#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x5a s LEU 2 N 0.00 2.88 0.10 3.17 1.02 -1.17 -5.01 118.68 119.67 2x5a s LEU 2 Ca 0.00 -0.41 -0.24 0.00 0.02 0.00 0.00 54.13 53.50 2x5a s LEU 2 Cb 0.00 -1.70 -0.07 0.00 0.02 0.00 0.00 46.19 44.44 2x5a s LEU 2 CO 0.00 0.20 0.72 -1.61 0.02 0.00 0.00 176.35 175.68 2x5a s GLU 3 N -1.97 4.45 -0.03 1.70 0.41 -1.25 -0.83 118.70 121.18 2x5a s GLU 3 Ca 0.19 1.01 0.03 0.00 -0.41 0.00 0.00 54.97 55.79 2x5a s GLU 3 Cb -0.11 -3.30 0.00 0.00 -1.78 0.00 0.00 34.13 28.95 2x5a s GLU 3 CO 0.11 0.48 -0.11 0.00 -0.49 0.00 0.00 175.26 175.24 2x5a s ALA 4 N -0.71 1.03 -0.25 5.21 0.00 0.66 -0.47 121.76 127.23 2x5a s ALA 4 Ca 0.35 -0.42 -0.07 0.00 0.00 0.00 0.00 51.96 51.82 2x5a s ALA 4 Cb -0.21 -0.37 -0.02 0.00 0.00 0.00 0.00 23.12 22.51 2x5a s ALA 4 CO 0.23 0.17 0.06 -0.80 0.00 0.00 0.00 175.76 175.42 2x5a s ASN 5 N 0.18 5.02 -0.27 0.00 -0.87 0.49 -1.33 114.94 118.17 2x5a s ASN 5 Ca -0.04 -0.25 -0.08 0.00 -1.57 0.00 0.00 52.86 50.93 2x5a s ASN 5 Cb -0.10 -1.90 -0.02 0.00 -0.02 0.00 0.00 41.25 39.22 2x5a s ASN 5 CO 0.01 -0.04 0.08 -0.69 -2.57 0.00 0.00 177.10 173.90 2x5a s VAL 6 N 1.59 4.26 0.21 1.60 1.01 -0.99 -0.82 120.40 127.27 2x5a s VAL 6 Ca 0.06 -0.34 0.10 0.00 0.00 0.00 0.00 61.98 61.80 2x5a s VAL 6 Cb -0.15 -3.07 -0.04 0.00 0.00 0.00 0.00 36.38 33.12 2x5a s VAL 6 CO 0.03 0.24 -0.12 -0.31 0.00 0.00 0.00 175.10 174.93 2x5a s TYR 7 N 1.59 2.53 0.63 5.22 2.02 -0.42 -0.90 117.35 128.01 2x5a s TYR 7 Ca 0.05 -0.26 -0.12 0.00 -0.37 0.00 0.00 57.07 56.36 2x5a s TYR 7 Cb -0.16 -1.20 -0.03 0.00 -0.40 0.00 0.00 41.96 40.18 2x5a s TYR 7 CO 0.04 0.56 1.04 -0.51 -1.57 0.00 0.00 175.55 175.11 2x5a s ASP 8 N -3.05 5.89 -0.08 2.29 1.01 -1.26 -0.32 116.67 121.15 2x5a s ASP 8 Ca 0.26 1.58 -0.40 0.00 0.71 0.00 0.00 52.55 54.69 2x5a s ASP 8 Cb -0.08 -2.49 -0.20 0.00 1.01 0.00 0.00 42.92 41.16 2x5a s ASP 8 CO 0.15 -1.10 1.13 -3.20 0.21 0.00 0.00 175.17 172.36 2x5a n ASN 9 N -2.63 0.17 -3.89 0.27 2.85 -1.24 -4.46 115.26 106.35 2x5a n ASN 9 Ca 0.07 1.14 -0.42 0.00 -0.11 0.00 0.00 54.58 55.26 2x5a n ASN 9 Cb 0.54 -0.90 -0.01 0.00 1.24 0.00 0.00 39.78 40.65 2x5a n ASN 9 CO 0.00 0.00 0.00 0.49 -2.11 0.00 0.00 177.26 175.64 2x5a n PHE 10 N 1.85 3.46 -1.83 1.20 3.72 -1.26 -4.94 117.46 119.66 2x5a n PHE 10 Ca 0.21 -2.74 -0.43 0.00 -0.05 0.00 0.00 57.45 54.45 2x5a n PHE 10 Cb 0.06 -2.45 -0.03 0.00 -0.94 0.00 0.00 39.48 36.12 2x5a n PHE 10 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 2x5a s ASN 11 N 3.74 6.18 0.08 4.37 2.47 -1.26 -1.51 114.94 129.01 2x5a s ASN 11 Ca 0.50 2.08 0.22 0.00 0.42 0.00 0.00 52.86 56.08 2x5a s ASN 11 Cb 0.12 -2.53 0.88 0.00 -1.45 0.00 0.00 41.25 38.27 2x5a s ASN 11 CO -0.02 -1.35 1.67 -0.81 -3.72 0.00 0.00 177.10 172.87 2x5a n PRO 12 N 7.87 0.07 0.15 0.43 -0.05 -1.26 -1.72 135.00 140.50 2x5a n PRO 12 Ca 0.22 0.22 0.13 0.00 -0.05 0.00 0.00 63.50 64.01 2x5a n PRO 12 Cb 0.44 -1.61 0.50 0.00 -0.05 0.00 0.00 33.50 32.78 2x5a n PRO 12 CO 0.00 0.00 0.00 -0.91 -0.05 0.00 0.00 175.50 174.54 2x5a h ASN 13 N 0.00 0.00 0.00 3.54 2.35 -1.91 -2.82 115.58 116.74 2x5a h ASN 13 Ca 0.00 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.70 2x5a h ASN 13 Cb 0.40 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.76 2x5a h ASN 13 CO 0.00 0.00 -0.75 0.00 -1.65 0.00 0.00 177.43 175.03 2x5a n TYR 14 N -2.39 0.00 0.33 1.19 9.36 -0.99 -4.81 117.16 119.84 2x5a n TYR 14 Ca 0.02 0.00 0.15 0.00 3.32 0.00 0.00 57.90 61.39 2x5a n TYR 14 Cb 0.27 -0.24 0.54 0.00 -0.63 0.00 0.00 39.34 39.28 2x5a n TYR 14 CO 0.00 0.00 0.00 1.88 0.22 0.00 0.00 176.86 178.96 2x5a h TYR 15 N -0.37 0.00 -1.23 2.98 -1.99 -1.47 -3.33 116.97 111.56 2x5a h TYR 15 Ca -0.08 0.00 -0.65 0.00 2.00 0.00 0.00 58.73 59.99 2x5a h TYR 15 Cb 0.64 0.00 -0.16 0.00 2.00 0.00 0.00 36.73 39.21 2x5a h TYR 15 CO -0.12 0.00 1.48 -1.71 -0.00 0.00 0.00 178.16 177.82 2x5a n ASN 16 N -2.81 7.38 -3.79 3.88 5.15 -1.06 -3.07 115.26 120.92 2x5a n ASN 16 Ca 0.02 -3.23 -0.24 0.00 -0.60 0.00 0.00 54.58 50.53 2x5a n ASN 16 Cb 0.33 -1.29 -0.17 0.00 -0.53 0.00 0.00 39.78 38.12 2x5a n ASN 16 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2x5a s ILE 17 N -1.96 0.48 -1.42 -1.44 1.01 -1.25 -4.98 121.20 111.63 2x5a s ILE 17 Ca 0.55 0.05 -0.07 0.00 0.00 0.00 0.00 60.65 61.17 2x5a s ILE 17 Cb 0.27 -0.62 0.05 0.00 0.01 0.00 0.00 42.46 42.18 2x5a s ILE 17 CO -0.16 0.27 2.53 -1.20 0.00 0.00 0.00 174.94 176.38 2x5a n SER 18 N 5.11 7.92 -0.24 3.58 7.64 -1.26 -2.19 113.62 134.18 2x5a n SER 18 Ca -0.08 -2.94 0.04 0.00 1.01 0.00 0.00 58.87 56.89 2x5a n SER 18 Cb 0.50 -1.44 0.02 0.00 -1.01 0.00 0.00 64.21 62.27 2x5a n SER 18 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 2x5a n ASP 19 N 2.64 1.39 -4.66 6.43 5.75 -1.14 -4.37 116.55 122.59 2x5a n ASP 19 Ca 0.66 -1.20 -0.43 0.00 -0.01 0.00 0.00 54.79 53.82 2x5a n ASP 19 Cb 0.25 0.17 -0.02 0.00 -1.03 0.00 0.00 41.12 40.49 2x5a n ASP 19 CO 0.00 0.00 0.00 0.12 -0.11 0.00 0.00 177.20 177.21 2x5a s PHE 20 N -0.78 2.29 -0.49 2.11 5.36 -0.59 -4.88 117.98 121.00 2x5a s PHE 20 Ca 0.08 0.52 -0.28 0.00 -0.96 0.00 0.00 56.93 56.29 2x5a s PHE 20 Cb 0.06 -3.79 0.03 0.00 -0.34 0.00 0.00 43.02 38.98 2x5a s PHE 20 CO 0.12 -2.98 1.08 0.45 -1.46 0.00 0.00 175.22 172.43 2x5a s SER 21 N 3.01 6.56 0.60 6.13 0.15 -1.26 -1.52 113.70 127.37 2x5a s SER 21 Ca 0.67 0.29 -0.16 0.00 0.70 0.00 0.00 55.95 57.44 2x5a s SER 21 Cb -0.28 -2.52 -0.03 0.00 -1.71 0.00 0.00 66.02 61.48 2x5a s SER 21 CO 0.24 -1.24 1.09 -0.04 1.20 0.00 0.00 173.24 174.50 2x5a s MET 22 N 4.33 3.15 0.53 5.44 -1.94 -0.81 -4.97 119.30 125.03 2x5a s MET 22 Ca 0.44 1.35 0.21 0.00 -1.71 0.00 0.00 55.69 55.98 2x5a s MET 22 Cb -0.08 -2.00 1.35 0.00 2.01 0.00 0.00 34.83 36.11 2x5a s MET 22 CO 0.29 -0.97 2.07 -1.35 -0.01 0.00 0.00 175.02 175.06 2x5a h PRO 23 N 0.47 0.00 -0.04 2.03 0.11 -1.89 -1.75 132.00 130.93 2x5a h PRO 23 Ca -0.47 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 65.48 2x5a h PRO 23 Cb 1.24 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 2x5a h PRO 23 CO 0.56 0.00 -0.68 -2.95 -0.21 0.00 0.00 178.00 174.72 2x5a h ASN 24 N 0.00 0.22 0.00 -2.05 -1.07 -1.93 -3.48 115.58 107.27 2x5a h ASN 24 Ca 0.12 -0.14 0.00 0.00 0.07 0.00 0.00 56.30 56.35 2x5a h ASN 24 Cb 0.50 -0.06 0.00 0.00 -2.07 0.00 0.00 38.32 36.69 2x5a h ASN 24 CO -0.00 0.83 0.00 0.61 0.07 0.00 0.00 177.43 178.94 2x5a n GLY 25 N 0.43 4.56 3.71 9.14 0.00 -0.66 -5.15 105.19 117.23 2x5a n GLY 25 Ca -0.02 -0.79 -0.32 0.00 0.00 0.00 0.00 46.02 44.89 2x5a n GLY 25 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2x5a s LYS 26 N 0.00 1.64 -0.16 1.61 0.00 -1.26 -4.49 119.74 117.09 2x5a s LYS 26 Ca 0.00 1.49 -0.12 0.00 0.00 0.00 0.00 55.97 57.33 2x5a s LYS 26 Cb 0.00 -1.80 -0.05 0.00 0.00 0.00 0.00 37.83 35.98 2x5a s LYS 26 CO 0.00 -2.16 0.24 0.15 0.00 0.00 0.00 175.35 173.59 2x5a s LYS 27 N -4.54 4.14 0.33 1.78 -0.14 -1.26 -1.92 119.74 118.12 2x5a s LYS 27 Ca 0.67 0.01 0.04 0.00 -1.36 0.00 0.00 55.97 55.33 2x5a s LYS 27 Cb -0.22 -3.39 -0.06 0.00 -1.68 0.00 0.00 37.83 32.47 2x5a s LYS 27 CO 0.54 0.34 0.06 -1.21 -0.76 0.00 0.00 175.35 174.31 2x5a s GLU 28 N 0.19 1.69 0.75 1.68 0.41 -0.58 -4.92 118.70 117.92 2x5a s GLU 28 Ca 0.15 -1.94 -0.14 0.00 -0.41 0.00 0.00 54.97 52.62 2x5a s GLU 28 Cb -0.13 -0.92 0.05 0.00 -1.78 0.00 0.00 34.13 31.35 2x5a s GLU 28 CO 0.03 -0.19 1.19 0.15 -0.49 0.00 0.00 175.26 175.95 2x5a s LYS 29 N -3.87 2.07 -0.01 1.61 1.02 -1.26 -1.54 119.74 117.76 2x5a s LYS 29 Ca 0.36 1.69 -0.30 0.00 0.02 0.00 0.00 55.97 57.74 2x5a s LYS 29 Cb 0.09 -1.83 -0.06 0.00 -0.52 0.00 0.00 37.83 35.50 2x5a s LYS 29 CO 0.16 -1.87 1.56 1.03 -0.92 0.00 0.00 175.35 175.31 2x5a s ARG 30 N -4.03 4.22 0.71 1.68 0.52 -0.93 -4.66 118.95 116.45 2x5a s ARG 30 Ca 0.73 2.14 -0.12 0.00 -0.52 0.00 0.00 55.73 57.95 2x5a s ARG 30 Cb -0.27 -3.75 0.02 0.00 0.52 0.00 0.00 34.95 31.47 2x5a s ARG 30 CO 0.47 -0.73 1.09 0.20 0.02 0.00 0.00 175.30 176.34 2x5a s GLY 31 N 2.61 1.87 0.55 -3.53 0.00 -1.26 -4.85 107.32 102.70 2x5a s GLY 31 Ca 0.70 0.34 -0.21 0.00 0.00 0.00 0.00 44.72 45.55 2x5a s GLY 31 CO 0.29 0.68 1.33 1.08 0.00 0.00 0.00 173.10 176.48 2x5a s LEU 32 N -5.42 3.83 1.04 0.66 1.43 -0.35 -4.91 118.68 114.96 2x5a s LEU 32 Ca 0.63 2.69 -0.17 0.00 -1.03 0.00 0.00 54.13 56.24 2x5a s LEU 32 Cb -0.18 -4.32 0.24 0.00 0.03 0.00 0.00 46.19 41.96 2x5a s LEU 32 CO 0.50 -1.55 1.29 -2.16 0.23 0.00 0.00 176.35 174.66 2x5a s PRO 33 N -2.95 0.01 0.33 1.29 0.04 -1.26 -4.57 135.00 127.89 2x5a s PRO 33 Ca 0.72 -0.40 -0.16 0.00 0.04 0.00 0.00 61.00 61.20 2x5a s PRO 33 Cb -0.38 -1.77 -0.09 0.00 0.04 0.00 0.00 34.50 32.29 2x5a s PRO 33 CO 0.45 -2.84 0.77 0.96 0.04 0.00 0.00 177.00 176.38 2x5a s ILE 34 N -3.71 4.62 0.21 0.56 -5.25 -1.26 -5.01 121.20 111.36 2x5a s ILE 34 Ca 0.75 1.07 -0.32 0.00 -0.99 0.00 0.00 60.65 61.16 2x5a s ILE 34 Cb -0.04 -3.64 -0.12 0.00 2.95 0.00 0.00 42.46 41.61 2x5a s ILE 34 CO 0.54 -0.16 1.68 -2.84 -1.79 0.00 0.00 174.94 172.37 2x5a s PRO 35 N -2.90 4.14 0.56 0.37 0.02 -1.26 -4.87 135.00 131.06 2x5a s PRO 35 Ca 0.54 2.57 0.29 0.00 0.02 0.00 0.00 61.00 64.41 2x5a s PRO 35 Cb -0.11 -3.08 1.65 0.00 0.02 0.00 0.00 34.50 32.98 2x5a s PRO 35 CO 0.17 -0.71 2.17 1.57 -0.33 0.00 0.00 177.00 179.87 2x5a h LYS 36 N 6.57 0.00 -2.19 5.54 2.10 -1.40 -3.43 116.57 123.76 2x5a h LYS 36 Ca -0.43 0.00 -0.05 0.00 -2.00 0.00 0.00 60.65 58.17 2x5a h LYS 36 Cb 1.20 0.00 -0.22 0.00 -0.90 0.00 0.00 32.23 32.31 2x5a h LYS 36 CO 0.93 0.06 0.00 0.00 -2.00 0.00 0.00 179.45 178.44 2x5a s ALA 37 N -4.41 -1.60 -0.27 0.07 0.00 -1.22 -5.08 121.76 109.25 2x5a s ALA 37 Ca -0.04 1.92 -0.13 0.00 0.00 0.00 0.00 51.96 53.71 2x5a s ALA 37 Cb 0.14 -1.12 -0.04 0.00 0.00 0.00 0.00 23.12 22.10 2x5a s ALA 37 CO 0.56 -0.32 0.30 0.50 0.00 0.00 0.00 175.76 176.80 2x5a s ARG 38 N 0.72 4.00 0.38 0.00 6.06 -1.26 -2.34 118.95 126.50 2x5a s ARG 38 Ca -0.03 -0.10 0.04 0.00 -2.50 0.00 0.00 55.73 53.14 2x5a s ARG 38 Cb -0.05 -3.65 -0.03 0.00 0.06 0.00 0.00 34.95 31.28 2x5a s ARG 38 CO -0.05 -0.22 0.14 0.00 -2.50 0.00 0.00 175.30 172.67 2x5a s GLN 40 N -3.72 2.81 -0.23 0.00 0.00 -1.26 -0.25 119.66 117.02 2x5a s GLN 40 Ca 0.28 -0.78 -0.27 0.00 -0.00 0.00 0.00 55.36 54.59 2x5a s GLN 40 Cb 0.03 -2.30 0.00 0.00 0.00 0.00 0.00 33.01 30.74 2x5a s GLN 40 CO 0.16 -0.04 0.96 0.54 0.00 0.00 0.00 175.29 176.91 2x5a s VAL 41 N 0.90 4.74 0.13 3.63 0.11 -0.01 -3.22 120.40 126.67 2x5a s VAL 41 Ca -0.06 1.86 0.09 0.00 -2.93 0.00 0.00 61.98 60.94 2x5a s VAL 41 Cb -0.15 -4.24 -0.04 0.00 -1.53 0.00 0.00 36.38 30.42 2x5a s VAL 41 CO -0.03 -0.14 -0.21 0.27 -3.33 0.00 0.00 175.10 171.67 2x5a s ILE 42 N 3.04 1.86 -0.76 7.04 -5.25 -0.47 -3.04 121.20 123.60 2x5a s ILE 42 Ca 0.41 -1.70 -0.01 0.00 -0.99 0.00 0.00 60.65 58.36 2x5a s ILE 42 Cb -0.15 -1.73 0.00 0.00 2.95 0.00 0.00 42.46 43.53 2x5a s ILE 42 CO 0.07 -0.11 0.67 -3.20 -1.79 0.00 0.00 174.94 170.57 2x5a n ASN 43 N 0.80 -6.86 -4.45 4.36 2.85 -1.26 -1.45 115.26 109.25 2x5a n ASN 43 Ca -0.17 -0.34 -0.26 0.00 -0.11 0.00 0.00 54.58 53.70 2x5a n ASN 43 Cb 0.55 -4.14 -0.11 0.00 1.24 0.00 0.00 39.78 37.31 2x5a n ASN 43 CO 0.00 0.00 0.00 -0.72 -2.11 0.00 0.00 177.26 174.43 2x5a s TYR 44 N -2.98 2.30 -0.35 1.20 -0.85 -1.26 -3.39 117.35 112.02 2x5a s TYR 44 Ca 0.01 -0.35 -0.01 0.00 -0.52 0.00 0.00 57.07 56.21 2x5a s TYR 44 Cb -0.00 -1.08 0.13 0.00 0.38 0.00 0.00 41.96 41.39 2x5a s TYR 44 CO 0.80 0.60 0.18 -2.00 -1.52 0.00 0.00 175.55 173.61 2x5a s GLU 45 N -3.04 0.61 -0.31 -3.49 2.12 -0.59 -4.01 118.70 110.00 2x5a s GLU 45 Ca 0.25 -1.24 -0.05 0.00 0.36 0.00 0.00 54.97 54.29 2x5a s GLU 45 Cb -0.07 -1.53 0.03 0.00 0.26 0.00 0.00 34.13 32.82 2x5a s GLU 45 CO 0.12 -1.13 0.06 -0.51 -0.54 0.00 0.00 175.26 173.26 2x5a s LEU 46 N 1.24 3.97 -0.13 2.70 1.43 -0.04 -1.98 118.68 125.86 2x5a s LEU 46 Ca 0.15 -0.98 -0.23 0.00 -1.03 0.00 0.00 54.13 52.05 2x5a s LEU 46 Cb -0.21 -1.83 -0.03 0.00 0.03 0.00 0.00 46.19 44.15 2x5a s LEU 46 CO -0.11 -0.25 0.70 0.26 0.23 0.00 0.00 176.35 177.19 2x5a s TRP 47 N 1.41 3.48 0.23 0.29 0.52 -1.26 -0.34 118.94 123.27 2x5a s TRP 47 Ca -0.00 1.14 -0.06 0.00 0.02 0.00 0.00 56.10 57.20 2x5a s TRP 47 Cb -0.18 -2.85 0.22 0.00 -1.15 0.00 0.00 33.47 29.51 2x5a s TRP 47 CO 0.01 -0.07 1.82 1.49 0.02 0.00 0.00 176.95 180.22 2x5a h GLU 48 N 7.11 1.18 0.00 4.98 4.81 -1.31 -3.38 114.58 127.96 2x5a h GLU 48 Ca -0.35 -0.18 0.00 0.00 -0.13 0.00 0.00 59.36 58.69 2x5a h GLU 48 Cb 1.16 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 30.34 2x5a h GLU 48 CO 0.78 0.92 -1.00 0.25 -0.73 0.00 0.00 179.01 179.23 2x5a n THR 49 N -4.30 0.00 -1.97 0.32 -2.24 -1.26 -4.80 114.28 100.03 2x5a n THR 49 Ca 0.08 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.86 2x5a n THR 49 Cb 0.15 -0.84 0.00 0.00 -2.10 0.00 0.00 70.33 67.55 2x5a n THR 49 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2x5a n GLY 50 N 3.16 0.82 0.17 3.38 0.00 -1.26 -4.85 105.19 106.61 2x5a n GLY 50 Ca 0.00 -0.52 -0.12 0.00 0.00 0.00 0.00 46.02 45.38 2x5a n GLY 50 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2x5a h TYR 51 N 0.00 0.61 0.00 1.61 3.20 -1.97 -3.43 116.97 116.99 2x5a h TYR 51 Ca 0.00 -0.15 0.00 0.00 3.14 0.00 0.00 58.73 61.72 2x5a h TYR 51 Cb 0.84 -0.14 0.00 0.00 1.54 0.00 0.00 36.73 38.97 2x5a h TYR 51 CO 0.00 0.78 -0.90 -0.11 -1.64 0.00 0.00 178.16 176.30 2x5a n LEU 52 N -4.48 0.41 -4.67 2.82 7.94 -1.26 -5.10 117.00 112.66 2x5a n LEU 52 Ca -0.04 0.00 -0.26 0.00 -1.11 0.00 0.00 56.01 54.60 2x5a n LEU 52 Cb 0.35 0.00 -0.07 0.00 0.53 0.00 0.00 43.42 44.22 2x5a n LEU 52 CO 0.41 0.02 -0.32 -0.31 -1.11 0.00 0.00 177.39 176.08 2x5a s TYR 53 N -1.98 2.83 -0.04 1.96 2.02 -1.26 -5.13 117.35 115.75 2x5a s TYR 53 Ca 0.00 -0.15 -0.11 0.00 -0.37 0.00 0.00 57.07 56.44 2x5a s TYR 53 Cb 0.00 -1.35 -0.05 0.00 -0.40 0.00 0.00 41.96 40.16 2x5a s TYR 53 CO 0.00 0.53 0.30 0.95 -1.57 0.00 0.00 175.55 175.77 2x5a s THR 54 N -1.84 5.22 0.66 -0.71 -4.23 -1.26 -4.62 115.64 108.86 2x5a s THR 54 Ca 0.28 0.55 -0.14 0.00 -1.18 0.00 0.00 61.69 61.20 2x5a s THR 54 Cb -0.09 -3.59 0.00 0.00 1.34 0.00 0.00 72.50 70.17 2x5a s THR 54 CO 0.19 0.57 1.10 -0.44 -0.54 0.00 0.00 174.62 175.49 2x5a s SER 55 N -1.14 5.16 -0.09 3.99 0.01 -0.48 -4.90 113.70 116.26 2x5a s SER 55 Ca 0.21 1.92 -0.08 0.00 1.31 0.00 0.00 55.95 59.32 2x5a s SER 55 Cb -0.15 -2.54 0.03 0.00 0.21 0.00 0.00 66.02 63.57 2x5a s SER 55 CO 0.10 -1.59 0.23 -0.94 0.41 0.00 0.00 173.24 171.46 2x5a s SER 56 N -2.79 -0.24 -0.23 2.44 1.04 -0.84 -0.27 113.70 112.80 2x5a s SER 56 Ca 0.65 0.47 -0.26 0.00 0.48 0.00 0.00 55.95 57.29 2x5a s SER 56 Cb -0.19 0.46 0.07 0.00 0.10 0.00 0.00 66.02 66.46 2x5a s SER 56 CO 0.43 -0.09 0.72 0.00 0.98 0.00 0.00 173.24 175.28 2x5a s ALA 57 N 0.28 -1.78 -0.26 5.32 0.00 -0.61 -1.55 121.76 123.16 2x5a s ALA 57 Ca -0.01 1.90 -0.16 0.00 0.00 0.00 0.00 51.96 53.69 2x5a s ALA 57 Cb -0.03 -0.98 -0.03 0.00 0.00 0.00 0.00 23.12 22.08 2x5a s ALA 57 CO -0.01 -0.34 0.43 0.99 0.00 0.00 0.00 175.76 176.83 2x5a s THR 58 N 0.10 5.14 -0.00 0.00 2.01 -0.53 -0.53 115.64 121.83 2x5a s THR 58 Ca -0.02 0.70 0.01 0.00 0.31 0.00 0.00 61.69 62.69 2x5a s THR 58 Cb -0.04 -3.75 -0.04 0.00 0.01 0.00 0.00 72.50 68.68 2x5a s THR 58 CO 0.02 0.14 0.02 -0.76 -0.69 0.00 0.00 174.62 173.36 2x5a s LEU 59 N 2.10 3.62 0.15 4.42 1.43 -1.21 -1.37 118.68 127.82 2x5a s LEU 59 Ca 0.18 0.03 -0.15 0.00 -1.03 0.00 0.00 54.13 53.16 2x5a s LEU 59 Cb -0.16 -2.09 0.03 0.00 0.03 0.00 0.00 46.19 44.00 2x5a s LEU 59 CO 0.09 0.28 1.73 0.71 0.23 0.00 0.00 176.35 179.39 2x5a h THR 60 N 3.43 1.19 -3.89 5.49 1.35 -1.92 -3.43 112.91 115.12 2x5a h THR 60 Ca -0.49 -0.53 -0.47 0.00 -0.55 0.00 0.00 66.41 64.37 2x5a h THR 60 Cb 1.18 0.67 -0.02 0.00 -1.73 0.00 0.00 68.15 68.25 2x5a h THR 60 CO 0.59 0.20 0.22 0.54 -0.25 0.00 0.00 175.52 176.82 2x5a s VAL 61 N -5.71 4.56 -1.30 6.82 0.11 -1.26 -4.98 120.40 118.64 2x5a s VAL 61 Ca -0.13 1.17 -0.18 0.00 -2.93 0.00 0.00 61.98 59.91 2x5a s VAL 61 Cb 0.11 -3.62 0.07 0.00 -1.53 0.00 0.00 36.38 31.42 2x5a s VAL 61 CO 0.76 -0.29 1.74 -1.54 -3.33 0.00 0.00 175.10 172.43 2x5a n SER 62 N -0.61 4.93 -4.76 3.54 3.41 -1.26 -4.99 113.62 113.88 2x5a n SER 62 Ca 0.05 -2.92 -0.33 0.00 -0.26 0.00 0.00 58.87 55.41 2x5a n SER 62 Cb 0.54 -1.74 0.06 0.00 -0.26 0.00 0.00 64.21 62.80 2x5a n SER 62 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 2x5a s VAL 63 N 4.09 3.00 0.24 -3.33 -7.23 -1.26 -5.08 120.40 110.83 2x5a s VAL 63 Ca 0.53 0.48 0.08 0.00 -1.81 0.00 0.00 61.98 61.27 2x5a s VAL 63 Cb 0.04 -3.02 -0.05 0.00 0.56 0.00 0.00 36.38 33.91 2x5a s VAL 63 CO 0.07 -0.27 -0.12 -1.83 -0.31 0.00 0.00 175.10 172.64 2x5a s GLU 64 N -3.99 1.46 0.11 4.82 -1.05 -1.26 -4.95 118.70 113.84 2x5a s GLU 64 Ca 0.69 -1.68 -0.34 0.00 -0.15 0.00 0.00 54.97 53.49 2x5a s GLU 64 Cb -0.23 -1.23 -0.13 0.00 -0.44 0.00 0.00 34.13 32.10 2x5a s GLU 64 CO 0.41 0.16 1.66 0.28 0.95 0.00 0.00 175.26 178.72 2x5a n VAL 65 N -0.48 0.14 0.00 1.83 0.31 -1.26 -2.54 118.33 116.33 2x5a n VAL 65 Ca -0.07 -0.03 0.00 0.00 -0.01 0.00 0.00 64.34 64.24 2x5a n VAL 65 Cb 0.61 -1.66 0.00 0.00 -0.91 0.00 0.00 33.84 31.88 2x5a n VAL 65 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2x5a n GLY 66 N 3.69 2.07 3.71 2.92 0.00 -0.75 -5.02 105.19 111.81 2x5a n GLY 66 Ca 0.18 -0.50 -0.39 0.00 0.00 0.00 0.00 46.02 45.31 2x5a n GLY 66 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2x5a n ASP 67 N 0.14 2.36 -4.69 1.61 8.00 -1.05 -3.62 116.55 119.29 2x5a n ASP 67 Ca 0.00 0.99 -0.36 0.00 0.71 0.00 0.00 54.79 56.13 2x5a n ASP 67 Cb 0.00 -1.53 -0.09 0.00 -0.02 0.00 0.00 41.12 39.49 2x5a n ASP 67 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2x5a s ILE 68 N -1.29 5.37 -0.26 0.53 -1.09 0.57 -1.19 121.20 123.85 2x5a s ILE 68 Ca 0.69 0.22 -0.06 0.00 -2.23 0.00 0.00 60.65 59.28 2x5a s ILE 68 Cb -0.44 -3.50 -0.01 0.00 -1.58 0.00 0.00 42.46 36.93 2x5a s ILE 68 CO 0.52 0.38 0.03 -0.69 -1.23 0.00 0.00 174.94 173.95 2x5a s VAL 69 N 0.74 3.79 -0.40 2.92 1.01 0.14 -1.30 120.40 127.29 2x5a s VAL 69 Ca 0.09 -0.51 -0.10 0.00 0.00 0.00 0.00 61.98 61.46 2x5a s VAL 69 Cb -0.12 -2.83 0.06 0.00 0.00 0.00 0.00 36.38 33.49 2x5a s VAL 69 CO 0.02 0.27 0.24 -1.58 0.00 0.00 0.00 175.10 174.05 2x5a s GLN 70 N 1.51 2.69 -0.19 2.72 0.74 -0.00 -1.22 119.66 125.90 2x5a s GLN 70 Ca 0.04 -1.33 -0.21 0.00 0.05 0.00 0.00 55.36 53.91 2x5a s GLN 70 Cb -0.16 -3.77 -0.02 0.00 1.10 0.00 0.00 33.01 30.17 2x5a s GLN 70 CO 0.00 -0.87 0.66 0.42 -0.55 0.00 0.00 175.29 174.95 2x5a s ILE 71 N 1.47 5.00 -0.08 -2.34 1.01 0.29 -0.38 121.20 126.17 2x5a s ILE 71 Ca 0.02 1.24 -0.07 0.00 0.00 0.00 0.00 60.65 61.85 2x5a s ILE 71 Cb -0.22 -3.97 -0.04 0.00 0.01 0.00 0.00 42.46 38.24 2x5a s ILE 71 CO 0.04 0.10 0.18 -0.76 0.00 0.00 0.00 174.94 174.49 2x5a s LEU 72 N 1.95 4.39 -0.04 2.97 1.43 0.38 -1.88 118.68 127.87 2x5a s LEU 72 Ca 0.30 0.50 0.03 0.00 -1.03 0.00 0.00 54.13 53.93 2x5a s LEU 72 Cb -0.16 -2.25 0.00 0.00 0.03 0.00 0.00 46.19 43.81 2x5a s LEU 72 CO 0.11 0.37 -0.13 -0.36 0.23 0.00 0.00 176.35 176.56 2x5a s PHE 73 N -1.10 1.39 0.00 0.29 0.08 -1.19 -3.85 117.98 113.60 2x5a s PHE 73 Ca 0.19 -0.41 -0.01 0.00 0.12 0.00 0.00 56.93 56.82 2x5a s PHE 73 Cb -0.13 -0.97 -0.05 0.00 -0.57 0.00 0.00 43.02 41.31 2x5a s PHE 73 CO 0.08 -0.16 1.97 -0.35 -0.10 0.00 0.00 175.22 176.66 2x5a n PRO 74 N 3.32 1.01 -4.15 0.24 -0.04 -1.26 -4.46 135.00 129.66 2x5a n PRO 74 Ca -0.19 -0.19 -0.10 0.00 -0.04 0.00 0.00 63.50 62.99 2x5a n PRO 74 Cb 0.53 -1.27 -0.10 0.00 -0.04 0.00 0.00 33.50 32.62 2x5a n PRO 74 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 2x5a s GLU 75 N 0.58 0.77 -0.05 0.54 -1.05 -1.26 -5.09 118.70 113.13 2x5a s GLU 75 Ca 0.12 -1.29 0.06 0.00 -0.15 0.00 0.00 54.97 53.71 2x5a s GLU 75 Cb 0.06 -0.09 -0.02 0.00 -0.44 0.00 0.00 34.13 33.64 2x5a s GLU 75 CO 0.00 -0.04 -0.22 0.14 0.95 0.00 0.00 175.26 176.09 2x5a s VAL 76 N -3.68 2.40 -0.22 1.83 -7.23 -1.26 -1.50 120.40 110.74 2x5a s VAL 76 Ca 0.10 -0.96 -0.05 0.00 -1.81 0.00 0.00 61.98 59.26 2x5a s VAL 76 Cb 0.06 -1.89 -0.02 0.00 0.56 0.00 0.00 36.38 35.09 2x5a s VAL 76 CO -0.06 0.58 0.01 -0.69 -0.31 0.00 0.00 175.10 174.62 2x5a s VAL 77 N -0.42 3.88 -0.34 1.32 1.01 0.18 -4.88 120.40 121.16 2x5a s VAL 77 Ca 0.04 -0.33 -0.16 0.00 0.00 0.00 0.00 61.98 61.53 2x5a s VAL 77 Cb -0.12 -2.78 -0.01 0.00 0.00 0.00 0.00 36.38 33.47 2x5a s VAL 77 CO 0.01 0.40 0.41 -2.16 0.00 0.00 0.00 175.10 173.77 2x5a s PRO 78 N 1.32 3.62 -0.11 2.72 0.04 -1.26 -2.39 135.00 138.95 2x5a s PRO 78 Ca 0.04 -0.29 -0.05 0.00 0.04 0.00 0.00 61.00 60.74 2x5a s PRO 78 Cb -0.15 -3.79 -0.04 0.00 0.04 0.00 0.00 34.50 30.56 2x5a s PRO 78 CO 0.01 -0.54 0.08 0.96 0.04 0.00 0.00 177.00 177.55 2x5a s ILE 79 N 2.14 5.00 -0.54 0.56 -5.25 -1.24 -3.94 121.20 117.93 2x5a s ILE 79 Ca 0.14 0.02 -0.19 0.00 -0.99 0.00 0.00 60.65 59.63 2x5a s ILE 79 Cb -0.16 -3.15 0.08 0.00 2.95 0.00 0.00 42.46 42.17 2x5a s ILE 79 CO 0.12 0.61 0.66 -0.70 -1.79 0.00 0.00 174.94 173.83 2x5a s GLU 80 N -0.92 3.08 0.27 0.37 2.12 0.83 -2.52 118.70 121.93 2x5a s GLU 80 Ca 0.14 -1.09 0.19 0.00 0.36 0.00 0.00 54.97 54.57 2x5a s GLU 80 Cb -0.12 -4.18 0.10 0.00 0.26 0.00 0.00 34.13 30.19 2x5a s GLU 80 CO 0.03 -1.36 1.31 1.05 -0.54 0.00 0.00 175.26 175.75 2x5a h GLU 81 N 9.08 0.00 -4.66 4.30 4.11 -1.78 -3.40 114.58 122.24 2x5a h GLU 81 Ca -0.28 0.00 -0.26 0.00 0.07 0.00 0.00 59.36 58.89 2x5a h GLU 81 Cb 1.09 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 30.19 2x5a h GLU 81 CO 1.02 0.23 -0.63 0.00 0.07 0.00 0.00 179.01 179.70 2x5a s ALA 82 N -3.10 1.26 0.24 1.06 0.00 -1.12 -4.79 121.76 115.32 2x5a s ALA 82 Ca 0.03 -1.67 -0.06 0.00 0.00 0.00 0.00 51.96 50.26 2x5a s ALA 82 Cb 0.07 1.05 0.45 0.00 0.00 0.00 0.00 23.12 24.70 2x5a s ALA 82 CO 0.74 -0.49 1.67 1.25 0.00 0.00 0.00 175.76 178.93 2x5a h LEU 83 N 2.63 -0.12 0.00 0.00 7.12 -2.00 -3.09 115.31 119.86 2x5a h LEU 83 Ca -0.36 0.16 -0.11 0.00 0.13 0.00 0.00 57.88 57.70 2x5a h LEU 83 Cb 1.23 0.25 -0.02 0.00 -0.53 0.00 0.00 40.66 41.59 2x5a h LEU 83 CO 0.58 -0.09 -1.68 0.61 -0.13 0.00 0.00 178.44 177.72 2x5a n GLY 84 N -1.37 -0.57 3.70 3.75 0.00 -1.26 -4.86 105.19 104.58 2x5a n GLY 84 Ca 0.14 -0.24 -0.42 0.00 0.00 0.00 0.00 46.02 45.49 2x5a n GLY 84 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2x5a s LYS 85 N -2.57 4.49 -0.01 1.61 2.20 -1.17 -5.06 119.74 119.23 2x5a s LYS 85 Ca -0.05 1.51 0.07 0.00 -0.36 0.00 0.00 55.97 57.14 2x5a s LYS 85 Cb 0.06 -3.46 -0.02 0.00 -1.51 0.00 0.00 37.83 32.90 2x5a s LYS 85 CO 0.49 -0.18 -0.22 0.15 -0.36 0.00 0.00 175.35 175.24 2x5a s LYS 86 N 1.31 1.75 -0.11 4.03 1.02 -1.26 -2.39 119.74 124.09 2x5a s LYS 86 Ca 0.53 -0.79 0.03 0.00 0.02 0.00 0.00 55.97 55.76 2x5a s LYS 86 Cb -0.23 -1.70 -0.00 0.00 -0.52 0.00 0.00 37.83 35.38 2x5a s LYS 86 CO 0.26 0.47 -0.21 0.21 -0.92 0.00 0.00 175.35 175.15 2x5a s LYS 87 N -0.54 3.12 -0.86 1.68 2.20 -1.05 -4.99 119.74 119.30 2x5a s LYS 87 Ca 0.08 -0.83 -0.25 0.00 -0.36 0.00 0.00 55.97 54.62 2x5a s LYS 87 Cb -0.08 -2.38 -0.04 0.00 -1.51 0.00 0.00 37.83 33.82 2x5a s LYS 87 CO -0.01 0.20 1.89 0.15 -0.36 0.00 0.00 175.35 177.22 2x5a s LYS 88 N 0.32 2.64 -0.25 4.03 -0.14 -1.26 -3.60 119.74 121.48 2x5a s LYS 88 Ca -0.16 -0.20 -0.11 0.00 -1.36 0.00 0.00 55.97 54.14 2x5a s LYS 88 Cb -0.17 -4.96 -0.05 0.00 -1.68 0.00 0.00 37.83 30.97 2x5a s LYS 88 CO 0.08 -3.18 0.19 -1.17 -0.76 0.00 0.00 175.35 170.50 2x5a s LEU 89 N 9.53 4.09 0.26 3.17 1.98 -1.00 -5.00 118.68 131.70 2x5a s LEU 89 Ca 0.68 0.10 -0.30 0.00 -2.89 0.00 0.00 54.13 51.72 2x5a s LEU 89 Cb -0.07 -2.14 -0.09 0.00 0.66 0.00 0.00 46.19 44.55 2x5a s LEU 89 CO 0.02 0.02 1.10 0.20 -1.89 0.00 0.00 176.35 175.80 2x5a s ASN 90 N 1.27 7.27 0.01 3.68 0.01 -1.26 0.51 114.94 126.42 2x5a s ASN 90 Ca 0.08 2.24 -0.30 0.00 -0.71 0.00 0.00 52.86 54.17 2x5a s ASN 90 Cb -0.14 -2.62 -0.07 0.00 0.41 0.00 0.00 41.25 38.82 2x5a s ASN 90 CO 0.07 -0.16 1.66 -0.22 -1.51 0.00 0.00 177.10 176.93 2x5a s LEU 91 N -1.22 4.35 0.03 0.60 2.96 -0.56 -4.76 118.68 120.07 2x5a s LEU 91 Ca 0.46 2.37 0.01 0.00 -0.22 0.00 0.00 54.13 56.75 2x5a s LEU 91 Cb -0.32 -3.55 -0.02 0.00 0.50 0.00 0.00 46.19 42.81 2x5a s LEU 91 CO 0.40 -0.90 -0.05 -1.81 -1.32 0.00 0.00 176.35 172.67 2x5a s ASP 92 N 2.88 0.55 -0.33 3.68 -0.00 -1.26 -3.20 116.67 118.99 2x5a s ASP 92 Ca 0.74 -0.45 0.00 0.00 -0.00 0.00 0.00 52.55 52.85 2x5a s ASP 92 Cb -0.37 0.05 0.10 0.00 -0.00 0.00 0.00 42.92 42.70 2x5a s ASP 92 CO 0.31 -0.20 0.10 -0.04 -0.00 0.00 0.00 175.17 175.35 2x5a s MET 93 N -1.27 0.90 -0.21 8.23 -1.94 -0.79 -4.83 119.30 119.38 2x5a s MET 93 Ca -0.10 -1.31 -0.11 0.00 -1.71 0.00 0.00 55.69 52.46 2x5a s MET 93 Cb -0.08 -2.24 -0.05 0.00 2.01 0.00 0.00 34.83 34.47 2x5a s MET 93 CO -0.00 -1.00 0.18 0.08 -0.01 0.00 0.00 175.02 174.27 2x5a s VAL 94 N 1.37 5.36 0.11 -6.03 1.01 -1.25 -0.55 120.40 120.41 2x5a s VAL 94 Ca 0.11 0.25 0.01 0.00 0.00 0.00 0.00 61.98 62.35 2x5a s VAL 94 Cb -0.18 -3.52 -0.04 0.00 0.00 0.00 0.00 36.38 32.64 2x5a s VAL 94 CO -0.20 0.38 -0.04 -0.31 0.00 0.00 0.00 175.10 174.94 2x5a s TYR 95 N 0.75 0.89 -0.12 5.22 2.02 -0.36 -2.66 117.35 123.09 2x5a s TYR 95 Ca 0.09 -0.99 -0.02 0.00 -0.37 0.00 0.00 57.07 55.78 2x5a s TYR 95 Cb -0.13 -0.53 -0.03 0.00 -0.40 0.00 0.00 41.96 40.88 2x5a s TYR 95 CO 0.02 -0.23 -0.03 -1.17 -1.57 0.00 0.00 175.55 172.57 2x5a s LEU 96 N -3.05 3.35 -0.23 -1.29 2.96 0.28 -0.68 118.68 120.01 2x5a s LEU 96 Ca 0.14 -0.02 -0.29 0.00 -0.22 0.00 0.00 54.13 53.74 2x5a s LEU 96 Cb 0.06 -1.78 -0.00 0.00 0.50 0.00 0.00 46.19 44.97 2x5a s LEU 96 CO -0.03 0.27 1.21 -0.69 -1.32 0.00 0.00 176.35 175.78 2x5a s VAL 97 N -0.25 4.35 -0.16 1.68 1.01 -0.33 -1.56 120.40 125.14 2x5a s VAL 97 Ca 0.05 1.60 0.04 0.00 0.00 0.00 0.00 61.98 63.66 2x5a s VAL 97 Cb -0.13 -4.15 -0.23 0.00 0.00 0.00 0.00 36.38 31.88 2x5a s VAL 97 CO 0.02 -0.28 0.18 0.35 0.00 0.00 0.00 175.10 175.38 2x5a n THR 98 N 5.64 1.60 -3.64 3.92 -2.24 -0.31 -1.81 114.28 117.44 2x5a n THR 98 Ca 0.14 -0.69 -0.11 0.00 -2.27 0.00 0.00 64.05 61.12 2x5a n THR 98 Cb 0.46 -1.30 -0.07 0.00 -2.10 0.00 0.00 70.33 67.32 2x5a n THR 98 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2x5a s ASP 99 N -6.44 -0.63 -0.10 3.42 3.68 -1.23 -4.89 116.67 110.47 2x5a s ASP 99 Ca -0.21 1.18 0.03 0.00 2.13 0.00 0.00 52.55 55.69 2x5a s ASP 99 Cb 0.07 1.21 -0.00 0.00 -1.45 0.00 0.00 42.92 42.75 2x5a s ASP 99 CO 0.74 -0.20 -0.22 -0.69 0.13 0.00 0.00 175.17 174.93 2x5a s VAL 100 N 0.50 2.27 0.03 1.11 1.01 -1.26 -0.01 120.40 124.05 2x5a s VAL 100 Ca -0.00 -0.95 -0.00 0.00 0.00 0.00 0.00 61.98 61.03 2x5a s VAL 100 Cb -0.05 -1.88 0.01 0.00 0.00 0.00 0.00 36.38 34.45 2x5a s VAL 100 CO -0.05 0.55 0.04 -0.90 0.00 0.00 0.00 175.10 174.75 2x5a n ASP 101 N 3.47 0.05 -0.30 3.32 3.85 -1.10 -4.96 116.55 120.89 2x5a n ASP 101 Ca -0.19 -1.04 -0.05 0.00 -0.71 0.00 0.00 54.79 52.80 2x5a n ASP 101 Cb 0.53 -0.03 0.07 0.00 -1.35 0.00 0.00 41.12 40.34 2x5a n ASP 101 CO 0.00 0.00 0.00 -0.33 -1.01 0.00 0.00 177.20 175.86 2x5a h GLU 102 N 0.00 1.18 -0.76 0.11 3.07 -2.01 -2.88 114.58 113.29 2x5a h GLU 102 Ca -0.01 -0.17 0.00 0.00 -0.50 0.00 0.00 59.36 58.67 2x5a h GLU 102 Cb 0.05 -0.21 0.00 0.00 -0.84 0.00 0.00 28.75 27.75 2x5a h GLU 102 CO 0.01 0.91 0.00 -1.13 -1.40 0.00 0.00 179.01 177.40 2x5a n SER 103 N -4.34 1.61 -1.94 1.42 3.41 -1.26 -4.90 113.62 107.61 2x5a n SER 103 Ca 0.08 -2.13 -0.18 0.00 -0.26 0.00 0.00 58.87 56.38 2x5a n SER 103 Cb 0.14 -0.44 -0.04 0.00 -0.26 0.00 0.00 64.21 63.60 2x5a n SER 103 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2x5a n ASN 104 N 0.06 -4.98 -4.57 4.04 5.15 -1.09 -4.93 115.26 108.94 2x5a n ASN 104 Ca 0.05 0.26 -0.43 0.00 -0.60 0.00 0.00 54.58 53.86 2x5a n ASN 104 Cb 0.35 -4.32 -0.04 0.00 -0.53 0.00 0.00 39.78 35.25 2x5a n ASN 104 CO 0.00 0.00 0.00 -0.75 1.40 0.00 0.00 177.26 177.91 2x5a s LYS 105 N -4.24 3.60 -0.07 1.20 2.20 -1.26 -3.36 119.74 117.80 2x5a s LYS 105 Ca 0.00 0.27 -0.18 0.00 -0.36 0.00 0.00 55.97 55.70 2x5a s LYS 105 Cb 0.00 -3.91 -0.05 0.00 -1.51 0.00 0.00 37.83 32.36 2x5a s LYS 105 CO 0.00 -1.23 0.50 0.00 -0.36 0.00 0.00 175.35 174.26 2x5a s ALA 106 N 3.86 3.51 -0.41 3.13 0.00 0.31 -2.70 121.76 129.47 2x5a s ALA 106 Ca 0.39 -0.12 -0.23 0.00 0.00 0.00 0.00 51.96 52.00 2x5a s ALA 106 Cb -0.10 -2.64 0.02 0.00 0.00 0.00 0.00 23.12 20.40 2x5a s ALA 106 CO 0.27 0.12 0.78 0.99 0.00 0.00 0.00 175.76 177.92 2x5a s THR 107 N 0.13 4.70 -0.20 0.00 2.01 0.99 -1.58 115.64 121.69 2x5a s THR 107 Ca 0.27 0.64 -0.09 0.00 0.31 0.00 0.00 61.69 62.82 2x5a s THR 107 Cb -0.16 -4.26 -0.05 0.00 0.01 0.00 0.00 72.50 68.04 2x5a s THR 107 CO 0.13 -0.57 0.11 -0.76 -0.69 0.00 0.00 174.62 172.84 2x5a s LEU 108 N 3.18 4.09 -0.15 4.42 1.43 0.63 -1.16 118.68 131.12 2x5a s LEU 108 Ca 0.30 0.18 -0.02 0.00 -1.03 0.00 0.00 54.13 53.56 2x5a s LEU 108 Cb -0.13 -2.06 -0.02 0.00 0.03 0.00 0.00 46.19 44.02 2x5a s LEU 108 CO 0.20 0.17 -0.09 -0.75 0.23 0.00 0.00 176.35 176.11 2x5a s LYS 109 N 0.43 3.50 0.01 1.70 2.20 -0.60 -1.38 119.74 125.59 2x5a s LYS 109 Ca 0.07 -0.62 -0.35 0.00 -0.36 0.00 0.00 55.97 54.71 2x5a s LYS 109 Cb -0.12 -2.78 -0.14 0.00 -1.51 0.00 0.00 37.83 33.29 2x5a s LYS 109 CO -0.01 0.19 1.68 0.09 -0.36 0.00 0.00 175.35 176.93 2x5a n ASN 110 N 3.65 2.95 -0.33 1.43 4.13 -1.26 -0.56 115.26 125.26 2x5a n ASN 110 Ca -0.18 1.05 0.17 0.00 1.68 0.00 0.00 54.58 57.30 2x5a n ASN 110 Cb 0.52 -1.34 0.33 0.00 -1.54 0.00 0.00 39.78 37.75 2x5a n ASN 110 CO 0.00 0.00 0.00 0.22 0.28 0.00 0.00 177.26 177.76 2x5a h TYR 111 N 7.09 0.11 0.43 3.10 3.20 -1.83 -2.63 116.97 126.44 2x5a h TYR 111 Ca -0.47 0.07 -0.02 0.00 3.14 0.00 0.00 58.73 61.45 2x5a h TYR 111 Cb 1.28 0.11 0.00 0.00 1.54 0.00 0.00 36.73 39.67 2x5a h TYR 111 CO 0.73 -0.42 -0.21 0.35 -1.64 0.00 0.00 178.16 176.97 2x5a h PHE 112 N 0.02 -0.54 0.00 -3.82 3.57 -1.90 -1.25 116.94 113.02 2x5a h PHE 112 Ca 0.63 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 62.10 2x5a h PHE 112 Cb 1.37 0.18 -0.00 0.00 2.79 0.00 0.00 35.95 40.28 2x5a h PHE 112 CO -0.41 -0.32 -0.10 -1.49 -2.23 0.00 0.00 178.31 173.76 2x5a h TRP 113 N -0.60 0.00 0.00 0.41 4.06 -1.83 -1.61 115.95 116.38 2x5a h TRP 113 Ca -0.06 0.00 -0.10 0.00 2.06 0.00 0.00 58.89 60.79 2x5a h TRP 113 Cb 0.46 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.60 2x5a h TRP 113 CO -0.04 0.10 -0.67 0.00 -3.56 0.00 0.00 178.44 174.27 2x5a h ALA 114 N 1.90 0.70 0.11 1.49 0.00 -1.36 -3.31 119.26 118.79 2x5a h ALA 114 Ca -0.00 -0.44 -0.16 0.00 0.00 0.00 0.00 54.91 54.30 2x5a h ALA 114 Cb 0.33 0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.15 2x5a h ALA 114 CO 0.01 0.56 -0.74 1.98 0.00 0.00 0.00 179.25 181.06 2x5a h MET 115 N 0.00 0.24 -0.39 0.00 -1.53 -0.33 -3.32 114.93 109.61 2x5a h MET 115 Ca -0.04 -0.41 0.00 0.00 -3.44 0.00 0.00 59.70 55.81 2x5a h MET 115 Cb 1.35 0.15 0.00 0.00 -0.55 0.00 0.00 31.60 32.55 2x5a h MET 115 CO 0.05 1.20 0.00 0.44 0.14 0.00 0.00 176.91 178.74 2x5a n ILE 116 N -4.19 0.05 -1.99 1.77 -5.35 -0.72 -3.45 119.36 105.48 2x5a n ILE 116 Ca -0.14 -0.03 -0.41 0.00 -0.27 0.00 0.00 62.75 61.89 2x5a n ILE 116 Cb 0.77 -0.18 -0.01 0.00 -1.74 0.00 0.00 39.64 38.48 2x5a n ILE 116 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 2x5a s GLU 117 N -1.62 4.26 0.00 6.28 2.02 -1.24 -3.21 118.70 125.19 2x5a s GLU 117 Ca 0.01 2.35 0.00 0.00 0.02 0.00 0.00 54.97 57.36 2x5a s GLU 117 Cb 0.01 -3.04 0.00 0.00 0.10 0.00 0.00 34.13 31.20 2x5a s GLU 117 CO 0.01 -0.34 0.00 0.43 0.02 0.00 0.00 175.26 175.38 2x5a n SER 118 N 0.87 -4.30 -4.71 -0.19 7.64 -1.26 -4.75 113.62 106.92 2x5a n SER 118 Ca 0.01 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.48 2x5a n SER 118 Cb 0.41 -2.71 -0.04 0.00 -1.01 0.00 0.00 64.21 60.86 2x5a n SER 118 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 2x5a s LEU 119 N 0.00 4.32 -0.02 -3.43 2.96 -1.20 -4.98 118.68 116.34 2x5a s LEU 119 Ca 0.00 1.37 0.03 0.00 -0.22 0.00 0.00 54.13 55.31 2x5a s LEU 119 Cb 0.00 -3.28 -0.03 0.00 0.50 0.00 0.00 46.19 43.38 2x5a s LEU 119 CO 0.00 -0.20 -0.09 -1.81 -1.32 0.00 0.00 176.35 172.93 2x5a s ASP 120 N 0.91 4.45 -0.15 3.68 1.01 -1.26 0.69 116.67 126.00 2x5a s ASP 120 Ca 0.43 -0.14 -0.02 0.00 0.71 0.00 0.00 52.55 53.53 2x5a s ASP 120 Cb -0.19 -1.02 0.04 0.00 1.01 0.00 0.00 42.92 42.76 2x5a s ASP 120 CO 0.21 0.32 -0.00 0.54 0.21 0.00 0.00 175.17 176.45 2x5a s VAL 121 N -0.89 0.64 1.08 -1.27 0.11 0.14 -4.86 120.40 115.36 2x5a s VAL 121 Ca 0.14 -0.36 -0.16 0.00 -2.93 0.00 0.00 61.98 58.68 2x5a s VAL 121 Cb -0.11 -0.94 0.23 0.00 -1.53 0.00 0.00 36.38 34.03 2x5a s VAL 121 CO 0.04 0.04 1.12 -2.16 -3.33 0.00 0.00 175.10 170.82 2x5a s PRO 122 N 1.83 -0.28 0.57 1.54 0.04 -1.26 -2.14 135.00 135.30 2x5a s PRO 122 Ca 0.02 0.14 0.29 0.00 0.04 0.00 0.00 61.00 61.48 2x5a s PRO 122 Cb -0.15 -1.69 1.70 0.00 0.04 0.00 0.00 34.50 34.40 2x5a s PRO 122 CO -0.07 -3.12 2.19 -0.97 0.04 0.00 0.00 177.00 175.07 2x5a h ASN 123 N -2.16 0.00 -0.79 6.66 -1.24 -1.79 -3.08 115.58 113.19 2x5a h ASN 123 Ca -0.49 0.00 -0.01 0.00 0.71 0.00 0.00 56.30 56.51 2x5a h ASN 123 Cb 1.31 0.00 -0.04 0.00 0.73 0.00 0.00 38.32 40.32 2x5a h ASN 123 CO 0.46 0.04 0.46 0.00 -1.29 0.00 0.00 177.43 177.10 2x5a h ALA 124 N 1.96 1.00 0.02 1.57 0.00 -1.91 -2.83 119.26 119.06 2x5a h ALA 124 Ca -0.00 -0.10 -0.21 0.00 0.00 0.00 0.00 54.91 54.60 2x5a h ALA 124 Cb 0.12 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 2x5a h ALA 124 CO 0.01 0.48 -0.95 0.82 0.00 0.00 0.00 179.25 179.61 2x5a h ILE 125 N 1.08 1.55 0.00 0.00 2.04 -1.91 -3.24 117.51 117.03 2x5a h ILE 125 Ca 0.28 -2.88 0.00 0.00 1.00 0.00 0.00 64.86 63.26 2x5a h ILE 125 Cb -0.01 2.62 0.00 0.00 -0.74 0.00 0.00 36.82 38.69 2x5a h ILE 125 CO -0.05 0.83 0.00 0.71 0.00 0.00 0.00 178.15 179.64 2x5a h THR 126 N 0.06 0.00 -0.06 -0.27 1.35 -1.58 -3.22 112.91 109.19 2x5a h THR 126 Ca -0.05 -0.39 -0.00 0.00 -0.55 0.00 0.00 66.41 65.42 2x5a h THR 126 Cb 1.62 1.28 -0.00 0.00 -1.73 0.00 0.00 68.15 69.32 2x5a h THR 126 CO 0.14 0.00 0.03 0.11 -0.25 0.00 0.00 175.52 175.55 2x5a h LYS 127 N 0.00 0.08 0.00 4.72 1.57 -1.53 -3.44 116.57 117.97 2x5a h LYS 127 Ca 0.00 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2x5a h LYS 127 Cb 0.45 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.74 2x5a h LYS 127 CO 0.00 0.07 0.00 0.25 -0.57 0.00 0.00 179.45 179.20 2x5a n THR 128 N -4.52 0.00 -1.31 -0.16 -2.24 -1.22 -4.88 114.28 99.96 2x5a n THR 128 Ca -0.02 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.47 2x5a n THR 128 Cb 0.10 -1.74 0.15 0.00 -2.10 0.00 0.00 70.33 66.73 2x5a n THR 128 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2x5a s THR 129 N -0.48 2.33 0.48 4.28 -4.23 -1.26 -3.82 115.64 112.94 2x5a s THR 129 Ca 0.00 0.11 0.26 0.00 -1.18 0.00 0.00 61.69 60.87 2x5a s THR 129 Cb 0.00 -2.68 0.29 0.00 1.34 0.00 0.00 72.50 71.45 2x5a s THR 129 CO 0.00 -0.14 2.12 0.78 -0.54 0.00 0.00 174.62 176.84 2x5a h ASN 130 N -1.62 0.00 -0.58 3.99 2.35 -1.64 -2.87 115.58 115.21 2x5a h ASN 130 Ca -0.51 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.19 2x5a h ASN 130 Cb 1.31 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.66 2x5a h ASN 130 CO 0.58 0.09 0.19 0.15 -1.65 0.00 0.00 177.43 176.78 2x5a h PHE 131 N 0.00 0.93 -0.40 1.19 3.57 -1.90 -2.42 116.94 117.90 2x5a h PHE 131 Ca -0.00 -0.09 -0.08 0.00 3.53 0.00 0.00 57.97 61.33 2x5a h PHE 131 Cb 0.22 -0.27 -0.02 0.00 2.79 0.00 0.00 35.95 38.67 2x5a h PHE 131 CO 0.00 0.77 -0.09 0.00 -2.23 0.00 0.00 178.31 176.76 2x5a h ALA 132 N 1.05 1.09 -0.31 2.41 0.00 -1.88 -0.75 119.26 120.87 2x5a h ALA 132 Ca 0.19 -0.29 -0.15 0.00 0.00 0.00 0.00 54.91 54.65 2x5a h ALA 132 Cb 0.28 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 2x5a h ALA 132 CO -0.01 0.56 -0.41 0.82 0.00 0.00 0.00 179.25 180.22 2x5a h ILE 133 N 0.64 1.29 -0.44 0.00 2.04 -1.58 -2.14 117.51 117.31 2x5a h ILE 133 Ca 0.12 -1.59 -0.11 0.00 1.00 0.00 0.00 64.86 64.27 2x5a h ILE 133 Cb 0.53 1.56 -0.01 0.00 -0.74 0.00 0.00 36.82 38.16 2x5a h ILE 133 CO 0.03 0.52 -0.15 0.40 0.00 0.00 0.00 178.15 178.95 2x5a h ILE 134 N 0.60 1.27 0.00 -0.67 1.08 -1.33 -1.20 117.51 117.26 2x5a h ILE 134 Ca 0.04 -1.29 -0.05 0.00 -0.39 0.00 0.00 64.86 63.17 2x5a h ILE 134 Cb 1.01 1.17 -0.01 0.00 -3.07 0.00 0.00 36.82 35.92 2x5a h ILE 134 CO 0.10 0.44 -0.24 -0.78 -0.69 0.00 0.00 178.15 176.98 2x5a h ASP 135 N 0.72 0.00 0.03 1.72 3.58 -1.11 -1.28 116.42 120.08 2x5a h ASP 135 Ca 0.11 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.56 2x5a h ASP 135 Cb 0.71 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.76 2x5a h ASP 135 CO 0.05 0.24 -0.01 0.22 -2.88 0.00 0.00 179.24 176.86 2x5a h TYR 136 N 0.00 -0.04 -0.93 0.28 3.20 -1.21 -3.37 116.97 114.90 2x5a h TYR 136 Ca -0.00 -0.00 0.03 0.00 3.14 0.00 0.00 58.73 61.89 2x5a h TYR 136 Cb 0.48 0.01 -0.05 0.00 1.54 0.00 0.00 36.73 38.71 2x5a h TYR 136 CO 0.00 0.62 0.61 -0.07 -1.64 0.00 0.00 178.16 177.68 2x5a h LEU 137 N -0.94 1.03 -8.06 2.82 4.07 -1.12 -3.35 115.31 109.75 2x5a h LEU 137 Ca -0.00 -0.02 -0.75 0.00 0.08 0.00 0.00 57.88 57.19 2x5a h LEU 137 Cb 0.67 -0.24 -0.23 0.00 1.08 0.00 0.00 40.66 41.93 2x5a h LEU 137 CO 0.01 0.72 -0.06 -0.63 -1.08 0.00 0.00 178.44 177.39 2x5a s ILE 138 N -6.01 5.18 -0.27 1.22 1.09 -0.49 -4.82 121.20 117.10 2x5a s ILE 138 Ca -0.12 -1.56 -0.08 0.00 -1.10 0.00 0.00 60.65 57.79 2x5a s ILE 138 Cb 0.19 -4.41 0.13 0.00 -1.06 0.00 0.00 42.46 37.30 2x5a s ILE 138 CO 0.81 -0.97 0.58 -0.62 -0.10 0.00 0.00 174.94 174.63 2x5a s ASP 139 N 3.36 -0.90 0.00 3.58 2.15 -1.26 -4.74 116.67 118.86 2x5a s ASP 139 Ca 0.08 1.30 0.18 0.00 0.43 0.00 0.00 52.55 54.54 2x5a s ASP 139 Cb -0.25 2.01 0.82 0.00 -0.30 0.00 0.00 42.92 45.21 2x5a s ASP 139 CO 0.01 -0.23 1.54 -0.81 -0.17 0.00 0.00 175.17 175.51 2x5a n PRO 140 N 5.43 0.14 0.00 4.34 -0.04 -1.26 -2.11 135.00 141.50 2x5a n PRO 140 Ca -0.10 0.16 0.14 0.00 -0.04 0.00 0.00 63.50 63.66 2x5a n PRO 140 Cb 0.49 -1.50 0.62 0.00 -0.04 0.00 0.00 33.50 33.07 2x5a n PRO 140 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2x5a n ASN 141 N -1.38 0.53 0.00 3.54 3.02 -1.26 -4.41 115.26 115.30 2x5a n ASN 141 Ca 0.07 -0.68 0.00 0.00 -0.03 0.00 0.00 54.58 53.94 2x5a n ASN 141 Cb 0.17 -0.05 0.00 0.00 -0.61 0.00 0.00 39.78 39.28 2x5a n ASN 141 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2x5a n LYS 142 N -0.87 0.00 -1.51 3.52 5.02 -1.08 -5.13 118.16 118.11 2x5a n LYS 142 Ca 0.15 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 56.07 2x5a n LYS 142 Cb 0.27 -0.34 0.05 0.00 -0.02 0.00 0.00 35.03 34.99 2x5a n LYS 142 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2x5a n ASN 143 N -2.68 -0.06 0.19 4.39 3.02 -0.90 -4.95 115.26 114.28 2x5a n ASN 143 Ca 0.00 0.74 0.04 0.00 -0.03 0.00 0.00 54.58 55.33 2x5a n ASN 143 Cb 0.27 -1.30 0.37 0.00 -0.61 0.00 0.00 39.78 38.51 2x5a n ASN 143 CO 0.00 0.00 0.00 0.78 -2.62 0.00 0.00 177.26 175.42 2x5a h ASN 144 N 0.23 0.00 -3.50 6.41 2.35 -1.85 -3.45 115.58 115.77 2x5a h ASN 144 Ca -0.47 0.00 -0.67 0.00 -0.55 0.00 0.00 56.30 54.61 2x5a h ASN 144 Cb 1.37 0.00 -0.19 0.00 0.05 0.00 0.00 38.32 39.55 2x5a h ASN 144 CO 0.48 0.38 -0.82 -0.76 -1.65 0.00 0.00 177.43 175.07 2x5a s LEU 145 N -7.79 2.54 0.29 1.61 1.43 -1.26 -4.49 118.68 111.00 2x5a s LEU 145 Ca -0.02 -0.72 -0.29 0.00 -1.03 0.00 0.00 54.13 52.07 2x5a s LEU 145 Cb 0.13 -1.34 -0.10 0.00 0.03 0.00 0.00 46.19 44.92 2x5a s LEU 145 CO 0.71 0.15 1.10 -0.32 0.23 0.00 0.00 176.35 178.22 2x5a s MET 146 N -2.39 4.60 -0.12 1.70 -2.45 -0.57 -4.81 119.30 115.26 2x5a s MET 146 Ca 0.19 1.80 -0.09 0.00 -1.25 0.00 0.00 55.69 56.34 2x5a s MET 146 Cb -0.09 -3.14 0.04 0.00 1.25 0.00 0.00 34.83 32.89 2x5a s MET 146 CO 0.09 0.17 0.31 -1.54 1.05 0.00 0.00 175.02 175.11 2x5a s SER 147 N -0.91 -0.34 -0.24 1.11 1.04 -1.26 -4.98 113.70 108.11 2x5a s SER 147 Ca 0.45 0.64 0.01 0.00 0.48 0.00 0.00 55.95 57.54 2x5a s SER 147 Cb -0.32 0.59 -0.18 0.00 0.10 0.00 0.00 66.02 66.21 2x5a s SER 147 CO 0.41 -0.14 -0.15 -1.22 0.98 0.00 0.00 173.24 173.12 2x5a n TYR 148 N 3.57 0.17 -3.83 5.02 4.01 -0.87 -4.40 117.16 120.84 2x5a n TYR 148 Ca -0.19 0.04 -0.07 0.00 -0.16 0.00 0.00 57.90 57.51 2x5a n TYR 148 Cb 0.56 -1.02 0.02 0.00 -0.31 0.00 0.00 39.34 38.59 2x5a n TYR 148 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 2x5a s GLY 149 N -6.39 0.31 -0.12 2.72 0.00 -1.24 -5.07 107.32 97.52 2x5a s GLY 149 Ca -0.33 -0.65 -0.10 0.00 0.00 0.00 0.00 44.72 43.64 2x5a s GLY 149 CO 0.62 0.34 0.32 -2.52 0.00 0.00 0.00 173.10 171.86 2x5a s TYR 150 N -2.28 -0.38 -0.16 1.90 -0.85 -1.26 -2.30 117.35 112.01 2x5a s TYR 150 Ca 0.17 0.91 -0.04 0.00 -0.52 0.00 0.00 57.07 57.58 2x5a s TYR 150 Cb -0.05 0.13 -0.03 0.00 0.38 0.00 0.00 41.96 42.40 2x5a s TYR 150 CO 0.10 -0.21 -0.03 -0.06 -1.52 0.00 0.00 175.55 173.84 2x5a s PHE 151 N 0.55 3.05 0.06 -3.49 0.08 -1.07 -4.99 117.98 112.17 2x5a s PHE 151 Ca -0.03 -0.28 -0.08 0.00 0.12 0.00 0.00 56.93 56.66 2x5a s PHE 151 Cb -0.05 -1.98 -0.01 0.00 -0.57 0.00 0.00 43.02 40.42 2x5a s PHE 151 CO -0.03 -0.04 0.15 -0.59 -0.10 0.00 0.00 175.22 174.61 2x5a s PHE 152 N 0.42 0.16 -0.28 0.36 -0.71 -1.26 -0.55 117.98 116.12 2x5a s PHE 152 Ca -0.03 -0.51 -0.26 0.00 -1.04 0.00 0.00 56.93 55.09 2x5a s PHE 152 Cb -0.14 -0.10 0.00 0.00 -1.21 0.00 0.00 43.02 41.58 2x5a s PHE 152 CO 0.03 -0.46 0.89 1.21 -1.34 0.00 0.00 175.22 175.55 2x5a s ASN 153 N -2.47 6.81 0.34 1.98 3.84 -0.89 -4.89 114.94 119.66 2x5a s ASN 153 Ca -0.00 0.92 0.02 0.00 0.21 0.00 0.00 52.86 54.01 2x5a s ASN 153 Cb 0.02 -2.46 0.60 0.00 -0.55 0.00 0.00 41.25 38.86 2x5a s ASN 153 CO -0.07 -0.65 1.99 0.28 -2.79 0.00 0.00 177.10 175.85 2x5a h SER 154 N 7.92 0.78 -0.41 -4.21 0.02 -1.92 -3.17 113.55 112.57 2x5a h SER 154 Ca -0.23 -0.02 -0.06 0.00 -0.84 0.00 0.00 61.79 60.65 2x5a h SER 154 Cb 1.08 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 63.42 2x5a h SER 154 CO 0.92 0.55 0.04 0.77 -1.14 0.00 0.00 176.83 177.98 2x5a h SER 155 N 0.92 0.67 0.18 3.07 4.64 -1.92 -1.91 113.55 119.20 2x5a h SER 155 Ca 0.27 -0.28 -0.12 0.00 -0.47 0.00 0.00 61.79 61.19 2x5a h SER 155 Cb -0.05 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 61.85 2x5a h SER 155 CO -0.07 0.78 -0.43 0.16 -0.87 0.00 0.00 176.83 176.41 2x5a h ILE 156 N 0.54 1.32 -0.56 0.95 3.07 -1.90 -3.14 117.51 117.78 2x5a h ILE 156 Ca 0.12 -1.59 0.00 0.00 1.55 0.00 0.00 64.86 64.94 2x5a h ILE 156 Cb 0.42 1.69 0.00 0.00 -0.27 0.00 0.00 36.82 38.66 2x5a h ILE 156 CO 0.01 0.48 0.00 0.49 -1.05 0.00 0.00 178.15 178.08 2x5a n PHE 157 N -4.01 0.74 -0.18 0.16 3.72 -1.23 -4.54 117.46 112.13 2x5a n PHE 157 Ca -0.02 -0.42 -0.07 0.00 -0.05 0.00 0.00 57.45 56.90 2x5a n PHE 157 Cb 0.50 -0.00 0.08 0.00 -0.94 0.00 0.00 39.48 39.12 2x5a n PHE 157 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2x5a h ALA 158 N 3.96 0.96 -2.41 4.37 0.00 -1.29 -3.31 119.26 121.54 2x5a h ALA 158 Ca 0.00 -0.29 -0.52 0.00 0.00 0.00 0.00 54.91 54.10 2x5a h ALA 158 Cb 0.94 -0.22 0.18 0.00 0.00 0.00 0.00 17.79 18.69 2x5a h ALA 158 CO 0.00 0.64 0.29 0.20 0.00 0.00 0.00 179.25 180.37 2x5a s GLY 159 N -3.62 1.90 0.27 0.00 0.00 -1.26 -4.81 107.32 99.80 2x5a s GLY 159 Ca -0.11 0.66 -0.29 0.00 0.00 0.00 0.00 44.72 44.98 2x5a s GLY 159 CO 0.84 1.07 1.27 1.25 0.00 0.00 0.00 173.10 177.53 2x5a s LYS 160 N -4.44 4.42 0.79 2.90 2.36 -1.26 -3.63 119.74 120.88 2x5a s LYS 160 Ca 0.69 2.08 -0.14 0.00 -2.55 0.00 0.00 55.97 56.05 2x5a s LYS 160 Cb -0.24 -3.14 0.07 0.00 -1.05 0.00 0.00 37.83 33.47 2x5a s LYS 160 CO 0.54 -0.14 1.22 0.00 1.55 0.00 0.00 175.35 178.51 2x5a s ALA 161 N -0.66 1.89 0.35 3.13 0.00 -1.25 -4.89 121.76 120.32 2x5a s ALA 161 Ca 0.51 0.88 -0.28 0.00 0.00 0.00 0.00 51.96 53.08 2x5a s ALA 161 Cb -0.37 -3.50 -0.09 0.00 0.00 0.00 0.00 23.12 19.15 2x5a s ALA 161 CO 0.45 -2.23 1.21 0.95 0.00 0.00 0.00 175.76 176.15 2x5a s THR 162 N -2.07 3.03 0.05 0.00 -4.23 -1.26 -5.00 115.64 106.16 2x5a s THR 162 Ca 0.74 0.97 -0.31 0.00 -1.18 0.00 0.00 61.69 61.91 2x5a s THR 162 Cb -0.30 -3.59 -0.06 0.00 1.34 0.00 0.00 72.50 69.90 2x5a s THR 162 CO 0.49 0.18 1.24 0.27 -0.54 0.00 0.00 174.62 176.27 2x5a s ILE 163 N -1.24 3.93 0.47 2.99 -4.36 -1.26 -4.99 121.20 116.73 2x5a s ILE 163 Ca 0.51 1.37 -0.22 0.00 -0.26 0.00 0.00 60.65 62.04 2x5a s ILE 163 Cb -0.35 -3.88 -0.07 0.00 1.25 0.00 0.00 42.46 39.41 2x5a s ILE 163 CO 0.45 0.08 1.13 0.20 0.24 0.00 0.00 174.94 177.05 2x5a s ASN 164 N 1.19 6.20 -0.08 4.36 -0.87 -1.26 -5.03 114.94 119.46 2x5a s ASN 164 Ca 0.60 2.21 -0.30 0.00 -1.57 0.00 0.00 52.86 53.80 2x5a s ASN 164 Cb -0.30 -2.59 -0.02 0.00 -0.02 0.00 0.00 41.25 38.31 2x5a s ASN 164 CO 0.28 -0.89 1.07 0.00 -2.57 0.00 0.00 177.10 174.99 2x5a s ARG 165 N -2.81 4.41 0.00 -0.60 1.70 -1.26 -3.66 118.95 116.73 2x5a s ARG 165 Ca 0.64 1.49 0.00 0.00 -0.47 0.00 0.00 55.73 57.40 2x5a s ARG 165 Cb -0.26 -3.53 0.00 0.00 -0.57 0.00 0.00 34.95 30.59 2x5a s ARG 165 CO 0.31 -0.34 0.00 1.63 -1.08 0.00 0.00 175.30 175.82 2x5a n LYS 166 N 4.95 -0.32 -3.66 3.89 5.02 -1.26 -3.45 118.16 123.33 2x5a n LYS 166 Ca 0.09 0.08 -0.27 0.00 -2.02 0.00 0.00 58.31 56.19 2x5a n LYS 166 Cb 0.48 -4.22 0.02 0.00 -0.02 0.00 0.00 35.03 31.30 2x5a n LYS 166 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2x5a n ALA 167 N 1.00 -1.19 -2.12 7.82 0.00 -1.24 -5.00 120.51 119.78 2x5a n ALA 167 Ca 0.00 0.20 -0.07 0.00 0.00 0.00 0.00 53.44 53.57 2x5a n ALA 167 Cb 0.08 -4.16 0.04 0.00 0.00 0.00 0.00 19.45 15.42 2x5a n ALA 167 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2x5a n GLU 168 N -4.43 0.20 -3.04 0.00 1.02 -1.22 -4.56 120.64 108.60 2x5a n GLU 168 Ca 0.01 -0.83 -0.42 0.00 -0.02 0.00 0.00 57.16 55.91 2x5a n GLU 168 Cb 0.54 -0.27 -0.06 0.00 -0.02 0.00 0.00 31.44 31.64 2x5a n GLU 168 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2x5a s THR 169 N -1.09 4.85 0.11 2.62 2.01 -1.26 -3.16 115.64 119.72 2x5a s THR 169 Ca 0.22 0.87 0.05 0.00 0.31 0.00 0.00 61.69 63.14 2x5a s THR 169 Cb -0.01 -4.10 -0.04 0.00 0.01 0.00 0.00 72.50 68.36 2x5a s THR 169 CO 0.15 -0.27 0.01 -0.44 -0.69 0.00 0.00 174.62 173.38 2x5a s SER 170 N 1.71 5.04 0.67 3.53 0.01 -0.91 -4.94 113.70 118.81 2x5a s SER 170 Ca 0.28 -0.20 -0.11 0.00 1.31 0.00 0.00 55.95 57.23 2x5a s SER 170 Cb -0.14 -1.19 -0.01 0.00 0.21 0.00 0.00 66.02 64.88 2x5a s SER 170 CO 0.14 0.16 1.05 -0.94 0.41 0.00 0.00 173.24 174.05 2x5a s SER 171 N -2.45 5.64 0.46 2.44 1.04 -1.26 0.24 113.70 119.81 2x5a s SER 171 Ca 0.26 1.57 0.14 0.00 0.48 0.00 0.00 55.95 58.41 2x5a s SER 171 Cb -0.11 -2.49 1.06 0.00 0.10 0.00 0.00 66.02 64.58 2x5a s SER 171 CO 0.19 -1.27 2.04 0.00 0.98 0.00 0.00 173.24 175.18 2x5a h ALA 172 N -0.55 1.78 0.05 5.32 0.00 0.01 -2.52 119.26 123.35 2x5a h ALA 172 Ca -0.44 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.35 2x5a h ALA 172 Cb 1.20 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.97 2x5a h ALA 172 CO 0.58 0.17 -0.03 1.25 0.00 0.00 0.00 179.25 181.22 2x5a h HIS 173 N 0.03 -0.07 -0.78 0.00 -0.00 -1.80 -2.45 115.15 110.08 2x5a h HIS 173 Ca 0.01 -0.00 -0.04 0.00 -0.00 0.00 0.00 60.37 60.33 2x5a h HIS 173 Cb 0.21 0.02 -0.03 0.00 -0.00 0.00 0.00 27.41 27.61 2x5a h HIS 173 CO 0.00 0.32 0.32 -0.44 -0.00 0.00 0.00 177.93 178.13 2x5a h ASP 174 N -0.47 1.07 -0.21 3.26 5.19 -1.91 -1.78 116.42 121.58 2x5a h ASP 174 Ca -0.01 -0.17 -0.11 0.00 -0.62 0.00 0.00 57.03 56.12 2x5a h ASP 174 Cb 0.42 -0.28 -0.00 0.00 0.18 0.00 0.00 39.33 39.65 2x5a h ASP 174 CO 0.01 0.95 -0.29 -0.37 -3.12 0.00 0.00 179.24 176.41 2x5a h VAL 175 N 1.13 1.33 -0.18 -1.35 -1.51 -1.54 -2.11 116.25 112.01 2x5a h VAL 175 Ca 0.26 -1.50 0.01 0.00 -1.23 0.00 0.00 66.70 64.24 2x5a h VAL 175 Cb 0.21 1.80 -0.01 0.00 -2.13 0.00 0.00 31.29 31.15 2x5a h VAL 175 CO -0.02 0.46 0.09 0.00 -1.23 0.00 0.00 177.57 176.87 2x5a h ALA 176 N 0.63 0.22 -0.74 5.19 0.00 -1.39 0.12 119.26 123.29 2x5a h ALA 176 Ca 0.02 0.00 0.06 0.00 0.00 0.00 0.00 54.91 54.99 2x5a h ALA 176 Cb 0.87 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.57 2x5a h ALA 176 CO 0.07 -0.33 0.44 0.87 0.00 0.00 0.00 179.25 180.30 2x5a h LYS 177 N 0.20 0.78 -0.52 0.00 1.57 -1.35 0.44 116.57 117.69 2x5a h LYS 177 Ca 0.07 -0.05 -0.11 0.00 -1.87 0.00 0.00 60.65 58.69 2x5a h LYS 177 Cb 0.01 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.12 2x5a h LYS 177 CO -0.04 0.52 -0.11 -0.09 -0.57 0.00 0.00 179.45 179.16 2x5a h ARG 178 N 0.81 1.00 0.07 3.15 2.43 -0.95 -2.49 114.38 118.39 2x5a h ARG 178 Ca 0.32 -0.37 -0.00 0.00 -0.81 0.00 0.00 59.98 59.12 2x5a h ARG 178 Cb 0.16 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.64 2x5a h ARG 178 CO -0.17 1.05 -0.03 0.82 -1.51 0.00 0.00 179.97 180.13 2x5a h ILE 179 N 0.87 1.23 0.00 1.20 2.04 -0.20 -3.20 117.51 119.45 2x5a h ILE 179 Ca 0.14 -1.21 -0.00 0.00 1.00 0.00 0.00 64.86 64.78 2x5a h ILE 179 Cb 0.67 2.00 -0.00 0.00 -0.74 0.00 0.00 36.82 38.75 2x5a h ILE 179 CO 0.05 0.29 -0.00 -0.26 0.00 0.00 0.00 178.15 178.23 2x5a h PHE 180 N -0.65 0.00 0.05 1.37 0.04 -0.18 -1.05 116.94 116.52 2x5a h PHE 180 Ca -0.01 0.00 -0.22 0.00 2.80 0.00 0.00 57.97 60.54 2x5a h PHE 180 Cb 0.55 0.00 0.02 0.00 2.20 0.00 0.00 35.95 38.72 2x5a h PHE 180 CO 0.10 0.00 -0.91 0.77 -0.60 0.00 0.00 178.31 177.68 2x5a h SER 181 N 0.00 0.71 0.02 2.17 0.02 -1.48 -2.56 113.55 112.43 2x5a h SER 181 Ca -0.00 -0.80 -0.14 0.00 -0.84 0.00 0.00 61.79 60.01 2x5a h SER 181 Cb 0.01 -0.22 0.01 0.00 0.14 0.00 0.00 62.40 62.34 2x5a h SER 181 CO 0.00 1.42 -0.56 0.50 -1.14 0.00 0.00 176.83 177.05 2x5a h LYS 182 N 0.08 0.34 0.00 3.45 1.63 -1.40 -3.29 116.57 117.38 2x5a h LYS 182 Ca -0.13 -0.40 0.00 0.00 -0.85 0.00 0.00 60.65 59.27 2x5a h LYS 182 Cb 1.61 0.12 0.00 0.00 -0.60 0.00 0.00 32.23 33.36 2x5a h LYS 182 CO 0.18 1.09 0.00 -0.39 -3.45 0.00 0.00 179.45 176.88 2x5a h VAL 183 N -0.23 0.00 -5.73 2.00 -1.51 -1.36 -3.48 116.25 105.94 2x5a h VAL 183 Ca -0.08 -0.42 -0.35 0.00 -1.23 0.00 0.00 66.70 64.62 2x5a h VAL 183 Cb 1.31 1.30 0.15 0.00 -2.13 0.00 0.00 31.29 31.92 2x5a h VAL 183 CO 0.11 0.00 -0.77 0.00 -1.23 0.00 0.00 177.57 175.68 2x5a n GLN 184 N -2.52 -6.57 -4.06 5.19 6.02 -1.00 -5.02 117.38 109.43 2x5a n GLN 184 Ca 0.03 0.82 -0.07 0.00 -0.01 0.00 0.00 57.00 57.76 2x5a n GLN 184 Cb 0.32 -5.79 -0.10 0.00 1.02 0.00 0.00 30.24 25.69 2x5a n GLN 184 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 177.06 176.17 2x5a s PHE 185 N -3.39 0.45 0.00 1.08 5.36 -1.02 -4.90 117.98 115.56 2x5a s PHE 185 Ca 0.07 -0.94 0.01 0.00 -0.96 0.00 0.00 56.93 55.11 2x5a s PHE 185 Cb -0.03 -0.34 -0.01 0.00 -0.34 0.00 0.00 43.02 42.31 2x5a s PHE 185 CO 0.74 -0.36 -0.05 -0.65 -1.46 0.00 0.00 175.22 173.45 2x5a s GLN 186 N -3.47 0.36 0.27 10.12 -1.52 -1.26 -4.64 119.66 119.52 2x5a s GLN 186 Ca 0.03 -0.22 -0.17 0.00 -1.95 0.00 0.00 55.36 53.04 2x5a s GLN 186 Cb 0.05 -0.32 -0.09 0.00 -0.22 0.00 0.00 33.01 32.43 2x5a s GLN 186 CO -0.08 0.08 0.74 -1.25 -0.25 0.00 0.00 175.29 174.53 2x5a s PRO 187 N -0.28 4.14 -0.08 2.91 0.04 -1.26 -4.87 135.00 135.59 2x5a s PRO 187 Ca 0.00 0.78 0.02 0.00 0.04 0.00 0.00 61.00 61.84 2x5a s PRO 187 Cb -0.03 -2.65 0.01 0.00 0.04 0.00 0.00 34.50 31.87 2x5a s PRO 187 CO -0.00 0.27 -0.13 0.95 0.04 0.00 0.00 177.00 178.13 2x5a s THR 188 N -1.75 1.24 -0.11 1.26 -4.23 -1.02 -4.65 115.64 106.38 2x5a s THR 188 Ca 0.49 -0.51 -0.14 0.00 -1.18 0.00 0.00 61.69 60.34 2x5a s THR 188 Cb -0.13 -1.15 -0.05 0.00 1.34 0.00 0.00 72.50 72.51 2x5a s THR 188 CO 0.19 0.39 0.34 -0.89 -0.54 0.00 0.00 174.62 174.11 2x5a s THR 189 N 0.86 5.23 -0.02 3.99 2.01 -1.26 0.10 115.64 126.54 2x5a s THR 189 Ca -0.10 0.67 -0.02 0.00 0.31 0.00 0.00 61.69 62.55 2x5a s THR 189 Cb -0.15 -3.67 0.01 0.00 0.01 0.00 0.00 72.50 68.70 2x5a s THR 189 CO 0.01 0.45 0.06 0.28 -0.69 0.00 0.00 174.62 174.73 2x5a s THR 190 N -0.06 -0.02 -0.23 -0.82 -1.32 -0.76 -3.88 115.64 108.56 2x5a s THR 190 Ca 0.20 0.06 -0.14 0.00 -1.21 0.00 0.00 61.69 60.60 2x5a s THR 190 Cb -0.14 -0.10 -0.04 0.00 -1.51 0.00 0.00 72.50 70.71 2x5a s THR 190 CO 0.08 0.02 0.32 -0.63 -2.21 0.00 0.00 174.62 172.20 2x5a s ILE 191 N 0.33 5.24 -0.06 5.08 1.01 -1.26 -1.48 121.20 130.07 2x5a s ILE 191 Ca -0.03 0.51 -0.12 0.00 0.00 0.00 0.00 60.65 61.02 2x5a s ILE 191 Cb -0.04 -3.65 0.02 0.00 0.01 0.00 0.00 42.46 38.81 2x5a s ILE 191 CO -0.01 0.26 0.29 -1.10 0.00 0.00 0.00 174.94 174.38 2x5a s GLN 192 N 1.39 0.50 0.34 2.79 -1.52 0.58 -4.93 119.66 118.81 2x5a s GLN 192 Ca 0.15 0.07 -0.29 0.00 -1.95 0.00 0.00 55.36 53.34 2x5a s GLN 192 Cb -0.15 0.23 -0.11 0.00 -0.22 0.00 0.00 33.01 32.77 2x5a s GLN 192 CO 0.07 -0.11 1.40 -1.58 -0.25 0.00 0.00 175.29 174.82 2x5a s HIS 193 N -0.65 2.85 0.24 0.91 5.65 -1.26 -1.08 115.29 121.95 2x5a s HIS 193 Ca -0.07 1.26 -0.29 0.00 0.25 0.00 0.00 55.06 56.21 2x5a s HIS 193 Cb -0.04 -3.84 -0.15 0.00 -1.18 0.00 0.00 32.58 27.37 2x5a s HIS 193 CO 0.02 -2.43 0.82 0.00 -0.65 0.00 0.00 174.74 172.50 2x5a n ALA 194 N 0.85 -1.38 -0.16 1.58 0.00 -0.84 -4.84 120.51 115.71 2x5a n ALA 194 Ca 0.01 0.42 -0.04 0.00 0.00 0.00 0.00 53.44 53.83 2x5a n ALA 194 Cb 0.40 -1.85 0.06 0.00 0.00 0.00 0.00 19.45 18.06 2x5a n ALA 194 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2x5a h PRO 195 N 1.70 0.43 -6.65 0.00 0.13 -1.92 -3.42 132.00 122.27 2x5a h PRO 195 Ca -0.35 -0.03 -0.52 0.00 -0.87 0.00 0.00 66.00 64.23 2x5a h PRO 195 Cb 1.38 -0.10 0.03 0.00 0.13 0.00 0.00 31.00 32.44 2x5a h PRO 195 CO 0.60 0.28 0.62 -1.54 -0.23 0.00 0.00 178.00 177.73 2x5a s SER 196 N -5.45 6.97 0.48 1.44 1.04 -1.26 -4.94 113.70 111.97 2x5a s SER 196 Ca -0.13 2.31 0.22 0.00 0.48 0.00 0.00 55.95 58.84 2x5a s SER 196 Cb 0.14 -2.61 1.21 0.00 0.10 0.00 0.00 66.02 64.87 2x5a s SER 196 CO 0.73 -0.48 2.00 -0.33 0.98 0.00 0.00 173.24 176.14 2x5a h GLU 197 N 5.52 0.00 -0.33 4.02 5.08 -2.01 -2.96 114.58 123.90 2x5a h GLU 197 Ca -0.44 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 57.85 2x5a h GLU 197 Cb 1.21 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.45 2x5a h GLU 197 CO 0.77 0.18 -0.05 1.79 -1.00 0.00 0.00 179.01 180.70 2x5a h THR 198 N 0.00 1.27 -2.98 1.13 1.35 -1.95 -3.42 112.91 108.31 2x5a h THR 198 Ca -0.00 -1.08 -0.57 0.00 -0.55 0.00 0.00 66.41 64.21 2x5a h THR 198 Cb 0.41 1.31 -0.04 0.00 -1.73 0.00 0.00 68.15 68.09 2x5a h THR 198 CO 0.02 0.35 1.05 -0.62 -0.25 0.00 0.00 175.52 176.08 2x5a s ASP 199 N -6.19 6.50 0.00 5.36 2.15 -1.12 -4.59 116.67 118.78 2x5a s ASP 199 Ca -0.13 1.36 0.26 0.00 0.43 0.00 0.00 52.55 54.47 2x5a s ASP 199 Cb 0.09 -2.54 0.91 0.00 -0.30 0.00 0.00 42.92 41.08 2x5a s ASP 199 CO 0.78 -1.20 1.66 -0.81 -0.17 0.00 0.00 175.17 175.44 2x5a n PRO 200 N 7.55 1.76 -1.71 4.34 -0.04 -1.26 -4.65 135.00 140.98 2x5a n PRO 200 Ca 0.17 -1.11 -0.35 0.00 -0.04 0.00 0.00 63.50 62.16 2x5a n PRO 200 Cb 0.46 -1.47 0.07 0.00 -0.04 0.00 0.00 33.50 32.52 2x5a n PRO 200 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2x5a s ARG 201 N -1.96 2.54 -0.22 0.54 0.52 -1.26 -4.90 118.95 114.21 2x5a s ARG 201 Ca 0.36 1.84 -0.07 0.00 -0.52 0.00 0.00 55.73 57.34 2x5a s ARG 201 Cb 0.20 -1.87 -0.03 0.00 0.52 0.00 0.00 34.95 33.77 2x5a s ARG 201 CO 0.32 -1.54 0.06 1.21 0.02 0.00 0.00 175.30 175.37 2x5a s ASN 202 N -1.76 5.32 0.20 0.23 2.47 -1.26 -1.99 114.94 118.15 2x5a s ASN 202 Ca 0.77 -0.08 0.09 0.00 0.42 0.00 0.00 52.86 54.06 2x5a s ASN 202 Cb -0.31 -1.93 -0.05 0.00 -1.45 0.00 0.00 41.25 37.51 2x5a s ASN 202 CO 0.40 0.06 -0.17 -0.76 -3.72 0.00 0.00 177.10 172.91 2x5a s LEU 203 N 1.03 2.51 -0.18 3.21 1.43 -0.24 -1.21 118.68 125.23 2x5a s LEU 203 Ca 0.04 -0.95 -0.04 0.00 -1.03 0.00 0.00 54.13 52.14 2x5a s LEU 203 Cb -0.14 -0.83 -0.03 0.00 0.03 0.00 0.00 46.19 45.22 2x5a s LEU 203 CO 0.03 -0.07 -0.02 -0.22 0.23 0.00 0.00 176.35 176.30 2x5a s LEU 204 N -3.07 3.29 -0.01 1.79 0.20 -1.26 -0.31 118.68 119.30 2x5a s LEU 204 Ca 0.21 -0.14 0.04 0.00 0.69 0.00 0.00 54.13 54.92 2x5a s LEU 204 Cb -0.04 -1.81 -0.01 0.00 -0.43 0.00 0.00 46.19 43.90 2x5a s LEU 204 CO 0.08 0.13 -0.13 -0.36 -0.29 0.00 0.00 176.35 175.78 2x5a s PHE 205 N 0.62 1.17 -0.05 5.38 0.08 -0.55 -2.04 117.98 122.59 2x5a s PHE 205 Ca -0.01 -0.24 -0.21 0.00 0.12 0.00 0.00 56.93 56.59 2x5a s PHE 205 Cb -0.14 -0.77 -0.05 0.00 -0.57 0.00 0.00 43.02 41.50 2x5a s PHE 205 CO 0.02 -0.04 0.61 0.42 -0.10 0.00 0.00 175.22 176.13 2x5a s ILE 206 N -0.21 5.01 -0.20 0.64 -1.09 -0.98 -1.83 121.20 122.55 2x5a s ILE 206 Ca 0.03 1.25 -0.07 0.00 -2.23 0.00 0.00 60.65 59.63 2x5a s ILE 206 Cb -0.06 -3.95 -0.04 0.00 -1.58 0.00 0.00 42.46 36.84 2x5a s ILE 206 CO -0.00 0.34 0.07 0.20 -1.23 0.00 0.00 174.94 174.32 2x5a s ASN 207 N 0.32 5.50 -0.16 3.58 0.01 0.11 -2.60 114.94 121.71 2x5a s ASN 207 Ca 0.32 0.00 0.17 0.00 -0.71 0.00 0.00 52.86 52.65 2x5a s ASN 207 Cb -0.17 -1.95 0.44 0.00 0.41 0.00 0.00 41.25 39.97 2x5a s ASN 207 CO 0.16 0.12 1.18 0.49 -1.51 0.00 0.00 177.10 177.54 2x5a n PHE 208 N 3.92 0.64 -4.40 2.20 3.72 0.29 -2.43 117.46 121.40 2x5a n PHE 208 Ca -0.16 -1.38 -0.25 0.00 -0.05 0.00 0.00 57.45 55.61 2x5a n PHE 208 Cb 0.52 -0.23 -0.10 0.00 -0.94 0.00 0.00 39.48 38.73 2x5a n PHE 208 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2x5a s ALA 209 N -2.31 2.80 0.26 4.37 0.00 -1.20 -2.09 121.76 123.59 2x5a s ALA 209 Ca 0.37 -1.72 0.03 0.00 0.00 0.00 0.00 51.96 50.65 2x5a s ALA 209 Cb 0.38 -0.45 -0.05 0.00 0.00 0.00 0.00 23.12 22.99 2x5a s ALA 209 CO -0.08 0.34 0.02 -1.54 0.00 0.00 0.00 175.76 174.50 2x5a s SER 210 N -3.23 1.93 0.57 0.00 1.04 -1.26 -4.86 113.70 107.89 2x5a s SER 210 Ca 0.27 -1.27 0.28 0.00 0.48 0.00 0.00 55.95 55.71 2x5a s SER 210 Cb -0.07 -0.00 1.73 0.00 0.10 0.00 0.00 66.02 67.78 2x5a s SER 210 CO 0.15 -0.55 2.22 0.08 0.98 0.00 0.00 173.24 176.11 2x5a h ARG 211 N 2.37 0.00 -5.09 4.02 0.11 -1.93 0.24 114.38 114.10 2x5a h ARG 211 Ca -0.39 0.00 -0.64 0.00 0.10 0.00 0.00 59.98 59.05 2x5a h ARG 211 Cb 1.23 0.00 -0.34 0.00 1.11 0.00 0.00 29.97 31.98 2x5a h ARG 211 CO 0.65 0.02 -0.86 -0.80 0.10 0.00 0.00 179.97 179.09 2x5a s ASN 212 N -6.22 2.78 0.07 0.08 0.01 -1.26 -4.61 114.94 105.80 2x5a s ASN 212 Ca -0.05 -0.51 -0.20 0.00 -0.71 0.00 0.00 52.86 51.40 2x5a s ASN 212 Cb 0.15 -1.27 -0.11 0.00 0.41 0.00 0.00 41.25 40.43 2x5a s ASN 212 CO 0.56 0.10 1.50 -0.25 -1.51 0.00 0.00 177.10 177.50 2x5a h TRP 213 N 7.00 0.37 -3.74 2.20 2.91 -1.86 -3.33 115.95 119.50 2x5a h TRP 213 Ca -0.26 -0.06 -0.77 0.00 1.13 0.00 0.00 58.89 58.93 2x5a h TRP 213 Cb 1.21 -0.10 -0.28 0.00 -0.51 0.00 0.00 29.16 29.48 2x5a h TRP 213 CO 0.47 0.54 0.02 -0.80 -1.03 0.00 0.00 178.44 177.64 2x5a s ASN 214 N -5.85 6.45 0.19 2.65 0.01 -1.26 -4.89 114.94 112.24 2x5a s ASN 214 Ca -0.14 -2.83 -0.33 0.00 -0.71 0.00 0.00 52.86 48.85 2x5a s ASN 214 Cb 0.06 -2.12 -0.14 0.00 0.41 0.00 0.00 41.25 39.46 2x5a s ASN 214 CO 0.73 -0.49 1.37 0.54 -1.51 0.00 0.00 177.10 177.74 2x5a n ARG 215 N 3.71 1.76 -4.32 -0.60 1.74 -1.25 -5.02 116.66 112.68 2x5a n ARG 215 Ca 0.14 0.63 -0.31 0.00 -0.77 0.00 0.00 57.85 57.53 2x5a n ARG 215 Cb 0.44 -2.27 -0.10 0.00 -1.02 0.00 0.00 32.46 29.52 2x5a n ARG 215 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2x5a s LYS 216 N -0.07 2.49 -0.16 5.56 1.02 -1.26 -5.07 119.74 122.25 2x5a s LYS 216 Ca 0.73 -0.80 -0.18 0.00 0.02 0.00 0.00 55.97 55.73 2x5a s LYS 216 Cb -0.73 -2.49 -0.04 0.00 -0.52 0.00 0.00 37.83 34.05 2x5a s LYS 216 CO 0.48 0.57 0.50 0.50 -0.92 0.00 0.00 175.35 176.48 2x5a s ARG 217 N -1.80 4.26 0.00 1.68 3.52 -1.26 -4.28 118.95 121.07 2x5a s ARG 217 Ca 0.20 0.44 -0.01 0.00 -0.13 0.00 0.00 55.73 56.24 2x5a s ARG 217 Cb -0.11 -3.50 -0.04 0.00 -1.56 0.00 0.00 34.95 29.74 2x5a s ARG 217 CO 0.12 -0.00 0.10 0.42 -0.81 0.00 0.00 175.30 175.12 2x5a s ILE 218 N 1.15 4.86 -0.24 4.11 1.01 -0.25 -4.98 121.20 126.86 2x5a s ILE 218 Ca 0.25 -0.38 0.01 0.00 0.00 0.00 0.00 60.65 60.53 2x5a s ILE 218 Cb -0.15 -3.24 0.04 0.00 0.01 0.00 0.00 42.46 39.12 2x5a s ILE 218 CO 0.10 0.33 -0.10 0.28 0.00 0.00 0.00 174.94 175.55 2x5a s THR 219 N -1.23 2.43 0.34 2.92 -1.32 -1.26 0.28 115.64 117.79 2x5a s THR 219 Ca 0.24 -1.29 0.03 0.00 -1.21 0.00 0.00 61.69 59.46 2x5a s THR 219 Cb -0.12 -2.29 -0.04 0.00 -1.51 0.00 0.00 72.50 68.54 2x5a s THR 219 CO 0.15 0.15 0.12 0.28 -2.21 0.00 0.00 174.62 173.11 2x5a s THR 220 N 1.22 0.65 -0.04 5.08 -1.32 0.25 -4.95 115.64 116.53 2x5a s THR 220 Ca -0.03 -2.00 0.07 0.00 -1.21 0.00 0.00 61.69 58.52 2x5a s THR 220 Cb -0.18 -2.54 -0.01 0.00 -1.51 0.00 0.00 72.50 68.26 2x5a s THR 220 CO -0.06 0.00 -0.25 -0.60 -2.21 0.00 0.00 174.62 171.50 2x5a s ARG 221 N -3.83 2.31 -0.21 7.08 3.52 -1.26 -1.19 118.95 125.37 2x5a s ARG 221 Ca 0.32 -0.89 -0.01 0.00 -0.13 0.00 0.00 55.73 55.02 2x5a s ARG 221 Cb 0.05 -2.06 0.01 0.00 -1.56 0.00 0.00 34.95 31.40 2x5a s ARG 221 CO 0.16 0.44 -0.12 0.08 -0.81 0.00 0.00 175.30 175.05 2x5a s VAL 222 N -0.33 2.67 0.48 7.11 1.01 -0.58 -4.89 120.40 125.87 2x5a s VAL 222 Ca 0.02 -0.81 -0.07 0.00 0.00 0.00 0.00 61.98 61.11 2x5a s VAL 222 Cb -0.12 -2.22 -0.04 0.00 0.00 0.00 0.00 36.38 34.00 2x5a s VAL 222 CO 0.02 0.42 0.81 -0.62 0.00 0.00 0.00 175.10 175.73 2x5a s ASP 223 N 1.36 6.33 0.51 3.32 -1.08 -1.26 -4.49 116.67 121.36 2x5a s ASP 223 Ca 0.04 1.05 0.25 0.00 -0.52 0.00 0.00 52.55 53.37 2x5a s ASP 223 Cb -0.14 -2.30 1.40 0.00 -1.46 0.00 0.00 42.92 40.42 2x5a s ASP 223 CO -0.08 -0.56 2.08 -0.29 0.52 0.00 0.00 175.17 176.83 2x5a h ILE 224 N 0.40 0.68 0.00 4.11 6.09 -2.00 -2.53 117.51 124.27 2x5a h ILE 224 Ca -0.47 -0.49 0.00 0.00 -1.37 0.00 0.00 64.86 62.53 2x5a h ILE 224 Cb 1.20 1.30 0.00 0.00 0.47 0.00 0.00 36.82 39.79 2x5a h ILE 224 CO 0.62 0.12 0.00 0.07 -3.07 0.00 0.00 178.15 175.89 2x5a h LYS 225 N 0.00 0.00 -0.01 2.19 2.10 -2.02 -2.75 116.57 116.08 2x5a h LYS 225 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2x5a h LYS 225 Cb 0.29 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.62 2x5a h LYS 225 CO 0.02 0.00 0.00 1.04 -2.00 0.00 0.00 179.45 178.51 2x5a n GLN 226 N -2.89 1.02 -3.45 0.07 6.02 -0.95 -4.94 117.38 112.26 2x5a n GLN 226 Ca -0.00 -0.02 -0.21 0.00 -0.01 0.00 0.00 57.00 56.75 2x5a n GLN 226 Cb 0.23 -1.13 0.06 0.00 1.02 0.00 0.00 30.24 30.41 2x5a n GLN 226 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 2x5a n SER 227 N -0.61 -5.52 -4.70 1.08 7.64 -1.04 -1.29 113.62 109.19 2x5a n SER 227 Ca 0.06 -0.82 -0.42 0.00 1.01 0.00 0.00 58.87 58.70 2x5a n SER 227 Cb 0.03 -4.47 -0.03 0.00 -1.01 0.00 0.00 64.21 58.73 2x5a n SER 227 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2x5a s VAL 228 N -3.44 4.10 -0.47 0.44 1.01 -1.26 -4.67 120.40 116.11 2x5a s VAL 228 Ca 0.41 1.48 -0.11 0.00 0.00 0.00 0.00 61.98 63.76 2x5a s VAL 228 Cb -0.09 -3.95 0.11 0.00 0.00 0.00 0.00 36.38 32.45 2x5a s VAL 228 CO 0.79 0.06 0.36 -0.89 0.00 0.00 0.00 175.10 175.42 2x5a s THR 229 N 1.58 4.46 -0.26 3.92 2.01 -0.84 -4.97 115.64 121.55 2x5a s THR 229 Ca 0.58 -1.62 -0.16 0.00 0.31 0.00 0.00 61.69 60.80 2x5a s THR 229 Cb -0.28 -3.87 -0.03 0.00 0.01 0.00 0.00 72.50 68.33 2x5a s THR 229 CO 0.26 -0.73 0.43 -0.32 -0.69 0.00 0.00 174.62 173.57 2x5a s MET 230 N 1.43 4.05 0.24 4.92 1.75 -1.26 -2.82 119.30 127.61 2x5a s MET 230 Ca 0.05 0.17 -0.04 0.00 -1.25 0.00 0.00 55.69 54.61 2x5a s MET 230 Cb -0.26 -3.64 -0.02 0.00 2.84 0.00 0.00 34.83 33.74 2x5a s MET 230 CO 0.01 -0.28 0.29 0.16 -0.65 0.00 0.00 175.02 174.54 2x5a s ASP 231 N 1.54 0.26 -0.07 1.11 -4.77 -0.89 -5.01 116.67 108.84 2x5a s ASP 231 Ca 0.18 -1.28 0.05 0.00 -3.30 0.00 0.00 52.55 48.20 2x5a s ASP 231 Cb -0.16 0.49 -0.01 0.00 -1.09 0.00 0.00 42.92 42.15 2x5a s ASP 231 CO 0.09 -1.00 -0.24 0.42 0.70 0.00 0.00 175.17 175.15 2x5a s THR 232 N -3.95 2.16 0.16 2.11 -4.23 -1.26 0.23 115.64 110.86 2x5a s THR 232 Ca 0.33 -1.02 0.11 0.00 -1.18 0.00 0.00 61.69 59.93 2x5a s THR 232 Cb 0.03 -1.80 -0.04 0.00 1.34 0.00 0.00 72.50 72.03 2x5a s THR 232 CO 0.13 0.57 -0.25 -0.70 -0.54 0.00 0.00 174.62 173.82 2x5a s GLU 233 N -0.03 1.47 -0.21 3.99 2.12 0.11 -4.94 118.70 121.21 2x5a s GLU 233 Ca -0.07 -1.42 -0.01 0.00 0.36 0.00 0.00 54.97 53.82 2x5a s GLU 233 Cb -0.15 -1.88 0.01 0.00 0.26 0.00 0.00 34.13 32.37 2x5a s GLU 233 CO 0.05 0.43 -0.12 0.95 -0.54 0.00 0.00 175.26 176.03 2x5a s THR 234 N -1.35 2.66 -0.06 -1.70 -4.23 -1.26 -1.41 115.64 108.29 2x5a s THR 234 Ca 0.17 -0.79 -0.16 0.00 -1.18 0.00 0.00 61.69 59.72 2x5a s THR 234 Cb -0.09 -2.20 -0.12 0.00 1.34 0.00 0.00 72.50 71.44 2x5a s THR 234 CO 0.08 0.44 0.66 0.40 -0.54 0.00 0.00 174.62 175.66 2x5a h ILE 235 N 5.89 0.50 -2.93 2.99 2.04 -1.96 -3.46 117.51 120.58 2x5a h ILE 235 Ca -0.42 -1.01 -0.62 0.00 1.00 0.00 0.00 64.86 63.81 2x5a h ILE 235 Cb 1.14 0.86 -0.05 0.00 -0.74 0.00 0.00 36.82 38.04 2x5a h ILE 235 CO 0.61 0.14 -0.41 -0.69 0.00 0.00 0.00 178.15 177.80 2x5a s VAL 236 N -3.05 5.32 -0.33 1.67 1.01 -1.26 -5.03 120.40 118.73 2x5a s VAL 236 Ca -0.10 -0.02 -0.18 0.00 0.00 0.00 0.00 61.98 61.69 2x5a s VAL 236 Cb 0.00 -3.58 -0.01 0.00 0.00 0.00 0.00 36.38 32.79 2x5a s VAL 236 CO 0.34 0.26 0.53 -1.81 0.00 0.00 0.00 175.10 174.43 2x5a s ASP 237 N -2.01 6.36 -0.02 3.32 1.01 -1.26 -3.96 116.67 120.11 2x5a s ASP 237 Ca 0.31 0.14 -0.05 0.00 0.71 0.00 0.00 52.55 53.66 2x5a s ASP 237 Cb -0.13 -2.28 0.00 0.00 1.01 0.00 0.00 42.92 41.52 2x5a s ASP 237 CO 0.20 -0.45 0.11 -0.13 0.21 0.00 0.00 175.17 175.12 2x5a s ARG 238 N 2.42 0.32 0.48 8.23 0.52 -1.26 -5.00 118.95 124.66 2x5a s ARG 238 Ca 0.20 -0.17 -0.24 0.00 -0.52 0.00 0.00 55.73 55.00 2x5a s ARG 238 Cb -0.15 0.13 -0.07 0.00 0.52 0.00 0.00 34.95 35.38 2x5a s ARG 238 CO 0.12 -0.06 1.39 -1.12 0.02 0.00 0.00 175.30 175.65 2x5a s SER 239 N -0.76 5.70 0.00 0.23 0.01 -1.11 -4.37 113.70 113.40 2x5a s SER 239 Ca -0.08 2.84 0.24 0.00 1.31 0.00 0.00 55.95 60.26 2x5a s SER 239 Cb -0.05 -2.65 0.50 0.00 0.21 0.00 0.00 66.02 64.04 2x5a s SER 239 CO 0.01 -1.29 1.44 0.00 0.41 0.00 0.00 173.24 173.81 2x5a n ALA 240 N -0.46 2.48 -3.61 1.44 0.00 -1.26 -4.30 120.51 114.80 2x5a n ALA 240 Ca 0.07 -0.69 -0.40 0.00 0.00 0.00 0.00 53.44 52.42 2x5a n ALA 240 Cb 0.43 -0.94 -0.09 0.00 0.00 0.00 0.00 19.45 18.85 2x5a n ALA 240 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2x5a s TYR 241 N -1.85 3.47 -1.27 0.00 2.02 -1.26 -4.88 117.35 113.58 2x5a s TYR 241 Ca 0.33 -2.04 0.13 0.00 -0.37 0.00 0.00 57.07 55.12 2x5a s TYR 241 Cb 0.21 -3.43 0.62 0.00 -0.40 0.00 0.00 41.96 38.95 2x5a s TYR 241 CO 0.31 -0.98 1.36 0.27 -1.57 0.00 0.00 175.55 174.93 2x5a n ASN 242 N 4.76 0.00 -4.28 2.29 0.23 0.89 -4.63 115.26 114.51 2x5a n ASN 242 Ca -0.05 0.25 -0.32 0.00 -0.53 0.00 0.00 54.58 53.92 2x5a n ASN 242 Cb 0.41 -0.36 -0.16 0.00 -2.08 0.00 0.00 39.78 37.58 2x5a n ASN 242 CO 0.00 0.00 0.00 0.12 -0.93 0.00 0.00 177.26 176.45 2x5a s PHE 243 N -2.73 2.53 -0.16 -2.53 2.19 0.17 -3.77 117.98 113.67 2x5a s PHE 243 Ca 0.10 -0.75 0.01 0.00 0.33 0.00 0.00 56.93 56.62 2x5a s PHE 243 Cb 0.09 -1.65 0.02 0.00 -1.31 0.00 0.00 43.02 40.16 2x5a s PHE 243 CO 0.21 -0.24 -0.20 0.00 1.83 0.00 0.00 175.22 176.82 2x5a s ALA 244 N -0.03 2.27 -0.80 11.12 0.00 -0.62 -0.79 121.76 132.92 2x5a s ALA 244 Ca -0.07 -1.16 -0.17 0.00 0.00 0.00 0.00 51.96 50.56 2x5a s ALA 244 Cb -0.15 -1.11 0.15 0.00 0.00 0.00 0.00 23.12 22.02 2x5a s ALA 244 CO 0.05 -0.24 0.89 0.08 0.00 0.00 0.00 175.76 176.53 2x5a s VAL 245 N 1.14 5.05 -0.19 0.00 1.01 0.84 -1.00 120.40 127.25 2x5a s VAL 245 Ca 0.01 -1.70 -0.17 0.00 0.00 0.00 0.00 61.98 60.12 2x5a s VAL 245 Cb -0.14 -4.59 -0.04 0.00 0.00 0.00 0.00 36.38 31.61 2x5a s VAL 245 CO -0.09 -1.24 0.43 -0.69 0.00 0.00 0.00 175.10 173.51 2x5a s VAL 246 N 1.85 5.18 -0.10 2.92 1.01 -0.90 -0.65 120.40 129.71 2x5a s VAL 246 Ca 0.22 0.80 -0.02 0.00 0.00 0.00 0.00 61.98 62.97 2x5a s VAL 246 Cb -0.12 -3.76 -0.03 0.00 0.00 0.00 0.00 36.38 32.46 2x5a s VAL 246 CO -0.05 0.25 -0.02 -0.36 0.00 0.00 0.00 175.10 174.92 2x5a s PHE 247 N 1.24 3.07 -0.10 5.22 0.08 -0.44 -1.13 117.98 125.91 2x5a s PHE 247 Ca 0.21 0.01 0.03 0.00 0.12 0.00 0.00 56.93 57.31 2x5a s PHE 247 Cb -0.15 -1.83 0.00 0.00 -0.57 0.00 0.00 43.02 40.48 2x5a s PHE 247 CO 0.08 0.29 -0.22 0.08 -0.10 0.00 0.00 175.22 175.35 2x5a s VAL 248 N -0.48 1.91 0.49 -0.44 1.01 -1.26 -2.27 120.40 119.36 2x5a s VAL 248 Ca 0.08 -0.92 -0.23 0.00 0.00 0.00 0.00 61.98 60.91 2x5a s VAL 248 Cb -0.12 -1.67 -0.06 0.00 0.00 0.00 0.00 36.38 34.53 2x5a s VAL 248 CO 0.02 0.53 1.26 -0.75 0.00 0.00 0.00 175.10 176.16 2x5a s LYS 249 N 0.50 3.52 -0.08 2.72 2.20 -1.23 -4.56 119.74 122.83 2x5a s LYS 249 Ca -0.16 2.01 -0.17 0.00 -0.36 0.00 0.00 55.97 57.30 2x5a s LYS 249 Cb -0.17 -2.39 -0.05 0.00 -1.51 0.00 0.00 37.83 33.71 2x5a s LYS 249 CO 0.06 -0.81 0.43 1.21 -0.36 0.00 0.00 175.35 175.88 2x5a s ASN 250 N -1.11 6.71 0.12 1.43 3.84 0.39 -4.80 114.94 121.53 2x5a s ASN 250 Ca 0.66 0.84 -0.16 0.00 0.21 0.00 0.00 52.86 54.41 2x5a s ASN 250 Cb -0.35 -2.26 -0.02 0.00 -0.55 0.00 0.00 41.25 38.07 2x5a s ASN 250 CO 0.42 0.13 1.64 0.11 -2.79 0.00 0.00 177.10 176.60 2x5a h LYS 251 N 5.98 0.58 -0.61 0.43 1.79 -1.96 0.15 116.57 122.93 2x5a h LYS 251 Ca -0.45 -0.13 -0.09 0.00 -2.18 0.00 0.00 60.65 57.80 2x5a h LYS 251 Cb 1.19 -0.08 -0.02 0.00 -1.58 0.00 0.00 32.23 31.74 2x5a h LYS 251 CO 0.71 0.60 0.02 0.00 -1.08 0.00 0.00 179.45 179.70 2x5a h ALA 252 N 0.95 0.88 0.00 3.86 0.00 -1.95 -3.18 119.26 119.82 2x5a h ALA 252 Ca 0.12 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2x5a h ALA 252 Cb 0.27 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2x5a h ALA 252 CO -0.00 0.66 -1.01 0.25 0.00 0.00 0.00 179.25 179.15 2x5a n THR 253 N -4.19 0.27 -2.42 0.00 -2.24 -1.23 -4.95 114.28 99.52 2x5a n THR 253 Ca 0.03 -0.32 -0.16 0.00 -2.27 0.00 0.00 64.05 61.34 2x5a n THR 253 Cb 0.33 0.04 -0.01 0.00 -2.10 0.00 0.00 70.33 68.60 2x5a n THR 253 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2x5a n ASP 254 N -2.13 -4.77 -4.19 3.42 2.03 0.03 -4.95 116.55 105.99 2x5a n ASP 254 Ca 0.01 0.11 -0.16 0.00 0.52 0.00 0.00 54.79 55.27 2x5a n ASP 254 Cb 0.46 -4.01 -0.10 0.00 -0.72 0.00 0.00 41.12 36.76 2x5a n ASP 254 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2x5a s ASP 255 N -2.04 1.06 -0.23 1.67 2.15 -1.17 -4.91 116.67 113.21 2x5a s ASP 255 Ca 0.00 -1.44 0.02 0.00 0.43 0.00 0.00 52.55 51.57 2x5a s ASP 255 Cb 0.00 0.28 0.36 0.00 -0.30 0.00 0.00 42.92 43.25 2x5a s ASP 255 CO 0.00 -0.80 1.47 -1.22 -0.17 0.00 0.00 175.17 174.45 2x5a n TYR 256 N -0.46 1.59 -0.30 -5.34 4.01 -1.26 0.15 117.16 115.56 2x5a n TYR 256 Ca 0.01 -1.17 0.19 0.00 -0.16 0.00 0.00 57.90 56.77 2x5a n TYR 256 Cb 0.66 -0.60 0.47 0.00 -0.31 0.00 0.00 39.34 39.56 2x5a n TYR 256 CO 0.00 0.00 0.00 1.79 -0.46 0.00 0.00 176.86 178.19 2x5a h THR 257 N 0.61 0.62 -3.96 -0.72 1.35 -1.93 -3.42 112.91 105.46 2x5a h THR 257 Ca 0.32 -0.16 -0.52 0.00 -0.55 0.00 0.00 66.41 65.50 2x5a h THR 257 Cb 1.95 0.11 0.08 0.00 -1.73 0.00 0.00 68.15 68.56 2x5a h THR 257 CO 0.57 0.09 0.57 -1.81 -0.25 0.00 0.00 175.52 174.69 2x5a s ASP 258 N -5.44 6.26 0.73 5.36 1.01 -1.26 -5.02 116.67 118.30 2x5a s ASP 258 Ca -0.09 2.56 -0.14 0.00 0.71 0.00 0.00 52.55 55.59 2x5a s ASP 258 Cb 0.24 -2.63 0.04 0.00 1.01 0.00 0.00 42.92 41.58 2x5a s ASP 258 CO 0.79 -0.88 1.14 -2.84 0.21 0.00 0.00 175.17 173.59 2x5a s PRO 259 N -2.35 2.33 0.61 8.23 0.02 -1.26 -4.76 135.00 137.81 2x5a s PRO 259 Ca 0.59 1.46 -0.14 0.00 0.02 0.00 0.00 61.00 62.93 2x5a s PRO 259 Cb -0.36 -1.89 -0.04 0.00 0.02 0.00 0.00 34.50 32.24 2x5a s PRO 259 CO 0.45 -1.63 1.03 -1.25 -0.33 0.00 0.00 177.00 175.28 2x5a s PRO 260 N -4.26 3.43 -0.22 5.54 0.04 -1.26 -4.80 135.00 133.47 2x5a s PRO 260 Ca 0.68 0.98 -0.03 0.00 0.04 0.00 0.00 61.00 62.66 2x5a s PRO 260 Cb -0.22 -2.06 -0.01 0.00 0.04 0.00 0.00 34.50 32.26 2x5a s PRO 260 CO 0.47 -0.70 -0.06 0.15 0.04 0.00 0.00 177.00 176.90 2x5a s LYS 261 N -4.56 3.34 -0.10 4.56 1.02 -0.29 -4.95 119.74 118.76 2x5a s LYS 261 Ca 0.59 -0.65 -0.22 0.00 0.02 0.00 0.00 55.97 55.71 2x5a s LYS 261 Cb -0.13 -2.96 -0.04 0.00 -0.52 0.00 0.00 37.83 34.18 2x5a s LYS 261 CO 0.44 -0.19 0.65 -1.64 -0.92 0.00 0.00 175.35 173.69 2x5a s MET 262 N 1.45 4.38 -0.14 1.68 -1.94 -1.26 -2.11 119.30 121.36 2x5a s MET 262 Ca 0.06 0.77 0.02 0.00 -1.71 0.00 0.00 55.69 54.82 2x5a s MET 262 Cb -0.14 -3.47 0.00 0.00 2.01 0.00 0.00 34.83 33.23 2x5a s MET 262 CO -0.04 0.03 -0.19 0.71 -0.01 0.00 0.00 175.02 175.51 2x5a s TYR 263 N 0.96 2.70 -0.08 -0.03 2.02 -0.17 0.43 117.35 123.19 2x5a s TYR 263 Ca 0.34 -1.13 0.01 0.00 -0.37 0.00 0.00 57.07 55.92 2x5a s TYR 263 Cb -0.17 -1.83 -0.03 0.00 -0.40 0.00 0.00 41.96 39.54 2x5a s TYR 263 CO 0.15 -0.50 -0.09 -1.50 -1.57 0.00 0.00 175.55 172.04 2x5a s ILE 264 N 0.70 3.50 -0.30 2.71 2.07 -0.09 -1.58 121.20 128.20 2x5a s ILE 264 Ca -0.09 -0.55 -0.12 0.00 -1.41 0.00 0.00 60.65 58.48 2x5a s ILE 264 Cb -0.16 -2.43 -0.04 0.00 0.13 0.00 0.00 42.46 39.96 2x5a s ILE 264 CO 0.01 0.58 0.23 0.00 -1.91 0.00 0.00 174.94 173.85 2x5a s ALA 265 N -0.58 3.52 0.91 1.50 0.00 -1.25 -1.70 121.76 124.17 2x5a s ALA 265 Ca 0.08 -1.17 -0.12 0.00 0.00 0.00 0.00 51.96 50.76 2x5a s ALA 265 Cb -0.12 -2.58 0.14 0.00 0.00 0.00 0.00 23.12 20.57 2x5a s ALA 265 CO 0.02 -0.72 1.10 0.15 0.00 0.00 0.00 175.76 176.30 2x5a s LYS 266 N 1.79 1.13 0.42 0.00 1.02 -0.27 -4.53 119.74 119.30 2x5a s LYS 266 Ca 0.08 0.69 0.09 0.00 0.02 0.00 0.00 55.97 56.85 2x5a s LYS 266 Cb -0.16 -1.80 0.92 0.00 -0.52 0.00 0.00 37.83 36.26 2x5a s LYS 266 CO 0.11 -2.30 2.06 -0.91 -0.92 0.00 0.00 175.35 173.39 2x5a h ASN 267 N -1.58 0.41 0.68 2.83 -0.26 -1.05 -1.79 115.58 114.82 2x5a h ASN 267 Ca -0.51 -0.01 -0.10 0.00 -0.56 0.00 0.00 56.30 55.12 2x5a h ASN 267 Cb 1.30 -0.10 -0.01 0.00 -1.06 0.00 0.00 38.32 38.44 2x5a h ASN 267 CO 0.56 0.30 -0.50 -0.55 -1.06 0.00 0.00 177.43 176.18 2x5a h ASN 268 N 0.49 0.00 0.00 5.81 7.08 -1.94 -3.47 115.58 123.55 2x5a h ASN 268 Ca 0.15 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.37 2x5a h ASN 268 Cb -0.01 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.23 2x5a h ASN 268 CO -0.03 0.50 0.00 0.61 -2.08 0.00 0.00 177.43 176.42 2x5a n GLY 269 N 0.17 1.40 3.69 9.14 0.00 -0.67 -5.11 105.19 113.80 2x5a n GLY 269 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 2x5a n GLY 269 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2x5a s ASP 270 N -1.70 6.80 -0.32 1.61 1.01 -1.26 -4.67 116.67 118.14 2x5a s ASP 270 Ca 0.00 2.20 -0.15 0.00 0.71 0.00 0.00 52.55 55.31 2x5a s ASP 270 Cb 0.00 -2.56 -0.02 0.00 1.01 0.00 0.00 42.92 41.35 2x5a s ASP 270 CO 0.00 -0.75 0.35 -0.69 0.21 0.00 0.00 175.17 174.29 2x5a s VAL 271 N 2.37 5.18 0.26 -1.27 1.01 -1.26 -1.11 120.40 125.58 2x5a s VAL 271 Ca 0.66 0.17 0.08 0.00 0.00 0.00 0.00 61.98 62.89 2x5a s VAL 271 Cb -0.33 -3.77 -0.05 0.00 0.00 0.00 0.00 36.38 32.22 2x5a s VAL 271 CO 0.28 -0.01 -0.11 0.27 0.00 0.00 0.00 175.10 175.53 2x5a s ILE 272 N 2.01 1.88 0.31 2.22 -4.36 -0.69 -4.99 121.20 117.58 2x5a s ILE 272 Ca 0.12 -2.21 -0.29 0.00 -0.26 0.00 0.00 60.65 58.02 2x5a s ILE 272 Cb -0.16 -2.31 -0.10 0.00 1.25 0.00 0.00 42.46 41.14 2x5a s ILE 272 CO 0.11 -0.40 1.14 -0.62 0.24 0.00 0.00 174.94 175.41 2x5a s ASP 273 N -3.43 7.08 0.34 4.36 -1.08 -1.26 -0.92 116.67 121.76 2x5a s ASP 273 Ca 0.28 2.33 0.04 0.00 -0.52 0.00 0.00 52.55 54.67 2x5a s ASP 273 Cb 0.01 -2.63 0.62 0.00 -1.46 0.00 0.00 42.92 39.46 2x5a s ASP 273 CO 0.11 -0.28 1.92 0.22 0.52 0.00 0.00 175.17 177.66 2x5a h TYR 274 N 3.54 0.63 -0.51 -5.34 3.20 -0.36 -2.64 116.97 115.48 2x5a h TYR 274 Ca -0.47 -0.04 -0.05 0.00 3.14 0.00 0.00 58.73 61.31 2x5a h TYR 274 Cb 1.22 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 39.27 2x5a h TYR 274 CO 0.58 0.53 0.10 0.66 -1.64 0.00 0.00 178.16 178.38 2x5a h SER 275 N 0.61 0.74 0.88 -2.11 4.64 -1.93 -2.86 113.55 113.52 2x5a h SER 275 Ca 0.14 -0.14 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2x5a h SER 275 Cb 0.20 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2x5a h SER 275 CO -0.01 0.75 0.00 0.71 -0.87 0.00 0.00 176.83 177.41 2x5a h THR 276 N 0.76 0.00 -3.16 2.95 1.35 -1.86 -3.45 112.91 109.50 2x5a h THR 276 Ca 0.16 -0.36 -0.53 0.00 -0.55 0.00 0.00 66.41 65.14 2x5a h THR 276 Cb 0.32 1.21 0.06 0.00 -1.73 0.00 0.00 68.15 68.01 2x5a h THR 276 CO 0.00 0.00 0.84 -0.47 -0.25 0.00 0.00 175.52 175.65 2x5a s TYR 277 N -3.45 2.95 -0.04 4.73 5.04 -1.08 -4.94 117.35 120.56 2x5a s TYR 277 Ca 0.03 0.80 0.06 0.00 -2.44 0.00 0.00 57.07 55.52 2x5a s TYR 277 Cb 0.09 -3.94 0.08 0.00 0.35 0.00 0.00 41.96 38.55 2x5a s TYR 277 CO 0.46 -3.24 0.97 -2.39 -1.34 0.00 0.00 175.55 170.02 2x5a n HIS 278 N 2.86 0.00 -1.86 4.97 1.44 -1.26 -5.10 115.22 116.27 2x5a n HIS 278 Ca 0.10 -0.34 0.00 0.00 -2.01 0.00 0.00 57.72 55.47 2x5a n HIS 278 Cb 0.39 -0.07 0.00 0.00 0.12 0.00 0.00 29.99 30.42 2x5a n HIS 278 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2x5a n GLY 279 N -0.46 0.39 0.82 -1.39 0.00 -1.26 -5.05 105.19 98.24 2x5a n GLY 279 Ca 0.05 -1.89 0.09 0.00 0.00 0.00 0.00 46.02 44.27 2x5a n GLY 279 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2x5a n ASP 280 N -2.64 2.76 0.00 1.61 5.75 -1.26 -4.99 116.55 117.77 2x5a n ASP 280 Ca 0.00 -1.83 0.00 0.00 -0.01 0.00 0.00 54.79 52.95 2x5a n ASP 280 Cb 0.00 -0.07 0.00 0.00 -1.03 0.00 0.00 41.12 40.02 2x5a n ASP 280 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2x5a n GLY 281 N 1.09 2.42 0.24 6.12 0.00 -1.26 -4.93 105.19 108.87 2x5a n GLY 281 Ca 0.13 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.19 2x5a n GLY 281 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2x5a h THR 282 N 0.00 1.14 -0.02 2.61 1.35 -1.98 -2.41 112.91 113.60 2x5a h THR 282 Ca 0.00 -0.60 0.00 0.00 -0.55 0.00 0.00 66.41 65.26 2x5a h THR 282 Cb 0.00 1.18 0.00 0.00 -1.73 0.00 0.00 68.15 67.60 2x5a h THR 282 CO 0.00 0.18 -0.02 -0.90 -0.25 0.00 0.00 175.52 174.53 2x5a n ASP 283 N -4.33 1.63 -4.83 5.36 5.75 -1.26 -4.92 116.55 113.94 2x5a n ASP 283 Ca -0.01 -1.51 -0.24 0.00 -0.01 0.00 0.00 54.79 53.02 2x5a n ASP 283 Cb 0.22 0.01 -0.05 0.00 -1.03 0.00 0.00 41.12 40.28 2x5a n ASP 283 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 2x5a s LEU 284 N -2.04 3.88 0.66 -2.12 1.43 -0.91 -0.41 118.68 119.18 2x5a s LEU 284 Ca 0.36 -0.15 -0.17 0.00 -1.03 0.00 0.00 54.13 53.14 2x5a s LEU 284 Cb 0.21 -2.45 -0.00 0.00 0.03 0.00 0.00 46.19 43.98 2x5a s LEU 284 CO 0.35 0.01 1.24 -2.84 0.23 0.00 0.00 176.35 175.34 2x5a s PRO 285 N -3.51 2.55 0.54 1.29 0.02 -1.26 -4.81 135.00 129.82 2x5a s PRO 285 Ca 0.32 1.91 0.33 0.00 0.02 0.00 0.00 61.00 63.58 2x5a s PRO 285 Cb -0.09 -1.87 1.33 0.00 0.02 0.00 0.00 34.50 33.89 2x5a s PRO 285 CO 0.25 -1.56 1.97 0.38 -0.33 0.00 0.00 177.00 177.71 2x5a h ASP 286 N 0.39 0.00 -4.09 2.53 3.04 -1.97 -3.43 116.42 112.89 2x5a h ASP 286 Ca -0.50 0.00 -0.35 0.00 -3.24 0.00 0.00 57.03 52.94 2x5a h ASP 286 Cb 1.31 0.00 -0.27 0.00 -1.04 0.00 0.00 39.33 39.33 2x5a h ASP 286 CO 0.53 0.00 -0.76 0.68 -2.04 0.00 0.00 179.24 177.64 2x5a s VAL 287 N -3.65 0.59 -0.36 4.15 -7.23 -1.26 -5.14 120.40 107.50 2x5a s VAL 287 Ca 0.01 -0.45 -0.07 0.00 -1.81 0.00 0.00 61.98 59.66 2x5a s VAL 287 Cb 0.09 -0.52 0.05 0.00 0.56 0.00 0.00 36.38 36.56 2x5a s VAL 287 CO 0.54 0.07 0.15 -0.60 -0.31 0.00 0.00 175.10 174.96 2x5a s ARG 288 N -0.42 2.60 -0.37 4.82 3.52 -1.26 -5.01 118.95 122.83 2x5a s ARG 288 Ca 0.01 -1.27 -0.13 0.00 -0.13 0.00 0.00 55.73 54.21 2x5a s ARG 288 Cb -0.04 -3.57 0.00 0.00 -1.56 0.00 0.00 34.95 29.79 2x5a s ARG 288 CO -0.00 -0.75 0.26 0.95 -0.81 0.00 0.00 175.30 174.94 2x5a s THR 289 N 1.41 5.16 0.29 4.11 -4.23 -1.26 -4.99 115.64 116.12 2x5a s THR 289 Ca 0.00 -0.48 0.06 0.00 -1.18 0.00 0.00 61.69 60.10 2x5a s THR 289 Cb -0.20 -3.76 -0.03 0.00 1.34 0.00 0.00 72.50 69.85 2x5a s THR 289 CO 0.03 -0.15 0.32 0.00 -0.54 0.00 0.00 174.62 174.28 2x5a s ALA 290 N 1.68 3.88 -0.12 3.99 0.00 -1.26 0.44 121.76 130.37 2x5a s ALA 290 Ca 0.05 -1.43 -0.20 0.00 0.00 0.00 0.00 51.96 50.39 2x5a s ALA 290 Cb -0.18 -1.47 0.05 0.00 0.00 0.00 0.00 23.12 21.52 2x5a s ALA 290 CO 0.10 0.13 0.49 -1.59 0.00 0.00 0.00 175.76 174.89 2x5a s LYS 291 N -3.99 0.70 -0.25 0.00 -2.85 0.03 -4.83 119.74 108.56 2x5a s LYS 291 Ca 0.38 0.40 -0.08 0.00 -1.00 0.00 0.00 55.97 55.66 2x5a s LYS 291 Cb -0.08 0.33 -0.03 0.00 -2.06 0.00 0.00 37.83 35.99 2x5a s LYS 291 CO 0.28 -0.15 0.10 0.99 0.10 0.00 0.00 175.35 176.66 2x5a s THR 292 N -0.41 4.58 -0.08 3.79 2.01 -1.26 -0.11 115.64 124.16 2x5a s THR 292 Ca -0.05 -0.08 0.01 0.00 0.31 0.00 0.00 61.69 61.87 2x5a s THR 292 Cb -0.03 -3.14 -0.03 0.00 0.01 0.00 0.00 72.50 69.31 2x5a s THR 292 CO 0.03 0.33 -0.10 -0.76 -0.69 0.00 0.00 174.62 173.44 2x5a s LEU 293 N 1.51 2.99 -0.12 4.42 1.43 0.17 -4.95 118.68 124.13 2x5a s LEU 293 Ca 0.06 -0.12 -0.01 0.00 -1.03 0.00 0.00 54.13 53.02 2x5a s LEU 293 Cb -0.15 -1.65 -0.02 0.00 0.03 0.00 0.00 46.19 44.40 2x5a s LEU 293 CO 0.05 0.31 -0.08 -0.36 0.23 0.00 0.00 176.35 176.50 2x5a s PHE 294 N -0.50 2.91 0.07 0.29 0.08 -1.26 -1.33 117.98 118.24 2x5a s PHE 294 Ca 0.07 -0.35 0.06 0.00 0.12 0.00 0.00 56.93 56.83 2x5a s PHE 294 Cb -0.12 -1.85 -0.03 0.00 -0.57 0.00 0.00 43.02 40.45 2x5a s PHE 294 CO 0.02 -0.02 -0.17 0.71 -0.10 0.00 0.00 175.22 175.66 2x5a s TYR 295 N 0.07 1.49 -0.15 0.36 2.02 -0.96 -4.99 117.35 115.19 2x5a s TYR 295 Ca -0.03 -0.41 -0.05 0.00 -0.37 0.00 0.00 57.07 56.21 2x5a s TYR 295 Cb -0.14 -0.85 -0.04 0.00 -0.40 0.00 0.00 41.96 40.53 2x5a s TYR 295 CO 0.04 0.11 0.02 -0.51 -1.57 0.00 0.00 175.55 173.63 2x5a s ASP 296 N -1.57 5.34 0.39 2.29 1.01 -1.26 -3.48 116.67 119.38 2x5a s ASP 296 Ca 0.03 0.05 -0.27 0.00 0.71 0.00 0.00 52.55 53.06 2x5a s ASP 296 Cb -0.09 -1.82 -0.10 0.00 1.01 0.00 0.00 42.92 41.92 2x5a s ASP 296 CO 0.03 0.22 1.43 -0.13 0.21 0.00 0.00 175.17 176.92 2x5a s ARG 297 N 0.06 4.04 1.19 8.23 0.52 -1.26 -4.90 118.95 126.83 2x5a s ARG 297 Ca 0.03 2.44 -0.17 0.00 -0.52 0.00 0.00 55.73 57.51 2x5a s ARG 297 Cb -0.13 -2.89 0.28 0.00 0.52 0.00 0.00 34.95 32.73 2x5a s ARG 297 CO 0.01 -0.54 1.06 0.16 0.02 0.00 0.00 175.30 176.02 2x5a s ASP 298 N -0.34 0.95 0.40 0.23 3.84 -1.25 -4.86 116.67 115.63 2x5a s ASP 298 Ca 0.54 0.93 0.08 0.00 -0.00 0.00 0.00 52.55 54.10 2x5a s ASP 298 Cb -0.44 -1.38 0.84 0.00 -1.38 0.00 0.00 42.92 40.56 2x5a s ASP 298 CO 0.59 -4.14 2.01 0.44 -0.00 0.00 0.00 175.17 174.07 2x5a h ASP 299 N -2.59 0.39 0.60 2.11 3.32 -1.95 -1.79 116.42 116.52 2x5a h ASP 299 Ca -0.50 -0.03 -0.13 0.00 0.02 0.00 0.00 57.03 56.39 2x5a h ASP 299 Cb 1.32 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 40.75 2x5a h ASP 299 CO 0.42 0.36 -0.62 0.45 -1.72 0.00 0.00 179.24 178.12 2x5a h HIS 300 N 0.44 0.03 0.00 4.55 3.86 -2.04 -3.47 115.15 118.52 2x5a h HIS 300 Ca 0.11 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.31 2x5a h HIS 300 Cb 0.09 -0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.56 2x5a h HIS 300 CO 0.00 0.64 0.00 0.41 0.86 0.00 0.00 177.93 179.84 2x5a n GLY 301 N 0.27 1.73 3.76 2.45 0.00 -0.67 -5.10 105.19 107.64 2x5a n GLY 301 Ca -0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 2x5a n GLY 301 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2x5a s ASN 302 N -1.64 5.88 0.76 1.61 -0.87 -1.26 -4.66 114.94 114.76 2x5a s ASN 302 Ca 0.00 2.68 -0.14 0.00 -1.57 0.00 0.00 52.86 53.83 2x5a s ASN 302 Cb 0.00 -2.63 0.06 0.00 -0.02 0.00 0.00 41.25 38.65 2x5a s ASN 302 CO 0.00 -1.15 1.19 -2.16 -2.57 0.00 0.00 177.10 172.41 2x5a s PRO 303 N -2.56 1.99 0.37 -0.60 0.04 -1.26 -3.91 135.00 129.07 2x5a s PRO 303 Ca 0.63 1.68 -0.28 0.00 0.04 0.00 0.00 61.00 63.07 2x5a s PRO 303 Cb -0.38 -1.82 -0.11 0.00 0.04 0.00 0.00 34.50 32.23 2x5a s PRO 303 CO 0.48 -1.93 1.43 -1.25 0.04 0.00 0.00 177.00 175.76 2x5a s PRO 304 N -4.09 4.15 0.65 0.56 0.04 -1.26 -4.96 135.00 130.09 2x5a s PRO 304 Ca 0.72 2.46 -0.17 0.00 0.04 0.00 0.00 61.00 64.05 2x5a s PRO 304 Cb -0.27 -2.97 -0.03 0.00 0.04 0.00 0.00 34.50 31.26 2x5a s PRO 304 CO 0.48 -0.46 0.90 -1.91 0.04 0.00 0.00 177.00 176.05 2x5a n GLU 305 N 0.50 0.68 -0.11 4.56 2.13 -1.26 -4.94 120.64 122.21 2x5a n GLU 305 Ca 0.01 0.28 -0.10 0.00 0.66 0.00 0.00 57.16 58.01 2x5a n GLU 305 Cb 0.40 -2.13 -0.02 0.00 0.27 0.00 0.00 31.44 29.96 2x5a n GLU 305 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 2x5a h LEU 306 N 0.14 0.52 -1.35 4.31 7.12 -2.00 -3.11 115.31 120.93 2x5a h LEU 306 Ca -0.48 -0.24 0.04 0.00 0.13 0.00 0.00 57.88 57.33 2x5a h LEU 306 Cb 1.36 -0.14 -0.04 0.00 -0.53 0.00 0.00 40.66 41.31 2x5a h LEU 306 CO 0.48 0.62 0.46 0.77 -0.13 0.00 0.00 178.44 180.65 2x5a h SER 307 N 0.39 0.72 -0.06 1.25 4.64 -1.96 -1.61 113.55 116.92 2x5a h SER 307 Ca 0.11 -0.01 -0.11 0.00 -0.47 0.00 0.00 61.79 61.30 2x5a h SER 307 Cb 0.31 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 62.22 2x5a h SER 307 CO 0.00 0.50 -0.32 0.71 -0.87 0.00 0.00 176.83 176.85 2x5a h THR 308 N 0.84 1.28 -0.29 2.95 1.35 -1.93 -2.93 112.91 114.18 2x5a h THR 308 Ca 0.28 -1.42 -0.09 0.00 -0.55 0.00 0.00 66.41 64.63 2x5a h THR 308 Cb 0.07 1.43 -0.01 0.00 -1.73 0.00 0.00 68.15 67.92 2x5a h THR 308 CO -0.08 0.45 -0.18 0.40 -0.25 0.00 0.00 175.52 175.86 2x5a h ILE 309 N 0.46 1.30 -0.79 6.82 2.04 -1.39 -3.28 117.51 122.66 2x5a h ILE 309 Ca 0.06 -1.30 0.19 0.00 1.00 0.00 0.00 64.86 64.80 2x5a h ILE 309 Cb 0.78 1.51 -0.13 0.00 -0.74 0.00 0.00 36.82 38.24 2x5a h ILE 309 CO 0.06 0.41 0.14 0.50 0.00 0.00 0.00 178.15 179.27 2x5a h LYS 310 N 0.38 0.19 -0.93 2.37 3.64 -1.13 -1.56 116.57 119.54 2x5a h LYS 310 Ca 0.06 -0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.49 2x5a h LYS 310 Cb 0.71 -0.04 -0.06 0.00 -0.41 0.00 0.00 32.23 32.43 2x5a h LYS 310 CO 0.05 0.13 0.59 0.28 -2.27 0.00 0.00 179.45 178.22 2x5a h VAL 311 N 0.20 1.07 0.00 2.00 2.07 -1.60 -2.01 116.25 117.97 2x5a h VAL 311 Ca 0.46 -0.37 0.00 0.00 0.82 0.00 0.00 66.70 67.61 2x5a h VAL 311 Cb 0.85 -0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.52 2x5a h VAL 311 CO -0.61 0.20 0.00 1.21 0.02 0.00 0.00 177.57 178.39 2x5a n GLU 312 N -4.56 0.42 -1.63 1.57 4.07 -0.59 -3.59 120.64 116.32 2x5a n GLU 312 Ca 0.14 0.04 0.02 0.00 -0.06 0.00 0.00 57.16 57.29 2x5a n GLU 312 Cb 0.18 -1.50 0.06 0.00 -0.06 0.00 0.00 31.44 30.12 2x5a n GLU 312 CO 0.00 0.00 0.00 1.51 -0.06 0.00 0.00 177.13 178.58 2x5a n ILE 313 N -1.26 0.80 -3.65 6.31 3.06 -0.79 -4.68 119.36 119.14 2x5a n ILE 313 Ca 0.13 -1.97 -0.35 0.00 -2.50 0.00 0.00 62.75 58.06 2x5a n ILE 313 Cb 0.20 0.70 -0.05 0.00 0.54 0.00 0.00 39.64 41.03 2x5a n ILE 313 CO 0.00 0.00 0.00 -0.44 -2.50 0.00 0.00 176.55 173.61 2x5a s SER 314 N -2.67 6.59 0.39 9.51 0.01 -0.99 -4.84 113.70 121.70 2x5a s SER 314 Ca 0.34 0.70 -0.24 0.00 1.31 0.00 0.00 55.95 58.06 2x5a s SER 314 Cb 0.37 -2.15 -0.09 0.00 0.21 0.00 0.00 66.02 64.37 2x5a s SER 314 CO -0.11 0.23 1.06 -2.16 0.41 0.00 0.00 173.24 172.67 2x5a s PRO 315 N -1.72 4.19 0.33 12.44 0.04 -1.26 -2.76 135.00 146.26 2x5a s PRO 315 Ca 0.29 1.55 -0.03 0.00 0.04 0.00 0.00 61.00 62.86 2x5a s PRO 315 Cb -0.14 -2.60 -0.04 0.00 0.04 0.00 0.00 34.50 31.76 2x5a s PRO 315 CO 0.16 -0.13 0.58 -1.54 0.04 0.00 0.00 177.00 176.11 2x5a s SER 316 N -1.49 6.36 -0.63 6.66 1.04 -1.26 -4.77 113.70 119.62 2x5a s SER 316 Ca 0.57 0.63 -0.26 0.00 0.48 0.00 0.00 55.95 57.37 2x5a s SER 316 Cb -0.23 -2.11 -0.04 0.00 0.10 0.00 0.00 66.02 63.74 2x5a s SER 316 CO 0.29 -0.28 2.00 0.42 0.98 0.00 0.00 173.24 176.66 2x5a s THR 317 N -2.25 3.28 -0.35 2.02 -4.23 -1.25 -4.96 115.64 107.90 2x5a s THR 317 Ca 0.43 0.09 -0.29 0.00 -1.18 0.00 0.00 61.69 60.74 2x5a s THR 317 Cb -0.10 -3.73 0.01 0.00 1.34 0.00 0.00 72.50 70.02 2x5a s THR 317 CO 0.34 -0.70 1.27 -0.63 -0.54 0.00 0.00 174.62 174.36 2x5a s ILE 318 N 10.04 4.15 -0.08 2.99 1.09 -1.26 -3.56 121.20 134.56 2x5a s ILE 318 Ca 0.75 1.26 0.03 0.00 -1.10 0.00 0.00 60.65 61.59 2x5a s ILE 318 Cb -0.13 -4.26 0.01 0.00 -1.06 0.00 0.00 42.46 37.02 2x5a s ILE 318 CO 0.19 -0.61 -0.18 -0.69 -0.10 0.00 0.00 174.94 173.55 2x5a s VAL 319 N 4.50 1.59 -0.12 2.92 1.01 -0.50 -4.95 120.40 124.84 2x5a s VAL 319 Ca 0.55 -0.74 -0.21 0.00 0.00 0.00 0.00 61.98 61.58 2x5a s VAL 319 Cb -0.14 -1.40 -0.04 0.00 0.00 0.00 0.00 36.38 34.80 2x5a s VAL 319 CO 0.25 0.46 0.59 -0.89 0.00 0.00 0.00 175.10 175.51 2x5a s THR 320 N 0.55 5.10 -0.25 3.92 2.01 -1.26 0.04 115.64 125.74 2x5a s THR 320 Ca -0.16 1.17 -0.07 0.00 0.31 0.00 0.00 61.69 62.94 2x5a s THR 320 Cb -0.17 -3.92 -0.02 0.00 0.01 0.00 0.00 72.50 68.40 2x5a s THR 320 CO 0.06 0.24 0.07 -0.13 -0.69 0.00 0.00 174.62 174.17 2x5a s ARG 321 N 1.04 3.60 -0.28 4.92 0.52 0.14 -3.18 118.95 125.70 2x5a s ARG 321 Ca 0.30 -0.51 -0.03 0.00 -0.52 0.00 0.00 55.73 54.97 2x5a s ARG 321 Cb -0.16 -3.32 0.03 0.00 0.52 0.00 0.00 34.95 32.02 2x5a s ARG 321 CO 0.13 -0.21 0.00 -0.51 0.02 0.00 0.00 175.30 174.73 2x5a s LEU 322 N 1.60 3.61 -0.30 2.53 1.43 -0.46 -2.09 118.68 124.99 2x5a s LEU 322 Ca 0.06 -0.95 -0.11 0.00 -1.03 0.00 0.00 54.13 52.10 2x5a s LEU 322 Cb -0.15 -1.74 -0.03 0.00 0.03 0.00 0.00 46.19 44.30 2x5a s LEU 322 CO 0.03 -0.19 0.19 -0.63 0.23 0.00 0.00 176.35 175.98 2x5a s ILE 323 N 1.35 5.06 0.06 -0.59 1.09 -1.13 -0.24 121.20 126.81 2x5a s ILE 323 Ca -0.01 -0.10 -0.02 0.00 -1.10 0.00 0.00 60.65 59.43 2x5a s ILE 323 Cb -0.18 -3.50 -0.04 0.00 -1.06 0.00 0.00 42.46 37.69 2x5a s ILE 323 CO -0.01 0.14 -0.01 0.72 -0.10 0.00 0.00 174.94 175.68 2x5a s PHE 324 N 1.71 0.53 0.50 3.97 -0.12 -0.28 -1.98 117.98 122.31 2x5a s PHE 324 Ca 0.06 -1.05 -0.21 0.00 -0.05 0.00 0.00 56.93 55.68 2x5a s PHE 324 Cb -0.17 -0.38 -0.07 0.00 -0.63 0.00 0.00 43.02 41.78 2x5a s PHE 324 CO 0.09 -0.40 1.10 -0.80 -0.05 0.00 0.00 175.22 175.16 2x5a s ASN 325 N -2.93 6.06 0.11 1.98 0.01 -0.41 -0.40 114.94 119.37 2x5a s ASN 325 Ca 0.09 2.11 -0.31 0.00 -0.71 0.00 0.00 52.86 54.03 2x5a s ASN 325 Cb 0.08 -2.58 -0.08 0.00 0.41 0.00 0.00 41.25 39.08 2x5a s ASN 325 CO -0.09 -0.98 1.45 -1.58 -1.51 0.00 0.00 177.10 174.39 2x5a s GLN 326 N -3.12 4.29 -0.31 -0.60 2.00 0.42 -4.83 119.66 117.51 2x5a s GLN 326 Ca 0.69 2.14 -0.16 0.00 -2.00 0.00 0.00 55.36 56.03 2x5a s GLN 326 Cb -0.22 -3.29 -0.02 0.00 0.80 0.00 0.00 33.01 30.28 2x5a s GLN 326 CO 0.26 -0.51 0.40 1.21 -0.50 0.00 0.00 175.29 176.15 2x5a s ASN 327 N 1.30 6.24 0.32 6.67 3.84 -1.26 -4.97 114.94 127.07 2x5a s ASN 327 Ca 0.66 0.05 0.26 0.00 0.21 0.00 0.00 52.86 54.04 2x5a s ASN 327 Cb -0.38 -2.22 1.02 0.00 -0.55 0.00 0.00 41.25 39.12 2x5a s ASN 327 CO 0.30 -0.30 1.77 1.05 -2.79 0.00 0.00 177.10 177.13 2x5a h GLU 328 N 8.33 0.00 -0.10 0.43 4.11 -1.99 -2.60 114.58 122.76 2x5a h GLU 328 Ca -0.30 0.00 -0.19 0.00 0.07 0.00 0.00 59.36 58.93 2x5a h GLU 328 Cb 1.15 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.40 2x5a h GLU 328 CO 0.69 0.00 -0.74 -0.07 0.07 0.00 0.00 179.01 178.96 2x5a h LEU 329 N 0.00 0.60 -6.39 3.06 3.38 -2.04 -3.39 115.31 110.53 2x5a h LEU 329 Ca 0.00 -0.39 -0.51 0.00 0.09 0.00 0.00 57.88 57.07 2x5a h LEU 329 Cb 0.46 -0.18 -0.36 0.00 0.09 0.00 0.00 40.66 40.67 2x5a h LEU 329 CO 0.00 1.15 -0.82 -0.22 0.09 0.00 0.00 178.44 178.63 2x5a s LEU 330 N -8.07 0.69 0.31 1.67 0.20 -1.13 -5.15 118.68 107.20 2x5a s LEU 330 Ca -0.07 -2.24 -0.29 0.00 0.69 0.00 0.00 54.13 52.22 2x5a s LEU 330 Cb 0.10 -0.05 -0.10 0.00 -0.43 0.00 0.00 46.19 45.72 2x5a s LEU 330 CO 0.86 -0.25 1.17 -2.84 -0.29 0.00 0.00 176.35 175.00 2x5a s PRO 331 N 0.89 4.50 -0.06 0.98 0.02 -0.99 -4.47 135.00 135.86 2x5a s PRO 331 Ca 0.22 1.93 0.06 0.00 0.02 0.00 0.00 61.00 63.23 2x5a s PRO 331 Cb -0.13 -3.10 -0.01 0.00 0.02 0.00 0.00 34.50 31.28 2x5a s PRO 331 CO -0.05 0.04 -0.24 -0.51 -0.33 0.00 0.00 177.00 175.91 2x5a s LEU 332 N -1.66 2.13 0.36 -5.54 1.43 -1.26 -5.06 118.68 109.08 2x5a s LEU 332 Ca 0.47 -0.49 0.07 0.00 -1.03 0.00 0.00 54.13 53.15 2x5a s LEU 332 Cb -0.34 -1.40 -0.07 0.00 0.03 0.00 0.00 46.19 44.41 2x5a s LEU 332 CO 0.44 0.24 -0.01 -0.31 0.23 0.00 0.00 176.35 176.94 2x5a s TYR 333 N -0.13 2.31 0.28 0.29 2.02 -1.26 -5.01 117.35 115.86 2x5a s TYR 333 Ca -0.04 -0.70 -0.30 0.00 -0.37 0.00 0.00 57.07 55.66 2x5a s TYR 333 Cb -0.14 -1.51 -0.13 0.00 -0.40 0.00 0.00 41.96 39.78 2x5a s TYR 333 CO 0.04 0.37 1.40 0.28 -1.57 0.00 0.00 175.55 176.07 2x5a n VAL 334 N -0.83 1.32 -2.07 0.71 0.31 -1.26 -3.17 118.33 113.33 2x5a n VAL 334 Ca -0.05 -0.33 -0.09 0.00 -0.01 0.00 0.00 64.34 63.86 2x5a n VAL 334 Cb 0.66 -1.59 -0.01 0.00 -0.91 0.00 0.00 33.84 31.99 2x5a n VAL 334 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2x5a n ASN 335 N 1.69 -3.30 -4.70 4.52 3.02 -0.19 -5.01 115.26 111.29 2x5a n ASN 335 Ca 0.09 0.02 -0.36 0.00 -0.03 0.00 0.00 54.58 54.30 2x5a n ASN 335 Cb 0.34 -2.46 -0.09 0.00 -0.61 0.00 0.00 39.78 36.96 2x5a n ASN 335 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 2x5a s ASP 336 N -2.62 6.15 -0.27 6.41 1.01 -1.19 -4.92 116.67 121.24 2x5a s ASP 336 Ca 0.00 0.17 -0.29 0.00 0.71 0.00 0.00 52.55 53.14 2x5a s ASP 336 Cb 0.00 -2.09 0.00 0.00 1.01 0.00 0.00 42.92 41.84 2x5a s ASP 336 CO 0.00 0.13 1.24 -0.76 0.21 0.00 0.00 175.17 175.99 2x5a s LEU 337 N 0.69 3.96 0.12 1.23 1.43 -1.26 -2.37 118.68 122.48 2x5a s LEU 337 Ca 0.08 1.28 0.05 0.00 -1.03 0.00 0.00 54.13 54.51 2x5a s LEU 337 Cb -0.12 -3.54 -0.04 0.00 0.03 0.00 0.00 46.19 42.52 2x5a s LEU 337 CO 0.01 -0.96 -0.12 0.68 0.23 0.00 0.00 176.35 176.19 2x5a s VAL 338 N 4.03 1.18 -0.29 -1.59 -7.23 -0.63 -1.09 120.40 114.78 2x5a s VAL 338 Ca 0.54 -1.81 0.01 0.00 -1.81 0.00 0.00 61.98 58.91 2x5a s VAL 338 Cb -0.17 -1.59 0.09 0.00 0.56 0.00 0.00 36.38 35.27 2x5a s VAL 338 CO 0.19 -0.56 0.03 -1.81 -0.31 0.00 0.00 175.10 172.64 2x5a s ASP 339 N -2.69 4.19 -0.15 4.85 1.01 0.14 -1.77 116.67 122.25 2x5a s ASP 339 Ca 0.11 -1.63 -0.12 0.00 0.71 0.00 0.00 52.55 51.61 2x5a s ASP 339 Cb -0.02 -1.21 -0.05 0.00 1.01 0.00 0.00 42.92 42.65 2x5a s ASP 339 CO 0.02 -0.34 0.24 -0.63 0.21 0.00 0.00 175.17 174.66 2x5a s ILE 340 N 1.32 5.34 -0.35 0.77 1.09 0.28 -0.58 121.20 129.07 2x5a s ILE 340 Ca 0.05 0.44 -0.13 0.00 -1.10 0.00 0.00 60.65 59.90 2x5a s ILE 340 Cb -0.18 -3.56 -0.01 0.00 -1.06 0.00 0.00 42.46 37.64 2x5a s ILE 340 CO -0.13 0.46 0.25 0.26 -0.10 0.00 0.00 174.94 175.68 2x5a s TRP 341 N 0.04 3.23 -0.17 3.97 0.52 -0.34 -0.70 118.94 125.50 2x5a s TRP 341 Ca 0.15 -0.26 -0.03 0.00 0.02 0.00 0.00 56.10 55.98 2x5a s TRP 341 Cb -0.13 -2.49 0.05 0.00 -1.15 0.00 0.00 33.47 29.76 2x5a s TRP 341 CO 0.03 -0.39 0.03 -0.47 0.02 0.00 0.00 176.95 176.18 2x5a s TYR 342 N 1.72 0.89 -1.47 -1.98 5.04 0.00 -1.53 117.35 120.01 2x5a s TYR 342 Ca 0.06 -0.69 -0.07 0.00 -2.44 0.00 0.00 57.07 53.93 2x5a s TYR 342 Cb -0.18 -0.96 0.02 0.00 0.35 0.00 0.00 41.96 41.19 2x5a s TYR 342 CO 0.10 -0.55 0.83 0.39 -1.34 0.00 0.00 175.55 174.99 2x5a n GLU 343 N 5.09 -5.94 -0.21 4.97 -0.58 -1.26 -2.52 120.64 120.18 2x5a n GLU 343 Ca -0.08 0.83 0.00 0.00 -0.42 0.00 0.00 57.16 57.49 2x5a n GLU 343 Cb 0.48 -5.76 0.00 0.00 -0.57 0.00 0.00 31.44 25.59 2x5a n GLU 343 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2x5a n GLY 344 N -1.69 0.99 3.56 0.62 0.00 -1.26 -5.06 105.19 102.35 2x5a n GLY 344 Ca -0.05 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.63 2x5a n GLY 344 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2x5a s LYS 345 N -0.58 2.71 -0.20 1.61 1.02 -1.05 -5.12 119.74 118.14 2x5a s LYS 345 Ca 0.00 -0.58 -0.12 0.00 0.02 0.00 0.00 55.97 55.29 2x5a s LYS 345 Cb 0.00 -2.55 -0.05 0.00 -0.52 0.00 0.00 37.83 34.71 2x5a s LYS 345 CO 0.00 0.65 0.23 -1.17 -0.92 0.00 0.00 175.35 174.14 2x5a s LEU 346 N -0.78 4.19 -0.08 3.17 2.96 -1.26 -0.82 118.68 126.07 2x5a s LEU 346 Ca 0.12 0.33 0.04 0.00 -0.22 0.00 0.00 54.13 54.40 2x5a s LEU 346 Cb -0.11 -2.24 0.00 0.00 0.50 0.00 0.00 46.19 44.34 2x5a s LEU 346 CO 0.01 0.09 -0.19 -0.31 -1.32 0.00 0.00 176.35 174.63 2x5a s TYR 347 N 0.69 2.06 -0.11 5.38 2.02 0.12 -5.01 117.35 122.51 2x5a s TYR 347 Ca 0.12 -0.77 0.02 0.00 -0.37 0.00 0.00 57.07 56.08 2x5a s TYR 347 Cb -0.13 -1.41 -0.01 0.00 -0.40 0.00 0.00 41.96 40.02 2x5a s TYR 347 CO 0.03 -0.32 -0.20 -1.12 -1.57 0.00 0.00 175.55 172.37 2x5a s SER 348 N 0.35 3.42 0.00 2.29 0.01 -1.26 -0.55 113.70 117.95 2x5a s SER 348 Ca -0.14 -0.48 0.00 0.00 1.31 0.00 0.00 55.95 56.65 2x5a s SER 348 Cb -0.16 -1.48 0.00 0.00 0.21 0.00 0.00 66.02 64.59 2x5a s SER 348 CO 0.06 0.16 0.00 0.61 0.41 0.00 0.00 173.24 174.48 2x5a n GLY 349 N 3.53 1.12 3.22 3.44 0.00 -0.73 -1.67 105.19 114.09 2x5a n GLY 349 Ca -0.19 -0.15 -0.13 0.00 0.00 0.00 0.00 46.02 45.55 2x5a n GLY 349 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2x5a s TYR 350 N -0.36 1.13 -0.81 1.61 -0.85 0.45 -1.60 117.35 116.93 2x5a s TYR 350 Ca 0.00 -0.77 -0.25 0.00 -0.52 0.00 0.00 57.07 55.53 2x5a s TYR 350 Cb 0.00 -0.60 0.05 0.00 0.38 0.00 0.00 41.96 41.79 2x5a s TYR 350 CO 0.00 0.01 1.26 0.42 -1.52 0.00 0.00 175.55 175.71 2x5a s ILE 351 N -3.21 3.94 0.10 -3.49 -1.09 -1.00 -1.20 121.20 115.25 2x5a s ILE 351 Ca 0.13 -0.15 -0.13 0.00 -2.23 0.00 0.00 60.65 58.28 2x5a s ILE 351 Cb 0.02 -4.90 -0.17 0.00 -1.58 0.00 0.00 42.46 35.83 2x5a s ILE 351 CO -0.01 -1.78 1.28 0.00 -1.23 0.00 0.00 174.94 173.20 2x5a h ALA 352 N 9.81 0.27 -2.72 9.38 0.00 -1.51 -0.47 119.26 134.02 2x5a h ALA 352 Ca -0.14 -0.62 -0.28 0.00 0.00 0.00 0.00 54.91 53.87 2x5a h ALA 352 Cb 1.04 0.00 -0.13 0.00 0.00 0.00 0.00 17.79 18.70 2x5a h ALA 352 CO 1.29 0.69 -0.49 0.34 0.00 0.00 0.00 179.25 181.07 2x5a s ASP 353 N -7.15 0.56 -0.15 0.00 -1.08 -1.24 -4.69 116.67 102.92 2x5a s ASP 353 Ca -0.10 -1.44 -0.07 0.00 -0.52 0.00 0.00 52.55 50.43 2x5a s ASP 353 Cb 0.08 0.47 0.07 0.00 -1.46 0.00 0.00 42.92 42.08 2x5a s ASP 353 CO 0.91 -0.97 0.34 -0.60 0.52 0.00 0.00 175.17 175.37 2x5a s ARG 354 N -3.87 0.27 -0.31 4.34 3.52 -1.26 -2.44 118.95 119.20 2x5a s ARG 354 Ca 0.37 0.80 -0.09 0.00 -0.13 0.00 0.00 55.73 56.67 2x5a s ARG 354 Cb 0.04 0.05 -0.00 0.00 -1.56 0.00 0.00 34.95 33.48 2x5a s ARG 354 CO 0.16 -0.22 0.15 0.54 -0.81 0.00 0.00 175.30 175.12 2x5a s VAL 355 N 1.99 4.53 -0.42 7.11 0.11 -0.43 -0.73 120.40 132.56 2x5a s VAL 355 Ca -0.04 -0.47 -0.20 0.00 -2.93 0.00 0.00 61.98 58.35 2x5a s VAL 355 Cb -0.11 -3.32 0.02 0.00 -1.53 0.00 0.00 36.38 31.44 2x5a s VAL 355 CO -0.11 0.06 0.58 -0.54 -3.33 0.00 0.00 175.10 171.76 2x5a s LYS 356 N 1.60 3.28 0.34 1.54 -0.14 0.54 -2.58 119.74 124.32 2x5a s LYS 356 Ca 0.04 -0.43 0.08 0.00 -1.36 0.00 0.00 55.97 54.31 2x5a s LYS 356 Cb -0.17 -3.93 -0.07 0.00 -1.68 0.00 0.00 37.83 31.98 2x5a s LYS 356 CO 0.06 -0.92 -0.06 0.95 -0.76 0.00 0.00 175.35 174.61 2x5a s THR 357 N 2.60 2.04 0.45 2.17 -4.23 -1.02 -0.86 115.64 116.79 2x5a s THR 357 Ca 0.20 -2.15 0.23 0.00 -1.18 0.00 0.00 61.69 58.79 2x5a s THR 357 Cb -0.15 -2.67 0.26 0.00 1.34 0.00 0.00 72.50 71.28 2x5a s THR 357 CO 0.17 -0.18 2.07 -0.33 -0.54 0.00 0.00 174.62 175.81 2x5a h GLU 358 N 2.04 0.00 0.00 3.99 5.08 -1.98 -3.34 114.58 120.37 2x5a h GLU 358 Ca -0.42 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 57.75 2x5a h GLU 358 Cb 1.24 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.47 2x5a h GLU 358 CO 0.71 0.12 -1.61 1.19 -1.00 0.00 0.00 179.01 178.43 2x5a n PHE 359 N -3.92 0.00 -4.50 4.33 3.72 -1.26 -5.09 117.46 110.74 2x5a n PHE 359 Ca -0.02 0.00 -0.24 0.00 -0.05 0.00 0.00 57.45 57.14 2x5a n PHE 359 Cb 0.22 -0.69 -0.10 0.00 -0.94 0.00 0.00 39.48 37.97 2x5a n PHE 359 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 2x5a s ASN 360 N -6.54 2.76 -0.16 4.37 -0.87 -1.26 -5.14 114.94 108.10 2x5a s ASN 360 Ca -0.32 -1.43 0.00 0.00 -1.57 0.00 0.00 52.86 49.54 2x5a s ASN 360 Cb 0.08 -0.02 0.03 0.00 -0.02 0.00 0.00 41.25 41.33 2x5a s ASN 360 CO 0.44 -0.64 -0.11 -0.62 -2.57 0.00 0.00 177.10 173.60 2x5a s ASP 361 N -3.56 2.90 0.29 -1.22 2.15 -1.26 -2.45 116.67 113.52 2x5a s ASP 361 Ca 0.33 -0.63 0.11 0.00 0.43 0.00 0.00 52.55 52.80 2x5a s ASP 361 Cb 0.08 -1.14 -0.05 0.00 -0.30 0.00 0.00 42.92 41.51 2x5a s ASP 361 CO 0.15 -0.11 -0.17 -0.13 -0.17 0.00 0.00 175.17 174.75 2x5a s ARG 362 N 1.49 1.75 0.04 4.34 0.52 -1.07 -0.44 118.95 125.59 2x5a s ARG 362 Ca 0.02 -1.78 0.05 0.00 -0.52 0.00 0.00 55.73 53.51 2x5a s ARG 362 Cb -0.14 -1.79 -0.02 0.00 0.52 0.00 0.00 34.95 33.52 2x5a s ARG 362 CO -0.09 0.30 -0.14 -0.51 0.02 0.00 0.00 175.30 174.87 2x5a s LEU 363 N -3.54 2.18 -0.24 2.53 2.01 0.47 -1.32 118.68 120.77 2x5a s LEU 363 Ca 0.31 -0.47 -0.07 0.00 0.01 0.00 0.00 54.13 53.91 2x5a s LEU 363 Cb -0.04 -0.60 -0.02 0.00 0.01 0.00 0.00 46.19 45.54 2x5a s LEU 363 CO 0.16 0.02 0.05 -0.63 1.01 0.00 0.00 176.35 176.96 2x5a s ILE 364 N -0.89 4.13 -0.23 -0.59 1.01 -1.02 -1.13 121.20 122.48 2x5a s ILE 364 Ca 0.01 -0.23 -0.09 0.00 0.00 0.00 0.00 60.65 60.34 2x5a s ILE 364 Cb -0.08 -2.92 -0.04 0.00 0.01 0.00 0.00 42.46 39.42 2x5a s ILE 364 CO 0.01 0.36 0.12 0.12 0.00 0.00 0.00 174.94 175.55 2x5a s PHE 365 N 1.59 3.24 -0.24 3.97 5.36 0.67 -1.18 117.98 131.40 2x5a s PHE 365 Ca 0.06 0.05 -0.00 0.00 -0.96 0.00 0.00 56.93 56.08 2x5a s PHE 365 Cb -0.15 -2.22 0.03 0.00 -0.34 0.00 0.00 43.02 40.34 2x5a s PHE 365 CO 0.02 -0.02 -0.10 0.08 -1.46 0.00 0.00 175.22 173.75 2x5a s VAL 366 N 1.06 2.58 0.10 3.12 1.01 -0.34 -1.36 120.40 126.57 2x5a s VAL 366 Ca 0.06 -1.11 -0.31 0.00 0.00 0.00 0.00 61.98 60.62 2x5a s VAL 366 Cb -0.14 -2.30 -0.08 0.00 0.00 0.00 0.00 36.38 33.87 2x5a s VAL 366 CO 0.04 0.23 1.39 -0.70 0.00 0.00 0.00 175.10 176.07 2x5a s GLU 367 N 1.28 4.32 0.06 2.72 2.12 -1.19 -0.41 118.70 127.59 2x5a s GLU 367 Ca -0.00 2.07 0.28 0.00 0.36 0.00 0.00 54.97 57.67 2x5a s GLU 367 Cb -0.16 -3.29 1.11 0.00 0.26 0.00 0.00 34.13 32.05 2x5a s GLU 367 CO -0.06 -0.45 1.88 0.45 -0.54 0.00 0.00 175.26 176.53 2x5a n SER 368 N 4.11 0.24 0.00 -1.70 2.88 -0.67 -4.77 113.62 113.71 2x5a n SER 368 Ca 0.12 0.52 0.00 0.00 -1.33 0.00 0.00 58.87 58.18 2x5a n SER 368 Cb 0.42 -0.59 0.00 0.00 -0.75 0.00 0.00 64.21 63.30 2x5a n SER 368 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2x5a n GLY 369 N 1.43 0.68 3.91 0.46 0.00 -1.26 -4.97 105.19 105.43 2x5a n GLY 369 Ca 0.07 -0.86 -0.29 0.00 0.00 0.00 0.00 46.02 44.93 2x5a n GLY 369 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2x5a n ASP 370 N 2.83 -3.91 0.05 1.61 2.03 -1.26 -4.96 116.55 112.94 2x5a n ASP 370 Ca 0.00 -0.82 -0.11 0.00 0.52 0.00 0.00 54.79 54.38 2x5a n ASP 370 Cb 0.00 -3.78 -0.08 0.00 -0.72 0.00 0.00 41.12 36.54 2x5a n ASP 370 CO 0.00 0.00 0.00 0.50 -1.92 0.00 0.00 177.20 175.78 2x5a h LYS 371 N -2.00 -0.20 -0.01 -0.67 3.64 -2.00 -3.54 116.57 111.80 2x5a h LYS 371 Ca -0.59 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.81 2x5a h LYS 371 Cb 1.37 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.24 2x5a h LYS 371 CO 0.66 0.24 0.00 -0.35 -2.27 0.00 0.00 179.45 177.74