CO 0.29 0.08 0.70 0.54 -0.17 0.00 0.00 175.17 176.61 3hhs n ARG 14 N 4.17 -1.35 0.28 4.34 5.12 0.22 -4.83 116.66 124.61 3hhs n ARG 14 Ca -0.16 0.88 0.11 0.00 -1.93 0.00 0.00 57.85 56.75 3hhs n ARG 14 Cb 0.52 -3.94 0.75 0.00 -1.16 0.00 0.00 32.46 28.64 3hhs n ARG 14 CO 0.00 0.00 0.00 -1.35 -1.93 0.00 0.00 177.63 174.35 3hhs h PRO 15 N -0.61 0.00 -0.00 5.56 0.11 -1.83 -0.65 132.00 134.58 3hhs h PRO 15 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3hhs h PRO 15 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 3hhs h PRO 15 CO 0.39 0.00 -0.18 0.09 -0.21 0.00 0.00 178.00 178.09 3hhs n ASN 16 N -4.24 0.20 -4.73 -2.05 4.13 -1.26 -4.83 115.26 102.48 3hhs n ASN 16 Ca -0.03 0.17 -0.40 0.00 1.68 0.00 0.00 54.58 56.00 3hhs n ASN 16 Cb 0.09 -0.21 -0.05 0.00 -1.54 0.00 0.00 39.78 38.07 3hhs n ASN 16 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 3hhs s GLU 17 N -2.97 4.46 0.29 3.52 2.02 -0.25 -5.02 118.70 120.76 3hhs s GLU 17 Ca 0.14 0.99 -0.29 0.00 0.02 0.00 0.00 54.97 55.82 3hhs s GLU 17 Cb 0.19 -3.41 -0.13 0.00 0.10 0.00 0.00 34.13 30.87 3hhs s GLU 17 CO 0.59 0.14 1.35 -2.30 0.02 0.00 0.00 175.26 175.06 3hhs n PRO 18 N 3.40 2.10 0.00 0.39 -0.02 -1.26 -4.86 135.00 134.75 3hhs n PRO 18 Ca -0.01 0.74 0.04 0.00 -2.02 0.00 0.00 63.50 62.25 3hhs n PRO 18 Cb 0.51 -2.36 0.23 0.00 -0.02 0.00 0.00 33.50 31.85 3hhs n PRO 18 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hhs n PHE 20 N -0.71 0.00 -2.07 0.00 -1.74 -1.26 -4.39 117.46 107.28 3hhs n PHE 20 Ca 0.06 0.00 -0.27 0.00 -0.56 0.00 0.00 57.45 56.67 3hhs n PHE 20 Cb 0.03 -0.23 0.07 0.00 1.52 0.00 0.00 39.48 40.87 3hhs n PHE 20 CO 0.00 0.00 0.00 -1.64 -0.56 0.00 0.00 176.76 174.56 3hhs s MET 21 N -2.57 2.20 0.32 3.97 -1.94 -0.20 -4.78 119.30 116.31 3hhs s MET 21 Ca 0.26 -0.04 -0.29 0.00 -1.71 0.00 0.00 55.69 53.92 3hhs s MET 21 Cb 0.20 -2.08 -0.10 0.00 2.01 0.00 0.00 34.83 34.86 3hhs s MET 21 CO 0.49 -1.33 1.27 -0.65 -0.01 0.00 0.00 175.02 174.80 3hhs s GLN 22 N -5.37 4.40 0.02 2.03 -0.21 -1.26 -4.70 119.66 114.57 3hhs s GLN 22 Ca 0.60 2.15 0.08 0.00 0.02 0.00 0.00 55.36 58.21 3hhs s GLN 22 Cb -0.11 -3.09 -0.03 0.00 1.00 0.00 0.00 33.01 30.78 3hhs s GLN 22 CO 0.47 -0.12 -0.23 0.15 -2.12 0.00 0.00 175.29 173.44 3hhs s LYS 23 N -1.71 2.03 0.05 2.91 -0.14 0.99 -4.89 119.74 118.98 3hhs s LYS 23 Ca 0.48 -0.98 0.00 0.00 -1.36 0.00 0.00 55.97 54.11 3hhs s LYS 23 Cb -0.38 -2.09 0.00 0.00 -1.68 0.00 0.00 37.83 33.67 3hhs s LYS 23 CO 0.51 0.54 0.00 0.41 -0.76 0.00 0.00 175.35 176.05 3hhs n GLY 24 N 1.95 -1.41 0.00 -3.33 0.00 -1.26 -2.04 105.19 99.10 3hhs n GLY 24 Ca -0.17 -1.48 0.15 0.00 0.00 0.00 0.00 46.02 44.53 3hhs n GLY 24 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3hhs n GLU 25 N -1.59 0.80 -0.04 1.61 -0.58 -1.26 -3.67 120.64 115.91 3hhs n GLU 25 Ca 0.00 0.00 0.06 0.00 -0.42 0.00 0.00 57.16 56.80 3hhs n GLU 25 Cb 0.10 -1.50 0.07 0.00 -0.57 0.00 0.00 31.44 29.55 3hhs n GLU 25 CO 0.00 0.00 0.00 -0.40 -0.48 0.00 0.00 177.13 176.25 3hhs n ASP 26 N -1.08 2.17 -3.37 1.62 5.68 -1.26 -5.00 116.55 115.30 3hhs n ASP 26 Ca 0.20 -1.59 -0.17 0.00 -0.50 0.00 0.00 54.79 52.73 3hhs n ASP 26 Cb 0.14 -0.05 0.07 0.00 -1.14 0.00 0.00 41.12 40.14 3hhs n ASP 26 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 3hhs n LYS 27 N 0.61 -4.02 -3.86 0.11 5.02 -1.24 -4.32 118.16 110.46 3hhs n LYS 27 Ca 0.08 0.82 -0.31 0.00 -2.02 0.00 0.00 58.31 56.88 3hhs n LYS 27 Cb 0.32 -5.71 -0.04 0.00 -0.02 0.00 0.00 35.03 29.57 3hhs n LYS 27 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3hhs s VAL 28 N -3.40 5.34 0.10 -0.18 1.01 -0.87 -0.79 120.40 121.61 3hhs s VAL 28 Ca 0.26 -0.29 0.08 0.00 0.00 0.00 0.00 61.98 62.03 3hhs s VAL 28 Cb -0.04 -3.63 -0.03 0.00 0.00 0.00 0.00 36.38 32.68 3hhs s VAL 28 CO 0.75 0.12 -0.21 0.68 0.00 0.00 0.00 175.10 176.43 3hhs s VAL 29 N -1.55 1.73 0.19 2.92 -7.23 -0.60 -0.01 120.40 115.85 3hhs s VAL 29 Ca 0.36 -1.51 -0.15 0.00 -1.81 0.00 0.00 61.98 58.87 3hhs s VAL 29 Cb -0.13 -1.56 -0.07 0.00 0.56 0.00 0.00 36.38 35.18 3hhs s VAL 29 CO 0.27 -0.03 0.60 -0.36 -0.31 0.00 0.00 175.10 175.28 3hhs s PHE 30 N -1.12 3.57 -1.30 2.82 0.08 -1.26 0.02 117.98 120.79 3hhs s PHE 30 Ca 0.07 1.12 -0.13 0.00 0.12 0.00 0.00 56.93 58.11 3hhs s PHE 30 Cb -0.10 -2.42 0.13 0.00 -0.57 0.00 0.00 43.02 40.06 3hhs s PHE 30 CO 0.04 0.36 1.82 0.39 -0.10 0.00 0.00 175.22 177.73 3hhs n GLU 31 N 0.55 3.34 -1.92 0.44 1.02 0.48 -4.81 120.64 119.73 3hhs n GLU 31 Ca -0.03 -3.38 -0.42 0.00 -0.02 0.00 0.00 57.16 53.31 3hhs n GLU 31 Cb 0.52 -3.12 -0.03 0.00 -0.02 0.00 0.00 31.44 28.79 3hhs n GLU 31 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3hhs s ILE 32 N 1.84 3.33 0.64 -3.67 -1.09 -1.26 -4.17 121.20 116.81 3hhs s ILE 32 Ca 0.44 0.52 -0.16 0.00 -2.23 0.00 0.00 60.65 59.22 3hhs s ILE 32 Cb 0.07 -3.33 -0.01 0.00 -1.58 0.00 0.00 42.46 37.60 3hhs s ILE 32 CO -0.00 -0.03 1.13 -2.84 -1.23 0.00 0.00 174.94 171.96 3hhs s PRO 33 N 3.73 2.86 0.27 2.79 0.02 -1.26 -4.93 135.00 138.49 3hhs s PRO 33 Ca 0.76 1.52 -0.01 0.00 0.02 0.00 0.00 61.00 63.29 3hhs s PRO 33 Cb -0.37 -1.95 0.48 0.00 0.02 0.00 0.00 34.50 32.68 3hhs s PRO 33 CO 0.33 -1.22 1.84 0.38 -0.33 0.00 0.00 177.00 177.99 3hhs h ASP 34 N 0.33 0.88 0.45 2.53 -0.00 -1.97 -1.49 116.42 117.15 3hhs h ASP 34 Ca -0.48 0.04 0.00 0.00 -0.00 0.00 0.00 57.03 56.59 3hhs h ASP 34 Cb 1.26 -0.14 0.00 0.00 -0.00 0.00 0.00 39.33 40.45 3hhs h ASP 34 CO 0.54 0.50 0.00 0.00 -0.00 0.00 0.00 179.24 180.28 3hhs n HIS 35 N -4.63 0.00 0.18 4.15 1.44 -1.26 -2.07 115.22 113.02 3hhs n HIS 35 Ca 0.17 0.00 0.10 0.00 -2.01 0.00 0.00 57.72 55.98 3hhs n HIS 35 Cb 0.30 -0.33 0.10 0.00 0.12 0.00 0.00 29.99 30.19 3hhs n HIS 35 CO 0.00 0.00 0.00 1.88 -2.81 0.00 0.00 176.34 175.41 3hhs h TYR 36 N 0.00 0.00 -3.96 -1.40 0.99 -1.63 -3.47 116.97 107.50 3hhs h TYR 36 Ca 0.00 0.00 -0.54 0.00 2.00 0.00 0.00 58.73 60.19 3hhs h TYR 36 Cb 0.22 0.00 0.11 0.00 1.00 0.00 0.00 36.73 38.07 3hhs h TYR 36 CO 0.00 0.08 0.75 0.71 -0.00 0.00 0.00 178.16 179.70 3hhs s TYR 37 N -3.21 2.53 0.77 4.88 2.02 -0.88 -4.91 117.35 118.55 3hhs s TYR 37 Ca 0.04 1.20 -0.15 0.00 -0.37 0.00 0.00 57.07 57.80 3hhs s TYR 37 Cb 0.07 -3.98 0.05 0.00 -0.40 0.00 0.00 41.96 37.69 3hhs s TYR 37 CO 0.71 -2.98 1.17 -2.30 -1.57 0.00 0.00 175.55 170.59 3hhs n PRO 38 N 0.20 0.40 -0.28 -1.71 -0.02 -1.26 -4.64 135.00 127.69 3hhs n PRO 38 Ca 0.03 0.21 0.10 0.00 -2.02 0.00 0.00 63.50 61.81 3hhs n PRO 38 Cb 0.40 -2.41 0.25 0.00 -0.02 0.00 0.00 33.50 31.72 3hhs n PRO 38 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 3hhs h ASP 39 N -0.54 0.20 0.55 2.55 3.32 -1.95 -0.08 116.42 120.47 3hhs h ASP 39 Ca -0.47 0.15 0.00 0.00 0.02 0.00 0.00 57.03 56.73 3hhs h ASP 39 Cb 1.31 0.16 0.00 0.00 0.22 0.00 0.00 39.33 41.02 3hhs h ASP 39 CO 0.47 -0.00 0.00 0.07 -1.72 0.00 0.00 179.24 178.06 3hhs h LYS 40 N 0.36 0.00 -0.01 3.56 2.10 -2.02 -2.92 116.57 117.65 3hhs h LYS 40 Ca 0.49 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.14 3hhs h LYS 40 Cb 0.89 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.22 3hhs h LYS 40 CO -0.51 0.00 -0.25 0.66 -2.00 0.00 0.00 179.45 177.34 3hhs n TYR 41 N -2.91 0.00 -0.30 0.07 4.01 -0.12 -4.71 117.16 113.20 3hhs n TYR 41 Ca -0.01 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.74 3hhs n TYR 41 Cb 0.19 0.00 0.14 0.00 -0.31 0.00 0.00 39.34 39.36 3hhs n TYR 41 CO 0.00 0.00 0.00 0.87 -0.46 0.00 0.00 176.86 177.27 3hhs h LYS 42 N 0.88 0.89 0.00 -0.72 1.57 -1.14 -1.10 116.57 116.95 3hhs h LYS 42 Ca 0.00 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 3hhs h LYS 42 Cb 0.31 -0.20 -0.00 0.00 0.08 0.00 0.00 32.23 32.42 3hhs h LYS 42 CO 0.00 0.59 -0.04 0.66 -0.57 0.00 0.00 179.45 180.08 3hhs h SER 43 N 0.91 0.00 -0.39 0.86 4.64 -1.84 -2.45 113.55 115.28 3hhs h SER 43 Ca 0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.69 3hhs h SER 43 Cb 0.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 3hhs h SER 43 CO -0.19 0.04 0.00 0.18 -0.87 0.00 0.00 176.83 176.00 3hhs n LEU 44 N -3.19 3.99 -0.18 5.97 4.77 -0.47 -4.75 117.00 123.13 3hhs n LEU 44 Ca -0.00 -2.63 -0.04 0.00 -0.03 0.00 0.00 56.01 53.30 3hhs n LEU 44 Cb 0.27 -0.48 0.14 0.00 -2.33 0.00 0.00 43.42 41.01 3hhs n LEU 44 CO 0.27 0.71 0.97 0.77 -1.33 0.00 0.00 177.39 178.78 3hhs h SER 45 N 2.54 0.89 0.19 -1.43 4.64 -0.90 -0.09 113.55 119.39 3hhs h SER 45 Ca 0.00 -0.17 -0.00 0.00 -0.47 0.00 0.00 61.79 61.15 3hhs h SER 45 Cb 1.31 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 63.16 3hhs h SER 45 CO 0.19 0.87 -0.14 0.78 -0.87 0.00 0.00 176.83 177.65 3hhs h ASN 46 N 0.91 -0.37 -0.56 4.97 2.35 -1.85 -1.26 115.58 119.77 3hhs h ASN 46 Ca 0.20 0.03 0.06 0.00 -0.55 0.00 0.00 56.30 56.03 3hhs h ASN 46 Cb 0.32 0.12 -0.05 0.00 0.05 0.00 0.00 38.32 38.76 3hhs h ASN 46 CO -0.00 -0.22 0.27 0.74 -1.65 0.00 0.00 177.43 176.56 3hhs h THR 47 N -0.34 0.91 -0.20 2.81 2.02 -1.79 -2.32 112.91 113.99 3hhs h THR 47 Ca -0.01 -0.17 -0.17 0.00 0.77 0.00 0.00 66.41 66.83 3hhs h THR 47 Cb 0.30 0.36 0.00 0.00 -1.74 0.00 0.00 68.15 67.08 3hhs h THR 47 CO -0.01 0.09 -0.54 -0.07 0.37 0.00 0.00 175.52 175.36 3hhs h LEU 48 N 0.51 0.83 -0.57 2.58 3.38 -0.88 -1.59 115.31 119.57 3hhs h LEU 48 Ca 0.26 -0.57 0.09 0.00 0.09 0.00 0.00 57.88 57.74 3hhs h LEU 48 Cb 0.20 -0.24 -0.07 0.00 0.09 0.00 0.00 40.66 40.64 3hhs h LEU 48 CO -0.20 1.25 0.20 -1.28 0.09 0.00 0.00 178.44 178.51 3hhs h SER 49 N 0.44 0.19 -0.47 -0.43 0.87 -1.09 -0.95 113.55 112.11 3hhs h SER 49 Ca -0.01 0.08 -0.10 0.00 -1.23 0.00 0.00 61.79 60.53 3hhs h SER 49 Cb 1.16 0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 63.16 3hhs h SER 49 CO 0.12 0.12 -0.08 0.78 -0.53 0.00 0.00 176.83 177.24 3hhs h ASN 50 N 0.38 0.89 -0.07 6.23 -0.26 -1.24 -0.95 115.58 120.57 3hhs h ASN 50 Ca 0.29 -0.35 0.01 0.00 -0.56 0.00 0.00 56.30 55.69 3hhs h ASN 50 Cb 0.35 -0.24 -0.01 0.00 -1.06 0.00 0.00 38.32 37.35 3hhs h ASN 50 CO -0.30 1.03 0.00 -0.09 -1.06 0.00 0.00 177.43 177.02 3hhs h ARG 51 N 0.74 0.03 0.00 0.81 2.43 -0.59 -1.81 114.38 115.99 3hhs h ARG 51 Ca 0.12 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.29 3hhs h ARG 51 Cb 0.62 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.16 3hhs h ARG 51 CO 0.04 0.02 -0.59 0.74 -1.51 0.00 0.00 179.97 178.67 3hhs h PHE 52 N 0.03 0.00 0.00 2.20 0.04 -1.17 -3.20 116.94 114.83 3hhs h PHE 52 Ca 0.03 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.76 3hhs h PHE 52 Cb 0.03 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.17 3hhs h PHE 52 CO -0.11 0.00 -0.17 0.78 -0.60 0.00 0.00 178.31 178.21 3hhs h GLY 53 N 4.17 0.00 -5.27 -1.45 0.00 -1.10 -3.40 103.07 96.02 3hhs h GLY 53 Ca 0.00 0.00 -0.54 0.00 0.00 0.00 0.00 47.33 46.79 3hhs h GLY 53 CO 0.00 0.00 1.11 0.21 0.00 0.00 0.00 176.54 177.86 3hhs s ASN 54 N -6.21 6.63 0.00 0.19 3.04 -0.69 -2.46 114.94 115.45 3hhs s ASN 54 Ca 0.04 2.32 0.00 0.00 0.04 0.00 0.00 52.86 55.26 3hhs s ASN 54 Cb 0.07 -2.53 0.00 0.00 -1.54 0.00 0.00 41.25 37.25 3hhs s ASN 54 CO 0.67 -0.95 0.00 -0.62 -3.04 0.00 0.00 177.10 173.16 3hhs n GLU 55 N 7.16 -0.04 -2.02 0.43 1.02 -1.26 -5.00 120.64 120.93 3hhs n GLU 55 Ca 0.18 0.01 -0.41 0.00 -0.02 0.00 0.00 57.16 56.92 3hhs n GLU 55 Cb 0.42 -2.78 -0.02 0.00 -0.02 0.00 0.00 31.44 29.05 3hhs n GLU 55 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3hhs s ALA 56 N -3.21 3.53 -0.20 0.62 0.00 -1.03 -4.92 121.76 116.54 3hhs s ALA 56 Ca 0.00 1.35 0.17 0.00 0.00 0.00 0.00 51.96 53.48 3hhs s ALA 56 Cb 0.00 -3.52 0.08 0.00 0.00 0.00 0.00 23.12 19.68 3hhs s ALA 56 CO 0.00 -0.76 1.39 1.79 0.00 0.00 0.00 175.76 178.18 3hhs h THR 57 N 3.05 0.66 -2.49 0.00 1.35 -1.15 -3.46 112.91 110.87 3hhs h THR 57 Ca -0.49 -1.96 -0.09 0.00 -0.55 0.00 0.00 66.41 63.32 3hhs h THR 57 Cb 1.23 2.28 -0.23 0.00 -1.73 0.00 0.00 68.15 69.70 3hhs h THR 57 CO 0.66 0.38 -0.12 -0.75 -0.25 0.00 0.00 175.52 175.44 3hhs s LYS 58 N -3.01 0.59 -0.18 4.72 2.20 -1.26 -5.06 119.74 117.74 3hhs s LYS 58 Ca 0.04 0.73 -0.04 0.00 -0.36 0.00 0.00 55.97 56.34 3hhs s LYS 58 Cb 0.07 0.27 -0.02 0.00 -1.51 0.00 0.00 37.83 36.65 3hhs s LYS 58 CO 0.74 -0.08 -0.03 1.03 -0.36 0.00 0.00 175.35 176.66 3hhs s ARG 59 N 0.36 3.58 -0.34 4.03 0.52 -1.26 -1.56 118.95 124.28 3hhs s ARG 59 Ca -0.01 -0.55 -0.14 0.00 -0.52 0.00 0.00 55.73 54.51 3hhs s ARG 59 Cb -0.04 -2.99 -0.01 0.00 0.52 0.00 0.00 34.95 32.43 3hhs s ARG 59 CO -0.00 0.06 0.30 0.42 0.02 0.00 0.00 175.30 176.10 3hhs s ILE 60 N 0.84 5.23 0.59 1.52 1.01 0.10 -4.92 121.20 125.57 3hhs s ILE 60 Ca -0.00 -0.10 -0.19 0.00 0.00 0.00 0.00 60.65 60.35 3hhs s ILE 60 Cb -0.14 -3.78 -0.04 0.00 0.01 0.00 0.00 42.46 38.51 3hhs s ILE 60 CO 0.02 -0.06 1.22 -2.84 0.00 0.00 0.00 174.94 173.27 3hhs s PRO 61 N 1.87 2.97 -0.19 2.79 0.02 -1.26 -0.39 135.00 140.80 3hhs s PRO 61 Ca 0.09 1.85 -0.01 0.00 0.02 0.00 0.00 61.00 62.95 3hhs s PRO 61 Cb -0.17 -1.94 -0.00 0.00 0.02 0.00 0.00 34.50 32.41 3hhs s PRO 61 CO 0.11 -1.22 -0.11 0.42 -0.33 0.00 0.00 177.00 175.87 3hhs s ILE 62 N -1.57 2.86 0.24 2.83 -1.09 -1.26 -4.79 121.20 118.41 3hhs s ILE 62 Ca 0.77 -0.68 -0.30 0.00 -2.23 0.00 0.00 60.65 58.22 3hhs s ILE 62 Cb -0.31 -2.25 -0.09 0.00 -1.58 0.00 0.00 42.46 38.23 3hhs s ILE 62 CO 0.34 0.48 1.16 -0.60 -1.23 0.00 0.00 174.94 175.09 3hhs s ARG 63 N 1.19 4.54 0.07 2.79 3.52 -1.26 -4.98 118.95 124.82 3hhs s ARG 63 Ca 0.02 1.87 -0.31 0.00 -0.13 0.00 0.00 55.73 57.18 3hhs s ARG 63 Cb -0.14 -3.21 -0.08 0.00 -1.56 0.00 0.00 34.95 29.96 3hhs s ARG 63 CO -0.04 0.03 1.59 1.21 -0.81 0.00 0.00 175.30 177.28 3hhs s ASN 64 N -0.34 6.65 0.25 -2.12 3.84 -1.26 -4.81 114.94 117.16 3hhs s ASN 64 Ca 0.49 2.43 0.04 0.00 0.21 0.00 0.00 52.86 56.03 3hhs s ASN 64 Cb -0.33 -2.57 -0.05 0.00 -0.55 0.00 0.00 41.25 37.75 3hhs s ASN 64 CO 0.40 -0.84 0.00 0.27 -2.79 0.00 0.00 177.10 174.13 3hhs s ILE 65 N 2.42 1.15 -0.12 -5.21 -4.36 -1.26 -5.09 121.20 108.72 3hhs s ILE 65 Ca 0.71 -2.04 -0.29 0.00 -0.26 0.00 0.00 60.65 58.77 3hhs s ILE 65 Cb -0.39 -2.44 -0.02 0.00 1.25 0.00 0.00 42.46 40.86 3hhs s ILE 65 CO 0.31 -0.26 1.19 -0.89 0.24 0.00 0.00 174.94 175.53 3hhs s THR 66 N -3.34 4.36 0.35 8.37 2.01 -1.26 -5.01 115.64 121.11 3hhs s THR 66 Ca 0.30 1.66 -0.27 0.00 0.31 0.00 0.00 61.69 63.70 3hhs s THR 66 Cb 0.06 -4.07 -0.09 0.00 0.01 0.00 0.00 72.50 68.41 3hhs s THR 66 CO 0.10 -0.08 1.12 -0.76 -0.69 0.00 0.00 174.62 174.32 3hhs s LEU 67 N 2.82 4.34 0.58 4.42 1.43 -1.26 -5.02 118.68 125.99 3hhs s LEU 67 Ca 0.53 2.27 -0.09 0.00 -1.03 0.00 0.00 54.13 55.81 3hhs s LEU 67 Cb -0.22 -3.88 -0.04 0.00 0.03 0.00 0.00 46.19 42.08 3hhs s LEU 67 CO 0.17 -0.42 0.96 -2.16 0.23 0.00 0.00 176.35 175.13 3hhs s PRO 68 N -1.98 3.58 -0.28 1.29 0.04 -1.26 -5.00 135.00 131.40 3hhs s PRO 68 Ca 0.52 0.58 -0.29 0.00 0.04 0.00 0.00 61.00 61.85 3hhs s PRO 68 Cb -0.30 -2.17 -0.00 0.00 0.04 0.00 0.00 34.50 32.07 3hhs s PRO 68 CO 0.38 -0.46 1.37 1.21 0.04 0.00 0.00 177.00 179.54 3hhs s ASN 69 N -4.15 6.62 -0.13 6.66 2.47 -1.26 -4.90 114.94 120.25 3hhs s ASN 69 Ca 0.53 1.30 0.16 0.00 0.42 0.00 0.00 52.86 55.27 3hhs s ASN 69 Cb -0.11 -2.54 0.65 0.00 -1.45 0.00 0.00 41.25 37.80 3hhs s ASN 69 CO 0.51 -1.11 1.56 0.18 -3.72 0.00 0.00 177.10 174.52 3hhs n LEU 70 N 7.77 4.51 -0.23 3.21 4.77 -1.26 -4.70 117.00 131.07 3hhs n LEU 70 Ca 0.16 -2.57 -0.03 0.00 -0.03 0.00 0.00 56.01 53.54 3hhs n LEU 70 Cb 0.46 -0.54 0.08 0.00 -2.33 0.00 0.00 43.42 41.09 3hhs n LEU 70 CO 0.63 0.75 1.10 -0.33 -1.33 0.00 0.00 177.39 178.22 3hhs h GLU 71 N 3.38 0.71 0.64 3.23 5.08 -1.97 -0.12 114.58 125.53 3hhs h GLU 71 Ca 0.00 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.29 3hhs h GLU 71 Cb 1.43 -0.16 0.01 0.00 0.50 0.00 0.00 28.75 30.53 3hhs h GLU 71 CO 0.24 0.47 -0.31 0.28 -1.00 0.00 0.00 179.01 178.69 3hhs h VAL 72 N 0.73 0.00 0.00 3.13 2.07 -1.98 -3.22 116.25 116.98 3hhs h VAL 72 Ca 0.27 -0.09 -0.01 0.00 0.82 0.00 0.00 66.70 67.69 3hhs h VAL 72 Cb 0.10 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 29.87 3hhs h VAL 72 CO -0.14 0.00 -0.05 1.55 0.02 0.00 0.00 177.57 178.95 3hhs h PRO 73 N -0.96 0.00 0.00 1.57 0.13 -1.76 -1.90 132.00 129.09 3hhs h PRO 73 Ca -0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.04 3hhs h PRO 73 Cb 0.66 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.79 3hhs h PRO 73 CO 0.14 0.05 0.00 -1.33 -0.23 0.00 0.00 178.00 176.64 3hhs n MET 74 N -3.54 0.33 0.26 0.86 2.81 -0.07 -3.15 117.12 114.62 3hhs n MET 74 Ca -0.02 0.09 0.15 0.00 -1.81 0.00 0.00 57.70 56.11 3hhs n MET 74 Cb 0.16 -1.50 0.62 0.00 -0.71 0.00 0.00 33.22 31.79 3hhs n MET 74 CO 0.00 0.00 0.00 1.96 1.51 0.00 0.00 175.97 179.44 3hhs h GLN 75 N 0.00 0.00 -6.12 0.03 4.20 -1.35 -3.42 115.11 108.45 3hhs h GLN 75 Ca 0.00 0.00 -0.57 0.00 0.06 0.00 0.00 58.65 58.14 3hhs h GLN 75 Cb 0.13 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 27.85 3hhs h GLN 75 CO 0.00 0.06 0.75 -1.17 -0.67 0.00 0.00 178.83 177.80 3hhs s LEU 76 N -6.37 4.14 0.29 1.46 2.96 -1.19 -5.00 118.68 114.97 3hhs s LEU 76 Ca 0.01 1.43 -0.29 0.00 -0.22 0.00 0.00 54.13 55.06 3hhs s LEU 76 Cb 0.09 -3.54 -0.14 0.00 0.50 0.00 0.00 46.19 43.10 3hhs s LEU 76 CO 0.57 -0.63 1.13 -2.65 -1.32 0.00 0.00 176.35 173.46 3hhs n PRO 77 N 6.04 1.61 -0.26 0.98 -0.02 -1.26 -4.46 135.00 137.62 3hhs n PRO 77 Ca 0.11 0.57 0.26 0.00 -2.02 0.00 0.00 63.50 62.42 3hhs n PRO 77 Cb 0.47 -2.03 0.62 0.00 -0.02 0.00 0.00 33.50 32.53 3hhs n PRO 77 CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 3hhs h TYR 78 N 2.43 0.32 -0.81 6.00 3.20 -1.91 -2.50 116.97 123.70 3hhs h TYR 78 Ca -0.42 0.01 -0.54 0.00 3.14 0.00 0.00 58.73 60.92 3hhs h TYR 78 Cb 1.32 -0.10 -0.31 0.00 1.54 0.00 0.00 36.73 39.18 3hhs h TYR 78 CO 0.50 0.05 0.12 0.27 -1.64 0.00 0.00 178.16 177.45 3hhs n ASN 79 N -4.42 5.63 -4.82 -2.11 6.94 -1.26 -4.27 115.26 110.96 3hhs n ASN 79 Ca 0.22 -3.77 -0.22 0.00 -0.02 0.00 0.00 54.58 50.80 3hhs n ASN 79 Cb 0.93 -0.69 -0.04 0.00 -2.36 0.00 0.00 39.78 37.61 3hhs n ASN 79 CO 0.00 0.00 0.00 -1.81 -1.03 0.00 0.00 177.26 174.42 3hhs s ASP 80 N -2.53 5.14 0.50 0.53 1.11 -0.94 -4.39 116.67 116.09 3hhs s ASP 80 Ca 0.56 -0.55 -0.19 0.00 0.18 0.00 0.00 52.55 52.56 3hhs s ASP 80 Cb 0.46 -0.95 -0.08 0.00 1.07 0.00 0.00 42.92 43.42 3hhs s ASP 80 CO 0.02 -0.30 1.01 -1.10 1.18 0.00 0.00 175.17 175.97 3hhs s GLN 81 N -3.94 3.81 -0.10 8.23 -1.52 -1.26 -4.65 119.66 120.24 3hhs s GLN 81 Ca 0.39 1.19 0.03 0.00 -1.95 0.00 0.00 55.36 55.01 3hhs s GLN 81 Cb -0.05 -2.11 -0.01 0.00 -0.22 0.00 0.00 33.01 30.62 3hhs s GLN 81 CO 0.25 -0.40 -0.19 0.12 -0.25 0.00 0.00 175.29 174.82 3hhs s PHE 82 N -2.27 2.66 -0.10 0.91 5.36 -1.26 -5.05 117.98 118.23 3hhs s PHE 82 Ca 0.63 -0.78 -0.07 0.00 -0.96 0.00 0.00 56.93 55.75 3hhs s PHE 82 Cb -0.13 -1.74 0.03 0.00 -0.34 0.00 0.00 43.02 40.84 3hhs s PHE 82 CO 0.25 -0.27 0.25 0.45 -1.46 0.00 0.00 175.22 174.44 3hhs s SER 83 N 0.21 -0.27 0.63 6.13 0.15 -1.26 -4.93 113.70 114.35 3hhs s SER 83 Ca -0.12 0.53 0.35 0.00 0.70 0.00 0.00 55.95 57.41 3hhs s SER 83 Cb -0.16 0.48 1.98 0.00 -1.71 0.00 0.00 66.02 66.61 3hhs s SER 83 CO 0.06 -0.12 2.23 0.25 1.20 0.00 0.00 173.24 176.86 3hhs h LEU 84 N 6.38 0.00 -1.80 3.45 5.85 -1.90 -2.01 115.31 125.29 3hhs h LEU 84 Ca -0.32 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.40 3hhs h LEU 84 Cb 1.18 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.20 3hhs h LEU 84 CO 0.36 0.00 0.11 -0.26 -0.34 0.00 0.00 178.44 178.31 3hhs h PHE 85 N 0.00 0.24 -3.17 1.25 0.04 -1.94 -3.42 116.94 109.94 3hhs h PHE 85 Ca 0.02 0.00 -0.57 0.00 2.80 0.00 0.00 57.97 60.23 3hhs h PHE 85 Cb 0.18 -0.08 -0.04 0.00 2.20 0.00 0.00 35.95 38.21 3hhs h PHE 85 CO 0.00 0.16 0.67 0.08 -0.60 0.00 0.00 178.31 178.62 3hhs s VAL 86 N -5.24 4.69 0.20 -0.55 1.01 -0.76 -4.91 120.40 114.84 3hhs s VAL 86 Ca -0.06 1.99 -0.13 0.00 0.00 0.00 0.00 61.98 63.77 3hhs s VAL 86 Cb 0.17 -4.28 0.17 0.00 0.00 0.00 0.00 36.38 32.44 3hhs s VAL 86 CO 0.70 -0.06 1.67 -0.65 0.00 0.00 0.00 175.10 176.75 3hhs h PRO 87 N 7.28 0.08 -0.06 2.72 0.11 -1.81 -1.88 132.00 138.45 3hhs h PRO 87 Ca -0.27 -0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.77 3hhs h PRO 87 Cb 1.12 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 3hhs h PRO 87 CO 0.90 0.05 -0.26 -0.22 -0.21 0.00 0.00 178.00 178.27 3hhs h LYS 88 N 0.08 0.10 -0.14 1.05 3.64 -1.64 -2.49 116.57 117.16 3hhs h LYS 88 Ca 0.28 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.58 3hhs h LYS 88 Cb 0.43 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.23 3hhs h LYS 88 CO -0.49 0.35 -0.11 0.45 -2.27 0.00 0.00 179.45 177.38 3hhs h HIS 89 N 0.09 0.23 -0.23 1.91 3.86 -1.61 -2.32 115.15 117.08 3hhs h HIS 89 Ca 0.01 -0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.20 3hhs h HIS 89 Cb 0.51 -0.07 -0.01 0.00 1.06 0.00 0.00 27.41 28.90 3hhs h HIS 89 CO 0.00 0.34 0.14 0.00 0.86 0.00 0.00 177.93 179.27 3hhs h ARG 90 N 0.22 0.31 -0.38 2.45 3.08 -1.19 -1.09 114.38 117.78 3hhs h ARG 90 Ca 0.05 -0.03 0.01 0.00 0.07 0.00 0.00 59.98 60.08 3hhs h ARG 90 Cb 0.34 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.30 3hhs h ARG 90 CO 0.02 0.25 0.23 1.15 -1.07 0.00 0.00 179.97 180.55 3hhs h THR 91 N 0.28 1.05 -0.28 2.04 2.02 -1.49 -1.41 112.91 115.13 3hhs h THR 91 Ca 0.08 -0.16 -0.13 0.00 0.77 0.00 0.00 66.41 66.97 3hhs h THR 91 Cb 0.02 0.55 -0.00 0.00 -1.74 0.00 0.00 68.15 66.98 3hhs h THR 91 CO -0.02 0.08 -0.34 0.24 0.37 0.00 0.00 175.52 175.86 3hhs h MET 92 N 0.47 0.72 -0.55 6.66 2.86 -1.37 -2.51 114.93 121.22 3hhs h MET 92 Ca 0.15 -0.41 -0.09 0.00 -2.06 0.00 0.00 59.70 57.29 3hhs h MET 92 Cb -0.01 0.03 -0.02 0.00 0.06 0.00 0.00 31.60 31.66 3hhs h MET 92 CO -0.06 1.03 -0.02 0.00 1.06 0.00 0.00 176.91 178.92 3hhs h ALA 93 N 0.69 0.74 -0.45 6.32 0.00 -1.14 -2.45 119.26 122.97 3hhs h ALA 93 Ca 0.04 -0.31 0.03 0.00 0.00 0.00 0.00 54.91 54.67 3hhs h ALA 93 Cb 0.92 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.48 3hhs h ALA 93 CO 0.08 0.58 0.24 0.00 0.00 0.00 0.00 179.25 180.16 3hhs h ALA 94 N 0.95 0.56 -0.35 0.00 0.00 -1.22 0.14 119.26 119.35 3hhs h ALA 94 Ca 0.15 0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.11 3hhs h ALA 94 Cb 0.57 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 3hhs h ALA 94 CO 0.03 -0.10 0.13 -0.22 0.00 0.00 0.00 179.25 179.10 3hhs h LYS 95 N 0.48 0.28 -0.30 0.00 1.63 -1.31 0.65 116.57 118.00 3hhs h LYS 95 Ca 0.19 -0.02 -0.11 0.00 -0.85 0.00 0.00 60.65 59.86 3hhs h LYS 95 Cb 0.06 -0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 31.63 3hhs h LYS 95 CO -0.11 0.18 -0.23 1.25 -3.45 0.00 0.00 179.45 177.09 3hhs h LEU 96 N 0.29 0.73 -0.35 5.20 5.85 -1.13 -0.78 115.31 125.11 3hhs h LEU 96 Ca 0.15 -0.45 0.06 0.00 0.84 0.00 0.00 57.88 58.49 3hhs h LEU 96 Cb 0.12 -0.20 -0.06 0.00 0.37 0.00 0.00 40.66 40.88 3hhs h LEU 96 CO -0.15 1.02 -0.01 0.40 -0.34 0.00 0.00 178.44 179.36 3hhs h ILE 97 N 0.44 0.73 -0.72 4.05 2.04 -0.87 -0.20 117.51 122.97 3hhs h ILE 97 Ca 0.06 -0.03 0.10 0.00 1.00 0.00 0.00 64.86 65.98 3hhs h ILE 97 Cb 0.79 0.63 -0.07 0.00 -0.74 0.00 0.00 36.82 37.43 3hhs h ILE 97 CO 0.06 0.02 0.36 -0.78 0.00 0.00 0.00 178.15 177.81 3hhs h ASP 98 N 0.09 0.46 -0.22 1.72 3.58 -0.58 0.12 116.42 121.59 3hhs h ASP 98 Ca 0.17 0.06 -0.01 0.00 0.42 0.00 0.00 57.03 57.67 3hhs h ASP 98 Cb 0.24 -0.01 -0.01 0.00 1.72 0.00 0.00 39.33 41.27 3hhs h ASP 98 CO -0.29 0.26 0.09 0.40 -2.88 0.00 0.00 179.24 176.81 3hhs h ILE 99 N 0.60 1.17 -0.87 2.25 2.04 -0.81 -1.91 117.51 119.97 3hhs h ILE 99 Ca 0.36 -0.51 -0.01 0.00 1.00 0.00 0.00 64.86 65.71 3hhs h ILE 99 Cb 0.40 1.10 -0.04 0.00 -0.74 0.00 0.00 36.82 37.53 3hhs h ILE 99 CO -0.28 0.17 0.52 -0.26 0.00 0.00 0.00 178.15 178.30 3hhs h PHE 100 N 0.20 1.16 0.00 1.37 0.04 -0.30 -2.70 116.94 116.70 3hhs h PHE 100 Ca 0.07 -0.01 -0.06 0.00 2.80 0.00 0.00 57.97 60.77 3hhs h PHE 100 Cb 0.18 -0.38 -0.01 0.00 2.20 0.00 0.00 35.95 37.94 3hhs h PHE 100 CO -0.01 0.77 -0.30 0.52 -0.60 0.00 0.00 178.31 178.69 3hhs h MET 101 N 1.20 0.00 0.00 1.51 2.86 -0.72 -3.23 114.93 116.55 3hhs h MET 101 Ca 0.31 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.95 3hhs h MET 101 Cb -0.04 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.62 3hhs h MET 101 CO -0.06 0.30 -0.44 0.78 1.06 0.00 0.00 176.91 178.55 3hhs h GLY 102 N 0.95 0.00 -4.34 8.32 0.00 -1.01 -3.46 103.07 103.52 3hhs h GLY 102 Ca -0.00 0.00 -0.56 0.00 0.00 0.00 0.00 47.33 46.76 3hhs h GLY 102 CO 0.04 0.00 0.63 1.03 0.00 0.00 0.00 176.54 178.24 3hhs n MET 103 N -2.38 2.24 0.11 4.80 2.81 -1.16 -4.90 117.12 118.65 3hhs n MET 103 Ca 0.03 0.79 -0.02 0.00 -1.81 0.00 0.00 57.70 56.70 3hhs n MET 103 Cb 0.47 -2.45 0.20 0.00 -0.71 0.00 0.00 33.22 30.73 3hhs n MET 103 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3hhs h ARG 104 N 3.56 0.14 -3.64 0.03 2.47 -1.93 -3.47 114.38 111.55 3hhs h ARG 104 Ca -0.46 -0.08 -0.06 0.00 -1.26 0.00 0.00 59.98 58.12 3hhs h ARG 104 Cb 1.27 0.01 -0.09 0.00 -1.65 0.00 0.00 29.97 29.50 3hhs h ARG 104 CO 0.70 0.63 -0.12 0.16 0.56 0.00 0.00 179.97 181.90 3hhs s ASP 105 N -6.88 -0.10 0.26 7.04 1.47 -1.26 -5.06 116.67 112.13 3hhs s ASP 105 Ca -0.03 -0.90 -0.03 0.00 1.18 0.00 0.00 52.55 52.77 3hhs s ASP 105 Cb 0.13 0.58 0.32 0.00 -0.34 0.00 0.00 42.92 43.61 3hhs s ASP 105 CO 0.77 -1.13 1.76 0.58 0.68 0.00 0.00 175.17 177.83 3hhs h VAL 106 N 2.26 1.24 -0.90 2.11 2.07 -1.93 -0.65 116.25 120.45 3hhs h VAL 106 Ca -0.26 -0.98 -0.00 0.00 0.82 0.00 0.00 66.70 66.27 3hhs h VAL 106 Cb 1.25 0.82 -0.04 0.00 -1.52 0.00 0.00 31.29 31.79 3hhs h VAL 106 CO 0.36 0.35 0.54 -0.33 0.02 0.00 0.00 177.57 178.51 3hhs h GLU 107 N 0.78 1.23 -0.69 1.57 3.07 -1.97 0.44 114.58 119.00 3hhs h GLU 107 Ca 0.16 -0.11 -0.08 0.00 -0.50 0.00 0.00 59.36 58.83 3hhs h GLU 107 Cb 0.43 -0.26 -0.03 0.00 -0.84 0.00 0.00 28.75 28.05 3hhs h GLU 107 CO 0.02 0.86 0.13 -0.44 -1.40 0.00 0.00 179.01 178.18 3hhs h ASP 108 N 1.24 1.08 -0.25 1.42 5.19 -1.83 -2.19 116.42 121.09 3hhs h ASP 108 Ca 0.32 -0.25 -0.01 0.00 -0.62 0.00 0.00 57.03 56.47 3hhs h ASP 108 Cb -0.05 -0.29 -0.01 0.00 0.18 0.00 0.00 39.33 39.16 3hhs h ASP 108 CO -0.06 1.05 0.11 0.25 -3.12 0.00 0.00 179.24 177.47 3hhs h LEU 109 N 1.06 0.33 -0.61 1.55 5.85 -0.65 -1.50 115.31 121.35 3hhs h LEU 109 Ca 0.21 -0.15 0.11 0.00 0.84 0.00 0.00 57.88 58.90 3hhs h LEU 109 Cb 0.42 -0.09 -0.09 0.00 0.37 0.00 0.00 40.66 41.27 3hhs h LEU 109 CO 0.01 0.39 0.12 -0.61 -0.34 0.00 0.00 178.44 178.02 3hhs h GLN 110 N 0.25 0.25 -0.22 1.25 4.15 -0.81 0.68 115.11 120.67 3hhs h GLN 110 Ca 0.08 -0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.48 3hhs h GLN 110 Cb 0.16 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 27.78 3hhs h GLN 110 CO -0.01 0.16 0.10 1.03 -1.93 0.00 0.00 178.83 178.18 3hhs h SER 111 N 0.25 0.29 -0.25 -0.69 0.87 -1.10 -1.73 113.55 111.19 3hhs h SER 111 Ca 0.32 -0.14 -0.12 0.00 -1.23 0.00 0.00 61.79 60.62 3hhs h SER 111 Cb 0.48 -0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 62.35 3hhs h SER 111 CO -0.41 0.35 -0.24 1.62 -0.53 0.00 0.00 176.83 177.62 3hhs h VAL 112 N 0.21 1.27 -0.94 2.23 3.04 -1.02 -2.70 116.25 118.34 3hhs h VAL 112 Ca 0.07 -1.35 0.05 0.00 -1.01 0.00 0.00 66.70 64.46 3hhs h VAL 112 Cb 0.15 1.26 -0.06 0.00 -2.01 0.00 0.00 31.29 30.62 3hhs h VAL 112 CO -0.01 0.45 0.60 0.00 -1.01 0.00 0.00 177.57 177.60 3hhs h SER 114 N 1.12 0.73 -0.44 0.00 4.64 -1.07 0.15 113.55 118.68 3hhs h SER 114 Ca 0.39 -0.29 0.03 0.00 -0.47 0.00 0.00 61.79 61.45 3hhs h SER 114 Cb 0.11 -0.20 -0.03 0.00 -0.31 0.00 0.00 62.40 61.97 3hhs h SER 114 CO -0.15 0.84 0.25 0.22 -0.87 0.00 0.00 176.83 177.11 3hhs h TYR 115 N 0.60 0.46 -0.36 4.77 3.20 -1.25 -2.96 116.97 121.43 3hhs h TYR 115 Ca 0.13 0.02 -0.14 0.00 3.14 0.00 0.00 58.73 61.87 3hhs h TYR 115 Cb 0.44 -0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.56 3hhs h TYR 115 CO 0.03 0.26 -0.34 0.00 -1.64 0.00 0.00 178.16 176.46 3hhs h GLN 117 N 0.69 0.75 0.00 0.00 -0.00 -0.54 0.27 115.11 116.28 3hhs h GLN 117 Ca 0.07 -0.04 0.00 0.00 -0.00 0.00 0.00 58.65 58.67 3hhs h GLN 117 Cb 0.90 -0.17 0.00 0.00 0.00 0.00 0.00 27.48 28.21 3hhs h GLN 117 CO 0.08 0.49 0.00 1.28 0.00 0.00 0.00 178.83 180.69 3hhs n LEU 118 N -4.52 0.00 0.00 -2.39 4.77 -1.19 -4.15 117.00 109.53 3hhs n LEU 118 Ca 0.14 0.30 0.00 0.00 -0.03 0.00 0.00 56.01 56.42 3hhs n LEU 118 Cb 0.34 -0.30 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 3hhs n LEU 118 CO 0.31 -0.04 -0.22 0.54 -1.33 0.00 0.00 177.39 176.66 3hhs n ARG 119 N -1.30 1.27 -3.68 3.23 1.74 -0.53 -4.72 116.66 112.69 3hhs n ARG 119 Ca 0.12 0.00 -0.37 0.00 -0.77 0.00 0.00 57.85 56.83 3hhs n ARG 119 Cb 0.21 -0.72 -0.06 0.00 -1.02 0.00 0.00 32.46 30.87 3hhs n ARG 119 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3hhs s ILE 120 N -1.43 5.26 -0.40 0.55 -1.09 0.83 -4.81 121.20 120.11 3hhs s ILE 120 Ca 0.00 0.53 -0.38 0.00 -2.23 0.00 0.00 60.65 58.58 3hhs s ILE 120 Cb 0.00 -3.56 -0.16 0.00 -1.58 0.00 0.00 42.46 37.16 3hhs s ILE 120 CO 0.00 0.59 1.31 -3.20 -1.23 0.00 0.00 174.94 172.41 3hhs n ASN 121 N 1.98 0.95 -0.10 3.58 2.85 -1.26 -4.71 115.26 118.54 3hhs n ASN 121 Ca -0.17 0.93 0.09 0.00 -0.11 0.00 0.00 54.58 55.32 3hhs n ASN 121 Cb 0.54 -0.71 0.44 0.00 1.24 0.00 0.00 39.78 41.29 3hhs n ASN 121 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 3hhs h PRO 122 N 4.19 0.53 -0.30 1.20 0.11 -1.90 0.57 132.00 136.40 3hhs h PRO 122 Ca -0.34 -0.03 -0.08 0.00 0.11 0.00 0.00 66.00 65.66 3hhs h PRO 122 Cb 1.10 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.08 3hhs h PRO 122 CO 0.79 0.35 -0.14 1.88 -0.21 0.00 0.00 178.00 180.67 3hhs h TYR 123 N 0.54 0.71 -0.52 0.65 0.05 -1.89 -1.21 116.97 115.30 3hhs h TYR 123 Ca 0.27 -0.18 -0.10 0.00 0.05 0.00 0.00 58.73 58.78 3hhs h TYR 123 Cb 0.37 -0.17 -0.02 0.00 1.01 0.00 0.00 36.73 37.92 3hhs h TYR 123 CO -0.00 0.85 -0.06 1.98 -1.05 0.00 0.00 178.16 179.87 3hhs h MET 124 N 0.38 0.93 -0.08 4.88 4.05 -1.81 -1.41 114.93 121.87 3hhs h MET 124 Ca 0.07 -0.31 0.01 0.00 -0.28 0.00 0.00 59.70 59.19 3hhs h MET 124 Cb 0.66 -0.08 -0.01 0.00 -0.80 0.00 0.00 31.60 31.37 3hhs h MET 124 CO 0.04 0.96 0.00 0.35 0.23 0.00 0.00 176.91 178.50 3hhs h PHE 125 N 0.84 0.00 -0.08 1.39 3.57 -0.82 -1.16 116.94 120.69 3hhs h PHE 125 Ca 0.14 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.68 3hhs h PHE 125 Cb 0.59 0.01 -0.04 0.00 2.79 0.00 0.00 35.95 39.30 3hhs h PHE 125 CO 0.04 -0.00 -0.13 -0.97 -2.23 0.00 0.00 178.31 175.02 3hhs h ASN 126 N 0.03 -0.38 0.06 0.41 -0.73 -1.08 -0.06 115.58 113.83 3hhs h ASN 126 Ca 0.03 0.07 0.01 0.00 1.87 0.00 0.00 56.30 58.28 3hhs h ASN 126 Cb 0.04 0.18 -0.01 0.00 0.27 0.00 0.00 38.32 38.80 3hhs h ASN 126 CO -0.06 -0.17 -0.07 0.22 -0.37 0.00 0.00 177.43 176.98 3hhs h TYR 127 N -0.17 -0.19 -0.37 0.67 3.20 -1.11 -0.74 116.97 118.26 3hhs h TYR 127 Ca 0.07 0.00 -0.12 0.00 3.14 0.00 0.00 58.73 61.82 3hhs h TYR 127 Cb 0.28 0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.61 3hhs h TYR 127 CO -0.22 -0.12 -0.25 0.00 -1.64 0.00 0.00 178.16 175.93 3hhs h LEU 129 N 0.66 0.73 -0.25 0.00 5.85 -0.93 -1.36 115.31 120.01 3hhs h LEU 129 Ca 0.09 -0.26 0.00 0.00 0.84 0.00 0.00 57.88 58.55 3hhs h LEU 129 Cb 0.77 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 3hhs h LEU 129 CO 0.06 0.80 0.16 0.28 -0.34 0.00 0.00 178.44 179.40 3hhs h SER 130 N 0.63 0.28 -0.69 1.25 0.02 -0.85 -0.46 113.55 113.72 3hhs h SER 130 Ca 0.14 -0.01 0.06 0.00 -0.84 0.00 0.00 61.79 61.15 3hhs h SER 130 Cb 0.38 -0.07 -0.06 0.00 0.14 0.00 0.00 62.40 62.79 3hhs h SER 130 CO 0.01 0.20 0.39 0.58 -1.14 0.00 0.00 176.83 176.87 3hhs h VAL 131 N 0.33 0.96 -0.54 2.27 2.07 -1.10 -1.81 116.25 118.44 3hhs h VAL 131 Ca 0.09 -0.24 -0.03 0.00 0.82 0.00 0.00 66.70 67.34 3hhs h VAL 131 Cb -0.03 0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 29.90 3hhs h VAL 131 CO -0.02 0.13 0.22 0.00 0.02 0.00 0.00 177.57 177.91 3hhs h ALA 132 N 1.37 0.70 -0.56 1.67 0.00 -0.82 -2.45 119.26 119.16 3hhs h ALA 132 Ca 0.31 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 3hhs h ALA 132 Cb 0.21 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 3hhs h ALA 132 CO -0.19 0.31 0.18 0.82 0.00 0.00 0.00 179.25 180.36 3hhs h ILE 133 N 0.73 1.22 0.00 0.00 2.04 -0.84 0.95 117.51 121.60 3hhs h ILE 133 Ca 0.18 -0.73 0.00 0.00 1.00 0.00 0.00 64.86 65.31 3hhs h ILE 133 Cb 0.19 0.59 0.00 0.00 -0.74 0.00 0.00 36.82 36.87 3hhs h ILE 133 CO -0.02 0.28 0.00 -0.07 0.00 0.00 0.00 178.15 178.34 3hhs h LEU 134 N 0.81 0.00 0.00 1.44 3.38 -0.98 -3.37 115.31 116.59 3hhs h LEU 134 Ca 0.19 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.14 3hhs h LEU 134 Cb 0.22 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.97 3hhs h LEU 134 CO -0.01 0.00 -1.13 1.41 0.09 0.00 0.00 178.44 178.80 3hhs n HIS 135 N -2.54 0.00 -1.93 1.13 8.25 -0.79 -5.00 115.22 114.35 3hhs n HIS 135 Ca 0.03 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.07 3hhs n HIS 135 Cb 0.34 -0.07 -0.03 0.00 1.12 0.00 0.00 29.99 31.35 3hhs n HIS 135 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 3hhs s ARG 136 N -2.14 4.21 0.51 -0.41 0.52 0.26 -4.90 118.95 117.01 3hhs s ARG 136 Ca -0.01 2.38 0.20 0.00 -0.52 0.00 0.00 55.73 57.78 3hhs s ARG 136 Cb 0.01 -3.12 1.32 0.00 0.52 0.00 0.00 34.95 33.68 3hhs s ARG 136 CO 0.10 -0.57 2.11 -1.35 0.02 0.00 0.00 175.30 175.61 3hhs h PRO 137 N 6.14 0.00 -0.05 3.54 0.11 -1.94 -2.59 132.00 137.21 3hhs h PRO 137 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 3hhs h PRO 137 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3hhs h PRO 137 CO 0.87 0.07 0.00 -0.40 -0.21 0.00 0.00 178.00 178.33 3hhs n ASP 138 N -4.22 0.74 -0.22 -2.05 5.68 -1.26 -3.58 116.55 111.63 3hhs n ASP 138 Ca -0.03 -1.45 0.08 0.00 -0.50 0.00 0.00 54.79 52.90 3hhs n ASP 138 Cb 0.16 -0.03 0.14 0.00 -1.14 0.00 0.00 41.12 40.24 3hhs n ASP 138 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 3hhs n THR 139 N -0.34 1.76 -1.89 2.12 -2.24 -0.98 -4.97 114.28 107.75 3hhs n THR 139 Ca 0.17 -2.24 -0.37 0.00 -2.27 0.00 0.00 64.05 59.35 3hhs n THR 139 Cb 0.20 -0.16 0.04 0.00 -2.10 0.00 0.00 70.33 68.31 3hhs n THR 139 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3hhs s LYS 140 N -2.66 2.94 -1.38 -0.78 -0.14 -1.23 -2.89 119.74 113.60 3hhs s LYS 140 Ca 0.31 1.99 0.00 0.00 -1.36 0.00 0.00 55.97 56.91 3hhs s LYS 140 Cb 0.28 -2.01 0.00 0.00 -1.68 0.00 0.00 37.83 34.41 3hhs s LYS 140 CO 0.01 -1.28 0.00 0.41 -0.76 0.00 0.00 175.35 173.73 3hhs n GLY 141 N 0.68 1.38 3.59 -3.33 0.00 -1.26 -5.00 105.19 101.25 3hhs n GLY 141 Ca 0.13 -0.40 -0.35 0.00 0.00 0.00 0.00 46.02 45.41 3hhs n GLY 141 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3hhs s LEU 142 N -2.96 3.72 0.12 0.99 2.96 -1.14 -3.84 118.68 118.53 3hhs s LEU 142 Ca 0.00 0.01 -0.07 0.00 -0.22 0.00 0.00 54.13 53.85 3hhs s LEU 142 Cb 0.00 -1.95 -0.06 0.00 0.50 0.00 0.00 46.19 44.68 3hhs s LEU 142 CO 0.00 0.13 0.40 -0.55 -1.32 0.00 0.00 176.35 175.01 3hhs s SER 143 N 0.63 6.56 -0.16 3.68 0.15 -1.26 -3.64 113.70 119.67 3hhs s SER 143 Ca 0.03 0.70 -0.29 0.00 0.70 0.00 0.00 55.95 57.10 3hhs s SER 143 Cb -0.13 -2.14 -0.00 0.00 -1.71 0.00 0.00 66.02 62.04 3hhs s SER 143 CO 0.02 0.09 0.98 -0.63 1.20 0.00 0.00 173.24 174.90 3hhs s ILE 144 N -1.57 4.77 0.25 6.45 -1.09 -1.26 -4.95 121.20 123.80 3hhs s ILE 144 Ca 0.38 1.96 -0.31 0.00 -2.23 0.00 0.00 60.65 60.45 3hhs s ILE 144 Cb -0.13 -4.28 -0.13 0.00 -1.58 0.00 0.00 42.46 36.34 3hhs s ILE 144 CO 0.21 -0.06 1.35 -2.65 -1.23 0.00 0.00 174.94 172.56 3hhs n PRO 145 N 5.52 1.92 -1.66 2.79 -0.02 -1.26 -4.81 135.00 137.49 3hhs n PRO 145 Ca 0.09 0.68 -0.53 0.00 -2.02 0.00 0.00 63.50 61.72 3hhs n PRO 145 Cb 0.48 -2.30 -0.06 0.00 -0.02 0.00 0.00 33.50 31.60 3hhs n PRO 145 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 3hhs n THR 146 N 1.58 0.20 -0.35 3.45 -1.04 -1.26 -4.84 114.28 112.02 3hhs n THR 146 Ca 0.11 -0.04 0.06 0.00 -2.04 0.00 0.00 64.05 62.14 3hhs n THR 146 Cb 0.31 -1.20 0.24 0.00 -1.82 0.00 0.00 70.33 67.86 3hhs n THR 146 CO 0.00 0.00 0.00 0.15 -0.64 0.00 0.00 175.07 174.58 3hhs h PHE 147 N 6.39 1.12 0.00 -1.42 3.57 -1.99 -1.40 116.94 123.21 3hhs h PHE 147 Ca -0.47 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.04 3hhs h PHE 147 Cb 1.31 -0.36 -0.00 0.00 2.79 0.00 0.00 35.95 39.69 3hhs h PHE 147 CO 0.71 0.50 -0.09 0.00 -2.23 0.00 0.00 178.31 177.20 3hhs h ALA 148 N 1.52 1.24 0.00 2.41 0.00 -1.89 -0.46 119.26 122.09 3hhs h ALA 148 Ca 0.46 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.29 3hhs h ALA 148 Cb 0.39 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.17 3hhs h ALA 148 CO -0.22 0.11 -0.92 0.39 0.00 0.00 0.00 179.25 178.61 3hhs n GLU 149 N -3.55 0.38 0.01 0.00 1.02 -0.57 -2.60 120.64 115.33 3hhs n GLU 149 Ca -0.02 0.05 -0.18 0.00 -0.02 0.00 0.00 57.16 56.99 3hhs n GLU 149 Cb 0.22 -1.68 -0.13 0.00 -0.02 0.00 0.00 31.44 29.83 3hhs n GLU 149 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 3hhs h THR 150 N 0.00 1.52 -2.15 2.62 2.02 -0.94 -3.09 112.91 112.89 3hhs h THR 150 Ca 0.00 -2.30 -0.57 0.00 0.77 0.00 0.00 66.41 64.31 3hhs h THR 150 Cb 0.81 2.99 -0.41 0.00 -1.74 0.00 0.00 68.15 69.80 3hhs h THR 150 CO 0.00 0.65 -0.82 0.49 0.37 0.00 0.00 175.52 176.20 3hhs n PHE 151 N -4.26 2.32 0.28 3.16 3.72 -0.23 -4.44 117.46 118.01 3hhs n PHE 151 Ca -0.12 -3.93 0.15 0.00 -0.05 0.00 0.00 57.45 53.50 3hhs n PHE 151 Cb 0.70 -0.47 0.82 0.00 -0.94 0.00 0.00 39.48 39.59 3hhs n PHE 151 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 3hhs h PRO 152 N 3.56 0.00 0.00 -1.08 0.13 -1.72 -2.17 132.00 130.72 3hhs h PRO 152 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 3hhs h PRO 152 Cb 0.72 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.85 3hhs h PRO 152 CO 0.69 0.07 0.00 -0.40 -0.23 0.00 0.00 178.00 178.14 3hhs n ASP 153 N -3.50 0.22 0.00 1.44 5.68 -1.26 -1.23 116.55 117.90 3hhs n ASP 153 Ca -0.02 0.58 0.12 0.00 -0.50 0.00 0.00 54.79 54.97 3hhs n ASP 153 Cb 0.21 -0.62 0.58 0.00 -1.14 0.00 0.00 41.12 40.15 3hhs n ASP 153 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 3hhs n LYS 154 N -1.77 0.21 0.00 0.11 5.02 -0.82 -4.13 118.16 116.78 3hhs n LYS 154 Ca 0.01 0.06 0.00 0.00 -2.02 0.00 0.00 58.31 56.36 3hhs n LYS 154 Cb 0.08 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.59 3hhs n LYS 154 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 3hhs n PHE 155 N -1.37 0.00 -3.44 2.13 3.72 -0.36 -4.79 117.46 113.34 3hhs n PHE 155 Ca 0.09 -0.06 -0.13 0.00 -0.05 0.00 0.00 57.45 57.30 3hhs n PHE 155 Cb 0.23 -0.01 -0.03 0.00 -0.94 0.00 0.00 39.48 38.74 3hhs n PHE 155 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3hhs s MET 156 N -0.13 1.24 0.10 -1.08 0.23 -1.22 -4.85 119.30 113.60 3hhs s MET 156 Ca 0.00 -0.38 -0.36 0.00 -1.03 0.00 0.00 55.69 53.93 3hhs s MET 156 Cb 0.00 0.57 -0.17 0.00 -1.53 0.00 0.00 34.83 33.70 3hhs s MET 156 CO 0.00 -0.53 1.14 -3.47 -2.03 0.00 0.00 175.02 170.13 3hhs n ASP 157 N -0.20 0.81 0.25 -1.18 -0.08 -1.26 -4.73 116.55 110.16 3hhs n ASP 157 Ca -0.17 1.14 0.18 0.00 -1.51 0.00 0.00 54.79 54.43 3hhs n ASP 157 Cb 0.64 -1.10 0.89 0.00 2.34 0.00 0.00 41.12 43.89 3hhs n ASP 157 CO 0.00 0.00 0.00 0.77 0.12 0.00 0.00 177.20 178.09 3hhs h SER 158 N 3.42 0.00 0.38 1.67 4.64 -1.65 -1.39 113.55 120.63 3hhs h SER 158 Ca -0.46 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.84 3hhs h SER 158 Cb 1.37 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.46 3hhs h SER 158 CO 0.70 0.00 -0.12 0.11 -0.87 0.00 0.00 176.83 176.65 3hhs h LYS 159 N 0.00 0.00 -0.86 4.77 1.57 -1.88 -2.63 116.57 117.55 3hhs h LYS 159 Ca 0.06 0.00 0.09 0.00 -1.87 0.00 0.00 60.65 58.93 3hhs h LYS 159 Cb 0.50 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.73 3hhs h LYS 159 CO -0.00 0.12 0.51 0.28 -0.57 0.00 0.00 179.45 179.79 3hhs h VAL 160 N 0.00 0.94 -0.09 0.50 2.07 -1.59 -2.86 116.25 115.22 3hhs h VAL 160 Ca -0.00 -0.30 -0.15 0.00 0.82 0.00 0.00 66.70 67.08 3hhs h VAL 160 Cb 0.34 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.11 3hhs h VAL 160 CO 0.02 0.16 -0.59 -0.26 0.02 0.00 0.00 177.57 176.92 3hhs h PHE 161 N 0.86 0.37 -0.13 1.57 0.04 -1.65 -0.01 116.94 117.98 3hhs h PHE 161 Ca 0.41 -0.14 0.03 0.00 2.80 0.00 0.00 57.97 61.07 3hhs h PHE 161 Cb 0.34 -0.07 -0.07 0.00 2.20 0.00 0.00 35.95 38.36 3hhs h PHE 161 CO -0.05 0.80 -0.51 -0.07 -0.60 0.00 0.00 178.31 177.88 3hhs h LEU 162 N 0.22 -1.63 -0.54 1.54 3.38 -1.56 -0.61 115.31 116.10 3hhs h LEU 162 Ca -0.00 0.20 0.01 0.00 0.09 0.00 0.00 57.88 58.17 3hhs h LEU 162 Cb 1.09 0.64 -0.03 0.00 0.09 0.00 0.00 40.66 42.45 3hhs h LEU 162 CO 0.09 -0.47 0.35 0.03 0.09 0.00 0.00 178.44 178.53 3hhs h ARG 163 N -0.56 0.69 -0.64 1.13 3.08 -1.37 -1.95 114.38 114.75 3hhs h ARG 163 Ca 0.04 -0.04 -0.07 0.00 0.07 0.00 0.00 59.98 59.98 3hhs h ARG 163 Cb 0.67 -0.16 -0.03 0.00 0.08 0.00 0.00 29.97 30.54 3hhs h ARG 163 CO -0.43 0.46 0.13 0.00 -1.07 0.00 0.00 179.97 179.06 3hhs h ALA 164 N 1.20 0.85 -0.41 0.04 0.00 -0.83 -1.04 119.26 119.07 3hhs h ALA 164 Ca 0.20 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 3hhs h ALA 164 Cb -0.07 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.45 3hhs h ALA 164 CO -0.05 0.59 0.03 -0.09 0.00 0.00 0.00 179.25 179.73 3hhs h ARG 165 N 0.97 0.65 -0.10 0.00 2.43 -0.90 -1.28 114.38 116.14 3hhs h ARG 165 Ca 0.20 -0.14 -0.01 0.00 -0.81 0.00 0.00 59.98 59.21 3hhs h ARG 165 Cb 0.39 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 29.85 3hhs h ARG 165 CO 0.01 0.65 0.02 1.49 -1.51 0.00 0.00 179.97 180.62 3hhs h GLU 166 N 0.62 0.16 -0.28 0.20 4.81 -0.75 -2.64 114.58 116.71 3hhs h GLU 166 Ca 0.13 -0.04 0.05 0.00 -0.13 0.00 0.00 59.36 59.36 3hhs h GLU 166 Cb 0.34 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.66 3hhs h GLU 166 CO 0.01 0.37 0.01 0.28 -0.73 0.00 0.00 179.01 178.95 3hhs h VAL 167 N -0.07 0.81 -0.91 0.32 2.07 -0.85 0.40 116.25 118.02 3hhs h VAL 167 Ca 0.03 -0.03 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 3hhs h VAL 167 Cb 0.29 0.71 -0.04 0.00 -1.52 0.00 0.00 31.29 30.72 3hhs h VAL 167 CO 0.00 0.02 0.54 -1.28 0.02 0.00 0.00 177.57 176.87 3hhs h SER 168 N 0.09 1.09 0.53 0.57 0.87 -1.22 -0.34 113.55 115.15 3hhs h SER 168 Ca 0.13 -0.07 -0.29 0.00 -1.23 0.00 0.00 61.79 60.34 3hhs h SER 168 Cb 0.17 -0.28 -0.04 0.00 -0.44 0.00 0.00 62.40 61.81 3hhs h SER 168 CO -0.22 0.84 -1.61 0.78 -0.53 0.00 0.00 176.83 176.10 3hhs h ASN 169 N 1.25 0.08 0.03 6.23 2.35 -1.30 -3.42 115.58 120.81 3hhs h ASN 169 Ca 0.32 -0.15 -0.39 0.00 -0.55 0.00 0.00 56.30 55.53 3hhs h ASN 169 Cb -0.04 -0.03 -0.06 0.00 0.05 0.00 0.00 38.32 38.24 3hhs h ASN 169 CO -0.06 1.13 -2.37 0.52 -1.65 0.00 0.00 177.43 175.00 3hhs n VAL 170 N -3.18 1.55 -2.69 2.81 0.31 0.12 -4.64 118.33 112.60 3hhs n VAL 170 Ca -0.16 -0.57 -0.43 0.00 -0.01 0.00 0.00 64.34 63.17 3hhs n VAL 170 Cb 1.03 -1.52 0.00 0.00 -0.91 0.00 0.00 33.84 32.44 3hhs n VAL 170 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 3hhs n VAL 171 N -3.38 4.15 1.25 2.52 0.31 -0.15 -4.69 118.33 118.34 3hhs n VAL 171 Ca -0.44 -4.43 0.13 0.00 -0.01 0.00 0.00 64.34 59.60 3hhs n VAL 171 Cb 0.99 -2.43 0.41 0.00 -0.91 0.00 0.00 33.84 31.90 3hhs n VAL 171 CO 0.00 0.00 0.00 2.30 -1.32 0.00 0.00 176.83 177.81 3hhs n ILE 172 N 4.85 0.00 -3.58 2.52 -5.35 -1.26 -4.84 119.36 111.69 3hhs n ILE 172 Ca 0.41 -0.10 -0.14 0.00 -0.27 0.00 0.00 62.75 62.65 3hhs n ILE 172 Cb 0.42 0.28 -0.05 0.00 -1.74 0.00 0.00 39.64 38.55 3hhs n ILE 172 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 3hhs s SER 173 N -2.54 -0.43 0.02 7.28 1.04 -1.26 -5.15 113.70 112.66 3hhs s SER 173 Ca 0.24 0.17 0.00 0.00 0.48 0.00 0.00 55.95 56.84 3hhs s SER 173 Cb 0.19 0.48 0.00 0.00 0.10 0.00 0.00 66.02 66.80 3hhs s SER 173 CO 0.53 -0.71 0.00 0.61 0.98 0.00 0.00 173.24 174.65 3hhs n GLY 174 N 0.44 -2.20 3.76 7.32 0.00 -1.26 -4.92 105.19 108.33 3hhs n GLY 174 Ca -0.18 -1.49 -0.37 0.00 0.00 0.00 0.00 46.02 43.98 3hhs n GLY 174 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3hhs s SER 175 N -2.75 5.67 -0.03 1.61 0.01 -1.26 -5.06 113.70 111.89 3hhs s SER 175 Ca 0.00 2.41 0.04 0.00 1.31 0.00 0.00 55.95 59.70 3hhs s SER 175 Cb 0.00 -2.61 -0.03 0.00 0.21 0.00 0.00 66.02 63.60 3hhs s SER 175 CO 0.00 -1.27 -0.12 -0.13 0.41 0.00 0.00 173.24 172.13 3hhs s ARG 176 N -2.98 2.49 0.19 12.44 0.52 -1.26 -5.07 118.95 125.27 3hhs s ARG 176 Ca 0.70 -0.72 -0.15 0.00 -0.52 0.00 0.00 55.73 55.04 3hhs s ARG 176 Cb -0.31 -2.41 -0.07 0.00 0.52 0.00 0.00 34.95 32.68 3hhs s ARG 176 CO 0.36 0.61 0.61 1.41 0.02 0.00 0.00 175.30 178.31 3hhs s MET 177 N -0.98 4.04 0.52 3.54 1.75 -1.26 -5.03 119.30 121.87 3hhs s MET 177 Ca 0.13 0.58 -0.22 0.00 -1.25 0.00 0.00 55.69 54.93 3hhs s MET 177 Cb -0.11 -2.86 -0.06 0.00 2.84 0.00 0.00 34.83 34.64 3hhs s MET 177 CO 0.03 0.42 1.25 -2.30 -0.65 0.00 0.00 175.02 173.76 3hhs n PRO 178 N 0.62 1.60 -2.38 4.11 -0.02 -1.26 -4.83 135.00 132.84 3hhs n PRO 178 Ca -0.03 0.58 -0.42 0.00 -2.02 0.00 0.00 63.50 61.61 3hhs n PRO 178 Cb 0.52 -2.42 -0.03 0.00 -0.02 0.00 0.00 33.50 31.55 3hhs n PRO 178 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3hhs s VAL 179 N -1.30 4.00 -0.04 -1.45 1.01 0.13 -4.78 120.40 117.97 3hhs s VAL 179 Ca 0.69 1.40 -0.30 0.00 0.00 0.00 0.00 61.98 63.77 3hhs s VAL 179 Cb -0.45 -3.90 -0.03 0.00 0.00 0.00 0.00 36.38 32.00 3hhs s VAL 179 CO 0.52 0.05 1.18 0.20 0.00 0.00 0.00 175.10 177.04 3hhs s ASN 180 N 1.35 7.08 -0.34 3.32 0.01 -1.26 -0.24 114.94 124.87 3hhs s ASN 180 Ca 0.59 1.82 -0.18 0.00 -0.71 0.00 0.00 52.86 54.38 3hhs s ASN 180 Cb -0.29 -2.56 -0.01 0.00 0.41 0.00 0.00 41.25 38.80 3hhs s ASN 180 CO 0.26 -0.54 0.52 -0.69 -1.51 0.00 0.00 177.10 175.14 3hhs s VAL 181 N 1.96 5.02 0.20 1.60 1.01 -0.17 -4.89 120.40 125.13 3hhs s VAL 181 Ca 0.56 0.42 -0.30 0.00 0.00 0.00 0.00 61.98 62.65 3hhs s VAL 181 Cb -0.25 -3.95 -0.09 0.00 0.00 0.00 0.00 36.38 32.09 3hhs s VAL 181 CO 0.23 -0.18 1.39 -2.16 0.00 0.00 0.00 175.10 174.38 3hhs s PRO 182 N 2.39 4.32 0.04 2.72 0.04 -1.26 -4.43 135.00 138.82 3hhs s PRO 182 Ca 0.19 2.16 -0.08 0.00 0.04 0.00 0.00 61.00 63.31 3hhs s PRO 182 Cb -0.15 -3.17 -0.31 0.00 0.04 0.00 0.00 34.50 30.91 3hhs s PRO 182 CO 0.13 -0.37 1.02 0.97 0.04 0.00 0.00 177.00 178.79 3hhs h ILE 183 N 3.78 1.33 -3.57 0.56 2.10 -1.96 -3.42 117.51 116.32 3hhs h ILE 183 Ca -0.45 -2.87 -0.71 0.00 1.08 0.00 0.00 64.86 61.92 3hhs h ILE 183 Cb 1.21 2.93 -0.23 0.00 -1.09 0.00 0.00 36.82 39.65 3hhs h ILE 183 CO 0.80 0.85 -0.49 0.20 -1.08 0.00 0.00 178.15 178.43 3hhs s ASN 184 N -7.26 5.84 0.00 2.19 0.01 -1.26 -4.83 114.94 109.63 3hhs s ASN 184 Ca -0.07 -0.91 0.00 0.00 -0.71 0.00 0.00 52.86 51.17 3hhs s ASN 184 Cb 0.06 -2.07 0.00 0.00 0.41 0.00 0.00 41.25 39.65 3hhs s ASN 184 CO 0.90 -0.39 0.00 0.00 -1.51 0.00 0.00 177.10 176.10 3hhs n TYR 185 N 5.05 0.00 0.12 2.20 4.11 -1.26 -4.95 117.16 122.43 3hhs n TYR 185 Ca -0.12 0.00 0.02 0.00 -0.00 0.00 0.00 57.90 57.80 3hhs n TYR 185 Cb 0.47 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.81 3hhs n TYR 185 CO 0.00 0.00 0.00 1.79 -0.00 0.00 0.00 176.86 178.65 3hhs h THR 186 N 0.00 0.84 -3.53 -3.48 1.35 -1.89 -3.48 112.91 102.71 3hhs h THR 186 Ca 0.00 -2.22 -0.04 0.00 -0.55 0.00 0.00 66.41 63.60 3hhs h THR 186 Cb 0.00 2.38 -0.09 0.00 -1.73 0.00 0.00 68.15 68.71 3hhs h THR 186 CO 0.00 0.48 -0.07 0.00 -0.25 0.00 0.00 175.52 175.67 3hhs s ALA 187 N -2.95 -0.46 0.83 6.62 0.00 -1.26 -4.60 121.76 119.93 3hhs s ALA 187 Ca 0.03 -0.69 -0.12 0.00 0.00 0.00 0.00 51.96 51.18 3hhs s ALA 187 Cb 0.08 0.98 0.09 0.00 0.00 0.00 0.00 23.12 24.27 3hhs s ALA 187 CO 0.76 -0.84 1.16 1.21 0.00 0.00 0.00 175.76 178.04 3hhs s ASN 188 N -2.97 4.33 0.53 0.00 3.84 -1.26 -4.95 114.94 114.47 3hhs s ASN 188 Ca 0.18 0.89 0.36 0.00 0.21 0.00 0.00 52.86 54.50 3hhs s ASN 188 Cb -0.01 -1.44 1.53 0.00 -0.55 0.00 0.00 41.25 40.78 3hhs s ASN 188 CO 0.05 -2.02 1.79 0.00 -2.79 0.00 0.00 177.10 174.13 3hhs h THR 189 N -1.14 0.38 0.00 -5.21 1.03 -2.02 -2.38 112.91 103.58 3hhs h THR 189 Ca -0.47 -0.01 0.00 0.00 -0.01 0.00 0.00 66.41 65.92 3hhs h THR 189 Cb 1.32 0.35 0.00 0.00 -1.07 0.00 0.00 68.15 68.76 3hhs h THR 189 CO 0.64 0.01 0.00 1.07 -0.01 0.00 0.00 175.52 177.23 3hhs n THR 190 N -4.20 0.00 -3.80 0.00 5.66 -1.26 -4.55 114.28 106.13 3hhs n THR 190 Ca 0.27 0.00 -0.37 0.00 -3.05 0.00 0.00 64.05 60.90 3hhs n THR 190 Cb 1.27 -0.21 -0.12 0.00 -1.55 0.00 0.00 70.33 69.72 3hhs n THR 190 CO 0.00 0.00 0.00 -0.70 -3.05 0.00 0.00 175.07 171.32 3hhs s GLU 191 N -2.00 2.40 0.29 1.09 2.56 -0.90 -5.01 118.70 117.14 3hhs s GLU 191 Ca 0.13 -1.38 0.04 0.00 0.00 0.00 0.00 54.97 53.75 3hhs s GLU 191 Cb 0.06 -3.41 0.76 0.00 2.00 0.00 0.00 34.13 33.53 3hhs s GLU 191 CO 0.10 -0.77 1.68 -1.35 -0.56 0.00 0.00 175.26 174.36 3hhs h PRO 192 N 8.11 0.32 -0.00 4.30 0.11 -1.87 -0.99 132.00 141.98 3hhs h PRO 192 Ca -0.20 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.89 3hhs h PRO 192 Cb 1.07 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.10 3hhs h PRO 192 CO 0.61 0.21 0.00 0.93 -0.21 0.00 0.00 178.00 179.54 3hhs h GLU 193 N 0.33 0.00 0.00 1.05 4.39 -1.95 -2.03 114.58 116.37 3hhs h GLU 193 Ca 0.57 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 60.26 3hhs h GLU 193 Cb 1.14 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.78 3hhs h GLU 193 CO -0.58 0.00 -0.07 0.37 -1.16 0.00 0.00 179.01 177.57 3hhs h GLN 194 N 0.00 0.00 0.00 2.33 5.75 -1.46 -2.88 115.11 118.85 3hhs h GLN 194 Ca 0.00 0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.50 3hhs h GLN 194 Cb 0.01 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 28.56 3hhs h GLN 194 CO -0.00 0.07 -0.01 0.00 -2.65 0.00 0.00 178.83 176.24 3hhs h ARG 195 N 0.00 0.00 -0.04 1.69 3.08 -1.49 -2.09 114.38 115.52 3hhs h ARG 195 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3hhs h ARG 195 Cb 0.53 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.58 3hhs h ARG 195 CO 0.01 0.01 0.00 1.33 -1.07 0.00 0.00 179.97 180.25 3hhs n VAL 196 N -3.55 1.48 -0.14 2.04 0.24 -1.09 -4.66 118.33 112.65 3hhs n VAL 196 Ca -0.03 -1.61 0.19 0.00 -2.04 0.00 0.00 64.34 60.85 3hhs n VAL 196 Cb 0.10 0.12 0.58 0.00 -1.47 0.00 0.00 33.84 33.18 3hhs n VAL 196 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3hhs h ALA 197 N 0.27 2.33 -0.06 2.33 0.00 -1.40 -1.79 119.26 120.94 3hhs h ALA 197 Ca 0.00 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.92 3hhs h ALA 197 Cb 0.80 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 3hhs h ALA 197 CO 0.02 -0.54 0.08 0.10 0.00 0.00 0.00 179.25 178.90 3hhs h TYR 198 N 0.25 0.00 0.00 0.00 -0.00 -1.83 -0.88 116.97 114.51 3hhs h TYR 198 Ca 0.36 0.00 -0.09 0.00 0.00 0.00 0.00 58.73 59.01 3hhs h TYR 198 Cb 1.06 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.78 3hhs h TYR 198 CO -0.00 0.00 -0.59 0.35 -0.00 0.00 0.00 178.16 177.92 3hhs h PHE 199 N 0.00 0.00 -0.88 0.10 3.57 -1.70 -3.30 116.94 114.73 3hhs h PHE 199 Ca 0.03 0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.58 3hhs h PHE 199 Cb 0.18 0.00 -0.05 0.00 2.79 0.00 0.00 35.95 38.87 3hhs h PHE 199 CO 0.00 0.81 0.58 0.00 -2.23 0.00 0.00 178.31 177.47 3hhs h ARG 200 N -1.00 1.03 -0.55 1.11 3.08 -1.32 -2.69 114.38 114.03 3hhs h ARG 200 Ca -0.13 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.86 3hhs h ARG 200 Cb 0.85 -0.23 0.00 0.00 0.08 0.00 0.00 29.97 30.67 3hhs h ARG 200 CO -0.08 0.68 0.00 0.39 -1.07 0.00 0.00 179.97 179.89 3hhs n GLU 201 N -4.46 2.52 -2.21 0.04 1.02 -0.36 -3.16 120.64 114.03 3hhs n GLU 201 Ca 0.12 -2.33 -0.42 0.00 -0.02 0.00 0.00 57.16 54.51 3hhs n GLU 201 Cb 0.14 -1.52 -0.03 0.00 -0.02 0.00 0.00 31.44 30.01 3hhs n GLU 201 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3hhs s ASP 202 N -1.21 6.87 0.22 1.62 2.15 -1.02 -4.92 116.67 120.38 3hhs s ASP 202 Ca 0.43 2.29 -0.06 0.00 0.43 0.00 0.00 52.55 55.64 3hhs s ASP 202 Cb 0.23 -2.59 0.20 0.00 -0.30 0.00 0.00 42.92 40.46 3hhs s ASP 202 CO 0.31 -0.62 1.72 -0.29 -0.17 0.00 0.00 175.17 176.13 3hhs h ILE 203 N 4.24 1.26 -0.55 4.11 2.10 -1.90 -1.97 117.51 124.79 3hhs h ILE 203 Ca -0.42 -1.02 -0.07 0.00 1.08 0.00 0.00 64.86 64.42 3hhs h ILE 203 Cb 1.21 0.72 -0.02 0.00 -1.09 0.00 0.00 36.82 37.64 3hhs h ILE 203 CO 0.85 0.38 0.05 1.23 -1.08 0.00 0.00 178.15 179.58 3hhs h GLY 204 N 1.02 0.97 0.76 8.18 0.00 -1.97 -1.19 103.07 110.84 3hhs h GLY 204 Ca 0.18 -0.63 -0.06 0.00 0.00 0.00 0.00 47.33 46.82 3hhs h GLY 204 CO 0.02 0.59 -0.15 -2.22 0.00 0.00 0.00 176.54 174.78 3hhs h ILE 205 N 0.84 1.34 -0.69 2.60 2.04 -1.84 -1.61 117.51 120.19 3hhs h ILE 205 Ca 0.17 -1.29 -0.05 0.00 1.00 0.00 0.00 64.86 64.69 3hhs h ILE 205 Cb 0.43 1.84 -0.03 0.00 -0.74 0.00 0.00 36.82 38.31 3hhs h ILE 205 CO 0.01 0.38 0.24 0.78 0.00 0.00 0.00 178.15 179.57 3hhs h ASN 206 N 0.02 0.96 -0.62 1.72 4.21 -1.31 -1.99 115.58 118.57 3hhs h ASN 206 Ca 0.03 -0.16 -0.02 0.00 1.21 0.00 0.00 56.30 57.36 3hhs h ASN 206 Cb 0.67 -0.25 -0.03 0.00 -1.12 0.00 0.00 38.32 37.60 3hhs h ASN 206 CO 0.04 0.88 0.32 -0.07 -1.29 0.00 0.00 177.43 177.31 3hhs h LEU 207 N 1.01 0.79 -0.78 1.61 3.38 -1.17 -1.37 115.31 118.78 3hhs h LEU 207 Ca 0.23 -0.11 0.04 0.00 0.09 0.00 0.00 57.88 58.13 3hhs h LEU 207 Cb 0.24 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.74 3hhs h LEU 207 CO -0.01 0.68 0.49 -0.74 0.09 0.00 0.00 178.44 178.94 3hhs h HIS 208 N 0.85 0.91 -0.23 1.13 2.76 -1.04 0.69 115.15 120.22 3hhs h HIS 208 Ca 0.22 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.40 3hhs h HIS 208 Cb 0.07 -0.30 -0.01 0.00 1.55 0.00 0.00 27.41 28.73 3hhs h HIS 208 CO -0.00 0.50 0.09 1.25 -1.30 0.00 0.00 177.93 178.47 3hhs h HIS 209 N 0.93 0.35 -0.08 5.26 -0.00 -0.97 0.15 115.15 120.79 3hhs h HIS 209 Ca 0.32 -0.03 0.03 0.00 -0.00 0.00 0.00 60.37 60.70 3hhs h HIS 209 Cb 0.06 -0.11 -0.04 0.00 -0.00 0.00 0.00 27.41 27.33 3hhs h HIS 209 CO -0.04 0.38 -0.12 2.35 -0.00 0.00 0.00 177.93 180.50 3hhs h TRP 210 N 0.23 -0.30 -0.46 5.26 2.91 -1.03 -2.47 115.95 120.08 3hhs h TRP 210 Ca 0.08 0.02 -0.11 0.00 1.13 0.00 0.00 58.89 60.00 3hhs h TRP 210 Cb 0.17 0.15 -0.02 0.00 -0.51 0.00 0.00 29.16 28.95 3hhs h TRP 210 CO -0.01 -0.18 -0.17 0.45 -1.03 0.00 0.00 178.44 177.51 3hhs h HIS 211 N -0.16 1.01 0.41 2.65 3.86 -0.71 -0.64 115.15 121.57 3hhs h HIS 211 Ca 0.07 -0.22 -0.01 0.00 -1.16 0.00 0.00 60.37 59.05 3hhs h HIS 211 Cb 0.26 -0.25 -0.01 0.00 1.06 0.00 0.00 27.41 28.48 3hhs h HIS 211 CO -0.22 0.99 -0.27 2.35 0.86 0.00 0.00 177.93 181.64 3hhs h TRP 212 N 0.79 -0.70 0.00 2.45 7.01 -0.61 -1.99 115.95 122.90 3hhs h TRP 212 Ca 0.12 -0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.10 3hhs h TRP 212 Cb 0.70 0.25 -0.00 0.00 -2.10 0.00 0.00 29.16 28.01 3hhs h TRP 212 CO 0.04 -0.41 -0.05 0.45 -2.79 0.00 0.00 178.44 175.69 3hhs h HIS 213 N -0.65 0.00 -0.48 2.65 3.86 -1.34 0.12 115.15 119.31 3hhs h HIS 213 Ca -0.04 0.00 -0.13 0.00 -1.16 0.00 0.00 60.37 59.03 3hhs h HIS 213 Cb 0.54 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.00 3hhs h HIS 213 CO -0.10 0.05 -0.22 1.25 0.86 0.00 0.00 177.93 179.77 3hhs h LEU 214 N 0.00 1.02 0.00 2.43 5.85 -0.81 -2.79 115.31 121.02 3hhs h LEU 214 Ca -0.00 -0.39 -0.18 0.00 0.84 0.00 0.00 57.88 58.15 3hhs h LEU 214 Cb 0.10 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 40.82 3hhs h LEU 214 CO 0.01 1.19 -1.19 0.58 -0.34 0.00 0.00 178.44 178.68 3hhs h VAL 215 N 0.86 0.83 -2.21 1.05 2.07 -0.93 -3.37 116.25 114.55 3hhs h VAL 215 Ca 0.11 -2.39 -0.59 0.00 0.82 0.00 0.00 66.70 64.65 3hhs h VAL 215 Cb 0.80 2.32 -0.42 0.00 -1.52 0.00 0.00 31.29 32.46 3hhs h VAL 215 CO 0.07 0.47 -0.65 -1.22 0.02 0.00 0.00 177.57 176.26 3hhs n TYR 216 N -3.06 3.49 -2.19 1.57 4.01 0.38 -5.01 117.16 116.36 3hhs n TYR 216 Ca -0.07 -4.07 -0.35 0.00 -0.16 0.00 0.00 57.90 53.24 3hhs n TYR 216 Cb 0.87 -0.52 0.01 0.00 -0.31 0.00 0.00 39.34 39.39 3hhs n TYR 216 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 3hhs s PRO 217 N -2.71 3.26 0.16 -0.72 0.04 -1.05 -4.72 135.00 129.26 3hhs s PRO 217 Ca 0.42 1.68 0.25 0.00 0.04 0.00 0.00 61.00 63.40 3hhs s PRO 217 Cb 0.19 -2.00 0.53 0.00 0.04 0.00 0.00 34.50 33.26 3hhs s PRO 217 CO -0.06 -0.94 1.50 1.97 0.04 0.00 0.00 177.00 179.52 3hhs n PHE 218 N -1.35 0.72 -3.82 0.56 1.16 -1.26 -4.61 117.46 108.86 3hhs n PHE 218 Ca 0.12 0.21 -0.12 0.00 -1.87 0.00 0.00 57.45 55.79 3hhs n PHE 218 Cb 0.50 -0.78 -0.09 0.00 -1.61 0.00 0.00 39.48 37.51 3hhs n PHE 218 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 3hhs s ASP 219 N -4.36 -0.05 0.00 5.98 1.01 -1.26 -1.29 116.67 116.70 3hhs s ASP 219 Ca 0.08 -0.15 0.00 0.00 0.71 0.00 0.00 52.55 53.19 3hhs s ASP 219 Cb 0.13 0.27 0.00 0.00 1.01 0.00 0.00 42.92 44.33 3hhs s ASP 219 CO 0.67 -0.45 0.00 -0.24 0.21 0.00 0.00 175.17 175.36 3hhs n SER 220 N 1.16 0.00 0.15 0.27 2.88 -1.26 -4.96 113.62 111.87 3hhs n SER 220 Ca -0.21 -0.20 0.04 0.00 -1.33 0.00 0.00 58.87 57.17 3hhs n SER 220 Cb 0.57 0.00 0.06 0.00 -0.75 0.00 0.00 64.21 64.09 3hhs n SER 220 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3hhs h ALA 221 N 2.00 0.73 -3.17 -1.46 0.00 -1.89 -3.45 119.26 112.02 3hhs h ALA 221 Ca 0.00 -0.39 -0.18 0.00 0.00 0.00 0.00 54.91 54.34 3hhs h ALA 221 Cb 0.00 -0.07 -0.27 0.00 0.00 0.00 0.00 17.79 17.46 3hhs h ALA 221 CO 0.00 0.54 -0.46 0.34 0.00 0.00 0.00 179.25 179.66 3hhs s ASP 222 N -6.42 -0.23 0.61 0.00 -1.08 -1.26 -4.91 116.67 103.37 3hhs s ASP 222 Ca 0.04 0.46 0.30 0.00 -0.52 0.00 0.00 52.55 52.83 3hhs s ASP 222 Cb 0.07 0.44 1.71 0.00 -1.46 0.00 0.00 42.92 43.69 3hhs s ASP 222 CO 0.73 -0.09 2.08 0.03 0.52 0.00 0.00 175.17 178.44 3hhs h ARG 223 N 6.05 0.00 0.00 4.34 3.08 -2.01 -2.28 114.38 123.57 3hhs h ARG 223 Ca -0.28 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 59.69 3hhs h ARG 223 Cb 1.19 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.23 3hhs h ARG 223 CO 0.37 0.00 -0.34 0.66 -1.07 0.00 0.00 179.97 179.59 3hhs h SER 224 N 0.00 0.00 -0.48 7.04 4.64 -1.96 0.26 113.55 123.06 3hhs h SER 224 Ca 0.08 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.29 3hhs h SER 224 Cb 0.54 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.62 3hhs h SER 224 CO -0.00 0.34 -0.11 0.40 -0.87 0.00 0.00 176.83 176.59 3hhs h ILE 225 N 0.00 1.27 -0.23 0.95 2.04 -1.84 -3.15 117.51 116.55 3hhs h ILE 225 Ca -0.00 -1.25 -0.17 0.00 1.00 0.00 0.00 64.86 64.44 3hhs h ILE 225 Cb 0.73 1.09 -0.00 0.00 -0.74 0.00 0.00 36.82 37.89 3hhs h ILE 225 CO 0.04 0.43 -0.54 0.58 0.00 0.00 0.00 178.15 178.67 3hhs h VAL 226 N 0.77 1.30 0.00 1.67 2.07 -1.52 -3.41 116.25 117.13 3hhs h VAL 226 Ca 0.12 -1.76 -0.64 0.00 0.82 0.00 0.00 66.70 65.24 3hhs h VAL 226 Cb 0.67 1.70 0.01 0.00 -1.52 0.00 0.00 31.29 32.14 3hhs h VAL 226 CO 0.05 0.56 3.40 -3.20 0.02 0.00 0.00 177.57 178.40 3hhs n ASN 227 N -3.98 6.52 -4.95 0.57 5.15 0.89 -4.86 115.26 114.60 3hhs n ASN 227 Ca -0.03 -2.62 -0.23 0.00 -0.60 0.00 0.00 54.58 51.10 3hhs n ASN 227 Cb 0.61 -1.50 -0.00 0.00 -0.53 0.00 0.00 39.78 38.36 3hhs n ASN 227 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 3hhs s LYS 228 N 2.80 3.30 0.01 1.20 -0.14 -1.26 -4.94 119.74 120.69 3hhs s LYS 228 Ca 0.59 -0.50 -0.30 0.00 -1.36 0.00 0.00 55.97 54.40 3hhs s LYS 228 Cb 0.16 -2.66 -0.07 0.00 -1.68 0.00 0.00 37.83 33.57 3hhs s LYS 228 CO -0.05 0.02 1.73 0.34 -0.76 0.00 0.00 175.35 176.63 3hhs s ASP 229 N -4.11 6.59 -1.42 2.83 2.15 -1.26 -2.71 116.67 118.75 3hhs s ASP 229 Ca 0.43 2.42 -0.07 0.00 0.43 0.00 0.00 52.55 55.76 3hhs s ASP 229 Cb -0.10 -2.54 0.04 0.00 -0.30 0.00 0.00 42.92 40.02 3hhs s ASP 229 CO 0.36 -0.95 0.54 0.54 -0.17 0.00 0.00 175.17 175.49 3hhs n ARG 230 N 6.78 -4.15 0.20 4.34 1.74 -1.26 -4.65 116.66 119.67 3hhs n ARG 230 Ca 0.18 0.70 0.06 0.00 -0.77 0.00 0.00 57.85 58.01 3hhs n ARG 230 Cb 0.42 -5.48 0.41 0.00 -1.02 0.00 0.00 32.46 26.78 3hhs n ARG 230 CO 0.00 0.00 0.00 0.07 -1.52 0.00 0.00 177.63 176.18 3hhs h ARG 231 N -1.17 0.00 -0.28 5.56 -0.00 -1.87 -0.94 114.38 115.69 3hhs h ARG 231 Ca -0.48 0.00 -0.01 0.00 -0.00 0.00 0.00 59.98 59.50 3hhs h ARG 231 Cb 1.33 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 31.28 3hhs h ARG 231 CO 0.55 0.34 0.15 0.78 -0.00 0.00 0.00 179.97 181.79 3hhs h GLY 232 N 1.54 0.41 1.14 0.08 0.00 -1.87 0.85 103.07 105.21 3hhs h GLY 232 Ca -0.00 -0.18 -0.10 0.00 0.00 0.00 0.00 47.33 47.05 3hhs h GLY 232 CO 0.04 0.18 -0.02 -2.09 0.00 0.00 0.00 176.54 174.65 3hhs h GLU 233 N 0.33 1.02 -0.40 4.80 4.81 -1.63 -2.58 114.58 120.94 3hhs h GLU 233 Ca 0.10 -0.33 -0.09 0.00 -0.13 0.00 0.00 59.36 58.91 3hhs h GLU 233 Cb 0.06 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.33 3hhs h GLU 233 CO -0.02 1.01 -0.14 1.25 -0.73 0.00 0.00 179.01 180.39 3hhs h LEU 234 N 0.93 0.72 -0.09 1.64 5.85 -1.04 -0.65 115.31 122.67 3hhs h LEU 234 Ca 0.16 -0.22 0.04 0.00 0.84 0.00 0.00 57.88 58.71 3hhs h LEU 234 Cb 0.56 -0.19 -0.06 0.00 0.37 0.00 0.00 40.66 41.34 3hhs h LEU 234 CO 0.03 0.88 -0.32 0.15 -0.34 0.00 0.00 178.44 178.84 3hhs h PHE 235 N 0.65 -0.88 -0.45 1.25 3.57 -0.63 -0.18 116.94 120.28 3hhs h PHE 235 Ca 0.11 0.04 0.09 0.00 3.53 0.00 0.00 57.97 61.74 3hhs h PHE 235 Cb 0.61 0.40 -0.09 0.00 2.79 0.00 0.00 35.95 39.66 3hhs h PHE 235 CO 0.03 -0.40 -0.18 -0.92 -2.23 0.00 0.00 178.31 174.61 3hhs h TYR 236 N -0.42 -0.44 -0.09 0.41 3.20 -1.22 -3.02 116.97 115.40 3hhs h TYR 236 Ca 0.09 0.05 -0.13 0.00 3.14 0.00 0.00 58.73 61.87 3hhs h TYR 236 Cb 0.55 0.26 0.01 0.00 1.54 0.00 0.00 36.73 39.09 3hhs h TYR 236 CO -0.39 -0.27 -0.47 -0.92 -1.64 0.00 0.00 178.16 174.48 3hhs h TYR 237 N -0.08 0.64 -0.76 -3.82 3.20 -0.63 -0.28 116.97 115.23 3hhs h TYR 237 Ca 0.22 -0.29 -0.02 0.00 3.14 0.00 0.00 58.73 61.78 3hhs h TYR 237 Cb 0.42 -0.10 -0.04 0.00 1.54 0.00 0.00 36.73 38.56 3hhs h TYR 237 CO -0.45 1.06 0.40 1.98 -1.64 0.00 0.00 178.16 179.51 3hhs h MET 238 N 0.04 1.07 0.04 1.82 4.05 -1.12 -0.82 114.93 120.01 3hhs h MET 238 Ca -0.03 -0.13 -0.22 0.00 -0.28 0.00 0.00 59.70 59.03 3hhs h MET 238 Cb 1.12 -0.21 -0.01 0.00 -0.80 0.00 0.00 31.60 31.70 3hhs h MET 238 CO 0.10 0.80 -1.02 0.45 0.23 0.00 0.00 176.91 177.47 3hhs h HIS 239 N 1.07 0.23 -0.96 1.39 3.86 -1.46 -2.07 115.15 117.21 3hhs h HIS 239 Ca 0.27 -0.15 0.01 0.00 -1.16 0.00 0.00 60.37 59.33 3hhs h HIS 239 Cb 0.06 -0.02 -0.05 0.00 1.06 0.00 0.00 27.41 28.46 3hhs h HIS 239 CO 0.01 1.06 0.62 0.37 0.86 0.00 0.00 177.93 180.85 3hhs h GLN 240 N 0.06 1.27 -0.18 2.45 -0.00 -0.63 -1.46 115.11 116.62 3hhs h GLN 240 Ca -0.06 -0.09 -0.19 0.00 -0.00 0.00 0.00 58.65 58.32 3hhs h GLN 240 Cb 1.72 -0.28 0.00 0.00 0.00 0.00 0.00 27.48 28.92 3hhs h GLN 240 CO 0.15 0.85 -0.66 1.96 0.00 0.00 0.00 178.83 181.13 3hhs h GLN 241 N 1.31 0.68 -0.49 1.69 1.08 -1.12 -0.95 115.11 117.30 3hhs h GLN 241 Ca 0.35 -0.49 0.06 0.00 -1.45 0.00 0.00 58.65 57.12 3hhs h GLN 241 Cb -0.13 0.08 -0.05 0.00 -0.05 0.00 0.00 27.48 27.33 3hhs h GLN 241 CO -0.07 1.11 0.20 0.82 -0.95 0.00 0.00 178.83 179.94 3hhs h ILE 242 N 0.49 0.88 -0.39 2.54 2.04 -1.19 -0.20 117.51 121.68 3hhs h ILE 242 Ca -0.02 -0.14 -0.16 0.00 1.00 0.00 0.00 64.86 65.55 3hhs h ILE 242 Cb 1.25 0.44 -0.01 0.00 -0.74 0.00 0.00 36.82 37.77 3hhs h ILE 242 CO 0.13 0.07 -0.37 0.40 0.00 0.00 0.00 178.15 178.38 3hhs h ILE 243 N 0.40 1.27 -0.04 -0.67 1.08 -1.12 -0.25 117.51 118.18 3hhs h ILE 243 Ca 0.23 -1.55 0.03 0.00 -0.39 0.00 0.00 64.86 63.18 3hhs h ILE 243 Cb 0.21 1.36 -0.04 0.00 -3.07 0.00 0.00 36.82 35.28 3hhs h ILE 243 CO -0.21 0.52 -0.17 1.23 -0.69 0.00 0.00 178.15 178.83 3hhs h GLY 244 N 0.77 -0.19 0.84 5.37 0.00 -1.04 0.08 103.07 108.90 3hhs h GLY 244 Ca 0.06 0.20 0.03 0.00 0.00 0.00 0.00 47.33 47.62 3hhs h GLY 244 CO 0.09 -0.16 0.21 3.21 0.00 0.00 0.00 176.54 179.89 3hhs h ARG 245 N -0.26 0.41 -0.36 4.80 3.08 -0.90 -1.75 114.38 119.41 3hhs h ARG 245 Ca 0.07 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 60.07 3hhs h ARG 245 Cb 0.35 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.29 3hhs h ARG 245 CO -0.19 0.27 0.14 -0.92 -1.07 0.00 0.00 179.97 178.20 3hhs h TYR 246 N 0.42 0.55 -0.97 3.04 3.20 -0.91 -1.83 116.97 120.47 3hhs h TYR 246 Ca 0.16 -0.04 0.10 0.00 3.14 0.00 0.00 58.73 62.09 3hhs h TYR 246 Cb 0.05 -0.16 -0.08 0.00 1.54 0.00 0.00 36.73 38.08 3hhs h TYR 246 CO -0.09 0.51 0.60 -0.91 -1.64 0.00 0.00 178.16 176.63 3hhs h ASN 247 N 0.43 0.91 -0.62 -2.11 2.35 -0.81 -0.48 115.58 115.24 3hhs h ASN 247 Ca 0.12 0.04 -0.05 0.00 -0.55 0.00 0.00 56.30 55.86 3hhs h ASN 247 Cb 0.19 -0.15 -0.03 0.00 0.05 0.00 0.00 38.32 38.38 3hhs h ASN 247 CO -0.01 0.52 0.23 0.58 -1.65 0.00 0.00 177.43 177.09 3hhs h VAL 248 N 1.01 1.24 -0.29 2.81 2.07 -0.95 -1.42 116.25 120.72 3hhs h VAL 248 Ca 0.46 -0.79 -0.05 0.00 0.82 0.00 0.00 66.70 67.14 3hhs h VAL 248 Cb 0.37 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.63 3hhs h VAL 248 CO -0.24 0.31 -0.00 -0.33 0.02 0.00 0.00 177.57 177.33 3hhs h GLU 249 N 0.96 0.51 -0.37 1.57 4.39 -0.66 -0.65 114.58 120.33 3hhs h GLU 249 Ca 0.22 -0.16 0.07 0.00 0.34 0.00 0.00 59.36 59.82 3hhs h GLU 249 Cb 0.24 -0.05 -0.06 0.00 -0.10 0.00 0.00 28.75 28.78 3hhs h GLU 249 CO -0.01 0.66 -0.03 0.00 -1.16 0.00 0.00 179.01 178.47 3hhs h ARG 250 N 0.30 0.06 -0.12 2.33 3.08 -0.88 -2.62 114.38 116.53 3hhs h ARG 250 Ca 0.08 -0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.06 3hhs h ARG 250 Cb 0.44 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.46 3hhs h ARG 250 CO 0.02 0.04 -0.22 0.52 -1.07 0.00 0.00 179.97 179.26 3hhs h MET 251 N 0.07 0.20 0.00 0.04 2.86 -0.65 -0.03 114.93 117.41 3hhs h MET 251 Ca 0.18 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.76 3hhs h MET 251 Cb 0.26 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.90 3hhs h MET 251 CO -0.33 0.41 0.00 0.00 1.06 0.00 0.00 176.91 178.05 3hhs n ASN 253 N -2.71 2.46 -0.18 0.00 4.13 -0.12 -4.73 115.26 114.12 3hhs n ASN 253 Ca -0.00 -3.23 -0.02 0.00 1.68 0.00 0.00 54.58 53.00 3hhs n ASN 253 Cb 0.17 -0.47 -0.01 0.00 -1.54 0.00 0.00 39.78 37.93 3hhs n ASN 253 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3hhs n GLY 254 N -1.26 0.56 3.86 7.41 0.00 -1.02 -5.01 105.19 109.73 3hhs n GLY 254 Ca 0.18 -0.37 -0.33 0.00 0.00 0.00 0.00 46.02 45.50 3hhs n GLY 254 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hhs s LEU 255 N -0.54 4.17 0.88 0.99 1.43 -0.64 -5.03 118.68 119.93 3hhs s LEU 255 Ca 0.00 0.24 -0.11 0.00 -1.03 0.00 0.00 54.13 53.23 3hhs s LEU 255 Cb 0.00 -2.55 0.12 0.00 0.03 0.00 0.00 46.19 43.79 3hhs s LEU 255 CO 0.00 0.24 1.10 -2.16 0.23 0.00 0.00 176.35 175.76 3hhs s PRO 256 N -2.02 1.40 0.69 1.29 0.04 -1.26 -3.69 135.00 131.45 3hhs s PRO 256 Ca 0.27 1.10 -0.17 0.00 0.04 0.00 0.00 61.00 62.24 3hhs s PRO 256 Cb -0.12 -1.80 0.00 0.00 0.04 0.00 0.00 34.50 32.61 3hhs s PRO 256 CO 0.19 -2.22 1.13 1.04 0.04 0.00 0.00 177.00 177.18 3hhs n GLN 257 N -3.90 0.76 -1.73 4.56 6.02 -1.26 -4.82 117.38 117.01 3hhs n GLN 257 Ca 0.08 0.32 -0.42 0.00 -0.01 0.00 0.00 57.00 56.97 3hhs n GLN 257 Cb 0.54 -2.37 -0.02 0.00 1.02 0.00 0.00 30.24 29.41 3hhs n GLN 257 CO 0.00 0.00 0.00 1.55 -1.01 0.00 0.00 177.06 177.60 3hhs n VAL 258 N -2.27 0.70 -3.01 5.09 3.14 -1.26 -4.99 118.33 115.73 3hhs n VAL 258 Ca 0.14 -0.18 -0.40 0.00 -2.96 0.00 0.00 64.34 60.95 3hhs n VAL 258 Cb 0.49 -1.89 -0.05 0.00 -1.06 0.00 0.00 33.84 31.33 3hhs n VAL 258 CO 0.00 0.00 0.00 -0.54 -6.46 0.00 0.00 176.83 169.83 3hhs s LYS 259 N -0.00 4.46 0.51 1.45 1.02 -1.26 -5.02 119.74 120.90 3hhs s LYS 259 Ca 0.68 0.97 -0.21 0.00 0.02 0.00 0.00 55.97 57.43 3hhs s LYS 259 Cb -0.53 -3.41 -0.06 0.00 -0.52 0.00 0.00 37.83 33.31 3hhs s LYS 259 CO 0.44 0.16 1.18 -1.25 -0.92 0.00 0.00 175.35 174.96 3hhs s PRO 260 N 0.43 3.47 -1.22 -1.68 0.04 -1.26 -4.48 135.00 130.29 3hhs s PRO 260 Ca 0.38 1.77 -0.12 0.00 0.04 0.00 0.00 61.00 63.08 3hhs s PRO 260 Cb -0.19 -2.20 0.18 0.00 0.04 0.00 0.00 34.50 32.33 3hhs s PRO 260 CO 0.20 -0.79 1.54 0.34 0.04 0.00 0.00 177.00 178.33 3hhs n PHE 261 N -0.94 4.39 0.67 0.56 7.35 -0.16 -4.75 117.46 124.57 3hhs n PHE 261 Ca 0.10 -3.22 0.10 0.00 -0.76 0.00 0.00 57.45 53.67 3hhs n PHE 261 Cb 0.49 -2.08 -0.14 0.00 0.35 0.00 0.00 39.48 38.10 3hhs n PHE 261 CO 0.00 0.00 0.00 -1.13 -0.76 0.00 0.00 176.76 174.87 3hhs n SER 262 N 4.94 0.67 -4.22 -2.13 3.41 -1.26 -4.66 113.62 110.37 3hhs n SER 262 Ca 0.37 -0.67 -0.40 0.00 -0.26 0.00 0.00 58.87 57.91 3hhs n SER 262 Cb 0.41 1.33 -0.09 0.00 -0.26 0.00 0.00 64.21 65.59 3hhs n SER 262 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3hhs s ASP 263 N -3.50 5.63 0.02 4.04 2.15 -1.26 -4.96 116.67 118.79 3hhs s ASP 263 Ca 0.03 -1.76 0.17 0.00 0.43 0.00 0.00 52.55 51.41 3hhs s ASP 263 Cb 0.15 -1.98 0.70 0.00 -0.30 0.00 0.00 42.92 41.49 3hhs s ASP 263 CO 0.88 -0.62 1.53 0.49 -0.17 0.00 0.00 175.17 177.28 3hhs n PHE 264 N 4.88 0.06 1.08 -5.34 3.72 -1.26 -1.61 117.46 118.99 3hhs n PHE 264 Ca -0.08 0.02 0.12 0.00 -0.05 0.00 0.00 57.45 57.46 3hhs n PHE 264 Cb 0.42 -0.54 0.24 0.00 -0.94 0.00 0.00 39.48 38.66 3hhs n PHE 264 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 3hhs n SER 265 N -1.56 0.78 -4.81 4.37 7.64 -1.26 -4.42 113.62 114.37 3hhs n SER 265 Ca 0.04 -0.58 -0.33 0.00 1.01 0.00 0.00 58.87 59.01 3hhs n SER 265 Cb 0.19 0.30 -0.02 0.00 -1.01 0.00 0.00 64.21 63.67 3hhs n SER 265 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3hhs s ALA 266 N -2.82 2.85 0.49 -0.43 0.00 -0.64 -4.89 121.76 116.32 3hhs s ALA 266 Ca 0.15 0.44 -0.24 0.00 0.00 0.00 0.00 51.96 52.32 3hhs s ALA 266 Cb 0.18 -3.22 -0.07 0.00 0.00 0.00 0.00 23.12 20.01 3hhs s ALA 266 CO 0.65 -0.49 1.35 -2.14 0.00 0.00 0.00 175.76 175.13 3hhs s PRO 267 N -3.71 3.49 -0.59 0.00 0.02 -1.26 -4.63 135.00 128.32 3hhs s PRO 267 Ca 0.64 2.24 -0.20 0.00 0.02 0.00 0.00 61.00 63.70 3hhs s PRO 267 Cb -0.15 -2.47 0.09 0.00 0.02 0.00 0.00 34.50 32.00 3hhs s PRO 267 CO 0.28 -0.91 0.74 0.42 -0.33 0.00 0.00 177.00 177.20 3hhs s ILE 268 N -1.29 4.74 0.31 2.83 1.01 0.11 -4.94 121.20 123.97 3hhs s ILE 268 Ca 0.65 -0.79 0.03 0.00 0.00 0.00 0.00 60.65 60.55 3hhs s ILE 268 Cb -0.40 -4.49 0.12 0.00 0.01 0.00 0.00 42.46 37.70 3hhs s ILE 268 CO 0.49 -1.13 1.81 -0.33 0.00 0.00 0.00 174.94 175.78 3hhs h GLU 269 N 9.22 0.52 -5.67 2.79 3.07 -1.91 0.11 114.58 122.70 3hhs h GLU 269 Ca -0.29 -0.14 -0.63 0.00 -0.50 0.00 0.00 59.36 57.80 3hhs h GLU 269 Cb 1.09 -0.06 -0.13 0.00 -0.84 0.00 0.00 28.75 28.80 3hhs h GLU 269 CO 1.09 0.62 0.42 -1.21 -1.40 0.00 0.00 179.01 178.53 3hhs s GLU 270 N -4.78 3.31 0.93 2.33 8.01 -1.26 -3.74 118.70 123.50 3hhs s GLU 270 Ca -0.07 -0.35 -0.13 0.00 0.01 0.00 0.00 54.97 54.43 3hhs s GLU 270 Cb 0.15 -4.04 0.15 0.00 -4.31 0.00 0.00 34.13 26.08 3hhs s GLU 270 CO 0.78 -1.35 1.16 0.20 0.01 0.00 0.00 175.26 176.05 3hhs s GLY 271 N 2.65 1.60 -0.21 -1.39 0.00 -1.26 -4.82 107.32 103.89 3hhs s GLY 271 Ca 0.27 -0.64 -0.10 0.00 0.00 0.00 0.00 44.72 44.26 3hhs s GLY 271 CO 0.19 -0.04 0.48 -0.47 0.00 0.00 0.00 173.10 173.25 3hhs s TYR 272 N -3.35 -0.79 -0.44 1.90 5.04 -0.19 -4.88 117.35 114.64 3hhs s TYR 272 Ca 0.65 1.57 -0.01 0.00 -2.44 0.00 0.00 57.07 56.84 3hhs s TYR 272 Cb -0.13 0.38 0.12 0.00 0.35 0.00 0.00 41.96 42.68 3hhs s TYR 272 CO 0.53 -0.44 0.23 -0.06 -1.34 0.00 0.00 175.55 174.47 3hhs s PHE 273 N 1.89 3.56 0.26 4.97 0.08 -1.26 -1.00 117.98 126.48 3hhs s PHE 273 Ca -0.07 -2.62 0.23 0.00 0.12 0.00 0.00 56.93 54.59 3hhs s PHE 273 Cb -0.09 -3.15 1.01 0.00 -0.57 0.00 0.00 43.02 40.22 3hhs s PHE 273 CO -0.14 -0.93 1.88 -1.00 -0.10 0.00 0.00 175.22 174.92 3hhs h PRO 274 N 7.70 0.00 -4.48 0.24 0.13 -1.87 -3.45 132.00 130.27 3hhs h PRO 274 Ca -0.09 0.00 -0.40 0.00 -0.87 0.00 0.00 66.00 64.64 3hhs h PRO 274 Cb 1.02 0.00 0.04 0.00 0.13 0.00 0.00 31.00 32.18 3hhs h PRO 274 CO 0.67 0.25 -0.59 1.63 -0.23 0.00 0.00 178.00 179.73 3hhs n LYS 275 N -3.58 -4.44 -4.13 0.86 5.02 -1.26 -4.90 118.16 105.72 3hhs n LYS 275 Ca -0.01 0.86 -0.28 0.00 -2.02 0.00 0.00 58.31 56.86 3hhs n LYS 275 Cb 0.39 -5.69 -0.07 0.00 -0.02 0.00 0.00 35.03 29.64 3hhs n LYS 275 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3hhs s LEU 276 N -6.60 3.54 0.02 -0.35 1.43 -1.26 -1.66 118.68 113.80 3hhs s LEU 276 Ca 0.29 -0.22 0.03 0.00 -1.03 0.00 0.00 54.13 53.20 3hhs s LEU 276 Cb -0.13 -2.21 -0.02 0.00 0.03 0.00 0.00 46.19 43.87 3hhs s LEU 276 CO 0.36 0.12 -0.10 -0.62 0.23 0.00 0.00 176.35 176.33 3hhs s ASP 277 N -2.75 1.20 -0.18 2.29 2.15 -1.26 -1.52 116.67 116.59 3hhs s ASP 277 Ca 0.28 -0.35 -0.02 0.00 0.43 0.00 0.00 52.55 52.88 3hhs s ASP 277 Cb -0.10 -0.07 -0.01 0.00 -0.30 0.00 0.00 42.92 42.43 3hhs s ASP 277 CO 0.20 0.01 -0.08 -0.55 -0.17 0.00 0.00 175.17 174.58 3hhs s SER 278 N -0.86 4.17 0.06 -0.34 0.15 -0.61 -4.70 113.70 111.57 3hhs s SER 278 Ca -0.00 -0.37 -0.21 0.00 0.70 0.00 0.00 55.95 56.08 3hhs s SER 278 Cb -0.06 -1.68 -0.12 0.00 -1.71 0.00 0.00 66.02 62.44 3hhs s SER 278 CO 0.00 0.06 1.46 1.56 1.20 0.00 0.00 173.24 177.52 3hhs h GLN 279 N 7.53 0.30 -0.37 5.44 4.20 -1.97 -0.36 115.11 129.89 3hhs h GLN 279 Ca -0.36 -0.11 0.07 0.00 0.06 0.00 0.00 58.65 58.31 3hhs h GLN 279 Cb 1.18 -0.02 -0.07 0.00 0.30 0.00 0.00 27.48 28.87 3hhs h GLN 279 CO 0.59 0.56 -0.09 0.28 -0.67 0.00 0.00 178.83 179.51 3hhs h VAL 280 N 0.02 0.64 -0.00 -0.54 2.07 -1.96 -2.59 116.25 113.88 3hhs h VAL 280 Ca 0.04 -0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.56 3hhs h VAL 280 Cb 0.44 0.63 0.00 0.00 -1.52 0.00 0.00 31.29 30.84 3hhs h VAL 280 CO 0.01 0.00 -0.10 0.00 0.02 0.00 0.00 177.57 177.50 3hhs n ALA 281 N -2.65 2.62 -4.06 1.67 0.00 -1.23 -4.43 120.51 112.44 3hhs n ALA 281 Ca 0.02 -0.17 -0.30 0.00 0.00 0.00 0.00 53.44 52.99 3hhs n ALA 281 Cb 0.20 -1.39 -0.04 0.00 0.00 0.00 0.00 19.45 18.22 3hhs n ALA 281 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3hhs n SER 282 N -1.42 -0.69 -3.54 0.00 2.88 -0.17 -4.84 113.62 105.84 3hhs n SER 282 Ca 0.08 -1.12 -0.10 0.00 -1.33 0.00 0.00 58.87 56.40 3hhs n SER 282 Cb 0.32 -2.50 -0.04 0.00 -0.75 0.00 0.00 64.21 61.24 3hhs n SER 282 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3hhs s ARG 283 N -6.85 0.72 0.58 -1.46 1.70 -1.08 -5.00 118.95 107.55 3hhs s ARG 283 Ca 0.09 -0.02 -0.14 0.00 -0.47 0.00 0.00 55.73 55.19 3hhs s ARG 283 Cb -0.04 0.34 -0.05 0.00 -0.57 0.00 0.00 34.95 34.62 3hhs s ARG 283 CO 0.93 -0.26 1.02 0.95 -1.08 0.00 0.00 175.30 176.85 3hhs s THR 284 N -1.89 4.44 0.24 4.99 -4.23 -1.26 -1.57 115.64 116.35 3hhs s THR 284 Ca 0.00 1.01 -0.30 0.00 -1.18 0.00 0.00 61.69 61.22 3hhs s THR 284 Cb -0.01 -3.69 -0.09 0.00 1.34 0.00 0.00 72.50 70.06 3hhs s THR 284 CO -0.02 -0.82 1.12 0.26 -0.54 0.00 0.00 174.62 174.62 3hhs s TRP 285 N -2.81 3.55 0.43 3.99 0.52 -0.57 -4.90 118.94 119.14 3hhs s TRP 285 Ca 0.58 1.62 -0.23 0.00 0.02 0.00 0.00 56.10 58.10 3hhs s TRP 285 Cb -0.11 -3.31 -0.08 0.00 -1.15 0.00 0.00 33.47 28.81 3hhs s TRP 285 CO 0.41 -0.69 1.09 -1.25 0.02 0.00 0.00 176.95 176.54 3hhs s PRO 286 N -0.96 3.98 0.78 4.98 0.04 -1.26 -4.78 135.00 137.77 3hhs s PRO 286 Ca 0.47 1.59 -0.10 0.00 0.04 0.00 0.00 61.00 63.00 3hhs s PRO 286 Cb -0.31 -2.44 0.08 0.00 0.04 0.00 0.00 34.50 31.86 3hhs s PRO 286 CO 0.39 -0.32 1.12 -1.25 0.04 0.00 0.00 177.00 176.98 3hhs s PRO 287 N -2.65 1.96 -0.20 0.56 0.04 -1.26 -4.58 135.00 128.87 3hhs s PRO 287 Ca 0.61 -0.09 0.01 0.00 0.04 0.00 0.00 61.00 61.57 3hhs s PRO 287 Cb -0.24 -2.04 0.03 0.00 0.04 0.00 0.00 34.50 32.30 3hhs s PRO 287 CO 0.29 -1.51 -0.17 0.50 0.04 0.00 0.00 177.00 176.15 3hhs s ARG 288 N -5.46 2.70 0.55 4.56 3.52 -0.17 -4.90 118.95 119.74 3hhs s ARG 288 Ca 0.62 -0.96 -0.19 0.00 -0.13 0.00 0.00 55.73 55.08 3hhs s ARG 288 Cb -0.10 -2.62 -0.05 0.00 -1.56 0.00 0.00 34.95 30.61 3hhs s ARG 288 CO 0.47 -0.32 1.11 -0.06 -0.81 0.00 0.00 175.30 175.70 3hhs s PHE 289 N 1.26 2.72 0.31 5.12 0.08 -1.26 -1.03 117.98 125.17 3hhs s PHE 289 Ca 0.01 1.55 -0.29 0.00 0.12 0.00 0.00 56.93 58.31 3hhs s PHE 289 Cb -0.15 -3.24 -0.12 0.00 -0.57 0.00 0.00 43.02 38.94 3hhs s PHE 289 CO -0.10 -1.47 1.40 0.00 -0.10 0.00 0.00 175.22 174.94 3hhs n ALA 290 N -1.41 1.60 -0.70 5.36 0.00 -1.26 -2.75 120.51 121.36 3hhs n ALA 290 Ca 0.11 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.93 3hhs n ALA 290 Cb 0.51 -2.32 0.00 0.00 0.00 0.00 0.00 19.45 17.64 3hhs n ALA 290 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hhs n GLY 291 N 1.39 0.70 3.76 0.00 0.00 0.37 -4.91 105.19 106.49 3hhs n GLY 291 Ca 0.07 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.76 3hhs n GLY 291 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3hhs s SER 292 N -2.23 4.81 0.16 1.61 0.01 -1.11 -4.45 113.70 112.49 3hhs s SER 292 Ca 0.00 2.06 0.09 0.00 1.31 0.00 0.00 55.95 59.41 3hhs s SER 292 Cb 0.00 -2.56 -0.04 0.00 0.21 0.00 0.00 66.02 63.63 3hhs s SER 292 CO 0.00 -1.84 -0.20 0.68 0.41 0.00 0.00 173.24 172.29 3hhs s VAL 293 N -2.33 1.94 0.21 3.43 -7.23 -1.26 0.06 120.40 115.22 3hhs s VAL 293 Ca 0.68 -1.87 -0.32 0.00 -1.81 0.00 0.00 61.98 58.65 3hhs s VAL 293 Cb -0.22 -1.86 -0.13 0.00 0.56 0.00 0.00 36.38 34.72 3hhs s VAL 293 CO 0.44 -0.21 1.51 0.49 -0.31 0.00 0.00 175.10 177.02 3hhs n PHE 294 N 0.45 2.29 -4.52 2.82 3.01 -1.26 -4.76 117.46 115.48 3hhs n PHE 294 Ca -0.14 0.33 -0.22 0.00 1.01 0.00 0.00 57.45 58.43 3hhs n PHE 294 Cb 0.56 -2.51 -0.14 0.00 -0.01 0.00 0.00 39.48 37.38 3hhs n PHE 294 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 3hhs s ARG 295 N 0.21 1.14 0.11 -1.08 0.52 -1.26 -4.99 118.95 113.60 3hhs s ARG 295 Ca 0.73 -0.77 -0.35 0.00 -0.52 0.00 0.00 55.73 54.82 3hhs s ARG 295 Cb -0.65 -1.17 -0.17 0.00 0.52 0.00 0.00 34.95 33.48 3hhs s ARG 295 CO 0.44 0.30 1.13 0.09 0.02 0.00 0.00 175.30 177.27 3hhs n ASN 296 N 2.05 0.85 -4.82 0.23 3.02 -1.26 -4.80 115.26 110.53 3hhs n ASN 296 Ca -0.17 1.14 -0.36 0.00 -0.03 0.00 0.00 54.58 55.15 3hhs n ASN 296 Cb 0.54 -1.11 -0.07 0.00 -0.61 0.00 0.00 39.78 38.53 3hhs n ASN 296 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3hhs s LEU 297 N 0.67 4.34 -0.47 3.41 1.43 0.08 -4.64 118.68 123.49 3hhs s LEU 297 Ca 0.80 0.46 0.06 0.00 -1.03 0.00 0.00 54.13 54.41 3hhs s LEU 297 Cb -0.99 -2.15 0.18 0.00 0.03 0.00 0.00 46.19 43.26 3hhs s LEU 297 CO 0.52 0.31 0.57 -0.62 0.23 0.00 0.00 176.35 177.37 3hhs s ASP 298 N -0.52 -0.35 -0.45 2.29 2.15 -0.14 -1.22 116.67 118.44 3hhs s ASP 298 Ca 0.14 -2.12 0.00 0.00 0.43 0.00 0.00 52.55 51.00 3hhs s ASP 298 Cb -0.12 1.05 0.12 0.00 -0.30 0.00 0.00 42.92 43.67 3hhs s ASP 298 CO 0.03 -0.11 0.21 -0.13 -0.17 0.00 0.00 175.17 175.01 3hhs s ARG 299 N 0.68 1.96 0.21 4.34 0.52 -0.13 -4.25 118.95 122.28 3hhs s ARG 299 Ca 0.29 -2.09 -0.11 0.00 -0.52 0.00 0.00 55.73 53.30 3hhs s ARG 299 Cb 0.00 -3.47 0.27 0.00 0.52 0.00 0.00 34.95 32.27 3hhs s ARG 299 CO -0.10 -1.06 1.68 1.15 0.02 0.00 0.00 175.30 176.99 3hhs h THR 300 N 6.10 0.57 -0.44 0.02 2.02 -1.88 -1.78 112.91 117.52 3hhs h THR 300 Ca -0.08 -0.06 0.05 0.00 0.77 0.00 0.00 66.41 67.10 3hhs h THR 300 Cb 1.00 0.39 -0.02 0.00 -1.74 0.00 0.00 68.15 67.78 3hhs h THR 300 CO 0.65 0.03 0.30 -0.37 0.37 0.00 0.00 175.52 176.50 3hhs h VAL 301 N 0.17 0.98 -0.01 3.16 -1.51 -1.95 -1.07 116.25 116.02 3hhs h VAL 301 Ca 0.30 -0.13 0.00 0.00 -1.23 0.00 0.00 66.70 65.64 3hhs h VAL 301 Cb 0.47 0.56 0.00 0.00 -2.13 0.00 0.00 31.29 30.20 3hhs h VAL 301 CO -0.45 0.07 -0.20 0.47 -1.23 0.00 0.00 177.57 176.22 3hhs n ASP 302 N -4.48 0.96 -4.13 4.19 8.00 -0.73 -4.86 116.55 115.51 3hhs n ASP 302 Ca 0.05 -0.88 -0.31 0.00 0.71 0.00 0.00 54.79 54.36 3hhs n ASP 302 Cb 0.23 0.08 -0.03 0.00 -0.02 0.00 0.00 41.12 41.38 3hhs n ASP 302 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3hhs n GLN 303 N -0.63 -3.00 -4.86 -1.24 6.02 -0.40 -1.89 117.38 111.37 3hhs n GLN 303 Ca 0.13 0.36 -0.32 0.00 -0.01 0.00 0.00 57.00 57.16 3hhs n GLN 303 Cb 0.33 -4.73 -0.17 0.00 1.02 0.00 0.00 30.24 26.70 3hhs n GLN 303 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 3hhs s VAL 304 N -3.66 2.06 -0.24 5.09 0.11 -1.07 -4.64 120.40 118.05 3hhs s VAL 304 Ca 0.38 -0.99 -0.03 0.00 -2.93 0.00 0.00 61.98 58.40 3hhs s VAL 304 Cb -0.20 -1.81 0.13 0.00 -1.53 0.00 0.00 36.38 32.97 3hhs s VAL 304 CO 0.92 0.55 0.37 -0.75 -3.33 0.00 0.00 175.10 172.87 3hhs s LYS 305 N 0.65 0.34 -0.28 1.54 2.20 -1.26 -0.96 119.74 121.97 3hhs s LYS 305 Ca -0.11 0.56 -0.22 0.00 -0.36 0.00 0.00 55.97 55.84 3hhs s LYS 305 Cb -0.16 -0.45 0.12 0.00 -1.51 0.00 0.00 37.83 35.83 3hhs s LYS 305 CO 0.02 -0.61 0.98 -1.50 -0.36 0.00 0.00 175.35 173.87 3hhs s ILE 306 N 2.54 0.00 0.27 5.43 2.07 -0.36 -4.99 121.20 126.16 3hhs s ILE 306 Ca 0.12 0.00 -0.09 0.00 -1.41 0.00 0.00 60.65 59.27 3hhs s ILE 306 Cb -0.15 -1.00 -0.07 0.00 0.13 0.00 0.00 42.46 41.37 3hhs s ILE 306 CO -0.15 0.00 0.58 -1.81 -1.91 0.00 0.00 174.94 171.65 3hhs s ASP 307 N 0.65 6.57 0.33 4.50 1.01 -1.26 -0.74 116.67 127.73 3hhs s ASP 307 Ca -0.01 0.90 0.10 0.00 0.71 0.00 0.00 52.55 54.24 3hhs s ASP 307 Cb -0.05 -2.22 0.85 0.00 1.01 0.00 0.00 42.92 42.52 3hhs s ASP 307 CO -0.09 -0.14 1.78 0.58 0.21 0.00 0.00 175.17 177.50 3hhs h VAL 308 N 1.74 0.65 -0.87 -1.27 2.07 -1.94 -1.03 116.25 115.59 3hhs h VAL 308 Ca -0.47 -0.22 0.23 0.00 0.82 0.00 0.00 66.70 67.05 3hhs h VAL 308 Cb 1.18 -0.05 -0.13 0.00 -1.52 0.00 0.00 31.29 30.76 3hhs h VAL 308 CO 0.68 0.12 0.29 -0.09 0.02 0.00 0.00 177.57 178.59 3hhs h ARG 309 N 0.65 0.27 -0.99 1.57 2.43 -1.99 -1.11 114.38 115.20 3hhs h ARG 309 Ca 0.58 -0.02 0.24 0.00 -0.81 0.00 0.00 59.98 59.97 3hhs h ARG 309 Cb 1.07 -0.06 -0.08 0.00 -0.42 0.00 0.00 29.97 30.47 3hhs h ARG 309 CO -0.36 0.18 0.64 -0.22 -1.51 0.00 0.00 179.97 178.70 3hhs h LYS 310 N 0.28 0.42 -0.57 0.20 1.63 -1.58 -1.87 116.57 115.08 3hhs h LYS 310 Ca 0.55 -0.03 -0.08 0.00 -0.85 0.00 0.00 60.65 60.24 3hhs h LYS 310 Cb 1.08 -0.10 -0.02 0.00 -0.60 0.00 0.00 32.23 32.59 3hhs h LYS 310 CO -0.60 0.28 0.04 -0.07 -3.45 0.00 0.00 179.45 175.65 3hhs h LEU 311 N 0.43 0.94 -0.55 5.20 3.38 -1.33 -0.29 115.31 123.10 3hhs h LEU 311 Ca 0.55 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 58.24 3hhs h LEU 311 Cb 1.34 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.81 3hhs h LEU 311 CO -0.26 0.99 0.35 -0.26 0.09 0.00 0.00 178.44 179.35 3hhs h PHE 312 N 0.86 0.70 -0.04 1.13 0.04 -1.40 0.17 116.94 118.39 3hhs h PHE 312 Ca 0.17 0.01 0.02 0.00 2.80 0.00 0.00 57.97 60.96 3hhs h PHE 312 Cb 0.48 -0.24 -0.02 0.00 2.20 0.00 0.00 35.95 38.38 3hhs h PHE 312 CO 0.04 0.46 -0.07 1.15 -0.60 0.00 0.00 178.31 179.29 3hhs h THR 313 N 0.74 0.80 -0.75 -1.55 2.02 -0.95 -0.73 112.91 112.49 3hhs h THR 313 Ca 0.20 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.34 3hhs h THR 313 Cb -0.06 0.80 -0.03 0.00 -1.74 0.00 0.00 68.15 67.12 3hhs h THR 313 CO -0.04 0.00 0.31 -0.50 0.37 0.00 0.00 175.52 175.66 3hhs h TRP 314 N -0.11 1.13 -0.04 3.16 6.55 -0.88 -1.71 115.95 124.05 3hhs h TRP 314 Ca 0.04 -0.08 0.01 0.00 0.95 0.00 0.00 58.89 59.81 3hhs h TRP 314 Cb 0.17 -0.34 -0.01 0.00 -0.86 0.00 0.00 29.16 28.12 3hhs h TRP 314 CO -0.16 0.86 -0.01 -0.09 -1.05 0.00 0.00 178.44 177.98 3hhs h ARG 315 N 1.07 -0.01 -0.95 0.49 2.43 -0.73 -2.36 114.38 114.33 3hhs h ARG 315 Ca 0.25 0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.44 3hhs h ARG 315 Cb 0.20 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 29.70 3hhs h ARG 315 CO -0.02 -0.00 0.63 -0.44 -1.51 0.00 0.00 179.97 178.62 3hhs h ASP 316 N -0.01 1.07 -0.92 -3.80 5.19 -0.92 -1.87 116.42 115.16 3hhs h ASP 316 Ca 0.02 -0.02 0.02 0.00 -0.62 0.00 0.00 57.03 56.43 3hhs h ASP 316 Cb 0.04 -0.26 -0.05 0.00 0.18 0.00 0.00 39.33 39.24 3hhs h ASP 316 CO -0.04 0.75 0.60 1.56 -3.12 0.00 0.00 179.24 179.00 3hhs h GLN 317 N 1.25 1.17 -0.22 3.56 4.20 -1.12 -1.09 115.11 122.85 3hhs h GLN 317 Ca 0.36 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 59.00 3hhs h GLN 317 Cb -0.09 -0.26 -0.01 0.00 0.30 0.00 0.00 27.48 27.42 3hhs h GLN 317 CO -0.09 0.77 0.12 0.74 -0.67 0.00 0.00 178.83 179.69 3hhs h PHE 318 N 1.20 0.31 -0.49 2.96 0.04 -0.83 -1.24 116.94 118.89 3hhs h PHE 318 Ca 0.35 -0.01 -0.03 0.00 2.80 0.00 0.00 57.97 61.08 3hhs h PHE 318 Cb -0.06 -0.10 -0.02 0.00 2.20 0.00 0.00 35.95 37.96 3hhs h PHE 318 CO -0.01 0.28 0.16 -0.07 -0.60 0.00 0.00 178.31 178.07 3hhs h LEU 319 N 0.24 0.65 -0.25 1.54 3.38 -1.07 -0.42 115.31 119.38 3hhs h LEU 319 Ca 0.08 -0.09 -0.07 0.00 0.09 0.00 0.00 57.88 57.89 3hhs h LEU 319 Cb 0.08 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 3hhs h LEU 319 CO -0.01 0.62 -0.11 -0.08 0.09 0.00 0.00 178.44 178.95 3hhs h GLU 320 N 0.70 0.51 -0.87 1.13 4.81 -1.12 -0.70 114.58 119.04 3hhs h GLU 320 Ca 0.16 -0.22 0.02 0.00 -0.13 0.00 0.00 59.36 59.20 3hhs h GLU 320 Cb 0.20 -0.02 -0.05 0.00 0.63 0.00 0.00 28.75 29.51 3hhs h GLU 320 CO -0.01 0.76 0.57 0.00 -0.73 0.00 0.00 179.01 179.60 3hhs h ALA 321 N 0.73 1.12 -0.38 2.92 0.00 -0.89 -1.15 119.26 121.61 3hhs h ALA 321 Ca 0.06 -0.05 -0.16 0.00 0.00 0.00 0.00 54.91 54.75 3hhs h ALA 321 Cb 0.60 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 3hhs h ALA 321 CO 0.03 0.47 -0.39 0.82 0.00 0.00 0.00 179.25 180.18 3hhs h ILE 322 N 1.15 1.27 -0.99 0.00 2.04 -1.04 0.27 117.51 120.20 3hhs h ILE 322 Ca 0.33 -1.56 0.08 0.00 1.00 0.00 0.00 64.86 64.71 3hhs h ILE 322 Cb -0.08 1.39 -0.07 0.00 -0.74 0.00 0.00 36.82 37.32 3hhs h ILE 322 CO -0.09 0.52 0.64 -0.61 0.00 0.00 0.00 178.15 178.61 3hhs h GLN 323 N 0.76 1.08 0.00 2.37 -0.00 -0.83 -2.52 115.11 115.97 3hhs h GLN 323 Ca 0.06 -0.07 0.00 0.00 -0.00 0.00 0.00 58.65 58.64 3hhs h GLN 323 Cb 0.99 -0.24 0.00 0.00 0.00 0.00 0.00 27.48 28.22 3hhs h GLN 323 CO 0.10 0.72 -0.56 1.63 0.00 0.00 0.00 178.83 180.72 3hhs n LYS 324 N -4.54 0.06 -3.84 1.69 5.02 -0.46 -4.94 118.16 111.14 3hhs n LYS 324 Ca 0.16 0.01 -0.27 0.00 -2.02 0.00 0.00 58.31 56.19 3hhs n LYS 324 Cb 0.23 -1.53 0.03 0.00 -0.02 0.00 0.00 35.03 33.73 3hhs n LYS 324 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 3hhs n MET 325 N -1.62 -5.44 -3.62 1.97 2.81 0.85 -4.95 117.12 107.12 3hhs n MET 325 Ca 0.05 0.61 -0.11 0.00 -1.81 0.00 0.00 57.70 56.44 3hhs n MET 325 Cb 0.36 -5.41 -0.07 0.00 -0.71 0.00 0.00 33.22 27.39 3hhs n MET 325 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3hhs s ALA 326 N -3.42 -1.90 0.01 3.04 0.00 -0.57 -0.57 121.76 118.36 3hhs s ALA 326 Ca 0.47 1.85 0.04 0.00 0.00 0.00 0.00 51.96 54.32 3hhs s ALA 326 Cb -0.23 -1.20 -0.03 0.00 0.00 0.00 0.00 23.12 21.66 3hhs s ALA 326 CO 0.82 -0.28 -0.08 0.96 0.00 0.00 0.00 175.76 177.18 3hhs s ILE 327 N 0.04 3.56 0.25 0.00 -4.36 0.12 -4.42 121.20 116.39 3hhs s ILE 327 Ca 0.01 -0.82 -0.30 0.00 -0.26 0.00 0.00 60.65 59.28 3hhs s ILE 327 Cb -0.04 -2.54 -0.10 0.00 1.25 0.00 0.00 42.46 41.03 3hhs s ILE 327 CO -0.02 0.39 1.38 -0.54 0.24 0.00 0.00 174.94 176.38 3hhs s LYS 328 N -1.42 4.32 0.21 0.37 1.02 -1.26 -1.20 119.74 121.77 3hhs s LYS 328 Ca 0.17 2.21 0.06 0.00 0.02 0.00 0.00 55.97 58.44 3hhs s LYS 328 Cb -0.11 -3.12 -0.04 0.00 -0.52 0.00 0.00 37.83 34.04 3hhs s LYS 328 CO 0.07 -0.32 0.13 -1.64 -0.92 0.00 0.00 175.35 172.68 3hhs s MET 329 N -0.61 2.81 0.59 1.68 -1.94 0.40 -4.82 119.30 117.42 3hhs s MET 329 Ca 0.56 -1.01 0.29 0.00 -1.71 0.00 0.00 55.69 53.83 3hhs s MET 329 Cb -0.40 -2.55 1.56 0.00 2.01 0.00 0.00 34.83 35.46 3hhs s MET 329 CO 0.44 0.44 1.98 -1.35 -0.01 0.00 0.00 175.02 176.52 3hhs h PRO 330 N 2.05 0.00 -0.20 2.03 0.11 -1.86 -1.35 132.00 132.78 3hhs h PRO 330 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3hhs h PRO 330 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3hhs h PRO 330 CO 0.61 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.67 3hhs n ASN 331 N -3.70 1.31 0.00 -2.05 0.23 -1.26 -4.87 115.26 104.91 3hhs n ASN 331 Ca 0.05 -1.83 0.00 0.00 -0.53 0.00 0.00 54.58 52.27 3hhs n ASN 331 Cb 0.51 -0.13 0.00 0.00 -2.08 0.00 0.00 39.78 38.08 3hhs n ASN 331 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3hhs n GLY 332 N 0.97 0.54 3.76 4.83 0.00 -0.51 -5.05 105.19 109.72 3hhs n GLY 332 Ca 0.12 -0.09 -0.28 0.00 0.00 0.00 0.00 46.02 45.77 3hhs n GLY 332 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hhs n ARG 333 N -2.91 0.70 -5.07 1.61 1.74 -1.26 -4.92 116.66 106.56 3hhs n ARG 333 Ca 0.00 -3.52 -0.30 0.00 -0.77 0.00 0.00 57.85 53.25 3hhs n ARG 333 Cb 0.00 0.56 -0.15 0.00 -1.02 0.00 0.00 32.46 31.85 3hhs n ARG 333 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 3hhs s GLU 334 N -4.13 1.90 -0.23 5.56 2.02 -1.26 -0.45 118.70 122.12 3hhs s GLU 334 Ca 0.22 -1.01 -0.05 0.00 0.02 0.00 0.00 54.97 54.15 3hhs s GLU 334 Cb -0.02 -1.97 -0.01 0.00 0.10 0.00 0.00 34.13 32.23 3hhs s GLU 334 CO 0.14 0.52 -0.01 -1.17 0.02 0.00 0.00 175.26 174.76 3hhs s LEU 335 N -0.94 3.05 0.51 1.80 2.96 -0.34 -4.94 118.68 120.78 3hhs s LEU 335 Ca 0.11 -0.34 -0.22 0.00 -0.22 0.00 0.00 54.13 53.46 3hhs s LEU 335 Cb -0.10 -1.79 -0.07 0.00 0.50 0.00 0.00 46.19 44.73 3hhs s LEU 335 CO 0.01 -0.02 1.10 -2.65 -1.32 0.00 0.00 176.35 173.47 3hhs n PRO 336 N 4.81 1.36 -2.93 0.98 -0.02 -1.26 -0.70 135.00 137.24 3hhs n PRO 336 Ca -0.18 0.50 -0.44 0.00 -2.02 0.00 0.00 63.50 61.37 3hhs n PRO 336 Cb 0.51 -2.25 -0.04 0.00 -0.02 0.00 0.00 33.50 31.71 3hhs n PRO 336 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3hhs s LEU 337 N -1.78 4.79 0.47 2.45 1.43 0.27 -4.80 118.68 121.51 3hhs s LEU 337 Ca 0.69 -1.37 -0.04 0.00 -1.03 0.00 0.00 54.13 52.37 3hhs s LEU 337 Cb -0.47 -2.39 -0.03 0.00 0.03 0.00 0.00 46.19 43.33 3hhs s LEU 337 CO 0.52 -1.27 0.76 1.51 0.23 0.00 0.00 176.35 178.10 3hhs s ASP 338 N 3.64 6.23 0.27 2.29 -4.77 -1.26 -4.76 116.67 118.32 3hhs s ASP 338 Ca 0.23 0.85 0.01 0.00 -3.30 0.00 0.00 52.55 50.34 3hhs s ASP 338 Cb -0.15 -2.19 0.60 0.00 -1.09 0.00 0.00 42.92 40.09 3hhs s ASP 338 CO 0.04 -0.57 1.75 -0.08 0.70 0.00 0.00 175.17 177.01 3hhs h GLU 339 N 0.27 0.57 0.08 2.11 4.81 -1.99 0.41 114.58 120.84 3hhs h GLU 339 Ca -0.47 -0.03 -0.16 0.00 -0.13 0.00 0.00 59.36 58.57 3hhs h GLU 339 Cb 1.21 -0.13 0.01 0.00 0.63 0.00 0.00 28.75 30.47 3hhs h GLU 339 CO 0.61 0.38 -0.75 0.28 -0.73 0.00 0.00 179.01 178.80 3hhs h VAL 340 N 0.59 1.44 -0.01 0.32 2.07 -2.03 -3.40 116.25 115.24 3hhs h VAL 340 Ca 0.50 -2.42 0.00 0.00 0.82 0.00 0.00 66.70 65.59 3hhs h VAL 340 Cb 0.78 3.07 0.00 0.00 -1.52 0.00 0.00 31.29 33.61 3hhs h VAL 340 CO -0.40 0.65 -0.38 0.35 0.02 0.00 0.00 177.57 177.81 3hhs n THR 341 N -4.25 0.00 -0.23 2.57 -2.24 -1.17 -4.67 114.28 104.29 3hhs n THR 341 Ca -0.17 -0.31 -0.00 0.00 -2.27 0.00 0.00 64.05 61.30 3hhs n THR 341 Cb 0.73 1.14 0.07 0.00 -2.10 0.00 0.00 70.33 70.17 3hhs n THR 341 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 3hhs h GLY 342 N 3.24 0.41 1.64 3.38 0.00 -0.40 -1.46 103.07 109.88 3hhs h GLY 342 Ca 0.00 0.26 -0.10 0.00 0.00 0.00 0.00 47.33 47.49 3hhs h GLY 342 CO 0.00 -0.26 -0.31 1.19 0.00 0.00 0.00 176.54 177.16 3hhs h ILE 343 N -0.03 1.28 -0.09 2.60 6.09 -1.83 -0.40 117.51 125.13 3hhs h ILE 343 Ca 0.32 -1.36 -0.01 0.00 -1.37 0.00 0.00 64.86 62.44 3hhs h ILE 343 Cb 0.52 1.47 -0.00 0.00 0.47 0.00 0.00 36.82 39.27 3hhs h ILE 343 CO -0.71 0.42 0.02 -0.78 -3.07 0.00 0.00 178.15 174.04 3hhs h ASP 344 N 0.36 0.13 -0.29 2.19 3.58 -1.68 -0.41 116.42 120.30 3hhs h ASP 344 Ca 0.05 -0.23 0.06 0.00 0.42 0.00 0.00 57.03 57.33 3hhs h ASP 344 Cb 0.73 -0.04 -0.06 0.00 1.72 0.00 0.00 39.33 41.69 3hhs h ASP 344 CO 0.06 0.33 -0.10 0.24 -2.88 0.00 0.00 179.24 176.89 3hhs h MET 345 N -0.06 -0.03 -0.70 0.28 2.86 -1.04 -2.15 114.93 114.08 3hhs h MET 345 Ca 0.03 0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.68 3hhs h MET 345 Cb 0.24 0.01 -0.04 0.00 0.06 0.00 0.00 31.60 31.87 3hhs h MET 345 CO 0.00 -0.02 0.46 -0.07 1.06 0.00 0.00 176.91 178.34 3hhs h LEU 346 N -0.04 0.78 -0.68 1.22 3.38 -0.97 0.05 115.31 119.05 3hhs h LEU 346 Ca 0.15 -0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.17 3hhs h LEU 346 Cb 0.26 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 40.76 3hhs h LEU 346 CO -0.32 0.56 0.36 1.23 0.09 0.00 0.00 178.44 180.36 3hhs h GLY 347 N 0.92 1.00 1.55 0.83 0.00 -0.76 -0.17 103.07 106.45 3hhs h GLY 347 Ca 0.27 -0.24 -0.21 0.00 0.00 0.00 0.00 47.33 47.15 3hhs h GLY 347 CO -0.07 0.12 -0.84 3.43 0.00 0.00 0.00 176.54 179.18 3hhs h ASN 348 N 0.65 0.53 -0.85 0.19 -0.26 -0.82 -1.67 115.58 113.35 3hhs h ASN 348 Ca 0.32 -0.39 0.00 0.00 -0.56 0.00 0.00 56.30 55.67 3hhs h ASN 348 Cb 0.25 -0.16 -0.04 0.00 -1.06 0.00 0.00 38.32 37.31 3hhs h ASN 348 CO -0.21 1.16 0.53 -0.07 -1.06 0.00 0.00 177.43 177.78 3hhs h LEU 349 N 0.27 0.99 0.18 1.61 3.38 -0.79 -2.02 115.31 118.93 3hhs h LEU 349 Ca -0.06 -0.05 -0.29 0.00 0.09 0.00 0.00 57.88 57.57 3hhs h LEU 349 Cb 1.45 -0.25 0.03 0.00 0.09 0.00 0.00 40.66 41.98 3hhs h LEU 349 CO 0.15 0.75 -1.26 -0.03 0.09 0.00 0.00 178.44 178.13 3hhs h MET 350 N 1.15 0.53 -0.49 1.13 4.05 -0.93 -3.40 114.93 116.98 3hhs h MET 350 Ca 0.31 -0.82 0.09 0.00 -0.28 0.00 0.00 59.70 59.00 3hhs h MET 350 Cb -0.09 0.29 -0.08 0.00 -0.80 0.00 0.00 31.60 30.92 3hhs h MET 350 CO -0.06 1.38 0.00 1.49 0.23 0.00 0.00 176.91 179.95 3hhs h GLU 351 N 0.10 0.11 -6.96 0.39 4.81 -1.40 -1.81 114.58 109.83 3hhs h GLU 351 Ca -0.21 -0.01 -0.44 0.00 -0.13 0.00 0.00 59.36 58.57 3hhs h GLU 351 Cb 1.97 -0.03 0.06 0.00 0.63 0.00 0.00 28.75 31.38 3hhs h GLU 351 CO 0.24 0.07 0.04 -1.54 -0.73 0.00 0.00 179.01 177.09 3hhs s SER 352 N -5.25 5.13 0.36 1.04 1.04 -1.26 -0.32 113.70 114.44 3hhs s SER 352 Ca -0.13 0.09 0.07 0.00 0.48 0.00 0.00 55.95 56.46 3hhs s SER 352 Cb 0.16 -0.90 -0.07 0.00 0.10 0.00 0.00 66.02 65.30 3hhs s SER 352 CO 0.72 -1.28 -0.02 -0.94 0.98 0.00 0.00 173.24 172.70 3hhs s SER 353 N -4.46 3.46 0.60 7.02 1.04 -0.76 -4.88 113.70 115.72 3hhs s SER 353 Ca 0.58 -1.30 0.38 0.00 0.48 0.00 0.00 55.95 56.10 3hhs s SER 353 Cb -0.10 -0.31 1.87 0.00 0.10 0.00 0.00 66.02 67.58 3hhs s SER 353 CO 0.40 -0.39 2.18 -0.29 0.98 0.00 0.00 173.24 176.12 3hhs h ILE 354 N 1.96 0.07 -0.45 -1.02 6.09 -1.52 -0.15 117.51 122.49 3hhs h ILE 354 Ca -0.42 -0.28 0.00 0.00 -1.37 0.00 0.00 64.86 62.79 3hhs h ILE 354 Cb 1.24 1.26 0.00 0.00 0.47 0.00 0.00 36.82 39.79 3hhs h ILE 354 CO 0.74 0.01 0.00 2.30 -3.07 0.00 0.00 178.15 178.14 3hhs n ILE 355 N -3.15 0.60 -1.61 2.19 -5.35 -1.26 -4.90 119.36 105.87 3hhs n ILE 355 Ca -0.01 -0.61 -0.51 0.00 -0.27 0.00 0.00 62.75 61.34 3hhs n ILE 355 Cb 0.19 0.33 -0.06 0.00 -1.74 0.00 0.00 39.64 38.36 3hhs n ILE 355 CO 0.00 0.00 0.00 -0.24 -1.76 0.00 0.00 176.55 174.55 3hhs n SER 356 N 0.85 1.89 -0.14 7.28 2.88 -0.07 -4.89 113.62 121.42 3hhs n SER 356 Ca 0.16 1.11 0.20 0.00 -1.33 0.00 0.00 58.87 59.01 3hhs n SER 356 Cb 0.39 -1.22 0.60 0.00 -0.75 0.00 0.00 64.21 63.23 3hhs n SER 356 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 3hhs h PRO 357 N 4.90 0.22 -1.00 -1.46 0.11 -1.89 -3.35 132.00 129.53 3hhs h PRO 357 Ca -0.47 -0.01 -0.25 0.00 0.11 0.00 0.00 66.00 65.37 3hhs h PRO 357 Cb 1.32 -0.05 -0.20 0.00 0.11 0.00 0.00 31.00 32.18 3hhs h PRO 357 CO 0.80 0.14 -0.60 -1.71 -0.21 0.00 0.00 178.00 176.43 3hhs n ASN 358 N -4.42 -2.70 -0.03 -2.05 5.15 -1.26 -4.79 115.26 105.16 3hhs n ASN 358 Ca 0.15 -2.93 -0.07 0.00 -0.60 0.00 0.00 54.58 51.13 3hhs n ASN 358 Cb 0.67 1.31 0.11 0.00 -0.53 0.00 0.00 39.78 41.34 3hhs n ASN 358 CO 0.00 0.00 0.00 -0.09 1.40 0.00 0.00 177.26 178.57 3hhs h ARG 359 N 4.78 0.63 -0.44 1.20 2.43 -1.89 -2.10 114.38 118.98 3hhs h ARG 359 Ca 0.04 -0.29 0.09 0.00 -0.81 0.00 0.00 59.98 59.01 3hhs h ARG 359 Cb 1.05 -0.01 -0.08 0.00 -0.42 0.00 0.00 29.97 30.51 3hhs h ARG 359 CO 0.17 0.88 -0.07 0.78 -1.51 0.00 0.00 179.97 180.21 3hhs h GLY 360 N 1.01 0.36 0.01 2.80 0.00 -1.94 -0.95 103.07 104.36 3hhs h GLY 360 Ca 0.06 0.12 -0.00 0.00 0.00 0.00 0.00 47.33 47.51 3hhs h GLY 360 CO 0.07 -0.15 -0.00 -1.82 0.00 0.00 0.00 176.54 174.63 3hhs h TYR 361 N 0.03 -0.01 0.00 5.60 3.20 -1.96 -3.38 116.97 120.46 3hhs h TYR 361 Ca 0.22 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.09 3hhs h TYR 361 Cb 0.33 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.60 3hhs h TYR 361 CO -0.35 0.70 0.00 1.88 -1.64 0.00 0.00 178.16 178.74 3hhs h TYR 362 N -0.99 0.00 0.00 -3.82 0.05 -1.40 -3.49 116.97 107.32 3hhs h TYR 362 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 3hhs h TYR 362 Cb 0.71 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.45 3hhs h TYR 362 CO 0.20 0.00 0.00 0.41 -1.05 0.00 0.00 178.16 177.72 3hhs n GLY 363 N 0.70 -0.18 2.61 3.88 0.00 -0.36 -4.55 105.19 107.28 3hhs n GLY 363 Ca 0.03 -1.17 -0.10 0.00 0.00 0.00 0.00 46.02 44.79 3hhs n GLY 363 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3hhs n ASP 364 N 1.48 -0.13 0.33 1.61 2.03 -1.26 -4.56 116.55 116.06 3hhs n ASP 364 Ca 0.00 -2.79 -0.17 0.00 0.52 0.00 0.00 54.79 52.34 3hhs n ASP 364 Cb 0.00 0.22 -0.09 0.00 -0.72 0.00 0.00 41.12 40.53 3hhs n ASP 364 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 3hhs h LEU 365 N 2.69 -0.69 -0.26 -2.67 5.85 -1.78 -1.39 115.31 117.05 3hhs h LEU 365 Ca -0.12 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.60 3hhs h LEU 365 Cb 1.18 0.18 -0.01 0.00 0.37 0.00 0.00 40.66 42.37 3hhs h LEU 365 CO 0.28 -0.46 0.17 -0.74 -0.34 0.00 0.00 178.44 177.34 3hhs h HIS 366 N -0.86 0.34 -0.66 1.25 2.76 -1.29 -2.09 115.15 114.59 3hhs h HIS 366 Ca -0.08 0.00 -0.04 0.00 -2.20 0.00 0.00 60.37 58.05 3hhs h HIS 366 Cb 0.64 -0.11 -0.03 0.00 1.55 0.00 0.00 27.41 29.46 3hhs h HIS 366 CO -0.02 0.24 0.27 -0.91 -1.30 0.00 0.00 177.93 176.20 3hhs h ASN 367 N 0.34 0.91 0.12 3.26 2.35 -0.65 -2.49 115.58 119.43 3hhs h ASN 367 Ca 0.10 -0.17 -0.06 0.00 -0.55 0.00 0.00 56.30 55.61 3hhs h ASN 367 Cb -0.01 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.11 3hhs h ASN 367 CO -0.02 0.83 -0.22 0.24 -1.65 0.00 0.00 177.43 176.61 3hhs h MET 368 N 0.94 0.19 -0.54 0.81 2.86 -1.13 -2.25 114.93 115.80 3hhs h MET 368 Ca 0.22 -0.05 0.08 0.00 -2.06 0.00 0.00 59.70 57.89 3hhs h MET 368 Cb 0.20 -0.02 -0.07 0.00 0.06 0.00 0.00 31.60 31.78 3hhs h MET 368 CO -0.02 0.41 0.16 0.78 1.06 0.00 0.00 176.91 179.30 3hhs h GLY 369 N 0.88 0.71 0.72 8.32 0.00 -0.92 0.38 103.07 113.16 3hhs h GLY 369 Ca 0.03 -0.08 0.05 0.00 0.00 0.00 0.00 47.33 47.33 3hhs h GLY 369 CO 0.03 -0.03 0.33 0.45 0.00 0.00 0.00 176.54 177.32 3hhs h HIS 370 N 0.32 0.62 -0.23 5.60 -0.00 -1.27 -1.59 115.15 118.60 3hhs h HIS 370 Ca 0.27 0.02 -0.06 0.00 -0.00 0.00 0.00 60.37 60.60 3hhs h HIS 370 Cb 0.33 -0.19 -0.01 0.00 -0.00 0.00 0.00 27.41 27.55 3hhs h HIS 370 CO -0.19 0.31 -0.11 0.28 -0.00 0.00 0.00 177.93 178.22 3hhs h VAL 371 N 0.63 1.30 -0.18 2.45 2.07 -0.81 0.75 116.25 122.47 3hhs h VAL 371 Ca 0.27 -1.17 0.04 0.00 0.82 0.00 0.00 66.70 66.65 3hhs h VAL 371 Cb 0.15 1.58 -0.03 0.00 -1.52 0.00 0.00 31.29 31.46 3hhs h VAL 371 CO -0.16 0.36 -0.04 -0.26 0.02 0.00 0.00 177.57 177.49 3hhs h PHE 372 N 0.19 -0.09 -0.57 1.57 0.04 -0.23 -2.48 116.94 115.37 3hhs h PHE 372 Ca 0.05 0.02 -0.06 0.00 2.80 0.00 0.00 57.97 60.77 3hhs h PHE 372 Cb 0.60 0.07 -0.02 0.00 2.20 0.00 0.00 35.95 38.79 3hhs h PHE 372 CO 0.06 -0.07 0.10 0.00 -0.60 0.00 0.00 178.31 177.80 3hhs h ALA 373 N 1.18 1.10 0.00 2.45 0.00 -1.16 -2.85 119.26 119.98 3hhs h ALA 373 Ca 0.09 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 3hhs h ALA 373 Cb 0.13 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 3hhs h ALA 373 CO -0.18 0.59 -0.11 0.00 0.00 0.00 0.00 179.25 179.55 3hhs h ALA 374 N 1.24 1.05 0.00 0.00 0.00 -0.49 -3.29 119.26 117.77 3hhs h ALA 374 Ca 0.18 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 3hhs h ALA 374 Cb 0.37 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 3hhs h ALA 374 CO 0.01 0.13 -0.12 0.66 0.00 0.00 0.00 179.25 179.93 3hhs n TYR 375 N -3.29 0.00 0.08 0.00 0.53 -0.97 -1.12 117.16 112.40 3hhs n TYR 375 Ca -0.00 -1.04 0.14 0.00 -1.02 0.00 0.00 57.90 55.99 3hhs n TYR 375 Cb 0.33 -0.16 0.64 0.00 -1.03 0.00 0.00 39.34 39.12 3hhs n TYR 375 CO 0.00 0.00 0.00 1.79 -1.02 0.00 0.00 176.86 177.63 3hhs h THR 376 N 0.57 0.86 0.00 -0.72 1.35 -1.59 -1.29 112.91 112.10 3hhs h THR 376 Ca -0.00 -0.02 -0.04 0.00 -0.55 0.00 0.00 66.41 65.79 3hhs h THR 376 Cb 1.03 0.79 -0.01 0.00 -1.73 0.00 0.00 68.15 68.23 3hhs h THR 376 CO 0.00 0.01 -0.20 1.12 -0.25 0.00 0.00 175.52 176.21 3hhs h HIS 377 N 0.07 0.00 -1.01 4.73 2.07 -1.89 -3.40 115.15 115.72 3hhs h HIS 377 Ca 0.16 0.00 -0.37 0.00 -2.85 0.00 0.00 60.37 57.32 3hhs h HIS 377 Cb 0.56 0.00 -0.27 0.00 2.57 0.00 0.00 27.41 30.27 3hhs h HIS 377 CO -0.00 0.20 -0.82 -3.47 -3.07 0.00 0.00 177.93 170.77 3hhs n ASP 378 N -3.16 -0.87 0.25 3.10 2.03 -0.54 -4.97 116.55 112.39 3hhs n ASP 378 Ca 0.03 -3.29 0.17 0.00 0.52 0.00 0.00 54.79 52.23 3hhs n ASP 378 Cb 0.59 0.64 0.81 0.00 -0.72 0.00 0.00 41.12 42.44 3hhs n ASP 378 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 3hhs h PRO 379 N 3.20 0.00 0.00 -0.67 0.13 -1.63 -2.91 132.00 130.13 3hhs h PRO 379 Ca -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.12 3hhs h PRO 379 Cb 1.02 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.15 3hhs h PRO 379 CO 0.33 0.00 -0.03 -0.40 -0.23 0.00 0.00 178.00 177.67 3hhs n ASP 380 N -2.82 1.85 0.00 1.44 5.68 -1.26 -0.97 116.55 120.48 3hhs n ASP 380 Ca -0.01 -2.35 0.00 0.00 -0.50 0.00 0.00 54.79 51.93 3hhs n ASP 380 Cb 0.18 -0.18 0.00 0.00 -1.14 0.00 0.00 41.12 39.98 3hhs n ASP 380 CO 0.00 0.00 0.00 1.57 -1.33 0.00 0.00 177.20 177.44 3hhs n HIS 381 N -0.80 0.00 0.26 2.11 -0.00 -1.10 -4.67 115.22 111.02 3hhs n HIS 381 Ca 0.06 0.00 0.09 0.00 -0.00 0.00 0.00 57.72 57.88 3hhs n HIS 381 Cb 0.45 -1.13 0.68 0.00 -0.00 0.00 0.00 29.99 30.00 3hhs n HIS 381 CO 0.00 0.00 0.00 0.07 -0.00 0.00 0.00 176.34 176.41 3hhs h ARG 382 N 0.48 0.00 -0.11 1.57 0.11 -1.94 -1.54 114.38 112.95 3hhs h ARG 382 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3hhs h ARG 382 Cb 0.54 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.62 3hhs h ARG 382 CO 0.00 0.00 0.00 0.72 0.10 0.00 0.00 179.97 180.79 3hhs n HIS 383 N -4.43 0.12 -3.63 4.08 8.25 -1.26 -4.97 115.22 113.38 3hhs n HIS 383 Ca -0.03 -0.06 -0.27 0.00 -0.26 0.00 0.00 57.72 57.10 3hhs n HIS 383 Cb 0.10 0.00 0.02 0.00 1.12 0.00 0.00 29.99 31.23 3hhs n HIS 383 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3hhs n LEU 384 N 0.84 -2.40 -4.91 2.41 4.77 -0.58 -4.97 117.00 112.16 3hhs n LEU 384 Ca 0.17 -0.59 -0.30 0.00 -0.03 0.00 0.00 56.01 55.25 3hhs n LEU 384 Cb 0.48 -2.56 -0.04 0.00 -2.33 0.00 0.00 43.42 38.97 3hhs n LEU 384 CO 0.15 0.37 0.03 -1.61 -1.33 0.00 0.00 177.39 175.00 3hhs s GLU 385 N -6.32 3.58 0.81 3.23 0.41 -1.26 -5.12 118.70 114.03 3hhs s GLU 385 Ca 0.55 -0.18 -0.05 0.00 -0.41 0.00 0.00 54.97 54.88 3hhs s GLU 385 Cb -0.27 -2.84 0.17 0.00 -1.78 0.00 0.00 34.13 29.40 3hhs s GLU 385 CO 0.67 0.44 1.11 1.14 -0.49 0.00 0.00 175.26 178.14 3hhs s GLN 386 N -2.90 1.21 0.59 1.61 -2.07 -1.26 -4.97 119.66 111.86 3hhs s GLN 386 Ca 0.40 -1.05 -0.14 0.00 -1.82 0.00 0.00 55.36 52.75 3hhs s GLN 386 Cb -0.12 -2.19 -0.05 0.00 -1.09 0.00 0.00 33.01 29.57 3hhs s GLN 386 CO 0.26 -1.85 1.02 -0.59 -1.32 0.00 0.00 175.29 172.82 3hhs s PHE 387 N -3.40 3.41 0.95 9.60 -0.71 -1.26 -4.79 117.98 121.79 3hhs s PHE 387 Ca 0.70 1.40 -0.16 0.00 -1.04 0.00 0.00 56.93 57.84 3hhs s PHE 387 Cb -0.04 -2.81 0.23 0.00 -1.21 0.00 0.00 43.02 39.20 3hhs s PHE 387 CO 0.48 -0.69 0.98 0.41 -1.34 0.00 0.00 175.22 175.05 3hhs n GLY 388 N -1.98 -2.27 0.23 1.99 0.00 -0.27 -4.44 105.19 98.44 3hhs n GLY 388 Ca 0.07 -1.56 0.06 0.00 0.00 0.00 0.00 46.02 44.58 3hhs n GLY 388 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3hhs h VAL 389 N -2.22 1.09 0.00 1.61 -1.51 -1.90 -0.18 116.25 113.14 3hhs h VAL 389 Ca -0.35 -0.57 0.00 0.00 -1.23 0.00 0.00 66.70 64.55 3hhs h VAL 389 Cb 1.02 1.31 0.00 0.00 -2.13 0.00 0.00 31.29 31.50 3hhs h VAL 389 CO 0.23 0.16 0.18 0.24 -1.23 0.00 0.00 177.57 177.15 3hhs h MET 390 N 0.00 0.00 0.00 5.19 2.86 -1.83 -2.57 114.93 118.58 3hhs h MET 390 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3hhs h MET 390 Cb 0.30 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.96 3hhs h MET 390 CO 0.02 0.00 -0.07 0.41 1.06 0.00 0.00 176.91 178.33 3hhs n GLY 391 N -1.21 -1.49 2.91 8.32 0.00 -0.08 -4.76 105.19 108.88 3hhs n GLY 391 Ca -0.02 -0.12 -0.22 0.00 0.00 0.00 0.00 46.02 45.66 3hhs n GLY 391 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3hhs s ASP 392 N -3.17 1.28 0.60 1.61 -1.08 -0.99 -4.66 116.67 110.26 3hhs s ASP 392 Ca 0.13 -0.17 0.38 0.00 -0.52 0.00 0.00 52.55 52.37 3hhs s ASP 392 Cb 0.18 -0.55 1.89 0.00 -1.46 0.00 0.00 42.92 42.98 3hhs s ASP 392 CO 0.56 -0.06 2.19 0.77 0.52 0.00 0.00 175.17 179.15 3hhs h SER 393 N 7.34 0.00 0.76 -0.34 4.64 -1.86 -0.45 113.55 123.65 3hhs h SER 393 Ca -0.34 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.96 3hhs h SER 393 Cb 1.15 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.24 3hhs h SER 393 CO 0.44 0.02 -0.12 0.00 -0.87 0.00 0.00 176.83 176.30 3hhs h ALA 394 N 1.98 1.08 0.00 5.18 0.00 -1.91 -3.34 119.26 122.24 3hhs h ALA 394 Ca -0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3hhs h ALA 394 Cb 0.24 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3hhs h ALA 394 CO 0.00 0.16 -0.11 0.25 0.00 0.00 0.00 179.25 179.55 3hhs n THR 395 N -3.35 0.00 0.03 0.00 -2.24 -0.66 -4.76 114.28 103.30 3hhs n THR 395 Ca -0.00 -0.39 0.00 0.00 -2.27 0.00 0.00 64.05 61.39 3hhs n THR 395 Cb 0.33 0.93 0.32 0.00 -2.10 0.00 0.00 70.33 69.81 3hhs n THR 395 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hhs h ALA 396 N 0.00 1.40 0.00 6.98 0.00 -0.88 -1.95 119.26 124.81 3hhs h ALA 396 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.71 3hhs h ALA 396 Cb 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.66 3hhs h ALA 396 CO 0.00 0.42 0.00 0.52 0.00 0.00 0.00 179.25 180.19 3hhs h MET 397 N 0.43 0.00 0.00 0.00 2.86 -1.86 -2.13 114.93 114.23 3hhs h MET 397 Ca 0.09 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.70 3hhs h MET 397 Cb 0.35 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.00 3hhs h MET 397 CO 0.01 0.00 -0.18 0.00 1.06 0.00 0.00 176.91 177.81 3hhs h ARG 398 N 0.00 0.00 -5.77 1.72 3.08 -1.30 -3.42 114.38 108.69 3hhs h ARG 398 Ca 0.00 0.00 -0.58 0.00 0.07 0.00 0.00 59.98 59.47 3hhs h ARG 398 Cb 0.16 0.00 -0.08 0.00 0.08 0.00 0.00 29.97 30.13 3hhs h ARG 398 CO 0.00 0.18 0.03 0.34 -1.07 0.00 0.00 179.97 179.45 3hhs s ASP 399 N -6.78 6.76 0.55 7.04 -1.08 -0.80 -4.76 116.67 117.60 3hhs s ASP 399 Ca -0.04 0.91 0.30 0.00 -0.52 0.00 0.00 52.55 53.21 3hhs s ASP 399 Cb 0.15 -2.35 1.47 0.00 -1.46 0.00 0.00 42.92 40.73 3hhs s ASP 399 CO 0.67 -0.16 1.89 -0.65 0.52 0.00 0.00 175.17 177.44 3hhs h PRO 400 N 7.09 0.00 -0.01 4.34 0.11 -1.88 -1.00 132.00 140.66 3hhs h PRO 400 Ca -0.36 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.69 3hhs h PRO 400 Cb 1.17 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 3hhs h PRO 400 CO 0.76 0.00 -0.25 0.35 -0.21 0.00 0.00 178.00 178.66 3hhs h PHE 401 N 0.00 0.02 -0.88 0.65 3.57 -1.92 -2.99 116.94 115.40 3hhs h PHE 401 Ca 0.36 -0.00 0.20 0.00 3.53 0.00 0.00 57.97 62.06 3hhs h PHE 401 Cb 1.54 -0.00 -0.12 0.00 2.79 0.00 0.00 35.95 40.16 3hhs h PHE 401 CO 0.00 0.26 0.39 0.35 -2.23 0.00 0.00 178.31 177.09 3hhs h PHE 402 N 0.01 0.66 0.04 0.41 3.57 -1.41 -1.13 116.94 119.10 3hhs h PHE 402 Ca 0.00 0.04 -0.22 0.00 3.53 0.00 0.00 57.97 61.32 3hhs h PHE 402 Cb 0.45 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 39.02 3hhs h PHE 402 CO 0.00 0.01 -1.00 1.88 -2.23 0.00 0.00 178.31 176.97 3hhs h TYR 403 N 0.45 0.25 -0.42 0.41 0.05 -1.70 -0.02 116.97 115.99 3hhs h TYR 403 Ca 0.53 -0.16 -0.05 0.00 0.05 0.00 0.00 58.73 59.09 3hhs h TYR 403 Cb 0.94 -0.02 -0.02 0.00 1.01 0.00 0.00 36.73 38.65 3hhs h TYR 403 CO -0.13 1.05 0.05 0.00 -1.05 0.00 0.00 178.16 178.08 3hhs h ARG 404 N 0.06 0.70 0.15 4.88 3.08 -1.42 0.14 114.38 121.98 3hhs h ARG 404 Ca -0.06 -0.20 -0.01 0.00 0.07 0.00 0.00 59.98 59.79 3hhs h ARG 404 Cb 1.69 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 31.67 3hhs h ARG 404 CO 0.15 0.76 -0.07 2.35 -1.07 0.00 0.00 179.97 182.09 3hhs h TRP 405 N 0.55 -0.18 0.00 3.04 -0.00 -1.09 -0.29 115.95 117.98 3hhs h TRP 405 Ca 0.12 -0.00 -0.04 0.00 -0.00 0.00 0.00 58.89 58.97 3hhs h TRP 405 Cb 0.41 0.06 -0.01 0.00 -0.00 0.00 0.00 29.16 29.63 3hhs h TRP 405 CO 0.03 0.00 -0.17 0.45 -0.00 0.00 0.00 178.44 178.75 3hhs h HIS 406 N -0.34 0.00 -0.26 2.65 3.86 -1.00 0.00 115.15 120.06 3hhs h HIS 406 Ca -0.02 0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 59.05 3hhs h HIS 406 Cb 0.27 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.73 3hhs h HIS 406 CO -0.02 0.17 -0.43 -0.09 0.86 0.00 0.00 177.93 178.42 3hhs h ARG 407 N 0.00 0.63 0.33 2.45 9.65 -0.67 0.57 114.38 127.34 3hhs h ARG 407 Ca -0.00 -0.34 -0.02 0.00 -1.10 0.00 0.00 59.98 58.53 3hhs h ARG 407 Cb 0.42 0.01 0.00 0.00 -1.39 0.00 0.00 29.97 29.01 3hhs h ARG 407 CO 0.02 0.94 -0.16 0.35 2.80 0.00 0.00 179.97 183.93 3hhs h PHE 408 N 0.51 -0.41 -0.66 2.20 3.57 -0.89 -0.20 116.94 121.07 3hhs h PHE 408 Ca 0.04 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.59 3hhs h PHE 408 Cb 0.96 0.13 -0.05 0.00 2.79 0.00 0.00 35.95 39.77 3hhs h PHE 408 CO 0.04 -0.20 0.36 0.28 -2.23 0.00 0.00 178.31 176.56 3hhs h VAL 409 N -0.52 0.96 -0.29 1.41 2.07 -0.97 -2.23 116.25 116.69 3hhs h VAL 409 Ca -0.04 -0.23 -0.07 0.00 0.82 0.00 0.00 66.70 67.17 3hhs h VAL 409 Cb 0.39 0.24 -0.02 0.00 -1.52 0.00 0.00 31.29 30.38 3hhs h VAL 409 CO 0.07 0.12 -0.14 -0.78 0.02 0.00 0.00 177.57 176.86 3hhs h ASP 410 N 0.67 0.48 -0.91 0.57 3.58 -0.80 -2.20 116.42 117.81 3hhs h ASP 410 Ca 0.29 -0.13 0.02 0.00 0.42 0.00 0.00 57.03 57.64 3hhs h ASP 410 Cb 0.19 -0.13 -0.05 0.00 1.72 0.00 0.00 39.33 41.06 3hhs h ASP 410 CO -0.18 0.65 0.60 0.44 -2.88 0.00 0.00 179.24 177.87 3hhs h ASP 411 N 0.45 1.01 0.12 2.28 3.32 -0.46 0.13 116.42 123.27 3hhs h ASP 411 Ca 0.08 -0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.11 3hhs h ASP 411 Cb 0.52 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.82 3hhs h ASP 411 CO 0.03 0.71 -0.06 0.58 -1.72 0.00 0.00 179.24 178.79 3hhs h VAL 412 N 1.18 1.03 -0.91 -1.35 2.07 -0.93 -1.47 116.25 115.87 3hhs h VAL 412 Ca 0.35 -0.64 0.11 0.00 0.82 0.00 0.00 66.70 67.34 3hhs h VAL 412 Cb -0.06 1.43 -0.07 0.00 -1.52 0.00 0.00 31.29 31.07 3hhs h VAL 412 CO -0.09 0.15 0.59 -0.26 0.02 0.00 0.00 177.57 177.98 3hhs h PHE 413 N -0.46 0.97 0.00 1.57 0.04 -1.29 -2.19 116.94 115.58 3hhs h PHE 413 Ca -0.02 0.03 -0.10 0.00 2.80 0.00 0.00 57.97 60.68 3hhs h PHE 413 Cb 0.37 -0.31 -0.01 0.00 2.20 0.00 0.00 35.95 38.20 3hhs h PHE 413 CO 0.02 0.42 -0.49 -0.97 -0.60 0.00 0.00 178.31 176.69 3hhs h ASN 414 N 0.88 0.00 -0.65 2.17 -0.73 -0.48 -1.33 115.58 115.43 3hhs h ASN 414 Ca 0.43 0.00 0.05 0.00 1.87 0.00 0.00 56.30 58.66 3hhs h ASN 414 Cb 0.47 0.00 -0.05 0.00 0.27 0.00 0.00 38.32 39.01 3hhs h ASN 414 CO -0.20 0.49 0.37 0.40 -0.37 0.00 0.00 177.43 178.12 3hhs h ILE 415 N 0.00 0.99 -0.30 2.57 2.04 -0.61 -0.40 117.51 121.79 3hhs h ILE 415 Ca -0.00 -0.24 -0.03 0.00 1.00 0.00 0.00 64.86 65.59 3hhs h ILE 415 Cb 0.90 0.24 -0.01 0.00 -0.74 0.00 0.00 36.82 37.21 3hhs h ILE 415 CO 0.06 0.13 0.08 0.22 0.00 0.00 0.00 178.15 178.64 3hhs h TYR 416 N 0.69 0.50 -0.96 1.37 3.20 -1.34 -3.11 116.97 117.33 3hhs h TYR 416 Ca 0.29 -0.06 0.02 0.00 3.14 0.00 0.00 58.73 62.12 3hhs h TYR 416 Cb 0.15 -0.14 -0.05 0.00 1.54 0.00 0.00 36.73 38.22 3hhs h TYR 416 CO -0.07 0.53 0.63 0.87 -1.64 0.00 0.00 178.16 178.48 3hhs h LYS 417 N 0.32 1.21 0.00 1.82 1.79 -0.84 -1.15 116.57 119.71 3hhs h LYS 417 Ca 0.09 -0.07 0.00 0.00 -2.18 0.00 0.00 60.65 58.49 3hhs h LYS 417 Cb 0.28 -0.27 0.00 0.00 -1.58 0.00 0.00 32.23 30.66 3hhs h LYS 417 CO 0.00 0.80 0.00 0.39 -1.08 0.00 0.00 179.45 179.56 3hhs n GLU 418 N -4.45 0.44 0.05 3.15 1.02 -0.20 -2.37 120.64 118.28 3hhs n GLU 418 Ca 0.12 0.05 0.12 0.00 -0.02 0.00 0.00 57.16 57.43 3hhs n GLU 418 Cb 0.06 -1.50 0.13 0.00 -0.02 0.00 0.00 31.44 30.11 3hhs n GLU 418 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3hhs n LYS 419 N -1.21 0.30 -2.24 3.49 5.02 -0.44 -4.88 118.16 118.20 3hhs n LYS 419 Ca 0.13 0.06 -0.35 0.00 -2.02 0.00 0.00 58.31 56.13 3hhs n LYS 419 Cb 0.16 -1.66 0.00 0.00 -0.02 0.00 0.00 35.03 33.51 3hhs n LYS 419 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3hhs s LEU 420 N -4.16 3.72 0.09 -0.35 1.43 -1.00 -4.95 118.68 113.46 3hhs s LEU 420 Ca 0.05 2.14 -0.31 0.00 -1.03 0.00 0.00 54.13 54.99 3hhs s LEU 420 Cb 0.14 -4.58 -0.08 0.00 0.03 0.00 0.00 46.19 41.70 3hhs s LEU 420 CO 0.74 -1.22 1.55 -0.89 0.23 0.00 0.00 176.35 176.76 3hhs s THR 421 N -1.84 3.08 0.30 5.49 2.01 -1.26 -4.77 115.64 118.65 3hhs s THR 421 Ca 0.72 0.65 -0.26 0.00 0.31 0.00 0.00 61.69 63.10 3hhs s THR 421 Cb -0.23 -3.41 -0.15 0.00 0.01 0.00 0.00 72.50 68.72 3hhs s THR 421 CO 0.28 0.02 0.65 -2.65 -0.69 0.00 0.00 174.62 172.22 3hhs n PRO 422 N 4.89 0.56 -1.74 4.92 -0.02 -1.26 -4.88 135.00 137.47 3hhs n PRO 422 Ca 0.14 0.20 -0.42 0.00 -2.02 0.00 0.00 63.50 61.40 3hhs n PRO 422 Cb 0.41 -1.39 -0.03 0.00 -0.02 0.00 0.00 33.50 32.47 3hhs n PRO 422 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 3hhs s TYR 423 N -1.19 2.71 0.77 6.00 2.02 -1.26 -4.99 117.35 121.40 3hhs s TYR 423 Ca 0.62 0.26 -0.11 0.00 -0.37 0.00 0.00 57.07 57.47 3hhs s TYR 423 Cb -0.75 -4.13 0.05 0.00 -0.40 0.00 0.00 41.96 36.73 3hhs s TYR 423 CO 0.58 -4.40 1.09 0.95 -1.57 0.00 0.00 175.55 172.21 3hhs s THR 424 N 1.62 3.29 0.31 -0.71 -4.23 -1.26 -4.88 115.64 109.78 3hhs s THR 424 Ca 0.76 0.42 0.01 0.00 -1.18 0.00 0.00 61.69 61.71 3hhs s THR 424 Cb -0.48 -3.19 0.28 0.00 1.34 0.00 0.00 72.50 70.45 3hhs s THR 424 CO 0.33 -0.55 1.93 0.78 -0.54 0.00 0.00 174.62 176.57 3hhs h ASN 425 N -0.98 0.86 -0.37 3.99 2.35 -1.99 -1.74 115.58 117.71 3hhs h ASN 425 Ca -0.46 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.23 3hhs h ASN 425 Cb 1.26 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 39.43 3hhs h ASN 425 CO 0.59 0.56 0.00 -0.08 -1.65 0.00 0.00 177.43 176.85 3hhs h GLU 426 N 0.98 0.66 -0.36 0.81 4.81 -1.92 0.19 114.58 119.75 3hhs h GLU 426 Ca 0.37 -0.21 0.05 0.00 -0.13 0.00 0.00 59.36 59.43 3hhs h GLU 426 Cb 0.18 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.46 3hhs h GLU 426 CO -0.13 0.76 0.11 -0.09 -0.73 0.00 0.00 179.01 178.93 3hhs h ARG 427 N 0.48 0.24 -0.09 1.92 9.65 -1.77 -3.23 114.38 121.58 3hhs h ARG 427 Ca 0.11 -0.01 -0.19 0.00 -1.10 0.00 0.00 59.98 58.78 3hhs h ARG 427 Cb 0.46 -0.05 -0.00 0.00 -1.39 0.00 0.00 29.97 28.99 3hhs h ARG 427 CO 0.02 0.16 -0.73 -0.07 2.80 0.00 0.00 179.97 182.14 3hhs h LEU 428 N 0.25 0.53-10.11 3.80 3.38 -0.97 -3.47 115.31 108.71 3hhs h LEU 428 Ca 0.17 -0.35 -0.47 0.00 0.09 0.00 0.00 57.88 57.32 3hhs h LEU 428 Cb 0.16 -0.16 0.03 0.00 0.09 0.00 0.00 40.66 40.79 3hhs h LEU 428 CO -0.19 1.09 0.38 -1.81 0.09 0.00 0.00 178.44 178.00 3hhs s ASP 429 N -6.99 6.25 -0.55 -0.43 1.11 0.64 -4.91 116.67 111.78 3hhs s ASP 429 Ca -0.06 1.87 0.04 0.00 0.18 0.00 0.00 52.55 54.57 3hhs s ASP 429 Cb 0.10 -2.55 0.15 0.00 1.07 0.00 0.00 42.92 41.70 3hhs s ASP 429 CO 0.85 -0.84 0.36 0.12 1.18 0.00 0.00 175.17 176.83 3hhs s PHE 430 N -2.15 2.70 0.04 4.23 5.36 -1.26 -4.84 117.98 122.06 3hhs s PHE 430 Ca 0.66 -2.91 -0.36 0.00 -0.96 0.00 0.00 56.93 53.35 3hhs s PHE 430 Cb -0.15 -2.24 -0.16 0.00 -0.34 0.00 0.00 43.02 40.13 3hhs s PHE 430 CO 0.24 -0.69 1.50 -2.30 -1.46 0.00 0.00 175.22 172.51 3hhs n PRO 431 N 2.75 1.46 0.00 10.12 -0.02 -1.26 -1.84 135.00 146.21 3hhs n PRO 431 Ca 0.15 0.53 0.00 0.00 -2.02 0.00 0.00 63.50 62.16 3hhs n PRO 431 Cb 0.36 -2.22 0.00 0.00 -0.02 0.00 0.00 33.50 31.62 3hhs n PRO 431 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hhs n GLY 432 N 3.13 0.32 2.91 -1.23 0.00 -1.26 -4.99 105.19 104.07 3hhs n GLY 432 Ca 0.20 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.93 3hhs n GLY 432 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hhs s VAL 433 N -2.00 1.19 -0.12 1.61 1.01 -0.77 -0.67 120.40 120.64 3hhs s VAL 433 Ca 0.00 -0.63 0.02 0.00 0.00 0.00 0.00 61.98 61.37 3hhs s VAL 433 Cb 0.00 -1.31 0.01 0.00 0.00 0.00 0.00 36.38 35.08 3hhs s VAL 433 CO 0.00 0.18 -0.17 -0.60 0.00 0.00 0.00 175.10 174.52 3hhs s ARG 434 N 1.61 2.42 -0.37 2.72 3.52 -1.04 -3.79 118.95 124.01 3hhs s ARG 434 Ca 0.01 -0.63 -0.18 0.00 -0.13 0.00 0.00 55.73 54.80 3hhs s ARG 434 Cb -0.15 -2.05 0.00 0.00 -1.56 0.00 0.00 34.95 31.20 3hhs s ARG 434 CO -0.08 -0.07 0.50 0.08 -0.81 0.00 0.00 175.30 174.92 3hhs s VAL 435 N 1.00 5.02 0.03 7.11 1.01 -0.03 -1.10 120.40 133.45 3hhs s VAL 435 Ca -0.05 0.17 0.03 0.00 0.00 0.00 0.00 61.98 62.12 3hhs s VAL 435 Cb -0.15 -3.99 -0.25 0.00 0.00 0.00 0.00 36.38 32.00 3hhs s VAL 435 CO -0.03 -0.28 0.93 0.77 0.00 0.00 0.00 175.10 176.50 3hhs h SER 436 N 8.55 0.21 -4.86 3.32 4.64 -0.47 -3.43 113.55 121.51 3hhs h SER 436 Ca -0.28 -0.29 -0.01 0.00 -0.47 0.00 0.00 61.79 60.75 3hhs h SER 436 Cb 1.12 -0.07 -0.16 0.00 -0.31 0.00 0.00 62.40 62.98 3hhs h SER 436 CO 0.78 1.24 0.28 -0.94 -0.87 0.00 0.00 176.83 177.32 3hhs s SER 437 N -6.74 -0.55 0.06 4.97 1.04 -1.18 -4.99 113.70 106.31 3hhs s SER 437 Ca -0.05 0.30 0.04 0.00 0.48 0.00 0.00 55.95 56.72 3hhs s SER 437 Cb 0.08 0.52 -0.03 0.00 0.10 0.00 0.00 66.02 66.69 3hhs s SER 437 CO 0.84 -0.73 -0.12 0.54 0.98 0.00 0.00 173.24 174.76 3hhs s VAL 438 N -2.47 0.89 0.12 5.02 0.11 -1.26 -0.85 120.40 121.96 3hhs s VAL 438 Ca -0.03 -1.24 -0.24 0.00 -2.93 0.00 0.00 61.98 57.53 3hhs s VAL 438 Cb -0.01 -0.91 0.08 0.00 -1.53 0.00 0.00 36.38 34.01 3hhs s VAL 438 CO -0.03 -0.30 1.12 -0.83 -3.33 0.00 0.00 175.10 171.72 3hhs s GLY 439 N -1.72 0.00 -0.11 6.54 0.00 -0.65 -4.59 107.32 106.79 3hhs s GLY 439 Ca -0.05 -0.16 0.03 0.00 0.00 0.00 0.00 44.72 44.55 3hhs s GLY 439 CO 0.01 3.04 -0.22 -0.42 0.00 0.00 0.00 173.10 175.52 3hhs s ILE 440 N -2.20 1.97 0.78 0.90 1.01 -1.26 -1.22 121.20 121.18 3hhs s ILE 440 Ca 0.23 -0.96 -0.11 0.00 0.00 0.00 0.00 60.65 59.82 3hhs s ILE 440 Cb -0.02 -1.72 0.06 0.00 0.01 0.00 0.00 42.46 40.79 3hhs s ILE 440 CO 0.03 0.54 1.10 -1.61 0.00 0.00 0.00 174.94 175.00 3hhs s GLU 441 N 0.51 2.19 0.00 2.79 2.02 -0.36 -0.82 118.70 125.03 3hhs s GLU 441 Ca -0.15 1.20 0.00 0.00 0.02 0.00 0.00 54.97 56.04 3hhs s GLU 441 Cb -0.17 -1.89 0.00 0.00 0.10 0.00 0.00 34.13 32.17 3hhs s GLU 441 CO 0.05 -1.70 0.00 0.41 0.02 0.00 0.00 175.26 174.04 3hhs n GLY 442 N -1.08 0.31 1.18 -1.39 0.00 -1.26 -4.63 105.19 98.31 3hhs n GLY 442 Ca 0.09 -0.81 -0.11 0.00 0.00 0.00 0.00 46.02 45.20 3hhs n GLY 442 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hhs n ARG 444 N 0.00 0.00 -1.94 1.61 1.74 -1.26 -5.07 116.66 111.73 3hhs n ARG 444 Ca 0.00 0.00 -0.40 0.00 -0.77 0.00 0.00 57.85 56.68 3hhs n ARG 444 Cb 0.00 -0.43 -0.00 0.00 -1.02 0.00 0.00 32.46 31.01 3hhs n ARG 444 CO 0.00 0.00 0.00 -2.14 -1.52 0.00 0.00 177.63 173.97 3hhs s PRO 445 N 2.73 3.97 -0.94 5.56 0.02 -1.26 -3.46 135.00 141.62 3hhs s PRO 445 Ca 0.45 2.32 0.00 0.00 0.02 0.00 0.00 61.00 63.79 3hhs s PRO 445 Cb -0.36 -2.81 0.00 0.00 0.02 0.00 0.00 34.50 31.34 3hhs s PRO 445 CO 0.18 -0.55 0.00 0.09 -0.33 0.00 0.00 177.00 176.39 3hhs n ASN 446 N 0.20 -3.62 -4.10 2.53 3.02 0.00 -4.97 115.26 108.32 3hhs n ASN 446 Ca 0.03 0.04 -0.25 0.00 -0.03 0.00 0.00 54.58 54.37 3hhs n ASN 446 Cb 0.42 -2.71 -0.16 0.00 -0.61 0.00 0.00 39.78 36.72 3hhs n ASN 446 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3hhs s THR 447 N -2.50 1.32 0.01 3.41 2.01 -1.22 -1.38 115.64 117.29 3hhs s THR 447 Ca 0.00 -0.64 0.06 0.00 0.31 0.00 0.00 61.69 61.42 3hhs s THR 447 Cb 0.00 -1.15 -0.03 0.00 0.01 0.00 0.00 72.50 71.33 3hhs s THR 447 CO 0.00 0.39 -0.15 -0.76 -0.69 0.00 0.00 174.62 173.40 3hhs s LEU 448 N 0.18 2.72 -0.08 4.42 1.43 0.11 -4.97 118.68 122.49 3hhs s LEU 448 Ca -0.06 -0.33 0.04 0.00 -1.03 0.00 0.00 54.13 52.76 3hhs s LEU 448 Cb -0.12 -1.58 -0.01 0.00 0.03 0.00 0.00 46.19 44.51 3hhs s LEU 448 CO 0.02 0.28 -0.22 -0.60 0.23 0.00 0.00 176.35 176.07 3hhs s ARG 449 N -1.26 2.80 0.27 1.70 3.52 -1.26 -0.64 118.95 124.08 3hhs s ARG 449 Ca 0.14 -0.85 0.09 0.00 -0.13 0.00 0.00 55.73 54.98 3hhs s ARG 449 Cb -0.11 -2.29 -0.05 0.00 -1.56 0.00 0.00 34.95 30.94 3hhs s ARG 449 CO 0.04 0.33 -0.12 0.95 -0.81 0.00 0.00 175.30 175.69 3hhs s THR 450 N -0.01 1.97 0.08 4.11 -4.23 -0.77 -1.26 115.64 115.53 3hhs s THR 450 Ca -0.07 -2.23 -0.12 0.00 -1.18 0.00 0.00 61.69 58.09 3hhs s THR 450 Cb -0.15 -2.35 0.04 0.00 1.34 0.00 0.00 72.50 71.38 3hhs s THR 450 CO 0.05 -0.38 0.58 0.00 -0.54 0.00 0.00 174.62 174.34 3hhs n LEU 451 N -0.58 0.00 -4.84 4.79 -0.00 -0.59 -1.03 117.00 114.75 3hhs n LEU 451 Ca -0.06 -0.67 -0.32 0.00 -0.00 0.00 0.00 56.01 54.96 3hhs n LEU 451 Cb 0.62 1.41 -0.06 0.00 -0.00 0.00 0.00 43.42 45.39 3hhs n LEU 451 CO 0.39 -0.22 -0.21 0.26 -0.00 0.00 0.00 177.39 177.60 3hhs s TRP 452 N -3.62 3.38 0.00 1.47 0.23 -0.11 -1.19 118.94 119.09 3hhs s TRP 452 Ca 0.13 0.22 0.00 0.00 -2.03 0.00 0.00 56.10 54.42 3hhs s TRP 452 Cb -0.01 -1.73 -0.00 0.00 0.03 0.00 0.00 33.47 31.75 3hhs s TRP 452 CO 0.02 0.57 -0.01 -1.14 0.96 0.00 0.00 176.95 177.36 3hhs s GLN 453 N -2.14 0.09 -0.23 4.98 0.74 -0.24 -1.05 119.66 121.80 3hhs s GLN 453 Ca 0.29 -0.07 -0.11 0.00 0.05 0.00 0.00 55.36 55.51 3hhs s GLN 453 Cb -0.12 -0.06 -0.05 0.00 1.10 0.00 0.00 33.01 33.88 3hhs s GLN 453 CO 0.21 0.01 0.17 -0.65 -0.55 0.00 0.00 175.29 174.48 3hhs s GLN 454 N -0.13 4.10 0.23 1.67 -0.21 0.19 -0.84 119.66 124.67 3hhs s GLN 454 Ca -0.01 -0.22 0.05 0.00 0.02 0.00 0.00 55.36 55.19 3hhs s GLN 454 Cb -0.01 -3.52 -0.05 0.00 1.00 0.00 0.00 33.01 30.43 3hhs s GLN 454 CO -0.00 0.09 -0.04 -1.12 -2.12 0.00 0.00 175.29 172.10 3hhs s SER 455 N 0.94 2.09 0.15 5.90 0.01 -0.15 -4.60 113.70 118.04 3hhs s SER 455 Ca 0.09 -1.17 0.09 0.00 1.31 0.00 0.00 55.95 56.27 3hhs s SER 455 Cb -0.13 -0.04 -0.04 0.00 0.21 0.00 0.00 66.02 66.01 3hhs s SER 455 CO 0.04 -0.42 -0.15 0.42 0.41 0.00 0.00 173.24 173.53 3hhs s THR 456 N -3.28 2.93 0.04 1.44 -4.23 -1.26 -0.71 115.64 110.57 3hhs s THR 456 Ca 0.26 -1.63 0.05 0.00 -1.18 0.00 0.00 61.69 59.19 3hhs s THR 456 Cb 0.04 -2.40 -0.02 0.00 1.34 0.00 0.00 72.50 71.46 3hhs s THR 456 CO 0.08 -0.01 -0.14 0.54 -0.54 0.00 0.00 174.62 174.55 3hhs s VAL 457 N -1.44 1.11 -0.12 2.29 0.11 -0.65 -4.99 120.40 116.71 3hhs s VAL 457 Ca 0.21 -1.00 -0.24 0.00 -2.93 0.00 0.00 61.98 58.02 3hhs s VAL 457 Cb -0.10 -1.01 -0.03 0.00 -1.53 0.00 0.00 36.38 33.72 3hhs s VAL 457 CO 0.12 0.00 0.75 -0.70 -3.33 0.00 0.00 175.10 171.94 3hhs s GLU 458 N -1.14 4.36 -0.01 1.54 2.56 -1.26 -0.94 118.70 123.82 3hhs s GLU 458 Ca 0.01 0.91 0.22 0.00 0.00 0.00 0.00 54.97 56.11 3hhs s GLU 458 Cb -0.08 -3.51 -0.24 0.00 2.00 0.00 0.00 34.13 32.30 3hhs s GLU 458 CO 0.01 -0.12 0.75 1.28 -0.56 0.00 0.00 175.26 176.62 3hhs n LEU 459 N 4.45 0.55 0.25 2.70 4.77 -0.12 -4.68 117.00 124.92 3hhs n LEU 459 Ca 0.01 -0.24 0.08 0.00 -0.03 0.00 0.00 56.01 55.83 3hhs n LEU 459 Cb 0.50 -0.01 0.63 0.00 -2.33 0.00 0.00 43.42 42.21 3hhs n LEU 459 CO 0.47 0.12 1.02 1.23 -1.33 0.00 0.00 177.39 178.90 3hhs h GLY 460 N 4.54 0.00 2.00 -0.72 0.00 -1.83 -1.74 103.07 105.32 3hhs h GLY 460 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 3hhs h GLY 460 CO 0.00 0.00 -0.15 -0.09 0.00 0.00 0.00 176.54 176.30 3hhs h ARG 461 N 0.00 0.00 -0.08 4.80 2.43 -1.83 -3.33 114.38 116.37 3hhs h ARG 461 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3hhs h ARG 461 Cb 0.12 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.67 3hhs h ARG 461 CO 0.01 0.15 0.00 0.41 -1.51 0.00 0.00 179.97 179.03 3hhs n GLY 462 N 0.59 0.39 3.34 2.80 0.00 -0.69 -0.61 105.19 111.01 3hhs n GLY 462 Ca 0.02 -0.22 -0.46 0.00 0.00 0.00 0.00 46.02 45.36 3hhs n GLY 462 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3hhs s LEU 463 N -0.72 6.24 0.45 0.99 2.96 -0.98 -4.75 118.68 122.86 3hhs s LEU 463 Ca 0.10 -2.22 -0.23 0.00 -0.22 0.00 0.00 54.13 51.57 3hhs s LEU 463 Cb 0.07 -2.24 -0.08 0.00 0.50 0.00 0.00 46.19 44.43 3hhs s LEU 463 CO 0.09 -0.78 1.15 -1.81 -1.32 0.00 0.00 176.35 173.68 3hhs s ASP 464 N 2.89 6.28 -1.28 3.68 1.01 -1.26 -3.83 116.67 124.16 3hhs s ASP 464 Ca 0.15 2.26 -0.07 0.00 0.71 0.00 0.00 52.55 55.60 3hhs s ASP 464 Cb -0.17 -2.60 0.01 0.00 1.01 0.00 0.00 42.92 41.17 3hhs s ASP 464 CO -0.04 -0.84 0.97 0.49 0.21 0.00 0.00 175.17 175.96 3hhs n PHE 465 N -0.41 -2.46 -4.40 4.23 3.72 -1.26 -5.01 117.46 111.87 3hhs n PHE 465 Ca 0.07 0.83 -0.20 0.00 -0.05 0.00 0.00 57.45 58.10 3hhs n PHE 465 Cb 0.48 -4.59 -0.10 0.00 -0.94 0.00 0.00 39.48 34.34 3hhs n PHE 465 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 3hhs s THR 466 N -3.26 1.88 0.63 4.37 -4.23 -1.25 -5.14 115.64 108.64 3hhs s THR 466 Ca 0.48 -2.23 -0.18 0.00 -1.18 0.00 0.00 61.69 58.59 3hhs s THR 466 Cb -0.21 -2.21 -0.04 0.00 1.34 0.00 0.00 72.50 71.38 3hhs s THR 466 CO 0.60 -0.48 0.92 -2.65 -0.54 0.00 0.00 174.62 172.47 3hhs n PRO 467 N -0.49 0.77 -0.93 3.99 -0.02 -1.26 -5.02 135.00 132.04 3hhs n PRO 467 Ca -0.07 0.31 -0.28 0.00 -2.02 0.00 0.00 63.50 61.43 3hhs n PRO 467 Cb 0.61 -2.13 0.21 0.00 -0.02 0.00 0.00 33.50 32.17 3hhs n PRO 467 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3hhs s ARG 468 N -2.83 -0.30 0.00 -0.52 1.81 -1.26 -4.98 118.95 110.87 3hhs s ARG 468 Ca 0.75 0.55 0.00 0.00 -1.72 0.00 0.00 55.73 55.32 3hhs s ARG 468 Cb -0.40 -1.65 0.00 0.00 -0.45 0.00 0.00 34.95 32.45 3hhs s ARG 468 CO 0.48 -3.24 0.00 0.41 -0.68 0.00 0.00 175.30 172.27 3hhs n GLY 469 N -0.37 2.89 3.71 -3.53 0.00 -1.26 -5.05 105.19 101.58 3hhs n GLY 469 Ca 0.05 -2.04 -0.42 0.00 0.00 0.00 0.00 46.02 43.61 3hhs n GLY 469 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3hhs s SER 470 N 0.00 7.30 -0.33 1.61 0.15 -1.26 -4.66 113.70 116.51 3hhs s SER 470 Ca 0.00 1.72 0.01 0.00 0.70 0.00 0.00 55.95 58.38 3hhs s SER 470 Cb 0.00 -2.57 0.10 0.00 -1.71 0.00 0.00 66.02 61.84 3hhs s SER 470 CO 0.00 -0.33 0.08 -0.69 1.20 0.00 0.00 173.24 173.50 3hhs s VAL 471 N 1.16 1.53 0.18 4.45 1.01 -1.26 -5.00 120.40 122.47 3hhs s VAL 471 Ca 0.53 -1.86 -0.18 0.00 0.00 0.00 0.00 61.98 60.47 3hhs s VAL 471 Cb -0.22 -2.14 -0.08 0.00 0.00 0.00 0.00 36.38 33.94 3hhs s VAL 471 CO 0.27 -0.65 0.66 -0.76 0.00 0.00 0.00 175.10 174.62 3hhs s LEU 472 N 1.26 4.37 0.05 3.92 1.43 -1.26 -0.95 118.68 127.49 3hhs s LEU 472 Ca 0.11 1.31 0.07 0.00 -1.03 0.00 0.00 54.13 54.58 3hhs s LEU 472 Cb -0.18 -3.42 -0.03 0.00 0.03 0.00 0.00 46.19 42.58 3hhs s LEU 472 CO -0.17 0.08 -0.15 0.00 0.23 0.00 0.00 176.35 176.34 3hhs s ALA 473 N -1.46 2.72 -0.24 4.21 0.00 -0.11 -0.69 121.76 126.19 3hhs s ALA 473 Ca 0.40 -1.18 -0.03 0.00 0.00 0.00 0.00 51.96 51.14 3hhs s ALA 473 Cb -0.17 -0.82 0.01 0.00 0.00 0.00 0.00 23.12 22.14 3hhs s ALA 473 CO 0.20 0.59 -0.03 0.50 0.00 0.00 0.00 175.76 177.02 3hhs s ARG 474 N -1.58 3.11 0.22 0.00 3.52 0.67 -1.64 118.95 123.25 3hhs s ARG 474 Ca 0.16 -0.80 0.08 0.00 -0.13 0.00 0.00 55.73 55.04 3hhs s ARG 474 Cb -0.11 -3.05 -0.04 0.00 -1.56 0.00 0.00 34.95 30.19 3hhs s ARG 474 CO 0.07 -0.32 -0.01 -0.59 -0.81 0.00 0.00 175.30 173.64 3hhs s PHE 475 N 1.42 2.76 -0.12 5.12 -0.71 0.11 -1.00 117.98 125.57 3hhs s PHE 475 Ca 0.03 -0.19 -0.01 0.00 -1.04 0.00 0.00 56.93 55.73 3hhs s PHE 475 Cb -0.16 -1.29 -0.02 0.00 -1.21 0.00 0.00 43.02 40.34 3hhs s PHE 475 CO -0.03 0.56 -0.09 0.99 -1.34 0.00 0.00 175.22 175.31 3hhs s THR 476 N -1.99 3.44 0.09 -4.49 2.01 -1.26 -0.98 115.64 112.47 3hhs s THR 476 Ca 0.29 -0.54 -0.04 0.00 0.31 0.00 0.00 61.69 61.71 3hhs s THR 476 Cb -0.08 -2.45 -0.03 0.00 0.01 0.00 0.00 72.50 69.95 3hhs s THR 476 CO 0.19 0.54 0.08 -1.38 -0.69 0.00 0.00 174.62 173.35 3hhs s HIS 477 N 0.01 0.51 0.71 4.92 -3.43 -0.02 -4.87 115.29 113.12 3hhs s HIS 477 Ca -0.02 -0.96 -0.16 0.00 -0.80 0.00 0.00 55.06 53.12 3hhs s HIS 477 Cb -0.14 -0.30 0.03 0.00 -1.43 0.00 0.00 32.58 30.74 3hhs s HIS 477 CO 0.03 -0.49 1.21 -1.17 -2.00 0.00 0.00 174.74 172.32 3hhs s LEU 478 N -2.94 3.37 0.08 5.38 2.96 -1.26 -1.08 118.68 125.18 3hhs s LEU 478 Ca 0.12 2.36 -0.17 0.00 -0.22 0.00 0.00 54.13 56.22 3hhs s LEU 478 Cb 0.07 -4.59 0.03 0.00 0.50 0.00 0.00 46.19 42.20 3hhs s LEU 478 CO -0.06 -2.15 0.40 -1.58 -1.32 0.00 0.00 176.35 171.64 3hhs s GLN 479 N -3.83 0.99 0.15 1.98 2.00 -0.33 -4.66 119.66 115.96 3hhs s GLN 479 Ca 0.75 -0.54 0.07 0.00 -2.00 0.00 0.00 55.36 53.64 3hhs s GLN 479 Cb -0.29 0.44 -0.04 0.00 0.80 0.00 0.00 33.01 33.91 3hhs s GLN 479 CO 0.44 -0.36 -0.14 -3.38 -0.50 0.00 0.00 175.29 171.34 3hhs s HIS 480 N -3.13 1.54 0.49 1.67 -3.43 -1.26 -1.55 115.29 109.62 3hhs s HIS 480 Ca -0.01 -0.57 -0.21 0.00 -0.80 0.00 0.00 55.06 53.46 3hhs s HIS 480 Cb 0.01 -0.77 -0.07 0.00 -1.43 0.00 0.00 32.58 30.31 3hhs s HIS 480 CO -0.07 0.23 1.11 -0.51 -2.00 0.00 0.00 174.74 173.50 3hhs s ASP 481 N -2.82 6.11 0.63 7.38 -0.00 -0.39 -4.99 116.67 122.59 3hhs s ASP 481 Ca 0.15 2.15 -0.11 0.00 -0.00 0.00 0.00 52.55 54.74 3hhs s ASP 481 Cb -0.03 -2.58 -0.03 0.00 -0.00 0.00 0.00 42.92 40.28 3hhs s ASP 481 CO 0.04 -0.95 1.03 -1.61 -0.00 0.00 0.00 175.17 173.69 3hhs s GLU 482 N -3.00 3.47 0.33 8.23 0.41 -1.26 -4.77 118.70 122.11 3hhs s GLU 482 Ca 0.67 0.81 -0.13 0.00 -0.41 0.00 0.00 54.97 55.91 3hhs s GLU 482 Cb -0.24 -2.06 0.03 0.00 -1.78 0.00 0.00 34.13 30.08 3hhs s GLU 482 CO 0.28 -0.67 0.65 -0.59 -0.49 0.00 0.00 175.26 174.43 3hhs s PHE 483 N -3.11 0.31 -0.02 1.61 -0.12 -1.26 -5.04 117.98 110.35 3hhs s PHE 483 Ca 0.56 -0.79 0.01 0.00 -0.05 0.00 0.00 56.93 56.67 3hhs s PHE 483 Cb -0.12 0.49 0.01 0.00 -0.63 0.00 0.00 43.02 42.77 3hhs s PHE 483 CO 0.53 -1.30 -0.04 -1.14 -0.05 0.00 0.00 175.22 173.22 3hhs s GLN 484 N -3.13 0.58 0.37 1.99 0.74 -1.26 -0.77 119.66 118.18 3hhs s GLN 484 Ca 0.19 -0.12 -0.24 0.00 0.05 0.00 0.00 55.36 55.24 3hhs s GLN 484 Cb -0.03 -0.61 -0.10 0.00 1.10 0.00 0.00 33.01 33.37 3hhs s GLN 484 CO 0.12 -0.00 0.98 0.71 -0.55 0.00 0.00 175.29 176.55 3hhs s TYR 485 N 0.49 3.47 -0.12 1.67 2.02 0.16 -1.23 117.35 123.81 3hhs s TYR 485 Ca -0.06 1.70 0.01 0.00 -0.37 0.00 0.00 57.07 58.36 3hhs s TYR 485 Cb -0.09 -2.98 0.02 0.00 -0.40 0.00 0.00 41.96 38.51 3hhs s TYR 485 CO -0.00 -0.13 -0.14 0.08 -1.57 0.00 0.00 175.55 173.79 3hhs s VAL 486 N -1.74 1.47 -0.10 0.71 1.01 -0.36 -1.92 120.40 119.46 3hhs s VAL 486 Ca 0.55 -0.60 0.03 0.00 0.00 0.00 0.00 61.98 61.95 3hhs s VAL 486 Cb -0.18 -1.36 0.01 0.00 0.00 0.00 0.00 36.38 34.85 3hhs s VAL 486 CO 0.23 0.44 -0.18 -0.63 0.00 0.00 0.00 175.10 174.96 3hhs s ILE 487 N 1.19 1.64 -0.21 2.22 1.01 0.18 -1.64 121.20 125.59 3hhs s ILE 487 Ca -0.02 -0.75 -0.06 0.00 0.00 0.00 0.00 60.65 59.82 3hhs s ILE 487 Cb -0.14 -1.46 -0.03 0.00 0.01 0.00 0.00 42.46 40.84 3hhs s ILE 487 CO -0.05 0.47 0.03 -1.61 0.00 0.00 0.00 174.94 173.78 3hhs s GLU 488 N 0.71 3.69 -0.01 2.79 0.41 -0.03 -0.91 118.70 125.35 3hhs s GLU 488 Ca -0.12 -0.48 0.00 0.00 -0.41 0.00 0.00 54.97 53.97 3hhs s GLU 488 Cb -0.16 -3.18 0.01 0.00 -1.78 0.00 0.00 34.13 29.03 3hhs s GLU 488 CO 0.03 -0.00 -0.01 0.54 -0.49 0.00 0.00 175.26 175.33 3hhs s VAL 489 N 1.07 0.14 -0.32 2.63 0.11 -0.79 0.30 120.40 123.54 3hhs s VAL 489 Ca 0.03 0.01 -0.12 0.00 -2.93 0.00 0.00 61.98 58.97 3hhs s VAL 489 Cb -0.14 -0.17 -0.03 0.00 -1.53 0.00 0.00 36.38 34.50 3hhs s VAL 489 CO 0.02 0.08 0.22 0.21 -3.33 0.00 0.00 175.10 172.30 3hhs s ASN 490 N 0.43 6.01 -0.49 3.54 2.47 -0.26 -0.20 114.94 126.45 3hhs s ASN 490 Ca -0.04 -0.28 -0.19 0.00 0.42 0.00 0.00 52.86 52.77 3hhs s ASN 490 Cb -0.06 -2.12 0.05 0.00 -1.45 0.00 0.00 41.25 37.66 3hhs s ASN 490 CO -0.01 -0.16 0.62 0.21 -3.72 0.00 0.00 177.10 174.04 3hhs s ASN 491 N 1.73 6.24 -0.41 -4.21 2.47 0.65 -2.51 114.94 118.90 3hhs s ASN 491 Ca 0.06 -0.82 0.06 0.00 0.42 0.00 0.00 52.86 52.58 3hhs s ASN 491 Cb -0.17 -2.29 0.69 0.00 -1.45 0.00 0.00 41.25 38.03 3hhs s ASN 491 CO 0.10 -0.86 1.87 0.35 -3.72 0.00 0.00 177.10 174.84 3hhs n THR 492 N 5.64 3.11 -0.04 -5.21 -2.24 0.15 -4.07 114.28 111.63 3hhs n THR 492 Ca -0.06 -1.88 -0.02 0.00 -2.27 0.00 0.00 64.05 59.82 3hhs n THR 492 Cb 0.46 -0.43 -0.10 0.00 -2.10 0.00 0.00 70.33 68.15 3hhs n THR 492 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3hhs n THR 493 N -0.88 0.57 0.00 4.28 -2.24 -1.26 -4.95 114.28 109.79 3hhs n THR 493 Ca 0.54 -0.46 0.00 0.00 -2.27 0.00 0.00 64.05 61.86 3hhs n THR 493 Cb 1.58 -0.37 0.00 0.00 -2.10 0.00 0.00 70.33 69.44 3hhs n THR 493 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hhs n GLY 494 N 2.04 0.47 3.20 3.38 0.00 -1.26 -5.07 105.19 107.95 3hhs n GLY 494 Ca -0.14 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.79 3hhs n GLY 494 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3hhs s GLY 495 N -1.41 0.47 0.32 -0.02 0.00 -1.26 -4.91 107.32 100.51 3hhs s GLY 495 Ca 0.00 -1.00 -0.29 0.00 0.00 0.00 0.00 44.72 43.43 3hhs s GLY 495 CO 0.00 -1.04 1.48 0.70 0.00 0.00 0.00 173.10 174.24 3hhs n ASN 496 N -0.07 3.50 -4.30 1.64 5.03 -1.26 -4.37 115.26 115.43 3hhs n ASN 496 Ca -0.11 1.18 -0.20 0.00 0.87 0.00 0.00 54.58 56.32 3hhs n ASN 496 Cb 0.63 -1.56 -0.11 0.00 -1.02 0.00 0.00 39.78 37.71 3hhs n ASN 496 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 3hhs s LEU 497 N -1.03 2.42 -0.14 3.41 1.43 -0.09 -4.98 118.68 119.70 3hhs s LEU 497 Ca 0.59 -0.84 -0.03 0.00 -1.03 0.00 0.00 54.13 52.82 3hhs s LEU 497 Cb -0.52 -0.73 -0.03 0.00 0.03 0.00 0.00 46.19 44.94 3hhs s LEU 497 CO 0.56 -0.07 -0.03 -0.04 0.23 0.00 0.00 176.35 177.00 3hhs s MET 498 N -2.73 3.53 0.19 1.70 -1.94 -1.26 -0.34 119.30 118.45 3hhs s MET 498 Ca 0.13 -0.50 0.10 0.00 -1.71 0.00 0.00 55.69 53.71 3hhs s MET 498 Cb -0.05 -2.88 -0.04 0.00 2.01 0.00 0.00 34.83 33.86 3hhs s MET 498 CO 0.05 0.33 -0.18 0.20 -0.01 0.00 0.00 175.02 175.41 3hhs s GLY 499 N 0.11 1.72 -0.38 -0.03 0.00 -0.05 -1.99 107.32 106.71 3hhs s GLY 499 Ca -0.00 -1.59 -0.14 0.00 0.00 0.00 0.00 44.72 42.98 3hhs s GLY 499 CO 0.03 -1.62 0.27 -1.59 0.00 0.00 0.00 173.10 170.19 3hhs s THR 500 N -1.73 5.19 -0.12 0.90 2.01 -0.13 -1.05 115.64 120.72 3hhs s THR 500 Ca 0.23 -0.53 -0.25 0.00 0.31 0.00 0.00 61.69 61.44 3hhs s THR 500 Cb -0.08 -3.82 -0.02 0.00 0.01 0.00 0.00 72.50 68.59 3hhs s THR 500 CO 0.12 -0.20 0.80 -0.69 -0.69 0.00 0.00 174.62 173.96 3hhs s VAL 501 N 1.68 4.93 -0.15 3.82 1.01 0.37 -1.37 120.40 130.70 3hhs s VAL 501 Ca 0.05 1.62 0.00 0.00 0.00 0.00 0.00 61.98 63.65 3hhs s VAL 501 Cb -0.18 -4.13 0.02 0.00 0.00 0.00 0.00 36.38 32.09 3hhs s VAL 501 CO 0.10 0.11 -0.13 -0.13 0.00 0.00 0.00 175.10 175.05 3hhs s ARG 502 N 1.59 2.19 -0.12 2.72 0.52 0.49 -1.65 118.95 124.70 3hhs s ARG 502 Ca 0.39 -0.53 0.03 0.00 -0.52 0.00 0.00 55.73 55.10 3hhs s ARG 502 Cb -0.17 -2.06 0.00 0.00 0.52 0.00 0.00 34.95 33.24 3hhs s ARG 502 CO 0.16 -0.25 -0.22 0.42 0.02 0.00 0.00 175.30 175.43 3hhs s ILE 503 N 1.51 2.15 0.16 1.52 1.01 0.45 -1.57 121.20 126.43 3hhs s ILE 503 Ca 0.05 -0.97 0.04 0.00 0.00 0.00 0.00 60.65 59.77 3hhs s ILE 503 Cb -0.13 -1.84 -0.05 0.00 0.01 0.00 0.00 42.46 40.45 3hhs s ILE 503 CO -0.10 0.55 -0.08 -0.36 0.00 0.00 0.00 174.94 174.95 3hhs s PHE 504 N 0.53 1.31 0.05 3.97 0.40 -0.62 -0.53 117.98 123.09 3hhs s PHE 504 Ca -0.14 -0.79 0.03 0.00 -0.60 0.00 0.00 56.93 55.43 3hhs s PHE 504 Cb -0.17 -0.69 -0.02 0.00 0.51 0.00 0.00 43.02 42.65 3hhs s PHE 504 CO 0.05 0.06 -0.10 0.00 0.70 0.00 0.00 175.22 175.92 3hhs s MET 505 N -3.77 0.62 0.08 0.44 0.23 -0.59 -0.08 119.30 116.23 3hhs s MET 505 Ca 0.19 -0.79 0.03 0.00 -1.03 0.00 0.00 55.69 54.08 3hhs s MET 505 Cb 0.03 -0.47 -0.03 0.00 -1.53 0.00 0.00 34.83 32.83 3hhs s MET 505 CO 0.02 0.10 -0.09 0.00 -2.03 0.00 0.00 175.02 173.01 3hhs s ALA 506 N -1.29 0.98 0.58 3.16 0.00 -0.53 -0.72 121.76 123.94 3hhs s ALA 506 Ca -0.07 -1.11 -0.20 0.00 0.00 0.00 0.00 51.96 50.58 3hhs s ALA 506 Cb -0.10 0.05 -0.05 0.00 0.00 0.00 0.00 23.12 23.02 3hhs s ALA 506 CO 0.01 -0.05 1.15 -2.30 0.00 0.00 0.00 175.76 174.56 3hhs n PRO 507 N 0.70 1.21 0.02 0.00 -0.02 -1.26 -0.12 135.00 135.52 3hhs n PRO 507 Ca -0.17 0.46 -0.13 0.00 -2.02 0.00 0.00 63.50 61.64 3hhs n PRO 507 Cb 0.57 -2.35 -0.01 0.00 -0.02 0.00 0.00 33.50 31.70 3hhs n PRO 507 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 3hhs h LYS 508 N 0.85 0.55 -5.37 -0.52 1.79 -1.73 -3.42 116.57 108.73 3hhs h LYS 508 Ca -0.49 -0.45 -0.42 0.00 -2.18 0.00 0.00 60.65 57.10 3hhs h LYS 508 Cb 1.34 0.09 -0.14 0.00 -1.58 0.00 0.00 32.23 31.94 3hhs h LYS 508 CO 0.54 1.08 -0.70 0.14 -1.08 0.00 0.00 179.45 179.42 3hhs s VAL 509 N -3.67 1.47 0.20 0.50 -7.23 -1.26 -4.28 120.40 106.13 3hhs s VAL 509 Ca -0.07 -2.13 -0.02 0.00 -1.81 0.00 0.00 61.98 57.95 3hhs s VAL 509 Cb 0.10 -2.17 0.04 0.00 0.56 0.00 0.00 36.38 34.91 3hhs s VAL 509 CO 0.86 -0.50 0.27 -0.90 -0.31 0.00 0.00 175.10 174.53 3hhs n ASP 510 N -0.41 0.15 0.26 4.85 3.85 -0.13 -4.85 116.55 120.28 3hhs n ASP 510 Ca -0.07 -1.18 0.18 0.00 -0.71 0.00 0.00 54.79 53.01 3hhs n ASP 510 Cb 0.62 -0.19 0.79 0.00 -1.35 0.00 0.00 41.12 40.98 3hhs n ASP 510 CO 0.00 0.00 0.00 -2.24 -1.01 0.00 0.00 177.20 173.95 3hhs h ASP 511 N -0.28 0.00 -0.58 -1.12 2.03 -1.93 -0.20 116.42 114.33 3hhs h ASP 511 Ca -0.09 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.21 3hhs h ASP 511 Cb 0.27 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.77 3hhs h ASP 511 CO 0.07 0.00 0.00 0.59 -1.03 0.00 0.00 179.24 178.87 3hhs n ASN 512 N -2.90 5.42 -0.79 4.15 3.02 -1.26 -4.92 115.26 117.98 3hhs n ASN 512 Ca -0.00 -2.80 -0.10 0.00 -0.03 0.00 0.00 54.58 51.65 3hhs n ASN 512 Cb 0.21 -0.66 -0.04 0.00 -0.61 0.00 0.00 39.78 38.68 3hhs n ASN 512 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3hhs n GLY 513 N 0.74 1.17 3.81 7.41 0.00 -0.09 -5.02 105.19 113.22 3hhs n GLY 513 Ca 0.27 -0.46 -0.33 0.00 0.00 0.00 0.00 46.02 45.50 3hhs n GLY 513 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3hhs s GLN 514 N -2.80 3.15 0.64 1.61 -1.52 -1.26 -4.74 119.66 114.74 3hhs s GLN 514 Ca 0.00 -0.46 -0.18 0.00 -1.95 0.00 0.00 55.36 52.77 3hhs s GLN 514 Cb 0.00 -2.91 -0.01 0.00 -0.22 0.00 0.00 33.01 29.86 3hhs s GLN 514 CO 0.00 0.65 1.28 -2.14 -0.25 0.00 0.00 175.29 174.83 3hhs s PRO 515 N -1.85 2.61 0.06 2.91 0.02 -1.26 -0.95 135.00 136.54 3hhs s PRO 515 Ca 0.25 2.02 0.04 0.00 0.02 0.00 0.00 61.00 63.33 3hhs s PRO 515 Cb -0.12 -1.86 -0.04 0.00 0.02 0.00 0.00 34.50 32.50 3hhs s PRO 515 CO 0.16 -1.54 -0.04 -1.64 -0.33 0.00 0.00 177.00 173.61 3hhs s MET 516 N -3.38 2.50 0.83 5.54 -1.94 -1.26 -4.85 119.30 116.74 3hhs s MET 516 Ca 0.82 -0.81 -0.11 0.00 -1.71 0.00 0.00 55.69 53.87 3hhs s MET 516 Cb -0.36 -2.50 0.10 0.00 2.01 0.00 0.00 34.83 34.07 3hhs s MET 516 CO 0.39 0.56 1.14 -1.54 -0.01 0.00 0.00 175.02 175.56 3hhs s SER 517 N -1.95 3.68 0.24 3.03 1.04 -1.26 -4.64 113.70 113.84 3hhs s SER 517 Ca 0.22 2.10 -0.05 0.00 0.48 0.00 0.00 55.95 58.70 3hhs s SER 517 Cb -0.11 -2.56 0.39 0.00 0.10 0.00 0.00 66.02 63.84 3hhs s SER 517 CO 0.13 -2.59 1.79 0.15 0.98 0.00 0.00 173.24 173.70 3hhs h PHE 518 N -1.32 0.76 0.00 5.02 3.57 -0.37 -0.82 116.94 123.78 3hhs h PHE 518 Ca -0.44 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.07 3hhs h PHE 518 Cb 1.26 -0.22 -0.00 0.00 2.79 0.00 0.00 35.95 39.78 3hhs h PHE 518 CO 0.52 0.28 -0.10 -0.91 -2.23 0.00 0.00 178.31 175.87 3hhs h ASN 519 N 0.69 0.00 0.00 0.41 2.35 -1.87 -0.66 115.58 116.51 3hhs h ASN 519 Ca 0.39 0.00 -0.13 0.00 -0.55 0.00 0.00 56.30 56.01 3hhs h ASN 519 Cb 0.40 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.76 3hhs h ASN 519 CO -0.27 0.10 -0.71 0.11 -1.65 0.00 0.00 177.43 175.00 3hhs h LYS 520 N 0.00 0.00 -0.04 0.81 1.79 -1.86 -3.40 116.57 113.87 3hhs h LYS 520 Ca -0.00 0.00 -0.07 0.00 -2.18 0.00 0.00 60.65 58.40 3hhs h LYS 520 Cb 0.28 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.92 3hhs h LYS 520 CO 0.01 0.96 -0.31 0.37 -1.08 0.00 0.00 179.45 179.41 3hhs h GLN 521 N -1.00 0.07 -0.28 3.15 4.15 -0.76 -2.55 115.11 117.88 3hhs h GLN 521 Ca -0.19 -0.02 0.06 0.00 0.77 0.00 0.00 58.65 59.27 3hhs h GLN 521 Cb 1.14 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.81 3hhs h GLN 521 CO -0.12 0.37 0.20 0.07 -1.93 0.00 0.00 178.83 177.42 3hhs h ARG 522 N 0.06 0.09 0.00 1.69 0.11 -1.34 0.88 114.38 115.86 3hhs h ARG 522 Ca 0.01 -0.01 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3hhs h ARG 522 Cb 0.58 -0.02 0.00 0.00 1.11 0.00 0.00 29.97 31.64 3hhs h ARG 522 CO 0.04 0.06 0.00 0.54 0.10 0.00 0.00 179.97 180.71 3hhs n ARG 523 N -4.47 0.01 -0.20 0.08 1.74 -0.96 -2.67 116.66 110.19 3hhs n ARG 523 Ca 0.03 0.10 0.06 0.00 -0.77 0.00 0.00 57.85 57.28 3hhs n ARG 523 Cb 0.30 -1.50 0.17 0.00 -1.02 0.00 0.00 32.46 30.41 3hhs n ARG 523 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3hhs n LEU 524 N -1.50 3.04 -4.60 0.55 4.77 0.29 -4.60 117.00 114.95 3hhs n LEU 524 Ca 0.06 -1.99 -0.43 0.00 -0.03 0.00 0.00 56.01 53.61 3hhs n LEU 524 Cb 0.27 -0.26 -0.02 0.00 -2.33 0.00 0.00 43.42 41.07 3hhs n LEU 524 CO 0.21 0.76 1.15 -0.04 -1.33 0.00 0.00 177.39 178.14 3hhs s MET 525 N -1.00 3.63 -0.15 3.23 -1.94 -1.09 -4.30 119.30 117.68 3hhs s MET 525 Ca 0.26 0.77 -0.10 0.00 -1.71 0.00 0.00 55.69 54.91 3hhs s MET 525 Cb 0.14 -3.98 -0.05 0.00 2.01 0.00 0.00 34.83 32.95 3hhs s MET 525 CO 0.18 -1.50 0.18 0.96 -0.01 0.00 0.00 175.02 174.83 3hhs s ILE 526 N 5.04 5.40 0.14 2.53 -4.36 0.10 -4.90 121.20 125.16 3hhs s ILE 526 Ca 0.56 0.31 -0.30 0.00 -0.26 0.00 0.00 60.65 60.96 3hhs s ILE 526 Cb -0.11 -3.49 -0.07 0.00 1.25 0.00 0.00 42.46 40.05 3hhs s ILE 526 CO 0.32 0.51 1.01 -0.70 0.24 0.00 0.00 174.94 176.33 3hhs s GLU 527 N -0.27 4.67 -0.03 0.37 2.12 -1.26 -1.55 118.70 122.74 3hhs s GLU 527 Ca 0.13 1.55 0.04 0.00 0.36 0.00 0.00 54.97 57.06 3hhs s GLU 527 Cb -0.12 -3.34 -0.06 0.00 0.26 0.00 0.00 34.13 30.87 3hhs s GLU 527 CO 0.02 0.17 0.05 1.28 -0.54 0.00 0.00 175.26 176.25 3hhs n LEU 528 N 2.59 0.00 -3.60 2.70 4.77 0.31 -4.96 117.00 118.81 3hhs n LEU 528 Ca 0.02 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 55.93 3hhs n LEU 528 Cb 0.48 0.07 -0.05 0.00 -2.33 0.00 0.00 43.42 41.60 3hhs n LEU 528 CO 0.52 0.07 0.93 -0.62 -1.33 0.00 0.00 177.39 176.96 3hhs s ASP 529 N -3.22 -0.23 -0.13 -1.43 -1.08 -0.97 -4.44 116.67 105.17 3hhs s ASP 529 Ca -0.02 0.24 -0.05 0.00 -0.52 0.00 0.00 52.55 52.20 3hhs s ASP 529 Cb 0.02 0.19 0.06 0.00 -1.46 0.00 0.00 42.92 41.74 3hhs s ASP 529 CO 0.19 -0.23 0.28 -0.75 0.52 0.00 0.00 175.17 175.19 3hhs s LYS 530 N -1.17 0.18 -0.01 4.34 2.20 -1.26 -0.41 119.74 123.61 3hhs s LYS 530 Ca 0.03 0.73 -0.20 0.00 -0.36 0.00 0.00 55.97 56.17 3hhs s LYS 530 Cb -0.01 -0.02 0.04 0.00 -1.51 0.00 0.00 37.83 36.33 3hhs s LYS 530 CO -0.02 -0.25 0.43 -0.59 -0.36 0.00 0.00 175.35 174.55 3hhs s PHE 531 N 2.17 -0.33 0.24 4.03 -0.71 -0.66 -4.59 117.98 118.13 3hhs s PHE 531 Ca -0.02 0.48 -0.26 0.00 -1.04 0.00 0.00 56.93 56.10 3hhs s PHE 531 Cb -0.12 0.21 -0.09 0.00 -1.21 0.00 0.00 43.02 41.81 3hhs s PHE 531 CO -0.09 -0.49 0.86 -1.54 -1.34 0.00 0.00 175.22 172.62 3hhs s SER 532 N -1.46 7.39 -0.07 1.98 1.04 -1.26 -0.48 113.70 120.85 3hhs s SER 532 Ca -0.11 1.75 -0.03 0.00 0.48 0.00 0.00 55.95 58.04 3hhs s SER 532 Cb -0.03 -2.54 0.04 0.00 0.10 0.00 0.00 66.02 63.59 3hhs s SER 532 CO 0.04 0.09 0.14 -1.58 0.98 0.00 0.00 173.24 172.91 3hhs s GLN 533 N -1.55 0.07 0.29 4.02 2.00 -0.21 -4.93 119.66 119.34 3hhs s GLN 533 Ca 0.42 0.40 -0.29 0.00 -2.00 0.00 0.00 55.36 53.89 3hhs s GLN 533 Cb -0.22 -0.21 -0.10 0.00 0.80 0.00 0.00 33.01 33.29 3hhs s GLN 533 CO 0.26 -0.20 1.16 0.00 -0.50 0.00 0.00 175.29 176.02 3hhs s ALA 534 N 1.42 3.44 -0.17 1.58 0.00 -1.26 -0.87 121.76 125.91 3hhs s ALA 534 Ca -0.06 1.01 -0.01 0.00 0.00 0.00 0.00 51.96 52.90 3hhs s ALA 534 Cb -0.12 -3.37 0.04 0.00 0.00 0.00 0.00 23.12 19.67 3hhs s ALA 534 CO -0.06 -0.31 -0.03 -0.51 0.00 0.00 0.00 175.76 174.85 3hhs s LEU 535 N -1.54 1.50 0.63 0.00 1.43 0.54 -4.94 118.68 116.30 3hhs s LEU 535 Ca 0.46 -0.68 -0.11 0.00 -1.03 0.00 0.00 54.13 52.77 3hhs s LEU 535 Cb -0.34 -0.83 -0.04 0.00 0.03 0.00 0.00 46.19 45.01 3hhs s LEU 535 CO 0.45 -0.21 1.03 -0.13 0.23 0.00 0.00 176.35 177.72 3hhs s ARG 536 N 1.69 3.54 0.29 1.70 0.52 -1.26 -0.91 118.95 124.51 3hhs s ARG 536 Ca 0.00 0.76 -0.29 0.00 -0.52 0.00 0.00 55.73 55.68 3hhs s ARG 536 Cb -0.16 -2.07 -0.13 0.00 0.52 0.00 0.00 34.95 33.11 3hhs s ARG 536 CO -0.07 -0.62 1.21 -2.30 0.02 0.00 0.00 175.30 173.54 3hhs n PRO 537 N -2.78 1.77 -0.01 3.54 -0.02 -1.26 -4.26 135.00 131.98 3hhs n PRO 537 Ca 0.06 0.63 -0.02 0.00 -2.02 0.00 0.00 63.50 62.14 3hhs n PRO 537 Cb 0.54 -2.15 -0.01 0.00 -0.02 0.00 0.00 33.50 31.86 3hhs n PRO 537 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hhs n GLY 538 N 1.33 -0.23 3.76 -1.23 0.00 -1.26 -4.97 105.19 102.60 3hhs n GLY 538 Ca 0.09 -0.09 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 3hhs n GLY 538 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3hhs s THR 539 N -1.80 3.83 0.00 2.61 -4.23 -1.26 0.24 115.64 115.03 3hhs s THR 539 Ca -0.08 1.77 0.02 0.00 -1.18 0.00 0.00 61.69 62.22 3hhs s THR 539 Cb 0.01 -4.10 -0.01 0.00 1.34 0.00 0.00 72.50 69.74 3hhs s THR 539 CO 0.11 0.37 -0.06 0.20 -0.54 0.00 0.00 174.62 174.71 3hhs s ASN 540 N -1.14 0.65 -0.24 3.99 -0.87 0.72 -4.91 114.94 113.14 3hhs s ASN 540 Ca 0.45 -0.18 0.02 0.00 -1.57 0.00 0.00 52.86 51.57 3hhs s ASN 540 Cb -0.27 -0.05 0.05 0.00 -0.02 0.00 0.00 41.25 40.96 3hhs s ASN 540 CO 0.34 0.01 -0.12 -0.89 -2.57 0.00 0.00 177.10 173.88 3hhs s THR 541 N -0.36 2.26 -0.22 1.60 2.01 -1.26 -1.89 115.64 117.78 3hhs s THR 541 Ca -0.00 -1.40 -0.12 0.00 0.31 0.00 0.00 61.69 60.47 3hhs s THR 541 Cb -0.04 -2.23 -0.05 0.00 0.01 0.00 0.00 72.50 70.20 3hhs s THR 541 CO -0.00 0.12 0.23 -0.63 -0.69 0.00 0.00 174.62 173.65 3hhs s ILE 542 N 1.17 5.32 -0.17 1.82 1.01 -0.09 -4.95 121.20 125.32 3hhs s ILE 542 Ca -0.05 0.35 -0.01 0.00 0.00 0.00 0.00 60.65 60.93 3hhs s ILE 542 Cb -0.18 -3.57 -0.01 0.00 0.01 0.00 0.00 42.46 38.71 3hhs s ILE 542 CO -0.07 0.33 -0.10 -0.13 0.00 0.00 0.00 174.94 174.97 3hhs s ARG 543 N 1.03 3.37 -0.09 2.79 0.52 -1.26 -0.64 118.95 124.66 3hhs s ARG 543 Ca 0.11 -0.67 0.02 0.00 -0.52 0.00 0.00 55.73 54.67 3hhs s ARG 543 Cb -0.14 -2.77 0.01 0.00 0.52 0.00 0.00 34.95 32.58 3hhs s ARG 543 CO 0.05 0.04 -0.14 0.50 0.02 0.00 0.00 175.30 175.77 3hhs s ARG 544 N 0.80 2.06 0.23 3.54 6.06 -0.81 -4.97 118.95 125.86 3hhs s ARG 544 Ca -0.04 -0.51 -0.30 0.00 -2.50 0.00 0.00 55.73 52.38 3hhs s ARG 544 Cb -0.15 -1.73 -0.09 0.00 0.06 0.00 0.00 34.95 33.04 3hhs s ARG 544 CO 0.01 -0.02 0.93 1.03 -2.50 0.00 0.00 175.30 174.75 3hhs s ARG 545 N 0.86 4.84 0.32 5.12 0.52 -1.26 -0.67 118.95 128.68 3hhs s ARG 545 Ca -0.10 1.47 0.05 0.00 -0.52 0.00 0.00 55.73 56.64 3hhs s ARG 545 Cb -0.15 -3.28 0.70 0.00 0.52 0.00 0.00 34.95 32.73 3hhs s ARG 545 CO 0.01 0.51 1.84 0.66 0.02 0.00 0.00 175.30 178.34 3hhs h SER 546 N 4.23 0.79 0.17 0.23 4.64 -1.33 -1.48 113.55 120.80 3hhs h SER 546 Ca -0.45 0.05 0.00 0.00 -0.47 0.00 0.00 61.79 60.92 3hhs h SER 546 Cb 1.20 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 3hhs h SER 546 CO 0.68 0.39 0.00 -0.37 -0.87 0.00 0.00 176.83 176.66 3hhs h VAL 547 N 0.83 0.00 -0.19 0.95 -1.51 -1.92 -2.66 116.25 111.74 3hhs h VAL 547 Ca 0.49 -0.08 0.00 0.00 -1.23 0.00 0.00 66.70 65.88 3hhs h VAL 547 Cb 0.65 0.93 0.00 0.00 -2.13 0.00 0.00 31.29 30.74 3hhs h VAL 547 CO -0.25 0.00 0.00 0.47 -1.23 0.00 0.00 177.57 176.56 3hhs n ASP 548 N -2.82 1.87 -4.53 4.19 8.00 -0.56 -4.99 116.55 117.72 3hhs n ASP 548 Ca -0.02 -1.74 -0.55 0.00 0.71 0.00 0.00 54.79 53.18 3hhs n ASP 548 Cb 0.10 -0.12 -0.07 0.00 -0.02 0.00 0.00 41.12 41.01 3hhs n ASP 548 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 3hhs n SER 549 N 0.46 0.57 0.00 -2.24 2.88 -1.01 -4.87 113.62 109.42 3hhs n SER 549 Ca 0.16 1.14 0.11 0.00 -1.33 0.00 0.00 58.87 58.95 3hhs n SER 549 Cb 0.36 -1.03 0.62 0.00 -0.75 0.00 0.00 64.21 63.41 3hhs n SER 549 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 3hhs n SER 550 N 1.90 0.00 -0.10 -3.46 3.41 -1.26 -3.55 113.62 110.56 3hhs n SER 550 Ca 0.19 -0.73 -0.10 0.00 -0.26 0.00 0.00 58.87 57.97 3hhs n SER 550 Cb 0.14 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 63.93 3hhs n SER 550 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 3hhs n VAL 551 N -0.97 1.35 -4.09 -3.33 0.31 -1.26 -1.91 118.33 108.43 3hhs n VAL 551 Ca 0.16 -0.82 -0.23 0.00 -0.01 0.00 0.00 64.34 63.44 3hhs n VAL 551 Cb 0.07 -0.51 -0.06 0.00 -0.91 0.00 0.00 33.84 32.43 3hhs n VAL 551 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 3hhs s THR 552 N -2.48 3.28 0.13 2.52 -4.23 -1.23 -1.90 115.64 111.73 3hhs s THR 552 Ca -0.11 -1.66 0.08 0.00 -1.18 0.00 0.00 61.69 58.83 3hhs s THR 552 Cb 0.06 -3.02 -0.04 0.00 1.34 0.00 0.00 72.50 70.84 3hhs s THR 552 CO 0.80 -0.22 -0.12 0.27 -0.54 0.00 0.00 174.62 174.80 3hhs s ILE 553 N -2.37 3.20 0.80 2.99 -4.36 -0.24 -4.13 121.20 117.08 3hhs s ILE 553 Ca 0.37 -1.43 -0.11 0.00 -0.26 0.00 0.00 60.65 59.22 3hhs s ILE 553 Cb -0.04 -2.51 0.07 0.00 1.25 0.00 0.00 42.46 41.23 3hhs s ILE 553 CO 0.23 0.05 1.09 -2.16 0.24 0.00 0.00 174.94 174.39 3hhs s PRO 554 N -2.36 2.05 0.12 0.37 0.04 -1.26 -1.96 135.00 132.00 3hhs s PRO 554 Ca 0.21 0.98 -0.20 0.00 0.04 0.00 0.00 61.00 62.04 3hhs s PRO 554 Cb -0.10 -1.89 -0.05 0.00 0.04 0.00 0.00 34.50 32.50 3hhs s PRO 554 CO 0.13 -1.74 1.74 -0.92 0.04 0.00 0.00 177.00 176.26 3hhs h TYR 555 N -1.19 0.08 0.00 0.56 5.03 -1.99 -2.52 116.97 116.94 3hhs h TYR 555 Ca -0.46 0.01 -0.01 0.00 2.58 0.00 0.00 58.73 60.85 3hhs h TYR 555 Cb 1.25 -0.01 -0.00 0.00 1.55 0.00 0.00 36.73 39.52 3hhs h TYR 555 CO 0.53 0.03 -0.07 1.05 -1.32 0.00 0.00 178.16 178.38 3hhs h GLU 556 N 0.13 0.00 -0.64 1.82 9.09 -2.03 -2.05 114.58 120.90 3hhs h GLU 556 Ca 0.08 0.00 0.11 0.00 0.05 0.00 0.00 59.36 59.61 3hhs h GLU 556 Cb 0.07 0.00 -0.08 0.00 -1.65 0.00 0.00 28.75 27.09 3hhs h GLU 556 CO -0.10 0.07 0.20 -0.09 0.05 0.00 0.00 179.01 179.14 3hhs h ARG 557 N 0.00 0.35 -3.29 1.06 9.65 -1.82 -3.54 114.38 116.78 3hhs h ARG 557 Ca -0.00 -0.02 -0.80 0.00 -1.10 0.00 0.00 59.98 58.06 3hhs h ARG 557 Cb 0.17 -0.08 -0.27 0.00 -1.39 0.00 0.00 29.97 28.40 3hhs h ARG 557 CO 0.01 0.23 0.74 2.41 2.80 0.00 0.00 179.97 186.16 3hhs n THR 558 N -5.05 4.94 0.00 0.20 -1.04 -0.78 -5.02 114.28 107.53 3hhs n THR 558 Ca 0.10 -5.58 0.00 0.00 -2.04 0.00 0.00 64.05 56.53 3hhs n THR 558 Cb 0.32 -2.32 0.00 0.00 -1.82 0.00 0.00 70.33 66.52 3hhs n THR 558 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 3hhs n ASP 578 N 2.19 0.00 -4.74 8.00 8.00 -1.25 -4.93 116.55 123.83 3hhs n ASP 578 Ca 0.26 0.00 -0.42 0.00 0.71 0.00 0.00 54.79 55.35 3hhs n ASP 578 Cb 0.36 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.44 3hhs n ASP 578 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 3hhs s PHE 579 N 0.00 3.01 -0.38 1.24 5.36 -1.24 -4.67 117.98 121.30 3hhs s PHE 579 Ca 0.00 0.91 0.11 0.00 -0.96 0.00 0.00 56.93 56.99 3hhs s PHE 579 Cb 0.00 -3.86 0.40 0.00 -0.34 0.00 0.00 43.02 39.22 3hhs s PHE 579 CO 0.00 -2.91 1.33 0.00 -1.46 0.00 0.00 175.22 172.18 3hhs n GLY 581 N -0.64 -1.01 3.77 0.00 0.00 -1.26 -4.95 105.19 101.09 3hhs n GLY 581 Ca -0.03 -0.54 -0.40 0.00 0.00 0.00 0.00 46.02 45.05 3hhs n GLY 581 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hhs n GLY 583 N 0.75 4.42 3.76 0.00 0.00 -1.26 -4.80 105.19 108.06 3hhs n GLY 583 Ca 0.01 -1.14 -0.41 0.00 0.00 0.00 0.00 46.02 44.49 3hhs n GLY 583 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3hhs s TRP 584 N -2.00 2.92 0.26 1.61 -0.11 -0.80 -4.55 118.94 116.28 3hhs s TRP 584 Ca 0.00 1.23 -0.30 0.00 1.22 0.00 0.00 56.10 58.25 3hhs s TRP 584 Cb 0.00 -3.81 -0.10 0.00 -1.50 0.00 0.00 33.47 28.06 3hhs s TRP 584 CO 0.00 -2.40 1.29 -1.25 -4.62 0.00 0.00 176.95 169.97 3hhs s PRO 585 N -1.43 4.40 0.48 5.86 0.04 -1.26 -1.08 135.00 142.01 3hhs s PRO 585 Ca 0.53 2.11 0.14 0.00 0.04 0.00 0.00 61.00 63.82 3hhs s PRO 585 Cb -0.42 -3.14 1.14 0.00 0.04 0.00 0.00 34.50 32.12 3hhs s PRO 585 CO 0.52 -0.18 2.08 1.25 0.04 0.00 0.00 177.00 180.71 3hhs h HIS 586 N 4.41 0.20 0.00 0.56 2.76 -1.72 -1.54 115.15 119.82 3hhs h HIS 586 Ca -0.47 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.71 3hhs h HIS 586 Cb 1.22 -0.07 0.00 0.00 1.55 0.00 0.00 27.41 30.11 3hhs h HIS 586 CO 0.59 0.12 0.00 1.12 -1.30 0.00 0.00 177.93 178.46 3hhs h HIS 587 N 0.21 0.00 -0.47 5.26 2.07 -1.88 -2.00 115.15 118.35 3hhs h HIS 587 Ca 0.11 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.63 3hhs h HIS 587 Cb 0.18 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.16 3hhs h HIS 587 CO -0.00 0.00 0.00 -1.33 -3.07 0.00 0.00 177.93 173.53 3hhs n MET 588 N -2.46 4.18 -0.32 5.12 2.00 -0.58 -3.93 117.12 121.14 3hhs n MET 588 Ca 0.02 -3.05 -0.02 0.00 0.00 0.00 0.00 57.70 54.65 3hhs n MET 588 Cb 0.28 -2.11 0.10 0.00 0.00 0.00 0.00 33.22 31.49 3hhs n MET 588 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 175.97 177.22 3hhs h LEU 589 N 3.22 0.96 -9.03 4.03 5.85 -1.38 -3.43 115.31 115.53 3hhs h LEU 589 Ca 0.00 -0.02 -0.68 0.00 0.84 0.00 0.00 57.88 58.02 3hhs h LEU 589 Cb 1.78 -0.23 -0.20 0.00 0.37 0.00 0.00 40.66 42.38 3hhs h LEU 589 CO 0.39 0.67 -0.79 0.27 -0.34 0.00 0.00 178.44 178.65 3hhs s ILE 590 N -6.11 2.94 0.82 4.05 -4.36 -1.26 -5.00 121.20 112.28 3hhs s ILE 590 Ca -0.13 -1.20 -0.14 0.00 -0.26 0.00 0.00 60.65 58.92 3hhs s ILE 590 Cb 0.17 -2.27 0.03 0.00 1.25 0.00 0.00 42.46 41.63 3hhs s ILE 590 CO 0.80 0.29 0.72 -2.65 0.24 0.00 0.00 174.94 174.33 3hhs n PRO 591 N 1.36 0.07 -0.30 0.37 -0.02 -1.26 -4.91 135.00 130.31 3hhs n PRO 591 Ca -0.16 0.08 0.11 0.00 -2.02 0.00 0.00 63.50 61.51 3hhs n PRO 591 Cb 0.52 -2.04 0.34 0.00 -0.02 0.00 0.00 33.50 32.30 3hhs n PRO 591 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 3hhs h LYS 592 N -0.94 0.75 0.00 -0.52 3.64 -1.94 -3.48 116.57 114.08 3hhs h LYS 592 Ca -0.45 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 58.88 3hhs h LYS 592 Cb 1.31 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.96 3hhs h LYS 592 CO 0.41 0.50 0.00 0.41 -2.27 0.00 0.00 179.45 178.50 3hhs n GLY 593 N -1.40 -0.33 3.23 5.01 0.00 -1.26 -4.07 105.19 106.36 3hhs n GLY 593 Ca 0.18 -1.07 -0.13 0.00 0.00 0.00 0.00 46.02 45.00 3hhs n GLY 593 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3hhs s THR 594 N 0.00 0.24 0.33 2.61 -4.23 -1.05 -4.71 115.64 108.83 3hhs s THR 594 Ca 0.00 -1.99 0.04 0.00 -1.18 0.00 0.00 61.69 58.56 3hhs s THR 594 Cb 0.00 -2.45 0.17 0.00 1.34 0.00 0.00 72.50 71.56 3hhs s THR 594 CO 0.00 -0.11 1.88 0.00 -0.54 0.00 0.00 174.62 175.86 3hhs h ALA 595 N 2.59 1.37 0.00 3.99 0.00 -1.88 0.79 119.26 126.12 3hhs h ALA 595 Ca -0.37 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.36 3hhs h ALA 595 Cb 1.24 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.87 3hhs h ALA 595 CO 0.57 0.44 -0.23 1.04 0.00 0.00 0.00 179.25 181.07 3hhs n GLN 596 N -4.29 0.05 -0.01 0.00 3.00 -1.26 -4.67 117.38 110.20 3hhs n GLN 596 Ca 0.02 0.03 0.00 0.00 -0.01 0.00 0.00 57.00 57.04 3hhs n GLN 596 Cb 0.23 -1.55 0.00 0.00 0.00 0.00 0.00 30.24 28.92 3hhs n GLN 596 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3hhs n GLY 597 N 1.47 1.04 3.60 1.08 0.00 -0.91 -5.04 105.19 106.43 3hhs n GLY 597 Ca 0.06 -1.11 -0.39 0.00 0.00 0.00 0.00 46.02 44.58 3hhs n GLY 597 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3hhs s TYR 598 N 0.00 3.24 -0.08 1.61 5.04 -0.09 -4.81 117.35 122.27 3hhs s TYR 598 Ca 0.00 0.36 -0.30 0.00 -2.44 0.00 0.00 57.07 54.70 3hhs s TYR 598 Cb 0.00 -2.54 -0.02 0.00 0.35 0.00 0.00 41.96 39.75 3hhs s TYR 598 CO 0.00 -0.21 1.10 -1.25 -1.34 0.00 0.00 175.55 173.84 3hhs s PRO 599 N 2.00 4.39 0.20 4.97 0.04 -1.26 -0.58 135.00 144.77 3hhs s PRO 599 Ca 0.14 1.52 0.05 0.00 0.04 0.00 0.00 61.00 62.75 3hhs s PRO 599 Cb -0.16 -3.54 -0.05 0.00 0.04 0.00 0.00 34.50 30.79 3hhs s PRO 599 CO 0.10 -0.37 -0.06 0.14 0.04 0.00 0.00 177.00 176.85 3hhs s VAL 600 N 2.06 1.22 -0.17 -0.36 -7.23 -0.33 -2.17 120.40 113.42 3hhs s VAL 600 Ca 0.52 -2.07 -0.05 0.00 -1.81 0.00 0.00 61.98 58.57 3hhs s VAL 600 Cb -0.21 -2.12 -0.03 0.00 0.56 0.00 0.00 36.38 34.58 3hhs s VAL 600 CO 0.20 -0.53 -0.01 0.54 -0.31 0.00 0.00 175.10 175.00 3hhs s VAL 601 N -3.30 4.11 -0.14 1.32 0.11 0.83 -0.89 120.40 122.45 3hhs s VAL 601 Ca 0.23 -0.28 -0.16 0.00 -2.93 0.00 0.00 61.98 58.84 3hhs s VAL 601 Cb 0.03 -2.83 -0.04 0.00 -1.53 0.00 0.00 36.38 32.02 3hhs s VAL 601 CO 0.05 0.47 0.40 -0.22 -3.33 0.00 0.00 175.10 172.48 3hhs s LEU 602 N 0.51 4.26 -0.03 2.54 2.96 0.16 -1.45 118.68 127.62 3hhs s LEU 602 Ca -0.01 0.69 0.07 0.00 -0.22 0.00 0.00 54.13 54.65 3hhs s LEU 602 Cb -0.14 -2.56 -0.01 0.00 0.50 0.00 0.00 46.19 43.97 3hhs s LEU 602 CO 0.02 0.04 -0.23 0.12 -1.32 0.00 0.00 176.35 174.98 3hhs s PHE 603 N 0.57 2.14 -0.01 5.38 2.19 0.89 -1.31 117.98 127.82 3hhs s PHE 603 Ca 0.22 -0.49 0.05 0.00 0.33 0.00 0.00 56.93 57.03 3hhs s PHE 603 Cb -0.14 -1.39 -0.01 0.00 -1.31 0.00 0.00 43.02 40.16 3hhs s PHE 603 CO 0.08 -0.10 -0.15 0.54 1.83 0.00 0.00 175.22 177.41 3hhs s VAL 604 N -0.38 1.22 -0.02 3.12 0.11 -0.14 -1.59 120.40 122.73 3hhs s VAL 604 Ca 0.04 -0.66 0.05 0.00 -2.93 0.00 0.00 61.98 58.49 3hhs s VAL 604 Cb -0.11 -1.02 -0.01 0.00 -1.53 0.00 0.00 36.38 33.72 3hhs s VAL 604 CO 0.01 0.35 -0.18 -0.32 -3.33 0.00 0.00 175.10 171.62 3hhs s MET 605 N -0.34 1.51 -0.32 1.54 0.00 -0.61 -1.02 119.30 120.06 3hhs s MET 605 Ca 0.06 -0.64 -0.03 0.00 0.00 0.00 0.00 55.69 55.08 3hhs s MET 605 Cb -0.06 -1.43 0.05 0.00 0.00 0.00 0.00 34.83 33.39 3hhs s MET 605 CO -0.01 0.36 0.04 0.42 0.00 0.00 0.00 175.02 175.84 3hhs s ILE 606 N -0.35 3.22 0.45 10.11 1.01 -0.42 -0.38 121.20 134.85 3hhs s ILE 606 Ca 0.05 -1.37 0.04 0.00 0.00 0.00 0.00 60.65 59.37 3hhs s ILE 606 Cb -0.08 -2.87 0.01 0.00 0.01 0.00 0.00 42.46 39.53 3hhs s ILE 606 CO -0.00 -0.17 0.63 -0.94 0.00 0.00 0.00 174.94 174.46 3hhs s SER 607 N 1.34 5.65 -0.38 3.58 1.04 -0.47 -4.73 113.70 119.73 3hhs s SER 607 Ca -0.03 -0.09 -0.29 0.00 0.48 0.00 0.00 55.95 56.02 3hhs s SER 607 Cb -0.20 -1.04 0.00 0.00 0.10 0.00 0.00 66.02 64.89 3hhs s SER 607 CO -0.00 -0.79 1.46 0.21 0.98 0.00 0.00 173.24 175.10 3hhs s ASN 608 N -4.30 6.32 0.46 7.02 3.84 -1.26 -0.95 114.94 126.06 3hhs s ASN 608 Ca 0.52 0.97 0.14 0.00 0.21 0.00 0.00 52.86 54.70 3hhs s ASN 608 Cb -0.10 -2.54 1.08 0.00 -0.55 0.00 0.00 41.25 39.15 3hhs s ASN 608 CO 0.35 -1.42 2.03 -0.25 -2.79 0.00 0.00 177.10 175.02 3hhs h TRP 609 N 10.83 0.31 -0.77 0.43 7.01 -1.67 -0.54 115.95 131.55 3hhs h TRP 609 Ca -0.28 0.01 0.12 0.00 2.11 0.00 0.00 58.89 60.85 3hhs h TRP 609 Cb 1.11 -0.10 -0.05 0.00 -2.10 0.00 0.00 29.16 28.02 3hhs h TRP 609 CO 0.96 0.17 0.51 -0.91 -2.79 0.00 0.00 178.44 176.37 3hhs h ASN 610 N 0.31 0.53 0.06 2.65 4.21 -1.91 -0.13 115.58 121.30 3hhs h ASN 610 Ca 0.19 0.02 0.00 0.00 1.21 0.00 0.00 56.30 57.73 3hhs h ASN 610 Cb 0.37 -0.09 0.00 0.00 -1.12 0.00 0.00 38.32 37.48 3hhs h ASN 610 CO -0.04 0.29 -0.13 0.59 -1.29 0.00 0.00 177.43 176.85 3hhs n ASN 611 N -4.50 1.64 -0.07 5.81 3.02 -0.22 -4.35 115.26 116.59 3hhs n ASN 611 Ca 0.14 -1.39 -0.09 0.00 -0.03 0.00 0.00 54.58 53.21 3hhs n ASN 611 Cb 0.43 0.09 -0.07 0.00 -0.61 0.00 0.00 39.78 39.63 3hhs n ASN 611 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3hhs n ASP 612 N 0.08 2.80 -4.72 6.41 8.00 -0.65 -4.66 116.55 123.80 3hhs n ASP 612 Ca 0.15 -0.06 -0.33 0.00 0.71 0.00 0.00 54.79 55.26 3hhs n ASP 612 Cb 0.40 0.01 0.10 0.00 -0.02 0.00 0.00 41.12 41.61 3hhs n ASP 612 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3hhs s ARG 613 N -2.27 2.05 -0.12 -1.24 1.70 -0.15 0.58 118.95 119.50 3hhs s ARG 613 Ca -0.15 1.66 0.01 0.00 -0.47 0.00 0.00 55.73 56.77 3hhs s ARG 613 Cb 0.04 -1.83 0.02 0.00 -0.57 0.00 0.00 34.95 32.61 3hhs s ARG 613 CO 0.35 -1.88 -0.14 0.42 -1.08 0.00 0.00 175.30 172.97 3hhs s ILE 614 N -2.17 1.42 -0.20 4.99 -1.09 -1.26 -4.69 121.20 118.20 3hhs s ILE 614 Ca 0.72 -0.58 -0.28 0.00 -2.23 0.00 0.00 60.65 58.28 3hhs s ILE 614 Cb -0.27 -1.32 0.00 0.00 -1.58 0.00 0.00 42.46 39.29 3hhs s ILE 614 CO 0.47 0.43 0.97 -0.70 -1.23 0.00 0.00 174.94 174.88 3hhs s GLU 615 N 1.18 4.28 0.03 2.79 2.12 -1.26 -4.97 118.70 122.87 3hhs s GLU 615 Ca -0.03 1.25 -0.28 0.00 0.36 0.00 0.00 54.97 56.28 3hhs s GLU 615 Cb -0.14 -3.61 0.10 0.00 0.26 0.00 0.00 34.13 30.73 3hhs s GLU 615 CO -0.04 -0.52 0.83 1.14 -0.54 0.00 0.00 175.26 176.14 3hhs s GLN 616 N 2.79 0.90 0.00 4.30 -2.07 -1.26 -5.12 119.66 119.21 3hhs s GLN 616 Ca 0.43 -0.33 0.00 0.00 -1.82 0.00 0.00 55.36 53.63 3hhs s GLN 616 Cb -0.16 0.42 0.00 0.00 -1.09 0.00 0.00 33.01 32.18 3hhs s GLN 616 CO 0.09 -0.40 0.00 -3.47 -1.32 0.00 0.00 175.29 170.20 3hhs n ASP 617 N -0.27 0.00 -3.29 12.60 -0.08 -1.26 -5.18 116.55 119.07 3hhs n ASP 617 Ca -0.10 0.00 -0.07 0.00 -1.51 0.00 0.00 54.79 53.11 3hhs n ASP 617 Cb 0.62 0.00 -0.02 0.00 2.34 0.00 0.00 41.12 44.07 3hhs n ASP 617 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 3hhs n GLY 620 N 3.53 0.90 3.87 0.27 0.00 -1.26 -5.10 105.19 107.40 3hhs n GLY 620 Ca 0.00 -0.14 -0.37 0.00 0.00 0.00 0.00 46.02 45.51 3hhs n GLY 620 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3hhs s SER 621 N 4.02 6.47 -0.35 1.61 0.01 -1.26 -5.05 113.70 119.15 3hhs s SER 621 Ca 0.10 0.56 -0.28 0.00 1.31 0.00 0.00 55.95 57.64 3hhs s SER 621 Cb 0.02 -2.11 -0.02 0.00 0.21 0.00 0.00 66.02 64.13 3hhs s SER 621 CO 0.05 0.39 1.76 0.00 0.41 0.00 0.00 173.24 175.85 3hhs n ASN 623 N 10.19 2.78 -4.68 0.00 2.85 -1.26 -4.48 115.26 120.67 3hhs n ASN 623 Ca 0.22 -2.74 -0.46 0.00 -0.11 0.00 0.00 54.58 51.49 3hhs n ASN 623 Cb 0.47 -0.36 -0.04 0.00 1.24 0.00 0.00 39.78 41.09 3hhs n ASN 623 CO 0.00 0.00 0.00 0.47 -2.11 0.00 0.00 177.26 175.62 3hhs n ASP 624 N -0.78 3.25 -1.52 1.20 9.92 -1.26 -4.03 116.55 123.33 3hhs n ASP 624 Ca 0.14 1.07 -0.11 0.00 -0.53 0.00 0.00 54.79 55.36 3hhs n ASP 624 Cb 0.61 -1.44 0.01 0.00 -0.64 0.00 0.00 41.12 39.66 3hhs n ASP 624 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3hhs n ALA 625 N 3.71 -0.44 0.23 2.24 0.00 -1.24 -4.91 120.51 120.09 3hhs n ALA 625 Ca 0.17 0.13 0.08 0.00 0.00 0.00 0.00 53.44 53.82 3hhs n ALA 625 Cb 0.30 -2.01 0.54 0.00 0.00 0.00 0.00 19.45 18.28 3hhs n ALA 625 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hhs h ALA 626 N 0.49 1.36 -0.32 0.00 0.00 -1.54 -2.83 119.26 116.42 3hhs h ALA 626 Ca -0.26 -0.20 0.06 0.00 0.00 0.00 0.00 54.91 54.51 3hhs h ALA 626 Cb 1.18 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.87 3hhs h ALA 626 CO 0.28 0.28 -0.09 0.77 0.00 0.00 0.00 179.25 180.49 3hhs h SER 627 N 0.00 -0.32 0.00 0.00 0.02 -1.69 0.70 113.55 112.27 3hhs h SER 627 Ca -0.00 0.10 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 3hhs h SER 627 Cb 0.48 0.20 0.00 0.00 0.14 0.00 0.00 62.40 63.22 3hhs h SER 627 CO 0.03 -0.11 -1.18 -1.22 -1.14 0.00 0.00 176.83 173.21 3hhs n TYR 628 N -5.27 0.00 0.05 3.45 4.01 -1.23 -4.61 117.16 113.56 3hhs n TYR 628 Ca 0.00 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.75 3hhs n TYR 628 Cb 0.19 -0.10 -0.00 0.00 -0.31 0.00 0.00 39.34 39.11 3hhs n TYR 628 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3hhs n GLY 630 N 0.76 0.95 3.06 0.00 0.00 0.23 -4.64 105.19 105.54 3hhs n GLY 630 Ca 0.00 -0.69 -0.30 0.00 0.00 0.00 0.00 46.02 45.03 3hhs n GLY 630 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hhs s ILE 631 N 0.00 1.69 -0.03 -0.61 1.01 -1.26 -4.09 121.20 117.90 3hhs s ILE 631 Ca 0.00 -0.72 -0.35 0.00 0.00 0.00 0.00 60.65 59.58 3hhs s ILE 631 Cb 0.00 -1.55 -0.13 0.00 0.01 0.00 0.00 42.46 40.78 3hhs s ILE 631 CO 0.00 0.48 1.73 -1.14 0.00 0.00 0.00 174.94 176.01 3hhs n ARG 632 N 4.54 1.91 -1.92 2.79 0.63 -1.26 -1.68 116.66 121.68 3hhs n ARG 632 Ca -0.18 0.70 -0.17 0.00 -0.92 0.00 0.00 57.85 57.27 3hhs n ARG 632 Cb 0.50 -2.48 -0.04 0.00 0.45 0.00 0.00 32.46 30.89 3hhs n ARG 632 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 3hhs n ASP 633 N 5.19 -5.09 -4.34 6.15 8.00 -1.26 -4.99 116.55 120.22 3hhs n ASP 633 Ca 0.21 0.21 -0.19 0.00 0.71 0.00 0.00 54.79 55.73 3hhs n ASP 633 Cb 0.26 -4.14 -0.10 0.00 -0.02 0.00 0.00 41.12 37.11 3hhs n ASP 633 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 3hhs s ARG 634 N -4.17 1.55 0.37 -1.24 1.81 -0.68 -5.10 118.95 111.49 3hhs s ARG 634 Ca 0.00 -1.86 -0.27 0.00 -1.72 0.00 0.00 55.73 51.89 3hhs s ARG 634 Cb 0.00 -0.51 -0.09 0.00 -0.45 0.00 0.00 34.95 33.90 3hhs s ARG 634 CO 0.00 -0.27 1.22 0.15 -0.68 0.00 0.00 175.30 175.72 3hhs s LYS 635 N -3.95 4.17 0.02 3.54 1.02 -1.26 -4.57 119.74 118.71 3hhs s LYS 635 Ca 0.36 1.99 -0.33 0.00 0.02 0.00 0.00 55.97 58.02 3hhs s LYS 635 Cb 0.08 -2.84 -0.11 0.00 -0.52 0.00 0.00 37.83 34.43 3hhs s LYS 635 CO 0.15 -0.27 1.85 0.98 -0.92 0.00 0.00 175.35 177.14 3hhs n TYR 636 N 0.38 2.43 0.20 3.18 9.36 -1.26 -4.61 117.16 126.83 3hhs n TYR 636 Ca 0.03 -0.09 0.00 0.00 3.32 0.00 0.00 57.90 61.16 3hhs n TYR 636 Cb 0.45 -2.70 0.00 0.00 -0.63 0.00 0.00 39.34 36.46 3hhs n TYR 636 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 3hhs n PRO 637 N 6.17 0.99 -3.59 2.98 -0.04 -1.26 -4.61 135.00 135.64 3hhs n PRO 637 Ca 0.20 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.62 3hhs n PRO 637 Cb 0.34 -1.01 -0.06 0.00 -0.04 0.00 0.00 33.50 32.73 3hhs n PRO 637 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 3hhs s ASP 638 N 1.53 -0.69 0.43 3.54 2.15 -1.26 -4.58 116.67 117.79 3hhs s ASP 638 Ca 0.00 1.18 0.21 0.00 0.43 0.00 0.00 52.55 54.37 3hhs s ASP 638 Cb 0.00 1.81 0.94 0.00 -0.30 0.00 0.00 42.92 45.37 3hhs s ASP 638 CO 0.00 -0.23 1.86 0.50 -0.17 0.00 0.00 175.17 177.12 3hhs h LYS 639 N 8.09 0.00 -7.21 4.34 3.64 -0.12 -3.45 116.57 121.86 3hhs h LYS 639 Ca -0.17 0.00 -0.52 0.00 -1.27 0.00 0.00 60.65 58.69 3hhs h LYS 639 Cb 1.11 0.00 0.13 0.00 -0.41 0.00 0.00 32.23 33.06 3hhs h LYS 639 CO 0.13 0.27 0.36 -0.65 -2.27 0.00 0.00 179.45 177.30 3hhs s GLN 640 N -3.86 2.37 0.37 1.90 -1.52 -1.26 -4.97 119.66 112.68 3hhs s GLN 640 Ca -0.01 1.52 -0.26 0.00 -1.95 0.00 0.00 55.36 54.66 3hhs s GLN 640 Cb 0.12 -1.88 -0.12 0.00 -0.22 0.00 0.00 33.01 30.91 3hhs s GLN 640 CO 0.65 -1.61 1.09 0.00 -0.25 0.00 0.00 175.29 175.17 3hhs n ALA 641 N -2.77 0.40 -1.79 6.09 0.00 -1.26 -4.89 120.51 116.29 3hhs n ALA 641 Ca 0.11 0.30 -0.42 0.00 0.00 0.00 0.00 53.44 53.43 3hhs n ALA 641 Cb 0.51 -2.12 -0.03 0.00 0.00 0.00 0.00 19.45 17.82 3hhs n ALA 641 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 3hhs s MET 642 N -1.89 4.16 0.00 0.00 -1.94 -1.26 -1.82 119.30 116.55 3hhs s MET 642 Ca 0.60 2.49 0.00 0.00 -1.71 0.00 0.00 55.69 57.07 3hhs s MET 642 Cb -0.59 -3.75 0.00 0.00 2.01 0.00 0.00 34.83 32.50 3hhs s MET 642 CO 0.59 -0.83 0.00 0.41 -0.01 0.00 0.00 175.02 175.17 3hhs n GLY 643 N 4.22 0.69 3.63 -0.03 0.00 -1.26 -4.77 105.19 107.66 3hhs n GLY 643 Ca 0.18 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.74 3hhs n GLY 643 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3hhs n TYR 644 N -2.06 1.68 -0.36 1.61 9.36 -0.75 -0.22 117.16 126.43 3hhs n TYR 644 Ca 0.00 0.60 0.05 0.00 3.32 0.00 0.00 57.90 61.87 3hhs n TYR 644 Cb 0.00 -2.34 0.29 0.00 -0.63 0.00 0.00 39.34 36.66 3hhs n TYR 644 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 3hhs n PRO 645 N 1.35 3.80 -0.11 2.98 -0.04 -1.26 -4.95 135.00 136.76 3hhs n PRO 645 Ca 0.11 -2.29 0.12 0.00 -0.04 0.00 0.00 63.50 61.40 3hhs n PRO 645 Cb 0.31 -2.04 0.19 0.00 -0.04 0.00 0.00 33.50 31.92 3hhs n PRO 645 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3hhs n PHE 646 N 0.48 0.29 0.13 0.54 3.72 0.69 -4.49 117.46 118.83 3hhs n PHE 646 Ca 0.20 -0.14 0.01 0.00 -0.05 0.00 0.00 57.45 57.47 3hhs n PHE 646 Cb 0.93 0.00 0.08 0.00 -0.94 0.00 0.00 39.48 39.55 3hhs n PHE 646 CO 0.00 0.00 0.00 0.38 -0.05 0.00 0.00 176.76 177.09 3hhs h ASP 647 N 4.37 0.00 -1.97 4.37 2.03 -1.85 -3.44 116.42 119.93 3hhs h ASP 647 Ca 0.00 0.00 -0.45 0.00 -0.73 0.00 0.00 57.03 55.85 3hhs h ASP 647 Cb 0.95 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 39.44 3hhs h ASP 647 CO 0.00 0.58 -0.39 -0.13 -1.03 0.00 0.00 179.24 178.27 3hhs s ARG 648 N -3.10 3.21 0.63 4.15 0.52 -1.26 -4.71 118.95 118.39 3hhs s ARG 648 Ca 0.02 -0.93 0.02 0.00 -0.52 0.00 0.00 55.73 54.32 3hhs s ARG 648 Cb 0.09 -2.82 0.09 0.00 0.52 0.00 0.00 34.95 32.83 3hhs s ARG 648 CO 0.75 0.22 0.87 -1.59 0.02 0.00 0.00 175.30 175.57 3hhs s LYS 649 N -4.07 2.09 0.20 3.54 -2.85 -1.26 -4.99 119.74 112.38 3hhs s LYS 649 Ca 0.40 -1.13 0.01 0.00 -1.00 0.00 0.00 55.97 54.25 3hhs s LYS 649 Cb -0.09 -2.46 -0.04 0.00 -2.06 0.00 0.00 37.83 33.19 3hhs s LYS 649 CO 0.30 -1.08 0.36 -1.64 0.10 0.00 0.00 175.35 173.39 3hhs s MET 650 N -4.91 3.49 0.31 1.78 -1.94 -1.26 -4.35 119.30 112.42 3hhs s MET 650 Ca 0.62 -0.44 -0.00 0.00 -1.71 0.00 0.00 55.69 54.16 3hhs s MET 650 Cb -0.07 -2.87 0.50 0.00 2.01 0.00 0.00 34.83 34.40 3hhs s MET 650 CO 0.41 0.43 1.95 0.00 -0.01 0.00 0.00 175.02 177.80 3hhs h ALA 651 N 1.93 1.41 -2.51 3.03 0.00 -1.98 -3.40 119.26 117.74 3hhs h ALA 651 Ca -0.48 -0.09 -0.63 0.00 0.00 0.00 0.00 54.91 53.71 3hhs h ALA 651 Cb 1.20 -0.28 -0.14 0.00 0.00 0.00 0.00 17.79 18.57 3hhs h ALA 651 CO 0.67 0.50 -0.03 1.21 0.00 0.00 0.00 179.25 181.60 3hhs s ASN 652 N -6.43 6.37 0.22 0.00 3.84 -1.26 -4.93 114.94 112.75 3hhs s ASN 652 Ca -0.11 0.23 0.24 0.00 0.21 0.00 0.00 52.86 53.43 3hhs s ASN 652 Cb 0.17 -2.27 0.92 0.00 -0.55 0.00 0.00 41.25 39.51 3hhs s ASN 652 CO 0.78 -0.39 1.73 0.47 -2.79 0.00 0.00 177.10 176.90 3hhs n ASP 653 N 5.66 0.65 -0.05 -4.21 8.00 -1.26 -1.66 116.55 123.68 3hhs n ASP 653 Ca -0.04 0.62 0.11 0.00 0.71 0.00 0.00 54.79 56.19 3hhs n ASP 653 Cb 0.49 -0.77 0.12 0.00 -0.02 0.00 0.00 41.12 40.94 3hhs n ASP 653 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3hhs n ALA 654 N -1.75 3.93 -1.76 2.24 0.00 -1.26 -4.78 120.51 117.12 3hhs n ALA 654 Ca 0.03 -0.46 -0.39 0.00 0.00 0.00 0.00 53.44 52.63 3hhs n ALA 654 Cb 0.30 -0.98 0.01 0.00 0.00 0.00 0.00 19.45 18.77 3hhs n ALA 654 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hhs s ALA 655 N -2.93 3.13 0.45 0.00 0.00 -0.66 -4.84 121.76 116.90 3hhs s ALA 655 Ca 0.12 1.32 0.07 0.00 0.00 0.00 0.00 51.96 53.46 3hhs s ALA 655 Cb 0.17 -3.53 -0.02 0.00 0.00 0.00 0.00 23.12 19.74 3hhs s ALA 655 CO 0.74 -1.07 0.30 0.95 0.00 0.00 0.00 175.76 176.67 3hhs s THR 656 N -1.27 2.24 0.26 0.00 -4.23 -1.26 0.33 115.64 111.70 3hhs s THR 656 Ca 0.62 -1.54 -0.05 0.00 -1.18 0.00 0.00 61.69 59.55 3hhs s THR 656 Cb -0.40 -2.78 0.26 0.00 1.34 0.00 0.00 72.50 70.93 3hhs s THR 656 CO 0.50 0.00 1.91 0.25 -0.54 0.00 0.00 174.62 176.74 3hhs h LEU 657 N 1.13 1.12 -1.25 4.79 5.85 -1.88 -0.99 115.31 124.08 3hhs h LEU 657 Ca -0.41 -0.02 0.09 0.00 0.84 0.00 0.00 57.88 58.39 3hhs h LEU 657 Cb 1.27 -0.26 -0.06 0.00 0.37 0.00 0.00 40.66 41.98 3hhs h LEU 657 CO 0.63 0.78 0.56 0.77 -0.34 0.00 0.00 178.44 180.83 3hhs h SER 658 N 1.30 0.76 0.47 1.25 4.64 -1.97 -1.80 113.55 118.20 3hhs h SER 658 Ca 0.39 0.02 -0.06 0.00 -0.47 0.00 0.00 61.79 61.67 3hhs h SER 658 Cb -0.05 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 61.89 3hhs h SER 658 CO -0.11 0.46 -0.29 0.44 -0.87 0.00 0.00 176.83 176.45 3hhs h ASP 659 N 0.85 0.00 -0.36 4.97 3.32 -1.58 -2.85 116.42 120.77 3hhs h ASP 659 Ca 0.39 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 57.33 3hhs h ASP 659 Cb 0.39 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.93 3hhs h ASP 659 CO -0.16 0.29 -0.18 0.15 -1.72 0.00 0.00 179.24 177.63 3hhs h PHE 660 N 0.00 0.94 -3.42 4.55 3.57 -0.98 -3.47 116.94 118.13 3hhs h PHE 660 Ca -0.00 -0.20 -0.53 0.00 3.53 0.00 0.00 57.97 60.77 3hhs h PHE 660 Cb 0.61 -0.23 0.07 0.00 2.79 0.00 0.00 35.95 39.19 3hhs h PHE 660 CO 0.00 0.95 0.81 -0.51 -2.23 0.00 0.00 178.31 177.33 3hhs s LEU 661 N -9.00 4.36 0.40 0.59 1.43 -1.08 -5.01 118.68 110.38 3hhs s LEU 661 Ca -0.10 2.83 0.08 0.00 -1.03 0.00 0.00 54.13 55.91 3hhs s LEU 661 Cb 0.13 -3.63 -0.05 0.00 0.03 0.00 0.00 46.19 42.67 3hhs s LEU 661 CO 0.84 -0.81 0.19 -0.13 0.23 0.00 0.00 176.35 176.68 3hhs s ARG 662 N -0.63 2.29 0.65 1.70 1.81 -1.26 -5.02 118.95 118.48 3hhs s ARG 662 Ca 0.60 -1.74 0.40 0.00 -1.72 0.00 0.00 55.73 53.27 3hhs s ARG 662 Cb -0.45 -2.07 2.25 0.00 -0.45 0.00 0.00 34.95 34.23 3hhs s ARG 662 CO 0.47 -0.07 2.33 -1.35 -0.68 0.00 0.00 175.30 176.00 3hhs h PRO 663 N 1.42 0.00 -0.73 3.54 0.11 -1.95 -1.17 132.00 133.22 3hhs h PRO 663 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 3hhs h PRO 663 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3hhs h PRO 663 CO 0.67 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.73 3hhs n ASN 664 N -3.28 3.83 -4.23 -2.05 6.94 -1.25 -0.85 115.26 114.37 3hhs n ASN 664 Ca -0.03 -2.54 -0.20 0.00 -0.02 0.00 0.00 54.58 51.79 3hhs n ASN 664 Cb 0.09 -0.60 -0.12 0.00 -2.36 0.00 0.00 39.78 36.79 3hhs n ASN 664 CO 0.00 0.00 0.00 -0.04 -1.03 0.00 0.00 177.26 176.19 3hhs s MET 665 N -2.05 0.98 0.01 -3.83 -1.94 -0.44 -1.30 119.30 110.74 3hhs s MET 665 Ca 0.33 -1.13 -0.11 0.00 -1.71 0.00 0.00 55.69 53.08 3hhs s MET 665 Cb 0.25 -1.01 0.01 0.00 2.01 0.00 0.00 34.83 36.09 3hhs s MET 665 CO 0.10 0.22 0.22 0.00 -0.01 0.00 0.00 175.02 175.55 3hhs s ALA 666 N -1.59 -0.50 0.15 3.03 0.00 -0.19 -4.69 121.76 117.97 3hhs s ALA 666 Ca 0.05 -0.02 0.09 0.00 0.00 0.00 0.00 51.96 52.07 3hhs s ALA 666 Cb -0.08 0.16 -0.04 0.00 0.00 0.00 0.00 23.12 23.16 3hhs s ALA 666 CO 0.03 -0.28 -0.20 0.14 0.00 0.00 0.00 175.76 175.45 3hhs s VAL 667 N -1.76 1.87 -0.08 0.00 -7.23 -1.26 -0.96 120.40 110.98 3hhs s VAL 667 Ca -0.11 -1.83 -0.05 0.00 -1.81 0.00 0.00 61.98 58.18 3hhs s VAL 667 Cb -0.05 -1.81 0.03 0.00 0.56 0.00 0.00 36.38 35.11 3hhs s VAL 667 CO 0.01 -0.21 0.19 -0.60 -0.31 0.00 0.00 175.10 174.17 3hhs s ARG 668 N -2.52 0.18 0.03 4.82 6.06 -0.43 -4.68 118.95 122.41 3hhs s ARG 668 Ca 0.14 0.34 -0.30 0.00 -2.50 0.00 0.00 55.73 53.41 3hhs s ARG 668 Cb -0.07 -0.01 -0.05 0.00 0.06 0.00 0.00 34.95 34.87 3hhs s ARG 668 CO 0.06 -0.09 1.23 -0.51 -2.50 0.00 0.00 175.30 173.49 3hhs s ASP 669 N 0.61 7.04 0.21 -2.12 -0.00 -1.26 -0.67 116.67 120.47 3hhs s ASP 669 Ca -0.04 2.00 0.07 0.00 -0.00 0.00 0.00 52.55 54.58 3hhs s ASP 669 Cb -0.06 -2.57 -0.05 0.00 -0.00 0.00 0.00 42.92 40.24 3hhs s ASP 669 CO -0.03 -0.53 -0.13 0.00 -0.00 0.00 0.00 175.17 174.48 3hhs s SER 671 N -3.31 2.94 -0.35 0.00 0.15 -0.48 -1.18 113.70 111.47 3hhs s SER 671 Ca 0.23 -0.48 -0.09 0.00 0.70 0.00 0.00 55.95 56.31 3hhs s SER 671 Cb 0.00 -0.70 0.03 0.00 -1.71 0.00 0.00 66.02 63.64 3hhs s SER 671 CO 0.07 0.25 0.15 -0.63 1.20 0.00 0.00 173.24 174.28 3hhs s ILE 672 N -0.24 4.23 -0.34 6.45 1.01 0.26 -0.71 121.20 131.86 3hhs s ILE 672 Ca -0.01 -0.90 -0.10 0.00 0.00 0.00 0.00 60.65 59.64 3hhs s ILE 672 Cb -0.13 -3.34 0.01 0.00 0.01 0.00 0.00 42.46 39.01 3hhs s ILE 672 CO 0.02 -0.16 0.18 -1.58 0.00 0.00 0.00 174.94 173.41 3hhs s GLN 673 N 1.50 3.12 -0.08 2.79 0.74 0.18 -0.91 119.66 127.00 3hhs s GLN 673 Ca 0.01 -0.87 -0.26 0.00 0.05 0.00 0.00 55.36 54.28 3hhs s GLN 673 Cb -0.19 -3.65 -0.03 0.00 1.10 0.00 0.00 33.01 30.24 3hhs s GLN 673 CO 0.05 -0.54 0.83 0.12 -0.55 0.00 0.00 175.29 175.20 3hhs s PHE 674 N 1.59 3.55 -0.27 1.67 5.36 0.22 -1.85 117.98 128.26 3hhs s PHE 674 Ca 0.04 1.39 -0.09 0.00 -0.96 0.00 0.00 56.93 57.31 3hhs s PHE 674 Cb -0.18 -2.97 -0.03 0.00 -0.34 0.00 0.00 43.02 39.49 3hhs s PHE 674 CO 0.07 -0.06 0.12 -1.12 -1.46 0.00 0.00 175.22 172.77 3hhs s SER 675 N 0.98 5.48 -1.22 6.13 0.01 -0.20 -4.08 113.70 120.80 3hhs s SER 675 Ca 0.42 -0.16 -0.13 0.00 1.31 0.00 0.00 55.95 57.39 3hhs s SER 675 Cb -0.18 -2.00 -0.06 0.00 0.21 0.00 0.00 66.02 63.99 3hhs s SER 675 CO 0.19 -0.05 2.32 -0.67 0.41 0.00 0.00 173.24 175.44 3hhs n ASP 676 N 4.98 5.04 -4.25 2.44 4.64 -1.26 -4.26 116.55 123.88 3hhs n ASP 676 Ca -0.15 -2.62 -0.15 0.00 -1.38 0.00 0.00 54.79 50.49 3hhs n ASP 676 Cb 0.51 -1.38 -0.10 0.00 -1.04 0.00 0.00 41.12 39.11 3hhs n ASP 676 CO 0.00 0.00 0.00 0.42 -0.82 0.00 0.00 177.20 176.80 3hhs s THR 677 N 3.40 1.21 -0.11 5.18 -4.23 -1.26 -5.04 115.64 114.78 3hhs s THR 677 Ca 0.53 -1.98 0.01 0.00 -1.18 0.00 0.00 61.69 59.07 3hhs s THR 677 Cb 0.14 -1.76 0.02 0.00 1.34 0.00 0.00 72.50 72.24 3hhs s THR 677 CO -0.02 -0.67 -0.12 -0.89 -0.54 0.00 0.00 174.62 172.37 3hhs s THR 678 N -3.04 1.33 0.37 3.99 2.01 -1.26 -0.94 115.64 118.10 3hhs s THR 678 Ca 0.15 -0.52 0.08 0.00 0.31 0.00 0.00 61.69 61.71 3hhs s THR 678 Cb 0.01 -1.25 -0.03 0.00 0.01 0.00 0.00 72.50 71.24 3hhs s THR 678 CO 0.01 0.41 0.29 0.68 -0.69 0.00 0.00 174.62 175.32 3hhs s VAL 679 N 1.25 3.05 -2.56 3.82 -7.23 -0.22 -4.97 120.40 113.54 3hhs s VAL 679 Ca -0.02 -1.44 0.28 0.00 -1.81 0.00 0.00 61.98 58.99 3hhs s VAL 679 Cb -0.14 -3.07 0.51 0.00 0.56 0.00 0.00 36.38 34.24 3hhs s VAL 679 CO -0.05 -0.10 1.69 -0.62 -0.31 0.00 0.00 175.10 175.71