#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ffz s LYS 3 N 0.00 4.12 -0.27 0.54 -0.14 -1.26 -4.97 119.74 117.75 3ffz s LYS 3 Ca 0.00 0.81 -0.00 0.00 -1.36 0.00 0.00 55.97 55.42 3ffz s LYS 3 Cb 0.00 -2.50 0.05 0.00 -1.68 0.00 0.00 37.83 33.69 3ffz s LYS 3 CO 0.00 0.18 -0.05 0.42 -0.76 0.00 0.00 175.35 175.14 3ffz s ILE 4 N -1.90 2.70 -0.07 2.17 1.01 -1.26 -4.58 121.20 119.27 3ffz s ILE 4 Ca 0.53 -1.37 -0.28 0.00 0.00 0.00 0.00 60.65 59.53 3ffz s ILE 4 Cb -0.12 -2.52 -0.02 0.00 0.01 0.00 0.00 42.46 39.81 3ffz s ILE 4 CO 0.18 -0.00 0.90 0.20 0.00 0.00 0.00 174.94 176.21 3ffz s ASN 5 N 1.23 7.18 -0.07 3.58 0.02 -0.41 -5.05 114.94 121.42 3ffz s ASN 5 Ca -0.05 1.44 -0.11 0.00 -1.02 0.00 0.00 52.86 53.12 3ffz s ASN 5 Cb -0.19 -2.51 -0.05 0.00 0.02 0.00 0.00 41.25 38.52 3ffz s ASN 5 CO -0.03 -0.29 0.28 -0.44 0.02 0.00 0.00 177.10 176.63 3ffz s SER 6 N 1.01 6.59 0.27 -1.22 0.01 -1.26 -4.67 113.70 114.42 3ffz s SER 6 Ca 0.45 0.71 0.02 0.00 1.31 0.00 0.00 55.95 58.44 3ffz s SER 6 Cb -0.19 -2.16 -0.03 0.00 0.21 0.00 0.00 66.02 63.85 3ffz s SER 6 CO 0.21 0.35 0.23 -0.36 0.41 0.00 0.00 173.24 174.07 3ffz s PHE 7 N -0.94 1.39 0.14 2.43 0.08 -1.26 -5.15 117.98 114.66 3ffz s PHE 7 Ca 0.19 -1.48 0.06 0.00 0.12 0.00 0.00 56.93 55.82 3ffz s PHE 7 Cb -0.14 -0.57 -0.04 0.00 -0.57 0.00 0.00 43.02 41.69 3ffz s PHE 7 CO 0.08 -0.78 -0.13 -0.80 -0.10 0.00 0.00 175.22 173.50 3ffz s ASN 8 N -3.25 1.96 0.09 1.36 0.01 -1.26 -4.77 114.94 109.07 3ffz s ASN 8 Ca 0.39 -0.89 -0.16 0.00 -0.71 0.00 0.00 52.86 51.49 3ffz s ASN 8 Cb 0.04 -0.05 -0.10 0.00 0.41 0.00 0.00 41.25 41.55 3ffz s ASN 8 CO 0.19 -0.21 1.39 0.22 -1.51 0.00 0.00 177.10 177.19 3ffz h TYR 9 N 3.22 0.77 0.00 2.20 3.20 -1.92 -2.93 116.97 121.50 3ffz h TYR 9 Ca -0.38 -0.24 0.00 0.00 3.14 0.00 0.00 58.73 61.25 3ffz h TYR 9 Cb 1.20 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 39.31 3ffz h TYR 9 CO 0.66 0.96 0.00 0.27 -1.64 0.00 0.00 178.16 178.41 3ffz n ASN 10 N -4.31 0.09 -4.77 -2.11 6.94 -1.26 -4.82 115.26 105.03 3ffz n ASN 10 Ca -0.05 -0.90 -0.39 0.00 -0.02 0.00 0.00 54.58 53.23 3ffz n ASN 10 Cb 0.46 -0.04 -0.06 0.00 -2.36 0.00 0.00 39.78 37.78 3ffz n ASN 10 CO 0.00 0.00 0.00 -1.81 -1.03 0.00 0.00 177.26 174.42 3ffz s ASP 11 N -1.35 7.41 0.40 0.53 -0.00 -1.11 -4.99 116.67 117.55 3ffz s ASP 11 Ca 0.00 1.95 -0.25 0.00 -0.00 0.00 0.00 52.55 54.25 3ffz s ASP 11 Cb 0.00 -2.60 -0.11 0.00 -0.00 0.00 0.00 42.92 40.21 3ffz s ASP 11 CO 0.00 -0.02 0.96 -2.65 -0.00 0.00 0.00 175.17 173.46 3ffz n PRO 12 N 0.96 1.27 -1.77 8.23 -0.02 -1.26 -4.81 135.00 137.60 3ffz n PRO 12 Ca 0.00 0.45 -0.39 0.00 -2.02 0.00 0.00 63.50 61.54 3ffz n PRO 12 Cb 0.48 -1.96 -0.03 0.00 -0.02 0.00 0.00 33.50 31.97 3ffz n PRO 12 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3ffz n VAL 13 N -0.42 2.62 0.00 -1.45 0.31 -1.26 -4.77 118.33 113.37 3ffz n VAL 13 Ca 0.10 -2.49 0.00 0.00 -0.01 0.00 0.00 64.34 61.94 3ffz n VAL 13 Cb 0.38 -2.36 0.00 0.00 -0.91 0.00 0.00 33.84 30.95 3ffz n VAL 13 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 3ffz n ASN 14 N 8.93 0.00 0.00 4.52 3.02 -1.22 -4.74 115.26 125.77 3ffz n ASN 14 Ca 0.49 0.34 0.00 0.00 -0.03 0.00 0.00 54.58 55.38 3ffz n ASN 14 Cb 0.43 -0.34 0.00 0.00 -0.61 0.00 0.00 39.78 39.26 3ffz n ASN 14 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3ffz n ASP 15 N -1.33 0.00 -0.04 6.41 8.00 0.20 -4.59 116.55 125.20 3ffz n ASP 15 Ca 0.00 0.00 -0.02 0.00 0.71 0.00 0.00 54.79 55.48 3ffz n ASP 15 Cb 0.13 -1.48 -0.01 0.00 -0.02 0.00 0.00 41.12 39.74 3ffz n ASP 15 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 3ffz h ARG 16 N 0.00 0.00 -0.06 -1.24 3.08 -1.98 -3.42 114.38 110.75 3ffz h ARG 16 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3ffz h ARG 16 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 3ffz h ARG 16 CO 0.00 0.00 0.00 0.25 -1.07 0.00 0.00 179.97 179.15 3ffz n THR 17 N -3.72 0.37 -3.66 2.04 -2.24 -1.26 -4.95 114.28 100.86 3ffz n THR 17 Ca -0.03 -0.69 -0.18 0.00 -2.27 0.00 0.00 64.05 60.88 3ffz n THR 17 Cb 0.10 0.88 -0.17 0.00 -2.10 0.00 0.00 70.33 69.05 3ffz n THR 17 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3ffz s ILE 18 N -0.64 -0.20 0.26 2.28 1.01 -1.26 0.06 121.20 122.71 3ffz s ILE 18 Ca 0.08 0.37 -0.10 0.00 0.00 0.00 0.00 60.65 60.99 3ffz s ILE 18 Cb 0.05 -0.25 0.04 0.00 0.01 0.00 0.00 42.46 42.31 3ffz s ILE 18 CO 0.07 0.15 0.54 0.00 0.00 0.00 0.00 174.94 175.69 3ffz n LEU 19 N 5.31 0.00 -4.76 2.97 -0.00 -1.18 0.59 117.00 119.93 3ffz n LEU 19 Ca -0.04 -1.70 -0.36 0.00 -0.00 0.00 0.00 56.01 53.91 3ffz n LEU 19 Cb 0.50 2.55 -0.08 0.00 -0.00 0.00 0.00 43.42 46.39 3ffz n LEU 19 CO 0.05 -0.57 -0.22 -0.31 -0.00 0.00 0.00 177.39 176.34 3ffz s TYR 20 N -4.36 3.40 -0.01 1.47 2.02 -1.05 -0.76 117.35 118.07 3ffz s TYR 20 Ca 0.11 0.33 0.02 0.00 -0.37 0.00 0.00 57.07 57.16 3ffz s TYR 20 Cb -0.03 -1.96 -0.00 0.00 -0.40 0.00 0.00 41.96 39.57 3ffz s TYR 20 CO 0.08 0.50 -0.06 0.42 -1.57 0.00 0.00 175.55 174.92 3ffz s ILE 21 N -0.55 0.52 -0.41 2.71 1.01 -0.65 -1.00 121.20 122.83 3ffz s ILE 21 Ca 0.11 -0.27 -0.08 0.00 0.00 0.00 0.00 60.65 60.41 3ffz s ILE 21 Cb -0.12 -0.44 0.08 0.00 0.01 0.00 0.00 42.46 41.99 3ffz s ILE 21 CO 0.02 0.15 0.23 -0.75 0.00 0.00 0.00 174.94 174.59 3ffz s LYS 22 N -0.10 2.52 1.12 2.79 2.20 0.39 -2.33 119.74 126.33 3ffz s LYS 22 Ca 0.02 -1.48 -0.12 0.00 -0.36 0.00 0.00 55.97 54.03 3ffz s LYS 22 Cb -0.03 -3.70 0.26 0.00 -1.51 0.00 0.00 37.83 32.85 3ffz s LYS 22 CO -0.00 -0.93 1.05 -2.14 -0.36 0.00 0.00 175.35 172.96 3ffz s PRO 23 N 1.38 -0.60 0.47 4.03 0.02 -1.26 -3.73 135.00 135.31 3ffz s PRO 23 Ca 0.03 0.85 -0.25 0.00 0.02 0.00 0.00 61.00 61.66 3ffz s PRO 23 Cb -0.23 -1.59 -0.08 0.00 0.02 0.00 0.00 34.50 32.63 3ffz s PRO 23 CO 0.01 -3.51 1.40 0.20 -0.33 0.00 0.00 177.00 174.77 3ffz s GLY 24 N -2.66 2.91 -1.42 0.52 0.00 -1.26 -2.86 107.32 102.55 3ffz s GLY 24 Ca 0.68 1.41 -0.07 0.00 0.00 0.00 0.00 44.72 46.74 3ffz s GLY 24 CO 0.63 2.00 0.99 0.61 0.00 0.00 0.00 173.10 177.33 3ffz n GLY 25 N 0.61 -0.53 3.45 0.20 0.00 -1.26 -4.89 105.19 102.77 3ffz n GLY 25 Ca 0.06 0.21 -0.25 0.00 0.00 0.00 0.00 46.02 46.04 3ffz n GLY 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ffz n GLN 27 N -0.29 2.81 0.00 0.00 3.00 -1.26 -4.96 117.38 116.68 3ffz n GLN 27 Ca -0.08 -3.04 0.00 0.00 -0.01 0.00 0.00 57.00 53.87 3ffz n GLN 27 Cb 0.59 -1.98 0.00 0.00 0.00 0.00 0.00 30.24 28.84 3ffz n GLN 27 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.06 176.21 3ffz n GLU 28 N -0.63 -1.14 -3.68 -1.09 0.28 -1.26 -5.13 120.64 107.99 3ffz n GLU 28 Ca 0.34 0.00 -0.38 0.00 -0.16 0.00 0.00 57.16 56.96 3ffz n GLU 28 Cb 1.15 0.00 -0.12 0.00 1.43 0.00 0.00 31.44 33.91 3ffz n GLU 28 CO 0.00 0.00 0.00 -0.06 -0.16 0.00 0.00 177.13 176.91 3ffz s PHE 29 N -2.00 3.16 0.34 -1.84 0.08 -1.26 -4.23 117.98 112.23 3ffz s PHE 29 Ca 0.00 -0.55 0.02 0.00 0.12 0.00 0.00 56.93 56.51 3ffz s PHE 29 Cb 0.00 -2.33 -0.03 0.00 -0.57 0.00 0.00 43.02 40.10 3ffz s PHE 29 CO 0.00 -0.44 0.53 0.71 -0.10 0.00 0.00 175.22 175.92 3ffz s TYR 30 N 1.61 3.43 -0.59 0.36 2.02 -0.99 -4.72 117.35 118.47 3ffz s TYR 30 Ca 0.05 0.23 -0.28 0.00 -0.37 0.00 0.00 57.07 56.70 3ffz s TYR 30 Cb -0.17 -1.90 0.03 0.00 -0.40 0.00 0.00 41.96 39.53 3ffz s TYR 30 CO 0.06 0.11 1.18 0.21 -1.57 0.00 0.00 175.55 175.53 3ffz s LYS 31 N -4.28 3.47 0.27 -0.62 2.20 -1.26 -1.64 119.74 117.88 3ffz s LYS 31 Ca 0.40 0.17 0.01 0.00 -0.36 0.00 0.00 55.97 56.19 3ffz s LYS 31 Cb -0.10 -4.03 -0.04 0.00 -1.51 0.00 0.00 37.83 32.16 3ffz s LYS 31 CO 0.35 -1.70 0.45 -1.12 -0.36 0.00 0.00 175.35 172.97 3ffz s SER 32 N 3.01 6.34 -0.12 1.43 0.01 0.06 -4.42 113.70 120.01 3ffz s SER 32 Ca 0.41 0.36 -0.02 0.00 1.31 0.00 0.00 55.95 58.02 3ffz s SER 32 Cb -0.08 -1.99 0.04 0.00 0.21 0.00 0.00 66.02 64.20 3ffz s SER 32 CO 0.24 -0.15 -0.01 -0.36 0.41 0.00 0.00 173.24 173.38 3ffz s PHE 33 N -2.07 1.00 -0.98 2.43 0.08 -0.17 -3.13 117.98 115.14 3ffz s PHE 33 Ca 0.38 -0.55 -0.24 0.00 0.12 0.00 0.00 56.93 56.65 3ffz s PHE 33 Cb -0.10 -0.99 -0.02 0.00 -0.57 0.00 0.00 43.02 41.34 3ffz s PHE 33 CO 0.32 -0.47 1.82 1.21 -0.10 0.00 0.00 175.22 178.00 3ffz s ASN 34 N 1.86 5.53 0.28 1.36 2.47 0.11 -2.02 114.94 124.53 3ffz s ASN 34 Ca 0.03 -1.06 0.00 0.00 0.42 0.00 0.00 52.86 52.25 3ffz s ASN 34 Cb -0.14 -2.57 0.42 0.00 -1.45 0.00 0.00 41.25 37.51 3ffz s ASN 34 CO -0.07 -2.42 1.80 -0.29 -3.72 0.00 0.00 177.10 172.40 3ffz h ILE 35 N 6.95 1.23 -4.49 -5.21 6.09 -1.82 -3.43 117.51 116.83 3ffz h ILE 35 Ca 0.15 -0.93 -0.38 0.00 -1.37 0.00 0.00 64.86 62.33 3ffz h ILE 35 Cb 0.99 0.89 -0.10 0.00 0.47 0.00 0.00 36.82 39.07 3ffz h ILE 35 CO 1.27 0.33 -0.31 -0.32 -3.07 0.00 0.00 178.15 176.05 3ffz s MET 36 N -4.99 1.90 -0.12 2.19 1.75 -1.21 -1.29 119.30 117.53 3ffz s MET 36 Ca -0.09 -1.92 -0.30 0.00 -1.25 0.00 0.00 55.69 52.14 3ffz s MET 36 Cb 0.15 0.40 -0.02 0.00 2.84 0.00 0.00 34.83 38.20 3ffz s MET 36 CO 0.80 -0.76 1.13 0.15 -0.65 0.00 0.00 175.02 175.69 3ffz s LYS 37 N -3.11 4.34 0.00 4.11 -0.14 -1.26 -3.23 119.74 120.44 3ffz s LYS 37 Ca 0.35 1.54 0.00 0.00 -1.36 0.00 0.00 55.97 56.50 3ffz s LYS 37 Cb 0.00 -3.60 0.00 0.00 -1.68 0.00 0.00 37.83 32.55 3ffz s LYS 37 CO 0.25 -0.48 0.00 0.09 -0.76 0.00 0.00 175.35 174.45 3ffz n ASN 38 N 5.55 -4.27 -4.06 2.83 4.13 -1.26 -4.63 115.26 113.55 3ffz n ASN 38 Ca 0.11 0.00 -0.29 0.00 1.68 0.00 0.00 54.58 56.08 3ffz n ASN 38 Cb 0.47 -1.86 -0.17 0.00 -1.54 0.00 0.00 39.78 36.68 3ffz n ASN 38 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 3ffz s ILE 39 N -1.57 1.53 0.18 2.41 1.01 -1.20 0.12 121.20 123.69 3ffz s ILE 39 Ca 0.00 -0.66 0.10 0.00 0.00 0.00 0.00 60.65 60.09 3ffz s ILE 39 Cb 0.00 -1.39 -0.04 0.00 0.01 0.00 0.00 42.46 41.04 3ffz s ILE 39 CO 0.00 0.45 -0.21 0.26 0.00 0.00 0.00 174.94 175.44 3ffz s TRP 40 N 0.95 2.07 -0.05 3.97 0.52 0.53 -3.16 118.94 123.77 3ffz s TRP 40 Ca -0.07 -0.41 0.05 0.00 0.02 0.00 0.00 56.10 55.69 3ffz s TRP 40 Cb -0.15 -1.02 -0.01 0.00 -1.15 0.00 0.00 33.47 31.14 3ffz s TRP 40 CO -0.01 0.43 -0.22 0.42 0.02 0.00 0.00 176.95 177.58 3ffz s ILE 41 N -1.87 1.82 -0.35 2.03 1.01 -0.86 0.96 121.20 123.95 3ffz s ILE 41 Ca 0.19 -0.94 0.01 0.00 0.00 0.00 0.00 60.65 59.90 3ffz s ILE 41 Cb -0.07 -1.55 0.11 0.00 0.01 0.00 0.00 42.46 40.96 3ffz s ILE 41 CO 0.08 0.51 0.13 -0.63 0.00 0.00 0.00 174.94 175.04 3ffz s ILE 42 N -0.08 1.16 -0.47 2.92 1.01 0.18 -1.00 121.20 124.92 3ffz s ILE 42 Ca -0.04 -1.83 -0.27 0.00 0.00 0.00 0.00 60.65 58.50 3ffz s ILE 42 Cb -0.13 -1.86 -0.28 0.00 0.01 0.00 0.00 42.46 40.21 3ffz s ILE 42 CO 0.03 -0.74 1.79 -2.65 0.00 0.00 0.00 174.94 173.38 3ffz n PRO 43 N 4.40 0.52 -4.26 2.79 -0.02 -1.26 -3.85 135.00 133.32 3ffz n PRO 43 Ca 0.02 -1.45 -0.17 0.00 -2.02 0.00 0.00 63.50 59.87 3ffz n PRO 43 Cb 0.40 -2.95 -0.09 0.00 -0.02 0.00 0.00 33.50 30.84 3ffz n PRO 43 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 3ffz s GLU 44 N 6.74 1.60 0.15 -0.52 0.41 -1.26 -4.78 118.70 121.03 3ffz s GLU 44 Ca 0.68 -1.90 -0.13 0.00 -0.41 0.00 0.00 54.97 53.21 3ffz s GLU 44 Cb 0.10 0.31 -0.07 0.00 -1.78 0.00 0.00 34.13 32.70 3ffz s GLU 44 CO 0.25 -0.58 0.52 1.03 -0.49 0.00 0.00 175.26 176.00 3ffz s ARG 45 N -3.65 3.92 -0.77 1.61 1.81 -1.26 -0.32 118.95 120.29 3ffz s ARG 45 Ca 0.40 0.41 -0.26 0.00 -1.72 0.00 0.00 55.73 54.56 3ffz s ARG 45 Cb 0.04 -2.90 0.03 0.00 -0.45 0.00 0.00 34.95 31.67 3ffz s ARG 45 CO 0.23 0.47 1.28 1.21 -0.68 0.00 0.00 175.30 177.81 3ffz s ASN 46 N -1.82 6.20 0.00 0.23 3.84 -0.15 -4.78 114.94 118.46 3ffz s ASN 46 Ca 0.38 -0.60 0.24 0.00 0.21 0.00 0.00 52.86 53.09 3ffz s ASN 46 Cb -0.14 -2.55 0.30 0.00 -0.55 0.00 0.00 41.25 38.30 3ffz s ASN 46 CO 0.19 -1.78 1.32 1.33 -2.79 0.00 0.00 177.10 175.37 3ffz n VAL 47 N 6.41 0.01 -1.66 -5.21 0.24 -1.26 -4.57 118.33 112.29 3ffz n VAL 47 Ca 0.06 -0.47 -0.48 0.00 -2.04 0.00 0.00 64.34 61.41 3ffz n VAL 47 Cb 0.49 1.37 -0.05 0.00 -1.47 0.00 0.00 33.84 34.19 3ffz n VAL 47 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 3ffz n ILE 48 N 1.21 0.09 -0.97 1.34 5.41 -1.26 -0.46 119.36 124.72 3ffz n ILE 48 Ca 0.15 -0.02 0.00 0.00 1.00 0.00 0.00 62.75 63.88 3ffz n ILE 48 Cb 0.57 -1.42 0.00 0.00 -0.71 0.00 0.00 39.64 38.08 3ffz n ILE 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3ffz n GLY 49 N 3.39 0.30 3.93 7.39 0.00 -1.26 -4.67 105.19 114.26 3ffz n GLY 49 Ca 0.18 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.01 3ffz n GLY 49 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3ffz s THR 50 N -1.66 3.03 -0.01 2.61 -4.23 0.39 0.37 115.64 116.14 3ffz s THR 50 Ca 0.00 -1.20 0.03 0.00 -1.18 0.00 0.00 61.69 59.34 3ffz s THR 50 Cb 0.00 -3.07 -0.01 0.00 1.34 0.00 0.00 72.50 70.77 3ffz s THR 50 CO 0.00 -0.04 -0.11 -0.89 -0.54 0.00 0.00 174.62 173.04 3ffz s THR 51 N -2.38 0.87 0.17 3.99 2.01 -1.26 -4.99 115.64 114.05 3ffz s THR 51 Ca 0.49 -0.49 -0.14 0.00 0.31 0.00 0.00 61.69 61.86 3ffz s THR 51 Cb -0.06 -0.73 0.16 0.00 0.01 0.00 0.00 72.50 71.88 3ffz s THR 51 CO 0.30 0.23 1.19 -2.65 -0.69 0.00 0.00 174.62 173.00 3ffz n PRO 52 N 2.78 -0.19 -0.32 4.92 -0.02 -1.26 0.67 135.00 141.57 3ffz n PRO 52 Ca -0.14 1.18 0.11 0.00 -2.02 0.00 0.00 63.50 62.62 3ffz n PRO 52 Cb 0.56 -1.74 0.23 0.00 -0.02 0.00 0.00 33.50 32.53 3ffz n PRO 52 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 3ffz h GLN 53 N 0.00 0.04 -1.42 -0.52 -0.00 -1.97 -1.05 115.11 110.18 3ffz h GLN 53 Ca 0.25 -0.00 0.42 0.00 -0.00 0.00 0.00 58.65 59.33 3ffz h GLN 53 Cb 0.45 -0.01 -0.09 0.00 0.00 0.00 0.00 27.48 27.83 3ffz h GLN 53 CO -0.76 0.03 0.98 -0.44 0.00 0.00 0.00 178.83 178.64 3ffz h ASP 54 N 0.04 0.13 1.77 -0.69 3.32 -0.17 -0.18 116.42 120.64 3ffz h ASP 54 Ca 0.53 0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.63 3ffz h ASP 54 Cb 1.02 0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.61 3ffz h ASP 54 CO -0.86 -0.05 -0.03 -0.26 -1.72 0.00 0.00 179.24 176.32 3ffz h PHE 55 N 0.08 0.00 -3.71 4.55 0.04 -1.31 -3.46 116.94 113.13 3ffz h PHE 55 Ca 0.75 0.00 -0.51 0.00 2.80 0.00 0.00 57.97 61.01 3ffz h PHE 55 Cb 2.67 0.00 0.01 0.00 2.20 0.00 0.00 35.95 40.84 3ffz h PHE 55 CO -0.00 0.00 0.48 -1.01 -0.60 0.00 0.00 178.31 177.18 3ffz s HIS 56 N -3.17 3.57 0.43 -0.55 3.76 -0.08 -4.41 115.29 114.83 3ffz s HIS 56 Ca 0.08 1.64 -0.25 0.00 -0.15 0.00 0.00 55.06 56.39 3ffz s HIS 56 Cb 0.08 -3.30 -0.08 0.00 1.11 0.00 0.00 32.58 30.39 3ffz s HIS 56 CO 0.65 -0.64 1.27 -1.25 -0.85 0.00 0.00 174.74 173.92 3ffz s PRO 57 N -1.04 3.82 0.49 8.40 0.04 -1.26 -5.03 135.00 140.42 3ffz s PRO 57 Ca 0.47 2.05 -0.01 0.00 0.04 0.00 0.00 61.00 63.55 3ffz s PRO 57 Cb -0.31 -2.61 0.10 0.00 0.04 0.00 0.00 34.50 31.72 3ffz s PRO 57 CO 0.39 -0.58 0.68 -0.35 0.04 0.00 0.00 177.00 177.18 3ffz n PRO 58 N -0.16 0.09 0.11 0.56 -0.04 -1.26 -5.01 135.00 129.29 3ffz n PRO 58 Ca 0.05 -1.80 -0.20 0.00 -0.04 0.00 0.00 63.50 61.51 3ffz n PRO 58 Cb 0.45 -0.46 -0.15 0.00 -0.04 0.00 0.00 33.50 33.30 3ffz n PRO 58 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 3ffz h THR 59 N -0.57 1.31 -2.98 0.52 2.02 -1.93 -3.47 112.91 107.80 3ffz h THR 59 Ca -0.22 -2.84 -0.10 0.00 0.77 0.00 0.00 66.41 64.02 3ffz h THR 59 Cb 0.82 2.93 -0.02 0.00 -1.74 0.00 0.00 68.15 70.14 3ffz h THR 59 CO 0.24 0.85 0.05 -0.24 0.37 0.00 0.00 175.52 176.78 3ffz n SER 60 N -3.59 -1.22 -4.29 4.18 2.88 -1.14 -4.87 113.62 105.57 3ffz n SER 60 Ca -0.14 -2.15 -0.31 0.00 -1.33 0.00 0.00 58.87 54.94 3ffz n SER 60 Cb 1.06 2.12 -0.16 0.00 -0.75 0.00 0.00 64.21 66.48 3ffz n SER 60 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 3ffz s LEU 61 N 0.00 2.08 0.00 2.46 1.02 -1.26 -2.03 118.68 120.96 3ffz s LEU 61 Ca 0.15 -0.49 -0.25 0.00 0.02 0.00 0.00 54.13 53.57 3ffz s LEU 61 Cb -0.02 -1.36 -0.16 0.00 0.02 0.00 0.00 46.19 44.66 3ffz s LEU 61 CO 0.11 0.28 1.20 0.11 0.02 0.00 0.00 176.35 178.06 3ffz h LYS 62 N 5.80 -0.38 -5.14 1.70 1.57 -0.35 -3.46 116.57 116.32 3ffz h LYS 62 Ca -0.37 0.03 -0.35 0.00 -1.87 0.00 0.00 60.65 58.09 3ffz h LYS 62 Cb 1.15 0.09 -0.16 0.00 0.08 0.00 0.00 32.23 33.38 3ffz h LYS 62 CO 0.47 -0.05 -0.73 -0.80 -0.57 0.00 0.00 179.45 177.77 3ffz s ASN 63 N -5.12 1.79 0.00 0.86 -0.87 -1.26 -4.96 114.94 105.37 3ffz s ASN 63 Ca -0.14 -0.91 0.00 0.00 -1.57 0.00 0.00 52.86 50.24 3ffz s ASN 63 Cb 0.02 -0.02 0.00 0.00 -0.02 0.00 0.00 41.25 41.23 3ffz s ASN 63 CO 0.54 -0.26 0.00 0.61 -2.57 0.00 0.00 177.10 175.41 3ffz n GLY 64 N 0.16 1.08 0.04 0.66 0.00 -0.94 -4.93 105.19 101.26 3ffz n GLY 64 Ca -0.13 -2.14 -0.02 0.00 0.00 0.00 0.00 46.02 43.72 3ffz n GLY 64 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 3ffz h ASP 65 N 0.00 0.00 -5.30 1.61 2.03 -1.94 -3.42 116.42 109.40 3ffz h ASP 65 Ca 0.00 0.00 -0.15 0.00 -0.73 0.00 0.00 57.03 56.15 3ffz h ASP 65 Cb 0.00 0.00 -0.06 0.00 -0.83 0.00 0.00 39.33 38.44 3ffz h ASP 65 CO 0.00 0.43 -0.04 -0.94 -1.03 0.00 0.00 179.24 177.66 3ffz s SER 66 N -4.79 0.40 0.28 4.15 1.04 -1.26 -1.91 113.70 111.60 3ffz s SER 66 Ca -0.08 -1.24 -0.20 0.00 0.48 0.00 0.00 55.95 54.91 3ffz s SER 66 Cb 0.01 0.70 0.02 0.00 0.10 0.00 0.00 66.02 66.85 3ffz s SER 66 CO 0.12 -1.36 0.71 -0.44 0.98 0.00 0.00 173.24 173.24 3ffz s SER 67 N -3.13 -0.24 -0.18 7.02 0.01 0.98 -4.97 113.70 113.19 3ffz s SER 67 Ca 0.24 -0.65 -0.04 0.00 1.31 0.00 0.00 55.95 56.81 3ffz s SER 67 Cb -0.02 0.73 0.09 0.00 0.21 0.00 0.00 66.02 67.03 3ffz s SER 67 CO 0.15 -1.35 0.26 -0.47 0.41 0.00 0.00 173.24 172.24 3ffz s TYR 68 N -3.87 -0.43 -0.14 2.43 5.04 -1.25 -1.03 117.35 118.10 3ffz s TYR 68 Ca 0.12 0.61 -0.07 0.00 -2.44 0.00 0.00 57.07 55.29 3ffz s TYR 68 Cb -0.06 -0.17 -0.04 0.00 0.35 0.00 0.00 41.96 42.04 3ffz s TYR 68 CO 0.07 -0.53 0.10 0.71 -1.34 0.00 0.00 175.55 174.57 3ffz s TYR 69 N 2.40 3.45 -0.45 4.97 2.02 0.22 -1.15 117.35 128.80 3ffz s TYR 69 Ca 0.06 0.38 0.07 0.00 -0.37 0.00 0.00 57.07 57.20 3ffz s TYR 69 Cb -0.14 -1.97 0.18 0.00 -0.40 0.00 0.00 41.96 39.63 3ffz s TYR 69 CO -0.11 0.54 0.61 0.34 -1.57 0.00 0.00 175.55 175.36 3ffz s ASP 70 N -0.58 -0.87 0.00 2.29 -1.08 -1.26 -4.34 116.67 110.83 3ffz s ASP 70 Ca 0.12 -1.51 -0.01 0.00 -0.52 0.00 0.00 52.55 50.63 3ffz s ASP 70 Cb -0.12 1.53 -0.06 0.00 -1.46 0.00 0.00 42.92 42.82 3ffz s ASP 70 CO 0.02 -0.13 2.02 -0.81 0.52 0.00 0.00 175.17 176.79 3ffz n PRO 71 N 3.62 1.04 0.00 4.34 -0.04 -1.26 -2.28 135.00 140.41 3ffz n PRO 71 Ca 0.16 -0.21 0.00 0.00 -0.04 0.00 0.00 63.50 63.41 3ffz n PRO 71 Cb 0.54 -1.30 0.00 0.00 -0.04 0.00 0.00 33.50 32.70 3ffz n PRO 71 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3ffz n ASN 72 N 1.84 2.61 -4.77 3.54 4.13 -1.26 -5.01 115.26 116.35 3ffz n ASN 72 Ca 0.09 0.00 -0.41 0.00 1.68 0.00 0.00 54.58 55.94 3ffz n ASN 72 Cb 0.50 0.38 -0.01 0.00 -1.54 0.00 0.00 39.78 39.11 3ffz n ASN 72 CO 0.00 0.00 0.00 -0.47 0.28 0.00 0.00 177.26 177.07 3ffz s TYR 73 N -1.30 2.75 -1.44 3.10 5.04 -0.97 -2.92 117.35 121.61 3ffz s TYR 73 Ca 0.00 1.14 0.00 0.00 -2.44 0.00 0.00 57.07 55.77 3ffz s TYR 73 Cb 0.00 -3.94 0.00 0.00 0.35 0.00 0.00 41.96 38.37 3ffz s TYR 73 CO 0.00 -2.83 0.00 1.28 -1.34 0.00 0.00 175.55 172.66 3ffz n LEU 74 N 1.02 -1.49 -0.01 6.97 4.77 -1.26 -4.80 117.00 122.19 3ffz n LEU 74 Ca 0.03 0.13 0.08 0.00 -0.03 0.00 0.00 56.01 56.22 3ffz n LEU 74 Cb 0.40 -2.51 -0.15 0.00 -2.33 0.00 0.00 43.42 38.82 3ffz n LEU 74 CO 0.62 -0.25 -0.76 0.00 -1.33 0.00 0.00 177.39 175.68 3ffz n GLN 75 N -2.82 0.62 -2.98 3.23 1.13 -1.15 -4.51 117.38 110.91 3ffz n GLN 75 Ca -0.19 -0.17 -0.40 0.00 -1.94 0.00 0.00 57.00 54.30 3ffz n GLN 75 Cb 0.64 -1.46 -0.05 0.00 0.11 0.00 0.00 30.24 29.48 3ffz n GLN 75 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 3ffz s SER 76 N -4.32 7.12 0.00 1.08 0.15 -1.26 -4.92 113.70 111.55 3ffz s SER 76 Ca -0.07 1.34 0.01 0.00 0.70 0.00 0.00 55.95 57.93 3ffz s SER 76 Cb 0.12 -2.45 0.03 0.00 -1.71 0.00 0.00 66.02 62.01 3ffz s SER 76 CO 0.81 -0.08 0.98 -0.67 1.20 0.00 0.00 173.24 175.48 3ffz n ASP 77 N 3.40 0.00 -0.08 5.45 2.03 -1.26 -0.17 116.55 125.92 3ffz n ASP 77 Ca -0.01 0.45 -0.09 0.00 0.52 0.00 0.00 54.79 55.66 3ffz n ASP 77 Cb 0.51 -0.45 -0.12 0.00 -0.72 0.00 0.00 41.12 40.33 3ffz n ASP 77 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 3ffz n GLU 78 N -1.45 1.19 0.10 -0.67 2.13 -1.26 -4.10 120.64 116.58 3ffz n GLU 78 Ca 0.00 0.01 0.11 0.00 0.66 0.00 0.00 57.16 57.94 3ffz n GLU 78 Cb 0.01 -1.42 0.45 0.00 0.27 0.00 0.00 31.44 30.74 3ffz n GLU 78 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 3ffz n GLU 79 N -2.69 0.15 0.04 5.31 1.02 0.76 -2.40 120.64 122.83 3ffz n GLU 79 Ca -0.28 0.38 -0.22 0.00 -0.02 0.00 0.00 57.16 57.01 3ffz n GLU 79 Cb 1.01 -1.78 -0.14 0.00 -0.02 0.00 0.00 31.44 30.51 3ffz n GLU 79 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 3ffz h LYS 80 N 0.00 0.32 0.00 3.49 1.57 -1.48 -3.22 116.57 117.25 3ffz h LYS 80 Ca 0.00 -0.55 0.00 0.00 -1.87 0.00 0.00 60.65 58.23 3ffz h LYS 80 Cb 0.34 0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.86 3ffz h LYS 80 CO 0.00 1.26 0.00 0.22 -0.57 0.00 0.00 179.45 180.36 3ffz h ASP 81 N 0.09 0.00 1.00 0.86 3.58 -1.65 -0.22 116.42 120.08 3ffz h ASP 81 Ca -0.39 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.06 3ffz h ASP 81 Cb 2.06 0.00 0.00 0.00 1.72 0.00 0.00 39.33 43.11 3ffz h ASP 81 CO 0.13 0.00 -0.72 -0.09 -2.88 0.00 0.00 179.24 175.68 3ffz h ARG 82 N 0.00 0.00 0.06 0.28 1.12 -1.57 -3.04 114.38 111.23 3ffz h ARG 82 Ca 0.00 0.00 -0.37 0.00 -1.11 0.00 0.00 59.98 58.50 3ffz h ARG 82 Cb 0.48 0.00 -0.04 0.00 -0.01 0.00 0.00 29.97 30.40 3ffz h ARG 82 CO 0.00 0.00 -2.20 0.34 -3.11 0.00 0.00 179.97 175.00 3ffz n PHE 83 N -2.39 0.64 -0.14 2.20 7.35 -0.89 -3.35 117.46 120.87 3ffz n PHE 83 Ca 0.02 0.15 -0.09 0.00 -0.76 0.00 0.00 57.45 56.77 3ffz n PHE 83 Cb 0.49 -1.09 -0.00 0.00 0.35 0.00 0.00 39.48 39.22 3ffz n PHE 83 CO 0.00 0.00 0.00 1.25 -0.76 0.00 0.00 176.76 177.25 3ffz h LEU 84 N 0.03 0.59 -0.73 -2.13 5.85 -1.17 -0.36 115.31 117.39 3ffz h LEU 84 Ca -0.49 -0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.06 3ffz h LEU 84 Cb 1.99 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 42.87 3ffz h LEU 84 CO 0.01 0.60 0.00 0.11 -0.34 0.00 0.00 178.44 178.82 3ffz h LYS 85 N 0.53 0.00 0.00 1.25 1.79 -1.72 -0.87 116.57 117.56 3ffz h LYS 85 Ca 0.14 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.61 3ffz h LYS 85 Cb 0.21 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.86 3ffz h LYS 85 CO -0.01 0.00 -1.03 1.51 -1.08 0.00 0.00 179.45 178.84 3ffz n ILE 86 N -2.85 0.58 -0.03 1.86 3.06 -0.90 -2.57 119.36 118.50 3ffz n ILE 86 Ca 0.02 -0.53 -0.22 0.00 -2.50 0.00 0.00 62.75 59.53 3ffz n ILE 86 Cb 0.37 -0.30 -0.13 0.00 0.54 0.00 0.00 39.64 40.12 3ffz n ILE 86 CO 0.00 0.00 0.00 0.58 -2.50 0.00 0.00 176.55 174.63 3ffz h VAL 87 N 0.00 0.83 -0.61 9.51 2.07 -0.97 -3.16 116.25 123.92 3ffz h VAL 87 Ca 0.00 -2.30 0.11 0.00 0.82 0.00 0.00 66.70 65.33 3ffz h VAL 87 Cb 0.98 2.46 -0.08 0.00 -1.52 0.00 0.00 31.29 33.14 3ffz h VAL 87 CO 0.00 0.65 0.18 0.74 0.02 0.00 0.00 177.57 179.16 3ffz h THR 88 N -0.40 0.69 -0.41 2.57 2.02 -1.29 0.51 112.91 116.61 3ffz h THR 88 Ca -0.37 -0.11 0.04 0.00 0.77 0.00 0.00 66.41 66.74 3ffz h THR 88 Cb 1.71 0.33 -0.04 0.00 -1.74 0.00 0.00 68.15 68.41 3ffz h THR 88 CO -0.02 0.06 0.18 0.50 0.37 0.00 0.00 175.52 176.61 3ffz h LYS 89 N 0.33 0.37 -0.30 6.66 3.64 -1.61 -2.22 116.57 123.43 3ffz h LYS 89 Ca 0.32 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.63 3ffz h LYS 89 Cb 0.45 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.17 3ffz h LYS 89 CO -0.36 0.24 -0.02 0.82 -2.27 0.00 0.00 179.45 177.86 3ffz h ILE 90 N 0.38 1.19 -0.72 2.00 2.04 -0.95 -1.78 117.51 119.67 3ffz h ILE 90 Ca 0.18 -0.77 -0.04 0.00 1.00 0.00 0.00 64.86 65.23 3ffz h ILE 90 Cb 0.12 0.99 -0.03 0.00 -0.74 0.00 0.00 36.82 37.15 3ffz h ILE 90 CO -0.15 0.26 0.31 -0.26 0.00 0.00 0.00 178.15 178.31 3ffz h PHE 91 N 0.45 1.06 -0.22 1.37 -1.00 -0.48 -2.18 116.94 115.95 3ffz h PHE 91 Ca 0.10 -0.06 -0.07 0.00 2.81 0.00 0.00 57.97 60.74 3ffz h PHE 91 Cb 0.33 -0.33 -0.01 0.00 3.61 0.00 0.00 35.95 39.55 3ffz h PHE 91 CO 0.01 0.80 -0.19 -0.91 -1.61 0.00 0.00 178.31 176.41 3ffz h ASN 92 N 1.04 0.37 0.53 2.17 2.35 -0.77 0.22 115.58 121.48 3ffz h ASN 92 Ca 0.25 -0.10 0.00 0.00 -0.55 0.00 0.00 56.30 55.89 3ffz h ASN 92 Cb 0.16 -0.10 0.00 0.00 0.05 0.00 0.00 38.32 38.44 3ffz h ASN 92 CO -0.03 0.58 0.00 -1.14 -1.65 0.00 0.00 177.43 175.19 3ffz n ARG 93 N -4.18 0.11 -0.09 0.81 0.63 -0.84 -1.39 116.66 111.70 3ffz n ARG 93 Ca -0.00 0.15 -0.11 0.00 -0.92 0.00 0.00 57.85 56.96 3ffz n ARG 93 Cb 0.34 -1.50 -0.04 0.00 0.45 0.00 0.00 32.46 31.71 3ffz n ARG 93 CO 0.00 0.00 0.00 -0.89 -2.51 0.00 0.00 177.63 174.23 3ffz n ILE 94 N -1.42 1.48 -0.16 5.15 5.41 -0.39 -4.39 119.36 125.05 3ffz n ILE 94 Ca 0.06 0.08 0.12 0.00 1.00 0.00 0.00 62.75 64.01 3ffz n ILE 94 Cb 0.19 -2.28 0.46 0.00 -0.71 0.00 0.00 39.64 37.30 3ffz n ILE 94 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 176.55 175.42 3ffz h ASN 95 N -1.00 0.47 0.00 4.38 -1.24 -1.03 0.27 115.58 117.43 3ffz h ASN 95 Ca -0.12 0.02 0.00 0.00 0.71 0.00 0.00 56.30 56.91 3ffz h ASN 95 Cb 0.97 -0.08 0.00 0.00 0.73 0.00 0.00 38.32 39.94 3ffz h ASN 95 CO -0.07 0.27 0.00 0.59 -1.29 0.00 0.00 177.43 176.92 3ffz n ASN 96 N -4.49 0.00 -4.24 1.15 4.13 -0.48 -4.29 115.26 107.04 3ffz n ASN 96 Ca 0.13 -0.50 -0.30 0.00 1.68 0.00 0.00 54.58 55.58 3ffz n ASN 96 Cb 0.42 0.00 -0.16 0.00 -1.54 0.00 0.00 39.78 38.49 3ffz n ASN 96 CO 0.00 0.00 0.00 0.21 0.28 0.00 0.00 177.26 177.75 3ffz s ASN 97 N -1.89 2.84 0.00 6.41 3.84 0.93 -5.01 114.94 122.06 3ffz s ASN 97 Ca 0.14 -0.47 0.00 0.00 0.21 0.00 0.00 52.86 52.73 3ffz s ASN 97 Cb 0.06 -0.76 0.00 0.00 -0.55 0.00 0.00 41.25 40.00 3ffz s ASN 97 CO 0.10 0.23 0.55 -0.11 -2.79 0.00 0.00 177.10 175.08 3ffz n LEU 98 N 2.97 0.00 -0.23 3.21 -0.00 -1.26 0.26 117.00 121.95 3ffz n LEU 98 Ca -0.17 0.55 0.03 0.00 -0.00 0.00 0.00 56.01 56.41 3ffz n LEU 98 Cb 0.52 -0.05 0.15 0.00 -0.00 0.00 0.00 43.42 44.04 3ffz n LEU 98 CO 0.25 -0.05 1.00 0.77 -0.00 0.00 0.00 177.39 179.36 3ffz h SER 99 N 0.00 0.24 -0.81 1.96 4.64 -1.92 -1.08 113.55 116.59 3ffz h SER 99 Ca 0.00 0.10 -0.01 0.00 -0.47 0.00 0.00 61.79 61.40 3ffz h SER 99 Cb 0.00 0.08 -0.04 0.00 -0.31 0.00 0.00 62.40 62.13 3ffz h SER 99 CO 0.00 0.11 0.45 1.23 -0.87 0.00 0.00 176.83 177.75 3ffz h GLY 100 N 0.42 1.20 1.13 -0.77 0.00 -1.72 -2.25 103.07 101.09 3ffz h GLY 100 Ca 0.36 -0.54 -0.02 0.00 0.00 0.00 0.00 47.33 47.13 3ffz h GLY 100 CO -0.36 0.52 0.41 -1.33 0.00 0.00 0.00 176.54 175.77 3ffz h GLY 101 N 1.12 1.21 2.00 4.60 0.00 0.47 -2.08 103.07 110.39 3ffz h GLY 101 Ca 0.28 -0.57 -0.06 0.00 0.00 0.00 0.00 47.33 46.98 3ffz h GLY 101 CO -0.05 0.54 -0.28 -2.22 0.00 0.00 0.00 176.54 174.53 3ffz h ILE 102 N 1.13 1.09 -0.00 2.60 2.04 -0.75 -2.72 117.51 120.89 3ffz h ILE 102 Ca 0.28 -1.01 -0.00 0.00 1.00 0.00 0.00 64.86 65.13 3ffz h ILE 102 Cb 0.07 1.56 -0.00 0.00 -0.74 0.00 0.00 36.82 37.72 3ffz h ILE 102 CO -0.04 0.28 0.00 0.25 0.00 0.00 0.00 178.15 178.64 3ffz h LEU 103 N 0.00 0.00 -1.79 1.44 5.85 -0.82 0.49 115.31 120.49 3ffz h LEU 103 Ca -0.00 -0.15 -0.02 0.00 0.84 0.00 0.00 57.88 58.54 3ffz h LEU 103 Cb 0.54 -0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.57 3ffz h LEU 103 CO 0.04 0.15 -0.12 -0.07 -0.34 0.00 0.00 178.44 178.10 3ffz h LEU 104 N -0.15 0.00 0.63 2.25 3.38 -1.45 -1.63 115.31 118.35 3ffz h LEU 104 Ca 0.00 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 3ffz h LEU 104 Cb 0.15 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.91 3ffz h LEU 104 CO -0.00 0.12 -0.30 -0.08 0.09 0.00 0.00 178.44 178.26 3ffz h GLU 105 N 0.00 -0.82 -1.00 1.13 4.57 -1.08 -0.70 114.58 116.68 3ffz h GLU 105 Ca -0.00 0.06 0.13 0.00 -1.18 0.00 0.00 59.36 58.37 3ffz h GLU 105 Cb 0.21 0.19 -0.09 0.00 -0.16 0.00 0.00 28.75 28.90 3ffz h GLU 105 CO 0.02 -0.50 0.63 0.93 -1.18 0.00 0.00 179.01 178.90 3ffz h GLU 106 N -1.03 0.92 -0.73 1.92 4.39 -0.47 0.28 114.58 119.85 3ffz h GLU 106 Ca -0.09 -0.06 -0.05 0.00 0.34 0.00 0.00 59.36 59.51 3ffz h GLU 106 Cb 0.70 -0.21 -0.03 0.00 -0.10 0.00 0.00 28.75 29.11 3ffz h GLU 106 CO 0.14 0.61 0.27 -0.07 -1.16 0.00 0.00 179.01 178.81 3ffz h LEU 107 N 0.95 1.00 -2.15 1.33 3.38 -1.19 -2.70 115.31 115.93 3ffz h LEU 107 Ca 0.50 -0.16 0.07 0.00 0.09 0.00 0.00 57.88 58.39 3ffz h LEU 107 Cb 0.56 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 3ffz h LEU 107 CO -0.28 0.90 0.28 -1.28 0.09 0.00 0.00 178.44 178.15 3ffz h SER 108 N 1.06 0.00 -0.08 -0.43 0.87 0.65 -2.23 113.55 113.40 3ffz h SER 108 Ca 0.24 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.80 3ffz h SER 108 Cb 0.22 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.18 3ffz h SER 108 CO -0.02 0.00 0.00 0.29 -0.53 0.00 0.00 176.83 176.57 3ffz n LYS 109 N -3.75 1.01 0.00 2.24 5.02 -1.03 -4.67 118.16 116.97 3ffz n LYS 109 Ca 0.03 -1.35 0.00 0.00 -2.02 0.00 0.00 58.31 54.98 3ffz n LYS 109 Cb 0.41 -1.23 0.00 0.00 -0.02 0.00 0.00 35.03 34.19 3ffz n LYS 109 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3ffz n ALA 110 N 0.63 1.77 -1.15 7.82 0.00 -0.84 -4.90 120.51 123.84 3ffz n ALA 110 Ca 0.08 0.00 -0.45 0.00 0.00 0.00 0.00 53.44 53.07 3ffz n ALA 110 Cb 0.31 -1.00 -0.06 0.00 0.00 0.00 0.00 19.45 18.70 3ffz n ALA 110 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3ffz n ASN 111 N 0.46 0.33 -4.77 0.00 2.85 -1.26 -4.72 115.26 108.15 3ffz n ASN 111 Ca 0.00 0.84 -0.39 0.00 -0.11 0.00 0.00 54.58 54.92 3ffz n ASN 111 Cb 0.15 -0.65 -0.02 0.00 1.24 0.00 0.00 39.78 40.50 3ffz n ASN 111 CO 0.00 0.00 0.00 -2.84 -2.11 0.00 0.00 177.26 172.31 3ffz s PRO 112 N 0.84 4.21 0.34 1.20 0.02 -1.26 -4.98 135.00 135.38 3ffz s PRO 112 Ca 0.69 1.93 -0.29 0.00 0.02 0.00 0.00 61.00 63.36 3ffz s PRO 112 Cb -0.98 -2.85 -0.11 0.00 0.02 0.00 0.00 34.50 30.59 3ffz s PRO 112 CO 0.48 -0.21 1.42 -0.47 -0.33 0.00 0.00 177.00 177.89 3ffz s TYR 113 N -1.31 2.81 -1.34 6.54 5.04 0.40 -4.88 117.35 124.61 3ffz s TYR 113 Ca 0.53 1.22 -0.12 0.00 -2.44 0.00 0.00 57.07 56.26 3ffz s TYR 113 Cb -0.33 -3.88 0.11 0.00 0.35 0.00 0.00 41.96 38.21 3ffz s TYR 113 CO 0.43 -2.57 1.95 1.28 -1.34 0.00 0.00 175.55 175.29 3ffz n LEU 114 N 0.86 6.41 0.00 6.97 4.77 -1.26 -4.83 117.00 129.93 3ffz n LEU 114 Ca 0.02 -4.36 0.00 0.00 -0.03 0.00 0.00 56.01 51.63 3ffz n LEU 114 Cb 0.40 -1.59 0.00 0.00 -2.33 0.00 0.00 43.42 39.90 3ffz n LEU 114 CO 0.62 1.09 0.00 0.61 -1.33 0.00 0.00 177.39 178.37 3ffz n GLY 115 N 3.69 -0.07 0.00 -0.72 0.00 -1.24 -2.12 105.19 104.73 3ffz n GLY 115 Ca 0.45 -1.53 0.00 0.00 0.00 0.00 0.00 46.02 44.94 3ffz n GLY 115 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3ffz n ASN 116 N 0.00 0.00 -1.22 1.61 2.04 -1.26 -4.88 115.26 111.55 3ffz n ASN 116 Ca 0.00 -0.17 -0.04 0.00 -0.44 0.00 0.00 54.58 53.92 3ffz n ASN 116 Cb 0.00 0.00 0.04 0.00 -2.53 0.00 0.00 39.78 37.29 3ffz n ASN 116 CO 0.00 0.00 0.00 0.47 -0.44 0.00 0.00 177.26 177.29 3ffz n ASP 117 N -0.12 3.07 0.00 0.53 8.00 -1.26 -3.25 116.55 123.52 3ffz n ASP 117 Ca 0.00 -2.32 0.00 0.00 0.71 0.00 0.00 54.79 53.18 3ffz n ASP 117 Cb 0.00 -0.57 0.00 0.00 -0.02 0.00 0.00 41.12 40.53 3ffz n ASP 117 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3ffz n ASN 118 N 0.16 0.00 -4.77 -2.24 3.02 -1.26 -5.11 115.26 105.07 3ffz n ASN 118 Ca 0.12 -0.52 -0.26 0.00 -0.03 0.00 0.00 54.58 53.88 3ffz n ASN 118 Cb 0.72 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.83 3ffz n ASN 118 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 3ffz s THR 119 N 0.00 4.31 -0.23 3.41 -4.23 -1.20 -5.05 115.64 112.64 3ffz s THR 119 Ca 0.00 -1.17 -0.28 0.00 -1.18 0.00 0.00 61.69 59.06 3ffz s THR 119 Cb 0.00 -3.19 -0.05 0.00 1.34 0.00 0.00 72.50 70.60 3ffz s THR 119 CO 0.00 -0.11 2.19 -2.16 -0.54 0.00 0.00 174.62 174.00 3ffz s PRO 120 N -3.07 3.13 0.44 3.99 0.04 -1.26 -4.74 135.00 133.52 3ffz s PRO 120 Ca 0.30 1.97 0.30 0.00 0.04 0.00 0.00 61.00 63.61 3ffz s PRO 120 Cb -0.10 -4.36 1.56 0.00 0.04 0.00 0.00 34.50 31.64 3ffz s PRO 120 CO 0.22 -2.10 1.91 0.38 0.04 0.00 0.00 177.00 177.44 3ffz h ASP 121 N 14.95 0.00 0.94 6.66 -0.00 -1.94 -2.83 116.42 134.19 3ffz h ASP 121 Ca -0.40 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 56.63 3ffz h ASP 121 Cb 1.23 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 40.56 3ffz h ASP 121 CO 0.97 0.00 -0.95 -0.46 -0.00 0.00 0.00 179.24 178.79 3ffz n ASN 122 N -2.56 0.81 -4.38 4.15 0.23 -1.26 -4.26 115.26 107.99 3ffz n ASN 122 Ca -0.01 0.26 -0.30 0.00 -0.53 0.00 0.00 54.58 54.00 3ffz n ASN 122 Cb 0.08 0.43 -0.14 0.00 -2.08 0.00 0.00 39.78 38.08 3ffz n ASN 122 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3ffz s GLN 123 N -3.33 1.64 1.24 -3.83 -2.07 -1.07 -0.14 119.66 112.11 3ffz s GLN 123 Ca 0.01 -1.21 -0.21 0.00 -1.82 0.00 0.00 55.36 52.13 3ffz s GLN 123 Cb 0.10 -1.97 0.32 0.00 -1.09 0.00 0.00 33.01 30.37 3ffz s GLN 123 CO 0.78 0.48 0.89 1.19 -1.32 0.00 0.00 175.29 177.32 3ffz n PHE 124 N 1.31 -3.74 -3.15 9.60 3.72 -1.26 -4.70 117.46 119.24 3ffz n PHE 124 Ca -0.17 -0.83 0.04 0.00 -0.05 0.00 0.00 57.45 56.45 3ffz n PHE 124 Cb 0.52 -1.10 -0.01 0.00 -0.94 0.00 0.00 39.48 37.96 3ffz n PHE 124 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 176.76 175.13 3ffz s HIS 125 N -2.39 -1.32 -0.68 1.38 5.65 -0.90 -4.92 115.29 112.10 3ffz s HIS 125 Ca 0.63 1.08 -0.26 0.00 0.25 0.00 0.00 55.06 56.77 3ffz s HIS 125 Cb -0.09 0.34 0.04 0.00 -1.18 0.00 0.00 32.58 31.70 3ffz s HIS 125 CO 0.51 -0.74 1.15 0.96 -0.65 0.00 0.00 174.74 175.96 3ffz s ILE 126 N 2.88 3.99 0.42 0.89 -4.36 -1.26 -3.62 121.20 120.13 3ffz s ILE 126 Ca 0.14 0.22 0.05 0.00 -0.26 0.00 0.00 60.65 60.80 3ffz s ILE 126 Cb -0.11 -4.80 0.05 0.00 1.25 0.00 0.00 42.46 38.85 3ffz s ILE 126 CO -0.21 -1.63 0.40 0.61 0.24 0.00 0.00 174.94 174.35 3ffz n GLY 127 N 5.31 2.56 0.27 6.27 0.00 -1.26 -4.73 105.19 113.61 3ffz n GLY 127 Ca 0.01 -2.25 0.16 0.00 0.00 0.00 0.00 46.02 43.95 3ffz n GLY 127 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3ffz h ASP 128 N 0.37 0.00 0.42 1.61 3.45 -1.77 0.62 116.42 121.11 3ffz h ASP 128 Ca -0.24 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.22 3ffz h ASP 128 Cb 0.95 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.72 3ffz h ASP 128 CO 0.38 0.01 -0.07 0.00 -1.57 0.00 0.00 179.24 177.99 3ffz n ALA 129 N -2.10 2.67 0.00 3.45 0.00 -1.26 -3.92 120.51 119.35 3ffz n ALA 129 Ca 0.01 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.23 3ffz n ALA 129 Cb 0.34 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.39 3ffz n ALA 129 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3ffz n SER 130 N -1.07 3.53 -3.97 0.00 2.88 -0.88 -1.17 113.62 112.94 3ffz n SER 130 Ca 0.15 -0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.59 3ffz n SER 130 Cb 0.26 0.71 -0.10 0.00 -0.75 0.00 0.00 64.21 64.33 3ffz n SER 130 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3ffz s ALA 131 N -1.42 0.07 0.06 -1.46 0.00 0.16 -4.53 121.76 114.64 3ffz s ALA 131 Ca 0.00 -0.60 0.08 0.00 0.00 0.00 0.00 51.96 51.44 3ffz s ALA 131 Cb 0.00 0.18 -0.03 0.00 0.00 0.00 0.00 23.12 23.27 3ffz s ALA 131 CO 0.00 -0.23 -0.22 0.14 0.00 0.00 0.00 175.76 175.45 3ffz s VAL 132 N -2.05 1.79 0.26 0.00 -7.23 -0.90 -4.42 120.40 107.85 3ffz s VAL 132 Ca -0.10 -1.33 -0.29 0.00 -1.81 0.00 0.00 61.98 58.44 3ffz s VAL 132 Cb -0.05 -1.56 -0.09 0.00 0.56 0.00 0.00 36.38 35.23 3ffz s VAL 132 CO -0.03 0.17 1.20 -0.70 -0.31 0.00 0.00 175.10 175.43 3ffz s GLU 133 N -1.39 4.51 0.27 4.82 2.56 -1.24 -1.52 118.70 126.70 3ffz s GLU 133 Ca 0.08 1.96 0.02 0.00 0.00 0.00 0.00 54.97 57.03 3ffz s GLU 133 Cb -0.09 -3.17 -0.04 0.00 2.00 0.00 0.00 34.13 32.83 3ffz s GLU 133 CO 0.03 -0.01 0.17 0.96 -0.56 0.00 0.00 175.26 175.85 3ffz s ILE 134 N -0.78 0.16 -0.17 -3.70 -4.36 0.38 -0.46 121.20 112.28 3ffz s ILE 134 Ca 0.49 -2.00 -0.08 0.00 -0.26 0.00 0.00 60.65 58.80 3ffz s ILE 134 Cb -0.35 -2.51 0.06 0.00 1.25 0.00 0.00 42.46 40.91 3ffz s ILE 134 CO 0.43 0.00 0.39 -0.54 0.24 0.00 0.00 174.94 175.46 3ffz s LYS 135 N -3.88 0.35 0.00 0.37 1.02 -0.17 -0.36 119.74 117.06 3ffz s LYS 135 Ca 0.38 0.80 0.00 0.00 0.02 0.00 0.00 55.97 57.18 3ffz s LYS 135 Cb 0.05 0.03 0.00 0.00 -0.52 0.00 0.00 37.83 37.39 3ffz s LYS 135 CO 0.17 -0.18 0.00 1.19 -0.92 0.00 0.00 175.35 175.61 3ffz n PHE 136 N 4.52 0.00 0.22 3.18 3.72 -1.20 -2.52 117.46 125.38 3ffz n PHE 136 Ca -0.20 0.00 0.10 0.00 -0.05 0.00 0.00 57.45 57.30 3ffz n PHE 136 Cb 0.54 0.00 -0.15 0.00 -0.94 0.00 0.00 39.48 38.92 3ffz n PHE 136 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 3ffz n SER 137 N 0.00 0.37 0.09 4.37 3.41 -1.26 -4.20 113.62 116.39 3ffz n SER 137 Ca 0.00 -0.23 0.12 0.00 -0.26 0.00 0.00 58.87 58.50 3ffz n SER 137 Cb 0.00 1.73 0.27 0.00 -0.26 0.00 0.00 64.21 65.96 3ffz n SER 137 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 3ffz h ASN 138 N 0.00 0.00 0.00 4.04 4.21 -1.98 -3.47 115.58 118.38 3ffz h ASN 138 Ca 0.00 -0.09 0.00 0.00 1.21 0.00 0.00 56.30 57.42 3ffz h ASN 138 Cb 0.85 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.05 3ffz h ASN 138 CO 0.00 0.05 0.00 0.61 -1.29 0.00 0.00 177.43 176.80 3ffz n GLY 139 N 1.30 0.68 3.65 2.83 0.00 -1.26 -5.04 105.19 107.35 3ffz n GLY 139 Ca 0.04 -0.54 -0.41 0.00 0.00 0.00 0.00 46.02 45.11 3ffz n GLY 139 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3ffz s SER 140 N -2.49 6.85 -0.03 1.61 0.15 -1.26 -4.90 113.70 113.63 3ffz s SER 140 Ca 0.00 1.05 -0.30 0.00 0.70 0.00 0.00 55.95 57.41 3ffz s SER 140 Cb 0.00 -2.43 -0.05 0.00 -1.71 0.00 0.00 66.02 61.82 3ffz s SER 140 CO 0.00 -0.45 1.54 -1.10 1.20 0.00 0.00 173.24 174.43 3ffz s GLN 141 N 2.53 4.22 0.26 5.44 -0.21 -1.26 -3.26 119.66 127.38 3ffz s GLN 141 Ca 0.35 2.09 0.02 0.00 0.02 0.00 0.00 55.36 57.85 3ffz s GLN 141 Cb -0.16 -3.79 -0.03 0.00 1.00 0.00 0.00 33.01 30.03 3ffz s GLN 141 CO 0.09 -0.74 0.21 -0.51 -2.12 0.00 0.00 175.29 172.22 3ffz s ASP 142 N 2.64 0.82 0.06 5.90 1.01 0.51 -4.58 116.67 123.03 3ffz s ASP 142 Ca 0.69 -1.54 0.09 0.00 0.71 0.00 0.00 52.55 52.49 3ffz s ASP 142 Cb -0.33 0.47 -0.03 0.00 1.01 0.00 0.00 42.92 44.04 3ffz s ASP 142 CO 0.27 -0.95 -0.23 0.27 0.21 0.00 0.00 175.17 174.74 3ffz s ILE 143 N -3.82 1.90 -0.02 0.77 -4.36 -1.18 0.14 121.20 114.64 3ffz s ILE 143 Ca 0.39 -1.37 0.08 0.00 -0.26 0.00 0.00 60.65 59.49 3ffz s ILE 143 Cb 0.05 -1.66 -0.02 0.00 1.25 0.00 0.00 42.46 42.08 3ffz s ILE 143 CO 0.19 0.22 -0.24 -0.22 0.24 0.00 0.00 174.94 175.12 3ffz s LEU 144 N -1.38 2.05 -0.88 0.37 2.96 -0.58 -2.70 118.68 118.52 3ffz s LEU 144 Ca 0.10 -0.44 -0.02 0.00 -0.22 0.00 0.00 54.13 53.54 3ffz s LEU 144 Cb -0.09 -1.26 0.22 0.00 0.50 0.00 0.00 46.19 45.55 3ffz s LEU 144 CO 0.03 0.30 0.76 -0.76 -1.32 0.00 0.00 176.35 175.36 3ffz s LEU 145 N -0.58 5.54 0.00 -0.68 1.02 -0.74 -2.12 118.68 121.12 3ffz s LEU 145 Ca 0.09 -3.67 0.00 0.00 0.02 0.00 0.00 54.13 50.57 3ffz s LEU 145 Cb -0.09 -1.91 0.00 0.00 0.02 0.00 0.00 46.19 44.21 3ffz s LEU 145 CO -0.01 -0.19 0.00 -0.81 0.02 0.00 0.00 176.35 175.36 3ffz n PRO 146 N 2.40 0.78 0.00 1.29 -0.04 -1.26 -4.34 135.00 133.82 3ffz n PRO 146 Ca 0.21 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.67 3ffz n PRO 146 Cb 0.37 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.83 3ffz n PRO 146 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3ffz n ASN 147 N -1.34 2.01 -3.68 3.54 4.13 0.33 -4.84 115.26 115.42 3ffz n ASN 147 Ca 0.00 0.00 -0.14 0.00 1.68 0.00 0.00 54.58 56.12 3ffz n ASN 147 Cb 0.00 0.06 -0.14 0.00 -1.54 0.00 0.00 39.78 38.16 3ffz n ASN 147 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 3ffz s VAL 148 N -1.47 -0.27 -0.19 2.41 1.01 -0.82 -1.11 120.40 119.96 3ffz s VAL 148 Ca 0.00 0.27 -0.06 0.00 0.00 0.00 0.00 61.98 62.19 3ffz s VAL 148 Cb 0.00 -0.36 -0.03 0.00 0.00 0.00 0.00 36.38 35.98 3ffz s VAL 148 CO 0.00 0.11 0.03 -0.63 0.00 0.00 0.00 175.10 174.61 3ffz s ILE 149 N 2.06 4.30 -0.18 2.22 1.01 0.37 -0.34 121.20 130.64 3ffz s ILE 149 Ca -0.01 -0.20 -0.05 0.00 0.00 0.00 0.00 60.65 60.39 3ffz s ILE 149 Cb -0.12 -2.94 -0.03 0.00 0.01 0.00 0.00 42.46 39.38 3ffz s ILE 149 CO -0.07 0.44 -0.01 -0.63 0.00 0.00 0.00 174.94 174.67 3ffz s ILE 150 N 0.73 4.02 0.38 2.92 1.01 0.27 0.01 121.20 130.53 3ffz s ILE 150 Ca 0.01 -0.30 0.05 0.00 0.00 0.00 0.00 60.65 60.41 3ffz s ILE 150 Cb -0.14 -2.80 -0.06 0.00 0.01 0.00 0.00 42.46 39.47 3ffz s ILE 150 CO 0.02 0.45 0.04 -0.04 0.00 0.00 0.00 174.94 175.42 3ffz s MET 151 N 0.70 1.83 0.74 2.79 -1.94 0.19 -0.64 119.30 122.97 3ffz s MET 151 Ca -0.00 -2.04 -0.09 0.00 -1.71 0.00 0.00 55.69 51.84 3ffz s MET 151 Cb -0.14 -1.19 0.06 0.00 2.01 0.00 0.00 34.83 35.57 3ffz s MET 151 CO 0.02 -0.17 1.08 0.20 -0.01 0.00 0.00 175.02 176.15 3ffz s GLY 152 N -3.61 1.64 0.72 -0.03 0.00 0.56 -0.71 107.32 105.89 3ffz s GLY 152 Ca 0.33 -0.77 -0.13 0.00 0.00 0.00 0.00 44.72 44.15 3ffz s GLY 152 CO 0.16 -0.33 -0.55 0.00 0.00 0.00 0.00 173.10 172.37 3ffz n ALA 153 N -3.07 -4.55 -3.50 3.20 0.00 -1.03 -2.01 120.51 109.55 3ffz n ALA 153 Ca 0.08 -0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.05 3ffz n ALA 153 Cb 0.60 -0.91 0.00 0.00 0.00 0.00 0.00 19.45 19.14 3ffz n ALA 153 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 3ffz n GLU 154 N 1.83 2.10 -0.28 0.00 0.28 -1.26 -0.98 120.64 122.34 3ffz n GLU 154 Ca -0.00 0.00 0.08 0.00 -0.16 0.00 0.00 57.16 57.07 3ffz n GLU 154 Cb 0.42 0.00 0.16 0.00 1.43 0.00 0.00 31.44 33.46 3ffz n GLU 154 CO 0.00 0.00 0.00 -2.30 -0.16 0.00 0.00 177.13 174.67 3ffz n PRO 155 N -0.24 -0.07 -3.67 3.44 -0.02 -1.26 -3.98 135.00 129.21 3ffz n PRO 155 Ca 0.00 1.20 -0.36 0.00 -2.02 0.00 0.00 63.50 62.32 3ffz n PRO 155 Cb 0.00 -1.85 -0.09 0.00 -0.02 0.00 0.00 33.50 31.54 3ffz n PRO 155 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3ffz s ASP 156 N -5.11 6.15 0.34 2.55 2.15 -1.26 -4.35 116.67 117.13 3ffz s ASP 156 Ca -0.11 0.15 0.26 0.00 0.43 0.00 0.00 52.55 53.28 3ffz s ASP 156 Cb 0.22 -2.11 0.75 0.00 -0.30 0.00 0.00 42.92 41.48 3ffz s ASP 156 CO 0.61 0.09 1.74 -0.07 -0.17 0.00 0.00 175.17 177.37 3ffz h LEU 157 N 7.32 0.00 -0.20 -1.34 4.07 -1.26 -3.00 115.31 120.89 3ffz h LEU 157 Ca -0.39 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.57 3ffz h LEU 157 Cb 1.17 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.91 3ffz h LEU 157 CO 0.68 0.00 0.00 0.49 -1.08 0.00 0.00 178.44 178.53 3ffz n PHE 158 N -2.66 0.70 -2.87 1.13 3.01 -1.26 -4.80 117.46 110.70 3ffz n PHE 158 Ca 0.04 0.23 -0.41 0.00 1.01 0.00 0.00 57.45 58.32 3ffz n PHE 158 Cb 0.42 -0.87 -0.04 0.00 -0.01 0.00 0.00 39.48 38.98 3ffz n PHE 158 CO 0.00 0.00 0.00 -1.21 1.01 0.00 0.00 176.76 176.56 3ffz s GLU 159 N -3.14 4.53 -0.25 -1.08 0.41 -1.14 -5.00 118.70 113.03 3ffz s GLU 159 Ca 0.09 1.19 -0.04 0.00 -0.41 0.00 0.00 54.97 55.80 3ffz s GLU 159 Cb 0.12 -3.42 0.09 0.00 -1.78 0.00 0.00 34.13 29.15 3ffz s GLU 159 CO 0.50 0.11 0.14 0.99 -0.49 0.00 0.00 175.26 176.52 3ffz s THR 160 N 0.51 -0.13 0.25 3.63 2.01 -1.26 -4.25 115.64 116.40 3ffz s THR 160 Ca 0.44 -0.54 -0.12 0.00 0.31 0.00 0.00 61.69 61.78 3ffz s THR 160 Cb -0.20 -0.86 -0.00 0.00 0.01 0.00 0.00 72.50 71.44 3ffz s THR 160 CO 0.24 -0.56 0.48 0.54 -0.69 0.00 0.00 174.62 174.64 3ffz s ASN 161 N 2.15 -0.06 0.30 3.53 2.20 -0.80 -5.00 114.94 117.26 3ffz s ASN 161 Ca 0.07 -0.96 0.03 0.00 -0.94 0.00 0.00 52.86 51.06 3ffz s ASN 161 Cb -0.16 0.59 -0.06 0.00 -2.00 0.00 0.00 41.25 39.62 3ffz s ASN 161 CO -0.28 -1.15 0.08 -0.94 -2.94 0.00 0.00 177.10 171.87 3ffz s SER 162 N -3.03 1.86 -0.01 3.54 1.04 -1.26 0.04 113.70 115.89 3ffz s SER 162 Ca 0.23 -1.38 -0.28 0.00 0.48 0.00 0.00 55.95 55.00 3ffz s SER 162 Cb -0.01 0.02 0.09 0.00 0.10 0.00 0.00 66.02 66.23 3ffz s SER 162 CO 0.09 -0.66 0.80 -0.94 0.98 0.00 0.00 173.24 173.51 3ffz s SER 163 N -3.41 -0.48 0.05 7.02 1.04 -0.61 -4.99 113.70 112.32 3ffz s SER 163 Ca 0.37 0.24 0.05 0.00 0.48 0.00 0.00 55.95 57.09 3ffz s SER 163 Cb 0.08 0.45 -0.04 0.00 0.10 0.00 0.00 66.02 66.62 3ffz s SER 163 CO 0.15 -0.64 -0.08 0.20 0.98 0.00 0.00 173.24 173.84 3ffz s ASN 164 N -1.98 4.50 0.52 7.02 -0.87 -1.26 -1.03 114.94 121.83 3ffz s ASN 164 Ca -0.01 -0.26 -0.23 0.00 -1.57 0.00 0.00 52.86 50.80 3ffz s ASN 164 Cb -0.01 -0.96 -0.06 0.00 -0.02 0.00 0.00 41.25 40.20 3ffz s ASN 164 CO -0.04 0.24 1.37 -0.38 -2.57 0.00 0.00 177.10 175.72 3ffz n ILE 165 N 1.19 3.55 -4.34 0.60 5.41 -1.20 -5.02 119.36 119.55 3ffz n ILE 165 Ca -0.14 -0.50 -0.26 0.00 1.00 0.00 0.00 62.75 62.84 3ffz n ILE 165 Cb 0.52 -1.70 -0.10 0.00 -0.71 0.00 0.00 39.64 37.65 3ffz n ILE 165 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 3ffz s SER 166 N -0.79 3.97 0.32 4.38 0.15 -1.26 -4.48 113.70 115.98 3ffz s SER 166 Ca 0.69 -0.70 0.08 0.00 0.70 0.00 0.00 55.95 56.72 3ffz s SER 166 Cb -0.43 -0.55 -0.03 0.00 -1.71 0.00 0.00 66.02 63.30 3ffz s SER 166 CO 0.51 0.10 0.24 -0.76 1.20 0.00 0.00 173.24 174.53 3ffz s LEU 167 N -2.85 3.55 0.56 3.45 1.43 0.42 -2.11 118.68 123.14 3ffz s LEU 167 Ca 0.24 -0.52 -0.18 0.00 -1.03 0.00 0.00 54.13 52.64 3ffz s LEU 167 Cb -0.08 -2.12 -0.12 0.00 0.03 0.00 0.00 46.19 43.90 3ffz s LEU 167 CO 0.14 -0.28 0.13 0.54 0.23 0.00 0.00 176.35 177.11 3ffz n ARG 168 N -1.28 0.21 -3.56 1.70 1.74 -0.78 -2.89 116.66 111.79 3ffz n ARG 168 Ca -0.03 0.08 -0.19 0.00 -0.77 0.00 0.00 57.85 56.94 3ffz n ARG 168 Cb 0.60 -1.32 0.06 0.00 -1.02 0.00 0.00 32.46 30.78 3ffz n ARG 168 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3ffz n ASN 169 N 1.61 -2.00 0.00 0.55 3.02 -1.26 -2.88 115.26 114.29 3ffz n ASN 169 Ca 0.09 -0.74 0.00 0.00 -0.03 0.00 0.00 54.58 53.90 3ffz n ASN 169 Cb 0.48 -4.54 0.00 0.00 -0.61 0.00 0.00 39.78 35.11 3ffz n ASN 169 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3ffz n ASN 170 N -3.08 0.00 -4.67 6.41 4.13 -1.23 -4.95 115.26 111.86 3ffz n ASN 170 Ca -0.27 0.00 -0.50 0.00 1.68 0.00 0.00 54.58 55.49 3ffz n ASN 170 Cb 0.67 -0.06 -0.05 0.00 -1.54 0.00 0.00 39.78 38.80 3ffz n ASN 170 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3ffz n TYR 171 N -0.72 2.18 -3.79 3.10 9.36 -1.14 -4.77 117.16 121.38 3ffz n TYR 171 Ca 0.00 0.23 -0.29 0.00 3.32 0.00 0.00 57.90 61.16 3ffz n TYR 171 Cb 0.00 -2.56 -0.16 0.00 -0.63 0.00 0.00 39.34 35.99 3ffz n TYR 171 CO 0.00 0.00 0.00 -1.64 0.22 0.00 0.00 176.86 175.44 3ffz s MET 172 N 2.81 0.93 0.55 2.98 -1.94 -1.26 0.16 119.30 123.52 3ffz s MET 172 Ca 0.89 -0.67 0.27 0.00 -1.71 0.00 0.00 55.69 54.47 3ffz s MET 172 Cb -0.79 -2.23 1.45 0.00 2.01 0.00 0.00 34.83 35.27 3ffz s MET 172 CO 0.50 -0.68 1.97 -1.35 -0.01 0.00 0.00 175.02 175.45 3ffz h PRO 173 N 8.14 0.00 0.00 2.03 0.11 -1.82 -1.19 132.00 139.27 3ffz h PRO 173 Ca -0.16 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.95 3ffz h PRO 173 Cb 1.09 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.20 3ffz h PRO 173 CO 0.38 0.00 0.00 0.43 -0.21 0.00 0.00 178.00 178.60 3ffz n SER 174 N -4.17 0.00 -0.00 -2.05 7.64 -1.26 -1.76 113.62 112.02 3ffz n SER 174 Ca 0.10 -0.38 0.07 0.00 1.01 0.00 0.00 58.87 59.67 3ffz n SER 174 Cb 0.66 -0.03 -0.09 0.00 -1.01 0.00 0.00 64.21 63.73 3ffz n SER 174 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 3ffz n ASN 175 N -1.03 0.75 -0.88 6.43 3.02 -0.45 -0.42 115.26 122.67 3ffz n ASN 175 Ca 0.10 -0.85 0.05 0.00 -0.03 0.00 0.00 54.58 53.85 3ffz n ASN 175 Cb 0.06 1.01 0.11 0.00 -0.61 0.00 0.00 39.78 40.35 3ffz n ASN 175 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 3ffz n HIS 176 N -1.38 0.00 0.00 3.10 8.25 -0.72 -3.68 115.22 120.79 3ffz n HIS 176 Ca 0.03 -0.94 0.00 0.00 -0.26 0.00 0.00 57.72 56.55 3ffz n HIS 176 Cb 0.25 -0.19 0.00 0.00 1.12 0.00 0.00 29.99 31.17 3ffz n HIS 176 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3ffz n GLY 177 N -0.44 2.53 0.24 -1.41 0.00 0.28 -4.82 105.19 101.58 3ffz n GLY 177 Ca 0.12 -0.02 0.02 0.00 0.00 0.00 0.00 46.02 46.14 3ffz n GLY 177 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 3ffz h PHE 178 N 0.00 0.25 0.00 1.61 0.04 -1.80 -3.27 116.94 113.77 3ffz h PHE 178 Ca 0.00 0.04 0.00 0.00 2.80 0.00 0.00 57.97 60.81 3ffz h PHE 178 Cb 0.00 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 38.14 3ffz h PHE 178 CO 0.00 -0.03 0.00 0.41 -0.60 0.00 0.00 178.31 178.09 3ffz n GLY 179 N -1.33 1.12 3.33 -1.45 0.00 -1.09 -0.45 105.19 105.31 3ffz n GLY 179 Ca 0.10 -1.88 -0.13 0.00 0.00 0.00 0.00 46.02 44.12 3ffz n GLY 179 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3ffz s SER 180 N -0.70 -0.29 0.47 1.61 0.15 -1.24 -4.37 113.70 109.33 3ffz s SER 180 Ca 0.00 -0.03 -0.24 0.00 0.70 0.00 0.00 55.95 56.38 3ffz s SER 180 Cb 0.00 0.43 -0.08 0.00 -1.71 0.00 0.00 66.02 64.66 3ffz s SER 180 CO 0.00 -0.69 1.29 -0.38 1.20 0.00 0.00 173.24 174.66 3ffz n ILE 181 N 0.41 2.97 -3.73 6.45 5.41 -0.32 -4.28 119.36 126.28 3ffz n ILE 181 Ca -0.18 -0.50 -0.37 0.00 1.00 0.00 0.00 62.75 62.70 3ffz n ILE 181 Cb 0.60 -1.60 -0.06 0.00 -0.71 0.00 0.00 39.64 37.87 3ffz n ILE 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3ffz s ALA 182 N -1.24 3.80 -0.28 -1.39 0.00 -0.27 -3.22 121.76 119.16 3ffz s ALA 182 Ca 0.65 -0.49 0.03 0.00 0.00 0.00 0.00 51.96 52.15 3ffz s ALA 182 Cb -0.47 -2.14 0.07 0.00 0.00 0.00 0.00 23.12 20.58 3ffz s ALA 182 CO 0.55 0.53 -0.07 0.42 0.00 0.00 0.00 175.76 177.19 3ffz s ILE 183 N -0.91 2.15 -0.13 0.00 -1.09 -0.20 -0.48 121.20 120.54 3ffz s ILE 183 Ca 0.18 -1.77 -0.10 0.00 -2.23 0.00 0.00 60.65 56.73 3ffz s ILE 183 Cb -0.14 -2.34 -0.05 0.00 -1.58 0.00 0.00 42.46 38.36 3ffz s ILE 183 CO 0.07 -0.16 0.19 -0.69 -1.23 0.00 0.00 174.94 173.12 3ffz s VAL 184 N 1.08 5.39 -0.37 2.92 1.01 0.10 -1.58 120.40 128.96 3ffz s VAL 184 Ca -0.04 0.34 -0.04 0.00 0.00 0.00 0.00 61.98 62.23 3ffz s VAL 184 Cb -0.20 -3.49 0.07 0.00 0.00 0.00 0.00 36.38 32.77 3ffz s VAL 184 CO -0.06 0.54 0.14 -0.89 0.00 0.00 0.00 175.10 174.83 3ffz s THR 185 N -0.51 3.46 -0.14 3.92 2.01 0.11 -0.63 115.64 123.86 3ffz s THR 185 Ca 0.15 -1.57 -0.02 0.00 0.31 0.00 0.00 61.69 60.56 3ffz s THR 185 Cb -0.13 -3.14 -0.02 0.00 0.01 0.00 0.00 72.50 69.22 3ffz s THR 185 CO 0.04 -0.39 -0.08 0.12 -0.69 0.00 0.00 174.62 173.62 3ffz s PHE 186 N 1.27 2.93 -0.53 4.92 5.36 0.11 -1.91 117.98 130.15 3ffz s PHE 186 Ca 0.01 -0.41 0.05 0.00 -0.96 0.00 0.00 56.93 55.62 3ffz s PHE 186 Cb -0.21 -1.89 0.20 0.00 -0.34 0.00 0.00 43.02 40.77 3ffz s PHE 186 CO -0.01 -0.08 0.47 0.45 -1.46 0.00 0.00 175.22 174.60 3ffz n SER 187 N 3.43 1.24 0.07 6.13 2.88 -1.26 -2.46 113.62 123.65 3ffz n SER 187 Ca -0.18 -2.82 0.06 0.00 -1.33 0.00 0.00 58.87 54.60 3ffz n SER 187 Cb 0.53 -0.64 0.49 0.00 -0.75 0.00 0.00 64.21 63.83 3ffz n SER 187 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 3ffz h PRO 188 N 5.06 0.38 0.00 -1.46 0.13 -1.94 -3.13 132.00 131.04 3ffz h PRO 188 Ca 0.19 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 3ffz h PRO 188 Cb 0.82 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 31.87 3ffz h PRO 188 CO 0.55 0.25 0.00 0.39 -0.23 0.00 0.00 178.00 178.96 3ffz n GLU 189 N -4.49 0.97 -4.43 0.86 4.71 -1.26 -4.70 120.64 112.29 3ffz n GLU 189 Ca 0.02 0.00 -0.23 0.00 -0.01 0.00 0.00 57.16 56.94 3ffz n GLU 189 Cb 0.09 -1.30 -0.16 0.00 -1.01 0.00 0.00 31.44 29.05 3ffz n GLU 189 CO 0.00 0.00 0.00 0.71 0.09 0.00 0.00 177.13 177.93 3ffz s TYR 190 N -2.00 1.23 0.31 -0.32 1.51 -1.18 0.01 117.35 116.90 3ffz s TYR 190 Ca 0.28 -0.43 0.04 0.00 -1.01 0.00 0.00 57.07 55.95 3ffz s TYR 190 Cb 0.13 -0.94 -0.03 0.00 -0.11 0.00 0.00 41.96 41.01 3ffz s TYR 190 CO 0.22 -0.25 0.28 0.45 -1.11 0.00 0.00 175.55 175.14 3ffz s SER 191 N 0.77 1.31 0.40 2.29 0.15 -1.22 -4.93 113.70 112.47 3ffz s SER 191 Ca -0.13 -1.65 0.07 0.00 0.70 0.00 0.00 55.95 54.94 3ffz s SER 191 Cb -0.15 0.54 -0.06 0.00 -1.71 0.00 0.00 66.02 64.64 3ffz s SER 191 CO 0.02 -1.06 0.11 0.72 1.20 0.00 0.00 173.24 174.23 3ffz s PHE 192 N -3.51 2.58 -0.04 3.44 -0.12 -1.26 -1.51 117.98 117.56 3ffz s PHE 192 Ca 0.39 -0.60 0.07 0.00 -0.05 0.00 0.00 56.93 56.74 3ffz s PHE 192 Cb 0.03 -1.86 -0.02 0.00 -0.63 0.00 0.00 43.02 40.54 3ffz s PHE 192 CO 0.24 0.30 -0.24 0.50 -0.05 0.00 0.00 175.22 175.97 3ffz s ARG 193 N -3.83 2.32 0.30 1.99 3.52 -1.03 -1.34 118.95 120.89 3ffz s ARG 193 Ca 0.39 -0.88 0.05 0.00 -0.13 0.00 0.00 55.73 55.15 3ffz s ARG 193 Cb 0.05 -2.14 -0.06 0.00 -1.56 0.00 0.00 34.95 31.24 3ffz s ARG 193 CO 0.21 0.51 0.02 -0.59 -0.81 0.00 0.00 175.30 174.64 3ffz s PHE 194 N -0.48 1.94 -0.04 5.12 -0.12 -0.02 -3.81 117.98 120.57 3ffz s PHE 194 Ca 0.06 -0.87 0.18 0.00 -0.05 0.00 0.00 56.93 56.25 3ffz s PHE 194 Cb -0.11 -1.22 0.34 0.00 -0.63 0.00 0.00 43.02 41.40 3ffz s PHE 194 CO 0.01 0.09 1.14 0.27 -0.05 0.00 0.00 175.22 176.68 3ffz n ASN 195 N -0.64 0.98 -0.36 1.98 6.94 -1.26 -1.14 115.26 121.76 3ffz n ASN 195 Ca -0.04 -2.35 -0.07 0.00 -0.02 0.00 0.00 54.58 52.10 3ffz n ASN 195 Cb 0.65 -0.32 -0.05 0.00 -2.36 0.00 0.00 39.78 37.70 3ffz n ASN 195 CO 0.00 0.00 0.00 0.47 -1.03 0.00 0.00 177.26 176.70 3ffz n ASP 196 N 0.05 -0.83 -4.55 0.53 8.00 -1.26 -3.85 116.55 114.63 3ffz n ASP 196 Ca 0.07 1.56 -0.38 0.00 0.71 0.00 0.00 54.79 56.75 3ffz n ASP 196 Cb 0.96 -0.24 -0.03 0.00 -0.02 0.00 0.00 41.12 41.79 3ffz n ASP 196 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 3ffz s ASN 197 N -5.41 4.99 0.00 -2.24 0.01 -1.26 -4.73 114.94 106.31 3ffz s ASN 197 Ca -0.11 0.70 0.00 0.00 -0.71 0.00 0.00 52.86 52.74 3ffz s ASN 197 Cb 0.12 -2.52 0.00 0.00 0.41 0.00 0.00 41.25 39.26 3ffz s ASN 197 CO 0.57 -2.52 0.00 0.00 -1.51 0.00 0.00 177.10 173.63 3ffz s MET 199 N 0.00 0.67 -0.24 0.00 1.75 -1.26 -4.94 119.30 115.28 3ffz s MET 199 Ca 0.00 -0.97 -0.06 0.00 -1.25 0.00 0.00 55.69 53.41 3ffz s MET 199 Cb 0.00 -0.77 0.12 0.00 2.84 0.00 0.00 34.83 37.02 3ffz s MET 199 CO 0.00 -1.21 0.47 1.21 -0.65 0.00 0.00 175.02 174.84 3ffz s ASN 200 N 1.30 -0.43 0.26 1.11 2.47 -1.03 -5.10 114.94 113.51 3ffz s ASN 200 Ca 0.18 0.90 -0.30 0.00 0.42 0.00 0.00 52.86 54.07 3ffz s ASN 200 Cb -0.14 1.56 -0.09 0.00 -1.45 0.00 0.00 41.25 41.13 3ffz s ASN 200 CO -0.03 -0.25 1.09 -1.61 -3.72 0.00 0.00 177.10 172.58 3ffz s GLU 201 N 2.68 4.64 0.03 0.43 2.02 -1.26 -4.44 118.70 122.80 3ffz s GLU 201 Ca 0.04 1.77 -0.02 0.00 0.02 0.00 0.00 54.97 56.78 3ffz s GLU 201 Cb -0.13 -3.21 -0.02 0.00 0.10 0.00 0.00 34.13 30.87 3ffz s GLU 201 CO -0.16 0.20 0.01 -0.06 0.02 0.00 0.00 175.26 175.28 3ffz s PHE 202 N -1.00 0.28 -0.08 1.61 0.08 -0.29 -0.46 117.98 118.10 3ffz s PHE 202 Ca 0.45 -0.59 -0.02 0.00 0.12 0.00 0.00 56.93 56.89 3ffz s PHE 202 Cb -0.31 -0.20 -0.03 0.00 -0.57 0.00 0.00 43.02 41.90 3ffz s PHE 202 CO 0.39 -0.27 0.01 0.42 -0.10 0.00 0.00 175.22 175.68 3ffz s ILE 203 N -2.13 4.39 0.35 0.64 1.09 -0.63 -0.84 121.20 124.08 3ffz s ILE 203 Ca -0.09 -0.23 -0.28 0.00 -1.10 0.00 0.00 60.65 58.95 3ffz s ILE 203 Cb -0.05 -2.86 -0.10 0.00 -1.06 0.00 0.00 42.46 38.40 3ffz s ILE 203 CO -0.03 0.60 1.24 -1.58 -0.10 0.00 0.00 174.94 175.07 3ffz s GLN 204 N -0.92 4.29 -0.18 2.79 2.00 -0.45 -4.92 119.66 122.26 3ffz s GLN 204 Ca 0.14 2.06 -0.27 0.00 -2.00 0.00 0.00 55.36 55.30 3ffz s GLN 204 Cb -0.11 -2.97 -0.01 0.00 0.80 0.00 0.00 33.01 30.72 3ffz s GLN 204 CO 0.03 -0.19 0.90 0.34 -0.50 0.00 0.00 175.29 175.87 3ffz s ASP 205 N -0.72 7.01 0.47 6.67 -1.08 -1.26 -4.73 116.67 123.03 3ffz s ASP 205 Ca 0.51 1.25 0.22 0.00 -0.52 0.00 0.00 52.55 54.01 3ffz s ASP 205 Cb -0.36 -2.48 1.19 0.00 -1.46 0.00 0.00 42.92 39.80 3ffz s ASP 205 CO 0.48 -0.48 1.63 1.55 0.52 0.00 0.00 175.17 178.86 3ffz h PRO 206 N 7.38 0.00 0.06 4.34 0.13 -1.93 -1.07 132.00 140.91 3ffz h PRO 206 Ca -0.26 0.00 -0.24 0.00 -0.87 0.00 0.00 66.00 64.62 3ffz h PRO 206 Cb 1.11 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.24 3ffz h PRO 206 CO 0.88 0.00 -1.07 0.00 -0.23 0.00 0.00 178.00 177.57 3ffz h ALA 207 N 1.39 0.27 -0.03 -0.56 0.00 -1.93 -3.13 119.26 115.25 3ffz h ALA 207 Ca 0.00 -0.81 -0.01 0.00 0.00 0.00 0.00 54.91 54.10 3ffz h ALA 207 Cb 0.52 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 3ffz h ALA 207 CO 0.00 0.93 -0.00 1.25 0.00 0.00 0.00 179.25 181.43 3ffz h LEU 208 N 0.12 0.06 -1.38 0.00 5.85 -1.60 -2.31 115.31 116.05 3ffz h LEU 208 Ca -0.09 -0.32 0.23 0.00 0.84 0.00 0.00 57.88 58.53 3ffz h LEU 208 Cb 1.76 -0.02 -0.08 0.00 0.37 0.00 0.00 40.66 42.69 3ffz h LEU 208 CO 0.17 0.36 0.63 0.74 -0.34 0.00 0.00 178.44 180.01 3ffz h THR 209 N -0.24 0.62 -0.12 1.05 2.02 -1.63 0.32 112.91 114.94 3ffz h THR 209 Ca 0.01 -0.16 -0.09 0.00 0.77 0.00 0.00 66.41 66.94 3ffz h THR 209 Cb 0.33 0.12 0.00 0.00 -1.74 0.00 0.00 68.15 66.87 3ffz h THR 209 CO 0.00 0.08 -0.29 0.25 0.37 0.00 0.00 175.52 175.94 3ffz h LEU 210 N 0.46 0.45 -0.26 2.58 5.85 -1.46 -2.38 115.31 120.55 3ffz h LEU 210 Ca 0.54 -0.58 0.02 0.00 0.84 0.00 0.00 57.88 58.69 3ffz h LEU 210 Cb 1.26 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 42.14 3ffz h LEU 210 CO -0.25 0.95 0.12 0.24 -0.34 0.00 0.00 178.44 179.16 3ffz h MET 211 N -0.03 0.25 -0.79 1.25 2.86 -0.46 0.40 114.93 118.42 3ffz h MET 211 Ca -0.00 -0.01 0.18 0.00 -2.06 0.00 0.00 59.70 57.80 3ffz h MET 211 Cb 0.89 -0.06 -0.12 0.00 0.06 0.00 0.00 31.60 32.38 3ffz h MET 211 CO 0.06 0.16 0.23 1.25 1.06 0.00 0.00 176.91 179.67 3ffz h HIS 212 N 0.25 0.36 -0.00 -0.22 -0.00 -0.41 0.42 115.15 115.56 3ffz h HIS 212 Ca 0.11 0.04 -0.17 0.00 -0.00 0.00 0.00 60.37 60.35 3ffz h HIS 212 Cb 0.05 -0.03 -0.02 0.00 -0.00 0.00 0.00 27.41 27.40 3ffz h HIS 212 CO -0.11 -0.09 -0.80 0.93 -0.00 0.00 0.00 177.93 177.87 3ffz h GLU 213 N 0.29 0.02 -0.59 5.26 4.39 -0.71 -2.93 114.58 120.31 3ffz h GLU 213 Ca 0.46 -0.02 -0.08 0.00 0.34 0.00 0.00 59.36 60.06 3ffz h GLU 213 Cb 0.82 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.45 3ffz h GLU 213 CO -0.53 0.81 0.04 -0.07 -1.16 0.00 0.00 179.01 178.09 3ffz h LEU 214 N 0.01 0.97 -0.41 1.33 3.38 0.33 -1.72 115.31 119.20 3ffz h LEU 214 Ca -0.01 -0.25 -0.02 0.00 0.09 0.00 0.00 57.88 57.69 3ffz h LEU 214 Cb 1.41 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.88 3ffz h LEU 214 CO 0.11 1.01 0.17 0.40 0.09 0.00 0.00 178.44 180.21 3ffz h ILE 215 N 0.93 1.19 -0.77 1.22 2.04 -0.29 0.17 117.51 122.00 3ffz h ILE 215 Ca 0.18 -0.59 0.10 0.00 1.00 0.00 0.00 64.86 65.54 3ffz h ILE 215 Cb 0.49 0.81 -0.07 0.00 -0.74 0.00 0.00 36.82 37.31 3ffz h ILE 215 CO 0.02 0.22 0.42 0.45 0.00 0.00 0.00 178.15 179.26 3ffz h HIS 216 N 0.52 0.76 0.00 1.37 3.86 -1.30 0.10 115.15 120.46 3ffz h HIS 216 Ca 0.14 0.03 -0.06 0.00 -1.16 0.00 0.00 60.37 59.32 3ffz h HIS 216 Cb 0.18 -0.22 -0.01 0.00 1.06 0.00 0.00 27.41 28.41 3ffz h HIS 216 CO -0.00 0.29 -0.28 0.77 0.86 0.00 0.00 177.93 179.57 3ffz h SER 217 N 0.70 0.00 0.54 2.45 0.02 -0.51 0.28 113.55 117.04 3ffz h SER 217 Ca 0.38 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 61.30 3ffz h SER 217 Cb 0.38 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.92 3ffz h SER 217 CO -0.26 0.28 -0.26 0.25 -1.14 0.00 0.00 176.83 175.69 3ffz h LEU 218 N 0.00 -0.62 -1.95 5.07 5.85 0.18 0.24 115.31 124.08 3ffz h LEU 218 Ca -0.00 -0.05 0.11 0.00 0.84 0.00 0.00 57.88 58.78 3ffz h LEU 218 Cb 0.64 0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.82 3ffz h LEU 218 CO 0.04 -0.25 0.30 0.45 -0.34 0.00 0.00 178.44 178.64 3ffz h HIS 219 N -1.04 0.06 0.06 1.25 3.86 -0.95 -0.81 115.15 117.58 3ffz h HIS 219 Ca -0.07 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.13 3ffz h HIS 219 Cb 0.63 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 29.08 3ffz h HIS 219 CO 0.01 0.03 -0.03 0.78 0.86 0.00 0.00 177.93 179.57 3ffz h GLY 220 N 0.05 -0.09 2.00 2.45 0.00 -0.04 -0.84 103.07 106.60 3ffz h GLY 220 Ca 0.20 0.03 -0.03 0.00 0.00 0.00 0.00 47.33 47.54 3ffz h GLY 220 CO -0.01 -0.03 -0.12 1.41 0.00 0.00 0.00 176.54 177.78 3ffz h LEU 221 N -0.47 0.00 -2.54 3.11 3.38 0.82 -1.21 115.31 118.39 3ffz h LEU 221 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3ffz h LEU 221 Cb 0.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.16 3ffz h LEU 221 CO 0.01 0.12 0.00 -1.22 0.09 0.00 0.00 178.44 177.45 3ffz n TYR 222 N -4.13 1.27 -4.45 1.13 4.02 -0.53 -4.03 117.16 110.44 3ffz n TYR 222 Ca -0.02 -0.45 -0.40 0.00 -0.01 0.00 0.00 57.90 57.02 3ffz n TYR 222 Cb 0.20 -0.33 -0.07 0.00 -0.02 0.00 0.00 39.34 39.12 3ffz n TYR 222 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3ffz n GLY 223 N 0.46 -0.36 2.17 2.72 0.00 -0.46 -4.33 105.19 105.40 3ffz n GLY 223 Ca 0.17 0.10 -0.29 0.00 0.00 0.00 0.00 46.02 46.01 3ffz n GLY 223 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ffz n ALA 224 N -4.20 5.58 0.47 4.61 0.00 -0.33 0.10 120.51 126.74 3ffz n ALA 224 Ca 0.03 -3.69 0.05 0.00 0.00 0.00 0.00 53.44 49.83 3ffz n ALA 224 Cb 0.50 -0.94 -0.06 0.00 0.00 0.00 0.00 19.45 18.95 3ffz n ALA 224 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3ffz n LYS 225 N -0.78 3.38 -0.29 0.00 5.02 0.43 -4.68 118.16 121.25 3ffz n LYS 225 Ca 0.52 -0.00 0.10 0.00 -2.02 0.00 0.00 58.31 56.90 3ffz n LYS 225 Cb 0.82 -1.01 0.24 0.00 -0.02 0.00 0.00 35.03 35.06 3ffz n LYS 225 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 3ffz h GLY 226 N 2.46 1.13 0.65 0.72 0.00 -1.62 -0.13 103.07 106.28 3ffz h GLY 226 Ca 0.00 0.07 -0.32 0.00 0.00 0.00 0.00 47.33 47.08 3ffz h GLY 226 CO 0.00 -0.37 -1.94 1.39 0.00 0.00 0.00 176.54 175.62 3ffz n ILE 227 N -5.33 1.54 0.36 2.60 2.08 -1.26 -4.00 119.36 115.35 3ffz n ILE 227 Ca 0.19 -0.81 0.14 0.00 0.56 0.00 0.00 62.75 62.82 3ffz n ILE 227 Cb 0.62 -0.88 0.40 0.00 -0.75 0.00 0.00 39.64 39.03 3ffz n ILE 227 CO 0.00 0.00 0.00 0.71 0.56 0.00 0.00 176.55 177.82 3ffz h THR 228 N 0.00 0.00 -0.34 1.39 1.35 -1.75 -3.04 112.91 110.53 3ffz h THR 228 Ca -0.38 -0.64 0.00 0.00 -0.55 0.00 0.00 66.41 64.84 3ffz h THR 228 Cb 2.09 1.60 0.00 0.00 -1.73 0.00 0.00 68.15 70.11 3ffz h THR 228 CO 0.06 0.00 0.00 0.35 -0.25 0.00 0.00 175.52 175.68 3ffz n THR 229 N -2.78 1.65 0.19 6.82 -2.24 -0.09 -2.35 114.28 115.48 3ffz n THR 229 Ca 0.03 -1.40 0.03 0.00 -2.27 0.00 0.00 64.05 60.44 3ffz n THR 229 Cb 0.41 0.13 -0.04 0.00 -2.10 0.00 0.00 70.33 68.73 3ffz n THR 229 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3ffz n LYS 230 N 0.13 3.57 -3.61 -0.78 4.76 -1.15 -4.83 118.16 116.24 3ffz n LYS 230 Ca 0.17 -0.02 -0.39 0.00 -2.87 0.00 0.00 58.31 55.20 3ffz n LYS 230 Cb 0.68 -0.89 -0.07 0.00 -1.84 0.00 0.00 35.03 32.91 3ffz n LYS 230 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 3ffz s TYR 231 N -1.82 3.56 -0.03 2.13 2.02 -1.19 -5.07 117.35 116.95 3ffz s TYR 231 Ca 0.01 -2.58 0.00 0.00 -0.37 0.00 0.00 57.07 54.13 3ffz s TYR 231 Cb 0.04 -3.37 -0.03 0.00 -0.40 0.00 0.00 41.96 38.20 3ffz s TYR 231 CO 0.24 -0.86 0.01 -0.08 -1.57 0.00 0.00 175.55 173.28 3ffz s THR 232 N -0.21 4.25 -0.28 -0.71 -1.32 -1.26 -1.81 115.64 114.30 3ffz s THR 232 Ca 0.19 -0.46 -0.16 0.00 -1.21 0.00 0.00 61.69 60.06 3ffz s THR 232 Cb -0.16 -2.86 -0.03 0.00 -1.51 0.00 0.00 72.50 67.94 3ffz s THR 232 CO -0.06 0.46 0.40 -0.63 -2.21 0.00 0.00 174.62 172.59 3ffz s ILE 233 N -1.02 5.14 0.16 5.08 1.01 0.85 -4.81 121.20 127.61 3ffz s ILE 233 Ca 0.17 0.54 0.05 0.00 0.00 0.00 0.00 60.65 61.41 3ffz s ILE 233 Cb -0.11 -3.75 -0.04 0.00 0.01 0.00 0.00 42.46 38.57 3ffz s ILE 233 CO 0.07 0.09 0.11 -0.89 0.00 0.00 0.00 174.94 174.33 3ffz s THR 234 N 2.13 4.40 0.30 2.92 2.01 -1.26 -1.11 115.64 125.02 3ffz s THR 234 Ca 0.16 -1.09 -0.18 0.00 0.31 0.00 0.00 61.69 60.89 3ffz s THR 234 Cb -0.16 -3.23 -0.09 0.00 0.01 0.00 0.00 72.50 69.03 3ffz s THR 234 CO 0.10 -0.08 0.78 -1.10 -0.69 0.00 0.00 174.62 173.63 3ffz s GLN 235 N -3.01 4.17 0.38 4.92 -1.52 -1.26 0.70 119.66 124.05 3ffz s GLN 235 Ca 0.30 0.86 -0.26 0.00 -1.95 0.00 0.00 55.36 54.31 3ffz s GLN 235 Cb -0.10 -2.60 -0.09 0.00 -0.22 0.00 0.00 33.01 30.00 3ffz s GLN 235 CO 0.23 0.23 1.19 0.21 -0.25 0.00 0.00 175.29 176.90 3ffz s LYS 236 N -2.55 4.12 -0.23 2.91 2.20 0.92 -4.31 119.74 122.80 3ffz s LYS 236 Ca 0.51 1.91 -0.21 0.00 -0.36 0.00 0.00 55.97 57.81 3ffz s LYS 236 Cb -0.13 -2.77 -0.02 0.00 -1.51 0.00 0.00 37.83 33.40 3ffz s LYS 236 CO 0.19 -0.28 0.66 -0.65 -0.36 0.00 0.00 175.35 174.91 3ffz s GLN 237 N -2.17 4.16 -0.24 4.03 -1.52 -1.26 -4.85 119.66 117.81 3ffz s GLN 237 Ca 0.55 0.64 -0.28 0.00 -1.95 0.00 0.00 55.36 54.32 3ffz s GLN 237 Cb -0.32 -3.63 0.15 0.00 -0.22 0.00 0.00 33.01 28.99 3ffz s GLN 237 CO 0.41 -0.37 1.13 1.21 -0.25 0.00 0.00 175.29 177.42 3ffz s ASN 238 N 1.36 -0.29 0.28 5.90 3.84 -1.26 -5.04 114.94 119.74 3ffz s ASN 238 Ca 0.28 0.43 0.02 0.00 0.21 0.00 0.00 52.86 53.81 3ffz s ASN 238 Cb -0.16 0.39 0.59 0.00 -0.55 0.00 0.00 41.25 41.53 3ffz s ASN 238 CO 0.09 -0.19 1.82 -0.65 -2.79 0.00 0.00 177.10 175.38 3ffz h PRO 239 N 3.03 0.89 0.00 0.43 0.11 -1.99 -1.58 132.00 132.89 3ffz h PRO 239 Ca -0.21 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.85 3ffz h PRO 239 Cb 1.18 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 32.08 3ffz h PRO 239 CO 0.22 0.59 0.00 1.28 -0.21 0.00 0.00 178.00 179.88 3ffz n LEU 240 N -4.67 0.00 -4.62 2.35 4.77 -1.26 -4.80 117.00 108.76 3ffz n LEU 240 Ca 0.20 0.00 -0.33 0.00 -0.03 0.00 0.00 56.01 55.85 3ffz n LEU 240 Cb 0.41 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.40 3ffz n LEU 240 CO 0.25 0.00 -0.36 -0.63 -1.33 0.00 0.00 177.39 175.33 3ffz s ILE 241 N -2.00 3.87 0.93 -0.08 1.01 -0.59 -2.20 121.20 122.13 3ffz s ILE 241 Ca 0.34 -0.57 -0.11 0.00 0.00 0.00 0.00 60.65 60.32 3ffz s ILE 241 Cb 0.16 -2.65 0.12 0.00 0.01 0.00 0.00 42.46 40.09 3ffz s ILE 241 CO 0.26 0.49 0.94 1.07 0.00 0.00 0.00 174.94 177.71 3ffz n THR 242 N 1.82 0.04 -4.01 2.92 5.66 0.15 -4.74 114.28 116.12 3ffz n THR 242 Ca -0.16 -0.06 -0.31 0.00 -3.05 0.00 0.00 64.05 60.47 3ffz n THR 242 Cb 0.53 -0.90 -0.15 0.00 -1.55 0.00 0.00 70.33 68.26 3ffz n THR 242 CO 0.00 0.00 0.00 0.20 -3.05 0.00 0.00 175.07 172.22 3ffz s ASN 243 N -2.46 4.79 0.17 1.09 0.01 -1.26 -4.89 114.94 112.39 3ffz s ASN 243 Ca 0.64 -2.15 0.03 0.00 -0.71 0.00 0.00 52.86 50.68 3ffz s ASN 243 Cb -0.23 -1.64 -0.05 0.00 0.41 0.00 0.00 41.25 39.75 3ffz s ASN 243 CO 0.61 -0.39 -0.04 -0.51 -1.51 0.00 0.00 177.10 175.25 3ffz s ILE 244 N 0.91 0.93 1.25 0.60 2.07 -1.26 -2.22 121.20 123.48 3ffz s ILE 244 Ca 0.11 -2.01 -0.19 0.00 -1.41 0.00 0.00 60.65 57.14 3ffz s ILE 244 Cb -0.19 -2.02 0.30 0.00 0.13 0.00 0.00 42.46 40.68 3ffz s ILE 244 CO -0.08 -0.59 1.05 -0.13 -1.91 0.00 0.00 174.94 173.29 3ffz s ARG 245 N -3.84 -1.59 0.36 3.50 0.52 -1.26 -4.76 118.95 111.88 3ffz s ARG 245 Ca 0.21 0.10 -0.24 0.00 -0.52 0.00 0.00 55.73 55.28 3ffz s ARG 245 Cb 0.05 -1.54 -0.10 0.00 0.52 0.00 0.00 34.95 33.88 3ffz s ARG 245 CO 0.03 -3.98 0.94 0.20 0.02 0.00 0.00 175.30 172.50 3ffz s GLY 246 N -3.54 2.65 -0.31 -3.53 0.00 -1.26 -4.83 107.32 96.48 3ffz s GLY 246 Ca 0.70 0.46 -0.09 0.00 0.00 0.00 0.00 44.72 45.78 3ffz s GLY 246 CO 0.57 0.84 0.15 -1.59 0.00 0.00 0.00 173.10 173.07 3ffz s THR 247 N -1.81 4.53 0.39 0.90 2.01 -0.27 -4.85 115.64 116.53 3ffz s THR 247 Ca 0.54 -0.49 -0.27 0.00 0.31 0.00 0.00 61.69 61.78 3ffz s THR 247 Cb -0.15 -3.33 -0.09 0.00 0.01 0.00 0.00 72.50 68.94 3ffz s THR 247 CO 0.20 0.04 1.33 0.20 -0.69 0.00 0.00 174.62 175.70 3ffz s ASN 248 N 1.60 6.39 0.63 3.53 0.01 -1.26 -0.11 114.94 125.73 3ffz s ASN 248 Ca 0.04 2.72 0.37 0.00 -0.71 0.00 0.00 52.86 55.28 3ffz s ASN 248 Cb -0.17 -2.65 2.11 0.00 0.41 0.00 0.00 41.25 40.95 3ffz s ASN 248 CO 0.06 -0.80 2.29 0.16 -1.51 0.00 0.00 177.10 177.30 3ffz h ILE 249 N 2.64 0.25 -0.92 0.60 3.07 -1.27 -0.72 117.51 121.17 3ffz h ILE 249 Ca -0.50 0.00 0.20 0.00 1.55 0.00 0.00 64.86 66.11 3ffz h ILE 249 Cb 1.24 0.98 -0.11 0.00 -0.27 0.00 0.00 36.82 38.65 3ffz h ILE 249 CO 0.63 0.00 0.47 -0.08 -1.05 0.00 0.00 178.15 178.12 3ffz h GLU 250 N 0.00 0.52 0.18 0.16 4.57 -1.76 0.83 114.58 119.09 3ffz h GLU 250 Ca 0.01 -0.03 0.01 0.00 -1.18 0.00 0.00 59.36 58.17 3ffz h GLU 250 Cb 0.06 -0.12 -0.03 0.00 -0.16 0.00 0.00 28.75 28.50 3ffz h GLU 250 CO -0.00 0.35 -0.27 0.93 -1.18 0.00 0.00 179.01 178.83 3ffz h GLU 251 N 0.54 -0.50 -0.83 1.92 4.39 -1.44 -0.01 114.58 118.65 3ffz h GLU 251 Ca 0.55 0.03 0.10 0.00 0.34 0.00 0.00 59.36 60.39 3ffz h GLU 251 Cb 0.96 0.11 -0.08 0.00 -0.10 0.00 0.00 28.75 29.65 3ffz h GLU 251 CO -0.46 -0.34 0.47 0.74 -1.16 0.00 0.00 179.01 178.27 3ffz h PHE 252 N -0.52 0.85 -0.33 4.33 -1.00 -1.06 0.58 116.94 119.78 3ffz h PHE 252 Ca 0.01 0.03 -0.09 0.00 2.81 0.00 0.00 57.97 60.73 3ffz h PHE 252 Cb 0.52 -0.26 -0.02 0.00 3.61 0.00 0.00 35.95 39.81 3ffz h PHE 252 CO -0.22 0.33 -0.18 1.25 -1.61 0.00 0.00 178.31 177.88 3ffz h LEU 253 N 0.77 0.61 0.16 1.54 5.85 -0.52 -1.33 115.31 122.39 3ffz h LEU 253 Ca 0.41 -0.19 -0.30 0.00 0.84 0.00 0.00 57.88 58.64 3ffz h LEU 253 Cb 0.41 -0.17 0.01 0.00 0.37 0.00 0.00 40.66 41.28 3ffz h LEU 253 CO -0.26 0.80 -1.38 0.74 -0.34 0.00 0.00 178.44 178.00 3ffz h THR 254 N 0.55 1.36 -0.10 1.05 2.02 0.14 -3.32 112.91 114.61 3ffz h THR 254 Ca 0.09 -2.91 -0.01 0.00 0.77 0.00 0.00 66.41 64.34 3ffz h THR 254 Cb 0.62 2.92 -0.00 0.00 -1.74 0.00 0.00 68.15 69.95 3ffz h THR 254 CO 0.04 0.86 0.01 0.15 0.37 0.00 0.00 175.52 176.95 3ffz h PHE 255 N 0.09 0.19 0.00 3.16 3.57 0.18 0.10 116.94 124.23 3ffz h PHE 255 Ca -0.19 -0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.28 3ffz h PHE 255 Cb 2.03 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 40.72 3ffz h PHE 255 CO 0.08 0.40 0.00 0.41 -2.23 0.00 0.00 178.31 176.97 3ffz n GLY 256 N -0.34 -1.75 7.00 2.40 0.00 -0.51 -0.23 105.19 111.76 3ffz n GLY 256 Ca -0.06 -1.55 0.00 0.00 0.00 0.00 0.00 46.02 44.41 3ffz n GLY 256 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ffz n GLY 257 N 0.00 -0.05 0.21 -0.02 0.00 -1.26 -3.22 105.19 100.85 3ffz n GLY 257 Ca 0.00 -1.03 0.15 0.00 0.00 0.00 0.00 46.02 45.14 3ffz n GLY 257 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3ffz h THR 258 N 0.00 0.00 0.00 2.61 2.02 -1.90 -2.65 112.91 112.99 3ffz h THR 258 Ca 0.00 -0.31 0.00 0.00 0.77 0.00 0.00 66.41 66.87 3ffz h THR 258 Cb 0.00 1.15 0.00 0.00 -1.74 0.00 0.00 68.15 67.56 3ffz h THR 258 CO 0.00 0.00 0.00 0.47 0.37 0.00 0.00 175.52 176.36 3ffz n ASP 259 N -2.66 0.59 0.28 4.18 9.92 -1.20 -2.06 116.55 125.61 3ffz n ASP 259 Ca 0.01 0.68 0.18 0.00 -0.53 0.00 0.00 54.79 55.12 3ffz n ASP 259 Cb 0.23 -0.79 0.75 0.00 -0.64 0.00 0.00 41.12 40.67 3ffz n ASP 259 CO 0.00 0.00 0.00 -0.07 0.13 0.00 0.00 177.20 177.26 3ffz h LEU 260 N 0.00 0.00 0.00 0.64 3.38 -1.64 -1.37 115.31 116.32 3ffz h LEU 260 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3ffz h LEU 260 Cb 0.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.01 3ffz h LEU 260 CO 0.00 0.00 0.00 0.59 0.09 0.00 0.00 178.44 179.12 3ffz n ASN 261 N -3.06 0.00 -0.04 -0.43 3.02 -0.87 -2.97 115.26 110.91 3ffz n ASN 261 Ca 0.00 0.49 -0.14 0.00 -0.03 0.00 0.00 54.58 54.90 3ffz n ASN 261 Cb 0.27 -0.50 -0.09 0.00 -0.61 0.00 0.00 39.78 38.86 3ffz n ASN 261 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 3ffz h ILE 262 N 0.00 1.41 -3.94 2.41 2.04 -1.43 -3.32 117.51 114.68 3ffz h ILE 262 Ca 0.00 -1.59 -0.54 0.00 1.00 0.00 0.00 64.86 63.73 3ffz h ILE 262 Cb 0.41 2.22 0.10 0.00 -0.74 0.00 0.00 36.82 38.81 3ffz h ILE 262 CO 0.00 0.46 0.76 -0.63 0.00 0.00 0.00 178.15 178.74 3ffz s ILE 263 N -3.83 2.11 0.50 -0.67 1.09 -1.16 -4.67 121.20 114.58 3ffz s ILE 263 Ca -0.14 0.11 -0.03 0.00 -1.10 0.00 0.00 60.65 59.49 3ffz s ILE 263 Cb 0.04 -3.07 -0.01 0.00 -1.06 0.00 0.00 42.46 38.36 3ffz s ILE 263 CO 0.76 0.03 0.76 0.42 -0.10 0.00 0.00 174.94 176.81 3ffz s THR 264 N -1.13 4.16 0.23 2.92 -4.23 -1.26 -4.93 115.64 111.39 3ffz s THR 264 Ca 0.53 -0.17 -0.08 0.00 -1.18 0.00 0.00 61.69 60.79 3ffz s THR 264 Cb -0.46 -3.58 0.19 0.00 1.34 0.00 0.00 72.50 70.00 3ffz s THR 264 CO 0.62 -0.51 1.88 -1.28 -0.54 0.00 0.00 174.62 174.78 3ffz h SER 265 N 0.19 0.89 -0.05 3.99 0.87 -1.89 -0.43 113.55 117.13 3ffz h SER 265 Ca -0.46 -0.01 -0.02 0.00 -1.23 0.00 0.00 61.79 60.07 3ffz h SER 265 Cb 1.24 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 62.99 3ffz h SER 265 CO 0.60 0.62 -0.01 0.00 -0.53 0.00 0.00 176.83 177.51 3ffz h ALA 266 N 1.34 1.76 0.08 6.23 0.00 -1.93 -1.46 119.26 125.28 3ffz h ALA 266 Ca 0.33 -0.09 -0.29 0.00 0.00 0.00 0.00 54.91 54.86 3ffz h ALA 266 Cb -0.01 -0.06 0.03 0.00 0.00 0.00 0.00 17.79 17.74 3ffz h ALA 266 CO -0.11 0.19 -1.19 1.96 0.00 0.00 0.00 179.25 180.10 3ffz h GLN 267 N 0.17 0.65 -0.66 0.00 4.20 -1.66 -1.27 115.11 116.54 3ffz h GLN 267 Ca 0.04 -0.81 -0.02 0.00 0.06 0.00 0.00 58.65 57.92 3ffz h GLN 267 Cb 0.14 0.26 -0.03 0.00 0.30 0.00 0.00 27.48 28.15 3ffz h GLN 267 CO 0.00 1.37 0.34 0.77 -0.67 0.00 0.00 178.83 180.64 3ffz h SER 268 N 0.31 0.83 0.70 1.46 0.02 -0.65 0.17 113.55 116.39 3ffz h SER 268 Ca -0.17 -0.07 -0.20 0.00 -0.84 0.00 0.00 61.79 60.51 3ffz h SER 268 Cb 1.85 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 64.17 3ffz h SER 268 CO 0.23 0.69 -0.90 0.78 -1.14 0.00 0.00 176.83 176.48 3ffz h ASN 269 N 0.93 0.17 -0.12 3.07 2.35 -1.29 -2.61 115.58 118.08 3ffz h ASN 269 Ca 0.23 -0.14 -0.17 0.00 -0.55 0.00 0.00 56.30 55.66 3ffz h ASN 269 Cb 0.06 -0.05 -0.00 0.00 0.05 0.00 0.00 38.32 38.38 3ffz h ASN 269 CO -0.03 0.98 -0.56 0.44 -1.65 0.00 0.00 177.43 176.61 3ffz h ASP 270 N 0.06 0.79 0.13 5.81 3.32 -0.70 -0.85 116.42 124.99 3ffz h ASP 270 Ca -0.04 -0.43 0.00 0.00 0.02 0.00 0.00 57.03 56.59 3ffz h ASP 270 Cb 1.56 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 40.87 3ffz h ASP 270 CO 0.13 1.18 -0.13 0.40 -1.72 0.00 0.00 179.24 179.11 3ffz h ILE 271 N 0.54 0.71 0.42 0.35 2.04 -0.67 -2.01 117.51 118.88 3ffz h ILE 271 Ca 0.01 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.86 3ffz h ILE 271 Cb 1.13 0.71 -0.02 0.00 -0.74 0.00 0.00 36.82 37.90 3ffz h ILE 271 CO 0.11 0.00 -0.37 0.22 0.00 0.00 0.00 178.15 178.11 3ffz h TYR 272 N -0.28 -1.01 -0.47 1.37 3.20 -1.33 -1.54 116.97 116.91 3ffz h TYR 272 Ca 0.01 0.00 -0.10 0.00 3.14 0.00 0.00 58.73 61.78 3ffz h TYR 272 Cb 0.27 0.39 -0.02 0.00 1.54 0.00 0.00 36.73 38.91 3ffz h TYR 272 CO -0.13 -0.53 -0.12 1.79 -1.64 0.00 0.00 178.16 177.53 3ffz h THR 273 N -0.80 1.26 -0.53 1.81 1.35 -1.20 -2.31 112.91 112.50 3ffz h THR 273 Ca -0.04 -1.23 -0.07 0.00 -0.55 0.00 0.00 66.41 64.52 3ffz h THR 273 Cb 0.70 1.04 -0.02 0.00 -1.73 0.00 0.00 68.15 68.14 3ffz h THR 273 CO -0.04 0.43 0.04 0.78 -0.25 0.00 0.00 175.52 176.48 3ffz h ASN 274 N 0.78 0.83 -0.25 5.36 2.35 -1.34 0.96 115.58 124.27 3ffz h ASN 274 Ca 0.12 -0.19 -0.10 0.00 -0.55 0.00 0.00 56.30 55.59 3ffz h ASN 274 Cb 0.64 -0.22 -0.00 0.00 0.05 0.00 0.00 38.32 38.79 3ffz h ASN 274 CO 0.04 0.86 -0.21 0.25 -1.65 0.00 0.00 177.43 176.72 3ffz h LEU 275 N 0.81 0.63 -0.23 1.61 5.85 -1.16 -2.06 115.31 120.76 3ffz h LEU 275 Ca 0.16 -0.46 -0.01 0.00 0.84 0.00 0.00 57.88 58.41 3ffz h LEU 275 Cb 0.43 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 3ffz h LEU 275 CO 0.01 0.95 0.09 0.25 -0.34 0.00 0.00 178.44 179.41 3ffz h LEU 276 N 0.31 0.32 -1.87 2.25 5.85 -1.26 0.02 115.31 120.93 3ffz h LEU 276 Ca 0.04 -0.17 -0.02 0.00 0.84 0.00 0.00 57.88 58.57 3ffz h LEU 276 Cb 0.76 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 41.71 3ffz h LEU 276 CO 0.06 0.41 -0.10 0.00 -0.34 0.00 0.00 178.44 178.46 3ffz h ALA 277 N 0.93 1.73 -0.22 1.25 0.00 -0.81 0.14 119.26 122.27 3ffz h ALA 277 Ca 0.08 -0.09 -0.18 0.00 0.00 0.00 0.00 54.91 54.72 3ffz h ALA 277 Cb 0.19 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.97 3ffz h ALA 277 CO -0.01 0.12 -0.56 -0.44 0.00 0.00 0.00 179.25 178.37 3ffz h ASP 278 N 0.00 0.88 0.51 0.00 5.19 -0.74 -2.36 116.42 119.91 3ffz h ASP 278 Ca -0.00 -0.57 -0.16 0.00 -0.62 0.00 0.00 57.03 55.68 3ffz h ASP 278 Cb 0.19 -0.26 -0.01 0.00 0.18 0.00 0.00 39.33 39.43 3ffz h ASP 278 CO 0.01 1.29 -0.71 1.88 -3.12 0.00 0.00 179.24 178.60 3ffz h TYR 279 N 0.51 0.22 -0.57 4.55 -1.99 -0.30 -1.06 116.97 118.33 3ffz h TYR 279 Ca -0.01 -0.10 -0.06 0.00 2.00 0.00 0.00 58.73 60.57 3ffz h TYR 279 Cb 1.18 -0.03 -0.02 0.00 2.00 0.00 0.00 36.73 39.85 3ffz h TYR 279 CO 0.08 0.81 0.12 0.87 -0.00 0.00 0.00 178.16 180.05 3ffz h LYS 280 N 0.11 0.92 -0.08 4.88 1.57 -0.73 0.59 116.57 123.83 3ffz h LYS 280 Ca -0.02 -0.23 -0.00 0.00 -1.87 0.00 0.00 60.65 58.53 3ffz h LYS 280 Cb 1.25 -0.12 -0.00 0.00 0.08 0.00 0.00 32.23 33.44 3ffz h LYS 280 CO 0.10 0.87 0.03 -0.22 -0.57 0.00 0.00 179.45 179.66 3ffz h LYS 281 N 0.82 0.12 -0.73 3.15 3.64 -1.24 0.52 116.57 122.86 3ffz h LYS 281 Ca 0.18 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.51 3ffz h LYS 281 Cb 0.37 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.14 3ffz h LYS 281 CO 0.01 0.23 0.36 0.82 -2.27 0.00 0.00 179.45 178.59 3ffz h ILE 282 N -0.02 1.23 0.73 2.00 2.04 -0.95 0.07 117.51 122.61 3ffz h ILE 282 Ca 0.03 -0.62 -0.03 0.00 1.00 0.00 0.00 64.86 65.24 3ffz h ILE 282 Cb 0.15 0.28 0.00 0.00 -0.74 0.00 0.00 36.82 36.51 3ffz h ILE 282 CO -0.00 0.27 -0.41 0.00 0.00 0.00 0.00 178.15 178.00 3ffz h ALA 283 N 1.37 -1.08 -0.99 1.87 0.00 0.57 0.15 119.26 121.15 3ffz h ALA 283 Ca 0.25 -0.22 0.23 0.00 0.00 0.00 0.00 54.91 55.17 3ffz h ALA 283 Cb 0.08 0.48 -0.09 0.00 0.00 0.00 0.00 17.79 18.27 3ffz h ALA 283 CO -0.04 -1.12 0.64 1.03 0.00 0.00 0.00 179.25 179.77 3ffz h SER 284 N -1.06 0.49 0.09 0.00 0.87 -0.44 -2.09 113.55 111.42 3ffz h SER 284 Ca -0.10 0.07 -0.00 0.00 -1.23 0.00 0.00 61.79 60.53 3ffz h SER 284 Cb 0.84 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.79 3ffz h SER 284 CO 0.12 0.14 -0.04 0.11 -0.53 0.00 0.00 176.83 176.63 3ffz h LYS 285 N 0.46 -0.12 -0.18 2.24 1.57 -0.38 -3.24 116.57 116.92 3ffz h LYS 285 Ca 0.55 0.01 0.05 0.00 -1.87 0.00 0.00 60.65 59.39 3ffz h LYS 285 Cb 1.30 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.63 3ffz h LYS 285 CO -0.27 0.39 0.20 1.25 -0.57 0.00 0.00 179.45 180.44 3ffz h LEU 286 N -0.73 0.00 -0.71 2.94 5.85 -0.15 -2.08 115.31 120.43 3ffz h LEU 286 Ca -0.01 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.62 3ffz h LEU 286 Cb 0.56 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.57 3ffz h LEU 286 CO 0.02 0.00 -0.02 0.28 -0.34 0.00 0.00 178.44 178.39 3ffz h SER 287 N 0.00 0.95 -0.27 1.25 0.02 -1.42 -2.85 113.55 111.23 3ffz h SER 287 Ca 0.09 -0.27 0.00 0.00 -0.84 0.00 0.00 61.79 60.77 3ffz h SER 287 Cb 0.48 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 62.77 3ffz h SER 287 CO -0.00 1.02 0.00 2.29 -1.14 0.00 0.00 176.83 179.00 3ffz n LYS 288 N -4.18 2.63 -2.60 3.45 2.85 -0.78 -4.76 118.16 114.76 3ffz n LYS 288 Ca 0.03 -1.39 -0.34 0.00 -1.05 0.00 0.00 58.31 55.56 3ffz n LYS 288 Cb 0.34 -1.77 -0.04 0.00 -0.65 0.00 0.00 35.03 32.91 3ffz n LYS 288 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 3ffz s VAL 289 N -1.76 3.90 0.05 0.58 1.01 -1.08 -4.19 120.40 118.90 3ffz s VAL 289 Ca 0.24 1.19 0.04 0.00 0.00 0.00 0.00 61.98 63.45 3ffz s VAL 289 Cb 0.18 -3.49 -0.02 0.00 0.00 0.00 0.00 36.38 33.05 3ffz s VAL 289 CO 0.08 -0.25 -0.11 -1.10 0.00 0.00 0.00 175.10 173.72 3ffz s GLN 290 N -3.20 0.71 -1.14 2.72 -0.21 0.80 -4.99 119.66 114.35 3ffz s GLN 290 Ca 0.66 -0.77 -0.23 0.00 0.02 0.00 0.00 55.36 55.05 3ffz s GLN 290 Cb -0.15 -0.63 -0.07 0.00 1.00 0.00 0.00 33.01 33.15 3ffz s GLN 290 CO 0.19 0.14 1.92 0.08 -2.12 0.00 0.00 175.29 175.50 3ffz s VAL 291 N -1.10 3.55 0.10 1.09 1.01 -1.26 -4.69 120.40 119.11 3ffz s VAL 291 Ca -0.03 -0.86 -0.17 0.00 0.00 0.00 0.00 61.98 60.91 3ffz s VAL 291 Cb -0.09 -4.50 -0.06 0.00 0.00 0.00 0.00 36.38 31.73 3ffz s VAL 291 CO 0.01 -1.03 1.54 -1.28 0.00 0.00 0.00 175.10 174.34 3ffz h SER 292 N 9.92 0.50 -4.51 3.32 0.87 -1.93 -3.45 113.55 118.26 3ffz h SER 292 Ca 0.20 -0.30 -0.29 0.00 -1.23 0.00 0.00 61.79 60.17 3ffz h SER 292 Cb 0.95 -0.13 -0.15 0.00 -0.44 0.00 0.00 62.40 62.63 3ffz h SER 292 CO 1.23 0.68 -0.66 0.20 -0.53 0.00 0.00 176.83 177.75 3ffz s ASN 293 N -6.00 1.21 -0.00 6.23 0.01 -1.26 -5.08 114.94 110.05 3ffz s ASN 293 Ca -0.13 -1.19 -0.21 0.00 -0.71 0.00 0.00 52.86 50.62 3ffz s ASN 293 Cb 0.08 0.12 -0.22 0.00 0.41 0.00 0.00 41.25 41.65 3ffz s ASN 293 CO 0.76 -0.58 1.12 1.55 -1.51 0.00 0.00 177.10 178.44 3ffz h PRO 294 N 2.67 0.35 -0.74 -0.60 0.13 -2.01 -3.30 132.00 128.50 3ffz h PRO 294 Ca -0.37 -0.33 0.21 0.00 -0.87 0.00 0.00 66.00 64.64 3ffz h PRO 294 Cb 1.21 0.08 -0.03 0.00 0.13 0.00 0.00 31.00 32.39 3ffz h PRO 294 CO 0.62 1.00 1.01 -0.07 -0.23 0.00 0.00 178.00 180.33 3ffz h LEU 295 N -0.18 0.00 -6.85 1.56 4.07 -2.01 -3.28 115.31 108.62 3ffz h LEU 295 Ca -0.04 0.00 -0.60 0.00 0.08 0.00 0.00 57.88 57.31 3ffz h LEU 295 Cb 1.12 0.00 -0.40 0.00 1.08 0.00 0.00 40.66 42.47 3ffz h LEU 295 CO 0.09 0.00 -0.77 -1.48 -1.08 0.00 0.00 178.44 175.19 3ffz s LEU 296 N -6.42 2.37 0.00 1.67 0.05 -1.24 -4.88 118.68 110.22 3ffz s LEU 296 Ca -0.03 -2.67 0.00 0.00 0.05 0.00 0.00 54.13 51.49 3ffz s LEU 296 Cb 0.12 -0.89 0.00 0.00 -2.05 0.00 0.00 46.19 43.37 3ffz s LEU 296 CO 0.41 -0.25 0.00 -3.20 -0.55 0.00 0.00 176.35 172.76 3ffz n ASN 297 N 3.46 0.00 0.00 1.48 5.15 -1.24 -4.78 115.26 119.34 3ffz n ASN 297 Ca 0.12 0.00 0.04 0.00 -0.60 0.00 0.00 54.58 54.14 3ffz n ASN 297 Cb 0.36 0.00 0.21 0.00 -0.53 0.00 0.00 39.78 39.83 3ffz n ASN 297 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 3ffz n PRO 298 N -0.23 0.62 0.17 1.20 -0.04 -1.26 -1.24 135.00 134.22 3ffz n PRO 298 Ca 0.00 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.54 3ffz n PRO 298 Cb 0.00 -1.18 0.09 0.00 -0.04 0.00 0.00 33.50 32.37 3ffz n PRO 298 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 3ffz h TYR 299 N 0.00 0.00 -0.93 0.54 0.05 -1.97 -3.12 116.97 111.54 3ffz h TYR 299 Ca 0.00 0.00 0.17 0.00 0.05 0.00 0.00 58.73 58.95 3ffz h TYR 299 Cb 0.00 0.00 -0.08 0.00 1.01 0.00 0.00 36.73 37.66 3ffz h TYR 299 CO 0.00 0.20 0.59 0.87 -1.05 0.00 0.00 178.16 178.77 3ffz h LYS 300 N 0.00 0.63 0.00 4.88 1.57 -1.53 -2.55 116.57 119.57 3ffz h LYS 300 Ca -0.01 -0.04 -0.05 0.00 -1.87 0.00 0.00 60.65 58.68 3ffz h LYS 300 Cb 1.16 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 33.32 3ffz h LYS 300 CO 0.02 0.42 -2.02 -0.25 -0.57 0.00 0.00 179.45 177.05 3ffz n ASP 301 N -4.59 0.03 -0.10 0.86 9.92 -1.23 -3.95 116.55 117.49 3ffz n ASP 301 Ca 0.19 0.01 -0.07 0.00 -0.53 0.00 0.00 54.79 54.39 3ffz n ASP 301 Cb 0.55 1.80 0.09 0.00 -0.64 0.00 0.00 41.12 42.91 3ffz n ASP 301 CO 0.00 0.00 0.00 1.62 0.13 0.00 0.00 177.20 178.95 3ffz h VAL 302 N 0.00 1.27 -0.01 2.53 3.04 -1.40 -2.76 116.25 118.92 3ffz h VAL 302 Ca -0.08 -1.28 -0.00 0.00 -1.01 0.00 0.00 66.70 64.33 3ffz h VAL 302 Cb 1.18 1.14 0.00 0.00 -2.01 0.00 0.00 31.29 31.60 3ffz h VAL 302 CO 0.00 0.43 -0.01 -0.26 -1.01 0.00 0.00 177.57 176.73 3ffz h PHE 303 N 0.71 0.02 -1.10 3.17 0.04 -1.70 -2.03 116.94 116.05 3ffz h PHE 303 Ca 0.11 -0.01 0.39 0.00 2.80 0.00 0.00 57.97 61.26 3ffz h PHE 303 Cb 0.69 -0.00 -0.15 0.00 2.20 0.00 0.00 35.95 38.68 3ffz h PHE 303 CO 0.04 0.57 0.64 1.49 -0.60 0.00 0.00 178.31 180.46 3ffz h GLU 304 N -0.54 0.12 0.00 1.51 4.81 -1.66 0.55 114.58 119.38 3ffz h GLU 304 Ca 0.00 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.22 3ffz h GLU 304 Cb 0.57 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.93 3ffz h GLU 304 CO 0.00 0.08 -0.00 0.00 -0.73 0.00 0.00 179.01 178.36 3ffz h ALA 305 N 1.83 -0.00 -0.30 2.92 0.00 -1.40 0.25 119.26 122.56 3ffz h ALA 305 Ca 0.81 -0.39 0.07 0.00 0.00 0.00 0.00 54.91 55.39 3ffz h ALA 305 Cb 2.17 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 19.89 3ffz h ALA 305 CO -0.61 -0.10 -0.22 -0.22 0.00 0.00 0.00 179.25 178.09 3ffz h LYS 306 N -0.80 -0.19 -0.36 0.00 3.64 0.71 -0.88 116.57 118.69 3ffz h LYS 306 Ca -0.00 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 3ffz h LYS 306 Cb 0.79 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.65 3ffz h LYS 306 CO 0.00 -0.13 0.00 0.66 -2.27 0.00 0.00 179.45 177.71 3ffz n TYR 307 N -5.37 0.47 -3.76 1.91 4.02 0.46 -4.94 117.16 109.95 3ffz n TYR 307 Ca 0.00 -0.22 -0.35 0.00 -0.01 0.00 0.00 57.90 57.32 3ffz n TYR 307 Cb 0.29 -0.02 0.04 0.00 -0.02 0.00 0.00 39.34 39.63 3ffz n TYR 307 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3ffz n GLY 308 N 0.95 -0.97 3.98 2.72 0.00 -0.34 -4.73 105.19 106.81 3ffz n GLY 308 Ca 0.11 0.44 -0.18 0.00 0.00 0.00 0.00 46.02 46.38 3ffz n GLY 308 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ffz s LEU 309 N -6.66 3.61 0.00 0.99 1.43 0.86 -2.47 118.68 116.45 3ffz s LEU 309 Ca 0.48 -0.48 0.07 0.00 -1.03 0.00 0.00 54.13 53.17 3ffz s LEU 309 Cb -0.19 -2.53 -0.02 0.00 0.03 0.00 0.00 46.19 43.48 3ffz s LEU 309 CO 0.88 -0.72 -0.23 -1.81 0.23 0.00 0.00 176.35 174.70 3ffz s ASP 310 N -4.30 2.67 -0.15 2.29 1.01 0.09 -4.84 116.67 113.46 3ffz s ASP 310 Ca 0.53 -0.46 0.01 0.00 0.71 0.00 0.00 52.55 53.34 3ffz s ASP 310 Cb -0.08 -0.27 0.02 0.00 1.01 0.00 0.00 42.92 43.59 3ffz s ASP 310 CO 0.32 0.25 -0.15 -0.75 0.21 0.00 0.00 175.17 175.05 3ffz s LYS 311 N -0.77 2.39 0.95 8.23 2.20 -1.26 -1.78 119.74 129.70 3ffz s LYS 311 Ca 0.09 -0.60 -0.14 0.00 -0.36 0.00 0.00 55.97 54.96 3ffz s LYS 311 Cb -0.09 -2.15 0.16 0.00 -1.51 0.00 0.00 37.83 34.24 3ffz s LYS 311 CO 0.00 -0.22 1.19 0.16 -0.36 0.00 0.00 175.35 176.13 3ffz s ASP 312 N 1.43 3.24 0.57 1.43 -4.77 -1.13 -4.87 116.67 112.56 3ffz s ASP 312 Ca 0.04 0.68 0.28 0.00 -3.30 0.00 0.00 52.55 50.25 3ffz s ASP 312 Cb -0.13 -1.04 1.52 0.00 -1.09 0.00 0.00 42.92 42.18 3ffz s ASP 312 CO -0.10 -2.69 1.99 0.00 0.70 0.00 0.00 175.17 175.07 3ffz h ALA 313 N -1.60 2.13 0.00 2.11 0.00 -2.00 0.42 119.26 120.32 3ffz h ALA 313 Ca -0.47 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.43 3ffz h ALA 313 Cb 1.30 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.12 3ffz h ALA 313 CO 0.52 -0.55 -0.06 0.43 0.00 0.00 0.00 179.25 179.58 3ffz n SER 314 N -3.92 0.41 0.00 0.00 7.64 -1.26 -4.95 113.62 111.55 3ffz n SER 314 Ca 0.06 0.47 0.00 0.00 1.01 0.00 0.00 58.87 60.41 3ffz n SER 314 Cb 0.53 -0.55 0.00 0.00 -1.01 0.00 0.00 64.21 63.19 3ffz n SER 314 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3ffz n GLY 315 N 1.41 0.69 3.74 0.23 0.00 0.14 -5.07 105.19 106.33 3ffz n GLY 315 Ca 0.06 -0.29 -0.31 0.00 0.00 0.00 0.00 46.02 45.48 3ffz n GLY 315 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3ffz s ILE 316 N -2.00 4.40 0.34 -0.61 -4.36 -1.26 -4.81 121.20 112.90 3ffz s ILE 316 Ca 0.00 -0.74 0.05 0.00 -0.26 0.00 0.00 60.65 59.70 3ffz s ILE 316 Cb 0.00 -3.08 -0.01 0.00 1.25 0.00 0.00 42.46 40.62 3ffz s ILE 316 CO 0.00 0.19 0.49 -0.31 0.24 0.00 0.00 174.94 175.55 3ffz s TYR 317 N -1.30 3.19 -0.05 1.37 2.02 -1.26 -2.85 117.35 118.47 3ffz s TYR 317 Ca 0.26 -0.10 -0.23 0.00 -0.37 0.00 0.00 57.07 56.63 3ffz s TYR 317 Cb -0.12 -1.98 0.05 0.00 -0.40 0.00 0.00 41.96 39.51 3ffz s TYR 317 CO 0.18 0.00 0.52 -1.54 -1.57 0.00 0.00 175.55 173.15 3ffz s SER 318 N -4.15 -0.46 -0.00 2.29 1.04 -0.73 -4.49 113.70 107.20 3ffz s SER 318 Ca 0.44 0.50 -0.30 0.00 0.48 0.00 0.00 55.95 57.07 3ffz s SER 318 Cb -0.10 0.50 -0.03 0.00 0.10 0.00 0.00 66.02 66.50 3ffz s SER 318 CO 0.32 -0.51 0.99 -0.69 0.98 0.00 0.00 173.24 174.33 3ffz s VAL 319 N -1.11 4.84 -0.43 5.02 1.01 -1.26 -0.73 120.40 127.74 3ffz s VAL 319 Ca -0.11 2.04 -0.23 0.00 0.00 0.00 0.00 61.98 63.68 3ffz s VAL 319 Cb -0.02 -4.31 0.02 0.00 0.00 0.00 0.00 36.38 32.07 3ffz s VAL 319 CO 0.07 0.16 0.78 0.21 0.00 0.00 0.00 175.10 176.32 3ffz s ASN 320 N 1.01 6.43 0.57 3.32 3.84 -1.03 -4.91 114.94 124.18 3ffz s ASN 320 Ca 0.52 -0.03 0.34 0.00 0.21 0.00 0.00 52.86 53.90 3ffz s ASN 320 Cb -0.21 -2.39 1.45 0.00 -0.55 0.00 0.00 41.25 39.55 3ffz s ASN 320 CO 0.28 -0.88 1.75 0.40 -2.79 0.00 0.00 177.10 175.86 3ffz h ILE 321 N 5.94 0.32 0.11 -5.21 1.08 -1.94 0.11 117.51 117.91 3ffz h ILE 321 Ca -0.25 0.00 -0.30 0.00 -0.39 0.00 0.00 64.86 63.93 3ffz h ILE 321 Cb 1.09 0.39 0.03 0.00 -3.07 0.00 0.00 36.82 35.26 3ffz h ILE 321 CO 0.95 0.00 -1.22 0.78 -0.69 0.00 0.00 178.15 177.97 3ffz h ASN 322 N 0.00 0.89 -0.41 1.72 2.35 -1.94 -2.78 115.58 115.42 3ffz h ASN 322 Ca 0.47 -0.81 -0.10 0.00 -0.55 0.00 0.00 56.30 55.31 3ffz h ASN 322 Cb 2.12 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 40.20 3ffz h ASN 322 CO -0.00 1.61 -0.14 0.11 -1.65 0.00 0.00 177.43 177.36 3ffz h LYS 323 N 0.29 0.82 0.34 0.81 1.79 -1.10 -3.13 116.57 116.38 3ffz h LYS 323 Ca -0.18 -0.33 -0.00 0.00 -2.18 0.00 0.00 60.65 57.95 3ffz h LYS 323 Cb 1.89 -0.04 -0.03 0.00 -1.58 0.00 0.00 32.23 32.48 3ffz h LYS 323 CO 0.24 0.96 -0.38 0.35 -1.08 0.00 0.00 179.45 179.53 3ffz h PHE 324 N 0.63 -1.05 -0.03 -1.35 3.57 -1.26 0.22 116.94 117.68 3ffz h PHE 324 Ca 0.10 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.62 3ffz h PHE 324 Cb 0.68 0.41 -0.00 0.00 2.79 0.00 0.00 35.95 39.83 3ffz h PHE 324 CO 0.05 -0.53 0.46 -0.91 -2.23 0.00 0.00 178.31 175.16 3ffz h ASN 325 N -0.76 0.00 0.17 0.41 4.21 -1.52 0.45 115.58 118.54 3ffz h ASN 325 Ca -0.02 0.00 -0.35 0.00 1.21 0.00 0.00 56.30 57.14 3ffz h ASN 325 Cb 0.70 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.90 3ffz h ASN 325 CO -0.09 0.00 -1.81 0.44 -1.29 0.00 0.00 177.43 174.69 3ffz h ASP 326 N 0.00 0.55 -0.45 5.81 5.19 -0.63 -2.72 116.42 124.16 3ffz h ASP 326 Ca 0.01 -0.94 0.05 0.00 -0.62 0.00 0.00 57.03 55.54 3ffz h ASP 326 Cb 0.94 -0.18 -0.05 0.00 0.18 0.00 0.00 39.33 40.23 3ffz h ASP 326 CO -0.00 1.80 0.18 0.40 -3.12 0.00 0.00 179.24 178.50 3ffz h ILE 327 N 0.07 0.88 -0.43 0.35 1.08 0.24 0.46 117.51 120.17 3ffz h ILE 327 Ca -0.37 -0.12 0.02 0.00 -0.39 0.00 0.00 64.86 64.00 3ffz h ILE 327 Cb 2.06 0.49 -0.03 0.00 -3.07 0.00 0.00 36.82 36.27 3ffz h ILE 327 CO 0.15 0.07 0.25 -0.26 -0.69 0.00 0.00 178.15 177.66 3ffz h PHE 328 N 0.36 0.47 0.00 1.37 -1.00 -1.22 0.12 116.94 117.04 3ffz h PHE 328 Ca 0.21 0.01 -0.10 0.00 2.81 0.00 0.00 57.97 60.90 3ffz h PHE 328 Cb 0.18 -0.15 -0.01 0.00 3.61 0.00 0.00 35.95 39.58 3ffz h PHE 328 CO -0.14 0.27 -0.50 -0.22 -1.61 0.00 0.00 178.31 176.11 3ffz h LYS 329 N 0.51 0.00 0.00 1.51 3.64 -1.11 0.73 116.57 121.84 3ffz h LYS 329 Ca 0.17 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.53 3ffz h LYS 329 Cb 0.01 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.83 3ffz h LYS 329 CO -0.08 0.50 -0.08 -0.22 -2.27 0.00 0.00 179.45 177.30 3ffz h LYS 330 N 0.00 0.00 0.00 1.90 3.64 0.86 -2.98 116.57 119.99 3ffz h LYS 330 Ca -0.00 0.00 -0.38 0.00 -1.27 0.00 0.00 60.65 58.99 3ffz h LYS 330 Cb 0.93 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 32.68 3ffz h LYS 330 CO 0.06 0.08 -2.45 1.28 -2.27 0.00 0.00 179.45 176.16 3ffz n LEU 331 N -3.19 2.58 -0.88 5.20 4.32 0.32 -4.67 117.00 120.68 3ffz n LEU 331 Ca 0.01 -0.12 0.08 0.00 -0.02 0.00 0.00 56.01 55.96 3ffz n LEU 331 Cb 0.39 -0.71 0.20 0.00 -1.62 0.00 0.00 43.42 41.67 3ffz n LEU 331 CO 0.30 0.87 0.66 -1.22 -1.22 0.00 0.00 177.39 176.79 3ffz n TYR 332 N -3.18 0.57 0.01 -1.77 4.02 0.19 -4.26 117.16 112.73 3ffz n TYR 332 Ca -0.44 -0.42 -0.12 0.00 -0.01 0.00 0.00 57.90 56.91 3ffz n TYR 332 Cb 1.00 -0.01 -0.14 0.00 -0.02 0.00 0.00 39.34 40.17 3ffz n TYR 332 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 176.86 176.62 3ffz h SER 333 N 2.97 0.15 -3.02 7.72 0.02 -1.73 -3.42 113.55 116.24 3ffz h SER 333 Ca 0.00 -0.27 -0.57 0.00 -0.84 0.00 0.00 61.79 60.11 3ffz h SER 333 Cb 0.81 -0.05 -0.04 0.00 0.14 0.00 0.00 62.40 63.26 3ffz h SER 333 CO 0.00 1.24 1.10 -0.36 -1.14 0.00 0.00 176.83 177.66 3ffz s PHE 334 N -2.61 2.29 0.02 3.45 0.08 -1.26 -4.62 117.98 115.33 3ffz s PHE 334 Ca -0.08 0.68 -0.03 0.00 0.12 0.00 0.00 56.93 57.62 3ffz s PHE 334 Cb 0.08 -4.11 -0.01 0.00 -0.57 0.00 0.00 43.02 38.41 3ffz s PHE 334 CO 0.82 -2.32 0.03 0.95 -0.10 0.00 0.00 175.22 174.59 3ffz s THR 335 N 5.37 0.11 0.53 0.64 -4.23 -1.26 -4.88 115.64 111.92 3ffz s THR 335 Ca 0.66 -0.88 0.24 0.00 -1.18 0.00 0.00 61.69 60.52 3ffz s THR 335 Cb -0.19 -0.39 0.37 0.00 1.34 0.00 0.00 72.50 73.64 3ffz s THR 335 CO 0.30 -0.49 2.03 -0.08 -0.54 0.00 0.00 174.62 175.84 3ffz h GLU 336 N 4.43 0.00 -0.02 3.99 4.81 -0.59 -2.30 114.58 124.91 3ffz h GLU 336 Ca -0.32 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 58.91 3ffz h GLU 336 Cb 1.20 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.58 3ffz h GLU 336 CO 0.42 0.00 -0.02 0.35 -0.73 0.00 0.00 179.01 179.03 3ffz h PHE 337 N 0.00 0.05 0.08 0.92 3.57 -0.85 -2.62 116.94 118.09 3ffz h PHE 337 Ca 0.19 -0.02 -0.28 0.00 3.53 0.00 0.00 57.97 61.39 3ffz h PHE 337 Cb 0.79 -0.01 0.02 0.00 2.79 0.00 0.00 35.95 39.54 3ffz h PHE 337 CO 0.00 0.52 -1.16 -0.44 -2.23 0.00 0.00 178.31 174.99 3ffz h ASP 338 N -0.43 0.84 -0.98 0.41 3.32 -1.80 -3.14 116.42 114.63 3ffz h ASP 338 Ca 0.00 -0.74 0.12 0.00 0.02 0.00 0.00 57.03 56.44 3ffz h ASP 338 Cb 0.51 -0.26 -0.08 0.00 0.22 0.00 0.00 39.33 39.71 3ffz h ASP 338 CO 0.00 1.54 0.62 -0.07 -1.72 0.00 0.00 179.24 179.62 3ffz h LEU 339 N 0.30 0.88 -1.00 1.55 3.38 -1.53 0.29 115.31 119.17 3ffz h LEU 339 Ca -0.16 0.05 0.05 0.00 0.09 0.00 0.00 57.88 57.91 3ffz h LEU 339 Cb 1.83 -0.13 -0.06 0.00 0.09 0.00 0.00 40.66 42.39 3ffz h LEU 339 CO 0.22 0.47 0.65 0.00 0.09 0.00 0.00 178.44 179.87 3ffz h ALA 340 N 1.55 1.37 0.00 1.53 0.00 -1.42 -0.10 119.26 122.19 3ffz h ALA 340 Ca 0.49 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.36 3ffz h ALA 340 Cb 0.52 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.98 3ffz h ALA 340 CO -0.25 0.49 0.00 1.79 0.00 0.00 0.00 179.25 181.28 3ffz h THR 341 N 1.22 0.00 -0.03 0.00 1.35 -0.46 -1.60 112.91 113.38 3ffz h THR 341 Ca 0.42 -0.42 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 3ffz h THR 341 Cb 0.10 1.31 0.00 0.00 -1.73 0.00 0.00 68.15 67.83 3ffz h THR 341 CO -0.15 0.00 0.00 0.29 -0.25 0.00 0.00 175.52 175.41 3ffz n LYS 342 N -2.38 2.06 0.00 4.72 4.76 -0.15 -3.88 118.16 123.29 3ffz n LYS 342 Ca 0.04 -1.54 0.00 0.00 -2.87 0.00 0.00 58.31 53.94 3ffz n LYS 342 Cb 0.35 -1.47 0.00 0.00 -1.84 0.00 0.00 35.03 32.07 3ffz n LYS 342 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 3ffz n PHE 343 N 0.87 0.00 -3.61 2.13 3.72 -0.60 -4.91 117.46 115.05 3ffz n PHE 343 Ca 0.16 -0.03 -0.21 0.00 -0.05 0.00 0.00 57.45 57.32 3ffz n PHE 343 Cb 0.50 -0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.04 3ffz n PHE 343 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 3ffz n GLN 344 N -0.03 -1.55 -3.87 -1.08 6.02 -0.63 -4.98 117.38 111.26 3ffz n GLN 344 Ca 0.00 0.98 -0.11 0.00 -0.01 0.00 0.00 57.00 57.86 3ffz n GLN 344 Cb 0.07 -3.01 -0.11 0.00 1.02 0.00 0.00 30.24 28.22 3ffz n GLN 344 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 3ffz s VAL 345 N -2.87 0.06 0.25 5.09 -7.23 -1.10 -4.88 120.40 109.72 3ffz s VAL 345 Ca 0.03 -0.53 -0.30 0.00 -1.81 0.00 0.00 61.98 59.38 3ffz s VAL 345 Cb -0.00 -0.36 -0.09 0.00 0.56 0.00 0.00 36.38 36.48 3ffz s VAL 345 CO 0.86 -0.29 1.05 -0.75 -0.31 0.00 0.00 175.10 175.67 3ffz s LYS 346 N -1.02 4.69 0.16 4.82 2.47 -1.26 -4.60 119.74 125.00 3ffz s LYS 346 Ca -0.11 1.70 0.09 0.00 -1.56 0.00 0.00 55.97 56.09 3ffz s LYS 346 Cb -0.06 -3.23 -0.04 0.00 -1.46 0.00 0.00 37.83 33.03 3ffz s LYS 346 CO 0.01 0.27 -0.20 0.00 0.16 0.00 0.00 175.35 175.59 3ffz s ARG 348 N -2.59 2.90 0.39 0.00 1.70 -1.26 -4.94 118.95 115.15 3ffz s ARG 348 Ca 0.15 1.26 0.27 0.00 -0.47 0.00 0.00 55.73 56.94 3ffz s ARG 348 Cb -0.07 -1.97 0.90 0.00 -0.57 0.00 0.00 34.95 33.24 3ffz s ARG 348 CO 0.07 -1.15 1.79 0.37 -1.08 0.00 0.00 175.30 175.29 3ffz h GLN 349 N -0.08 0.00 -3.08 3.89 4.15 -1.99 -3.46 115.11 114.54 3ffz h GLN 349 Ca -0.46 0.00 -0.05 0.00 0.77 0.00 0.00 58.65 58.91 3ffz h GLN 349 Cb 1.23 0.00 -0.14 0.00 0.21 0.00 0.00 27.48 28.78 3ffz h GLN 349 CO 0.55 0.00 0.01 -0.08 -1.93 0.00 0.00 178.83 177.38 3ffz s THR 350 N -3.36 0.04 0.14 2.39 -1.32 -1.26 -4.65 115.64 107.62 3ffz s THR 350 Ca 0.05 -0.35 0.05 0.00 -1.21 0.00 0.00 61.69 60.24 3ffz s THR 350 Cb 0.09 -1.05 -0.19 0.00 -1.51 0.00 0.00 72.50 69.84 3ffz s THR 350 CO 0.55 -0.19 1.32 0.22 -2.21 0.00 0.00 174.62 174.32 3ffz h TYR 351 N 2.49 0.12 -2.85 9.09 5.03 -1.91 -3.43 116.97 125.51 3ffz h TYR 351 Ca -0.33 -0.08 -0.56 0.00 2.58 0.00 0.00 58.73 60.35 3ffz h TYR 351 Cb 1.25 -0.01 -0.03 0.00 1.55 0.00 0.00 36.73 39.49 3ffz h TYR 351 CO 0.33 0.98 0.93 0.96 -1.32 0.00 0.00 178.16 180.04 3ffz s ILE 352 N -2.91 4.09 0.00 1.81 -4.36 -1.26 -4.94 121.20 113.63 3ffz s ILE 352 Ca -0.01 1.33 0.00 0.00 -0.26 0.00 0.00 60.65 61.71 3ffz s ILE 352 Cb 0.10 -3.86 0.00 0.00 1.25 0.00 0.00 42.46 39.95 3ffz s ILE 352 CO 0.82 -0.11 0.00 0.61 0.24 0.00 0.00 174.94 176.51 3ffz n GLY 353 N 3.72 1.56 3.34 6.27 0.00 -1.26 -5.10 105.19 113.72 3ffz n GLY 353 Ca 0.14 -0.42 -0.38 0.00 0.00 0.00 0.00 46.02 45.36 3ffz n GLY 353 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3ffz s GLN 354 N -2.00 2.90 0.12 1.61 1.11 -1.26 -5.10 119.66 117.05 3ffz s GLN 354 Ca 0.00 -1.00 0.03 0.00 0.01 0.00 0.00 55.36 54.40 3ffz s GLN 354 Cb 0.00 -3.50 -0.04 0.00 -1.01 0.00 0.00 33.01 28.46 3ffz s GLN 354 CO 0.00 -0.57 0.15 0.71 0.01 0.00 0.00 175.29 175.59 3ffz s TYR 355 N 1.49 3.26 -0.35 0.91 2.02 -1.26 -5.05 117.35 118.37 3ffz s TYR 355 Ca 0.01 0.06 -0.10 0.00 -0.37 0.00 0.00 57.07 56.68 3ffz s TYR 355 Cb -0.18 -1.60 0.02 0.00 -0.40 0.00 0.00 41.96 39.80 3ffz s TYR 355 CO 0.04 0.53 0.18 0.21 -1.57 0.00 0.00 175.55 174.93 3ffz s LYS 356 N -2.83 2.93 0.59 -0.62 2.47 -1.25 -4.89 119.74 116.13 3ffz s LYS 356 Ca 0.31 -1.00 -0.16 0.00 -1.56 0.00 0.00 55.97 53.56 3ffz s LYS 356 Cb -0.11 -3.64 -0.04 0.00 -1.46 0.00 0.00 37.83 32.58 3ffz s LYS 356 CO 0.24 -0.62 1.06 0.71 0.16 0.00 0.00 175.35 176.90 3ffz s TYR 357 N 1.55 2.96 0.36 4.03 2.02 -1.26 -2.46 117.35 124.54 3ffz s TYR 357 Ca 0.02 1.52 0.05 0.00 -0.37 0.00 0.00 57.07 58.29 3ffz s TYR 357 Cb -0.19 -3.03 -0.03 0.00 -0.40 0.00 0.00 41.96 38.32 3ffz s TYR 357 CO 0.06 -1.14 0.21 -0.06 -1.57 0.00 0.00 175.55 173.05 3ffz s PHE 358 N -2.39 1.74 -0.17 2.71 0.40 -0.57 -4.95 117.98 114.75 3ffz s PHE 358 Ca 0.64 -1.50 -0.07 0.00 -0.60 0.00 0.00 56.93 55.40 3ffz s PHE 358 Cb -0.17 -0.89 -0.04 0.00 0.51 0.00 0.00 43.02 42.43 3ffz s PHE 358 CO 0.36 -0.63 0.07 0.21 0.70 0.00 0.00 175.22 175.93 3ffz s LYS 359 N -3.59 3.89 -0.01 0.44 2.20 -0.97 -3.37 119.74 118.33 3ffz s LYS 359 Ca 0.33 -0.32 -0.22 0.00 -0.36 0.00 0.00 55.97 55.41 3ffz s LYS 359 Cb 0.03 -3.21 -0.05 0.00 -1.51 0.00 0.00 37.83 33.09 3ffz s LYS 359 CO 0.22 0.35 0.66 -0.51 -0.36 0.00 0.00 175.35 175.71 3ffz s LEU 360 N 0.16 4.39 1.46 5.43 1.43 0.10 -2.25 118.68 129.40 3ffz s LEU 360 Ca 0.05 1.23 -0.24 0.00 -1.03 0.00 0.00 54.13 54.14 3ffz s LEU 360 Cb -0.12 -3.03 0.38 0.00 0.03 0.00 0.00 46.19 43.45 3ffz s LEU 360 CO 0.00 0.02 0.90 -0.44 0.23 0.00 0.00 176.35 177.07 3ffz s SER 361 N 0.13 -1.41 -0.45 2.29 0.01 -0.68 -4.72 113.70 108.86 3ffz s SER 361 Ca 0.34 0.87 -0.27 0.00 1.31 0.00 0.00 55.95 58.20 3ffz s SER 361 Cb -0.19 -1.23 -0.07 0.00 0.21 0.00 0.00 66.02 64.75 3ffz s SER 361 CO 0.19 -5.58 2.39 -3.20 0.41 0.00 0.00 173.24 167.45 3ffz n ASN 362 N -5.78 2.41 0.24 2.44 5.15 -1.26 -4.76 115.26 113.70 3ffz n ASN 362 Ca 0.13 -0.31 0.07 0.00 -0.60 0.00 0.00 54.58 53.87 3ffz n ASN 362 Cb 0.60 -1.54 0.59 0.00 -0.53 0.00 0.00 39.78 38.90 3ffz n ASN 362 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 3ffz h LEU 363 N 18.20 0.00 -1.59 1.20 3.38 -1.95 -1.43 115.31 133.11 3ffz h LEU 363 Ca -0.27 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.66 3ffz h LEU 363 Cb 1.27 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.01 3ffz h LEU 363 CO 1.13 0.09 -0.20 -0.07 0.09 0.00 0.00 178.44 179.48 3ffz h LEU 364 N 0.00 0.00 -8.25 1.67 3.38 -1.88 -3.40 115.31 106.83 3ffz h LEU 364 Ca -0.00 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.67 3ffz h LEU 364 Cb 0.17 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.87 3ffz h LEU 364 CO 0.01 0.20 0.75 0.21 0.09 0.00 0.00 178.44 179.70 3ffz s ASN 365 N -6.35 5.10 0.00 -0.43 3.84 -0.54 -4.80 114.94 111.76 3ffz s ASN 365 Ca -0.02 -0.58 0.00 0.00 0.21 0.00 0.00 52.86 52.47 3ffz s ASN 365 Cb 0.13 -2.56 0.00 0.00 -0.55 0.00 0.00 41.25 38.27 3ffz s ASN 365 CO 0.63 -2.77 0.38 0.47 -2.79 0.00 0.00 177.10 173.02 3ffz n ASP 366 N 14.09 0.00 0.01 -4.21 8.00 -1.25 -0.84 116.55 132.35 3ffz n ASP 366 Ca 0.39 0.00 0.11 0.00 0.71 0.00 0.00 54.79 56.01 3ffz n ASP 366 Cb 0.47 0.00 0.10 0.00 -0.02 0.00 0.00 41.12 41.67 3ffz n ASP 366 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 3ffz n SER 367 N -0.87 0.65 0.00 -2.24 2.88 -1.26 -4.17 113.62 108.61 3ffz n SER 367 Ca 0.00 -0.40 0.00 0.00 -1.33 0.00 0.00 58.87 57.14 3ffz n SER 367 Cb 0.00 0.56 0.00 0.00 -0.75 0.00 0.00 64.21 64.02 3ffz n SER 367 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3ffz n ILE 368 N -1.65 0.00 -3.49 2.46 3.06 -0.02 -5.00 119.36 114.72 3ffz n ILE 368 Ca 0.04 -0.35 0.01 0.00 -2.50 0.00 0.00 62.75 59.94 3ffz n ILE 368 Cb 0.36 0.87 -0.04 0.00 0.54 0.00 0.00 39.64 41.37 3ffz n ILE 368 CO 0.00 0.00 0.00 -0.47 -2.50 0.00 0.00 176.55 173.58 3ffz s TYR 369 N -1.18 -0.97 0.29 9.51 5.04 -1.12 -4.63 117.35 124.29 3ffz s TYR 369 Ca 0.00 1.66 0.05 0.00 -2.44 0.00 0.00 57.07 56.34 3ffz s TYR 369 Cb 0.00 0.57 -0.06 0.00 0.35 0.00 0.00 41.96 42.82 3ffz s TYR 369 CO 0.00 -0.49 -0.01 0.54 -1.34 0.00 0.00 175.55 174.26 3ffz s ASN 370 N 2.66 2.54 0.24 4.32 2.20 0.10 -3.87 114.94 123.13 3ffz s ASN 370 Ca -0.03 -1.27 -0.04 0.00 -0.94 0.00 0.00 52.86 50.57 3ffz s ASN 370 Cb -0.09 -0.12 0.45 0.00 -2.00 0.00 0.00 41.25 39.49 3ffz s ASN 370 CO -0.18 -0.47 1.74 0.40 -2.94 0.00 0.00 177.10 175.65 3ffz h ILE 371 N 2.23 0.68 0.00 0.54 1.08 -1.91 -1.18 117.51 118.95 3ffz h ILE 371 Ca -0.40 -0.16 0.00 0.00 -0.39 0.00 0.00 64.86 63.91 3ffz h ILE 371 Cb 1.24 0.17 0.00 0.00 -3.07 0.00 0.00 36.82 35.16 3ffz h ILE 371 CO 0.68 0.08 0.00 -1.20 -0.69 0.00 0.00 178.15 177.03 3ffz n SER 372 N -4.98 0.00 -0.94 1.72 7.64 -1.26 -4.35 113.62 111.45 3ffz n SER 372 Ca 0.14 0.50 0.08 0.00 1.01 0.00 0.00 58.87 60.59 3ffz n SER 372 Cb 0.40 -0.35 0.22 0.00 -1.01 0.00 0.00 64.21 63.48 3ffz n SER 372 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3ffz n GLU 373 N -1.54 2.22 0.00 1.43 1.02 -1.26 -5.02 120.64 117.49 3ffz n GLU 373 Ca 0.00 -1.79 0.00 0.00 -0.02 0.00 0.00 57.16 55.35 3ffz n GLU 373 Cb 0.00 -1.42 0.00 0.00 -0.02 0.00 0.00 31.44 30.00 3ffz n GLU 373 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3ffz n GLY 374 N 1.24 1.41 0.10 0.62 0.00 -0.44 -1.60 105.19 106.51 3ffz n GLY 374 Ca 0.17 0.42 -0.11 0.00 0.00 0.00 0.00 46.02 46.49 3ffz n GLY 374 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3ffz n TYR 375 N 0.35 0.07 -1.57 1.61 4.01 -1.26 -0.72 117.16 119.65 3ffz n TYR 375 Ca 0.00 0.02 -0.42 0.00 -0.16 0.00 0.00 57.90 57.35 3ffz n TYR 375 Cb 0.00 -1.01 -0.01 0.00 -0.31 0.00 0.00 39.34 38.00 3ffz n TYR 375 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 3ffz n ASN 376 N -2.83 3.89 -4.66 7.72 5.03 -0.63 -4.51 115.26 119.26 3ffz n ASN 376 Ca -0.34 -2.78 -0.40 0.00 0.87 0.00 0.00 54.58 51.93 3ffz n ASN 376 Cb 1.13 -1.53 -0.05 0.00 -1.02 0.00 0.00 39.78 38.31 3ffz n ASN 376 CO 0.00 0.00 0.00 0.27 -1.83 0.00 0.00 177.26 175.70 3ffz s ILE 377 N 3.51 4.98 0.00 2.41 -4.36 -1.26 -4.46 121.20 122.02 3ffz s ILE 377 Ca 0.50 1.32 0.00 0.00 -0.26 0.00 0.00 60.65 62.21 3ffz s ILE 377 Cb 0.14 -4.00 0.00 0.00 1.25 0.00 0.00 42.46 39.85 3ffz s ILE 377 CO -0.05 0.09 0.00 0.59 0.24 0.00 0.00 174.94 175.82 3ffz n ASN 378 N 5.07 0.00 -0.33 4.36 5.03 -1.26 -2.48 115.26 125.65 3ffz n ASN 378 Ca 0.00 0.00 0.23 0.00 0.87 0.00 0.00 54.58 55.68 3ffz n ASN 378 Cb 0.49 0.00 0.46 0.00 -1.02 0.00 0.00 39.78 39.71 3ffz n ASN 378 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 3ffz h ASN 379 N 0.00 0.46 0.00 6.41 -1.07 -2.01 0.71 115.58 120.08 3ffz h ASN 379 Ca 0.00 0.19 0.00 0.00 0.07 0.00 0.00 56.30 56.56 3ffz h ASN 379 Cb 0.00 0.16 0.00 0.00 -2.07 0.00 0.00 38.32 36.41 3ffz h ASN 379 CO 0.00 -0.15 0.00 0.18 0.07 0.00 0.00 177.43 177.53 3ffz n LEU 380 N -5.08 0.30 0.08 6.14 4.77 -1.03 -3.12 117.00 119.06 3ffz n LEU 380 Ca 0.31 -0.15 -0.08 0.00 -0.03 0.00 0.00 56.01 56.06 3ffz n LEU 380 Cb 0.96 -0.15 -0.07 0.00 -2.33 0.00 0.00 43.42 41.83 3ffz n LEU 380 CO 0.09 0.07 0.17 0.50 -1.33 0.00 0.00 177.39 176.89 3ffz h LYS 381 N 0.34 0.08 -6.25 3.23 3.64 -1.06 -2.03 116.57 114.52 3ffz h LYS 381 Ca 0.00 -0.11 -0.55 0.00 -1.27 0.00 0.00 60.65 58.72 3ffz h LYS 381 Cb 0.15 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.99 3ffz h LYS 381 CO 0.00 0.98 1.09 0.14 -2.27 0.00 0.00 179.45 179.40 3ffz s VAL 382 N -2.89 3.62 -1.65 2.00 -7.23 -1.18 -2.25 120.40 110.83 3ffz s VAL 382 Ca -0.01 0.74 0.00 0.00 -1.81 0.00 0.00 61.98 60.90 3ffz s VAL 382 Cb 0.10 -3.51 0.00 0.00 0.56 0.00 0.00 36.38 33.53 3ffz s VAL 382 CO 0.82 -0.10 0.00 0.59 -0.31 0.00 0.00 175.10 176.11 3ffz n ASN 383 N 7.40 -5.03 -4.14 4.85 5.03 -1.26 -2.62 115.26 119.49 3ffz n ASN 383 Ca 0.18 0.22 -0.32 0.00 0.87 0.00 0.00 54.58 55.52 3ffz n ASN 383 Cb 0.43 -4.08 -0.03 0.00 -1.02 0.00 0.00 39.78 35.08 3ffz n ASN 383 CO 0.00 0.00 0.00 0.49 -1.83 0.00 0.00 177.26 175.92 3ffz n PHE 384 N -3.20 -1.67 0.31 3.10 3.72 -0.95 -4.80 117.46 113.97 3ffz n PHE 384 Ca -0.19 0.76 0.20 0.00 -0.05 0.00 0.00 57.45 58.18 3ffz n PHE 384 Cb 0.60 -3.21 1.07 0.00 -0.94 0.00 0.00 39.48 37.00 3ffz n PHE 384 CO 0.00 0.00 0.00 -0.09 -0.05 0.00 0.00 176.76 176.62 3ffz h ARG 385 N -1.64 0.00 0.00 -1.08 2.43 -1.13 -1.30 114.38 111.66 3ffz h ARG 385 Ca -0.61 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.56 3ffz h ARG 385 Cb 1.38 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.93 3ffz h ARG 385 CO 0.72 0.00 0.00 0.41 -1.51 0.00 0.00 179.97 179.59 3ffz n GLY 386 N -1.03 -0.77 0.00 2.80 0.00 -1.01 -2.46 105.19 102.71 3ffz n GLY 386 Ca -0.02 -0.14 0.01 0.00 0.00 0.00 0.00 46.02 45.86 3ffz n GLY 386 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3ffz n GLN 387 N -0.95 0.65 -1.62 1.61 6.02 -0.50 -4.55 117.38 118.04 3ffz n GLN 387 Ca 0.17 -0.01 -0.47 0.00 -0.01 0.00 0.00 57.00 56.68 3ffz n GLN 387 Cb 0.08 -1.04 -0.05 0.00 1.02 0.00 0.00 30.24 30.25 3ffz n GLN 387 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 3ffz n ASN 388 N -1.63 3.29 -0.12 1.08 2.85 -1.03 -1.60 115.26 118.10 3ffz n ASN 388 Ca -0.01 0.71 -0.09 0.00 -0.11 0.00 0.00 54.58 55.08 3ffz n ASN 388 Cb 0.12 -1.41 -0.03 0.00 1.24 0.00 0.00 39.78 39.70 3ffz n ASN 388 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3ffz h ALA 389 N 11.19 -0.33 -0.26 5.20 0.00 -1.07 -2.17 119.26 131.81 3ffz h ALA 389 Ca -0.44 0.08 -0.14 0.00 0.00 0.00 0.00 54.91 54.41 3ffz h ALA 389 Cb 1.27 0.81 -0.00 0.00 0.00 0.00 0.00 17.79 19.87 3ffz h ALA 389 CO 0.96 -0.81 -0.39 -0.91 0.00 0.00 0.00 179.25 178.10 3ffz h ASN 390 N -0.30 0.80 0.80 0.00 2.35 -1.89 -3.25 115.58 114.09 3ffz h ASN 390 Ca 0.15 -0.51 0.00 0.00 -0.55 0.00 0.00 56.30 55.39 3ffz h ASN 390 Cb 0.57 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 38.71 3ffz h ASN 390 CO -0.55 1.16 0.00 0.18 -1.65 0.00 0.00 177.43 176.57 3ffz n LEU 391 N -4.19 0.00 -2.96 1.61 4.77 -1.14 -4.08 117.00 111.01 3ffz n LEU 391 Ca -0.05 0.42 -0.14 0.00 -0.03 0.00 0.00 56.01 56.21 3ffz n LEU 391 Cb 0.54 -0.42 0.02 0.00 -2.33 0.00 0.00 43.42 41.23 3ffz n LEU 391 CO 0.47 -0.02 -0.04 -3.20 -1.33 0.00 0.00 177.39 173.27 3ffz n ASN 392 N -1.42 0.10 -0.35 -1.43 5.15 -0.83 -5.01 115.26 111.48 3ffz n ASN 392 Ca 0.09 -3.06 -0.02 0.00 -0.60 0.00 0.00 54.58 50.99 3ffz n ASN 392 Cb 0.29 0.03 0.01 0.00 -0.53 0.00 0.00 39.78 39.58 3ffz n ASN 392 CO 0.00 0.00 0.00 -2.65 1.40 0.00 0.00 177.26 176.01 3ffz n PRO 393 N 0.17 -0.24 0.00 1.20 -0.02 -1.22 -3.15 135.00 131.74 3ffz n PRO 393 Ca 0.16 1.35 0.00 0.00 -2.02 0.00 0.00 63.50 63.00 3ffz n PRO 393 Cb 0.71 -2.01 0.00 0.00 -0.02 0.00 0.00 33.50 32.18 3ffz n PRO 393 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3ffz n ARG 394 N -5.26 0.00 0.25 -0.52 5.12 -1.26 0.38 116.66 115.37 3ffz n ARG 394 Ca 0.08 0.00 0.10 0.00 -1.93 0.00 0.00 57.85 56.10 3ffz n ARG 394 Cb 0.33 0.00 0.65 0.00 -1.16 0.00 0.00 32.46 32.28 3ffz n ARG 394 CO 0.00 0.00 0.00 -0.84 -1.93 0.00 0.00 177.63 174.86 3ffz h ILE 395 N 0.00 0.73 -2.41 0.55 3.07 -1.92 -3.44 117.51 114.08 3ffz h ILE 395 Ca 0.00 -0.62 -0.44 0.00 1.55 0.00 0.00 64.86 65.35 3ffz h ILE 395 Cb 0.00 1.38 0.04 0.00 -0.27 0.00 0.00 36.82 37.96 3ffz h ILE 395 CO 0.00 0.15 -0.09 -0.63 -1.05 0.00 0.00 178.15 176.53 3ffz s ILE 396 N -4.27 3.11 -0.30 0.16 1.01 0.16 -1.69 121.20 119.38 3ffz s ILE 396 Ca -0.03 -0.68 -0.20 0.00 0.00 0.00 0.00 60.65 59.75 3ffz s ILE 396 Cb 0.14 -3.14 0.20 0.00 0.01 0.00 0.00 42.46 39.66 3ffz s ILE 396 CO 0.62 -0.09 1.32 0.28 0.00 0.00 0.00 174.94 177.07 3ffz s THR 397 N -2.63 -0.01 1.21 2.92 -1.32 -0.96 -4.75 115.64 110.10 3ffz s THR 397 Ca 0.54 0.00 -0.15 0.00 -1.21 0.00 0.00 61.69 60.87 3ffz s THR 397 Cb -0.10 -1.00 0.27 0.00 -1.51 0.00 0.00 72.50 70.16 3ffz s THR 397 CO 0.37 0.00 0.80 -2.65 -2.21 0.00 0.00 174.62 170.93 3ffz n PRO 398 N 4.54 -2.62 -4.39 7.08 -0.02 -1.26 -2.30 135.00 136.02 3ffz n PRO 398 Ca -0.06 -0.74 -0.31 0.00 -2.02 0.00 0.00 63.50 60.36 3ffz n PRO 398 Cb 0.56 -2.04 -0.10 0.00 -0.02 0.00 0.00 33.50 31.89 3ffz n PRO 398 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3ffz s ILE 399 N -2.33 3.54 0.08 4.25 1.01 -1.26 -4.80 121.20 121.68 3ffz s ILE 399 Ca 0.66 -0.95 -0.22 0.00 0.00 0.00 0.00 60.65 60.14 3ffz s ILE 399 Cb -0.22 -2.58 -0.13 0.00 0.01 0.00 0.00 42.46 39.54 3ffz s ILE 399 CO 0.65 0.30 1.63 0.74 0.00 0.00 0.00 174.94 178.26 3ffz h THR 400 N 3.57 1.12 0.00 2.92 2.02 -2.06 -3.47 112.91 117.01 3ffz h THR 400 Ca -0.48 -0.36 0.00 0.00 0.77 0.00 0.00 66.41 66.34 3ffz h THR 400 Cb 1.17 1.20 0.00 0.00 -1.74 0.00 0.00 68.15 68.77 3ffz h THR 400 CO 0.53 0.11 0.00 0.61 0.37 0.00 0.00 175.52 177.14 3ffz n GLY 401 N -0.76 0.64 4.51 2.16 0.00 -1.26 -4.92 105.19 105.56 3ffz n GLY 401 Ca -0.06 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 44.89 3ffz n GLY 401 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3ffz n ARG 402 N 6.22 0.00 -0.16 1.61 3.00 -1.26 -4.40 116.66 121.67 3ffz n ARG 402 Ca 0.00 0.00 0.09 0.00 -0.00 0.00 0.00 57.85 57.94 3ffz n ARG 402 Cb 0.00 -2.35 0.17 0.00 0.00 0.00 0.00 32.46 30.28 3ffz n ARG 402 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3ffz n GLY 403 N -1.49 1.71 3.52 5.14 0.00 -1.26 -4.88 105.19 107.92 3ffz n GLY 403 Ca 0.00 -0.54 -0.43 0.00 0.00 0.00 0.00 46.02 45.05 3ffz n GLY 403 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3ffz s LEU 404 N -1.17 4.46 -0.12 0.99 2.96 -1.26 0.69 118.68 125.24 3ffz s LEU 404 Ca 0.29 -0.33 -0.00 0.00 -0.22 0.00 0.00 54.13 53.87 3ffz s LEU 404 Cb 0.17 -2.77 -0.02 0.00 0.50 0.00 0.00 46.19 44.07 3ffz s LEU 404 CO 0.23 -0.84 -0.10 -0.69 -1.32 0.00 0.00 176.35 173.63 3ffz s VAL 405 N 2.97 3.32 0.25 1.68 1.01 -0.19 -4.95 120.40 124.48 3ffz s VAL 405 Ca 0.24 -0.58 0.10 0.00 0.00 0.00 0.00 61.98 61.74 3ffz s VAL 405 Cb -0.14 -2.39 -0.04 0.00 0.00 0.00 0.00 36.38 33.80 3ffz s VAL 405 CO 0.19 0.54 -0.06 -0.54 0.00 0.00 0.00 175.10 175.23 3ffz s LYS 406 N 0.05 2.14 -0.26 2.72 1.02 -1.26 -0.01 119.74 124.14 3ffz s LYS 406 Ca -0.03 -1.44 -0.10 0.00 0.02 0.00 0.00 55.97 54.42 3ffz s LYS 406 Cb -0.14 -2.10 -0.04 0.00 -0.52 0.00 0.00 37.83 35.03 3ffz s LYS 406 CO 0.04 0.38 0.14 0.21 -0.92 0.00 0.00 175.35 175.20 3ffz s LYS 407 N -3.46 3.86 -0.04 1.68 2.20 -0.80 -4.27 119.74 118.91 3ffz s LYS 407 Ca 0.30 -0.37 0.03 0.00 -0.36 0.00 0.00 55.97 55.57 3ffz s LYS 407 Cb -0.07 -3.53 -0.03 0.00 -1.51 0.00 0.00 37.83 32.70 3ffz s LYS 407 CO 0.18 -0.15 -0.10 0.42 -0.36 0.00 0.00 175.35 175.34 3ffz s ILE 408 N 1.61 3.40 -0.06 5.43 1.01 -1.26 -0.97 121.20 130.37 3ffz s ILE 408 Ca 0.07 -0.69 0.06 0.00 0.00 0.00 0.00 60.65 60.09 3ffz s ILE 408 Cb -0.15 -2.40 -0.01 0.00 0.01 0.00 0.00 42.46 39.91 3ffz s ILE 408 CO 0.08 0.53 -0.25 -0.63 0.00 0.00 0.00 174.94 174.67 3ffz s ILE 409 N -0.84 2.09 -0.10 2.92 1.09 -0.42 -3.78 121.20 122.16 3ffz s ILE 409 Ca 0.13 -1.06 0.03 0.00 -1.10 0.00 0.00 60.65 58.65 3ffz s ILE 409 Cb -0.11 -1.75 -0.01 0.00 -1.06 0.00 0.00 42.46 39.53 3ffz s ILE 409 CO 0.03 0.57 -0.20 -0.60 -0.10 0.00 0.00 174.94 174.64 3ffz s ARG 410 N -0.19 3.09 -0.00 2.79 3.52 -0.94 -1.70 118.95 125.51 3ffz s ARG 410 Ca -0.03 -0.80 0.07 0.00 -0.13 0.00 0.00 55.73 54.84 3ffz s ARG 410 Cb -0.14 -2.41 -0.03 0.00 -1.56 0.00 0.00 34.95 30.82 3ffz s ARG 410 CO 0.03 0.24 -0.21 -0.06 -0.81 0.00 0.00 175.30 174.49 3ffz s PHE 411 N 0.23 2.48 0.03 5.12 0.40 -0.98 -0.55 117.98 124.71 3ffz s PHE 411 Ca -0.13 -0.32 0.03 0.00 -0.60 0.00 0.00 56.93 55.92 3ffz s PHE 411 Cb -0.16 -1.50 -0.02 0.00 0.51 0.00 0.00 43.02 41.84 3ffz s PHE 411 CO 0.07 0.12 -0.10 0.00 0.70 0.00 0.00 175.22 176.00 3ffz s LYS 413 N -1.03 0.46 0.22 0.00 2.47 -0.68 -0.73 119.74 120.45 3ffz s LYS 413 Ca -0.02 -0.83 0.11 0.00 -1.56 0.00 0.00 55.97 53.67 3ffz s LYS 413 Cb -0.07 0.17 -0.05 0.00 -1.46 0.00 0.00 37.83 36.42 3ffz s LYS 413 CO 0.01 -0.09 -0.18 -0.80 0.16 0.00 0.00 175.35 174.45 3ffz s ASN 414 N -2.06 3.74 0.00 1.43 0.01 -1.26 -1.25 114.94 115.54 3ffz s ASN 414 Ca -0.06 -0.84 0.00 0.00 -0.71 0.00 0.00 52.86 51.25 3ffz s ASN 414 Cb -0.02 -0.41 0.00 0.00 0.41 0.00 0.00 41.25 41.23 3ffz s ASN 414 CO -0.05 0.08 0.00 1.17 -1.51 0.00 0.00 177.10 176.80 3ffz n LYS 423 N -0.15 0.00 -4.06 -0.60 0.00 -1.26 -4.94 118.16 107.16 3ffz n LYS 423 Ca -0.09 0.00 -0.28 0.00 0.00 0.00 0.00 58.31 57.93 3ffz n LYS 423 Cb 0.57 -0.05 -0.17 0.00 0.00 0.00 0.00 35.03 35.39 3ffz n LYS 423 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 3ffz s SER 424 N -0.28 2.42 0.14 3.14 1.04 -1.26 -5.11 113.70 113.78 3ffz s SER 424 Ca 0.00 -0.40 -0.21 0.00 0.48 0.00 0.00 55.95 55.81 3ffz s SER 424 Cb 0.00 -1.02 -0.07 0.00 0.10 0.00 0.00 66.02 65.02 3ffz s SER 424 CO 0.00 -0.07 0.67 -0.63 0.98 0.00 0.00 173.24 174.20 3ffz s ILE 425 N 1.47 4.57 -0.16 -1.02 1.01 -0.38 -4.91 121.20 121.79 3ffz s ILE 425 Ca 0.03 1.40 -0.01 0.00 0.00 0.00 0.00 60.65 62.06 3ffz s ILE 425 Cb -0.13 -3.98 0.04 0.00 0.01 0.00 0.00 42.46 38.41 3ffz s ILE 425 CO -0.08 0.47 -0.02 0.00 0.00 0.00 0.00 174.94 175.31 3ffz s ILE 427 N 1.74 2.57 -0.01 0.00 -4.36 -0.71 -5.01 121.20 115.42 3ffz s ILE 427 Ca 0.01 -1.96 -0.00 0.00 -0.26 0.00 0.00 60.65 58.44 3ffz s ILE 427 Cb -0.15 -2.82 0.01 0.00 1.25 0.00 0.00 42.46 40.76 3ffz s ILE 427 CO -0.07 -0.18 0.03 -1.61 0.24 0.00 0.00 174.94 173.35 3ffz s GLU 428 N -3.73 -0.00 0.07 0.37 2.02 -1.26 -2.32 118.70 113.85 3ffz s GLU 428 Ca 0.35 0.10 0.04 0.00 0.02 0.00 0.00 54.97 55.49 3ffz s GLU 428 Cb 0.01 -0.10 -0.03 0.00 0.10 0.00 0.00 34.13 34.11 3ffz s GLU 428 CO 0.19 -0.08 -0.12 0.96 0.02 0.00 0.00 175.26 176.24 3ffz s ILE 429 N 0.48 0.96 0.41 -1.63 -0.00 -0.69 -4.98 121.20 115.74 3ffz s ILE 429 Ca -0.04 -1.32 -0.24 0.00 -0.00 0.00 0.00 60.65 59.05 3ffz s ILE 429 Cb -0.06 -1.02 -0.09 0.00 -0.00 0.00 0.00 42.46 41.29 3ffz s ILE 429 CO -0.01 -0.32 1.08 0.21 -0.00 0.00 0.00 174.94 175.89 3ffz s ASN 430 N -1.84 6.67 0.23 4.36 3.84 -1.26 -1.30 114.94 125.64 3ffz s ASN 430 Ca -0.02 2.10 -0.14 0.00 0.21 0.00 0.00 52.86 55.01 3ffz s ASN 430 Cb -0.09 -2.59 0.30 0.00 -0.55 0.00 0.00 41.25 38.32 3ffz s ASN 430 CO 0.01 -0.56 1.58 -1.13 -2.79 0.00 0.00 177.10 174.21 3ffz h ASN 431 N 2.47 -0.99 0.00 -4.21 -1.24 -1.33 0.03 115.58 110.30 3ffz h ASN 431 Ca -0.48 0.26 0.00 0.00 0.71 0.00 0.00 56.30 56.79 3ffz h ASN 431 Cb 1.22 0.58 0.00 0.00 0.73 0.00 0.00 38.32 40.85 3ffz h ASN 431 CO 0.62 -0.29 0.03 0.61 -1.29 0.00 0.00 177.43 177.11 3ffz n GLY 432 N -1.51 -0.59 0.02 1.57 0.00 -1.26 -2.00 105.19 101.41 3ffz n GLY 432 Ca 0.10 0.06 0.13 0.00 0.00 0.00 0.00 46.02 46.32 3ffz n GLY 432 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3ffz n GLU 433 N -1.72 0.09 -1.83 1.61 1.02 -0.00 -4.80 120.64 115.00 3ffz n GLU 433 Ca -0.00 -0.03 -0.30 0.00 -0.02 0.00 0.00 57.16 56.80 3ffz n GLU 433 Cb 0.04 -1.50 0.05 0.00 -0.02 0.00 0.00 31.44 30.01 3ffz n GLU 433 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3ffz s LEU 434 N -2.94 2.91 0.68 -4.62 1.43 -0.85 -5.04 118.68 110.25 3ffz s LEU 434 Ca 0.14 1.21 -0.14 0.00 -1.03 0.00 0.00 54.13 54.31 3ffz s LEU 434 Cb 0.18 -4.01 0.01 0.00 0.03 0.00 0.00 46.19 42.40 3ffz s LEU 434 CO 0.60 -1.37 1.09 -0.36 0.23 0.00 0.00 176.35 176.54 3ffz s PHE 435 N -3.30 2.74 -0.20 0.29 0.40 -0.93 -4.42 117.98 112.56 3ffz s PHE 435 Ca 0.58 1.53 -0.04 0.00 -0.60 0.00 0.00 56.93 58.40 3ffz s PHE 435 Cb -0.12 -3.08 -0.02 0.00 0.51 0.00 0.00 43.02 40.32 3ffz s PHE 435 CO 0.52 -1.55 -0.02 0.12 0.70 0.00 0.00 175.22 174.99 3ffz s PHE 436 N -2.56 3.00 -0.20 0.36 5.36 -1.26 0.31 117.98 122.98 3ffz s PHE 436 Ca 0.64 -0.58 -0.06 0.00 -0.96 0.00 0.00 56.93 55.97 3ffz s PHE 436 Cb -0.18 -2.06 0.10 0.00 -0.34 0.00 0.00 43.02 40.53 3ffz s PHE 436 CO 0.45 -0.30 0.40 0.08 -1.46 0.00 0.00 175.22 174.39 3ffz s VAL 437 N 1.03 -0.62 0.39 3.12 1.01 -1.26 -4.49 120.40 119.59 3ffz s VAL 437 Ca 0.01 0.13 -0.26 0.00 0.00 0.00 0.00 61.98 61.86 3ffz s VAL 437 Cb -0.14 -0.68 -0.09 0.00 0.00 0.00 0.00 36.38 35.47 3ffz s VAL 437 CO 0.01 0.03 1.22 0.00 0.00 0.00 0.00 175.10 176.36 3ffz s ALA 438 N 2.58 3.21 0.56 5.51 0.00 -0.75 -0.06 121.76 132.81 3ffz s ALA 438 Ca 0.02 1.06 -0.18 0.00 0.00 0.00 0.00 51.96 52.86 3ffz s ALA 438 Cb -0.13 -3.42 -0.05 0.00 0.00 0.00 0.00 23.12 19.52 3ffz s ALA 438 CO -0.13 -0.62 1.09 -1.54 0.00 0.00 0.00 175.76 174.56 3ffz s SER 439 N -0.97 5.79 0.31 0.00 1.04 0.22 -4.39 113.70 115.70 3ffz s SER 439 Ca 0.56 2.00 0.02 0.00 0.48 0.00 0.00 55.95 59.01 3ffz s SER 439 Cb -0.34 -2.56 0.51 0.00 0.10 0.00 0.00 66.02 63.73 3ffz s SER 439 CO 0.43 -1.16 1.85 -0.08 0.98 0.00 0.00 173.24 175.25 3ffz h GLU 440 N 0.92 0.66 0.00 4.02 4.57 -1.94 -0.35 114.58 122.46 3ffz h GLU 440 Ca -0.49 -0.14 0.00 0.00 -1.18 0.00 0.00 59.36 57.55 3ffz h GLU 440 Cb 1.24 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 29.73 3ffz h GLU 440 CO 0.57 0.64 0.00 0.27 -1.18 0.00 0.00 179.01 179.31 3ffz n ASN 441 N -4.27 0.00 -0.10 1.04 6.94 -1.26 -2.28 115.26 115.32 3ffz n ASN 441 Ca 0.02 -1.15 0.15 0.00 -0.02 0.00 0.00 54.58 53.58 3ffz n ASN 441 Cb 0.24 0.00 0.73 0.00 -2.36 0.00 0.00 39.78 38.39 3ffz n ASN 441 CO 0.00 0.00 0.00 -0.24 -1.03 0.00 0.00 177.26 175.99 3ffz n SER 442 N -0.66 0.36 -3.99 0.53 2.88 -0.14 -4.76 113.62 107.84 3ffz n SER 442 Ca 0.05 -0.72 -0.18 0.00 -1.33 0.00 0.00 58.87 56.70 3ffz n SER 442 Cb 0.02 -0.08 -0.15 0.00 -0.75 0.00 0.00 64.21 63.25 3ffz n SER 442 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 3ffz s TYR 443 N -2.30 0.71 0.53 0.66 1.51 -0.97 -4.79 117.35 112.70 3ffz s TYR 443 Ca 0.35 -0.14 0.08 0.00 -1.01 0.00 0.00 57.07 56.35 3ffz s TYR 443 Cb 0.21 -0.48 0.06 0.00 -0.11 0.00 0.00 41.96 41.64 3ffz s TYR 443 CO 0.43 -0.04 0.73 1.21 -1.11 0.00 0.00 175.55 176.77 3ffz s ASN 444 N -0.04 5.24 -0.87 2.29 2.47 -1.26 -5.03 114.94 117.74 3ffz s ASN 444 Ca 0.01 -0.66 0.01 0.00 0.42 0.00 0.00 52.86 52.64 3ffz s ASN 444 Cb -0.05 -0.06 0.28 0.00 -1.45 0.00 0.00 41.25 39.97 3ffz s ASN 444 CO -0.00 -1.18 1.10 0.47 -3.72 0.00 0.00 177.10 173.76 3ffz n ASP 445 N -2.16 5.07 -3.59 -4.21 9.92 -1.26 -4.88 116.55 115.44 3ffz n ASP 445 Ca 0.13 -3.41 -0.41 0.00 -0.53 0.00 0.00 54.79 50.58 3ffz n ASP 445 Cb 0.61 -0.99 -0.00 0.00 -0.64 0.00 0.00 41.12 40.10 3ffz n ASP 445 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 3ffz n ASP 446 N 1.19 7.21 0.11 -2.24 8.00 -1.26 -3.88 116.55 125.68 3ffz n ASP 446 Ca 0.27 -3.13 0.00 0.00 0.71 0.00 0.00 54.79 52.64 3ffz n ASP 446 Cb 0.37 -1.39 0.00 0.00 -0.02 0.00 0.00 41.12 40.07 3ffz n ASP 446 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3ffz n ASN 447 N 2.34 0.35 -1.67 -2.24 4.13 -1.26 -4.77 115.26 112.14 3ffz n ASN 447 Ca 0.56 0.35 -0.00 0.00 1.68 0.00 0.00 54.58 57.16 3ffz n ASN 447 Cb 0.28 0.11 -0.01 0.00 -1.54 0.00 0.00 39.78 38.62 3ffz n ASN 447 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3ffz n ILE 448 N -3.49 1.46 -3.69 2.41 3.06 -1.25 -4.76 119.36 113.09 3ffz n ILE 448 Ca 0.00 -0.39 -0.36 0.00 -2.50 0.00 0.00 62.75 59.49 3ffz n ILE 448 Cb 0.00 -1.38 -0.07 0.00 0.54 0.00 0.00 39.64 38.73 3ffz n ILE 448 CO 0.00 0.00 0.00 0.21 -2.50 0.00 0.00 176.55 174.26 3ffz s ASN 449 N 2.02 6.40 -0.05 9.51 3.84 -1.26 -4.85 114.94 130.54 3ffz s ASN 449 Ca 0.03 0.47 0.01 0.00 0.21 0.00 0.00 52.86 53.58 3ffz s ASN 449 Cb 0.01 -2.13 -0.03 0.00 -0.55 0.00 0.00 41.25 38.55 3ffz s ASN 449 CO 0.00 0.24 -0.07 0.42 -2.79 0.00 0.00 177.10 174.91 3ffz s THR 450 N -0.20 3.68 0.06 -5.21 -4.23 -1.26 -5.01 115.64 103.47 3ffz s THR 450 Ca 0.14 -0.56 0.02 0.00 -1.18 0.00 0.00 61.69 60.12 3ffz s THR 450 Cb -0.13 -2.53 -0.04 0.00 1.34 0.00 0.00 72.50 71.15 3ffz s THR 450 CO 0.03 0.55 0.08 -2.84 -0.54 0.00 0.00 174.62 171.90 3ffz s PRO 451 N -0.97 2.92 0.00 3.99 0.02 -1.26 -5.07 135.00 134.64 3ffz s PRO 451 Ca 0.14 -0.65 -0.17 0.00 0.02 0.00 0.00 61.00 60.34 3ffz s PRO 451 Cb -0.11 -2.75 -0.06 0.00 0.02 0.00 0.00 34.50 31.60 3ffz s PRO 451 CO 0.03 0.58 0.47 -1.59 -0.33 0.00 0.00 177.00 176.16 3ffz s LYS 452 N -2.28 4.08 0.00 5.54 0.00 -1.26 -2.86 119.74 122.97 3ffz s LYS 452 Ca 0.28 0.52 0.00 0.00 0.00 0.00 0.00 55.97 56.77 3ffz s LYS 452 Cb -0.12 -3.27 0.00 0.00 0.00 0.00 0.00 37.83 34.44 3ffz s LYS 452 CO 0.21 0.57 0.00 -1.91 0.00 0.00 0.00 175.35 174.22 3ffz n GLU 453 N 2.14 3.78 -0.56 1.78 4.07 0.40 -4.95 120.64 127.31 3ffz n GLU 453 Ca -0.12 0.00 -0.19 0.00 -0.06 0.00 0.00 57.16 56.80 3ffz n GLU 453 Cb 0.52 0.00 -0.01 0.00 -0.06 0.00 0.00 31.44 31.89 3ffz n GLU 453 CO 0.00 0.00 0.00 1.51 -0.06 0.00 0.00 177.13 178.58 3ffz n ILE 454 N 0.00 0.69 0.00 6.31 3.06 -1.26 -4.74 119.36 123.41 3ffz n ILE 454 Ca 0.00 -0.20 0.00 0.00 -2.50 0.00 0.00 62.75 60.05 3ffz n ILE 454 Cb 0.00 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.18 3ffz n ILE 454 CO 0.00 0.00 0.00 0.47 -2.50 0.00 0.00 176.55 174.52 3ffz n ASP 455 N 0.84 0.00 -0.94 9.51 9.92 -1.26 -4.71 116.55 129.91 3ffz n ASP 455 Ca 0.07 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.33 3ffz n ASP 455 Cb 0.12 0.08 0.00 0.00 -0.64 0.00 0.00 41.12 40.67 3ffz n ASP 455 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 3ffz n ASP 456 N -1.85 -2.58 -3.85 -2.24 8.00 -1.26 -5.15 116.55 107.62 3ffz n ASP 456 Ca 0.00 0.13 -0.07 0.00 0.71 0.00 0.00 54.79 55.56 3ffz n ASP 456 Cb 0.00 -1.33 -0.02 0.00 -0.02 0.00 0.00 41.12 39.75 3ffz n ASP 456 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 3ffz s THR 457 N -0.05 0.00 -1.06 -3.53 -4.23 -1.26 -5.08 115.64 100.44 3ffz s THR 457 Ca 0.00 -0.97 -0.22 0.00 -1.18 0.00 0.00 61.69 59.31 3ffz s THR 457 Cb 0.00 -1.96 0.04 0.00 1.34 0.00 0.00 72.50 71.92 3ffz s THR 457 CO 0.00 -0.00 1.57 -0.69 -0.54 0.00 0.00 174.62 174.96 3ffz s VAL 458 N -3.92 3.89 0.00 2.29 1.01 -1.26 -4.87 120.40 117.54 3ffz s VAL 458 Ca 0.11 -0.91 -0.00 0.00 0.00 0.00 0.00 61.98 61.18 3ffz s VAL 458 Cb -0.05 -4.95 -0.02 0.00 0.00 0.00 0.00 36.38 31.36 3ffz s VAL 458 CO 0.06 -1.81 1.29 0.41 0.00 0.00 0.00 175.10 175.05 3ffz n THR 459 N 6.95 1.20 -1.86 3.92 -1.04 -1.26 -5.19 114.28 117.01 3ffz n THR 459 Ca 0.37 -0.36 0.02 0.00 -2.04 0.00 0.00 64.05 62.03 3ffz n THR 459 Cb 0.50 -1.35 -0.00 0.00 -1.82 0.00 0.00 70.33 67.65 3ffz n THR 459 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 3ffz n SER 460 N 1.87 -2.85 0.00 8.00 2.88 -1.26 -4.86 113.62 117.40 3ffz n SER 460 Ca 0.04 0.14 0.00 0.00 -1.33 0.00 0.00 58.87 57.72 3ffz n SER 460 Cb 0.32 -0.45 0.00 0.00 -0.75 0.00 0.00 64.21 63.32 3ffz n SER 460 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 3ffz n ASN 466 N -3.74 0.00 -1.85 -3.46 2.04 -1.26 -3.44 115.26 103.55 3ffz n ASN 466 Ca 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 54.58 54.14 3ffz n ASN 466 Cb 0.06 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.31 3ffz n ASN 466 CO 0.00 0.00 0.00 -0.90 -0.44 0.00 0.00 177.26 175.92 3ffz n ASP 467 N 0.00 -3.12 -0.09 0.53 5.68 -1.26 -4.86 116.55 113.44 3ffz n ASP 467 Ca 0.00 0.69 -0.07 0.00 -0.50 0.00 0.00 54.79 54.90 3ffz n ASP 467 Cb 0.00 -1.07 0.10 0.00 -1.14 0.00 0.00 41.12 39.00 3ffz n ASP 467 CO 0.00 0.00 0.00 0.25 -1.33 0.00 0.00 177.20 176.12 3ffz h LEU 468 N 3.97 0.78 -0.90 -2.12 5.85 -1.95 -3.10 115.31 117.85 3ffz h LEU 468 Ca 0.00 -0.27 0.16 0.00 0.84 0.00 0.00 57.88 58.60 3ffz h LEU 468 Cb 0.00 -0.21 -0.16 0.00 0.37 0.00 0.00 40.66 40.66 3ffz h LEU 468 CO 0.00 0.97 -0.29 0.47 -0.34 0.00 0.00 178.44 179.25 3ffz n ASP 469 N -4.12 -0.46 -0.18 1.25 8.00 -1.26 -0.42 116.55 119.36 3ffz n ASP 469 Ca 0.00 1.55 -0.00 0.00 0.71 0.00 0.00 54.79 57.05 3ffz n ASP 469 Cb 0.42 -0.41 0.08 0.00 -0.02 0.00 0.00 41.12 41.20 3ffz n ASP 469 CO 0.00 0.00 0.00 -0.61 -0.39 0.00 0.00 177.20 176.20 3ffz h GLN 470 N 0.00 0.12 -0.57 -1.24 5.75 -1.87 -1.32 115.11 115.99 3ffz h GLN 470 Ca 0.37 -0.01 -0.08 0.00 -0.15 0.00 0.00 58.65 58.78 3ffz h GLN 470 Cb 0.59 -0.03 -0.02 0.00 1.07 0.00 0.00 27.48 29.09 3ffz h GLN 470 CO -0.90 0.08 0.03 -0.39 -2.65 0.00 0.00 178.83 175.00 3ffz h VAL 471 N 0.13 1.26 -0.45 2.39 -1.51 -0.89 -2.97 116.25 114.21 3ffz h VAL 471 Ca 0.29 -1.08 0.05 0.00 -1.23 0.00 0.00 66.70 64.73 3ffz h VAL 471 Cb 0.46 0.84 -0.05 0.00 -2.13 0.00 0.00 31.29 30.41 3ffz h VAL 471 CO -0.47 0.39 0.18 0.40 -1.23 0.00 0.00 177.57 176.84 3ffz h ILE 472 N 0.87 0.89 0.00 7.19 2.04 -0.87 -2.13 117.51 125.50 3ffz h ILE 472 Ca 0.16 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 65.90 3ffz h ILE 472 Cb 0.50 0.49 0.00 0.00 -0.74 0.00 0.00 36.82 37.07 3ffz h ILE 472 CO 0.02 0.07 0.00 -0.11 0.00 0.00 0.00 178.15 178.13 3ffz n LEU 473 N -4.97 0.23 -2.93 1.44 7.94 -0.56 -3.40 117.00 114.75 3ffz n LEU 473 Ca 0.04 -0.12 -0.14 0.00 -1.11 0.00 0.00 56.01 54.68 3ffz n LEU 473 Cb 0.16 -0.06 0.01 0.00 0.53 0.00 0.00 43.42 44.05 3ffz n LEU 473 CO 0.27 0.04 0.02 0.59 -1.11 0.00 0.00 177.39 177.20 3ffz n ASN 474 N 0.66 -1.56 -0.38 1.96 4.13 -0.80 -4.83 115.26 114.43 3ffz n ASN 474 Ca 0.00 -3.13 -0.07 0.00 1.68 0.00 0.00 54.58 53.06 3ffz n ASN 474 Cb 0.04 0.85 -0.04 0.00 -1.54 0.00 0.00 39.78 39.10 3ffz n ASN 474 CO 0.00 0.00 0.00 -0.26 0.28 0.00 0.00 177.26 177.28 3ffz h PHE 475 N 3.82 -1.53 -2.78 3.10 -1.00 -1.78 -3.21 116.94 113.57 3ffz h PHE 475 Ca -0.05 0.12 -0.62 0.00 2.81 0.00 0.00 57.97 60.22 3ffz h PHE 475 Cb 0.98 0.80 -0.41 0.00 3.61 0.00 0.00 35.95 40.93 3ffz h PHE 475 CO 0.20 -0.39 -0.51 -1.71 -1.61 0.00 0.00 178.31 174.29 3ffz n ASN 476 N -5.35 3.48 0.00 2.17 2.85 -1.26 -4.57 115.26 112.57 3ffz n ASN 476 Ca 0.05 -3.30 0.00 0.00 -0.11 0.00 0.00 54.58 51.22 3ffz n ASN 476 Cb 0.32 -0.76 0.00 0.00 1.24 0.00 0.00 39.78 40.58 3ffz n ASN 476 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 3ffz n SER 477 N 1.56 0.64 -4.13 1.20 3.41 -1.21 -4.70 113.62 110.39 3ffz n SER 477 Ca 0.24 -0.85 -0.38 0.00 -0.26 0.00 0.00 58.87 57.63 3ffz n SER 477 Cb 0.37 0.25 -0.07 0.00 -0.26 0.00 0.00 64.21 64.50 3ffz n SER 477 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 3ffz s GLU 478 N -0.25 2.99 0.00 4.33 1.03 -1.26 -5.00 118.70 120.55 3ffz s GLU 478 Ca 0.00 -2.82 0.00 0.00 0.03 0.00 0.00 54.97 52.18 3ffz s GLU 478 Cb 0.00 -3.92 0.00 0.00 -0.80 0.00 0.00 34.13 29.41 3ffz s GLU 478 CO 0.00 -1.22 0.00 0.43 -1.33 0.00 0.00 175.26 173.14 3ffz n SER 479 N 3.09 0.00 -0.34 0.83 7.64 -1.26 -4.91 113.62 118.67 3ffz n SER 479 Ca 0.14 0.01 0.13 0.00 1.01 0.00 0.00 58.87 60.16 3ffz n SER 479 Cb 0.39 -0.01 0.36 0.00 -1.01 0.00 0.00 64.21 63.93 3ffz n SER 479 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3ffz n ALA 480 N 1.42 3.01 0.30 -0.43 0.00 -1.26 -4.58 120.51 118.97 3ffz n ALA 480 Ca 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 53.44 52.99 3ffz n ALA 480 Cb 0.00 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 18.36 3ffz n ALA 480 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3ffz n PRO 481 N -0.36 0.30 0.00 0.00 -0.02 -1.26 -4.79 135.00 128.87 3ffz n PRO 481 Ca 0.13 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.61 3ffz n PRO 481 Cb 0.37 -1.27 0.00 0.00 -0.02 0.00 0.00 33.50 32.58 3ffz n PRO 481 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ffz n GLY 482 N 0.65 1.77 7.00 -1.23 0.00 -1.26 -4.90 105.19 107.23 3ffz n GLY 482 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3ffz n GLY 482 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3ffz n LEU 483 N 0.00 0.00 0.00 0.99 -0.00 -1.26 -4.96 117.00 111.77 3ffz n LEU 483 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 3ffz n LEU 483 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 3ffz n LEU 483 CO 0.00 0.00 0.00 -1.20 -0.00 0.00 0.00 177.39 176.19 3ffz n SER 484 N 7.97 0.00 0.00 1.96 7.64 -1.26 -5.00 113.62 124.94 3ffz n SER 484 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 3ffz n SER 484 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 3ffz n SER 484 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 3ffz n ASP 485 N 0.00 0.00 -4.17 6.43 2.03 -1.26 -4.63 116.55 114.95 3ffz n ASP 485 Ca 0.00 0.00 -0.35 0.00 0.52 0.00 0.00 54.79 54.96 3ffz n ASP 485 Cb 0.00 0.00 0.09 0.00 -0.72 0.00 0.00 41.12 40.49 3ffz n ASP 485 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 3ffz n GLU 486 N 0.00 -0.51 -3.64 -0.67 -0.58 -1.26 -4.45 120.64 109.53 3ffz n GLU 486 Ca 0.00 -0.13 -0.08 0.00 -0.42 0.00 0.00 57.16 56.53 3ffz n GLU 486 Cb 0.00 -1.39 -0.07 0.00 -0.57 0.00 0.00 31.44 29.41 3ffz n GLU 486 CO 0.00 0.00 0.00 -1.59 -0.48 0.00 0.00 177.13 175.06 3ffz s LYS 487 N -2.77 0.68 0.00 3.49 0.00 -1.26 -1.79 119.74 118.09 3ffz s LYS 487 Ca 0.47 1.05 0.00 0.00 0.00 0.00 0.00 55.97 57.49 3ffz s LYS 487 Cb -0.09 0.20 0.00 0.00 0.00 0.00 0.00 37.83 37.93 3ffz s LYS 487 CO 0.70 -0.12 0.00 1.28 0.00 0.00 0.00 175.35 177.21 3ffz n LEU 488 N 3.72 0.00 -4.76 2.77 4.77 -1.10 -4.97 117.00 117.43 3ffz n LEU 488 Ca -0.18 0.00 -0.39 0.00 -0.03 0.00 0.00 56.01 55.41 3ffz n LEU 488 Cb 0.58 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.68 3ffz n LEU 488 CO 0.00 0.00 0.96 0.54 -1.33 0.00 0.00 177.39 177.56 3ffz s ASN 489 N 1.43 5.91 1.01 -1.43 2.20 -1.26 -3.09 114.94 119.70 3ffz s ASN 489 Ca 0.00 2.65 -0.15 0.00 -0.94 0.00 0.00 52.86 54.42 3ffz s ASN 489 Cb 0.00 -2.63 0.13 0.00 -2.00 0.00 0.00 41.25 36.74 3ffz s ASN 489 CO 0.00 -1.12 0.11 0.18 -2.94 0.00 0.00 177.10 173.33 3ffz n LEU 490 N -0.39 -1.68 0.00 3.54 4.77 -1.26 -4.61 117.00 117.38 3ffz n LEU 490 Ca 0.07 -0.30 0.00 0.00 -0.03 0.00 0.00 56.01 55.75 3ffz n LEU 490 Cb 0.45 -0.77 0.00 0.00 -2.33 0.00 0.00 43.42 40.77 3ffz n LEU 490 CO 0.54 -3.11 0.00 0.35 -1.33 0.00 0.00 177.39 173.84 3ffz n THR 491 N -4.28 0.00 -1.12 -5.08 -2.24 -1.26 -4.97 114.28 95.32 3ffz n THR 491 Ca 0.04 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.82 3ffz n THR 491 Cb 0.41 -1.38 0.00 0.00 -2.10 0.00 0.00 70.33 67.26 3ffz n THR 491 CO 0.00 0.00 0.00 2.30 -0.57 0.00 0.00 175.07 176.80 3ffz n ILE 492 N -0.84 0.00 -4.42 2.28 -6.64 -1.26 -5.12 119.36 103.35 3ffz n ILE 492 Ca 0.00 0.00 -0.22 0.00 -1.77 0.00 0.00 62.75 60.76 3ffz n ILE 492 Cb 0.00 1.14 -0.10 0.00 -1.44 0.00 0.00 39.64 39.23 3ffz n ILE 492 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 3ffz s GLN 493 N 0.00 1.53 -0.38 6.28 1.03 -1.26 -5.09 119.66 121.78 3ffz s GLN 493 Ca 0.00 -1.70 0.12 0.00 0.04 0.00 0.00 55.36 53.82 3ffz s GLN 493 Cb 0.00 -1.46 0.37 0.00 0.03 0.00 0.00 33.01 31.96 3ffz s GLN 493 CO 0.00 0.24 0.89 0.09 -2.54 0.00 0.00 175.29 173.97 3ffz n ASN 494 N -0.53 0.23 -4.76 12.60 3.02 -1.26 -4.83 115.26 119.73 3ffz n ASN 494 Ca -0.06 -3.02 -0.38 0.00 -0.03 0.00 0.00 54.58 51.09 3ffz n ASN 494 Cb 0.61 -0.05 -0.06 0.00 -0.61 0.00 0.00 39.78 39.67 3ffz n ASN 494 CO 0.00 0.00 0.00 1.51 -2.62 0.00 0.00 177.26 176.15 3ffz s ASP 495 N -2.30 6.84 0.00 6.41 1.47 -1.26 -5.02 116.67 122.82 3ffz s ASP 495 Ca 0.33 1.00 0.00 0.00 1.18 0.00 0.00 52.55 55.06 3ffz s ASP 495 Cb 0.37 -2.32 0.00 0.00 -0.34 0.00 0.00 42.92 40.63 3ffz s ASP 495 CO -0.05 0.10 0.00 0.00 0.68 0.00 0.00 175.17 175.90 3ffz n ALA 496 N 2.93 0.00 0.00 2.11 0.00 -1.26 -4.06 120.51 120.23 3ffz n ALA 496 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.36 3ffz n ALA 496 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.96 3ffz n ALA 496 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 3ffz n TYR 497 N 0.00 0.00 -3.87 0.00 9.36 -0.89 -1.86 117.16 119.89 3ffz n TYR 497 Ca 0.00 0.00 -0.32 0.00 3.32 0.00 0.00 57.90 60.90 3ffz n TYR 497 Cb 0.00 0.00 -0.06 0.00 -0.63 0.00 0.00 39.34 38.65 3ffz n TYR 497 CO 0.00 0.00 0.00 1.51 0.22 0.00 0.00 176.86 178.59 3ffz n ILE 498 N 0.00 0.00 -2.58 2.97 0.13 -1.26 -4.93 119.36 113.69 3ffz n ILE 498 Ca 0.00 0.00 -0.22 0.00 -1.10 0.00 0.00 62.75 61.43 3ffz n ILE 498 Cb 0.00 -0.37 0.12 0.00 -0.84 0.00 0.00 39.64 38.54 3ffz n ILE 498 CO 0.00 0.00 0.00 -0.81 2.80 0.00 0.00 176.55 178.54 3ffz n PRO 499 N -3.36 -0.10 -1.74 9.51 -0.05 -1.26 -4.84 135.00 133.16 3ffz n PRO 499 Ca 0.09 -2.57 -0.01 0.00 -0.05 0.00 0.00 63.50 60.96 3ffz n PRO 499 Cb 0.39 -0.65 0.00 0.00 -0.05 0.00 0.00 33.50 33.19 3ffz n PRO 499 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 175.50 177.08 3ffz n LYS 500 N -2.78 -0.51 -1.63 0.54 4.76 -1.23 -4.97 118.16 112.33 3ffz n LYS 500 Ca 0.16 0.84 -0.40 0.00 -2.87 0.00 0.00 58.31 56.04 3ffz n LYS 500 Cb 0.56 -2.09 0.03 0.00 -1.84 0.00 0.00 35.03 31.69 3ffz n LYS 500 CO 0.00 0.00 0.00 0.98 -1.37 0.00 0.00 177.40 177.01 3ffz n TYR 501 N -0.24 1.24 -3.09 2.13 9.36 0.16 -4.84 117.16 121.87 3ffz n TYR 501 Ca 0.01 0.49 -0.45 0.00 3.32 0.00 0.00 57.90 61.28 3ffz n TYR 501 Cb 0.05 -2.22 -0.02 0.00 -0.63 0.00 0.00 39.34 36.52 3ffz n TYR 501 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 3ffz s ASP 502 N -0.91 6.81 0.17 2.98 3.68 -1.26 -4.99 116.67 123.15 3ffz s ASP 502 Ca 0.68 -2.54 -0.33 0.00 2.13 0.00 0.00 52.55 52.49 3ffz s ASP 502 Cb -0.49 -2.33 -0.13 0.00 -1.45 0.00 0.00 42.92 38.53 3ffz s ASP 502 CO 0.53 -0.79 1.65 -1.20 0.13 0.00 0.00 175.17 175.48 3ffz n SER 503 N 5.27 3.45 -1.30 -0.34 7.64 -1.26 -4.87 113.62 122.21 3ffz n SER 503 Ca 0.23 1.07 0.11 0.00 1.01 0.00 0.00 58.87 61.29 3ffz n SER 503 Cb 0.47 -1.48 0.31 0.00 -1.01 0.00 0.00 64.21 62.49 3ffz n SER 503 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 3ffz n ASN 504 N 3.81 3.93 -4.76 6.43 5.15 -1.26 -4.97 115.26 123.58 3ffz n ASN 504 Ca 0.17 -2.04 -0.39 0.00 -0.60 0.00 0.00 54.58 51.71 3ffz n ASN 504 Cb 0.31 -0.47 -0.04 0.00 -0.53 0.00 0.00 39.78 39.05 3ffz n ASN 504 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 3ffz s GLY 505 N -1.00 3.00 0.22 8.20 0.00 -1.26 0.39 107.32 116.87 3ffz s GLY 505 Ca 0.47 0.84 0.05 0.00 0.00 0.00 0.00 44.72 46.08 3ffz s GLY 505 CO 0.31 1.41 0.19 2.41 0.00 0.00 0.00 173.10 177.41 3ffz n THR 506 N 0.92 0.00 0.00 0.90 -1.04 -0.86 -4.69 114.28 109.51 3ffz n THR 506 Ca 0.00 -1.63 0.00 0.00 -2.04 0.00 0.00 64.05 60.38 3ffz n THR 506 Cb 0.46 0.81 0.00 0.00 -1.82 0.00 0.00 70.33 69.77 3ffz n THR 506 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 3ffz n SER 507 N -2.10 0.00 -4.40 8.00 3.41 -1.26 -2.88 113.62 114.39 3ffz n SER 507 Ca 0.05 0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 58.23 3ffz n SER 507 Cb 0.40 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.26 3ffz n SER 507 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 3ffz s ASP 508 N -0.05 5.98 0.53 4.04 -4.77 -1.26 -4.84 116.67 116.30 3ffz s ASP 508 Ca 0.00 -1.12 -0.22 0.00 -3.30 0.00 0.00 52.55 47.92 3ffz s ASP 508 Cb 0.00 -2.12 -0.05 0.00 -1.09 0.00 0.00 42.92 39.66 3ffz s ASP 508 CO 0.00 -0.50 1.28 -0.63 0.70 0.00 0.00 175.17 176.01 3ffz s ILE 509 N 1.61 2.45 0.36 2.11 1.01 -1.26 -4.97 121.20 122.51 3ffz s ILE 509 Ca 0.04 0.33 -0.26 0.00 0.00 0.00 0.00 60.65 60.76 3ffz s ILE 509 Cb -0.21 -3.16 -0.09 0.00 0.01 0.00 0.00 42.46 39.01 3ffz s ILE 509 CO 0.07 -0.01 1.04 -0.70 0.00 0.00 0.00 174.94 175.34 3ffz s GLU 510 N -2.92 4.36 -0.18 2.79 2.12 -1.25 -5.00 118.70 118.61 3ffz s GLU 510 Ca 0.70 1.54 -0.14 0.00 0.36 0.00 0.00 54.97 57.44 3ffz s GLU 510 Cb -0.35 -2.75 0.05 0.00 0.26 0.00 0.00 34.13 31.34 3ffz s GLU 510 CO 0.42 0.03 0.47 -1.14 -0.54 0.00 0.00 175.26 174.50 3ffz s GLN 511 N -2.15 0.52 0.02 4.30 0.74 -1.26 -2.21 119.66 119.62 3ffz s GLN 511 Ca 0.53 0.75 0.05 0.00 0.05 0.00 0.00 55.36 56.74 3ffz s GLN 511 Cb -0.24 0.17 -0.02 0.00 1.10 0.00 0.00 33.01 34.02 3ffz s GLN 511 CO 0.30 -0.10 -0.14 -1.01 -0.55 0.00 0.00 175.29 173.79 3ffz s HIS 512 N 0.74 1.20 -0.15 1.67 3.76 0.29 -4.98 115.29 117.81 3ffz s HIS 512 Ca -0.04 -0.31 -0.07 0.00 -0.15 0.00 0.00 55.06 54.50 3ffz s HIS 512 Cb -0.05 -0.73 -0.04 0.00 1.11 0.00 0.00 32.58 32.87 3ffz s HIS 512 CO -0.05 0.02 0.09 -0.51 -0.85 0.00 0.00 174.74 173.43 3ffz s ASP 513 N -0.86 5.88 -0.00 1.40 1.01 -1.26 -0.78 116.67 122.06 3ffz s ASP 513 Ca 0.03 0.24 0.05 0.00 0.71 0.00 0.00 52.55 53.57 3ffz s ASP 513 Cb -0.07 -1.93 -0.01 0.00 1.01 0.00 0.00 42.92 41.92 3ffz s ASP 513 CO 0.01 0.28 -0.16 0.68 0.21 0.00 0.00 175.17 176.19 3ffz s VAL 514 N -0.29 1.30 -0.21 -1.27 -7.23 0.09 -4.92 120.40 107.86 3ffz s VAL 514 Ca 0.09 -0.77 0.18 0.00 -1.81 0.00 0.00 61.98 59.67 3ffz s VAL 514 Cb -0.12 -1.10 0.07 0.00 0.56 0.00 0.00 36.38 35.79 3ffz s VAL 514 CO 0.01 0.31 1.30 0.78 -0.31 0.00 0.00 175.10 177.20 3ffz h ASN 515 N 5.57 0.00 -3.72 4.85 2.35 -1.99 -3.41 115.58 119.24 3ffz h ASN 515 Ca -0.37 0.00 -0.53 0.00 -0.55 0.00 0.00 56.30 54.86 3ffz h ASN 515 Cb 1.16 0.00 -0.19 0.00 0.05 0.00 0.00 38.32 39.34 3ffz h ASN 515 CO 0.48 0.36 -0.79 -1.61 -1.65 0.00 0.00 177.43 174.22 3ffz s GLU 516 N -3.05 1.23 0.79 0.81 0.41 -1.26 -4.97 118.70 112.66 3ffz s GLU 516 Ca 0.03 -1.34 -0.12 0.00 -0.41 0.00 0.00 54.97 53.13 3ffz s GLU 516 Cb 0.08 -1.33 0.07 0.00 -1.78 0.00 0.00 34.13 31.17 3ffz s GLU 516 CO 0.75 0.28 1.12 -0.51 -0.49 0.00 0.00 175.26 176.41 3ffz s LEU 517 N -2.48 2.57 0.25 1.80 1.43 -1.26 -5.05 118.68 115.94 3ffz s LEU 517 Ca 0.13 1.07 -0.04 0.00 -1.03 0.00 0.00 54.13 54.26 3ffz s LEU 517 Cb -0.07 -3.66 -0.02 0.00 0.03 0.00 0.00 46.19 42.47 3ffz s LEU 517 CO 0.06 -1.85 0.30 0.54 0.23 0.00 0.00 176.35 175.62 3ffz s ASN 518 N -4.23 0.32 0.62 2.29 2.20 -1.26 -5.03 114.94 109.85 3ffz s ASN 518 Ca 0.61 -1.29 0.13 0.00 -0.94 0.00 0.00 52.86 51.36 3ffz s ASN 518 Cb -0.13 0.50 0.70 0.00 -2.00 0.00 0.00 41.25 40.32 3ffz s ASN 518 CO 0.52 -1.02 1.38 1.62 -2.94 0.00 0.00 177.10 176.66 3ffz h VAL 519 N 2.39 0.00 0.04 3.54 3.04 -1.84 -0.37 116.25 123.06 3ffz h VAL 519 Ca -0.31 0.00 -0.27 0.00 -1.01 0.00 0.00 66.70 65.11 3ffz h VAL 519 Cb 1.25 0.29 -0.03 0.00 -2.01 0.00 0.00 31.29 30.79 3ffz h VAL 519 CO 0.44 0.00 -1.39 -0.26 -1.01 0.00 0.00 177.57 175.35 3ffz h PHE 520 N 0.00 0.16 0.46 3.17 0.04 -1.96 -2.35 116.94 116.46 3ffz h PHE 520 Ca 0.00 -0.12 -0.02 0.00 2.80 0.00 0.00 57.97 60.63 3ffz h PHE 520 Cb 1.35 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 39.50 3ffz h PHE 520 CO 0.00 1.14 -0.22 0.74 -0.60 0.00 0.00 178.31 179.37 3ffz h PHE 521 N 0.02 -0.57 -1.01 -0.55 0.04 -1.47 0.15 116.94 113.56 3ffz h PHE 521 Ca -0.17 -0.01 0.26 0.00 2.80 0.00 0.00 57.97 60.84 3ffz h PHE 521 Cb 1.93 0.19 -0.13 0.00 2.20 0.00 0.00 35.95 40.14 3ffz h PHE 521 CO 0.02 -0.25 0.60 1.88 -0.60 0.00 0.00 178.31 179.96 3ffz h TYR 522 N -1.00 0.99 -0.10 -0.55 0.99 -1.63 0.56 116.97 116.24 3ffz h TYR 522 Ca -0.06 0.04 -0.17 0.00 2.00 0.00 0.00 58.73 60.54 3ffz h TYR 522 Cb 0.57 -0.28 -0.01 0.00 1.00 0.00 0.00 36.73 38.01 3ffz h TYR 522 CO 0.02 0.04 -0.65 -0.07 -0.00 0.00 0.00 178.16 177.49 3ffz h LEU 523 N 0.55 0.43 -0.05 3.88 3.38 -1.28 -3.14 115.31 119.07 3ffz h LEU 523 Ca 0.65 -0.26 -0.04 0.00 0.09 0.00 0.00 57.88 58.32 3ffz h LEU 523 Cb 1.29 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.92 3ffz h LEU 523 CO -0.48 0.97 -0.12 -0.78 0.09 0.00 0.00 178.44 178.11 3ffz h ASP 524 N 0.27 0.20 0.00 -0.43 3.58 0.28 -2.88 116.42 117.45 3ffz h ASP 524 Ca -0.01 -0.58 0.00 0.00 0.42 0.00 0.00 57.03 56.86 3ffz h ASP 524 Cb 1.20 -0.06 0.00 0.00 1.72 0.00 0.00 39.33 42.19 3ffz h ASP 524 CO 0.11 0.75 0.04 0.00 -2.88 0.00 0.00 179.24 177.26 3ffz n ALA 525 N -2.43 0.94 -1.26 -0.78 0.00 0.11 -0.28 120.51 116.80 3ffz n ALA 525 Ca -0.08 0.07 -0.25 0.00 0.00 0.00 0.00 53.44 53.18 3ffz n ALA 525 Cb 0.37 -1.04 0.16 0.00 0.00 0.00 0.00 19.45 18.95 3ffz n ALA 525 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3ffz n GLN 526 N -1.74 2.30 -4.39 0.00 6.02 -1.09 -0.67 117.38 117.81 3ffz n GLN 526 Ca -0.00 -3.07 -0.25 0.00 -0.01 0.00 0.00 57.00 53.66 3ffz n GLN 526 Cb 0.05 -2.18 -0.12 0.00 1.02 0.00 0.00 30.24 29.02 3ffz n GLN 526 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 3ffz s LYS 527 N -3.38 1.42 -0.53 -1.09 2.20 0.61 -4.74 119.74 114.23 3ffz s LYS 527 Ca 0.58 -1.48 -0.25 0.00 -0.36 0.00 0.00 55.97 54.46 3ffz s LYS 527 Cb 0.48 -1.64 0.04 0.00 -1.51 0.00 0.00 37.83 35.19 3ffz s LYS 527 CO 0.08 0.35 0.97 0.54 -0.36 0.00 0.00 175.35 176.93 3ffz s VAL 528 N -1.81 4.36 -0.20 4.02 0.11 -1.26 -4.82 120.40 120.79 3ffz s VAL 528 Ca 0.19 0.49 -0.29 0.00 -2.93 0.00 0.00 61.98 59.44 3ffz s VAL 528 Cb -0.07 -4.54 -0.02 0.00 -1.53 0.00 0.00 36.38 30.23 3ffz s VAL 528 CO 0.09 -1.07 1.39 -2.16 -3.33 0.00 0.00 175.10 170.02 3ffz s PRO 529 N 4.03 4.04 0.21 1.54 0.04 -1.26 -4.96 135.00 138.65 3ffz s PRO 529 Ca 0.34 1.60 -0.32 0.00 0.04 0.00 0.00 61.00 62.65 3ffz s PRO 529 Cb -0.11 -3.88 -0.14 0.00 0.04 0.00 0.00 34.50 30.41 3ffz s PRO 529 CO 0.22 -0.97 1.43 0.39 0.04 0.00 0.00 177.00 178.11 3ffz n GLU 530 N 7.10 1.98 0.00 4.56 4.71 -1.26 -1.64 120.64 136.09 3ffz n GLU 530 Ca 0.16 0.71 0.00 0.00 -0.01 0.00 0.00 57.16 58.01 3ffz n GLU 530 Cb 0.45 -2.38 0.00 0.00 -1.01 0.00 0.00 31.44 28.50 3ffz n GLU 530 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3ffz n GLY 531 N 2.48 2.41 3.77 0.62 0.00 -1.26 -5.06 105.19 108.15 3ffz n GLY 531 Ca 0.13 -0.25 -0.39 0.00 0.00 0.00 0.00 46.02 45.51 3ffz n GLY 531 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ffz s GLU 532 N 0.00 4.44 0.00 1.61 0.41 -0.65 -4.93 118.70 119.58 3ffz s GLU 532 Ca 0.00 0.98 0.00 0.00 -0.41 0.00 0.00 54.97 55.54 3ffz s GLU 532 Cb 0.00 -3.30 0.00 0.00 -1.78 0.00 0.00 34.13 29.05 3ffz s GLU 532 CO 0.00 0.46 0.00 0.09 -0.49 0.00 0.00 175.26 175.32 3ffz n ASN 533 N 2.17 0.87 -3.53 -0.19 4.13 -1.26 -4.85 115.26 112.60 3ffz n ASN 533 Ca -0.06 -0.02 -0.40 0.00 1.68 0.00 0.00 54.58 55.78 3ffz n ASN 533 Cb 0.50 0.21 -0.01 0.00 -1.54 0.00 0.00 39.78 38.94 3ffz n ASN 533 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 3ffz n ASN 534 N -0.30 6.91 -4.72 6.41 5.15 -1.26 -4.72 115.26 122.73 3ffz n ASN 534 Ca 0.00 -2.84 -0.42 0.00 -0.60 0.00 0.00 54.58 50.72 3ffz n ASN 534 Cb 0.00 -1.53 -0.04 0.00 -0.53 0.00 0.00 39.78 37.69 3ffz n ASN 534 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 3ffz s VAL 535 N 1.42 4.38 0.35 3.44 -7.23 -1.26 -4.77 120.40 116.74 3ffz s VAL 535 Ca 0.56 1.84 0.03 0.00 -1.81 0.00 0.00 61.98 62.60 3ffz s VAL 535 Cb 0.16 -4.17 -0.04 0.00 0.56 0.00 0.00 36.38 32.89 3ffz s VAL 535 CO -0.07 0.21 0.11 0.20 -0.31 0.00 0.00 175.10 175.25 3ffz s ASN 536 N 0.54 2.29 0.02 4.85 -0.87 -0.58 -4.96 114.94 116.23 3ffz s ASN 536 Ca 0.52 -1.54 0.01 0.00 -1.57 0.00 0.00 52.86 50.28 3ffz s ASN 536 Cb -0.25 0.29 -0.02 0.00 -0.02 0.00 0.00 41.25 41.25 3ffz s ASN 536 CO 0.30 -0.82 -0.05 -0.76 -2.57 0.00 0.00 177.10 173.20 3ffz s LEU 537 N -3.50 2.17 0.06 0.60 1.02 -1.26 -0.25 118.68 117.52 3ffz s LEU 537 Ca 0.31 -0.37 -0.10 0.00 0.02 0.00 0.00 54.13 53.99 3ffz s LEU 537 Cb 0.05 -0.11 0.01 0.00 0.02 0.00 0.00 46.19 46.16 3ffz s LEU 537 CO 0.15 -0.14 0.22 0.42 0.02 0.00 0.00 176.35 177.02 3ffz s THR 538 N -0.95 0.12 -0.16 5.49 -4.23 -1.19 -4.95 115.64 109.77 3ffz s THR 538 Ca -0.07 -0.96 0.15 0.00 -1.18 0.00 0.00 61.69 59.63 3ffz s THR 538 Cb -0.07 -1.08 0.04 0.00 1.34 0.00 0.00 72.50 72.73 3ffz s THR 538 CO -0.00 -0.53 1.36 0.77 -0.54 0.00 0.00 174.62 175.68 3ffz h SER 539 N 3.13 0.00 -3.18 3.99 4.64 -1.92 -3.14 113.55 117.06 3ffz h SER 539 Ca -0.33 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.42 3ffz h SER 539 Cb 1.20 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.24 3ffz h SER 539 CO 0.51 0.50 0.96 -0.55 -0.87 0.00 0.00 176.83 177.38 3ffz s SER 540 N -6.36 6.69 0.09 4.97 0.15 -1.26 -4.90 113.70 113.07 3ffz s SER 540 Ca 0.03 1.16 -0.22 0.00 0.70 0.00 0.00 55.95 57.62 3ffz s SER 540 Cb 0.08 -2.54 -0.14 0.00 -1.71 0.00 0.00 66.02 61.71 3ffz s SER 540 CO 0.75 -1.07 1.72 -0.29 1.20 0.00 0.00 173.24 175.55 3ffz h ILE 541 N 5.96 1.03 -0.06 6.45 6.09 -1.97 -2.78 117.51 132.23 3ffz h ILE 541 Ca -0.26 -0.08 0.01 0.00 -1.37 0.00 0.00 64.86 63.16 3ffz h ILE 541 Cb 1.09 1.01 -0.01 0.00 0.47 0.00 0.00 36.82 39.39 3ffz h ILE 541 CO 1.04 0.03 -0.06 0.44 -3.07 0.00 0.00 178.15 176.53 3ffz h ASP 542 N 0.03 -0.20 -0.80 2.19 3.32 -1.98 0.14 116.42 119.12 3ffz h ASP 542 Ca 0.01 0.03 0.19 0.00 0.02 0.00 0.00 57.03 57.28 3ffz h ASP 542 Cb 0.02 0.08 -0.13 0.00 0.22 0.00 0.00 39.33 39.52 3ffz h ASP 542 CO -0.00 -0.04 0.13 0.71 -1.72 0.00 0.00 179.24 178.33 3ffz h THR 543 N -0.03 0.38 -0.88 0.35 1.35 -1.97 1.07 112.91 113.19 3ffz h THR 543 Ca 0.01 -0.06 0.19 0.00 -0.55 0.00 0.00 66.41 66.00 3ffz h THR 543 Cb 0.06 0.17 -0.06 0.00 -1.73 0.00 0.00 68.15 66.59 3ffz h THR 543 CO -0.07 0.03 0.58 0.00 -0.25 0.00 0.00 175.52 175.82 3ffz h ALA 544 N 1.71 2.20 0.00 6.62 0.00 -0.80 0.44 119.26 129.42 3ffz h ALA 544 Ca 0.46 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.37 3ffz h ALA 544 Cb 0.86 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 3ffz h ALA 544 CO -0.62 -0.47 -0.12 -0.07 0.00 0.00 0.00 179.25 177.97 3ffz h LEU 545 N 0.40 0.00 -2.61 0.00 3.38 0.27 -3.34 115.31 113.41 3ffz h LEU 545 Ca 0.45 -0.49 0.00 0.00 0.09 0.00 0.00 57.88 57.94 3ffz h LEU 545 Cb 1.12 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.87 3ffz h LEU 545 CO -0.16 0.81 0.12 -0.07 0.09 0.00 0.00 178.44 179.22 3ffz h LEU 546 N -1.00 0.00 -8.08 1.67 3.38 0.77 -3.38 115.31 108.67 3ffz h LEU 546 Ca -0.03 0.00 -0.68 0.00 0.09 0.00 0.00 57.88 57.27 3ffz h LEU 546 Cb 0.58 0.00 -0.32 0.00 0.09 0.00 0.00 40.66 41.01 3ffz h LEU 546 CO -0.02 0.00 -0.71 -1.61 0.09 0.00 0.00 178.44 176.19 3ffz s GLU 547 N -4.20 2.56 0.34 1.13 8.01 0.15 -5.01 118.70 121.68 3ffz s GLU 547 Ca -0.04 -1.17 0.08 0.00 0.01 0.00 0.00 54.97 53.84 3ffz s GLU 547 Cb 0.12 -3.13 0.78 0.00 -4.31 0.00 0.00 34.13 27.59 3ffz s GLU 547 CO 0.39 -0.55 1.86 1.96 0.01 0.00 0.00 175.26 178.93 3ffz h GLN 548 N 8.01 0.72 -0.23 1.61 1.08 -1.82 -2.11 115.11 122.36 3ffz h GLN 548 Ca -0.25 -0.04 0.00 0.00 -1.45 0.00 0.00 58.65 56.91 3ffz h GLN 548 Cb 1.08 -0.16 0.00 0.00 -0.05 0.00 0.00 27.48 28.34 3ffz h GLN 548 CO 0.54 0.47 0.00 -0.35 -0.95 0.00 0.00 178.83 178.55 3ffz n PRO 549 N -4.58 1.59 -3.90 1.46 -0.04 -1.26 -4.62 135.00 123.66 3ffz n PRO 549 Ca 0.18 -0.91 -0.33 0.00 -0.04 0.00 0.00 63.50 62.39 3ffz n PRO 549 Cb 0.46 -1.25 -0.13 0.00 -0.04 0.00 0.00 33.50 32.54 3ffz n PRO 549 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 3ffz s LYS 550 N -1.70 1.83 0.17 0.54 1.02 -0.80 -1.53 119.74 119.27 3ffz s LYS 550 Ca 0.21 -2.01 -0.30 0.00 0.02 0.00 0.00 55.97 53.89 3ffz s LYS 550 Cb 0.11 -3.41 -0.07 0.00 -0.52 0.00 0.00 37.83 33.94 3ffz s LYS 550 CO 0.15 -1.03 1.15 0.42 -0.92 0.00 0.00 175.35 175.12 3ffz s ILE 551 N 0.75 3.78 0.32 2.17 1.09 0.65 -4.31 121.20 125.65 3ffz s ILE 551 Ca 0.11 1.48 -0.25 0.00 -1.10 0.00 0.00 60.65 60.90 3ffz s ILE 551 Cb -0.21 -3.95 -0.10 0.00 -1.06 0.00 0.00 42.46 37.14 3ffz s ILE 551 CO -0.05 0.23 0.93 -0.47 -0.10 0.00 0.00 174.94 175.47 3ffz s TYR 552 N -0.01 3.66 0.02 3.97 5.04 0.15 -3.14 117.35 127.05 3ffz s TYR 552 Ca 0.52 1.74 0.01 0.00 -2.44 0.00 0.00 57.07 56.90 3ffz s TYR 552 Cb -0.31 -2.89 -0.01 0.00 0.35 0.00 0.00 41.96 39.10 3ffz s TYR 552 CO 0.35 0.20 -0.05 -0.08 -1.34 0.00 0.00 175.55 174.63 3ffz s THR 553 N -1.65 0.35 -0.73 4.34 -1.32 -1.19 -4.48 115.64 110.97 3ffz s THR 553 Ca 0.50 -0.62 0.13 0.00 -1.21 0.00 0.00 61.69 60.50 3ffz s THR 553 Cb -0.18 -0.38 0.65 0.00 -1.51 0.00 0.00 72.50 71.08 3ffz s THR 553 CO 0.23 -0.18 1.51 2.22 -2.21 0.00 0.00 174.62 176.19 3ffz n PHE 554 N 2.20 1.53 -2.87 9.09 1.16 -1.26 -4.62 117.46 122.69 3ffz n PHE 554 Ca -0.18 -0.56 -0.19 0.00 -1.87 0.00 0.00 57.45 54.65 3ffz n PHE 554 Cb 0.57 -0.35 0.03 0.00 -1.61 0.00 0.00 39.48 38.12 3ffz n PHE 554 CO 0.00 0.00 0.00 -0.06 -1.87 0.00 0.00 176.76 174.83 3ffz s PHE 555 N -2.18 2.65 0.39 2.97 0.08 -1.26 -4.74 117.98 115.89 3ffz s PHE 555 Ca 0.44 -0.29 -0.26 0.00 0.12 0.00 0.00 56.93 56.94 3ffz s PHE 555 Cb 0.32 -2.52 -0.09 0.00 -0.57 0.00 0.00 43.02 40.16 3ffz s PHE 555 CO 0.16 -0.69 1.22 -1.54 -0.10 0.00 0.00 175.22 174.27 3ffz s SER 556 N -4.42 6.48 0.30 1.36 1.04 -1.26 -4.93 113.70 112.28 3ffz s SER 556 Ca 0.57 2.46 0.04 0.00 0.48 0.00 0.00 55.95 59.50 3ffz s SER 556 Cb -0.10 -2.62 0.78 0.00 0.10 0.00 0.00 66.02 64.18 3ffz s SER 556 CO 0.36 -0.71 1.61 0.77 0.98 0.00 0.00 173.24 176.25 3ffz h SER 557 N 2.72 -0.14 -0.66 7.02 4.64 -1.98 0.08 113.55 125.23 3ffz h SER 557 Ca -0.49 0.23 0.12 0.00 -0.47 0.00 0.00 61.79 61.18 3ffz h SER 557 Cb 1.24 0.34 -0.09 0.00 -0.31 0.00 0.00 62.40 63.58 3ffz h SER 557 CO 0.63 -0.25 0.22 1.05 -0.87 0.00 0.00 176.83 177.60 3ffz h GLU 558 N 0.12 0.36 -0.20 4.77 9.09 -1.98 0.22 114.58 126.95 3ffz h GLU 558 Ca 0.59 -0.02 -0.02 0.00 0.05 0.00 0.00 59.36 59.96 3ffz h GLU 558 Cb 1.25 -0.08 -0.01 0.00 -1.65 0.00 0.00 28.75 28.26 3ffz h GLU 558 CO -0.75 0.24 0.05 0.35 0.05 0.00 0.00 179.01 178.94 3ffz h PHE 559 N 0.37 0.28 0.15 2.06 3.57 -1.32 -1.58 116.94 120.46 3ffz h PHE 559 Ca 0.35 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.84 3ffz h PHE 559 Cb 0.50 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 39.16 3ffz h PHE 559 CO -0.20 0.25 -0.07 0.82 -2.23 0.00 0.00 178.31 176.88 3ffz h ILE 560 N 0.28 0.00 -0.09 1.41 2.04 -0.53 -3.16 117.51 117.46 3ffz h ILE 560 Ca 0.07 -0.28 0.02 0.00 1.00 0.00 0.00 64.86 65.67 3ffz h ILE 560 Cb 0.12 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.19 3ffz h ILE 560 CO -0.00 0.00 0.43 0.78 0.00 0.00 0.00 178.15 179.36 3ffz h ASN 561 N -0.49 0.00 -1.05 1.72 -0.26 -0.86 0.14 115.58 114.79 3ffz h ASN 561 Ca -0.02 0.00 -0.64 0.00 -0.56 0.00 0.00 56.30 55.08 3ffz h ASN 561 Cb 0.16 0.00 -0.34 0.00 -1.06 0.00 0.00 38.32 37.08 3ffz h ASN 561 CO 0.03 0.00 0.27 0.59 -1.06 0.00 0.00 177.43 177.27 3ffz n ASN 562 N -2.99 6.65 0.00 5.81 5.03 -0.60 -4.43 115.26 124.73 3ffz n ASN 562 Ca 0.00 -3.78 0.00 0.00 0.87 0.00 0.00 54.58 51.67 3ffz n ASN 562 Cb 0.50 -0.76 0.00 0.00 -1.02 0.00 0.00 39.78 38.50 3ffz n ASN 562 CO 0.00 0.00 0.00 0.55 -1.83 0.00 0.00 177.26 175.98 3ffz n VAL 563 N -0.79 0.00 -0.73 2.41 3.14 0.49 -4.89 118.33 117.97 3ffz n VAL 563 Ca 0.55 0.00 0.08 0.00 -2.96 0.00 0.00 64.34 62.01 3ffz n VAL 563 Cb 0.72 0.06 0.30 0.00 -1.06 0.00 0.00 33.84 33.86 3ffz n VAL 563 CO 0.00 0.00 0.00 0.59 -6.46 0.00 0.00 176.83 170.96 3ffz n ASN 564 N 0.00 4.32 -4.84 6.55 3.02 -1.13 -5.00 115.26 118.18 3ffz n ASN 564 Ca 0.00 -2.65 -0.32 0.00 -0.03 0.00 0.00 54.58 51.58 3ffz n ASN 564 Cb 0.00 -0.53 0.00 0.00 -0.61 0.00 0.00 39.78 38.65 3ffz n ASN 564 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3ffz s LYS 565 N -2.20 3.54 0.58 3.52 1.02 -1.26 -5.03 119.74 119.91 3ffz s LYS 565 Ca 0.44 0.95 -0.18 0.00 0.02 0.00 0.00 55.97 57.20 3ffz s LYS 565 Cb 0.31 -2.07 -0.04 0.00 -0.52 0.00 0.00 37.83 35.51 3ffz s LYS 565 CO 0.16 -0.61 1.11 -1.25 -0.92 0.00 0.00 175.35 173.84 3ffz s PRO 566 N -4.56 3.20 -0.10 -1.68 0.04 -1.26 -5.03 135.00 125.60 3ffz s PRO 566 Ca 0.59 1.48 -0.03 0.00 0.04 0.00 0.00 61.00 63.07 3ffz s PRO 566 Cb -0.12 -2.00 -0.03 0.00 0.04 0.00 0.00 34.50 32.39 3ffz s PRO 566 CO 0.43 -0.95 0.03 0.08 0.04 0.00 0.00 177.00 176.64 3ffz s VAL 567 N -2.05 4.55 0.00 -0.36 1.01 -1.26 -5.10 120.40 117.20 3ffz s VAL 567 Ca 0.69 -0.15 0.00 0.00 0.00 0.00 0.00 61.98 62.52 3ffz s VAL 567 Cb -0.21 -2.95 0.00 0.00 0.00 0.00 0.00 36.38 33.22 3ffz s VAL 567 CO 0.32 0.59 0.00 0.00 0.00 0.00 0.00 175.10 176.01 3ffz n GLN 568 N 2.30 0.29 0.04 2.72 3.00 -1.26 -5.07 117.38 119.41 3ffz n GLN 568 Ca -0.19 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.80 3ffz n GLN 568 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.78 3ffz n GLN 568 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 3ffz n ALA 569 N -3.00 3.00 -0.26 -1.58 0.00 -1.26 -4.69 120.51 112.71 3ffz n ALA 569 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3ffz n ALA 569 Cb 0.00 0.10 0.22 0.00 0.00 0.00 0.00 19.45 19.76 3ffz n ALA 569 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ffz h ALA 570 N 0.00 1.43 -0.40 0.00 0.00 -2.04 -1.64 119.26 116.61 3ffz h ALA 570 Ca 0.00 -0.05 -0.31 0.00 0.00 0.00 0.00 54.91 54.55 3ffz h ALA 570 Cb 0.00 -0.32 -0.12 0.00 0.00 0.00 0.00 17.79 17.34 3ffz h ALA 570 CO 0.00 0.52 0.32 1.28 0.00 0.00 0.00 179.25 181.36 3ffz n LEU 571 N -4.42 6.27 0.00 0.00 4.32 -1.26 -4.42 117.00 117.49 3ffz n LEU 571 Ca 0.10 -3.33 0.00 0.00 -0.02 0.00 0.00 56.01 52.76 3ffz n LEU 571 Cb 0.05 -1.12 0.00 0.00 -1.62 0.00 0.00 43.42 40.73 3ffz n LEU 571 CO 0.36 1.32 0.00 0.33 -1.22 0.00 0.00 177.39 178.18 3ffz n PHE 572 N 0.71 0.00 0.29 -1.77 7.35 -0.62 -4.13 117.46 119.28 3ffz n PHE 572 Ca 0.31 0.00 0.10 0.00 -0.76 0.00 0.00 57.45 57.09 3ffz n PHE 572 Cb 0.58 0.00 0.44 0.00 0.35 0.00 0.00 39.48 40.86 3ffz n PHE 572 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 3ffz h VAL 573 N 0.00 0.02 0.00 -2.13 2.07 -1.79 -0.86 116.25 113.57 3ffz h VAL 573 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 3ffz h VAL 573 Cb 0.00 0.34 0.00 0.00 -1.52 0.00 0.00 31.29 30.11 3ffz h VAL 573 CO 0.00 0.00 -0.09 0.77 0.02 0.00 0.00 177.57 178.27 3ffz h SER 574 N 0.00 0.00 -0.23 0.57 4.64 -1.84 -3.34 113.55 113.35 3ffz h SER 574 Ca 0.04 0.00 0.07 0.00 -0.47 0.00 0.00 61.79 61.43 3ffz h SER 574 Cb 1.39 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.48 3ffz h SER 574 CO -0.00 0.21 0.36 -0.25 -0.87 0.00 0.00 176.83 176.28 3ffz h TRP 575 N -0.33 0.00 -0.19 4.77 7.01 -1.51 0.13 115.95 125.83 3ffz h TRP 575 Ca 0.00 0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.00 3ffz h TRP 575 Cb 0.09 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.15 3ffz h TRP 575 CO -0.04 0.00 0.00 0.44 -2.79 0.00 0.00 178.44 176.05 3ffz n ILE 576 N -3.43 0.24 -0.01 2.65 -6.64 -0.40 -3.44 119.36 108.33 3ffz n ILE 576 Ca 0.03 -0.42 0.04 0.00 -1.77 0.00 0.00 62.75 60.63 3ffz n ILE 576 Cb 0.48 0.54 -0.08 0.00 -1.44 0.00 0.00 39.64 39.15 3ffz n ILE 576 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 3ffz n GLN 577 N 0.58 0.49 0.08 6.28 1.13 0.39 -4.21 117.38 122.12 3ffz n GLN 577 Ca 0.17 -0.08 0.13 0.00 -1.94 0.00 0.00 57.00 55.27 3ffz n GLN 577 Cb 0.39 -1.23 0.46 0.00 0.11 0.00 0.00 30.24 29.97 3ffz n GLN 577 CO 0.00 0.00 0.00 0.94 -1.44 0.00 0.00 177.06 176.56 3ffz n GLN 578 N -1.88 0.18 0.13 -1.09 0.00 -0.88 -2.31 117.38 111.53 3ffz n GLN 578 Ca -0.03 0.21 -0.22 0.00 -0.00 0.00 0.00 57.00 56.96 3ffz n GLN 578 Cb 0.30 -1.74 -0.15 0.00 0.00 0.00 0.00 30.24 28.65 3ffz n GLN 578 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.06 176.67 3ffz h VAL 579 N 0.00 1.34 0.00 1.69 -1.51 -1.73 -2.93 116.25 113.12 3ffz h VAL 579 Ca 0.00 -2.82 0.00 0.00 -1.23 0.00 0.00 66.70 62.65 3ffz h VAL 579 Cb 0.59 3.00 0.00 0.00 -2.13 0.00 0.00 31.29 32.75 3ffz h VAL 579 CO 0.00 0.84 0.00 0.18 -1.23 0.00 0.00 177.57 177.36 3ffz n LEU 580 N -3.65 0.00 -0.11 4.19 4.77 -0.98 -0.49 117.00 120.74 3ffz n LEU 580 Ca -0.14 0.00 0.08 0.00 -0.03 0.00 0.00 56.01 55.92 3ffz n LEU 580 Cb 1.08 0.00 0.11 0.00 -2.33 0.00 0.00 43.42 42.28 3ffz n LEU 580 CO 0.58 0.00 0.53 0.52 -1.33 0.00 0.00 177.39 177.69 3ffz n VAL 581 N -0.67 1.60 0.00 4.08 0.31 -1.11 -3.87 118.33 118.67 3ffz n VAL 581 Ca 0.06 -1.91 0.00 0.00 -0.01 0.00 0.00 64.34 62.48 3ffz n VAL 581 Cb 0.03 -0.09 0.00 0.00 -0.91 0.00 0.00 33.84 32.87 3ffz n VAL 581 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 3ffz n ASP 582 N -1.20 1.62 0.17 4.52 8.00 -0.42 -4.38 116.55 124.86 3ffz n ASP 582 Ca 0.13 0.00 -0.07 0.00 0.71 0.00 0.00 54.79 55.56 3ffz n ASP 582 Cb 0.61 0.12 -0.03 0.00 -0.02 0.00 0.00 41.12 41.80 3ffz n ASP 582 CO 0.00 0.00 0.00 0.15 -0.39 0.00 0.00 177.20 176.96 3ffz h PHE 583 N 0.00 -0.42 -0.50 1.24 3.57 -1.01 0.34 116.94 120.16 3ffz h PHE 583 Ca 0.00 -0.01 0.15 0.00 3.53 0.00 0.00 57.97 61.64 3ffz h PHE 583 Cb 0.34 0.14 -0.02 0.00 2.79 0.00 0.00 35.95 39.20 3ffz h PHE 583 CO 0.00 -0.26 0.42 0.00 -2.23 0.00 0.00 178.31 176.23 3ffz h THR 584 N -0.74 0.57 0.20 4.41 1.03 -1.79 1.84 112.91 118.42 3ffz h THR 584 Ca -0.05 0.00 -0.01 0.00 -0.01 0.00 0.00 66.41 66.34 3ffz h THR 584 Cb 0.35 0.69 0.00 0.00 -1.07 0.00 0.00 68.15 68.13 3ffz h THR 584 CO 0.08 0.00 -0.10 0.74 -0.01 0.00 0.00 175.52 176.23 3ffz h THR 585 N 0.00 0.78 0.02 0.00 2.02 -1.72 -3.32 112.91 110.70 3ffz h THR 585 Ca 0.24 -0.99 -0.22 0.00 0.77 0.00 0.00 66.41 66.21 3ffz h THR 585 Cb 1.07 1.28 -0.02 0.00 -1.74 0.00 0.00 68.15 68.73 3ffz h THR 585 CO -0.00 0.19 -1.01 -0.33 0.37 0.00 0.00 175.52 174.74 3ffz h GLU 586 N -0.84 0.06 -0.05 6.66 5.08 0.10 -3.14 114.58 122.46 3ffz h GLU 586 Ca -0.03 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.23 3ffz h GLU 586 Cb 0.52 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.80 3ffz h GLU 586 CO 0.05 1.01 0.00 0.00 -1.00 0.00 0.00 179.01 179.07 3ffz n ALA 587 N -2.40 2.03 -1.09 3.43 0.00 0.61 -2.43 120.51 120.67 3ffz n ALA 587 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 3ffz n ALA 587 Cb 0.92 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.37 3ffz n ALA 587 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3ffz n ASN 588 N -0.44 0.00 -4.74 0.00 3.02 -1.21 -4.33 115.26 107.55 3ffz n ASN 588 Ca 0.00 -1.00 -0.42 0.00 -0.03 0.00 0.00 54.58 53.13 3ffz n ASN 588 Cb 0.01 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.17 3ffz n ASN 588 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3ffz n GLN 589 N 0.00 2.61 -3.95 3.52 10.64 -1.02 -4.96 117.38 124.22 3ffz n GLN 589 Ca 0.00 0.93 -0.08 0.00 -1.83 0.00 0.00 57.00 56.01 3ffz n GLN 589 Cb 0.28 -2.68 -0.04 0.00 -0.86 0.00 0.00 30.24 26.94 3ffz n GLN 589 CO 0.00 0.00 0.00 -1.59 -1.83 0.00 0.00 177.06 173.64 3ffz s LYS 590 N -0.73 1.61 0.31 2.61 -2.85 -1.26 -4.31 119.74 115.12 3ffz s LYS 590 Ca 0.63 -1.16 0.04 0.00 -1.00 0.00 0.00 55.97 54.48 3ffz s LYS 590 Cb -0.51 0.51 -0.02 0.00 -2.06 0.00 0.00 37.83 35.76 3ffz s LYS 590 CO 0.51 -0.69 0.32 0.43 0.10 0.00 0.00 175.35 176.01 3ffz n SER 591 N -0.40 -0.84 -4.67 0.03 7.64 -0.91 -4.99 113.62 109.47 3ffz n SER 591 Ca -0.03 -2.91 -0.24 0.00 1.01 0.00 0.00 58.87 56.70 3ffz n SER 591 Cb 0.61 1.79 -0.07 0.00 -1.01 0.00 0.00 64.21 65.53 3ffz n SER 591 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3ffz s THR 592 N -3.09 3.67 -0.28 0.44 -4.23 -1.26 -2.48 115.64 108.42 3ffz s THR 592 Ca 0.33 -1.67 -0.04 0.00 -1.18 0.00 0.00 61.69 59.13 3ffz s THR 592 Cb 0.01 -2.93 0.02 0.00 1.34 0.00 0.00 72.50 70.95 3ffz s THR 592 CO 0.24 -0.28 0.00 -0.69 -0.54 0.00 0.00 174.62 173.35 3ffz s VAL 593 N -2.09 3.29 -0.15 2.29 1.01 -0.89 -4.91 120.40 118.96 3ffz s VAL 593 Ca 0.30 -0.98 0.06 0.00 0.00 0.00 0.00 61.98 61.37 3ffz s VAL 593 Cb -0.08 -2.73 -0.23 0.00 0.00 0.00 0.00 36.38 33.35 3ffz s VAL 593 CO 0.20 0.09 0.25 0.47 0.00 0.00 0.00 175.10 176.11 3ffz n ASP 594 N 4.73 1.25 0.00 3.32 9.92 -1.26 -4.14 116.55 130.38 3ffz n ASP 594 Ca -0.15 0.14 0.07 0.00 -0.53 0.00 0.00 54.79 54.33 3ffz n ASP 594 Cb 0.47 -0.11 0.44 0.00 -0.64 0.00 0.00 41.12 41.28 3ffz n ASP 594 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 3ffz n LYS 595 N -3.14 0.98 -3.52 -1.24 4.01 -1.26 -4.37 118.16 109.60 3ffz n LYS 595 Ca -0.31 0.00 -0.29 0.00 -0.51 0.00 0.00 58.31 57.20 3ffz n LYS 595 Cb 1.06 -1.24 -0.14 0.00 -0.51 0.00 0.00 35.03 34.20 3ffz n LYS 595 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 3ffz s ILE 596 N -2.00 0.10 -1.79 -0.18 1.01 -1.26 -4.99 121.20 112.09 3ffz s ILE 596 Ca 0.22 -1.21 0.15 0.00 0.00 0.00 0.00 60.65 59.82 3ffz s ILE 596 Cb 0.10 -1.10 0.37 0.00 0.01 0.00 0.00 42.46 41.85 3ffz s ILE 596 CO 0.17 -0.83 1.36 0.00 0.00 0.00 0.00 174.94 175.64 3ffz n ALA 597 N 4.72 1.99 0.03 9.38 0.00 -1.26 -2.13 120.51 133.23 3ffz n ALA 597 Ca 0.02 -0.09 0.09 0.00 0.00 0.00 0.00 53.44 53.46 3ffz n ALA 597 Cb 0.40 -1.25 -0.10 0.00 0.00 0.00 0.00 19.45 18.50 3ffz n ALA 597 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3ffz n ASP 598 N -1.10 0.37 -4.15 0.00 4.64 -1.26 -4.87 116.55 110.18 3ffz n ASP 598 Ca 0.10 0.15 -0.31 0.00 -1.38 0.00 0.00 54.79 53.35 3ffz n ASP 598 Cb 0.08 1.22 -0.17 0.00 -1.04 0.00 0.00 41.12 41.21 3ffz n ASP 598 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 3ffz s ILE 599 N -3.34 1.85 -0.23 5.18 1.01 -0.91 -4.77 121.20 120.00 3ffz s ILE 599 Ca -0.05 -0.87 -0.15 0.00 0.00 0.00 0.00 60.65 59.58 3ffz s ILE 599 Cb 0.11 -1.64 -0.09 0.00 0.01 0.00 0.00 42.46 40.86 3ffz s ILE 599 CO 0.85 0.51 -0.34 -1.54 0.00 0.00 0.00 174.94 174.42 3ffz n SER 600 N 3.91 1.89 -4.84 3.58 3.41 -1.26 -4.11 113.62 116.20 3ffz n SER 600 Ca -0.20 0.32 -0.34 0.00 -0.26 0.00 0.00 58.87 58.39 3ffz n SER 600 Cb 0.52 -0.76 -0.06 0.00 -0.26 0.00 0.00 64.21 63.65 3ffz n SER 600 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 175.04 174.37 3ffz s ILE 601 N -2.65 5.16 -0.08 -1.33 2.07 -1.26 -2.09 121.20 121.01 3ffz s ILE 601 Ca -0.33 -0.13 -0.03 0.00 -1.41 0.00 0.00 60.65 58.74 3ffz s ILE 601 Cb 0.10 -3.33 0.05 0.00 0.13 0.00 0.00 42.46 39.41 3ffz s ILE 601 CO 0.45 0.44 0.16 -0.69 -1.91 0.00 0.00 174.94 173.39 3ffz s VAL 602 N -1.16 -0.25 -0.52 4.00 1.01 -1.04 -4.41 120.40 118.03 3ffz s VAL 602 Ca 0.21 0.35 -0.23 0.00 0.00 0.00 0.00 61.98 62.32 3ffz s VAL 602 Cb -0.12 -0.29 0.04 0.00 0.00 0.00 0.00 36.38 36.01 3ffz s VAL 602 CO 0.12 0.15 0.85 -0.69 0.00 0.00 0.00 175.10 175.52 3ffz s VAL 603 N 2.25 4.54 -2.00 2.92 1.01 -1.26 -2.15 120.40 125.71 3ffz s VAL 603 Ca 0.03 0.16 0.06 0.00 0.00 0.00 0.00 61.98 62.23 3ffz s VAL 603 Cb -0.12 -4.45 0.17 0.00 0.00 0.00 0.00 36.38 31.98 3ffz s VAL 603 CO -0.06 -0.97 0.77 -0.81 0.00 0.00 0.00 175.10 174.03 3ffz n PRO 604 N 7.06 0.42 -0.32 2.72 -0.04 -1.26 -3.43 135.00 140.15 3ffz n PRO 604 Ca 0.00 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.55 3ffz n PRO 604 Cb 0.47 -1.21 0.21 0.00 -0.04 0.00 0.00 33.50 32.93 3ffz n PRO 604 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 3ffz n TYR 605 N -0.71 0.59 0.14 0.54 0.18 -1.26 -4.53 117.16 112.10 3ffz n TYR 605 Ca 0.04 -0.95 0.01 0.00 1.88 0.00 0.00 57.90 58.88 3ffz n TYR 605 Cb 0.02 -0.26 0.13 0.00 -0.38 0.00 0.00 39.34 38.85 3ffz n TYR 605 CO 0.00 0.00 0.00 0.82 -2.08 0.00 0.00 176.86 175.60 3ffz h ILE 606 N 1.09 1.14 -0.54 -3.48 2.04 -1.93 -2.79 117.51 113.05 3ffz h ILE 606 Ca 0.01 -2.20 -0.05 0.00 1.00 0.00 0.00 64.86 63.62 3ffz h ILE 606 Cb 1.28 2.29 -0.02 0.00 -0.74 0.00 0.00 36.82 39.63 3ffz h ILE 606 CO 0.14 0.57 0.14 1.23 0.00 0.00 0.00 178.15 180.23 3ffz h GLY 607 N 2.61 0.92 1.54 5.37 0.00 -1.81 -1.93 103.07 109.78 3ffz h GLY 607 Ca -0.01 -0.57 -0.05 0.00 0.00 0.00 0.00 47.33 46.70 3ffz h GLY 607 CO 0.08 0.53 -0.64 1.41 0.00 0.00 0.00 176.54 177.91 3ffz h LEU 608 N 0.76 0.00 -0.09 3.11 3.38 -1.72 -1.02 115.31 119.73 3ffz h LEU 608 Ca 0.17 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.09 3ffz h LEU 608 Cb 0.32 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.07 3ffz h LEU 608 CO -0.00 0.22 -0.14 0.00 0.09 0.00 0.00 178.44 178.61 3ffz h ALA 609 N 1.78 0.14 -0.11 1.53 0.00 -1.34 -3.35 119.26 117.90 3ffz h ALA 609 Ca -0.03 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.55 3ffz h ALA 609 Cb 1.19 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.96 3ffz h ALA 609 CO 0.02 0.02 0.00 1.28 0.00 0.00 0.00 179.25 180.57 3ffz n LEU 610 N -4.61 2.45 -3.01 0.00 4.77 -0.74 -4.68 117.00 111.19 3ffz n LEU 610 Ca -0.07 -2.25 -0.16 0.00 -0.03 0.00 0.00 56.01 53.50 3ffz n LEU 610 Cb 0.36 -0.17 0.02 0.00 -2.33 0.00 0.00 43.42 41.30 3ffz n LEU 610 CO 0.38 0.61 -0.04 -3.20 -1.33 0.00 0.00 177.39 173.80 3ffz n ASN 611 N -0.38 -7.35 -3.87 -1.43 5.15 -0.60 -4.21 115.26 102.58 3ffz n ASN 611 Ca 0.07 0.38 -0.29 0.00 -0.60 0.00 0.00 54.58 54.14 3ffz n ASN 611 Cb 0.41 -4.45 -0.16 0.00 -0.53 0.00 0.00 39.78 35.05 3ffz n ASN 611 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 3ffz s ILE 612 N -2.30 1.16 0.00 -1.44 -1.09 -0.49 -4.70 121.20 112.34 3ffz s ILE 612 Ca 0.28 -0.89 0.00 0.00 -2.23 0.00 0.00 60.65 57.81 3ffz s ILE 612 Cb -0.06 -1.46 0.00 0.00 -1.58 0.00 0.00 42.46 39.36 3ffz s ILE 612 CO 0.79 -0.06 0.00 0.61 -1.23 0.00 0.00 174.94 175.05 3ffz n GLY 613 N 4.82 1.81 3.61 6.18 0.00 -1.26 -4.19 105.19 116.16 3ffz n GLY 613 Ca -0.11 -1.75 -0.30 0.00 0.00 0.00 0.00 46.02 43.86 3ffz n GLY 613 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ffz s ASN 614 N -0.27 2.25 0.10 1.61 2.20 -1.26 -4.29 114.94 115.28 3ffz s ASN 614 Ca 0.00 1.74 -0.19 0.00 -0.94 0.00 0.00 52.86 53.47 3ffz s ASN 614 Cb 0.00 -2.36 -0.04 0.00 -2.00 0.00 0.00 41.25 36.84 3ffz s ASN 614 CO 0.00 -3.44 1.18 -0.62 -2.94 0.00 0.00 177.10 171.27 3ffz n GLU 615 N -4.43 -0.27 -0.33 3.55 4.71 -1.26 0.41 120.64 123.03 3ffz n GLU 615 Ca 0.07 1.16 0.19 0.00 -0.01 0.00 0.00 57.16 58.57 3ffz n GLU 615 Cb 0.54 -1.71 0.40 0.00 -1.01 0.00 0.00 31.44 29.65 3ffz n GLU 615 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3ffz h ALA 616 N 0.05 1.73 -0.07 0.62 0.00 -2.00 -2.30 119.26 117.29 3ffz h ALA 616 Ca 0.10 0.17 -0.07 0.00 0.00 0.00 0.00 54.91 55.10 3ffz h ALA 616 Cb 0.25 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.18 3ffz h ALA 616 CO -0.57 -0.43 -0.25 1.96 0.00 0.00 0.00 179.25 179.96 3ffz h GLN 617 N 0.40 0.29 0.00 0.00 4.20 -0.34 -2.75 115.11 116.91 3ffz h GLN 617 Ca 0.66 -0.22 0.00 0.00 0.06 0.00 0.00 58.65 59.15 3ffz h GLN 617 Cb 1.37 0.04 0.00 0.00 0.30 0.00 0.00 27.48 29.19 3ffz h GLN 617 CO -0.56 0.85 0.01 1.63 -0.67 0.00 0.00 178.83 180.09 3ffz n LYS 618 N -4.49 0.00 -0.03 1.46 5.02 -0.48 -1.70 118.16 117.93 3ffz n LYS 618 Ca -0.08 0.24 -0.03 0.00 -2.02 0.00 0.00 58.31 56.42 3ffz n LYS 618 Cb 0.46 -1.51 -0.01 0.00 -0.02 0.00 0.00 35.03 33.94 3ffz n LYS 618 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3ffz n GLY 619 N -1.22 -0.54 2.75 0.72 0.00 -1.17 -4.15 105.19 101.58 3ffz n GLY 619 Ca 0.00 -0.10 -0.42 0.00 0.00 0.00 0.00 46.02 45.50 3ffz n GLY 619 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3ffz n ASN 620 N -3.15 5.61 0.16 1.61 5.03 -0.95 -4.75 115.26 118.83 3ffz n ASN 620 Ca -0.04 -3.06 -0.14 0.00 0.87 0.00 0.00 54.58 52.20 3ffz n ASN 620 Cb 0.16 -1.48 -0.08 0.00 -1.02 0.00 0.00 39.78 37.36 3ffz n ASN 620 CO 0.00 0.00 0.00 0.15 -1.83 0.00 0.00 177.26 175.58 3ffz h PHE 621 N 5.54 -0.33 -0.52 3.10 -0.00 -1.56 -2.15 116.94 121.02 3ffz h PHE 621 Ca 0.49 -0.01 0.10 0.00 -0.00 0.00 0.00 57.97 58.56 3ffz h PHE 621 Cb 0.56 0.11 -0.10 0.00 -0.00 0.00 0.00 35.95 36.52 3ffz h PHE 621 CO 1.37 -0.15 -0.14 -0.22 -0.00 0.00 0.00 178.31 179.16 3ffz h LYS 622 N -0.43 -0.01 0.17 1.11 3.64 -1.87 0.46 116.57 119.65 3ffz h LYS 622 Ca -0.04 0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.36 3ffz h LYS 622 Cb 0.32 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.11 3ffz h LYS 622 CO 0.06 -0.01 -0.34 -0.44 -2.27 0.00 0.00 179.45 176.46 3ffz h ASP 623 N -0.01 -0.96 -0.46 4.20 3.32 -1.91 0.50 116.42 121.11 3ffz h ASP 623 Ca 0.25 0.10 0.08 0.00 0.02 0.00 0.00 57.03 57.48 3ffz h ASP 623 Cb 0.39 0.35 -0.07 0.00 0.22 0.00 0.00 39.33 40.23 3ffz h ASP 623 CO -0.54 -0.43 0.05 0.00 -1.72 0.00 0.00 179.24 176.59 3ffz h ALA 624 N -0.00 0.47 -0.98 3.45 0.00 -0.61 0.23 119.26 121.82 3ffz h ALA 624 Ca 0.02 0.11 0.18 0.00 0.00 0.00 0.00 54.91 55.22 3ffz h ALA 624 Cb 0.60 0.18 -0.09 0.00 0.00 0.00 0.00 17.79 18.48 3ffz h ALA 624 CO -0.16 -0.35 0.61 1.25 0.00 0.00 0.00 179.25 180.60 3ffz h LEU 625 N 0.17 0.73 0.07 0.00 5.85 0.58 0.45 115.31 123.16 3ffz h LEU 625 Ca 0.23 0.07 -0.00 0.00 0.84 0.00 0.00 57.88 59.02 3ffz h LEU 625 Cb 0.32 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.28 3ffz h LEU 625 CO -0.34 0.30 -0.03 -0.33 -0.34 0.00 0.00 178.44 177.70 3ffz h GLU 626 N 0.74 -0.09 0.00 1.25 4.39 0.16 0.26 114.58 121.29 3ffz h GLU 626 Ca 0.54 0.01 -0.04 0.00 0.34 0.00 0.00 59.36 60.20 3ffz h GLU 626 Cb 0.86 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.53 3ffz h GLU 626 CO -0.31 0.22 -0.18 1.25 -1.16 0.00 0.00 179.01 178.84 3ffz h LEU 627 N -0.42 0.00 0.00 1.33 7.12 0.34 -3.35 115.31 120.33 3ffz h LEU 627 Ca -0.01 0.00 -0.13 0.00 0.13 0.00 0.00 57.88 57.87 3ffz h LEU 627 Cb 0.36 0.00 -0.02 0.00 -0.53 0.00 0.00 40.66 40.47 3ffz h LEU 627 CO 0.02 0.18 -1.48 0.18 -0.13 0.00 0.00 178.44 177.21 3ffz n LEU 628 N -3.88 0.29 0.00 2.25 4.77 0.14 -5.08 117.00 115.49 3ffz n LEU 628 Ca -0.02 -0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.96 3ffz n LEU 628 Cb 0.27 0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.49 3ffz n LEU 628 CO 0.33 0.22 0.00 0.61 -1.33 0.00 0.00 177.39 177.22 3ffz n GLY 629 N 2.62 -1.77 0.00 -0.72 0.00 0.91 -4.24 105.19 102.00 3ffz n GLY 629 Ca -0.12 -1.92 0.08 0.00 0.00 0.00 0.00 46.02 44.07 3ffz n GLY 629 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ffz n ALA 630 N 0.01 2.30 0.13 4.61 0.00 -1.26 -2.95 120.51 123.35 3ffz n ALA 630 Ca 0.00 -0.11 -0.01 0.00 0.00 0.00 0.00 53.44 53.32 3ffz n ALA 630 Cb 0.00 -1.27 0.20 0.00 0.00 0.00 0.00 19.45 18.38 3ffz n ALA 630 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3ffz h GLY 631 N 3.68 0.08 0.38 0.00 0.00 -1.94 -3.13 103.07 102.16 3ffz h GLY 631 Ca 0.00 -0.09 0.15 0.00 0.00 0.00 0.00 47.33 47.39 3ffz h GLY 631 CO 0.00 0.09 0.61 1.19 0.00 0.00 0.00 176.54 178.42 3ffz h ILE 632 N 0.06 0.82 0.00 2.60 2.10 -1.79 0.12 117.51 121.42 3ffz h ILE 632 Ca -0.00 -0.28 -0.05 0.00 1.08 0.00 0.00 64.86 65.61 3ffz h ILE 632 Cb 0.98 -0.06 -0.01 0.00 -1.09 0.00 0.00 36.82 36.64 3ffz h ILE 632 CO 0.07 0.15 -0.23 -0.07 -1.08 0.00 0.00 178.15 176.99 3ffz h LEU 633 N 0.81 0.00 -9.73 2.19 -0.00 -1.80 -3.45 115.31 103.34 3ffz h LEU 633 Ca 0.50 0.00 -0.53 0.00 -0.00 0.00 0.00 57.88 57.86 3ffz h LEU 633 Cb 0.71 0.00 0.07 0.00 -0.00 0.00 0.00 40.66 41.44 3ffz h LEU 633 CO -0.27 0.23 0.91 -0.76 -0.00 0.00 0.00 178.44 178.54 3ffz s LEU 634 N -7.18 4.36 0.31 1.67 1.43 0.03 -4.91 118.68 114.38 3ffz s LEU 634 Ca -0.01 2.84 0.21 0.00 -1.03 0.00 0.00 54.13 56.15 3ffz s LEU 634 Cb 0.12 -3.62 0.15 0.00 0.03 0.00 0.00 46.19 42.88 3ffz s LEU 634 CO 0.63 -0.89 1.34 -0.08 0.23 0.00 0.00 176.35 177.58 3ffz h GLU 635 N 5.72 0.00 0.00 1.70 4.57 -1.86 -3.43 114.58 121.27 3ffz h GLU 635 Ca -0.45 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.73 3ffz h GLU 635 Cb 1.21 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.80 3ffz h GLU 635 CO 0.86 0.08 -0.54 1.19 -1.18 0.00 0.00 179.01 179.42 3ffz n PHE 636 N -2.95 -0.16 -3.24 0.92 3.72 -1.26 -5.11 117.46 109.37 3ffz n PHE 636 Ca 0.01 0.03 -0.10 0.00 -0.05 0.00 0.00 57.45 57.34 3ffz n PHE 636 Cb 0.58 0.18 0.00 0.00 -0.94 0.00 0.00 39.48 39.31 3ffz n PHE 636 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 3ffz n GLU 637 N -2.94 -1.58 -2.54 -1.08 2.13 -1.26 -4.95 120.64 108.43 3ffz n GLU 637 Ca 0.00 1.40 -0.41 0.00 0.66 0.00 0.00 57.16 58.81 3ffz n GLU 637 Cb 0.27 -4.64 -0.04 0.00 0.27 0.00 0.00 31.44 27.30 3ffz n GLU 637 CO 0.00 0.00 0.00 -2.14 -0.41 0.00 0.00 177.13 174.58 3ffz s PRO 638 N -3.39 4.59 0.28 5.31 0.02 -1.26 -5.00 135.00 135.56 3ffz s PRO 638 Ca 0.06 1.68 -0.29 0.00 0.02 0.00 0.00 61.00 62.47 3ffz s PRO 638 Cb -0.01 -3.30 -0.10 0.00 0.02 0.00 0.00 34.50 31.11 3ffz s PRO 638 CO 0.80 0.06 1.25 -1.83 -0.33 0.00 0.00 177.00 176.95 3ffz s GLU 639 N -0.18 4.44 -0.32 5.54 -1.05 -1.26 -4.99 118.70 120.88 3ffz s GLU 639 Ca 0.50 2.06 0.02 0.00 -0.15 0.00 0.00 54.97 57.40 3ffz s GLU 639 Cb -0.28 -3.14 0.09 0.00 -0.44 0.00 0.00 34.13 30.35 3ffz s GLU 639 CO 0.34 -0.10 0.02 -0.51 0.95 0.00 0.00 175.26 175.96 3ffz s LEU 640 N -1.23 4.38 -0.21 1.83 1.43 -1.26 -5.09 118.68 118.53 3ffz s LEU 640 Ca 0.50 -1.84 -0.08 0.00 -1.03 0.00 0.00 54.13 51.68 3ffz s LEU 640 Cb -0.37 -1.64 -0.04 0.00 0.03 0.00 0.00 46.19 44.17 3ffz s LEU 640 CO 0.46 -0.34 0.07 -0.76 0.23 0.00 0.00 176.35 176.01 3ffz s LEU 641 N 1.02 3.67 -0.11 1.79 1.02 -1.26 -5.08 118.68 119.74 3ffz s LEU 641 Ca 0.03 -0.04 -0.15 0.00 0.02 0.00 0.00 54.13 53.99 3ffz s LEU 641 Cb -0.20 -1.95 -0.05 0.00 0.02 0.00 0.00 46.19 44.01 3ffz s LEU 641 CO -0.06 0.08 0.36 -0.63 0.02 0.00 0.00 176.35 176.12 3ffz s ILE 642 N 0.96 5.22 0.78 -0.59 1.01 -1.26 -5.06 121.20 122.26 3ffz s ILE 642 Ca 0.04 0.71 -0.11 0.00 0.00 0.00 0.00 60.65 61.29 3ffz s ILE 642 Cb -0.14 -3.69 0.06 0.00 0.01 0.00 0.00 42.46 38.71 3ffz s ILE 642 CO 0.03 0.43 1.09 -2.16 0.00 0.00 0.00 174.94 174.33 3ffz s PRO 643 N 0.06 2.17 0.11 2.79 0.04 -1.26 -4.92 135.00 133.98 3ffz s PRO 643 Ca 0.21 1.09 -0.31 0.00 0.04 0.00 0.00 61.00 62.02 3ffz s PRO 643 Cb -0.14 -1.89 -0.10 0.00 0.04 0.00 0.00 34.50 32.40 3ffz s PRO 643 CO 0.08 -1.68 1.79 0.99 0.04 0.00 0.00 177.00 178.22 3ffz s THR 644 N -2.93 2.64 -0.00 1.26 2.01 -1.26 -4.92 115.64 112.44 3ffz s THR 644 Ca 0.61 0.15 -0.30 0.00 0.31 0.00 0.00 61.69 62.46 3ffz s THR 644 Cb -0.17 -3.09 -0.03 0.00 0.01 0.00 0.00 72.50 69.21 3ffz s THR 644 CO 0.56 -0.00 1.06 -0.63 -0.69 0.00 0.00 174.62 174.92 3ffz s ILE 645 N 2.69 4.58 0.53 1.82 1.01 -1.26 -4.88 121.20 125.68 3ffz s ILE 645 Ca 0.79 1.86 -0.18 0.00 0.00 0.00 0.00 60.65 63.12 3ffz s ILE 645 Cb -0.45 -4.19 -0.07 0.00 0.01 0.00 0.00 42.46 37.76 3ffz s ILE 645 CO 0.35 0.11 1.02 -0.76 0.00 0.00 0.00 174.94 175.67 3ffz s LEU 646 N 1.28 3.68 0.37 2.97 1.43 -1.26 -4.87 118.68 122.28 3ffz s LEU 646 Ca 0.54 1.78 0.03 0.00 -1.03 0.00 0.00 54.13 55.45 3ffz s LEU 646 Cb -0.23 -4.54 -0.01 0.00 0.03 0.00 0.00 46.19 41.44 3ffz s LEU 646 CO 0.26 -0.83 0.55 0.68 0.23 0.00 0.00 176.35 177.24 3ffz s VAL 647 N -2.33 4.23 0.81 -1.59 -7.23 -1.26 -4.98 120.40 108.05 3ffz s VAL 647 Ca 0.63 -0.76 -0.12 0.00 -1.81 0.00 0.00 61.98 59.93 3ffz s VAL 647 Cb -0.14 -3.51 0.08 0.00 0.56 0.00 0.00 36.38 33.37 3ffz s VAL 647 CO 0.28 -0.27 1.18 0.72 -0.31 0.00 0.00 175.10 176.70 3ffz s PHE 648 N -2.32 2.94 0.08 2.82 -0.71 -1.26 -4.80 117.98 114.73 3ffz s PHE 648 Ca 0.45 0.75 0.08 0.00 -1.04 0.00 0.00 56.93 57.18 3ffz s PHE 648 Cb -0.10 -3.50 -0.04 0.00 -1.21 0.00 0.00 43.02 38.18 3ffz s PHE 648 CO 0.34 -1.79 -0.20 0.99 -1.34 0.00 0.00 175.22 173.22 3ffz s THR 649 N -3.57 2.70 -0.18 -4.49 2.01 -1.13 -5.01 115.64 105.96 3ffz s THR 649 Ca 0.62 -1.40 -0.00 0.00 0.31 0.00 0.00 61.69 61.22 3ffz s THR 649 Cb -0.11 -2.18 0.01 0.00 0.01 0.00 0.00 72.50 70.22 3ffz s THR 649 CO 0.49 0.21 -0.15 -0.63 -0.69 0.00 0.00 174.62 173.86 3ffz s ILE 650 N -1.02 2.60 0.11 1.82 1.01 -1.26 -0.46 121.20 123.99 3ffz s ILE 650 Ca 0.16 -0.77 -0.36 0.00 0.00 0.00 0.00 60.65 59.68 3ffz s ILE 650 Cb -0.10 -2.12 -0.16 0.00 0.01 0.00 0.00 42.46 40.08 3ffz s ILE 650 CO 0.07 0.50 1.32 0.29 0.00 0.00 0.00 174.94 177.13 3ffz n LYS 651 N 4.45 1.22 -3.05 2.79 5.02 -1.26 -4.91 118.16 122.41 3ffz n LYS 651 Ca -0.20 0.44 -0.43 0.00 -2.02 0.00 0.00 58.31 56.10 3ffz n LYS 651 Cb 0.51 -2.06 -0.06 0.00 -0.02 0.00 0.00 35.03 33.40 3ffz n LYS 651 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3ffz s SER 652 N 0.42 6.27 -0.30 4.39 1.04 -1.26 -4.98 113.70 119.28 3ffz s SER 652 Ca 0.82 -0.67 -0.42 0.00 0.48 0.00 0.00 55.95 56.16 3ffz s SER 652 Cb -0.92 -2.34 -0.18 0.00 0.10 0.00 0.00 66.02 62.68 3ffz s SER 652 CO 0.47 -0.98 1.57 0.49 0.98 0.00 0.00 173.24 175.77 3ffz n PHE 653 N 6.58 1.73 -4.49 5.02 3.01 -1.26 -4.98 117.46 123.07 3ffz n PHE 653 Ca -0.03 0.84 -0.31 0.00 1.01 0.00 0.00 57.45 58.96 3ffz n PHE 653 Cb 0.46 -2.32 -0.11 0.00 -0.01 0.00 0.00 39.48 37.50 3ffz n PHE 653 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 3ffz s LEU 654 N 2.64 2.92 0.00 4.37 1.43 -1.26 -4.41 118.68 124.37 3ffz s LEU 654 Ca 0.99 -0.30 0.00 0.00 -1.03 0.00 0.00 54.13 53.78 3ffz s LEU 654 Cb -1.25 -1.70 0.00 0.00 0.03 0.00 0.00 46.19 43.27 3ffz s LEU 654 CO 0.69 0.25 0.00 0.61 0.23 0.00 0.00 176.35 178.13 3ffz n GLY 655 N 1.39 1.72 0.00 -3.19 0.00 -1.26 -4.99 105.19 98.86 3ffz n GLY 655 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.87 3ffz n GLY 655 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3ffz n SER 656 N 0.00 0.00 0.00 1.61 3.41 -1.26 -4.82 113.62 112.56 3ffz n SER 656 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3ffz n SER 656 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 3ffz n SER 656 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3ffz n SER 657 N 0.00 0.00 -1.39 4.04 3.41 -1.26 -5.11 113.62 113.32 3ffz n SER 657 Ca 0.00 -0.10 0.00 0.00 -0.26 0.00 0.00 58.87 58.51 3ffz n SER 657 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 3ffz n SER 657 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3ffz n ASP 658 N 0.00 -1.85 -3.62 4.04 -0.08 -1.26 -5.04 116.55 108.74 3ffz n ASP 658 Ca 0.00 0.00 -0.27 0.00 -1.51 0.00 0.00 54.79 53.01 3ffz n ASP 658 Cb 0.03 -0.92 -0.10 0.00 2.34 0.00 0.00 41.12 42.46 3ffz n ASP 658 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 3ffz n ASN 659 N 0.00 2.93 0.20 1.67 3.02 -1.26 -4.95 115.26 116.87 3ffz n ASN 659 Ca 0.00 -3.22 0.09 0.00 -0.03 0.00 0.00 54.58 51.42 3ffz n ASN 659 Cb 0.00 -0.70 0.48 0.00 -0.61 0.00 0.00 39.78 38.95 3ffz n ASN 659 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 3ffz h LYS 660 N 4.81 0.00 0.05 3.52 3.11 -1.97 -2.13 116.57 123.96 3ffz h LYS 660 Ca 0.17 0.00 -0.29 0.00 -2.81 0.00 0.00 60.65 57.72 3ffz h LYS 660 Cb 0.73 0.00 -0.03 0.00 -1.00 0.00 0.00 32.23 31.93 3ffz h LYS 660 CO 0.73 0.00 -1.60 0.09 -2.81 0.00 0.00 179.45 175.86 3ffz n ASN 661 N -2.24 1.98 -0.22 4.20 5.03 -1.26 -4.19 115.26 118.55 3ffz n ASN 661 Ca -0.01 0.33 0.02 0.00 0.87 0.00 0.00 54.58 55.79 3ffz n ASN 661 Cb 0.29 -0.92 0.11 0.00 -1.02 0.00 0.00 39.78 38.24 3ffz n ASN 661 CO 0.00 0.00 0.00 0.11 -1.83 0.00 0.00 177.26 175.54 3ffz h LYS 662 N -0.54 0.09 0.00 3.52 1.79 -1.81 0.33 116.57 119.95 3ffz h LYS 662 Ca -0.39 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.08 3ffz h LYS 662 Cb 1.63 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 32.26 3ffz h LYS 662 CO -0.09 0.06 0.00 1.33 -1.08 0.00 0.00 179.45 179.67 3ffz n VAL 663 N -5.33 1.60 -0.10 0.50 0.24 -1.21 -0.86 118.33 113.18 3ffz n VAL 663 Ca 0.10 0.40 -0.10 0.00 -2.04 0.00 0.00 64.34 62.70 3ffz n VAL 663 Cb 0.39 -1.35 -0.15 0.00 -1.47 0.00 0.00 33.84 31.26 3ffz n VAL 663 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 3ffz n ILE 664 N -1.44 1.34 -0.27 1.34 2.08 0.11 -3.53 119.36 118.98 3ffz n ILE 664 Ca 0.01 -0.80 -0.05 0.00 0.56 0.00 0.00 62.75 62.47 3ffz n ILE 664 Cb 0.03 -0.56 0.10 0.00 -0.75 0.00 0.00 39.64 38.46 3ffz n ILE 664 CO 0.00 0.00 0.00 0.50 0.56 0.00 0.00 176.55 177.61 3ffz h LYS 665 N 0.00 1.13 0.41 0.38 3.64 -0.01 -2.71 116.57 119.42 3ffz h LYS 665 Ca -0.53 -0.19 -0.02 0.00 -1.27 0.00 0.00 60.65 58.64 3ffz h LYS 665 Cb 2.17 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 33.80 3ffz h LYS 665 CO 0.02 0.91 -0.20 0.00 -2.27 0.00 0.00 179.45 177.91 3ffz h ALA 666 N 1.23 -0.56 -0.37 5.00 0.00 -1.42 -2.30 119.26 120.85 3ffz h ALA 666 Ca 0.26 -0.19 0.11 0.00 0.00 0.00 0.00 54.91 55.09 3ffz h ALA 666 Cb 0.19 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 3ffz h ALA 666 CO -0.02 -0.64 0.39 0.82 0.00 0.00 0.00 179.25 179.79 3ffz h ILE 667 N -0.89 0.43 0.09 0.00 2.04 -1.60 0.61 117.51 118.19 3ffz h ILE 667 Ca -0.06 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.80 3ffz h ILE 667 Cb 0.56 0.70 0.00 0.00 -0.74 0.00 0.00 36.82 37.34 3ffz h ILE 667 CO 0.09 0.00 -0.04 0.78 0.00 0.00 0.00 178.15 178.98 3ffz h ASN 668 N 0.00 -0.10 -0.74 1.72 2.35 -1.33 -2.03 115.58 115.45 3ffz h ASN 668 Ca 0.18 -0.45 0.02 0.00 -0.55 0.00 0.00 56.30 55.49 3ffz h ASN 668 Cb 0.95 0.03 -0.04 0.00 0.05 0.00 0.00 38.32 39.30 3ffz h ASN 668 CO -0.00 0.45 0.49 0.78 -1.65 0.00 0.00 177.43 177.49 3ffz h ASN 669 N -0.70 0.81 0.14 5.81 2.35 -0.20 -0.82 115.58 122.97 3ffz h ASN 669 Ca -0.01 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.73 3ffz h ASN 669 Cb 0.55 -0.20 -0.03 0.00 0.05 0.00 0.00 38.32 38.69 3ffz h ASN 669 CO 0.02 0.57 -0.37 0.00 -1.65 0.00 0.00 177.43 176.00 3ffz h ALA 670 N 1.55 -0.91 -0.51 -0.83 0.00 0.19 0.29 119.26 119.05 3ffz h ALA 670 Ca 0.28 -0.09 0.15 0.00 0.00 0.00 0.00 54.91 55.25 3ffz h ALA 670 Cb -0.03 0.74 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 3ffz h ALA 670 CO -0.07 -0.98 0.41 -0.07 0.00 0.00 0.00 179.25 178.54 3ffz h LEU 671 N -0.57 0.00 0.40 0.00 3.38 -0.77 -0.15 115.31 117.60 3ffz h LEU 671 Ca -0.01 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 3ffz h LEU 671 Cb 0.56 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.31 3ffz h LEU 671 CO -0.17 0.00 -0.19 0.50 0.09 0.00 0.00 178.44 178.66 3ffz h LYS 672 N 0.00 -0.52 -0.82 1.13 1.63 0.26 -3.13 116.57 115.11 3ffz h LYS 672 Ca 0.24 0.04 0.20 0.00 -0.85 0.00 0.00 60.65 60.27 3ffz h LYS 672 Cb 1.07 0.12 -0.05 0.00 -0.60 0.00 0.00 32.23 32.76 3ffz h LYS 672 CO -0.00 -0.35 0.56 1.49 -3.45 0.00 0.00 179.45 177.70 3ffz h GLU 673 N -1.07 0.28 -0.06 1.90 4.57 0.19 0.85 114.58 121.24 3ffz h GLU 673 Ca -0.06 -0.02 -0.01 0.00 -1.18 0.00 0.00 59.36 58.10 3ffz h GLU 673 Cb 0.42 -0.06 -0.00 0.00 -0.16 0.00 0.00 28.75 28.94 3ffz h GLU 673 CO 0.09 0.18 -0.00 -0.09 -1.18 0.00 0.00 179.01 178.02 3ffz h ARG 674 N 0.29 0.08 -0.22 1.92 1.12 -1.08 -0.47 114.38 116.03 3ffz h ARG 674 Ca 0.41 -0.01 -0.18 0.00 -1.11 0.00 0.00 59.98 59.10 3ffz h ARG 674 Cb 1.18 -0.02 0.00 0.00 -0.01 0.00 0.00 29.97 31.12 3ffz h ARG 674 CO -0.11 0.10 -0.56 -0.44 -3.11 0.00 0.00 179.97 175.84 3ffz h ASP 675 N 0.09 0.87 -0.76 -3.80 5.19 0.77 -3.05 116.42 115.73 3ffz h ASP 675 Ca 0.02 -0.57 0.01 0.00 -0.62 0.00 0.00 57.03 55.87 3ffz h ASP 675 Cb 0.06 -0.25 -0.04 0.00 0.18 0.00 0.00 39.33 39.28 3ffz h ASP 675 CO 0.00 1.29 0.50 -0.08 -3.12 0.00 0.00 179.24 177.83 3ffz h GLU 676 N 0.50 0.98 -0.32 3.56 4.81 -0.56 -2.16 114.58 121.41 3ffz h GLU 676 Ca -0.01 -0.06 0.01 0.00 -0.13 0.00 0.00 59.36 59.17 3ffz h GLU 676 Cb 1.18 -0.22 -0.02 0.00 0.63 0.00 0.00 28.75 30.32 3ffz h GLU 676 CO 0.12 0.65 0.19 -0.22 -0.73 0.00 0.00 179.01 179.02 3ffz h LYS 677 N 1.01 0.37 -0.65 1.92 1.63 -1.04 -0.81 116.57 119.01 3ffz h LYS 677 Ca 0.28 -0.02 0.06 0.00 -0.85 0.00 0.00 60.65 60.12 3ffz h LYS 677 Cb -0.09 -0.08 -0.04 0.00 -0.60 0.00 0.00 32.23 31.42 3ffz h LYS 677 CO -0.07 0.25 0.43 -1.49 -3.45 0.00 0.00 179.45 175.12 3ffz h TRP 678 N 0.38 0.65 0.01 1.91 4.06 -1.34 -0.06 115.95 121.57 3ffz h TRP 678 Ca 0.12 0.02 -0.00 0.00 2.06 0.00 0.00 58.89 61.09 3ffz h TRP 678 Cb -0.00 -0.21 0.00 0.00 -1.00 0.00 0.00 29.16 27.94 3ffz h TRP 678 CO -0.07 0.35 -0.01 0.87 -3.56 0.00 0.00 178.44 176.02 3ffz h LYS 679 N 0.65 -0.02 -0.87 0.49 1.57 -0.85 0.18 116.57 117.72 3ffz h LYS 679 Ca 0.28 0.00 0.05 0.00 -1.87 0.00 0.00 60.65 59.11 3ffz h LYS 679 Cb 0.27 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.53 3ffz h LYS 679 CO -0.09 0.19 0.55 0.93 -0.57 0.00 0.00 179.45 180.46 3ffz h GLU 680 N -0.22 1.00 -0.30 3.15 5.08 -0.27 0.27 114.58 123.29 3ffz h GLU 680 Ca -0.00 -0.06 -0.07 0.00 -1.00 0.00 0.00 59.36 58.22 3ffz h GLU 680 Cb 0.21 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 3ffz h GLU 680 CO 0.00 0.66 -0.10 0.28 -1.00 0.00 0.00 179.01 178.86 3ffz h VAL 681 N 1.03 1.29 0.21 3.13 2.07 -0.91 -1.86 116.25 121.21 3ffz h VAL 681 Ca 0.37 -1.17 0.00 0.00 0.82 0.00 0.00 66.70 66.72 3ffz h VAL 681 Cb 0.10 1.42 -0.01 0.00 -1.52 0.00 0.00 31.29 31.27 3ffz h VAL 681 CO -0.15 0.37 -0.19 1.88 0.02 0.00 0.00 177.57 179.51 3ffz h TYR 682 N 0.36 -0.49 -0.65 1.57 0.05 0.26 -1.79 116.97 116.29 3ffz h TYR 682 Ca 0.07 0.00 0.11 0.00 0.05 0.00 0.00 58.73 58.96 3ffz h TYR 682 Cb 0.60 0.19 -0.04 0.00 1.01 0.00 0.00 36.73 38.49 3ffz h TYR 682 CO 0.05 -0.28 0.43 0.66 -1.05 0.00 0.00 178.16 177.97 3ffz h SER 683 N -0.42 0.39 0.05 3.88 4.64 -0.44 -0.86 113.55 120.79 3ffz h SER 683 Ca -0.00 0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3ffz h SER 683 Cb 0.38 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.41 3ffz h SER 683 CO -0.03 0.23 -0.03 0.15 -0.87 0.00 0.00 176.83 176.28 3ffz h PHE 684 N 0.43 -0.07 -0.22 4.77 3.57 -0.80 -1.24 116.94 123.39 3ffz h PHE 684 Ca 0.30 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.80 3ffz h PHE 684 Cb 0.60 0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.35 3ffz h PHE 684 CO -0.00 0.20 0.14 0.82 -2.23 0.00 0.00 178.31 177.24 3ffz h ILE 685 N -0.33 1.05 -0.39 1.41 1.08 -0.57 -0.95 117.51 118.80 3ffz h ILE 685 Ca -0.01 -0.10 0.01 0.00 -0.39 0.00 0.00 64.86 64.37 3ffz h ILE 685 Cb 0.30 0.73 -0.02 0.00 -3.07 0.00 0.00 36.82 34.76 3ffz h ILE 685 CO 0.01 0.05 0.25 0.58 -0.69 0.00 0.00 178.15 178.35 3ffz h VAL 686 N 0.29 1.08 -0.35 1.67 2.07 -1.18 0.69 116.25 120.52 3ffz h VAL 686 Ca 0.08 -0.17 -0.00 0.00 0.82 0.00 0.00 66.70 67.42 3ffz h VAL 686 Cb -0.03 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 30.25 3ffz h VAL 686 CO -0.02 0.09 0.21 -1.28 0.02 0.00 0.00 177.57 176.59 3ffz h SER 687 N 0.51 0.42 -0.74 0.57 0.87 -0.99 0.13 113.55 114.32 3ffz h SER 687 Ca 0.15 -0.06 -0.05 0.00 -1.23 0.00 0.00 61.79 60.60 3ffz h SER 687 Cb -0.03 -0.11 -0.03 0.00 -0.44 0.00 0.00 62.40 61.79 3ffz h SER 687 CO -0.05 0.36 0.28 0.78 -0.53 0.00 0.00 176.83 177.67 3ffz h ASN 688 N 0.45 1.04 -0.32 6.23 2.35 -0.97 -1.47 115.58 122.89 3ffz h ASN 688 Ca 0.12 -0.17 -0.04 0.00 -0.55 0.00 0.00 56.30 55.66 3ffz h ASN 688 Cb 0.02 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.10 3ffz h ASN 688 CO -0.02 0.94 0.08 -0.25 -1.65 0.00 0.00 177.43 176.52 3ffz h TRP 689 N 1.09 0.61 -0.04 1.19 7.01 -0.23 0.65 115.95 126.24 3ffz h TRP 689 Ca 0.25 -0.05 -0.19 0.00 2.11 0.00 0.00 58.89 61.01 3ffz h TRP 689 Cb 0.24 -0.18 -0.01 0.00 -2.10 0.00 0.00 29.16 27.11 3ffz h TRP 689 CO 0.02 0.55 -0.79 0.52 -2.79 0.00 0.00 178.44 175.94 3ffz h MET 690 N 0.59 0.34 0.00 2.65 2.86 -0.05 0.30 114.93 121.61 3ffz h MET 690 Ca 0.13 -0.31 0.00 0.00 -2.06 0.00 0.00 59.70 57.47 3ffz h MET 690 Cb 0.26 0.07 0.00 0.00 0.06 0.00 0.00 31.60 31.99 3ffz h MET 690 CO 0.00 0.97 -0.78 0.25 1.06 0.00 0.00 176.91 178.41 3ffz n THR 691 N -3.78 0.06 0.00 2.22 -2.24 -0.62 -3.88 114.28 106.03 3ffz n THR 691 Ca -0.04 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.66 3ffz n THR 691 Cb 0.75 0.42 0.00 0.00 -2.10 0.00 0.00 70.33 69.40 3ffz n THR 691 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3ffz n LYS 692 N -1.64 2.50 -0.04 -0.78 5.02 0.19 -1.81 118.16 121.60 3ffz n LYS 692 Ca 0.04 0.00 -0.09 0.00 -2.02 0.00 0.00 58.31 56.24 3ffz n LYS 692 Cb 0.36 -0.83 -0.03 0.00 -0.02 0.00 0.00 35.03 34.51 3ffz n LYS 692 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 3ffz n ILE 693 N -1.38 1.19 -0.27 -0.18 2.08 -1.00 -4.58 119.36 115.23 3ffz n ILE 693 Ca 0.00 0.10 0.12 0.00 0.56 0.00 0.00 62.75 63.52 3ffz n ILE 693 Cb 0.25 -1.90 0.37 0.00 -0.75 0.00 0.00 39.64 37.62 3ffz n ILE 693 CO 0.00 0.00 0.00 -1.13 0.56 0.00 0.00 176.55 175.98 3ffz h ASN 694 N -0.54 0.66 -0.58 4.38 -1.24 -0.63 -0.90 115.58 116.72 3ffz h ASN 694 Ca -0.13 0.04 0.02 0.00 0.71 0.00 0.00 56.30 56.94 3ffz h ASN 694 Cb 0.82 -0.09 -0.03 0.00 0.73 0.00 0.00 38.32 39.75 3ffz h ASN 694 CO -0.08 0.34 0.39 0.71 -1.29 0.00 0.00 177.43 177.49 3ffz h THR 695 N 0.70 1.10 -0.17 -3.57 1.35 -1.77 -2.13 112.91 108.43 3ffz h THR 695 Ca 0.44 -0.25 -0.19 0.00 -0.55 0.00 0.00 66.41 65.86 3ffz h THR 695 Cb 0.69 0.31 0.00 0.00 -1.73 0.00 0.00 68.15 67.43 3ffz h THR 695 CO -0.20 0.13 -0.67 1.56 -0.25 0.00 0.00 175.52 176.09 3ffz h GLN 696 N 0.73 0.68 -0.74 4.72 4.20 -1.39 -2.36 115.11 120.95 3ffz h GLN 696 Ca 0.23 -0.50 -0.03 0.00 0.06 0.00 0.00 58.65 58.41 3ffz h GLN 696 Cb 0.01 0.09 -0.03 0.00 0.30 0.00 0.00 27.48 27.85 3ffz h GLN 696 CO -0.06 1.12 0.35 0.74 -0.67 0.00 0.00 178.83 180.32 3ffz h PHE 697 N 0.49 1.07 0.00 2.96 0.04 -1.29 0.11 116.94 120.32 3ffz h PHE 697 Ca -0.02 -0.05 -0.00 0.00 2.80 0.00 0.00 57.97 60.69 3ffz h PHE 697 Cb 1.27 -0.33 -0.00 0.00 2.20 0.00 0.00 35.95 39.09 3ffz h PHE 697 CO 0.07 0.79 -0.02 -0.91 -0.60 0.00 0.00 178.31 177.63 3ffz h ASN 698 N 1.04 0.00 0.44 2.17 -0.26 -1.37 -2.42 115.58 115.18 3ffz h ASN 698 Ca 0.25 0.00 -0.31 0.00 -0.56 0.00 0.00 56.30 55.69 3ffz h ASN 698 Cb 0.12 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.39 3ffz h ASN 698 CO -0.03 0.02 -1.49 0.50 -1.06 0.00 0.00 177.43 175.37 3ffz h LYS 699 N 0.00 0.30 -0.33 0.81 1.63 -0.54 -3.17 116.57 115.27 3ffz h LYS 699 Ca -0.00 -0.51 0.00 0.00 -0.85 0.00 0.00 60.65 59.29 3ffz h LYS 699 Cb 0.50 0.19 -0.02 0.00 -0.60 0.00 0.00 32.23 32.30 3ffz h LYS 699 CO 0.00 1.19 0.21 0.00 -3.45 0.00 0.00 179.45 177.41 3ffz h ARG 700 N 0.08 0.44 0.37 1.90 2.47 -0.40 -0.22 114.38 119.02 3ffz h ARG 700 Ca -0.23 -0.03 -0.00 0.00 -1.26 0.00 0.00 59.98 58.46 3ffz h ARG 700 Cb 2.03 -0.10 -0.02 0.00 -1.65 0.00 0.00 29.97 30.23 3ffz h ARG 700 CO 0.19 0.29 -0.35 0.87 0.56 0.00 0.00 179.97 181.52 3ffz h LYS 701 N 0.45 -0.72 0.34 0.04 1.57 -1.44 0.12 116.57 116.93 3ffz h LYS 701 Ca 0.12 0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.95 3ffz h LYS 701 Cb -0.04 0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.41 3ffz h LYS 701 CO -0.03 -0.48 -0.31 0.93 -0.57 0.00 0.00 179.45 179.00 3ffz h GLU 702 N -0.74 -0.65 -0.93 3.15 5.08 -1.33 -0.69 114.58 118.46 3ffz h GLU 702 Ca -0.03 0.04 0.24 0.00 -1.00 0.00 0.00 59.36 58.62 3ffz h GLU 702 Cb 0.67 0.15 -0.06 0.00 0.50 0.00 0.00 28.75 30.00 3ffz h GLU 702 CO -0.06 -0.43 0.64 1.96 -1.00 0.00 0.00 179.01 180.12 3ffz h GLN 703 N -0.67 0.23 -0.13 2.33 4.20 -0.93 0.54 115.11 120.68 3ffz h GLN 703 Ca -0.02 -0.01 -0.19 0.00 0.06 0.00 0.00 58.65 58.49 3ffz h GLN 703 Cb 0.60 -0.05 0.01 0.00 0.30 0.00 0.00 27.48 28.34 3ffz h GLN 703 CO -0.04 0.15 -0.65 1.98 -0.67 0.00 0.00 178.83 179.60 3ffz h MET 704 N 0.24 0.68 0.05 1.46 4.05 0.20 -2.10 114.93 119.51 3ffz h MET 704 Ca 0.48 -0.55 -0.00 0.00 -0.28 0.00 0.00 59.70 59.34 3ffz h MET 704 Cb 1.47 0.11 0.00 0.00 -0.80 0.00 0.00 31.60 32.38 3ffz h MET 704 CO -0.12 1.17 -0.03 -0.92 0.23 0.00 0.00 176.91 177.23 3ffz h TYR 705 N 0.36 -0.07 -0.97 1.39 3.20 0.47 -1.72 116.97 119.63 3ffz h TYR 705 Ca -0.04 -0.00 0.15 0.00 3.14 0.00 0.00 58.73 61.98 3ffz h TYR 705 Cb 1.29 0.02 -0.09 0.00 1.54 0.00 0.00 36.73 39.49 3ffz h TYR 705 CO 0.10 0.06 0.61 1.96 -1.64 0.00 0.00 178.16 179.25 3ffz h GLN 706 N -0.18 0.80 -0.09 1.82 4.20 -1.08 0.86 115.11 121.44 3ffz h GLN 706 Ca -0.01 -0.05 -0.00 0.00 0.06 0.00 0.00 58.65 58.65 3ffz h GLN 706 Cb 0.16 -0.18 -0.00 0.00 0.30 0.00 0.00 27.48 27.75 3ffz h GLN 706 CO 0.01 0.53 0.04 0.00 -0.67 0.00 0.00 178.83 178.74 3ffz h ALA 707 N 1.59 0.11 -0.33 3.87 0.00 -0.83 0.27 119.26 123.95 3ffz h ALA 707 Ca 0.51 -0.07 -0.18 0.00 0.00 0.00 0.00 54.91 55.17 3ffz h ALA 707 Cb 0.70 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 3ffz h ALA 707 CO -0.28 -0.32 -0.48 -0.07 0.00 0.00 0.00 179.25 178.10 3ffz h LEU 708 N 0.01 0.98 -0.82 0.00 3.38 -0.52 -2.70 115.31 115.64 3ffz h LEU 708 Ca 0.03 -0.50 0.11 0.00 0.09 0.00 0.00 57.88 57.61 3ffz h LEU 708 Cb 0.13 -0.28 -0.08 0.00 0.09 0.00 0.00 40.66 40.52 3ffz h LEU 708 CO -0.00 1.30 0.46 -0.61 0.09 0.00 0.00 178.44 179.67 3ffz h GLN 709 N 0.71 0.72 0.00 1.13 5.75 0.90 -0.19 115.11 124.14 3ffz h GLN 709 Ca 0.03 -0.04 0.00 0.00 -0.15 0.00 0.00 58.65 58.49 3ffz h GLN 709 Cb 1.09 -0.16 0.00 0.00 1.07 0.00 0.00 27.48 29.47 3ffz h GLN 709 CO 0.11 0.48 0.00 0.09 -2.65 0.00 0.00 178.83 176.86 3ffz n ASN 710 N -4.78 0.14 0.08 -0.69 3.02 0.95 -3.01 115.26 110.97 3ffz n ASN 710 Ca 0.14 0.52 -0.20 0.00 -0.03 0.00 0.00 54.58 55.01 3ffz n ASN 710 Cb 0.31 -0.55 -0.15 0.00 -0.61 0.00 0.00 39.78 38.78 3ffz n ASN 710 CO 0.00 0.00 0.00 1.56 -2.62 0.00 0.00 177.26 176.20 3ffz h GLN 711 N 0.00 0.34 -0.72 3.52 1.08 -0.72 -2.87 115.11 115.72 3ffz h GLN 711 Ca 0.00 -0.58 0.10 0.00 -1.45 0.00 0.00 58.65 56.72 3ffz h GLN 711 Cb 0.47 0.21 -0.05 0.00 -0.05 0.00 0.00 27.48 28.06 3ffz h GLN 711 CO 0.00 1.23 0.48 0.28 -0.95 0.00 0.00 178.83 179.87 3ffz h VAL 712 N 0.09 0.93 0.06 -0.54 2.07 -1.32 -1.17 116.25 116.37 3ffz h VAL 712 Ca -0.27 -0.21 -0.25 0.00 0.82 0.00 0.00 66.70 66.78 3ffz h VAL 712 Cb 2.06 0.26 -0.02 0.00 -1.52 0.00 0.00 31.29 32.07 3ffz h VAL 712 CO 0.18 0.11 -1.21 0.78 0.02 0.00 0.00 177.57 177.46 3ffz h ASN 713 N 0.62 0.19 0.00 0.57 2.35 -1.63 0.11 115.58 117.79 3ffz h ASN 713 Ca 0.33 -0.22 0.00 0.00 -0.55 0.00 0.00 56.30 55.86 3ffz h ASN 713 Cb 0.47 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 38.78 3ffz h ASN 713 CO -0.12 1.18 0.00 0.00 -1.65 0.00 0.00 177.43 176.84 3ffz n ALA 714 N -2.47 2.13 0.02 -0.83 0.00 -0.49 -0.45 120.51 118.42 3ffz n ALA 714 Ca -0.06 -0.07 -0.02 0.00 0.00 0.00 0.00 53.44 53.29 3ffz n ALA 714 Cb 0.99 -1.17 -0.01 0.00 0.00 0.00 0.00 19.45 19.26 3ffz n ALA 714 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 3ffz n ILE 715 N -0.79 1.11 -0.28 0.00 2.08 -0.90 -4.29 119.36 116.29 3ffz n ILE 715 Ca 0.08 0.30 -0.01 0.00 0.56 0.00 0.00 62.75 63.68 3ffz n ILE 715 Cb 0.04 -1.68 0.05 0.00 -0.75 0.00 0.00 39.64 37.30 3ffz n ILE 715 CO 0.00 0.00 0.00 0.50 0.56 0.00 0.00 176.55 177.61 3ffz h LYS 716 N -0.15 -0.06 -0.95 0.38 3.64 -0.56 1.14 116.57 120.00 3ffz h LYS 716 Ca -0.02 0.00 0.09 0.00 -1.27 0.00 0.00 60.65 59.46 3ffz h LYS 716 Cb 0.30 0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 32.06 3ffz h LYS 716 CO -0.01 -0.04 0.61 1.15 -2.27 0.00 0.00 179.45 178.89 3ffz h THR 717 N -0.06 1.00 0.00 1.00 2.02 -1.01 -1.05 112.91 114.80 3ffz h THR 717 Ca 0.32 -0.34 0.00 0.00 0.77 0.00 0.00 66.41 67.16 3ffz h THR 717 Cb 0.58 -0.10 0.00 0.00 -1.74 0.00 0.00 68.15 66.90 3ffz h THR 717 CO -0.83 0.18 0.00 0.00 0.37 0.00 0.00 175.52 175.25 3ffz n ILE 718 N -4.54 0.01 0.46 3.11 3.06 0.38 -1.81 119.36 120.03 3ffz n ILE 718 Ca 0.16 0.00 0.09 0.00 -2.50 0.00 0.00 62.75 60.50 3ffz n ILE 718 Cb 0.28 -0.55 -0.13 0.00 0.54 0.00 0.00 39.64 39.79 3ffz n ILE 718 CO 0.00 0.00 0.00 -0.38 -2.50 0.00 0.00 176.55 173.67 3ffz n ILE 719 N -1.02 0.00 0.01 9.51 5.41 -0.43 -3.43 119.36 129.41 3ffz n ILE 719 Ca 0.21 -0.24 -0.06 0.00 1.00 0.00 0.00 62.75 63.66 3ffz n ILE 719 Cb 0.11 0.56 -0.12 0.00 -0.71 0.00 0.00 39.64 39.48 3ffz n ILE 719 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 3ffz h GLU 720 N 0.00 0.00 -0.04 0.38 4.39 -1.04 0.25 114.58 118.51 3ffz h GLU 720 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3ffz h GLU 720 Cb 0.64 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.29 3ffz h GLU 720 CO 0.00 0.57 0.00 -1.13 -1.16 0.00 0.00 179.01 177.29 3ffz n SER 721 N -3.10 0.82 -0.04 1.42 3.41 -0.75 -1.65 113.62 113.73 3ffz n SER 721 Ca -0.11 -1.41 -0.10 0.00 -0.26 0.00 0.00 58.87 57.00 3ffz n SER 721 Cb 0.98 -0.03 -0.03 0.00 -0.26 0.00 0.00 64.21 64.87 3ffz n SER 721 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 3ffz n LYS 722 N -0.30 0.23 -0.01 4.33 0.00 -1.16 -4.69 118.16 116.56 3ffz n LYS 722 Ca 0.18 0.10 -0.12 0.00 0.00 0.00 0.00 58.31 58.47 3ffz n LYS 722 Cb 0.22 -0.89 -0.07 0.00 0.00 0.00 0.00 35.03 34.30 3ffz n LYS 722 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.40 176.48 3ffz h TYR 723 N -0.40 0.11 -0.01 5.64 -0.00 -0.62 -3.14 116.97 118.55 3ffz h TYR 723 Ca -0.22 -0.01 -0.70 0.00 -0.00 0.00 0.00 58.73 57.80 3ffz h TYR 723 Cb 1.05 -0.03 -0.03 0.00 -0.00 0.00 0.00 36.73 37.73 3ffz h TYR 723 CO -0.07 0.26 3.29 0.09 -0.00 0.00 0.00 178.16 181.73 3ffz n ASN 724 N -4.93 4.94 -0.60 -2.11 3.02 -0.66 -3.15 115.26 111.77 3ffz n ASN 724 Ca -0.06 -2.78 -0.03 0.00 -0.03 0.00 0.00 54.58 51.68 3ffz n ASN 724 Cb 0.13 -1.64 -0.03 0.00 -0.61 0.00 0.00 39.78 37.63 3ffz n ASN 724 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 3ffz n SER 725 N 5.54 -0.36 -4.16 6.41 2.88 -1.19 -4.72 113.62 118.02 3ffz n SER 725 Ca 0.58 -0.97 -0.28 0.00 -1.33 0.00 0.00 58.87 56.86 3ffz n SER 725 Cb 0.36 0.11 -0.16 0.00 -0.75 0.00 0.00 64.21 63.76 3ffz n SER 725 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 3ffz s TYR 726 N 0.00 2.02 -0.27 0.66 2.02 -1.19 -5.06 117.35 115.54 3ffz s TYR 726 Ca 0.00 -0.68 -0.28 0.00 -0.37 0.00 0.00 57.07 55.73 3ffz s TYR 726 Cb 0.00 -1.37 -0.03 0.00 -0.40 0.00 0.00 41.96 40.16 3ffz s TYR 726 CO 0.00 -0.26 1.89 0.95 -1.57 0.00 0.00 175.55 176.56 3ffz s THR 727 N 0.19 3.37 0.00 -0.71 -4.23 -1.26 -4.45 115.64 108.54 3ffz s THR 727 Ca -0.09 0.38 0.00 0.00 -1.18 0.00 0.00 61.69 60.80 3ffz s THR 727 Cb -0.14 -3.46 0.00 0.00 1.34 0.00 0.00 72.50 70.24 3ffz s THR 727 CO 0.04 -0.27 0.00 -0.11 -0.54 0.00 0.00 174.62 173.74 3ffz n LEU 728 N 10.23 0.00 -0.05 4.79 0.00 -1.26 0.21 117.00 130.93 3ffz n LEU 728 Ca 0.24 0.00 -0.15 0.00 0.00 0.00 0.00 56.01 56.10 3ffz n LEU 728 Cb 0.46 0.00 -0.07 0.00 0.00 0.00 0.00 43.42 43.81 3ffz n LEU 728 CO 0.67 0.00 0.46 -0.33 0.00 0.00 0.00 177.39 178.19 3ffz h GLU 729 N 0.00 0.54 -0.01 1.96 5.08 -1.99 -3.08 114.58 117.08 3ffz h GLU 729 Ca 0.00 -0.37 -0.11 0.00 -1.00 0.00 0.00 59.36 57.88 3ffz h GLU 729 Cb 0.00 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.29 3ffz h GLU 729 CO 0.00 0.98 -0.52 1.49 -1.00 0.00 0.00 179.01 179.97 3ffz h GLU 730 N 0.18 0.02 -0.11 2.33 4.81 0.22 -2.95 114.58 119.08 3ffz h GLU 730 Ca -0.00 -0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.25 3ffz h GLU 730 Cb 0.99 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.37 3ffz h GLU 730 CO 0.08 0.53 0.26 -0.22 -0.73 0.00 0.00 179.01 178.94 3ffz h LYS 731 N 0.02 0.00 -4.69 1.92 3.64 -1.38 -3.34 116.57 112.73 3ffz h LYS 731 Ca -0.00 0.00 -0.73 0.00 -1.27 0.00 0.00 60.65 58.64 3ffz h LYS 731 Cb 0.92 0.00 -0.15 0.00 -0.41 0.00 0.00 32.23 32.59 3ffz h LYS 731 CO 0.07 0.00 1.67 0.09 -2.27 0.00 0.00 179.45 179.01 3ffz n ASN 732 N -3.28 5.11 -3.71 4.20 4.13 -1.12 -4.87 115.26 115.73 3ffz n ASN 732 Ca 0.00 -2.99 -0.30 0.00 1.68 0.00 0.00 54.58 52.98 3ffz n ASN 732 Cb 0.35 -1.59 -0.14 0.00 -1.54 0.00 0.00 39.78 36.86 3ffz n ASN 732 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 3ffz s GLU 733 N 1.84 0.98 -0.60 3.52 0.41 -1.26 -5.05 118.70 118.55 3ffz s GLU 733 Ca 0.44 -1.54 -0.06 0.00 -0.41 0.00 0.00 54.97 53.41 3ffz s GLU 733 Cb 0.01 -2.13 -0.05 0.00 -1.78 0.00 0.00 34.13 30.18 3ffz s GLU 733 CO 0.01 -1.08 1.74 1.28 -0.49 0.00 0.00 175.26 176.72 3ffz n LEU 734 N 4.18 3.24 0.00 1.80 4.77 -1.26 -3.52 117.00 126.21 3ffz n LEU 734 Ca 0.04 -2.27 0.00 0.00 -0.03 0.00 0.00 56.01 53.75 3ffz n LEU 734 Cb 0.38 -0.90 0.00 0.00 -2.33 0.00 0.00 43.42 40.58 3ffz n LEU 734 CO 0.18 -0.09 0.06 0.35 -1.33 0.00 0.00 177.39 176.56 3ffz n THR 735 N 4.64 0.02 -3.01 -5.08 -2.24 -1.26 -4.91 114.28 102.43 3ffz n THR 735 Ca 0.31 -0.07 -0.41 0.00 -2.27 0.00 0.00 64.05 61.60 3ffz n THR 735 Cb 0.11 1.75 0.00 0.00 -2.10 0.00 0.00 70.33 70.10 3ffz n THR 735 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3ffz n ASN 736 N -0.01 6.23 0.08 3.42 4.05 -1.23 -4.76 115.26 123.05 3ffz n ASN 736 Ca 0.00 -3.45 0.11 0.00 0.45 0.00 0.00 54.58 51.69 3ffz n ASN 736 Cb 0.25 -1.19 0.44 0.00 1.23 0.00 0.00 39.78 40.51 3ffz n ASN 736 CO 0.00 0.00 0.00 1.17 -3.05 0.00 0.00 177.26 175.38 3ffz n LYS 737 N 1.13 0.14 0.00 1.20 3.00 -1.26 -4.88 118.16 117.49 3ffz n LYS 737 Ca 0.28 0.31 0.00 0.00 -0.00 0.00 0.00 58.31 58.90 3ffz n LYS 737 Cb 0.33 -1.74 0.00 0.00 0.00 0.00 0.00 35.03 33.62 3ffz n LYS 737 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.40 178.38 3ffz n TYR 738 N -2.00 0.00 0.00 5.64 9.36 -1.26 -3.76 117.16 125.13 3ffz n TYR 738 Ca 0.03 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.25 3ffz n TYR 738 Cb 0.26 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 38.97 3ffz n TYR 738 CO 0.00 0.00 0.00 -3.47 0.22 0.00 0.00 176.86 173.61 3ffz n ASP 739 N 3.85 0.00 -4.77 2.98 2.03 -1.26 -2.88 116.55 116.51 3ffz n ASP 739 Ca 0.00 0.38 -0.40 0.00 0.52 0.00 0.00 54.79 55.29 3ffz n ASP 739 Cb 0.00 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.37 3ffz n ASP 739 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 3ffz s ILE 740 N -0.77 3.00 0.00 5.18 1.01 -1.25 -3.12 121.20 125.25 3ffz s ILE 740 Ca 0.00 0.97 0.00 0.00 0.00 0.00 0.00 60.65 61.62 3ffz s ILE 740 Cb 0.00 -3.60 0.00 0.00 0.01 0.00 0.00 42.46 38.87 3ffz s ILE 740 CO 0.00 0.20 0.00 1.17 0.00 0.00 0.00 174.94 176.31 3ffz n LYS 741 N 0.72 0.00 -2.83 2.79 4.81 -1.26 -4.89 118.16 117.50 3ffz n LYS 741 Ca 0.01 0.00 -0.05 0.00 -0.87 0.00 0.00 58.31 57.40 3ffz n LYS 741 Cb 0.44 -3.61 0.02 0.00 0.02 0.00 0.00 35.03 31.89 3ffz n LYS 741 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 3ffz n GLN 742 N -2.00 0.63 0.00 1.64 6.02 -1.18 -4.91 117.38 117.58 3ffz n GLN 742 Ca 0.00 -1.27 0.00 0.00 -0.01 0.00 0.00 57.00 55.72 3ffz n GLN 742 Cb 0.00 1.62 0.00 0.00 1.02 0.00 0.00 30.24 32.88 3ffz n GLN 742 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 3ffz n ILE 743 N -0.38 0.00 0.05 5.09 -0.00 -1.14 -0.41 119.36 122.58 3ffz n ILE 743 Ca -0.04 0.00 0.01 0.00 -0.00 0.00 0.00 62.75 62.71 3ffz n ILE 743 Cb 0.38 0.00 0.03 0.00 -0.00 0.00 0.00 39.64 40.04 3ffz n ILE 743 CO 0.00 0.00 0.00 -0.62 -0.00 0.00 0.00 176.55 175.93 3ffz n GLU 744 N 0.00 0.02 0.00 0.38 -0.58 -1.21 -0.70 120.64 118.55 3ffz n GLU 744 Ca 0.00 0.20 0.00 0.00 -0.42 0.00 0.00 57.16 56.94 3ffz n GLU 744 Cb 0.00 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.37 3ffz n GLU 744 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 3ffz n ASN 745 N -1.20 4.11 0.44 1.62 4.13 0.45 -4.17 115.26 120.63 3ffz n ASN 745 Ca 0.01 0.00 -0.18 0.00 1.68 0.00 0.00 54.58 56.09 3ffz n ASN 745 Cb 0.01 0.18 -0.09 0.00 -1.54 0.00 0.00 39.78 38.34 3ffz n ASN 745 CO 0.00 0.00 0.00 -0.33 0.28 0.00 0.00 177.26 177.21 3ffz h GLU 746 N 0.00 -1.10 0.15 3.52 4.39 -1.34 -0.46 114.58 119.74 3ffz h GLU 746 Ca 0.00 0.07 0.01 0.00 0.34 0.00 0.00 59.36 59.78 3ffz h GLU 746 Cb 0.94 0.25 -0.02 0.00 -0.10 0.00 0.00 28.75 29.82 3ffz h GLU 746 CO 0.00 -0.73 -0.17 -0.07 -1.16 0.00 0.00 179.01 176.88 3ffz h LEU 747 N -1.14 -0.44 -0.42 1.33 3.38 -1.21 0.21 115.31 117.02 3ffz h LEU 747 Ca -0.11 0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.90 3ffz h LEU 747 Cb 0.88 0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.79 3ffz h LEU 747 CO 0.16 -0.25 0.18 -3.20 0.09 0.00 0.00 178.44 175.43 3ffz n ASN 748 N -5.29 0.16 -0.02 -0.43 2.85 -1.17 -0.73 115.26 110.63 3ffz n ASN 748 Ca -0.07 0.46 -0.00 0.00 -0.11 0.00 0.00 54.58 54.85 3ffz n ASN 748 Cb 0.21 -0.45 -0.06 0.00 1.24 0.00 0.00 39.78 40.72 3ffz n ASN 748 CO 0.00 0.00 0.00 1.67 -2.11 0.00 0.00 177.26 176.82 3ffz n GLN 749 N -1.66 1.70 0.19 1.20 7.27 -0.19 -3.96 117.38 121.92 3ffz n GLN 749 Ca -0.00 -0.03 0.04 0.00 0.07 0.00 0.00 57.00 57.07 3ffz n GLN 749 Cb 0.19 -1.20 0.37 0.00 2.41 0.00 0.00 30.24 32.01 3ffz n GLN 749 CO 0.00 0.00 0.00 0.87 0.07 0.00 0.00 177.06 178.00 3ffz h LYS 750 N 0.00 0.00 -0.05 3.69 1.79 0.16 -2.68 116.57 119.48 3ffz h LYS 750 Ca -0.12 0.00 -0.10 0.00 -2.18 0.00 0.00 60.65 58.25 3ffz h LYS 750 Cb 1.01 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.67 3ffz h LYS 750 CO 0.01 0.38 -0.36 -0.24 -1.08 0.00 0.00 179.45 178.16 3ffz h VAL 751 N 0.00 1.43 0.00 0.50 3.04 -1.33 -2.56 116.25 117.34 3ffz h VAL 751 Ca -0.00 -1.80 0.00 0.00 -1.01 0.00 0.00 66.70 63.89 3ffz h VAL 751 Cb 0.74 2.40 0.00 0.00 -2.01 0.00 0.00 31.29 32.42 3ffz h VAL 751 CO 0.05 0.52 0.00 -1.54 -1.01 0.00 0.00 177.57 175.59 3ffz n SER 752 N -4.40 0.00 -0.01 3.17 3.41 -1.09 0.78 113.62 115.48 3ffz n SER 752 Ca -0.09 0.42 -0.13 0.00 -0.26 0.00 0.00 58.87 58.81 3ffz n SER 752 Cb 0.53 -0.44 -0.14 0.00 -0.26 0.00 0.00 64.21 63.90 3ffz n SER 752 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 3ffz n ILE 753 N -1.44 1.68 -0.03 -1.33 2.08 -1.03 -3.80 119.36 115.50 3ffz n ILE 753 Ca 0.01 -0.74 -0.13 0.00 0.56 0.00 0.00 62.75 62.45 3ffz n ILE 753 Cb 0.05 -1.30 -0.08 0.00 -0.75 0.00 0.00 39.64 37.55 3ffz n ILE 753 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 3ffz h ALA 754 N 0.65 0.10 -0.20 -1.39 0.00 0.77 -2.84 119.26 116.35 3ffz h ALA 754 Ca -0.34 -0.24 0.06 0.00 0.00 0.00 0.00 54.91 54.39 3ffz h ALA 754 Cb 2.02 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.78 3ffz h ALA 754 CO 0.08 -0.15 0.40 0.52 0.00 0.00 0.00 179.25 180.11 3ffz h MET 755 N -0.23 0.00 -0.39 0.00 2.86 -0.95 0.14 114.93 116.36 3ffz h MET 755 Ca 0.02 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.54 3ffz h MET 755 Cb 0.48 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.13 3ffz h MET 755 CO 0.01 0.00 -0.24 -0.91 1.06 0.00 0.00 176.91 176.83 3ffz h ASN 756 N 0.00 0.81 0.14 1.22 4.21 -1.60 0.14 115.58 120.50 3ffz h ASN 756 Ca 0.09 -0.30 -0.26 0.00 1.21 0.00 0.00 56.30 57.04 3ffz h ASN 756 Cb 0.89 -0.22 0.02 0.00 -1.12 0.00 0.00 38.32 37.89 3ffz h ASN 756 CO -0.00 1.01 -1.06 0.78 -1.29 0.00 0.00 177.43 176.87 3ffz h ASN 757 N 0.69 0.79 0.32 5.81 2.35 -0.83 -3.17 115.58 121.53 3ffz h ASN 757 Ca 0.09 -0.65 -0.02 0.00 -0.55 0.00 0.00 56.30 55.17 3ffz h ASN 757 Cb 0.76 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.89 3ffz h ASN 757 CO 0.06 1.46 -0.15 0.40 -1.65 0.00 0.00 177.43 177.54 3ffz h ILE 758 N 0.32 0.70 -0.65 2.81 2.04 -1.26 -1.21 117.51 120.26 3ffz h ILE 758 Ca -0.13 -0.18 0.12 0.00 1.00 0.00 0.00 64.86 65.67 3ffz h ILE 758 Cb 1.71 0.80 -0.08 0.00 -0.74 0.00 0.00 36.82 38.51 3ffz h ILE 758 CO 0.20 0.04 0.22 -0.78 0.00 0.00 0.00 178.15 177.83 3ffz h ASP 759 N -0.53 0.17 -0.32 1.72 1.82 -0.83 0.21 116.42 118.66 3ffz h ASP 759 Ca -0.04 0.10 -0.01 0.00 -0.39 0.00 0.00 57.03 56.69 3ffz h ASP 759 Cb 0.39 0.10 -0.02 0.00 0.68 0.00 0.00 39.33 40.49 3ffz h ASP 759 CO 0.07 0.08 0.17 -0.09 -1.61 0.00 0.00 179.24 177.86 3ffz h ARG 760 N 0.37 0.46 0.84 0.28 2.43 -1.50 -0.59 114.38 116.68 3ffz h ARG 760 Ca 0.34 -0.06 -0.04 0.00 -0.81 0.00 0.00 59.98 59.42 3ffz h ARG 760 Cb 0.49 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.95 3ffz h ARG 760 CO -0.37 0.41 -0.47 0.35 -1.51 0.00 0.00 179.97 178.38 3ffz h PHE 761 N 0.39 -1.24 0.43 2.20 3.57 -0.11 -1.01 116.94 121.17 3ffz h PHE 761 Ca 0.11 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.59 3ffz h PHE 761 Cb 0.09 0.43 -0.02 0.00 2.79 0.00 0.00 35.95 39.24 3ffz h PHE 761 CO -0.02 -0.72 -0.41 -0.07 -2.23 0.00 0.00 178.31 174.86 3ffz h LEU 762 N -1.21 -1.10 -1.00 0.59 3.38 -1.03 -1.14 115.31 113.81 3ffz h LEU 762 Ca -0.11 0.09 0.24 0.00 0.09 0.00 0.00 57.88 58.19 3ffz h LEU 762 Cb 0.95 0.37 -0.12 0.00 0.09 0.00 0.00 40.66 41.95 3ffz h LEU 762 CO 0.14 -0.56 0.59 0.74 0.09 0.00 0.00 178.44 179.44 3ffz h THR 763 N -0.85 0.53 -0.27 0.22 2.02 -1.10 0.30 112.91 113.77 3ffz h THR 763 Ca -0.04 -0.20 -0.18 0.00 0.77 0.00 0.00 66.41 66.76 3ffz h THR 763 Cb 0.75 -0.09 -0.00 0.00 -1.74 0.00 0.00 68.15 67.06 3ffz h THR 763 CO -0.05 0.10 -0.55 -0.33 0.37 0.00 0.00 175.52 175.07 3ffz h GLU 764 N 0.58 0.82 -0.71 6.66 5.08 -0.91 -2.02 114.58 124.06 3ffz h GLU 764 Ca 0.64 -0.52 -0.00 0.00 -1.00 0.00 0.00 59.36 58.48 3ffz h GLU 764 Cb 1.22 0.06 -0.03 0.00 0.50 0.00 0.00 28.75 30.50 3ffz h GLU 764 CO -0.48 1.15 0.43 0.77 -1.00 0.00 0.00 179.01 179.88 3ffz h SER 765 N 0.63 0.86 0.51 1.42 0.02 0.72 1.07 113.55 118.78 3ffz h SER 765 Ca 0.01 -0.06 -0.01 0.00 -0.84 0.00 0.00 61.79 60.89 3ffz h SER 765 Cb 1.14 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 63.45 3ffz h SER 765 CO 0.12 0.67 -0.46 -1.28 -1.14 0.00 0.00 176.83 174.73 3ffz h SER 766 N 0.97 -1.25 -0.97 3.07 0.87 -0.41 0.20 113.55 116.02 3ffz h SER 766 Ca 0.26 0.10 0.13 0.00 -1.23 0.00 0.00 61.79 61.04 3ffz h SER 766 Cb -0.03 0.41 -0.08 0.00 -0.44 0.00 0.00 62.40 62.25 3ffz h SER 766 CO -0.05 -0.64 0.62 0.40 -0.53 0.00 0.00 176.83 176.63 3ffz h ILE 767 N -0.97 0.89 -0.39 2.23 1.08 -0.73 0.43 117.51 120.05 3ffz h ILE 767 Ca -0.06 -0.31 0.02 0.00 -0.39 0.00 0.00 64.86 64.12 3ffz h ILE 767 Cb 0.84 -0.10 -0.03 0.00 -3.07 0.00 0.00 36.82 34.46 3ffz h ILE 767 CO -0.04 0.16 0.23 -1.28 -0.69 0.00 0.00 178.15 176.54 3ffz h SER 768 N 0.90 0.38 -0.32 1.72 0.87 0.21 -2.20 113.55 115.12 3ffz h SER 768 Ca 0.49 0.00 0.03 0.00 -1.23 0.00 0.00 61.79 61.08 3ffz h SER 768 Cb 0.57 -0.08 -0.03 0.00 -0.44 0.00 0.00 62.40 62.42 3ffz h SER 768 CO -0.26 0.28 0.14 0.22 -0.53 0.00 0.00 176.83 176.68 3ffz h TYR 769 N 0.48 0.26 -0.79 2.24 3.20 0.15 -1.91 116.97 120.60 3ffz h TYR 769 Ca 0.15 0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.11 3ffz h TYR 769 Cb -0.00 -0.07 -0.05 0.00 1.54 0.00 0.00 36.73 38.14 3ffz h TYR 769 CO -0.07 0.14 0.52 1.25 -1.64 0.00 0.00 178.16 178.36 3ffz h LEU 770 N 0.30 0.73 -0.81 2.82 5.85 -1.04 -0.11 115.31 123.05 3ffz h LEU 770 Ca 0.13 0.01 -0.12 0.00 0.84 0.00 0.00 57.88 58.74 3ffz h LEU 770 Cb 0.07 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 40.94 3ffz h LEU 770 CO -0.11 0.46 -0.49 0.24 -0.34 0.00 0.00 178.44 178.20 3ffz h MET 771 N 0.82 0.25 -0.25 1.25 2.86 -0.94 0.63 114.93 119.56 3ffz h MET 771 Ca 0.35 -0.14 0.01 0.00 -2.06 0.00 0.00 59.70 57.86 3ffz h MET 771 Cb 0.30 0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.95 3ffz h MET 771 CO -0.13 0.69 0.14 -0.22 1.06 0.00 0.00 176.91 178.46 3ffz h LYS 772 N 0.20 0.29 0.00 1.72 3.64 -0.27 0.21 116.57 122.37 3ffz h LYS 772 Ca 0.01 -0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.33 3ffz h LYS 772 Cb 0.94 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.69 3ffz h LYS 772 CO 0.08 0.19 -0.20 -0.84 -2.27 0.00 0.00 179.45 176.40 3ffz h ILE 773 N 0.29 0.36 0.04 2.00 3.07 -1.00 -2.52 117.51 119.76 3ffz h ILE 773 Ca 0.10 -1.42 -0.23 0.00 1.55 0.00 0.00 64.86 64.85 3ffz h ILE 773 Cb -0.00 2.10 -0.02 0.00 -0.27 0.00 0.00 36.82 38.63 3ffz h ILE 773 CO -0.05 0.20 -1.09 0.40 -1.05 0.00 0.00 178.15 176.57 3ffz h ILE 774 N 0.00 1.64 0.00 0.16 1.08 -0.52 -3.05 117.51 116.82 3ffz h ILE 774 Ca -0.00 -3.30 -0.11 0.00 -0.39 0.00 0.00 64.86 61.05 3ffz h ILE 774 Cb 1.09 2.88 -0.02 0.00 -3.07 0.00 0.00 36.82 37.70 3ffz h ILE 774 CO 0.03 0.95 -0.52 0.78 -0.69 0.00 0.00 178.15 178.70 3ffz h ASN 775 N 0.02 0.00 0.15 1.72 2.35 -0.53 -2.84 115.58 116.45 3ffz h ASN 775 Ca -0.05 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.69 3ffz h ASN 775 Cb 1.84 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.21 3ffz h ASN 775 CO 0.15 0.52 -0.07 -0.08 -1.65 0.00 0.00 177.43 176.30 3ffz h GLU 776 N 0.00 -0.20 -0.68 0.81 4.81 -1.48 -2.39 114.58 115.45 3ffz h GLU 776 Ca -0.01 0.01 0.09 0.00 -0.13 0.00 0.00 59.36 59.33 3ffz h GLU 776 Cb 1.14 0.05 -0.07 0.00 0.63 0.00 0.00 28.75 30.49 3ffz h GLU 776 CO 0.07 0.23 0.33 -0.24 -0.73 0.00 0.00 179.01 178.66 3ffz h VAL 777 N -0.88 0.84 0.00 0.32 3.04 -1.62 0.16 116.25 118.10 3ffz h VAL 777 Ca -0.02 -0.19 -0.06 0.00 -1.01 0.00 0.00 66.70 65.41 3ffz h VAL 777 Cb 0.52 0.23 -0.01 0.00 -2.01 0.00 0.00 31.29 30.02 3ffz h VAL 777 CO 0.03 0.10 -0.29 0.07 -1.01 0.00 0.00 177.57 176.48 3ffz h LYS 778 N 0.56 0.00 -0.33 4.17 2.10 -1.58 -0.03 116.57 121.47 3ffz h LYS 778 Ca 0.34 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.99 3ffz h LYS 778 Cb 0.36 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.69 3ffz h LYS 778 CO -0.27 0.29 0.00 1.51 -2.00 0.00 0.00 179.45 178.98 3ffz n ILE 779 N -3.73 0.42 0.00 0.07 0.13 -0.13 -3.32 119.36 112.81 3ffz n ILE 779 Ca -0.01 -0.58 0.00 0.00 -1.10 0.00 0.00 62.75 61.06 3ffz n ILE 779 Cb 0.39 0.62 0.00 0.00 -0.84 0.00 0.00 39.64 39.81 3ffz n ILE 779 CO 0.00 0.00 0.00 -3.20 2.80 0.00 0.00 176.55 176.15 3ffz n ASN 780 N 0.94 0.00 0.28 9.51 2.85 0.36 -4.71 115.26 124.50 3ffz n ASN 780 Ca 0.18 0.00 0.15 0.00 -0.11 0.00 0.00 54.58 54.80 3ffz n ASN 780 Cb 0.46 0.00 0.83 0.00 1.24 0.00 0.00 39.78 42.31 3ffz n ASN 780 CO 0.00 0.00 0.00 0.11 -2.11 0.00 0.00 177.26 175.26 3ffz h LYS 781 N 0.00 0.00 0.00 1.20 1.79 -1.69 0.53 116.57 118.40 3ffz h LYS 781 Ca 0.00 0.00 -0.23 0.00 -2.18 0.00 0.00 60.65 58.24 3ffz h LYS 781 Cb 0.00 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 30.61 3ffz h LYS 781 CO 0.00 0.07 -1.42 -0.07 -1.08 0.00 0.00 179.45 176.95 3ffz h LEU 782 N 0.00 0.00 -0.04 2.94 3.38 -1.25 -2.58 115.31 117.76 3ffz h LEU 782 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 3ffz h LEU 782 Cb 0.27 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.02 3ffz h LEU 782 CO 0.01 0.86 -0.01 -0.09 0.09 0.00 0.00 178.44 179.30 3ffz h ARG 783 N 0.00 0.07 -0.59 1.13 2.43 -1.31 -1.21 114.38 114.90 3ffz h ARG 783 Ca -0.19 -0.03 0.08 0.00 -0.81 0.00 0.00 59.98 59.03 3ffz h ARG 783 Cb 1.82 -0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 31.30 3ffz h ARG 783 CO 0.08 0.41 0.26 1.49 -1.51 0.00 0.00 179.97 180.70 3ffz h GLU 784 N -0.28 0.46 -0.94 0.20 4.81 -1.04 0.11 114.58 117.90 3ffz h GLU 784 Ca 0.01 -0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.24 3ffz h GLU 784 Cb 0.38 -0.10 -0.05 0.00 0.63 0.00 0.00 28.75 29.61 3ffz h GLU 784 CO 0.00 0.30 0.62 -0.92 -0.73 0.00 0.00 179.01 178.29 3ffz h TYR 785 N 0.47 1.15 -0.12 0.92 3.20 -1.28 0.16 116.97 121.48 3ffz h TYR 785 Ca 0.29 0.03 -0.17 0.00 3.14 0.00 0.00 58.73 62.01 3ffz h TYR 785 Cb 0.29 -0.39 0.01 0.00 1.54 0.00 0.00 36.73 38.18 3ffz h TYR 785 CO -0.14 0.68 -0.60 -0.44 -1.64 0.00 0.00 178.16 176.03 3ffz h ASP 786 N 1.21 0.73 -0.16 -2.11 3.32 0.01 0.18 116.42 119.60 3ffz h ASP 786 Ca 0.37 -0.64 -0.01 0.00 0.02 0.00 0.00 57.03 56.77 3ffz h ASP 786 Cb -0.03 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.30 3ffz h ASP 786 CO -0.10 1.25 0.09 -0.08 -1.72 0.00 0.00 179.24 178.68 3ffz h GLU 787 N 0.26 0.26 0.01 3.56 4.57 -0.52 -0.10 114.58 122.63 3ffz h GLU 787 Ca -0.04 -0.02 -0.24 0.00 -1.18 0.00 0.00 59.36 57.88 3ffz h GLU 787 Cb 1.24 -0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 29.74 3ffz h GLU 787 CO 0.12 0.21 -1.22 -0.91 -1.18 0.00 0.00 179.01 176.04 3ffz h ASN 788 N 0.27 0.03 -0.10 1.04 -0.26 -0.50 -2.83 115.58 113.22 3ffz h ASN 788 Ca 0.07 -0.04 -0.13 0.00 -0.56 0.00 0.00 56.30 55.65 3ffz h ASN 788 Cb 0.04 -0.01 -0.01 0.00 -1.06 0.00 0.00 38.32 37.28 3ffz h ASN 788 CO -0.01 1.03 -0.36 0.58 -1.06 0.00 0.00 177.43 177.61 3ffz h VAL 789 N 0.00 1.29 0.51 2.81 2.07 0.32 -2.57 116.25 120.68 3ffz h VAL 789 Ca -0.10 -1.51 -0.02 0.00 0.82 0.00 0.00 66.70 65.89 3ffz h VAL 789 Cb 1.85 1.48 0.00 0.00 -1.52 0.00 0.00 31.29 33.10 3ffz h VAL 789 CO 0.12 0.48 -0.24 0.50 0.02 0.00 0.00 177.57 178.45 3ffz h LYS 790 N 0.51 -0.65 -0.86 1.57 3.64 -1.11 -1.22 116.57 118.45 3ffz h LYS 790 Ca 0.05 0.04 0.17 0.00 -1.27 0.00 0.00 60.65 59.65 3ffz h LYS 790 Cb 0.86 0.15 -0.16 0.00 -0.41 0.00 0.00 32.23 32.67 3ffz h LYS 790 CO 0.07 -0.35 -0.20 1.15 -2.27 0.00 0.00 179.45 177.85 3ffz h THR 791 N -0.91 0.15 0.70 1.00 2.02 -1.44 0.20 112.91 114.64 3ffz h THR 791 Ca -0.07 -0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.08 3ffz h THR 791 Cb 0.60 0.14 0.01 0.00 -1.74 0.00 0.00 68.15 67.16 3ffz h THR 791 CO 0.11 0.00 -0.34 0.22 0.37 0.00 0.00 175.52 175.89 3ffz h TYR 792 N 0.00 -0.87 -0.18 3.16 3.20 -1.34 -2.84 116.97 118.11 3ffz h TYR 792 Ca 0.41 -0.02 0.04 0.00 3.14 0.00 0.00 58.73 62.31 3ffz h TYR 792 Cb 0.64 0.29 -0.04 0.00 1.54 0.00 0.00 36.73 39.15 3ffz h TYR 792 CO -0.66 -0.52 -0.10 -0.07 -1.64 0.00 0.00 178.16 175.18 3ffz h LEU 793 N -1.13 -0.31 -2.30 2.82 3.38 -0.50 0.19 115.31 117.46 3ffz h LEU 793 Ca -0.10 0.07 0.04 0.00 0.09 0.00 0.00 57.88 57.99 3ffz h LEU 793 Cb 0.75 0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.67 3ffz h LEU 793 CO 0.16 -0.13 0.17 0.25 0.09 0.00 0.00 178.44 178.98 3ffz h LEU 794 N -0.08 0.00 0.00 1.67 5.85 -0.71 -1.12 115.31 120.91 3ffz h LEU 794 Ca 0.10 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.77 3ffz h LEU 794 Cb 0.23 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.25 3ffz h LEU 794 CO -0.23 0.00 -0.32 -1.13 -0.34 0.00 0.00 178.44 176.42 3ffz h ASN 795 N 0.00 0.00 -1.30 1.25 -0.73 -1.00 -3.24 115.58 110.56 3ffz h ASN 795 Ca 0.06 -0.47 0.44 0.00 1.87 0.00 0.00 56.30 58.20 3ffz h ASN 795 Cb 0.40 0.00 -0.13 0.00 0.27 0.00 0.00 38.32 38.86 3ffz h ASN 795 CO -0.00 0.92 0.83 0.22 -0.37 0.00 0.00 177.43 179.03 3ffz h TYR 796 N -1.00 0.55 0.56 0.67 3.20 0.14 0.84 116.97 121.93 3ffz h TYR 796 Ca -0.07 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.80 3ffz h TYR 796 Cb 0.70 -0.13 0.01 0.00 1.54 0.00 0.00 36.73 38.84 3ffz h TYR 796 CO 0.09 -0.23 -0.27 0.82 -1.64 0.00 0.00 178.16 176.93 3ffz h ILE 797 N 0.07 0.00 -0.84 1.81 2.04 -1.32 -1.98 117.51 117.30 3ffz h ILE 797 Ca 0.83 -0.02 0.07 0.00 1.00 0.00 0.00 64.86 66.75 3ffz h ILE 797 Cb 2.57 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 38.60 3ffz h ILE 797 CO -0.45 0.00 0.55 0.16 0.00 0.00 0.00 178.15 178.40 3ffz h ILE 798 N -0.77 1.03 -0.02 -0.67 3.07 -0.97 0.58 117.51 119.76 3ffz h ILE 798 Ca -0.08 -0.31 0.01 0.00 1.55 0.00 0.00 64.86 66.03 3ffz h ILE 798 Cb 0.58 0.05 -0.00 0.00 -0.27 0.00 0.00 36.82 37.17 3ffz h ILE 798 CO 0.13 0.16 0.03 1.56 -1.05 0.00 0.00 178.15 178.98 3ffz h GLN 799 N 0.90 0.00 -0.21 0.16 1.08 -0.85 0.20 115.11 116.38 3ffz h GLN 799 Ca 0.37 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.57 3ffz h GLN 799 Cb 0.27 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.70 3ffz h GLN 799 CO -0.14 0.00 0.00 0.72 -0.95 0.00 0.00 178.83 178.46 3ffz n HIS 800 N -3.70 0.42 -0.05 2.96 8.25 0.13 -4.82 115.22 118.43 3ffz n HIS 800 Ca -0.02 -0.64 -0.05 0.00 -0.26 0.00 0.00 57.72 56.75 3ffz n HIS 800 Cb 0.12 -0.11 -0.03 0.00 1.12 0.00 0.00 29.99 31.08 3ffz n HIS 800 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 3ffz h GLY 801 N 1.30 -1.64 -5.45 -1.41 0.00 0.32 -2.28 103.07 93.90 3ffz h GLY 801 Ca 0.00 0.80 -0.43 0.00 0.00 0.00 0.00 47.33 47.70 3ffz h GLY 801 CO 0.05 -0.54 2.74 -1.14 0.00 0.00 0.00 176.54 177.65 3ffz n SER 802 N -3.58 5.20 0.00 0.19 3.41 -1.26 -0.39 113.62 117.19 3ffz n SER 802 Ca -0.01 -2.37 0.00 0.00 -0.26 0.00 0.00 58.87 56.23 3ffz n SER 802 Cb 0.11 -1.15 0.00 0.00 -0.26 0.00 0.00 64.21 62.91 3ffz n SER 802 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 3ffz n ILE 803 N 4.24 0.00 -2.62 -1.33 5.41 -0.87 -4.92 119.36 119.28 3ffz n ILE 803 Ca 0.48 0.00 -0.02 0.00 1.00 0.00 0.00 62.75 64.21 3ffz n ILE 803 Cb 0.16 0.00 0.09 0.00 -0.71 0.00 0.00 39.64 39.18 3ffz n ILE 803 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3ffz n LEU 804 N -0.17 -0.76 -0.43 1.39 -0.00 -0.02 -4.27 117.00 112.75 3ffz n LEU 804 Ca 0.00 -3.00 0.36 0.00 -0.00 0.00 0.00 56.01 53.37 3ffz n LEU 804 Cb 0.00 0.15 0.69 0.00 -0.00 0.00 0.00 43.42 44.26 3ffz n LEU 804 CO 0.00 1.52 1.31 1.23 -0.00 0.00 0.00 177.39 181.45 3ffz h GLY 805 N 1.19 0.60 0.62 1.47 0.00 -0.99 -2.55 103.07 103.42 3ffz h GLY 805 Ca -0.40 -0.07 -0.03 0.00 0.00 0.00 0.00 47.33 46.83 3ffz h GLY 805 CO -0.12 -0.13 -0.32 0.83 0.00 0.00 0.00 176.54 176.79 3ffz h GLU 806 N 0.11 -0.83 0.00 4.80 5.08 -1.95 -3.26 114.58 118.53 3ffz h GLU 806 Ca 0.71 0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 59.10 3ffz h GLU 806 Cb 2.47 0.19 -0.00 0.00 0.50 0.00 0.00 28.75 31.90 3ffz h GLU 806 CO -0.18 -0.55 -0.11 0.77 -1.00 0.00 0.00 179.01 177.94 3ffz h SER 807 N -0.86 0.00 -0.56 1.42 0.02 -1.88 -3.37 113.55 108.32 3ffz h SER 807 Ca -0.08 0.00 0.17 0.00 -0.84 0.00 0.00 61.79 61.04 3ffz h SER 807 Cb 0.67 0.00 -0.10 0.00 0.14 0.00 0.00 62.40 63.11 3ffz h SER 807 CO 0.13 0.11 0.07 1.67 -1.14 0.00 0.00 176.83 177.67 3ffz n GLN 808 N -3.43 -0.04 -0.06 3.45 7.27 -1.10 -0.09 117.38 123.38 3ffz n GLN 808 Ca -0.01 0.82 -0.07 0.00 0.07 0.00 0.00 57.00 57.81 3ffz n GLN 808 Cb 0.27 -1.35 0.11 0.00 2.41 0.00 0.00 30.24 31.69 3ffz n GLN 808 CO 0.00 0.00 0.00 -0.56 0.07 0.00 0.00 177.06 176.57 3ffz h GLN 809 N 0.00 0.70 0.00 3.69 -0.00 -1.83 -2.95 115.11 114.72 3ffz h GLN 809 Ca 0.37 -0.29 -0.08 0.00 -0.00 0.00 0.00 58.65 58.66 3ffz h GLN 809 Cb 0.82 -0.03 -0.01 0.00 -0.00 0.00 0.00 27.48 28.26 3ffz h GLN 809 CO -0.51 0.88 -0.37 1.49 -0.00 0.00 0.00 178.83 180.32 3ffz h GLU 810 N 0.61 0.00 -0.00 0.06 4.81 -0.80 -3.00 114.58 116.26 3ffz h GLU 810 Ca 0.08 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.31 3ffz h GLU 810 Cb 0.74 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.12 3ffz h GLU 810 CO 0.06 0.37 -0.01 -0.07 -0.73 0.00 0.00 179.01 178.63 3ffz h LEU 811 N 0.00 0.01 -1.44 1.64 3.38 -1.42 -0.14 115.31 117.35 3ffz h LEU 811 Ca -0.00 -0.69 0.10 0.00 0.09 0.00 0.00 57.88 57.38 3ffz h LEU 811 Cb 1.21 -0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.90 3ffz h LEU 811 CO 0.05 0.71 0.49 0.78 0.09 0.00 0.00 178.44 180.56 3ffz h ASN 812 N -0.68 0.56 1.41 -0.43 -0.26 -1.58 0.74 115.58 115.34 3ffz h ASN 812 Ca -0.00 0.02 -0.12 0.00 -0.56 0.00 0.00 56.30 55.63 3ffz h ASN 812 Cb 0.71 -0.10 -0.02 0.00 -1.06 0.00 0.00 38.32 37.85 3ffz h ASN 812 CO 0.00 0.33 -0.59 0.77 -1.06 0.00 0.00 177.43 176.88 3ffz h SER 813 N 0.62 0.00 0.12 5.81 4.64 -1.50 -2.20 113.55 121.04 3ffz h SER 813 Ca 0.35 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.49 3ffz h SER 813 Cb 0.53 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.64 3ffz h SER 813 CO -0.13 0.59 -0.79 -0.03 -0.87 0.00 0.00 176.83 175.60 3ffz h MET 814 N 0.00 0.33 0.09 4.77 1.85 0.70 -2.05 114.93 120.63 3ffz h MET 814 Ca -0.01 -0.51 0.02 0.00 -0.61 0.00 0.00 59.70 58.59 3ffz h MET 814 Cb 1.46 0.18 -0.05 0.00 0.43 0.00 0.00 31.60 33.62 3ffz h MET 814 CO 0.08 1.22 -0.40 0.28 -0.40 0.00 0.00 176.91 177.69 3ffz h VAL 815 N -0.31 0.18 -0.78 -5.77 2.07 0.39 0.31 116.25 112.33 3ffz h VAL 815 Ca -0.13 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.39 3ffz h VAL 815 Cb 1.59 0.18 -0.04 0.00 -1.52 0.00 0.00 31.29 31.51 3ffz h VAL 815 CO 0.15 0.00 0.49 0.74 0.02 0.00 0.00 177.57 178.97 3ffz h THR 816 N -0.62 1.21 0.15 2.57 2.02 -1.49 -0.94 112.91 115.81 3ffz h THR 816 Ca 0.03 -0.43 -0.01 0.00 0.77 0.00 0.00 66.41 66.77 3ffz h THR 816 Cb 0.66 0.08 0.00 0.00 -1.74 0.00 0.00 68.15 67.15 3ffz h THR 816 CO -0.25 0.21 -0.07 0.44 0.37 0.00 0.00 175.52 176.22 3ffz h ASP 817 N 1.07 -0.17 -0.38 4.18 3.32 -0.67 -2.71 116.42 121.06 3ffz h ASP 817 Ca 0.28 -0.30 -0.05 0.00 0.02 0.00 0.00 57.03 56.98 3ffz h ASP 817 Cb -0.08 0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.49 3ffz h ASP 817 CO -0.06 0.23 0.07 0.71 -1.72 0.00 0.00 179.24 178.47 3ffz h THR 818 N -0.62 1.22 0.00 0.35 1.35 -0.33 -2.22 112.91 112.65 3ffz h THR 818 Ca -0.02 -0.82 0.00 0.00 -0.55 0.00 0.00 66.41 65.02 3ffz h THR 818 Cb 0.46 0.80 0.00 0.00 -1.73 0.00 0.00 68.15 67.68 3ffz h THR 818 CO 0.03 0.29 0.00 0.18 -0.25 0.00 0.00 175.52 175.78 3ffz n LEU 819 N -4.27 0.00 -0.97 3.87 4.77 -0.36 -2.50 117.00 117.54 3ffz n LEU 819 Ca 0.03 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 56.12 3ffz n LEU 819 Cb 0.24 0.00 0.15 0.00 -2.33 0.00 0.00 43.42 41.48 3ffz n LEU 819 CO 0.40 0.00 0.64 -3.20 -1.33 0.00 0.00 177.39 173.89 3ffz n ASN 820 N -0.86 3.08 -4.42 -1.43 5.15 -0.84 -4.88 115.26 111.06 3ffz n ASN 820 Ca 0.17 -1.93 -0.27 0.00 -0.60 0.00 0.00 54.58 51.95 3ffz n ASN 820 Cb 0.08 -0.13 -0.12 0.00 -0.53 0.00 0.00 39.78 39.08 3ffz n ASN 820 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 3ffz s ASN 821 N -1.57 3.44 0.05 1.20 0.02 -1.04 -5.10 114.94 111.94 3ffz s ASN 821 Ca 0.31 -0.84 -0.05 0.00 -1.02 0.00 0.00 52.86 51.26 3ffz s ASN 821 Cb 0.20 -0.26 -0.02 0.00 0.02 0.00 0.00 41.25 41.19 3ffz s ASN 821 CO 0.28 0.13 0.09 -0.94 0.02 0.00 0.00 177.10 176.68 3ffz s SER 822 N -2.57 0.23 0.12 -1.22 1.04 -1.26 -4.98 113.70 105.06 3ffz s SER 822 Ca 0.20 -0.67 -0.35 0.00 0.48 0.00 0.00 55.95 55.61 3ffz s SER 822 Cb -0.08 0.25 -0.16 0.00 0.10 0.00 0.00 66.02 66.12 3ffz s SER 822 CO 0.09 -0.58 1.32 -0.38 0.98 0.00 0.00 173.24 174.67 3ffz n ILE 823 N 0.43 0.29 -2.63 -1.02 2.08 -1.26 -4.92 119.36 112.33 3ffz n ILE 823 Ca -0.17 -0.07 -0.37 0.00 0.56 0.00 0.00 62.75 62.70 3ffz n ILE 823 Cb 0.60 -0.93 -0.05 0.00 -0.75 0.00 0.00 39.64 38.51 3ffz n ILE 823 CO 0.00 0.00 0.00 -2.16 0.56 0.00 0.00 176.55 174.95 3ffz s PRO 824 N 0.25 4.32 -0.33 0.38 0.04 -1.26 -5.03 135.00 133.36 3ffz s PRO 824 Ca 0.80 1.45 -0.04 0.00 0.04 0.00 0.00 61.00 63.25 3ffz s PRO 824 Cb -0.88 -2.63 0.05 0.00 0.04 0.00 0.00 34.50 31.07 3ffz s PRO 824 CO 0.47 0.01 0.08 0.12 0.04 0.00 0.00 177.00 177.72 3ffz s PHE 825 N -1.65 3.29 -0.17 0.56 5.36 -1.26 -4.68 117.98 119.43 3ffz s PHE 825 Ca 0.55 -1.67 -0.37 0.00 -0.96 0.00 0.00 56.93 54.47 3ffz s PHE 825 Cb -0.21 -2.30 -0.14 0.00 -0.34 0.00 0.00 43.02 40.03 3ffz s PHE 825 CO 0.26 -0.78 1.76 1.63 -1.46 0.00 0.00 175.22 176.64 3ffz n LYS 826 N 4.73 1.58 -2.87 10.12 5.02 0.28 -4.92 118.16 132.10 3ffz n LYS 826 Ca -0.12 0.58 -0.42 0.00 -2.02 0.00 0.00 58.31 56.33 3ffz n LYS 826 Cb 0.44 -2.33 -0.04 0.00 -0.02 0.00 0.00 35.03 33.08 3ffz n LYS 826 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3ffz s LEU 827 N 3.44 4.05 -0.27 -0.35 1.43 -1.26 -4.77 118.68 120.95 3ffz s LEU 827 Ca 0.95 0.43 -0.27 0.00 -1.03 0.00 0.00 54.13 54.20 3ffz s LEU 827 Cb -0.90 -3.16 0.01 0.00 0.03 0.00 0.00 46.19 42.16 3ffz s LEU 827 CO 0.58 -0.83 0.98 -0.44 0.23 0.00 0.00 176.35 176.87 3ffz s SER 828 N 1.91 6.94 -0.16 2.29 0.01 -1.26 -5.04 113.70 118.39 3ffz s SER 828 Ca 0.35 1.12 -0.10 0.00 1.31 0.00 0.00 55.95 58.63 3ffz s SER 828 Cb -0.12 -2.50 -0.05 0.00 0.21 0.00 0.00 66.02 63.56 3ffz s SER 828 CO 0.19 -0.70 0.18 -0.55 0.41 0.00 0.00 173.24 172.76 3ffz s SER 829 N 1.42 6.34 0.50 2.44 0.15 -1.26 -5.07 113.70 118.22 3ffz s SER 829 Ca 0.41 0.39 -0.23 0.00 0.70 0.00 0.00 55.95 57.22 3ffz s SER 829 Cb -0.14 -2.11 -0.06 0.00 -1.71 0.00 0.00 66.02 62.00 3ffz s SER 829 CO 0.10 0.24 1.36 -0.47 1.20 0.00 0.00 173.24 175.68 3ffz s TYR 830 N -0.13 2.40 0.00 3.44 5.04 -1.26 -3.56 117.35 123.28 3ffz s TYR 830 Ca 0.12 1.35 0.00 0.00 -2.44 0.00 0.00 57.07 56.11 3ffz s TYR 830 Cb -0.12 -3.80 0.00 0.00 0.35 0.00 0.00 41.96 38.39 3ffz s TYR 830 CO 0.02 -2.78 0.00 2.41 -1.34 0.00 0.00 175.55 173.85 3ffz n THR 831 N -0.68 0.00 -0.40 4.34 -1.04 -1.26 -4.88 114.28 110.36 3ffz n THR 831 Ca 0.08 0.00 -0.27 0.00 -2.04 0.00 0.00 64.05 61.82 3ffz n THR 831 Cb 0.44 0.00 0.24 0.00 -1.82 0.00 0.00 70.33 69.19 3ffz n THR 831 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 3ffz n ASP 832 N -0.13 -3.25 -4.68 8.00 5.75 -1.23 -4.78 116.55 116.22 3ffz n ASP 832 Ca 0.00 -0.54 -0.46 0.00 -0.01 0.00 0.00 54.79 53.78 3ffz n ASP 832 Cb 0.17 -0.98 -0.04 0.00 -1.03 0.00 0.00 41.12 39.24 3ffz n ASP 832 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 3ffz n ASP 833 N -3.99 3.46 -4.44 -1.12 8.00 -1.26 -4.77 116.55 112.43 3ffz n ASP 833 Ca 0.08 1.01 -0.49 0.00 0.71 0.00 0.00 54.79 56.11 3ffz n ASP 833 Cb 0.53 -1.43 -0.09 0.00 -0.02 0.00 0.00 41.12 40.11 3ffz n ASP 833 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3ffz n LYS 834 N 5.34 0.71 -4.29 -1.24 5.02 -1.26 -4.94 118.16 117.49 3ffz n LYS 834 Ca 0.20 0.15 -0.31 0.00 -2.02 0.00 0.00 58.31 56.33 3ffz n LYS 834 Cb 0.31 -2.26 -0.10 0.00 -0.02 0.00 0.00 35.03 32.96 3ffz n LYS 834 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3ffz s ILE 835 N 8.04 3.56 -0.03 -0.18 -1.09 -1.26 -5.02 121.20 125.23 3ffz s ILE 835 Ca 1.14 -1.06 -0.04 0.00 -2.23 0.00 0.00 60.65 58.46 3ffz s ILE 835 Cb -0.94 -2.63 -0.01 0.00 -1.58 0.00 0.00 42.46 37.29 3ffz s ILE 835 CO 0.49 0.20 -0.08 0.18 -1.23 0.00 0.00 174.94 174.50 3ffz n LEU 836 N 0.95 0.53 0.00 2.97 4.32 -1.26 -4.93 117.00 119.58 3ffz n LEU 836 Ca -0.14 0.09 0.00 0.00 -0.02 0.00 0.00 56.01 55.94 3ffz n LEU 836 Cb 0.52 -0.45 0.00 0.00 -1.62 0.00 0.00 43.42 41.87 3ffz n LEU 836 CO 0.34 -0.47 0.00 0.00 -1.22 0.00 0.00 177.39 176.04 3ffz n ILE 837 N -3.02 0.00 0.00 -0.08 0.13 -1.26 -4.34 119.36 110.79 3ffz n ILE 837 Ca -0.03 0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.62 3ffz n ILE 837 Cb 0.12 0.00 0.00 0.00 -0.84 0.00 0.00 39.64 38.92 3ffz n ILE 837 CO 0.00 0.00 0.00 -1.54 2.80 0.00 0.00 176.55 177.81 3ffz n SER 838 N 0.02 0.00 0.17 9.51 3.41 -1.26 -4.89 113.62 120.58 3ffz n SER 838 Ca 0.00 0.00 0.17 0.00 -0.26 0.00 0.00 58.87 58.78 3ffz n SER 838 Cb 0.00 0.00 0.79 0.00 -0.26 0.00 0.00 64.21 64.74 3ffz n SER 838 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 175.04 176.76 3ffz h TYR 839 N 0.00 0.00 -0.59 7.33 0.05 -1.84 -1.98 116.97 119.95 3ffz h TYR 839 Ca 0.00 0.00 0.11 0.00 0.05 0.00 0.00 58.73 58.89 3ffz h TYR 839 Cb 0.00 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 37.71 3ffz h TYR 839 CO 0.00 0.00 0.40 0.35 -1.05 0.00 0.00 178.16 177.86 3ffz h PHE 840 N 0.00 0.38 -0.22 4.88 -0.00 -1.93 -1.46 116.94 118.59 3ffz h PHE 840 Ca 0.11 0.01 -0.05 0.00 -0.00 0.00 0.00 57.97 58.04 3ffz h PHE 840 Cb 0.58 -0.12 -0.03 0.00 -0.00 0.00 0.00 35.95 36.37 3ffz h PHE 840 CO 0.00 0.18 -0.04 0.09 -0.00 0.00 0.00 178.31 178.53 3ffz n ASN 841 N -4.46 3.08 -0.21 0.41 3.02 -0.75 -4.59 115.26 111.76 3ffz n ASN 841 Ca 0.10 -3.30 -0.01 0.00 -0.03 0.00 0.00 54.58 51.35 3ffz n ASN 841 Cb 0.40 -0.55 0.22 0.00 -0.61 0.00 0.00 39.78 39.24 3ffz n ASN 841 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 3ffz h LYS 842 N 1.18 0.98 0.00 3.52 3.64 -1.21 -3.25 116.57 121.43 3ffz h LYS 842 Ca 0.07 -0.09 -0.36 0.00 -1.27 0.00 0.00 60.65 58.99 3ffz h LYS 842 Cb 1.40 -0.20 -0.07 0.00 -0.41 0.00 0.00 32.23 32.96 3ffz h LYS 842 CO 0.22 0.70 -2.30 1.19 -2.27 0.00 0.00 179.45 176.99 3ffz n PHE 843 N -4.38 0.17 -3.56 1.91 3.01 -1.26 -4.76 117.46 108.58 3ffz n PHE 843 Ca 0.07 0.06 -0.06 0.00 1.01 0.00 0.00 57.45 58.53 3ffz n PHE 843 Cb 0.08 -1.03 -0.02 0.00 -0.01 0.00 0.00 39.48 38.50 3ffz n PHE 843 CO 0.00 0.00 0.00 -0.59 1.01 0.00 0.00 176.76 177.18 3ffz s PHE 844 N -2.51 -0.22 -0.22 1.38 -0.12 -1.23 0.98 117.98 116.04 3ffz s PHE 844 Ca -0.13 0.18 -0.28 0.00 -0.05 0.00 0.00 56.93 56.64 3ffz s PHE 844 Cb 0.07 0.52 -0.05 0.00 -0.63 0.00 0.00 43.02 42.93 3ffz s PHE 844 CO 0.79 -0.32 2.14 0.21 -0.05 0.00 0.00 175.22 177.99 3ffz s LYS 845 N -2.46 3.21 -0.12 1.99 2.47 -1.26 -4.44 119.74 119.13 3ffz s LYS 845 Ca 0.07 1.96 -0.04 0.00 -1.56 0.00 0.00 55.97 56.40 3ffz s LYS 845 Cb -0.01 -4.33 -0.03 0.00 -1.46 0.00 0.00 37.83 31.99 3ffz s LYS 845 CO -0.06 -2.01 0.02 1.03 0.16 0.00 0.00 175.35 174.49 3ffz s ARG 846 N 6.15 3.38 0.00 4.03 0.52 -1.26 -5.03 118.95 126.74 3ffz s ARG 846 Ca 0.97 -0.39 0.00 0.00 -0.52 0.00 0.00 55.73 55.78 3ffz s ARG 846 Cb -0.32 -2.94 0.00 0.00 0.52 0.00 0.00 34.95 32.21 3ffz s ARG 846 CO 0.35 0.52 0.00 -0.89 0.02 0.00 0.00 175.30 175.30 3ffz n ILE 847 N 2.72 0.00 0.00 1.52 5.41 -1.26 -4.81 119.36 122.94 3ffz n ILE 847 Ca -0.18 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.57 3ffz n ILE 847 Cb 0.53 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.46 3ffz n ILE 847 CO 0.00 0.00 0.00 2.29 0.00 0.00 0.00 176.55 178.84 3ffz n LYS 848 N 0.00 0.00 0.00 0.38 2.85 -1.22 -5.05 118.16 115.12 3ffz n LYS 848 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 3ffz n LYS 848 Cb 0.00 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.38 3ffz n LYS 848 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 177.40 177.78 3ffz n SER 849 N 0.00 0.00 0.00 -5.58 7.64 -1.26 -2.54 113.62 111.87 3ffz n SER 849 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 3ffz n SER 849 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 3ffz n SER 849 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 3ffz n SER 850 N -0.90 0.00 -4.72 6.43 3.41 -1.26 -4.36 113.62 112.22 3ffz n SER 850 Ca 0.00 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.19 3ffz n SER 850 Cb 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 3ffz n SER 850 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3ffz s SER 851 N -4.57 6.99 -0.06 4.04 0.15 -1.05 -2.00 113.70 117.19 3ffz s SER 851 Ca 0.00 2.17 0.10 0.00 0.70 0.00 0.00 55.95 58.92 3ffz s SER 851 Cb 0.00 -2.59 -0.15 0.00 -1.71 0.00 0.00 66.02 61.57 3ffz s SER 851 CO 0.00 -0.52 0.15 0.52 1.20 0.00 0.00 173.24 174.59 3ffz n VAL 852 N 3.64 0.35 -3.71 4.45 0.31 0.15 -4.87 118.33 118.65 3ffz n VAL 852 Ca 0.09 -0.35 -0.14 0.00 -0.01 0.00 0.00 64.34 63.93 3ffz n VAL 852 Cb 0.45 -0.22 -0.09 0.00 -0.91 0.00 0.00 33.84 33.06 3ffz n VAL 852 CO 0.00 0.00 0.00 -0.22 -1.32 0.00 0.00 176.83 175.29 3ffz s LEU 853 N -4.27 0.33 -0.14 7.52 2.96 -1.14 -4.73 118.68 119.22 3ffz s LEU 853 Ca -0.05 0.65 -0.05 0.00 -0.22 0.00 0.00 54.13 54.46 3ffz s LEU 853 Cb 0.05 1.59 0.07 0.00 0.50 0.00 0.00 46.19 48.40 3ffz s LEU 853 CO 0.45 -0.30 0.28 0.20 -1.32 0.00 0.00 176.35 175.67 3ffz s ASN 854 N -0.39 0.26 -0.31 3.68 0.01 -1.26 -2.30 114.94 114.63 3ffz s ASN 854 Ca -0.05 0.65 -0.16 0.00 -0.71 0.00 0.00 52.86 52.59 3ffz s ASN 854 Cb -0.03 0.79 -0.02 0.00 0.41 0.00 0.00 41.25 42.39 3ffz s ASN 854 CO 0.03 -0.24 0.40 -0.32 -1.51 0.00 0.00 177.10 175.46 3ffz s MET 855 N 2.44 3.79 0.19 -0.60 -2.45 -0.80 -1.98 119.30 119.88 3ffz s MET 855 Ca 0.01 -0.14 -0.06 0.00 -1.25 0.00 0.00 55.69 54.25 3ffz s MET 855 Cb -0.12 -3.73 -0.02 0.00 1.25 0.00 0.00 34.83 32.20 3ffz s MET 855 CO -0.09 -0.43 0.24 1.03 1.05 0.00 0.00 175.02 176.82 3ffz s ARG 856 N 2.13 1.22 -0.27 4.11 1.81 -0.86 -4.29 118.95 122.80 3ffz s ARG 856 Ca 0.15 -1.38 -0.08 0.00 -1.72 0.00 0.00 55.73 52.70 3ffz s ARG 856 Cb -0.16 0.34 -0.03 0.00 -0.45 0.00 0.00 34.95 34.66 3ffz s ARG 856 CO 0.11 -0.44 0.10 -0.47 -0.68 0.00 0.00 175.30 173.93 3ffz s TYR 857 N -4.05 3.12 -0.04 -0.53 5.04 -1.26 -1.05 117.35 118.58 3ffz s TYR 857 Ca 0.26 -0.41 -0.00 0.00 -2.44 0.00 0.00 57.07 54.48 3ffz s TYR 857 Cb 0.04 -2.28 0.03 0.00 0.35 0.00 0.00 41.96 40.10 3ffz s TYR 857 CO 0.06 -0.36 0.02 0.15 -1.34 0.00 0.00 175.55 174.08 3ffz s LYS 858 N 1.63 0.24 -1.17 4.97 -0.14 -0.12 -4.88 119.74 120.27 3ffz s LYS 858 Ca 0.06 0.15 -0.15 0.00 -1.36 0.00 0.00 55.97 54.67 3ffz s LYS 858 Cb -0.16 -0.55 -0.01 0.00 -1.68 0.00 0.00 37.83 35.43 3ffz s LYS 858 CO 0.05 -0.21 0.76 0.09 -0.76 0.00 0.00 175.35 175.29 3ffz n ASN 859 N 4.55 -4.58 -3.76 2.83 5.03 -1.26 -2.94 115.26 115.13 3ffz n ASN 859 Ca -0.19 -0.96 -0.24 0.00 0.87 0.00 0.00 54.58 54.06 3ffz n ASN 859 Cb 0.50 -3.61 0.02 0.00 -1.02 0.00 0.00 39.78 35.67 3ffz n ASN 859 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 3ffz n ASP 860 N -2.80 -1.91 -3.60 6.41 8.00 -1.26 -4.98 116.55 116.42 3ffz n ASP 860 Ca -0.13 -0.91 -0.08 0.00 0.71 0.00 0.00 54.79 54.37 3ffz n ASP 860 Cb 0.61 -3.66 -0.05 0.00 -0.02 0.00 0.00 41.12 38.00 3ffz n ASP 860 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 3ffz s LYS 861 N -6.09 0.46 -0.25 -1.24 2.47 -1.15 -5.12 119.74 108.82 3ffz s LYS 861 Ca 0.11 0.17 -0.22 0.00 -1.56 0.00 0.00 55.97 54.47 3ffz s LYS 861 Cb -0.04 0.22 -0.01 0.00 -1.46 0.00 0.00 37.83 36.54 3ffz s LYS 861 CO 0.84 -0.13 0.73 0.71 0.16 0.00 0.00 175.35 177.66 3ffz s TYR 862 N -0.88 3.30 0.16 4.03 1.51 -1.26 -0.95 117.35 123.27 3ffz s TYR 862 Ca 0.01 0.98 -0.01 0.00 -1.01 0.00 0.00 57.07 57.04 3ffz s TYR 862 Cb -0.01 -2.94 -0.04 0.00 -0.11 0.00 0.00 41.96 38.86 3ffz s TYR 862 CO -0.02 -0.36 0.08 0.14 -1.11 0.00 0.00 175.55 174.28 3ffz s VAL 863 N 2.64 0.16 -0.21 0.71 -7.23 -0.22 -4.52 120.40 111.73 3ffz s VAL 863 Ca 0.30 -1.95 -0.15 0.00 -1.81 0.00 0.00 61.98 58.37 3ffz s VAL 863 Cb -0.15 -2.23 -0.04 0.00 0.56 0.00 0.00 36.38 34.52 3ffz s VAL 863 CO 0.08 -0.29 0.36 -0.62 -0.31 0.00 0.00 175.10 174.31 3ffz s ASP 864 N -3.11 6.37 -0.25 4.85 2.15 -1.25 -2.03 116.67 123.40 3ffz s ASP 864 Ca 0.30 0.43 0.13 0.00 0.43 0.00 0.00 52.55 53.83 3ffz s ASP 864 Cb 0.07 -2.21 0.56 0.00 -0.30 0.00 0.00 42.92 41.04 3ffz s ASP 864 CO 0.06 -0.07 1.51 0.35 -0.17 0.00 0.00 175.17 176.85 3ffz n THR 865 N 4.41 2.50 0.12 1.71 -2.24 -0.84 -4.64 114.28 115.31 3ffz n THR 865 Ca -0.09 -2.15 -0.21 0.00 -2.27 0.00 0.00 64.05 59.32 3ffz n THR 865 Cb 0.51 -0.30 -0.14 0.00 -2.10 0.00 0.00 70.33 68.30 3ffz n THR 865 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 3ffz h SER 866 N 1.60 0.72 0.00 3.42 4.64 -1.89 -3.47 113.55 118.56 3ffz h SER 866 Ca 0.14 -0.73 0.00 0.00 -0.47 0.00 0.00 61.79 60.72 3ffz h SER 866 Cb 1.70 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 63.56 3ffz h SER 866 CO 0.38 1.56 0.00 0.61 -0.87 0.00 0.00 176.83 178.52 3ffz n GLY 867 N 1.55 4.49 3.89 -0.77 0.00 -1.26 -4.86 105.19 108.24 3ffz n GLY 867 Ca -0.13 -0.73 -0.29 0.00 0.00 0.00 0.00 46.02 44.87 3ffz n GLY 867 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3ffz s TYR 868 N 0.00 3.59 -0.74 1.61 2.02 -1.26 -4.26 117.35 118.31 3ffz s TYR 868 Ca 0.00 1.06 0.03 0.00 -0.37 0.00 0.00 57.07 57.79 3ffz s TYR 868 Cb 0.00 -2.54 0.18 0.00 -0.40 0.00 0.00 41.96 39.20 3ffz s TYR 868 CO 0.00 -0.52 0.55 -0.51 -1.57 0.00 0.00 175.55 173.50 3ffz s ASP 869 N -4.15 5.09 0.07 2.29 -0.00 -1.26 -4.77 116.67 113.94 3ffz s ASP 869 Ca 0.52 -3.75 -0.31 0.00 -0.00 0.00 0.00 52.55 49.01 3ffz s ASP 869 Cb -0.11 -1.71 -0.06 0.00 -0.00 0.00 0.00 42.92 41.04 3ffz s ASP 869 CO 0.50 -0.12 1.23 -0.44 -0.00 0.00 0.00 175.17 176.33 3ffz s SER 870 N -1.01 7.04 -0.47 0.27 0.01 -1.26 -4.81 113.70 113.46 3ffz s SER 870 Ca 0.25 2.07 -0.29 0.00 1.31 0.00 0.00 55.95 59.29 3ffz s SER 870 Cb -0.07 -2.58 0.03 0.00 0.21 0.00 0.00 66.02 63.61 3ffz s SER 870 CO -0.14 -0.50 1.11 0.21 0.41 0.00 0.00 173.24 174.33 3ffz s ASN 871 N 1.05 6.62 -0.40 2.44 2.47 -1.04 -4.13 114.94 121.96 3ffz s ASN 871 Ca 0.60 0.44 -0.12 0.00 0.42 0.00 0.00 52.86 54.20 3ffz s ASN 871 Cb -0.31 -2.54 0.04 0.00 -1.45 0.00 0.00 41.25 37.00 3ffz s ASN 871 CO 0.29 -1.22 0.25 -0.63 -3.72 0.00 0.00 177.10 172.08 3ffz s ILE 872 N 4.35 4.66 0.15 -5.21 1.01 -1.26 -0.94 121.20 123.96 3ffz s ILE 872 Ca 0.46 -0.98 0.07 0.00 0.00 0.00 0.00 60.65 60.20 3ffz s ILE 872 Cb -0.08 -3.68 -0.04 0.00 0.01 0.00 0.00 42.46 38.68 3ffz s ILE 872 CO 0.31 -0.35 -0.02 0.20 0.00 0.00 0.00 174.94 175.08 3ffz s ASN 873 N 1.81 4.75 0.11 3.58 -0.87 -0.52 -4.74 114.94 119.07 3ffz s ASN 873 Ca 0.03 -0.37 0.03 0.00 -1.57 0.00 0.00 52.86 50.98 3ffz s ASN 873 Cb -0.21 -1.01 -0.04 0.00 -0.02 0.00 0.00 41.25 39.97 3ffz s ASN 873 CO 0.06 0.11 0.14 0.27 -2.57 0.00 0.00 177.10 175.12 3ffz s ILE 874 N -1.60 4.73 -0.17 0.60 -5.25 -1.26 -1.69 121.20 116.55 3ffz s ILE 874 Ca 0.26 -0.81 -0.05 0.00 -0.99 0.00 0.00 60.65 59.06 3ffz s ILE 874 Cb -0.10 -3.35 0.06 0.00 2.95 0.00 0.00 42.46 42.02 3ffz s ILE 874 CO 0.18 0.02 0.08 0.20 -1.79 0.00 0.00 174.94 173.63 3ffz s ASN 875 N -2.75 2.43 0.00 4.36 0.01 0.52 -4.96 114.94 114.54 3ffz s ASN 875 Ca 0.31 -0.64 0.00 0.00 -0.71 0.00 0.00 52.86 51.82 3ffz s ASN 875 Cb -0.11 -0.29 0.00 0.00 0.41 0.00 0.00 41.25 41.25 3ffz s ASN 875 CO 0.24 -0.34 0.00 0.61 -1.51 0.00 0.00 177.10 176.10 3ffz n GLY 876 N 5.25 0.27 3.54 0.66 0.00 -1.25 0.15 105.19 113.81 3ffz n GLY 876 Ca -0.07 -1.51 -0.41 0.00 0.00 0.00 0.00 46.02 44.02 3ffz n GLY 876 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3ffz s ASP 877 N -4.00 6.22 -0.20 1.61 2.15 -1.24 -4.89 116.67 116.32 3ffz s ASP 877 Ca 0.00 -0.20 0.01 0.00 0.43 0.00 0.00 52.55 52.79 3ffz s ASP 877 Cb 0.00 -2.22 0.04 0.00 -0.30 0.00 0.00 42.92 40.44 3ffz s ASP 877 CO 0.00 -0.39 -0.12 -0.69 -0.17 0.00 0.00 175.17 173.80 3ffz s VAL 878 N 2.13 1.75 0.29 1.11 1.01 -1.26 -4.51 120.40 120.91 3ffz s VAL 878 Ca 0.14 -1.03 -0.29 0.00 0.00 0.00 0.00 61.98 60.80 3ffz s VAL 878 Cb -0.16 -1.77 -0.10 0.00 0.00 0.00 0.00 36.38 34.34 3ffz s VAL 878 CO 0.12 0.23 1.44 -0.47 0.00 0.00 0.00 175.10 176.42 3ffz s TYR 879 N 1.36 2.93 -0.15 5.22 5.04 -0.93 -4.77 117.35 126.04 3ffz s TYR 879 Ca -0.01 1.08 0.01 0.00 -2.44 0.00 0.00 57.07 55.72 3ffz s TYR 879 Cb -0.16 -3.86 0.02 0.00 0.35 0.00 0.00 41.96 38.31 3ffz s TYR 879 CO -0.09 -2.69 -0.17 0.15 -1.34 0.00 0.00 175.55 171.41 3ffz s LYS 880 N -0.90 2.57 -0.00 4.97 1.02 -1.26 -0.32 119.74 125.82 3ffz s LYS 880 Ca 0.57 -0.67 -0.30 0.00 0.02 0.00 0.00 55.97 55.59 3ffz s LYS 880 Cb -0.43 -2.22 -0.06 0.00 -0.52 0.00 0.00 37.83 34.59 3ffz s LYS 880 CO 0.49 -0.15 1.60 0.71 -0.92 0.00 0.00 175.35 177.08 3ffz s TYR 881 N 1.21 2.29 0.24 3.18 2.02 -0.72 -4.91 117.35 120.66 3ffz s TYR 881 Ca 0.00 0.36 -0.06 0.00 -0.37 0.00 0.00 57.07 57.00 3ffz s TYR 881 Cb -0.14 -3.88 0.36 0.00 -0.40 0.00 0.00 41.96 37.90 3ffz s TYR 881 CO -0.08 -3.58 1.80 -1.35 -1.57 0.00 0.00 175.55 170.77 3ffz h PRO 882 N 8.80 0.71 -0.30 -1.71 0.11 -1.98 -1.76 132.00 135.88 3ffz h PRO 882 Ca -0.40 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.67 3ffz h PRO 882 Cb 1.19 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.13 3ffz h PRO 882 CO 0.94 0.47 0.00 0.25 -0.21 0.00 0.00 178.00 179.45 3ffz n THR 883 N -4.78 0.40 -2.68 -1.15 -2.24 -1.26 -4.54 114.28 98.03 3ffz n THR 883 Ca 0.12 -0.39 -0.02 0.00 -2.27 0.00 0.00 64.05 61.50 3ffz n THR 883 Cb 0.26 0.18 0.03 0.00 -2.10 0.00 0.00 70.33 68.70 3ffz n THR 883 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3ffz s ASN 884 N -0.99 -0.16 0.54 3.42 3.04 -0.73 -4.92 114.94 115.14 3ffz s ASN 884 Ca 0.19 -0.16 0.32 0.00 0.04 0.00 0.00 52.86 53.25 3ffz s ASN 884 Cb 0.10 0.21 1.72 0.00 -1.54 0.00 0.00 41.25 41.74 3ffz s ASN 884 CO 0.13 -0.01 1.96 0.11 -3.04 0.00 0.00 177.10 176.25 3ffz h LYS 885 N 4.42 0.00 0.00 0.43 1.79 -1.61 -1.29 116.57 120.31 3ffz h LYS 885 Ca -0.02 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.45 3ffz h LYS 885 Cb 1.19 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.84 3ffz h LYS 885 CO -0.12 0.00 0.00 0.09 -1.08 0.00 0.00 179.45 178.34 3ffz n ASN 886 N -2.70 0.43 -4.56 0.86 5.03 -1.26 -4.48 115.26 108.57 3ffz n ASN 886 Ca -0.02 0.68 -0.35 0.00 0.87 0.00 0.00 54.58 55.76 3ffz n ASN 886 Cb 0.17 -0.74 -0.11 0.00 -1.02 0.00 0.00 39.78 38.08 3ffz n ASN 886 CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 3ffz s GLN 887 N -3.37 3.84 0.26 3.52 -0.21 -0.48 -4.06 119.66 119.15 3ffz s GLN 887 Ca -0.00 -0.40 0.06 0.00 0.02 0.00 0.00 55.36 55.03 3ffz s GLN 887 Cb 0.05 -3.24 -0.05 0.00 1.00 0.00 0.00 33.01 30.77 3ffz s GLN 887 CO 0.18 0.09 -0.06 -0.59 -2.12 0.00 0.00 175.29 172.80 3ffz s PHE 888 N 0.85 1.82 -0.00 0.91 -0.12 -0.92 -1.75 117.98 118.77 3ffz s PHE 888 Ca 0.03 -0.73 0.06 0.00 -0.05 0.00 0.00 56.93 56.25 3ffz s PHE 888 Cb -0.14 -1.02 -0.02 0.00 -0.63 0.00 0.00 43.02 41.22 3ffz s PHE 888 CO 0.02 0.22 -0.20 0.20 -0.05 0.00 0.00 175.22 175.41 3ffz s GLY 889 N -3.39 1.00 -0.11 1.99 0.00 0.57 -2.26 107.32 105.11 3ffz s GLY 889 Ca 0.28 -0.90 -0.01 0.00 0.00 0.00 0.00 44.72 44.09 3ffz s GLY 889 CO 0.10 -0.76 -0.08 -0.42 0.00 0.00 0.00 173.10 171.94 3ffz s ILE 890 N -0.53 3.58 0.22 0.90 -1.09 -0.82 -2.20 121.20 121.26 3ffz s ILE 890 Ca 0.08 -0.49 0.09 0.00 -2.23 0.00 0.00 60.65 58.09 3ffz s ILE 890 Cb -0.08 -2.51 -0.04 0.00 -1.58 0.00 0.00 42.46 38.25 3ffz s ILE 890 CO -0.00 0.54 -0.02 -0.31 -1.23 0.00 0.00 174.94 173.92 3ffz s TYR 891 N -0.09 2.74 -0.14 3.97 1.51 -1.26 -2.22 117.35 121.86 3ffz s TYR 891 Ca 0.00 -0.19 0.04 0.00 -1.01 0.00 0.00 57.07 55.91 3ffz s TYR 891 Cb -0.13 -1.28 -0.05 0.00 -0.11 0.00 0.00 41.96 40.39 3ffz s TYR 891 CO 0.03 0.56 0.15 0.27 -1.11 0.00 0.00 175.55 175.45 3ffz n ASN 892 N -0.44 1.27 0.09 2.29 0.23 -1.13 -4.10 115.26 113.46 3ffz n ASN 892 Ca -0.08 -0.43 -0.11 0.00 -0.53 0.00 0.00 54.58 53.43 3ffz n ASN 892 Cb 0.57 1.05 -0.07 0.00 -2.08 0.00 0.00 39.78 39.25 3ffz n ASN 892 CO 0.00 0.00 0.00 -2.24 -0.93 0.00 0.00 177.26 174.09 3ffz h ASP 893 N 0.00 0.26 -0.72 0.53 2.03 -1.94 -3.45 116.42 113.13 3ffz h ASP 893 Ca 0.00 -0.25 -0.53 0.00 -0.73 0.00 0.00 57.03 55.53 3ffz h ASP 893 Cb 0.12 -0.08 -0.00 0.00 -0.83 0.00 0.00 39.33 38.54 3ffz h ASP 893 CO 0.00 1.12 -0.18 -0.54 -1.03 0.00 0.00 179.24 178.61 3ffz s LYS 894 N -2.93 2.30 -1.02 4.15 1.02 -1.26 -5.04 119.74 116.96 3ffz s LYS 894 Ca -0.02 -1.79 -0.10 0.00 0.02 0.00 0.00 55.97 54.08 3ffz s LYS 894 Cb 0.09 -2.43 0.26 0.00 -0.52 0.00 0.00 37.83 35.23 3ffz s LYS 894 CO 0.84 -0.75 0.99 -0.51 -0.92 0.00 0.00 175.35 175.01 3ffz s LEU 895 N -4.50 6.44 -0.17 3.17 1.43 -1.26 -4.87 118.68 118.92 3ffz s LEU 895 Ca 0.50 -3.32 -0.02 0.00 -1.03 0.00 0.00 54.13 50.27 3ffz s LEU 895 Cb -0.04 -2.20 -0.01 0.00 0.03 0.00 0.00 46.19 43.97 3ffz s LEU 895 CO 0.32 -0.37 -0.10 -0.94 0.23 0.00 0.00 176.35 175.49 3ffz s SER 896 N 1.52 4.08 0.05 2.29 1.04 -1.26 -3.67 113.70 117.76 3ffz s SER 896 Ca 0.27 -0.37 -0.02 0.00 0.48 0.00 0.00 55.95 56.31 3ffz s SER 896 Cb -0.10 -1.66 -0.03 0.00 0.10 0.00 0.00 66.02 64.33 3ffz s SER 896 CO -0.08 0.08 -0.01 -1.61 0.98 0.00 0.00 173.24 172.60 3ffz s GLU 897 N 0.88 0.60 -0.30 4.02 2.02 0.40 -4.57 118.70 121.76 3ffz s GLU 897 Ca -0.02 -1.12 -0.01 0.00 0.02 0.00 0.00 54.97 53.84 3ffz s GLU 897 Cb -0.15 0.21 0.13 0.00 0.10 0.00 0.00 34.13 34.42 3ffz s GLU 897 CO 0.00 -0.12 0.26 0.08 0.02 0.00 0.00 175.26 175.50 3ffz s VAL 898 N -3.62 -0.29 -0.25 2.63 1.01 -0.57 -0.36 120.40 118.94 3ffz s VAL 898 Ca 0.04 -0.63 -0.10 0.00 0.00 0.00 0.00 61.98 61.29 3ffz s VAL 898 Cb 0.06 -0.97 -0.05 0.00 0.00 0.00 0.00 36.38 35.42 3ffz s VAL 898 CO -0.09 -0.56 0.15 0.21 0.00 0.00 0.00 175.10 174.81 3ffz s ASN 899 N 2.19 5.91 -0.23 3.32 3.84 -0.68 -0.44 114.94 128.84 3ffz s ASN 899 Ca 0.10 0.02 -0.09 0.00 0.21 0.00 0.00 52.86 53.10 3ffz s ASN 899 Cb -0.15 -2.08 -0.04 0.00 -0.55 0.00 0.00 41.25 38.43 3ffz s ASN 899 CO -0.31 0.02 0.13 -0.63 -2.79 0.00 0.00 177.10 173.52 3ffz s ILE 900 N 1.33 5.08 -0.47 -5.21 1.01 0.17 -1.44 121.20 121.68 3ffz s ILE 900 Ca 0.07 0.08 -0.17 0.00 0.00 0.00 0.00 60.65 60.63 3ffz s ILE 900 Cb -0.15 -3.36 0.06 0.00 0.01 0.00 0.00 42.46 39.02 3ffz s ILE 900 CO 0.06 0.36 0.46 -0.44 0.00 0.00 0.00 174.94 175.38 3ffz s SER 901 N 1.04 6.17 0.51 3.58 0.01 -0.12 0.11 113.70 125.01 3ffz s SER 901 Ca 0.06 -1.08 -0.23 0.00 1.31 0.00 0.00 55.95 56.02 3ffz s SER 901 Cb -0.14 -2.22 -0.06 0.00 0.21 0.00 0.00 66.02 63.82 3ffz s SER 901 CO 0.04 -0.69 1.33 -1.10 0.41 0.00 0.00 173.24 173.23 3ffz s GLN 902 N 2.00 3.39 0.13 12.44 -0.21 -1.10 -2.50 119.66 133.81 3ffz s GLN 902 Ca 0.08 2.17 -0.31 0.00 0.02 0.00 0.00 55.36 57.32 3ffz s GLN 902 Cb -0.21 -2.38 -0.09 0.00 1.00 0.00 0.00 33.01 31.33 3ffz s GLN 902 CO 0.09 -0.97 1.47 1.21 -2.12 0.00 0.00 175.29 174.97 3ffz s ASN 903 N -0.95 6.72 0.55 5.90 3.04 -1.26 -4.86 114.94 124.09 3ffz s ASN 903 Ca 0.68 2.44 0.37 0.00 0.04 0.00 0.00 52.86 56.39 3ffz s ASN 903 Cb -0.39 -2.59 1.54 0.00 -1.54 0.00 0.00 41.25 38.27 3ffz s ASN 903 CO 0.47 -0.73 1.75 0.44 -3.04 0.00 0.00 177.10 175.99 3ffz h ASP 904 N 6.85 0.00 1.88 -4.21 3.32 -1.95 0.40 116.42 122.71 3ffz h ASP 904 Ca -0.42 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.61 3ffz h ASP 904 Cb 1.21 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.75 3ffz h ASP 904 CO 0.89 0.00 -0.07 0.22 -1.72 0.00 0.00 179.24 178.55 3ffz h TYR 905 N 0.00 0.00 0.00 4.55 3.20 -2.00 -3.33 116.97 119.39 3ffz h TYR 905 Ca 0.58 0.00 -0.23 0.00 3.14 0.00 0.00 58.73 62.22 3ffz h TYR 905 Cb 2.42 0.00 -0.04 0.00 1.54 0.00 0.00 36.73 40.65 3ffz h TYR 905 CO 0.00 0.07 -1.56 -0.89 -1.64 0.00 0.00 178.16 174.14 3ffz n ILE 906 N -3.12 1.38 -1.50 1.81 -0.00 0.14 -4.93 119.36 113.14 3ffz n ILE 906 Ca 0.04 -0.74 -0.49 0.00 -0.00 0.00 0.00 62.75 61.55 3ffz n ILE 906 Cb 0.55 -0.87 -0.06 0.00 -0.00 0.00 0.00 39.64 39.26 3ffz n ILE 906 CO 0.00 0.00 0.00 -0.38 -0.00 0.00 0.00 176.55 176.17 3ffz n ILE 907 N -2.96 0.25 -1.65 1.39 5.41 -1.09 -4.89 119.36 115.83 3ffz n ILE 907 Ca -0.13 -0.28 -0.44 0.00 1.00 0.00 0.00 62.75 62.90 3ffz n ILE 907 Cb 0.94 -1.83 -0.01 0.00 -0.71 0.00 0.00 39.64 38.03 3ffz n ILE 907 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3ffz n TYR 908 N 9.88 1.82 -3.53 1.39 4.19 -1.26 -4.96 117.16 124.70 3ffz n TYR 908 Ca 0.37 0.61 -0.15 0.00 3.31 0.00 0.00 57.90 62.04 3ffz n TYR 908 Cb 0.27 -2.35 -0.05 0.00 0.49 0.00 0.00 39.34 37.71 3ffz n TYR 908 CO 0.00 0.00 0.00 0.34 0.91 0.00 0.00 176.86 178.11 3ffz s ASP 909 N -0.36 -0.56 0.43 2.98 -1.08 -1.22 -3.10 116.67 113.76 3ffz s ASP 909 Ca 0.58 0.54 0.00 0.00 -0.52 0.00 0.00 52.55 53.16 3ffz s ASP 909 Cb -0.64 0.48 0.00 0.00 -1.46 0.00 0.00 42.92 41.30 3ffz s ASP 909 CO 0.60 -0.57 0.00 0.59 0.52 0.00 0.00 175.17 176.31 3ffz n ASN 910 N 0.70 -6.99 -1.41 -0.34 4.13 -1.25 -4.24 115.26 105.86 3ffz n ASN 910 Ca -0.16 1.09 0.00 0.00 1.68 0.00 0.00 54.58 57.19 3ffz n ASN 910 Cb 0.58 -3.67 0.00 0.00 -1.54 0.00 0.00 39.78 35.15 3ffz n ASN 910 CO 0.00 0.00 0.00 2.29 0.28 0.00 0.00 177.26 179.83 3ffz n LYS 911 N -1.21 0.06 -0.74 3.52 -0.00 -1.25 -4.43 118.16 114.12 3ffz n LYS 911 Ca 0.00 0.00 -0.30 0.00 -0.00 0.00 0.00 58.31 58.01 3ffz n LYS 911 Cb 0.08 -1.47 0.18 0.00 -0.00 0.00 0.00 35.03 33.81 3ffz n LYS 911 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.40 178.92 3ffz s TYR 912 N 1.33 1.68 0.68 5.58 -0.85 -1.26 -4.96 117.35 119.55 3ffz s TYR 912 Ca 0.00 1.61 -0.08 0.00 -0.52 0.00 0.00 57.07 58.08 3ffz s TYR 912 Cb 0.00 -3.25 0.13 0.00 0.38 0.00 0.00 41.96 39.21 3ffz s TYR 912 CO 0.00 -2.93 0.29 1.17 -1.52 0.00 0.00 175.55 172.55 3ffz n LYS 913 N -4.31 -0.84 -0.65 -3.49 3.00 -1.26 -4.83 118.16 105.78 3ffz n LYS 913 Ca 0.09 -0.48 -0.24 0.00 -0.00 0.00 0.00 58.31 57.68 3ffz n LYS 913 Cb 0.53 -1.00 0.03 0.00 0.00 0.00 0.00 35.03 34.58 3ffz n LYS 913 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 3ffz n ASN 914 N -1.23 -3.78 -3.65 3.14 3.02 -1.26 -4.81 115.26 106.70 3ffz n ASN 914 Ca 0.05 0.11 -0.03 0.00 -0.03 0.00 0.00 54.58 54.68 3ffz n ASN 914 Cb 0.20 -0.48 -0.07 0.00 -0.61 0.00 0.00 39.78 38.82 3ffz n ASN 914 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 3ffz s PHE 915 N -1.30 -0.34 0.08 3.10 -0.12 -0.90 -3.50 117.98 114.99 3ffz s PHE 915 Ca 0.26 0.72 0.09 0.00 -0.05 0.00 0.00 56.93 57.95 3ffz s PHE 915 Cb -0.10 0.30 -0.03 0.00 -0.63 0.00 0.00 43.02 42.55 3ffz s PHE 915 CO 0.53 -0.16 -0.24 -1.12 -0.05 0.00 0.00 175.22 174.17 3ffz s SER 916 N 0.81 3.39 -0.02 1.98 0.01 -0.08 -1.98 113.70 117.80 3ffz s SER 916 Ca -0.03 -0.60 0.06 0.00 1.31 0.00 0.00 55.95 56.68 3ffz s SER 916 Cb -0.04 -0.35 -0.01 0.00 0.21 0.00 0.00 66.02 65.83 3ffz s SER 916 CO -0.12 0.23 -0.21 -0.63 0.41 0.00 0.00 173.24 172.91 3ffz s ILE 917 N -0.93 1.70 0.03 1.44 1.01 -0.31 -0.97 121.20 123.17 3ffz s ILE 917 Ca 0.13 -0.91 -0.11 0.00 0.00 0.00 0.00 60.65 59.76 3ffz s ILE 917 Cb -0.10 -1.42 0.01 0.00 0.01 0.00 0.00 42.46 40.96 3ffz s ILE 917 CO 0.04 0.48 0.24 -0.94 0.00 0.00 0.00 174.94 174.77 3ffz s SER 918 N -0.41 -0.06 0.06 3.58 1.04 -0.56 0.41 113.70 117.76 3ffz s SER 918 Ca 0.06 -0.21 -0.26 0.00 0.48 0.00 0.00 55.95 56.01 3ffz s SER 918 Cb -0.09 0.30 0.09 0.00 0.10 0.00 0.00 66.02 66.42 3ffz s SER 918 CO -0.00 -0.53 1.19 0.72 0.98 0.00 0.00 173.24 175.60 3ffz s PHE 919 N -2.21 0.04 -0.09 5.02 -0.12 -0.16 -0.80 117.98 119.66 3ffz s PHE 919 Ca -0.08 -0.26 0.03 0.00 -0.05 0.00 0.00 56.93 56.57 3ffz s PHE 919 Cb -0.02 0.61 0.01 0.00 -0.63 0.00 0.00 43.02 42.99 3ffz s PHE 919 CO -0.02 -0.51 -0.18 -1.58 -0.05 0.00 0.00 175.22 172.88 3ffz s TRP 920 N -2.09 2.04 0.12 3.49 0.52 -0.62 -0.46 118.94 121.93 3ffz s TRP 920 Ca 0.26 -0.84 0.10 0.00 0.02 0.00 0.00 56.10 55.64 3ffz s TRP 920 Cb -0.01 -1.42 -0.04 0.00 -1.15 0.00 0.00 33.47 30.85 3ffz s TRP 920 CO 0.01 -0.38 -0.23 0.54 0.02 0.00 0.00 176.95 176.92 3ffz s VAL 921 N 0.58 2.52 -0.17 4.03 0.11 0.48 -1.35 120.40 126.60 3ffz s VAL 921 Ca -0.15 -1.61 -0.01 0.00 -2.93 0.00 0.00 61.98 57.29 3ffz s VAL 921 Cb -0.17 -2.12 0.04 0.00 -1.53 0.00 0.00 36.38 32.60 3ffz s VAL 921 CO 0.05 0.12 -0.04 -0.60 -3.33 0.00 0.00 175.10 171.30 3ffz s ARG 922 N -2.02 1.33 -0.32 1.54 3.52 0.81 0.49 118.95 124.30 3ffz s ARG 922 Ca 0.16 -0.51 -0.04 0.00 -0.13 0.00 0.00 55.73 55.20 3ffz s ARG 922 Cb -0.10 -2.00 0.04 0.00 -1.56 0.00 0.00 34.95 31.33 3ffz s ARG 922 CO 0.07 -0.46 0.06 0.42 -0.81 0.00 0.00 175.30 174.59 3ffz s ILE 923 N 1.66 3.45 0.46 4.11 -1.09 -1.26 -0.36 121.20 128.17 3ffz s ILE 923 Ca 0.00 -1.23 -0.17 0.00 -2.23 0.00 0.00 60.65 57.03 3ffz s ILE 923 Cb -0.16 -2.96 -0.09 0.00 -1.58 0.00 0.00 42.46 37.68 3ffz s ILE 923 CO -0.07 -0.14 0.93 -2.16 -1.23 0.00 0.00 174.94 172.27 3ffz s PRO 924 N 1.34 4.00 -0.02 2.79 0.04 -1.26 -0.98 135.00 140.92 3ffz s PRO 924 Ca -0.03 0.92 0.05 0.00 0.04 0.00 0.00 61.00 61.97 3ffz s PRO 924 Cb -0.20 -2.20 -0.07 0.00 0.04 0.00 0.00 34.50 32.07 3ffz s PRO 924 CO 0.01 -0.15 0.08 0.09 0.04 0.00 0.00 177.00 177.08 3ffz n ASN 925 N -1.21 3.87 0.00 6.66 5.03 -1.19 -4.89 115.26 123.53 3ffz n ASN 925 Ca 0.06 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.51 3ffz n ASN 925 Cb 0.54 1.06 0.00 0.00 -1.02 0.00 0.00 39.78 40.36 3ffz n ASN 925 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 3ffz n TYR 926 N -1.80 0.00 -2.20 3.10 4.02 0.11 -3.90 117.16 116.49 3ffz n TYR 926 Ca -0.03 0.00 -0.11 0.00 -0.01 0.00 0.00 57.90 57.75 3ffz n TYR 926 Cb 0.27 -1.43 0.01 0.00 -0.02 0.00 0.00 39.34 38.17 3ffz n TYR 926 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 3ffz n ASP 927 N -0.06 -3.32 -3.77 7.72 8.00 -1.26 -3.61 116.55 120.25 3ffz n ASP 927 Ca 0.00 0.06 -0.09 0.00 0.71 0.00 0.00 54.79 55.47 3ffz n ASP 927 Cb 0.05 -0.87 -0.03 0.00 -0.02 0.00 0.00 41.12 40.24 3ffz n ASP 927 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 3ffz s ASN 928 N -0.68 -0.05 -0.03 -2.24 0.01 -1.25 -4.66 114.94 106.05 3ffz s ASN 928 Ca 0.11 -0.90 -0.00 0.00 -0.71 0.00 0.00 52.86 51.36 3ffz s ASN 928 Cb -0.01 0.67 0.02 0.00 0.41 0.00 0.00 41.25 42.34 3ffz s ASN 928 CO 0.25 -1.28 1.78 0.29 -1.51 0.00 0.00 177.10 176.63 3ffz n LYS 929 N -0.44 1.07 -0.09 -0.60 5.02 -1.26 -2.97 118.16 118.88 3ffz n LYS 929 Ca -0.03 -0.13 -0.15 0.00 -2.02 0.00 0.00 58.31 55.98 3ffz n LYS 929 Cb 0.61 -1.05 -0.14 0.00 -0.02 0.00 0.00 35.03 34.43 3ffz n LYS 929 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 3ffz n ILE 930 N 1.18 1.51 0.09 -0.18 -0.00 -1.26 -4.29 119.36 116.41 3ffz n ILE 930 Ca 0.03 -0.71 0.11 0.00 -0.00 0.00 0.00 62.75 62.18 3ffz n ILE 930 Cb 0.52 -1.09 -0.07 0.00 -0.00 0.00 0.00 39.64 38.99 3ffz n ILE 930 CO 0.00 0.00 0.00 0.52 -0.00 0.00 0.00 176.55 177.07 3ffz n VAL 931 N -3.09 0.31 -1.98 1.39 0.31 -1.16 -4.80 118.33 109.31 3ffz n VAL 931 Ca -0.36 -0.50 -0.30 0.00 -0.01 0.00 0.00 64.34 63.17 3ffz n VAL 931 Cb 1.06 -0.14 -0.04 0.00 -0.91 0.00 0.00 33.84 33.81 3ffz n VAL 931 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 3ffz s ASN 932 N -4.87 5.03 0.03 4.52 2.47 -1.25 -4.65 114.94 116.23 3ffz s ASN 932 Ca -0.03 -0.20 -0.01 0.00 0.42 0.00 0.00 52.86 53.04 3ffz s ASN 932 Cb 0.12 -2.55 0.00 0.00 -1.45 0.00 0.00 41.25 37.38 3ffz s ASN 932 CO 0.84 -2.74 0.05 1.33 -3.72 0.00 0.00 177.10 172.87 3ffz n VAL 933 N 7.76 0.00 -1.08 -5.21 0.24 -1.26 -4.96 118.33 113.81 3ffz n VAL 933 Ca 0.34 -0.13 0.00 0.00 -2.04 0.00 0.00 64.34 62.52 3ffz n VAL 933 Cb 0.49 0.09 0.01 0.00 -1.47 0.00 0.00 33.84 32.95 3ffz n VAL 933 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 3ffz n ASN 934 N -1.73 0.33 -4.77 -1.34 2.85 -1.26 -4.37 115.26 104.96 3ffz n ASN 934 Ca -0.00 -1.40 -0.37 0.00 -0.11 0.00 0.00 54.58 52.69 3ffz n ASN 934 Cb 0.05 -0.06 -0.03 0.00 1.24 0.00 0.00 39.78 40.99 3ffz n ASN 934 CO 0.00 0.00 0.00 0.21 -2.11 0.00 0.00 177.26 175.36 3ffz s ASN 935 N -0.43 6.60 -0.33 1.20 2.47 -1.26 -4.89 114.94 118.30 3ffz s ASN 935 Ca 0.01 2.21 -0.11 0.00 0.42 0.00 0.00 52.86 55.39 3ffz s ASN 935 Cb 0.01 -2.60 -0.00 0.00 -1.45 0.00 0.00 41.25 37.21 3ffz s ASN 935 CO 0.00 -0.61 0.18 -0.70 -3.72 0.00 0.00 177.10 172.25 3ffz s GLU 936 N -2.40 3.25 -0.07 0.43 2.12 -1.26 -4.52 118.70 116.25 3ffz s GLU 936 Ca 0.58 -0.79 0.02 0.00 0.36 0.00 0.00 54.97 55.14 3ffz s GLU 936 Cb -0.27 -3.65 -0.03 0.00 0.26 0.00 0.00 34.13 30.45 3ffz s GLU 936 CO 0.33 -0.49 -0.11 1.52 -0.54 0.00 0.00 175.26 175.97 3ffz s TYR 937 N 1.62 2.81 0.08 5.30 -0.85 -0.91 -4.91 117.35 120.49 3ffz s TYR 937 Ca 0.04 -0.19 -0.19 0.00 -0.52 0.00 0.00 57.07 56.21 3ffz s TYR 937 Cb -0.18 -1.71 -0.07 0.00 0.38 0.00 0.00 41.96 40.39 3ffz s TYR 937 CO 0.07 0.15 0.57 -0.08 -1.52 0.00 0.00 175.55 174.74 3ffz s THR 938 N -0.51 4.75 -0.16 -3.49 -1.32 -0.93 0.13 115.64 114.10 3ffz s THR 938 Ca 0.07 1.19 -0.09 0.00 -1.21 0.00 0.00 61.69 61.65 3ffz s THR 938 Cb -0.12 -3.89 -0.07 0.00 -1.51 0.00 0.00 72.50 66.92 3ffz s THR 938 CO 0.02 0.54 -0.23 2.30 -2.21 0.00 0.00 174.62 175.04 3ffz n ILE 939 N 1.66 1.05 -3.82 5.08 -5.35 -0.17 -1.65 119.36 116.17 3ffz n ILE 939 Ca -0.10 -0.16 -0.36 0.00 -0.27 0.00 0.00 62.75 61.86 3ffz n ILE 939 Cb 0.51 -1.80 -0.13 0.00 -1.74 0.00 0.00 39.64 36.48 3ffz n ILE 939 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 3ffz s ILE 940 N -2.37 3.40 0.00 7.28 1.01 -1.01 -1.90 121.20 127.62 3ffz s ILE 940 Ca -0.24 -1.33 0.00 0.00 0.00 0.00 0.00 60.65 59.09 3ffz s ILE 940 Cb 0.08 -2.98 0.00 0.00 0.01 0.00 0.00 42.46 39.58 3ffz s ILE 940 CO 0.30 -0.20 0.00 0.59 0.00 0.00 0.00 174.94 175.63 3ffz n ASN 941 N 4.71 0.00 -2.32 3.58 5.03 -0.15 -0.25 115.26 125.86 3ffz n ASN 941 Ca -0.12 0.00 -0.02 0.00 0.87 0.00 0.00 54.58 55.31 3ffz n ASN 941 Cb 0.44 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.20 3ffz n ASN 941 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3ffz s MET 943 N -2.57 0.60 -0.02 0.00 1.00 -1.26 -3.33 119.30 113.72 3ffz s MET 943 Ca 0.05 0.82 -0.20 0.00 0.00 0.00 0.00 55.69 56.37 3ffz s MET 943 Cb -0.02 0.22 -0.05 0.00 0.00 0.00 0.00 34.83 34.99 3ffz s MET 943 CO 0.42 -0.10 0.56 0.50 0.00 0.00 0.00 175.02 176.40 3ffz s ARG 944 N 0.68 4.29 0.00 2.03 3.00 -0.74 -4.67 118.95 123.55 3ffz s ARG 944 Ca -0.03 0.67 0.00 0.00 -1.00 0.00 0.00 55.73 55.37 3ffz s ARG 944 Cb -0.05 -3.35 0.00 0.00 0.00 0.00 0.00 34.95 31.55 3ffz s ARG 944 CO -0.05 0.35 0.00 -0.25 0.00 0.00 0.00 175.30 175.36 3ffz n ASP 945 N 2.82 0.00 -1.92 -2.12 9.92 -1.26 -0.55 116.55 123.44 3ffz n ASP 945 Ca -0.07 0.00 -0.03 0.00 -0.53 0.00 0.00 54.79 54.15 3ffz n ASP 945 Cb 0.51 0.00 -0.05 0.00 -0.64 0.00 0.00 41.12 40.95 3ffz n ASP 945 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 3ffz n ASN 946 N 0.00 3.23 -3.60 -2.24 4.13 -1.26 -4.76 115.26 110.76 3ffz n ASN 946 Ca 0.00 -1.97 -0.34 0.00 1.68 0.00 0.00 54.58 53.95 3ffz n ASN 946 Cb 0.00 -0.77 0.03 0.00 -1.54 0.00 0.00 39.78 37.50 3ffz n ASN 946 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 3ffz n ASN 947 N 2.14 -5.17 -4.02 6.41 3.02 0.29 -4.99 115.26 112.94 3ffz n ASN 947 Ca 0.12 -0.45 -0.19 0.00 -0.03 0.00 0.00 54.58 54.03 3ffz n ASN 947 Cb 0.42 -1.57 -0.15 0.00 -0.61 0.00 0.00 39.78 37.87 3ffz n ASN 947 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 3ffz s SER 948 N -1.97 1.08 0.00 6.41 0.01 -1.11 -4.86 113.70 113.26 3ffz s SER 948 Ca 0.25 -0.17 0.00 0.00 1.31 0.00 0.00 55.95 57.34 3ffz s SER 948 Cb -0.03 -0.15 0.00 0.00 0.21 0.00 0.00 66.02 66.06 3ffz s SER 948 CO 0.88 0.10 0.00 0.61 0.41 0.00 0.00 173.24 175.24 3ffz n GLY 949 N 2.92 0.43 3.54 3.44 0.00 -0.63 -1.79 105.19 113.10 3ffz n GLY 949 Ca -0.14 -1.76 -0.26 0.00 0.00 0.00 0.00 46.02 43.85 3ffz n GLY 949 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 3ffz s TRP 950 N 0.00 1.81 -0.29 1.61 1.48 -1.21 0.10 118.94 122.44 3ffz s TRP 950 Ca 0.00 -1.23 -0.27 0.00 -1.06 0.00 0.00 56.10 53.55 3ffz s TRP 950 Cb 0.00 -1.22 0.19 0.00 -1.16 0.00 0.00 33.47 31.28 3ffz s TRP 950 CO 0.00 -0.22 1.41 0.21 -4.06 0.00 0.00 176.95 174.29 3ffz s LYS 951 N -3.74 0.07 -0.15 3.25 2.36 -1.07 -4.16 119.74 116.30 3ffz s LYS 951 Ca 0.22 0.05 0.00 0.00 -2.55 0.00 0.00 55.97 53.70 3ffz s LYS 951 Cb 0.03 0.03 -0.00 0.00 -1.05 0.00 0.00 37.83 36.84 3ffz s LYS 951 CO 0.13 -0.01 -0.15 0.08 1.55 0.00 0.00 175.35 176.95 3ffz s VAL 952 N -0.35 2.69 0.28 4.02 1.01 0.66 -1.42 120.40 127.29 3ffz s VAL 952 Ca 0.08 -0.76 0.11 0.00 0.00 0.00 0.00 61.98 61.40 3ffz s VAL 952 Cb -0.04 -2.14 -0.05 0.00 0.00 0.00 0.00 36.38 34.16 3ffz s VAL 952 CO -0.13 0.51 -0.18 -0.44 0.00 0.00 0.00 175.10 174.87 3ffz s SER 953 N 0.78 3.43 -0.05 3.32 0.01 0.10 -1.00 113.70 120.30 3ffz s SER 953 Ca -0.06 -1.05 0.03 0.00 1.31 0.00 0.00 55.95 56.18 3ffz s SER 953 Cb -0.15 -0.28 0.01 0.00 0.21 0.00 0.00 66.02 65.81 3ffz s SER 953 CO 0.00 -0.03 -0.13 -0.76 0.41 0.00 0.00 173.24 172.74 3ffz s LEU 954 N -3.49 1.74 0.47 2.44 1.43 0.12 0.18 118.68 121.56 3ffz s LEU 954 Ca 0.29 -0.28 0.03 0.00 -1.03 0.00 0.00 54.13 53.13 3ffz s LEU 954 Cb -0.03 -0.80 -0.03 0.00 0.03 0.00 0.00 46.19 45.36 3ffz s LEU 954 CO 0.14 0.07 0.02 0.21 0.23 0.00 0.00 176.35 177.02 3ffz s ASN 955 N 0.41 3.82 -0.09 2.29 3.84 -0.96 -2.15 114.94 122.10 3ffz s ASN 955 Ca -0.09 -1.60 -0.36 0.00 0.21 0.00 0.00 52.86 51.01 3ffz s ASN 955 Cb -0.13 0.34 -0.14 0.00 -0.55 0.00 0.00 41.25 40.77 3ffz s ASN 955 CO 0.03 -0.79 1.72 1.57 -2.79 0.00 0.00 177.10 176.83 3ffz n HIS 956 N -1.14 2.11 -3.53 0.43 -0.00 -1.26 -1.80 115.22 110.03 3ffz n HIS 956 Ca -0.14 0.31 -0.26 0.00 -0.00 0.00 0.00 57.72 57.63 3ffz n HIS 956 Cb 0.67 -2.53 -0.01 0.00 -0.00 0.00 0.00 29.99 28.12 3ffz n HIS 956 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.34 176.43 3ffz n ASN 957 N 5.17 -3.65 -3.60 0.26 5.03 -1.26 -4.95 115.26 112.26 3ffz n ASN 957 Ca 0.22 -0.51 -0.14 0.00 0.87 0.00 0.00 54.58 55.03 3ffz n ASN 957 Cb 0.22 -3.01 -0.06 0.00 -1.02 0.00 0.00 39.78 35.91 3ffz n ASN 957 CO 0.00 0.00 0.00 -1.83 -1.83 0.00 0.00 177.26 173.60 3ffz s GLU 958 N -6.19 0.98 -0.03 3.52 -1.05 -0.74 -1.55 118.70 113.64 3ffz s GLU 958 Ca 0.47 -0.19 0.06 0.00 -0.15 0.00 0.00 54.97 55.16 3ffz s GLU 958 Cb -0.25 0.45 -0.02 0.00 -0.44 0.00 0.00 34.13 33.87 3ffz s GLU 958 CO 0.58 -0.34 -0.20 0.42 0.95 0.00 0.00 175.26 176.66 3ffz s ILE 959 N -2.19 2.54 -0.04 1.83 1.01 0.23 -2.26 121.20 122.32 3ffz s ILE 959 Ca -0.07 -0.94 0.01 0.00 0.00 0.00 0.00 60.65 59.65 3ffz s ILE 959 Cb -0.01 -1.95 0.02 0.00 0.01 0.00 0.00 42.46 40.54 3ffz s ILE 959 CO 0.00 0.58 -0.03 -0.63 0.00 0.00 0.00 174.94 174.86 3ffz s ILE 960 N -0.68 0.42 -0.17 2.92 1.01 0.13 -1.18 121.20 123.64 3ffz s ILE 960 Ca 0.11 -0.06 -0.03 0.00 0.00 0.00 0.00 60.65 60.67 3ffz s ILE 960 Cb -0.10 -0.47 -0.02 0.00 0.01 0.00 0.00 42.46 41.88 3ffz s ILE 960 CO -0.00 0.20 -0.06 0.86 0.00 0.00 0.00 174.94 175.94 3ffz s TRP 961 N 0.95 2.96 -0.29 3.97 -0.11 0.25 0.02 118.94 126.68 3ffz s TRP 961 Ca -0.11 -0.53 -0.02 0.00 1.22 0.00 0.00 56.10 56.66 3ffz s TRP 961 Cb -0.14 -1.98 0.09 0.00 -1.50 0.00 0.00 33.47 29.95 3ffz s TRP 961 CO -0.00 -0.21 0.10 0.95 -4.62 0.00 0.00 176.95 173.16 3ffz s THR 962 N 0.67 0.60 -0.49 5.86 -4.23 -0.51 -1.18 115.64 116.36 3ffz s THR 962 Ca -0.03 -1.13 -0.20 0.00 -1.18 0.00 0.00 61.69 59.14 3ffz s THR 962 Cb -0.15 -1.42 0.04 0.00 1.34 0.00 0.00 72.50 72.32 3ffz s THR 962 CO 0.02 -0.63 0.67 -0.22 -0.54 0.00 0.00 174.62 173.93 3ffz s LEU 963 N 1.77 4.70 -0.25 4.79 2.96 -1.00 -2.59 118.68 129.06 3ffz s LEU 963 Ca 0.08 -0.66 -0.10 0.00 -0.22 0.00 0.00 54.13 53.22 3ffz s LEU 963 Cb -0.17 -2.58 -0.05 0.00 0.50 0.00 0.00 46.19 43.89 3ffz s LEU 963 CO -0.26 -0.90 0.16 -1.58 -1.32 0.00 0.00 176.35 172.45 3ffz s GLN 964 N 2.87 4.03 0.64 1.98 0.74 0.29 -2.58 119.66 127.62 3ffz s GLN 964 Ca 0.19 -0.29 -0.16 0.00 0.05 0.00 0.00 55.36 55.15 3ffz s GLN 964 Cb -0.17 -3.55 -0.01 0.00 1.10 0.00 0.00 33.01 30.38 3ffz s GLN 964 CO 0.15 0.01 1.13 0.34 -0.55 0.00 0.00 175.29 176.36 3ffz s ASP 965 N 1.21 5.15 0.43 6.67 -1.08 -1.22 -1.61 116.67 126.23 3ffz s ASP 965 Ca 0.07 2.08 0.18 0.00 -0.52 0.00 0.00 52.55 54.36 3ffz s ASP 965 Cb -0.14 -2.56 1.10 0.00 -1.46 0.00 0.00 42.92 39.86 3ffz s ASP 965 CO 0.06 -1.60 1.89 -1.13 0.52 0.00 0.00 175.17 174.91 3ffz h ASN 966 N 0.26 0.36 0.00 -0.34 -1.24 0.40 -3.11 115.58 111.92 3ffz h ASN 966 Ca -0.48 0.03 0.00 0.00 0.71 0.00 0.00 56.30 56.56 3ffz h ASN 966 Cb 1.26 -0.04 0.00 0.00 0.73 0.00 0.00 38.32 40.27 3ffz h ASN 966 CO 0.54 0.16 0.00 0.00 -1.29 0.00 0.00 177.43 176.85 3ffz n ALA 967 N -2.54 -0.41 0.01 1.57 0.00 -1.26 -4.97 120.51 112.91 3ffz n ALA 967 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.61 3ffz n ALA 967 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.08 3ffz n ALA 967 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ffz n GLY 968 N -0.85 -0.52 3.77 0.00 0.00 -1.17 -5.13 105.19 101.28 3ffz n GLY 968 Ca 0.00 0.20 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 3ffz n GLY 968 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ffz s ILE 969 N -2.00 2.77 0.00 -0.61 1.01 -1.26 -4.69 121.20 116.42 3ffz s ILE 969 Ca 0.00 0.76 0.00 0.00 0.00 0.00 0.00 60.65 61.41 3ffz s ILE 969 Cb 0.00 -3.48 0.00 0.00 0.01 0.00 0.00 42.46 38.99 3ffz s ILE 969 CO 0.00 0.17 0.00 -0.46 0.00 0.00 0.00 174.94 174.65 3ffz n ASN 970 N 1.01 1.98 -3.65 3.58 0.23 -1.26 -3.39 115.26 113.75 3ffz n ASN 970 Ca 0.01 0.00 -0.15 0.00 -0.53 0.00 0.00 54.58 53.91 3ffz n ASN 970 Cb 0.42 0.00 -0.08 0.00 -2.08 0.00 0.00 39.78 38.04 3ffz n ASN 970 CO 0.00 0.00 0.00 -1.58 -0.93 0.00 0.00 177.26 174.75 3ffz s GLN 971 N 1.02 0.81 0.35 -3.83 2.00 -1.07 -4.95 119.66 113.99 3ffz s GLN 971 Ca 0.00 0.15 0.09 0.00 -2.00 0.00 0.00 55.36 53.60 3ffz s GLN 971 Cb 0.00 0.38 -0.07 0.00 0.80 0.00 0.00 33.01 34.12 3ffz s GLN 971 CO 0.00 -0.22 -0.08 0.15 -0.50 0.00 0.00 175.29 174.63 3ffz s LYS 972 N -0.99 1.83 -0.19 1.67 1.02 -1.26 -2.38 119.74 119.43 3ffz s LYS 972 Ca -0.10 -1.95 -0.17 0.00 0.02 0.00 0.00 55.97 53.76 3ffz s LYS 972 Cb -0.03 -1.70 0.05 0.00 -0.52 0.00 0.00 37.83 35.63 3ffz s LYS 972 CO 0.06 0.12 0.51 -1.17 -0.92 0.00 0.00 175.35 173.95 3ffz s LEU 973 N -3.62 0.01 0.31 3.17 2.96 -0.33 -4.73 118.68 116.45 3ffz s LEU 973 Ca 0.33 1.04 -0.10 0.00 -0.22 0.00 0.00 54.13 55.18 3ffz s LEU 973 Cb 0.03 1.75 0.01 0.00 0.50 0.00 0.00 46.19 48.48 3ffz s LEU 973 CO 0.17 -0.18 0.54 0.00 -1.32 0.00 0.00 176.35 175.55 3ffz s ALA 974 N 0.36 0.02 -0.25 5.97 0.00 -1.26 -0.58 121.76 126.01 3ffz s ALA 974 Ca -0.01 -1.08 -0.05 0.00 0.00 0.00 0.00 51.96 50.83 3ffz s ALA 974 Cb -0.04 1.03 0.13 0.00 0.00 0.00 0.00 23.12 24.24 3ffz s ALA 974 CO -0.00 -0.86 0.48 0.12 0.00 0.00 0.00 175.76 175.50 3ffz s PHE 975 N -3.38 -1.07 -0.23 0.00 5.36 -0.33 -4.77 117.98 113.57 3ffz s PHE 975 Ca 0.24 1.45 -0.05 0.00 -0.96 0.00 0.00 56.93 57.60 3ffz s PHE 975 Cb -0.01 0.34 -0.01 0.00 -0.34 0.00 0.00 43.02 42.99 3ffz s PHE 975 CO 0.13 -0.68 -0.00 1.21 -1.46 0.00 0.00 175.22 174.42 3ffz s ASN 976 N 2.69 4.60 0.00 6.13 3.84 -1.26 -0.60 114.94 130.33 3ffz s ASN 976 Ca 0.08 -0.34 0.20 0.00 0.21 0.00 0.00 52.86 53.01 3ffz s ASN 976 Cb -0.14 -1.80 0.50 0.00 -0.55 0.00 0.00 41.25 39.25 3ffz s ASN 976 CO -0.17 -0.03 1.42 0.00 -2.79 0.00 0.00 177.10 175.53 3ffz n TYR 977 N 4.84 0.71 -4.93 0.43 0.18 -0.59 -5.01 117.16 112.79 3ffz n TYR 977 Ca -0.17 -0.41 0.00 0.00 1.88 0.00 0.00 57.90 59.19 3ffz n TYR 977 Cb 0.51 -0.01 0.00 0.00 -0.38 0.00 0.00 39.34 39.46 3ffz n TYR 977 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 3ffz n GLY 978 N 1.34 -0.11 0.26 -7.48 0.00 -1.25 -4.27 105.19 93.67 3ffz n GLY 978 Ca 0.20 -0.94 0.03 0.00 0.00 0.00 0.00 46.02 45.31 3ffz n GLY 978 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3ffz n ASN 979 N -2.76 1.66 -1.11 1.61 0.23 -1.26 -4.83 115.26 108.81 3ffz n ASN 979 Ca 0.00 -1.37 0.00 0.00 -0.53 0.00 0.00 54.58 52.68 3ffz n ASN 979 Cb 0.00 -0.02 0.00 0.00 -2.08 0.00 0.00 39.78 37.68 3ffz n ASN 979 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3ffz n ALA 980 N 0.30 -1.17 -2.57 -2.53 0.00 -1.26 -4.81 120.51 108.48 3ffz n ALA 980 Ca 0.04 0.08 -0.34 0.00 0.00 0.00 0.00 53.44 53.23 3ffz n ALA 980 Cb 0.18 -0.67 -0.11 0.00 0.00 0.00 0.00 19.45 18.85 3ffz n ALA 980 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3ffz s ASN 981 N -4.10 4.54 0.17 0.00 2.20 -1.26 -4.09 114.94 112.41 3ffz s ASN 981 Ca 0.00 -0.06 0.00 0.00 -0.94 0.00 0.00 52.86 51.86 3ffz s ASN 981 Cb 0.00 -1.10 0.00 0.00 -2.00 0.00 0.00 41.25 38.15 3ffz s ASN 981 CO 0.00 0.35 0.00 0.61 -2.94 0.00 0.00 177.10 175.12 3ffz n GLY 982 N 2.17 1.12 3.14 0.45 0.00 0.15 -4.82 105.19 107.40 3ffz n GLY 982 Ca -0.18 -1.04 -0.32 0.00 0.00 0.00 0.00 46.02 44.48 3ffz n GLY 982 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3ffz s ILE 983 N 0.00 1.97 0.37 -0.61 -5.25 -1.26 -0.71 121.20 115.70 3ffz s ILE 983 Ca 0.00 -0.92 -0.25 0.00 -0.99 0.00 0.00 60.65 58.49 3ffz s ILE 983 Cb 0.00 -1.75 -0.09 0.00 2.95 0.00 0.00 42.46 43.56 3ffz s ILE 983 CO 0.00 0.53 1.03 -0.55 -1.79 0.00 0.00 174.94 174.17 3ffz s SER 984 N 0.93 6.94 0.00 4.36 0.15 -1.26 -4.97 113.70 119.85 3ffz s SER 984 Ca -0.05 2.03 0.19 0.00 0.70 0.00 0.00 55.95 58.82 3ffz s SER 984 Cb -0.15 -2.59 0.34 0.00 -1.71 0.00 0.00 66.02 61.91 3ffz s SER 984 CO -0.04 -0.36 1.28 0.47 1.20 0.00 0.00 173.24 175.79 3ffz n ASP 985 N 0.21 3.11 0.00 5.45 9.92 -1.26 -4.69 116.55 129.29 3ffz n ASP 985 Ca 0.04 -1.90 0.00 0.00 -0.53 0.00 0.00 54.79 52.39 3ffz n ASP 985 Cb 0.49 -0.20 0.00 0.00 -0.64 0.00 0.00 41.12 40.77 3ffz n ASP 985 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 3ffz n TYR 986 N 1.19 0.00 -1.68 1.24 4.01 -1.26 -4.90 117.16 115.76 3ffz n TYR 986 Ca 0.16 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.48 3ffz n TYR 986 Cb 0.52 0.05 -0.03 0.00 -0.31 0.00 0.00 39.34 39.57 3ffz n TYR 986 CO 0.00 0.00 0.00 -0.89 -0.46 0.00 0.00 176.86 175.51 3ffz n ILE 987 N -2.39 0.49 -0.60 -0.72 5.41 -1.26 -1.93 119.36 118.36 3ffz n ILE 987 Ca 0.00 -0.09 0.00 0.00 1.00 0.00 0.00 62.75 63.66 3ffz n ILE 987 Cb 0.34 -2.20 0.00 0.00 -0.71 0.00 0.00 39.64 37.07 3ffz n ILE 987 CO 0.00 0.00 0.00 -3.20 0.00 0.00 0.00 176.55 173.35 3ffz n ASN 988 N 6.21 0.00 -4.92 4.38 5.15 -0.15 -4.95 115.26 120.98 3ffz n ASN 988 Ca 0.19 0.00 -0.28 0.00 -0.60 0.00 0.00 54.58 53.88 3ffz n ASN 988 Cb 0.39 -1.89 -0.03 0.00 -0.53 0.00 0.00 39.78 37.71 3ffz n ASN 988 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 3ffz s LYS 989 N -0.75 3.57 0.04 1.20 1.02 -0.81 -4.80 119.74 119.21 3ffz s LYS 989 Ca 0.00 -0.19 -0.30 0.00 0.02 0.00 0.00 55.97 55.50 3ffz s LYS 989 Cb 0.00 -2.77 -0.05 0.00 -0.52 0.00 0.00 37.83 34.49 3ffz s LYS 989 CO 0.00 0.34 1.25 -1.58 -0.92 0.00 0.00 175.35 174.44 3ffz s TRP 990 N -1.92 3.28 -0.10 3.18 0.52 -0.34 -4.28 118.94 119.28 3ffz s TRP 990 Ca 0.41 1.17 0.00 0.00 0.02 0.00 0.00 56.10 57.70 3ffz s TRP 990 Cb -0.11 -3.49 -0.02 0.00 -1.15 0.00 0.00 33.47 28.70 3ffz s TRP 990 CO 0.29 -1.58 -0.10 0.42 0.02 0.00 0.00 176.95 176.00 3ffz s ILE 991 N 1.48 3.37 -0.50 2.03 1.01 0.18 -4.93 121.20 123.83 3ffz s ILE 991 Ca 0.60 -0.57 -0.19 0.00 0.00 0.00 0.00 60.65 60.48 3ffz s ILE 991 Cb -0.30 -2.40 0.06 0.00 0.01 0.00 0.00 42.46 39.83 3ffz s ILE 991 CO 0.28 0.55 0.63 0.12 0.00 0.00 0.00 174.94 176.52 3ffz s PHE 992 N -0.15 3.04 -0.10 3.97 5.36 -1.26 -0.39 117.98 128.45 3ffz s PHE 992 Ca 0.01 -0.50 -0.13 0.00 -0.96 0.00 0.00 56.93 55.35 3ffz s PHE 992 Cb -0.13 -3.54 -0.05 0.00 -0.34 0.00 0.00 43.02 38.96 3ffz s PHE 992 CO 0.03 -1.03 0.32 0.08 -1.46 0.00 0.00 175.22 173.15 3ffz s VAL 993 N 2.67 5.24 -0.10 3.12 1.01 0.39 -0.89 120.40 131.85 3ffz s VAL 993 Ca 0.16 0.61 -0.04 0.00 0.00 0.00 0.00 61.98 62.71 3ffz s VAL 993 Cb -0.19 -3.63 0.05 0.00 0.00 0.00 0.00 36.38 32.62 3ffz s VAL 993 CO 0.12 0.49 0.19 -0.89 0.00 0.00 0.00 175.10 175.02 3ffz s THR 994 N -0.29 -0.31 -0.30 3.92 2.01 -0.65 -0.99 115.64 119.03 3ffz s THR 994 Ca 0.19 0.33 -0.05 0.00 0.31 0.00 0.00 61.69 62.46 3ffz s THR 994 Cb -0.14 -0.34 0.02 0.00 0.01 0.00 0.00 72.50 72.05 3ffz s THR 994 CO 0.07 0.14 0.06 -0.63 -0.69 0.00 0.00 174.62 173.57 3ffz s ILE 995 N 2.30 3.64 -0.49 1.82 1.09 0.16 0.18 121.20 129.91 3ffz s ILE 995 Ca 0.02 -0.94 -0.16 0.00 -1.10 0.00 0.00 60.65 58.47 3ffz s ILE 995 Cb -0.12 -2.95 0.09 0.00 -1.06 0.00 0.00 42.46 38.42 3ffz s ILE 995 CO -0.07 0.00 0.43 -0.89 -0.10 0.00 0.00 174.94 174.32 3ffz s THR 996 N 1.42 5.21 -0.11 2.92 2.01 -1.07 -1.16 115.64 124.86 3ffz s THR 996 Ca 0.00 -1.14 -0.12 0.00 0.31 0.00 0.00 61.69 60.75 3ffz s THR 996 Cb -0.18 -4.19 -0.05 0.00 0.01 0.00 0.00 72.50 68.09 3ffz s THR 996 CO 0.01 -0.66 0.26 0.20 -0.69 0.00 0.00 174.62 173.74 3ffz s ASN 997 N 2.85 6.50 -0.38 3.53 -0.87 -0.84 -1.45 114.94 124.28 3ffz s ASN 997 Ca 0.04 0.59 0.01 0.00 -1.57 0.00 0.00 52.86 51.93 3ffz s ASN 997 Cb -0.25 -2.16 0.13 0.00 -0.02 0.00 0.00 41.25 38.95 3ffz s ASN 997 CO 0.06 0.26 0.20 -0.62 -2.57 0.00 0.00 177.10 174.43 3ffz s ASP 998 N -0.41 3.49 0.42 -1.22 2.15 -0.88 -2.82 116.67 117.41 3ffz s ASP 998 Ca 0.17 -2.25 0.25 0.00 0.43 0.00 0.00 52.55 51.15 3ffz s ASP 998 Cb -0.13 -0.77 1.28 0.00 -0.30 0.00 0.00 42.92 43.00 3ffz s ASP 998 CO 0.06 -0.31 1.69 0.03 -0.17 0.00 0.00 175.17 176.46 3ffz h ARG 999 N 7.13 0.21 -2.02 4.34 2.47 -1.87 0.33 114.38 124.97 3ffz h ARG 999 Ca -0.02 -0.01 -0.77 0.00 -1.26 0.00 0.00 59.98 57.92 3ffz h ARG 999 Cb 0.96 -0.05 -0.28 0.00 -1.65 0.00 0.00 29.97 28.96 3ffz h ARG 999 CO 0.41 0.14 1.00 -0.11 0.56 0.00 0.00 179.97 181.97 3ffz n LEU 1000N -4.67 7.41 0.00 3.04 7.94 -1.26 -4.41 117.00 125.05 3ffz n LEU 1000Ca 0.32 -4.93 0.00 0.00 -1.11 0.00 0.00 56.01 50.29 3ffz n LEU 1000Cb 1.18 -1.06 0.00 0.00 0.53 0.00 0.00 43.42 44.07 3ffz n LEU 1000CO 0.23 1.82 0.00 0.61 -1.11 0.00 0.00 177.39 178.93 3ffz n GLY 1001N -0.47 -0.86 3.96 -3.96 0.00 0.11 -5.04 105.19 98.93 3ffz n GLY 1001Ca 0.52 -0.07 -0.24 0.00 0.00 0.00 0.00 46.02 46.24 3ffz n GLY 1001CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3ffz s ASP 1002N -4.00 4.65 -0.51 1.61 1.01 -1.23 -0.39 116.67 117.80 3ffz s ASP 1002Ca 0.00 0.11 0.03 0.00 0.71 0.00 0.00 52.55 53.40 3ffz s ASP 1002Cb 0.00 -0.69 0.15 0.00 1.01 0.00 0.00 42.92 43.39 3ffz s ASP 1002CO 0.00 -1.66 0.32 -0.55 0.21 0.00 0.00 175.17 173.48 3ffz s SER 1003N -4.59 3.73 0.87 0.27 0.15 -1.26 -2.06 113.70 110.81 3ffz s SER 1003Ca 0.62 -3.03 -0.12 0.00 0.70 0.00 0.00 55.95 54.12 3ffz s SER 1003Cb -0.09 -1.19 0.11 0.00 -1.71 0.00 0.00 66.02 63.15 3ffz s SER 1003CO 0.44 -0.21 1.10 -0.54 1.20 0.00 0.00 173.24 175.23 3ffz s LYS 1004N -0.21 1.51 -0.13 5.44 1.02 -0.53 -3.56 119.74 123.27 3ffz s LYS 1004Ca 0.21 0.68 -0.04 0.00 0.02 0.00 0.00 55.97 56.84 3ffz s LYS 1004Cb -0.16 -1.85 0.06 0.00 -0.52 0.00 0.00 37.83 35.36 3ffz s LYS 1004CO -0.06 -2.03 0.14 -1.17 -0.92 0.00 0.00 175.35 171.31 3ffz s LEU 1005N -6.05 0.06 -0.10 3.17 1.98 -0.43 -2.59 118.68 114.71 3ffz s LEU 1005Ca 0.63 -0.11 -0.01 0.00 -2.89 0.00 0.00 54.13 51.74 3ffz s LEU 1005Cb -0.16 0.11 -0.03 0.00 0.66 0.00 0.00 46.19 46.77 3ffz s LEU 1005CO 0.56 -0.30 -0.05 -0.31 -1.89 0.00 0.00 176.35 174.36 3ffz s TYR 1006N 2.24 2.99 -0.25 5.38 1.51 0.13 -1.84 117.35 127.51 3ffz s TYR 1006Ca 0.04 -0.09 0.02 0.00 -1.01 0.00 0.00 57.07 56.04 3ffz s TYR 1006Cb -0.14 -1.81 0.06 0.00 -0.11 0.00 0.00 41.96 39.96 3ffz s TYR 1006CO -0.08 0.21 -0.08 0.42 -1.11 0.00 0.00 175.55 174.91 3ffz s ILE 1007N -0.39 1.91 -1.29 2.71 -1.09 -0.49 -1.64 121.20 120.92 3ffz s ILE 1007Ca 0.06 -1.50 -0.07 0.00 -2.23 0.00 0.00 60.65 56.90 3ffz s ILE 1007Cb -0.12 -2.10 0.01 0.00 -1.58 0.00 0.00 42.46 38.66 3ffz s ILE 1007CO 0.02 -0.09 1.12 0.59 -1.23 0.00 0.00 174.94 175.36 3ffz n ASN 1008N 4.52 -5.56 -1.11 3.58 3.02 -0.06 -2.13 115.26 117.52 3ffz n ASN 1008Ca -0.12 -0.54 -0.11 0.00 -0.03 0.00 0.00 54.58 53.78 3ffz n ASN 1008Cb 0.43 -4.91 -0.02 0.00 -0.61 0.00 0.00 39.78 34.67 3ffz n ASN 1008CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3ffz n GLY 1009N -1.83 0.38 3.02 7.41 0.00 -1.26 -5.00 105.19 107.91 3ffz n GLY 1009Ca -0.04 -0.46 -0.31 0.00 0.00 0.00 0.00 46.02 45.22 3ffz n GLY 1009CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3ffz s ASN 1010N -2.64 3.08 0.10 1.61 0.01 -0.90 -4.93 114.94 111.27 3ffz s ASN 1010Ca 0.00 -0.70 -0.31 0.00 -0.71 0.00 0.00 52.86 51.14 3ffz s ASN 1010Cb 0.00 -1.25 -0.10 0.00 0.41 0.00 0.00 41.25 40.32 3ffz s ASN 1010CO 0.00 -0.09 1.78 -0.22 -1.51 0.00 0.00 177.10 177.06 3ffz s LEU 1011N 1.42 4.39 0.00 0.60 2.96 -1.26 -1.40 118.68 125.39 3ffz s LEU 1011Ca 0.02 2.66 0.00 0.00 -0.22 0.00 0.00 54.13 56.59 3ffz s LEU 1011Cb -0.14 -3.56 0.00 0.00 0.50 0.00 0.00 46.19 42.98 3ffz s LEU 1011CO -0.10 -0.97 0.00 0.00 -1.32 0.00 0.00 176.35 173.96 3ffz n ILE 1012N 4.79 0.00 -3.52 6.68 0.13 -0.76 -4.95 119.36 121.72 3ffz n ILE 1012Ca 0.17 -0.20 0.00 0.00 -1.10 0.00 0.00 62.75 61.62 3ffz n ILE 1012Cb 0.39 0.93 -0.05 0.00 -0.84 0.00 0.00 39.64 40.07 3ffz n ILE 1012CO 0.00 0.00 0.00 -0.62 2.80 0.00 0.00 176.55 178.73 3ffz s ASP 1013N -0.49 -0.41 0.01 9.51 2.15 -1.22 -5.02 116.67 121.20 3ffz s ASP 1013Ca 0.00 0.61 0.03 0.00 0.43 0.00 0.00 52.55 53.62 3ffz s ASP 1013Cb 0.00 1.31 -0.01 0.00 -0.30 0.00 0.00 42.92 43.92 3ffz s ASP 1013CO 0.00 -0.09 -0.09 0.00 -0.17 0.00 0.00 175.17 174.81 3ffz s GLN 1014N 1.72 0.70 -0.36 4.34 -2.07 -1.26 -1.32 119.66 121.42 3ffz s GLN 1014Ca -0.06 -0.45 0.02 0.00 -1.82 0.00 0.00 55.36 53.06 3ffz s GLN 1014Cb -0.04 -0.66 0.15 0.00 -1.09 0.00 0.00 33.01 31.37 3ffz s GLN 1014CO -0.15 0.17 0.35 0.15 -1.32 0.00 0.00 175.29 174.49 3ffz s LYS 1015N -0.56 0.58 0.01 9.60 1.02 -1.23 -4.93 119.74 124.23 3ffz s LYS 1015Ca 0.01 -0.80 -0.04 0.00 0.02 0.00 0.00 55.97 55.17 3ffz s LYS 1015Cb -0.05 -0.77 -0.02 0.00 -0.52 0.00 0.00 37.83 36.47 3ffz s LYS 1015CO 0.00 -1.17 0.08 0.45 -0.92 0.00 0.00 175.35 173.79 3ffz n SER 1016N 4.39 -0.08 -0.72 2.83 2.88 -1.26 -4.10 113.62 117.56 3ffz n SER 1016Ca 0.09 0.12 0.08 0.00 -1.33 0.00 0.00 58.87 57.83 3ffz n SER 1016Cb 0.45 -0.10 0.21 0.00 -0.75 0.00 0.00 64.21 64.01 3ffz n SER 1016CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 3ffz n ILE 1017N 0.07 1.87 0.00 2.46 -5.35 0.47 -4.68 119.36 114.20 3ffz n ILE 1017Ca 0.02 -1.65 0.00 0.00 -0.27 0.00 0.00 62.75 60.85 3ffz n ILE 1017Cb 0.02 -0.03 0.00 0.00 -1.74 0.00 0.00 39.64 37.89 3ffz n ILE 1017CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 3ffz n LEU 1018N -0.32 0.00 0.03 7.28 4.77 -1.24 -1.08 117.00 126.45 3ffz n LEU 1018Ca 0.17 0.22 -0.18 0.00 -0.03 0.00 0.00 56.01 56.19 3ffz n LEU 1018Cb 0.73 -0.22 -0.14 0.00 -2.33 0.00 0.00 43.42 41.46 3ffz n LEU 1018CO 0.12 -0.22 -0.55 0.78 -1.33 0.00 0.00 177.39 176.18 3ffz h ASN 1019N 0.00 0.37 -3.37 -1.43 4.21 -1.91 -3.47 115.58 109.97 3ffz h ASN 1019Ca 0.00 -0.65 -0.53 0.00 1.21 0.00 0.00 56.30 56.34 3ffz h ASN 1019Cb 0.03 -0.12 0.01 0.00 -1.12 0.00 0.00 38.32 37.12 3ffz h ASN 1019CO 0.00 1.56 0.54 -0.76 -1.29 0.00 0.00 177.43 177.49 3ffz s LEU 1020N -6.90 4.42 0.00 1.61 1.02 -0.24 -5.02 118.68 113.57 3ffz s LEU 1020Ca -0.14 2.12 0.00 0.00 0.02 0.00 0.00 54.13 56.13 3ffz s LEU 1020Cb 0.07 -3.59 0.00 0.00 0.02 0.00 0.00 46.19 42.68 3ffz s LEU 1020CO 0.82 -0.38 0.00 0.61 0.02 0.00 0.00 176.35 177.42 3ffz n GLY 1021N 2.60 0.76 3.70 -3.19 0.00 -1.26 -5.00 105.19 102.80 3ffz n GLY 1021Ca 0.06 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.64 3ffz n GLY 1021CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3ffz n ASN 1022N 0.00 3.53 -3.74 1.61 5.15 -1.26 -3.85 115.26 116.70 3ffz n ASN 1022Ca 0.00 1.09 -0.30 0.00 -0.60 0.00 0.00 54.58 54.77 3ffz n ASN 1022Cb 0.00 -1.51 -0.15 0.00 -0.53 0.00 0.00 39.78 37.59 3ffz n ASN 1022CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 3ffz s ILE 1023N 0.78 1.06 -0.60 -1.44 1.01 -1.26 0.11 121.20 120.85 3ffz s ILE 1023Ca 0.74 -1.71 -0.12 0.00 0.00 0.00 0.00 60.65 59.56 3ffz s ILE 1023Cb -0.58 -1.79 0.15 0.00 0.01 0.00 0.00 42.46 40.26 3ffz s ILE 1023CO 0.38 -0.73 0.52 -2.28 0.00 0.00 0.00 174.94 172.84 3ffz s HIS 1024N 1.29 3.45 0.89 3.97 2.46 -1.26 -3.44 115.29 122.66 3ffz s HIS 1024Ca 0.12 -1.78 -0.11 0.00 0.47 0.00 0.00 55.06 53.76 3ffz s HIS 1024Cb -0.19 -3.66 0.13 0.00 -0.13 0.00 0.00 32.58 28.73 3ffz s HIS 1024CO -0.18 -0.99 1.10 0.14 -2.47 0.00 0.00 174.74 172.34 3ffz s VAL 1025N 1.00 2.66 0.96 0.89 -7.23 -1.18 -4.01 120.40 113.49 3ffz s VAL 1025Ca 0.09 0.21 -0.12 0.00 -1.81 0.00 0.00 61.98 60.36 3ffz s VAL 1025Cb -0.23 -2.55 0.17 0.00 0.56 0.00 0.00 36.38 34.33 3ffz s VAL 1025CO -0.02 -0.28 1.09 -0.94 -0.31 0.00 0.00 175.10 174.64 3ffz s SER 1026N -3.16 2.79 -0.02 4.85 1.04 -1.26 -4.79 113.70 113.16 3ffz s SER 1026Ca 0.64 1.61 -0.24 0.00 0.48 0.00 0.00 55.95 58.44 3ffz s SER 1026Cb -0.19 -2.26 -0.17 0.00 0.10 0.00 0.00 66.02 63.50 3ffz s SER 1026CO 0.58 -3.09 1.14 0.44 0.98 0.00 0.00 173.24 173.29 3ffz h ASP 1027N -1.86 -0.21 -3.33 7.02 3.32 -1.94 -3.45 116.42 115.97 3ffz h ASP 1027Ca -0.51 -0.30 -0.66 0.00 0.02 0.00 0.00 57.03 55.58 3ffz h ASP 1027Cb 1.29 0.06 -0.13 0.00 0.22 0.00 0.00 39.33 40.77 3ffz h ASP 1027CO 0.51 0.23 -0.64 0.54 -1.72 0.00 0.00 179.24 178.17 3ffz s ASN 1028N -5.34 5.18 0.10 6.45 2.20 -1.26 -2.73 114.94 119.55 3ffz s ASN 1028Ca -0.14 0.01 -0.18 0.00 -0.94 0.00 0.00 52.86 51.62 3ffz s ASN 1028Cb 0.02 -1.37 -0.07 0.00 -2.00 0.00 0.00 41.25 37.83 3ffz s ASN 1028CO 0.55 0.28 0.56 -0.63 -2.94 0.00 0.00 177.10 174.93 3ffz s ILE 1029N -1.09 4.78 -0.09 0.54 1.01 0.31 -4.51 121.20 122.15 3ffz s ILE 1029Ca 0.20 1.08 0.03 0.00 0.00 0.00 0.00 60.65 61.96 3ffz s ILE 1029Cb -0.12 -3.84 0.01 0.00 0.01 0.00 0.00 42.46 38.53 3ffz s ILE 1029CO 0.10 0.44 -0.18 -0.22 0.00 0.00 0.00 174.94 175.08 3ffz s LEU 1030N -1.42 1.87 -0.43 2.97 0.20 -1.26 0.46 118.68 121.07 3ffz s LEU 1030Ca 0.32 -0.45 -0.04 0.00 0.69 0.00 0.00 54.13 54.66 3ffz s LEU 1030Cb -0.18 -1.15 0.11 0.00 -0.43 0.00 0.00 46.19 44.55 3ffz s LEU 1030CO 0.19 0.09 0.23 -0.36 -0.29 0.00 0.00 176.35 176.21 3ffz s PHE 1031N 0.59 3.56 -0.27 5.38 0.08 0.42 -0.98 117.98 126.76 3ffz s PHE 1031Ca -0.15 -2.37 -0.25 0.00 0.12 0.00 0.00 56.93 54.28 3ffz s PHE 1031Cb -0.17 -3.26 0.07 0.00 -0.57 0.00 0.00 43.02 39.10 3ffz s PHE 1031CO 0.05 -0.97 0.72 0.21 -0.10 0.00 0.00 175.22 175.12 3ffz s LYS 1032N 1.11 0.84 -0.46 0.44 2.20 -0.80 -1.51 119.74 121.56 3ffz s LYS 1032Ca 0.08 1.00 -0.29 0.00 -0.36 0.00 0.00 55.97 56.40 3ffz s LYS 1032Cb -0.23 0.41 0.02 0.00 -1.51 0.00 0.00 37.83 36.52 3ffz s LYS 1032CO -0.04 -0.10 1.20 0.42 -0.36 0.00 0.00 175.35 176.47 3ffz s ILE 1033N 0.39 4.15 -0.13 5.43 1.01 -1.26 -4.31 121.20 126.47 3ffz s ILE 1033Ca -0.00 1.18 0.02 0.00 0.00 0.00 0.00 60.65 61.85 3ffz s ILE 1033Cb -0.05 -4.51 0.00 0.00 0.01 0.00 0.00 42.46 37.91 3ffz s ILE 1033CO 0.01 -0.94 -0.21 -0.69 0.00 0.00 0.00 174.94 173.12 3ffz s VAL 1034N 4.64 2.21 -0.09 2.92 1.01 -0.66 -4.72 120.40 125.73 3ffz s VAL 1034Ca 0.51 -0.94 0.00 0.00 0.00 0.00 0.00 61.98 61.55 3ffz s VAL 1034Cb -0.09 -1.89 0.00 0.00 0.00 0.00 0.00 36.38 34.40 3ffz s VAL 1034CO 0.31 0.54 0.00 0.59 0.00 0.00 0.00 175.10 176.55 3ffz n ASN 1035N 3.93 -2.05 -4.74 3.32 3.02 -1.26 -2.19 115.26 115.28 3ffz n ASN 1035Ca -0.20 0.01 -0.39 0.00 -0.03 0.00 0.00 54.58 53.97 3ffz n ASN 1035Cb 0.52 -0.69 -0.05 0.00 -0.61 0.00 0.00 39.78 38.95 3ffz n ASN 1035CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3ffz h SER 1037N 6.19 0.00 -3.79 0.00 4.64 -1.96 -3.45 113.55 115.18 3ffz h SER 1037Ca -0.43 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.31 3ffz h SER 1037Cb 1.20 0.00 -0.20 0.00 -0.31 0.00 0.00 62.40 63.09 3ffz h SER 1037CO 0.73 0.11 -0.82 -0.72 -0.87 0.00 0.00 176.83 175.26 3ffz s TYR 1038N -3.71 1.95 -0.06 4.77 -0.85 -1.26 -5.10 117.35 113.09 3ffz s TYR 1038Ca 0.00 -0.42 -0.30 0.00 -0.52 0.00 0.00 57.07 55.84 3ffz s TYR 1038Cb 0.10 -1.02 -0.04 0.00 0.38 0.00 0.00 41.96 41.38 3ffz s TYR 1038CO 0.59 0.31 1.42 0.95 -1.52 0.00 0.00 175.55 177.30 3ffz s THR 1039N -1.51 3.85 0.08 -3.49 -4.23 -1.26 -4.96 115.64 104.12 3ffz s THR 1039Ca 0.13 1.13 -0.01 0.00 -1.18 0.00 0.00 61.69 61.76 3ffz s THR 1039Cb -0.08 -3.73 0.00 0.00 1.34 0.00 0.00 72.50 70.03 3ffz s THR 1039CO 0.06 -0.05 0.12 -2.11 -0.54 0.00 0.00 174.62 172.10 3ffz n ARG 1040N 6.16 0.17 -3.64 3.99 1.85 -1.26 -5.01 116.66 118.92 3ffz n ARG 1040Ca 0.14 -0.56 -0.15 0.00 -1.00 0.00 0.00 57.85 56.28 3ffz n ARG 1040Cb 0.44 0.58 -0.08 0.00 -1.05 0.00 0.00 32.46 32.35 3ffz n ARG 1040CO 0.00 0.00 0.00 1.52 -0.01 0.00 0.00 177.63 179.14 3ffz s TYR 1041N -5.37 -0.52 0.06 2.89 -0.85 -1.26 -2.85 117.35 109.45 3ffz s TYR 1041Ca 0.05 1.03 0.05 0.00 -0.52 0.00 0.00 57.07 57.68 3ffz s TYR 1041Cb -0.00 0.26 -0.03 0.00 0.38 0.00 0.00 41.96 42.57 3ffz s TYR 1041CO 0.04 -0.45 -0.15 0.96 -1.52 0.00 0.00 175.55 174.44 3ffz s ILE 1042N -0.73 1.16 0.14 -3.49 -4.36 -0.94 -4.31 121.20 108.67 3ffz s ILE 1042Ca -0.08 -1.18 0.00 0.00 -0.26 0.00 0.00 60.65 59.13 3ffz s ILE 1042Cb -0.03 -1.08 -0.04 0.00 1.25 0.00 0.00 42.46 42.56 3ffz s ILE 1042CO 0.05 -0.10 0.30 -0.83 0.24 0.00 0.00 174.94 174.60 3ffz s GLY 1043N -1.47 1.91 -0.25 6.27 0.00 0.51 -1.95 107.32 112.34 3ffz s GLY 1043Ca 0.00 -0.88 -0.26 0.00 0.00 0.00 0.00 44.72 43.58 3ffz s GLY 1043CO 0.02 -0.86 0.79 -1.50 0.00 0.00 0.00 173.10 171.55 3ffz s ILE 1044N -1.71 0.00 0.16 0.90 2.07 -0.96 -0.13 121.20 121.54 3ffz s ILE 1044Ca 0.36 0.00 -0.16 0.00 -1.41 0.00 0.00 60.65 59.44 3ffz s ILE 1044Cb -0.12 -1.00 0.03 0.00 0.13 0.00 0.00 42.46 41.50 3ffz s ILE 1044CO 0.28 0.00 0.45 0.00 -1.91 0.00 0.00 174.94 173.76 3ffz s ARG 1045N 0.15 1.22 -1.55 3.50 1.70 -0.46 -2.16 118.95 121.35 3ffz s ARG 1045Ca -0.00 -0.81 -0.12 0.00 -0.47 0.00 0.00 55.73 54.33 3ffz s ARG 1045Cb -0.04 0.49 0.09 0.00 -0.57 0.00 0.00 34.95 34.91 3ffz s ARG 1045CO 0.00 -0.50 0.78 0.66 -1.08 0.00 0.00 175.30 175.17 3ffz n TYR 1046N -0.28 -1.94 -2.41 5.89 4.01 -1.26 -1.59 117.16 119.58 3ffz n TYR 1046Ca -0.13 0.83 -0.41 0.00 -0.16 0.00 0.00 57.90 58.03 3ffz n TYR 1046Cb 0.63 -3.60 -0.04 0.00 -0.31 0.00 0.00 39.34 36.02 3ffz n TYR 1046CO 0.00 0.00 0.00 0.12 -0.46 0.00 0.00 176.86 176.52 3ffz s PHE 1047N -3.46 3.46 -0.06 -0.72 5.36 -1.26 -4.24 117.98 117.07 3ffz s PHE 1047Ca 0.51 1.47 -0.30 0.00 -0.96 0.00 0.00 56.93 57.64 3ffz s PHE 1047Cb -0.27 -3.40 0.09 0.00 -0.34 0.00 0.00 43.02 39.11 3ffz s PHE 1047CO 0.88 -1.07 0.78 0.54 -1.46 0.00 0.00 175.22 174.89 3ffz s ASN 1048N 0.07 -0.55 0.12 6.13 2.20 0.02 -1.90 114.94 121.03 3ffz s ASN 1048Ca 0.52 0.53 0.07 0.00 -0.94 0.00 0.00 52.86 53.03 3ffz s ASN 1048Cb -0.32 0.47 -0.04 0.00 -2.00 0.00 0.00 41.25 39.36 3ffz s ASN 1048CO 0.36 -0.56 -0.06 -0.63 -2.94 0.00 0.00 177.10 173.27 3ffz s ILE 1049N -1.49 3.56 0.02 0.54 1.01 -0.97 -1.49 121.20 122.37 3ffz s ILE 1049Ca -0.06 -1.28 0.04 0.00 0.00 0.00 0.00 60.65 59.35 3ffz s ILE 1049Cb -0.00 -2.70 -0.02 0.00 0.01 0.00 0.00 42.46 39.75 3ffz s ILE 1049CO 0.05 0.05 -0.12 -0.36 0.00 0.00 0.00 174.94 174.55 3ffz s PHE 1050N -1.38 1.04 -0.63 3.97 0.08 -0.15 0.35 117.98 121.26 3ffz s PHE 1050Ca 0.24 -0.30 0.03 0.00 0.12 0.00 0.00 56.93 57.01 3ffz s PHE 1050Cb -0.11 -0.63 0.21 0.00 -0.57 0.00 0.00 43.02 41.92 3ffz s PHE 1050CO 0.16 0.00 0.94 -0.40 -0.10 0.00 0.00 175.22 175.82 3ffz n ASP 1051N 2.18 2.50 -2.57 1.36 3.85 -0.85 -2.19 116.55 120.83 3ffz n ASP 1051Ca -0.17 -2.29 -0.13 0.00 -0.71 0.00 0.00 54.79 51.49 3ffz n ASP 1051Cb 0.55 -0.56 -0.04 0.00 -1.35 0.00 0.00 41.12 39.72 3ffz n ASP 1051CO 0.00 0.00 0.00 2.29 -1.01 0.00 0.00 177.20 178.48 3ffz n LYS 1052N 0.14 0.39 -3.36 0.11 2.85 -1.23 -4.55 118.16 112.52 3ffz n LYS 1052Ca 0.10 -2.29 -0.46 0.00 -1.05 0.00 0.00 58.31 54.61 3ffz n LYS 1052Cb 0.58 2.00 -0.04 0.00 -0.65 0.00 0.00 35.03 36.92 3ffz n LYS 1052CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 177.40 175.35 3ffz s GLU 1053N -2.83 3.24 -0.14 -1.58 -6.30 -1.26 -0.90 118.70 108.93 3ffz s GLU 1053Ca 0.26 -2.13 -0.39 0.00 -2.50 0.00 0.00 54.97 50.21 3ffz s GLU 1053Cb 0.01 -4.31 -0.16 0.00 0.00 0.00 0.00 34.13 29.67 3ffz s GLU 1053CO 0.19 -1.29 1.59 1.28 0.02 0.00 0.00 175.26 177.04 3ffz n LEU 1054N 4.50 2.09 -4.87 2.70 4.77 -1.26 -4.93 117.00 119.99 3ffz n LEU 1054Ca 0.01 1.09 -0.32 0.00 -0.03 0.00 0.00 56.01 56.77 3ffz n LEU 1054Cb 0.43 -1.16 -0.05 0.00 -2.33 0.00 0.00 43.42 40.31 3ffz n LEU 1054CO 0.42 -0.67 0.20 -1.81 -1.33 0.00 0.00 177.39 174.20 3ffz s ASP 1055N 2.38 6.63 0.29 -1.43 1.11 -1.26 -4.89 116.67 119.50 3ffz s ASP 1055Ca 0.93 0.90 0.21 0.00 0.18 0.00 0.00 52.55 54.77 3ffz s ASP 1055Cb -1.03 -2.22 1.00 0.00 1.07 0.00 0.00 42.92 41.75 3ffz s ASP 1055CO 0.59 -0.05 1.06 1.21 1.18 0.00 0.00 175.17 179.16 3ffz n GLU 1056N -0.04 -0.03 0.08 8.23 2.13 -1.26 0.65 120.64 130.40 3ffz n GLU 1056Ca -0.00 0.87 -0.07 0.00 0.66 0.00 0.00 57.16 58.62 3ffz n GLU 1056Cb 0.52 -1.68 -0.04 0.00 0.27 0.00 0.00 31.44 30.51 3ffz n GLU 1056CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3ffz h THR 1057N 0.00 1.61 -0.42 6.31 1.03 -2.00 -3.07 112.91 116.36 3ffz h THR 1057Ca 0.60 -3.00 -0.11 0.00 -0.01 0.00 0.00 66.41 63.88 3ffz h THR 1057Cb 1.88 2.65 -0.01 0.00 -1.07 0.00 0.00 68.15 71.60 3ffz h THR 1057CO -0.34 0.86 -0.17 -0.33 -0.01 0.00 0.00 175.52 175.52 3ffz h GLU 1058N 0.02 0.87 -0.48 0.00 3.07 -0.16 -3.01 114.58 114.89 3ffz h GLU 1058Ca -0.02 -0.37 0.06 0.00 -0.50 0.00 0.00 59.36 58.53 3ffz h GLU 1058Cb 1.60 -0.03 -0.05 0.00 -0.84 0.00 0.00 28.75 29.43 3ffz h GLU 1058CO 0.13 1.01 0.19 0.82 -1.40 0.00 0.00 179.01 179.75 3ffz h ILE 1059N 0.69 0.86 0.00 3.13 1.08 -1.53 0.58 117.51 122.32 3ffz h ILE 1059Ca 0.10 -0.13 -0.00 0.00 -0.39 0.00 0.00 64.86 64.44 3ffz h ILE 1059Cb 0.73 0.46 -0.00 0.00 -3.07 0.00 0.00 36.82 34.94 3ffz h ILE 1059CO 0.06 0.07 -0.00 1.56 -0.69 0.00 0.00 178.15 179.14 3ffz h GLN 1060N 0.37 0.00 0.17 2.37 1.08 -1.44 -0.91 115.11 116.74 3ffz h GLN 1060Ca 0.23 0.00 -0.31 0.00 -1.45 0.00 0.00 58.65 57.12 3ffz h GLN 1060Cb 0.22 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 27.66 3ffz h GLN 1060CO -0.22 0.00 -1.51 1.15 -0.95 0.00 0.00 178.83 177.31 3ffz h THR 1061N 0.00 1.08 -0.36 -0.54 2.02 -0.81 -3.13 112.91 111.17 3ffz h THR 1061Ca -0.00 -2.51 -0.01 0.00 0.77 0.00 0.00 66.41 64.67 3ffz h THR 1061Cb 0.01 2.84 -0.02 0.00 -1.74 0.00 0.00 68.15 69.24 3ffz h THR 1061CO 0.00 0.79 0.20 -0.07 0.37 0.00 0.00 175.52 176.81 3ffz h LEU 1062N -0.07 0.44 -2.83 2.58 3.38 -0.85 0.15 115.31 118.11 3ffz h LEU 1062Ca -0.30 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 57.59 3ffz h LEU 1062Cb 1.96 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 42.59 3ffz h LEU 1062CO 0.15 0.40 -0.00 0.22 0.09 0.00 0.00 178.44 179.30 3ffz h TYR 1063N 0.45 0.00 0.00 1.13 3.20 -1.31 -1.41 116.97 119.04 3ffz h TYR 1063Ca 0.13 0.00 -0.17 0.00 3.14 0.00 0.00 58.73 61.83 3ffz h TYR 1063Cb 0.05 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 38.29 3ffz h TYR 1063CO -0.03 0.00 -1.72 0.43 -1.64 0.00 0.00 178.16 175.20 3ffz n SER 1064N -3.11 2.26 -0.00 -2.11 7.64 -0.85 -4.69 113.62 112.76 3ffz n SER 1064Ca -0.03 0.00 0.10 0.00 1.01 0.00 0.00 58.87 59.96 3ffz n SER 1064Cb 0.09 0.91 -0.14 0.00 -1.01 0.00 0.00 64.21 64.07 3ffz n SER 1064CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 3ffz n ASN 1065N -2.32 0.58 0.11 6.43 3.02 0.46 -4.00 115.26 119.55 3ffz n ASN 1065Ca -0.15 -0.57 -0.03 0.00 -0.03 0.00 0.00 54.58 53.80 3ffz n ASN 1065Cb 0.76 1.40 0.12 0.00 -0.61 0.00 0.00 39.78 41.45 3ffz n ASN 1065CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 3ffz h GLU 1066N 0.00 0.08 -0.64 3.52 5.08 -1.44 -3.05 114.58 118.12 3ffz h GLU 1066Ca 0.00 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 3ffz h GLU 1066Cb 0.71 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.97 3ffz h GLU 1066CO 0.00 0.71 0.00 -2.30 -1.00 0.00 0.00 179.01 176.42 3ffz n PRO 1067N -3.78 2.14 -2.68 2.33 -0.02 -1.26 -4.95 135.00 126.77 3ffz n PRO 1067Ca -0.02 -1.08 -0.02 0.00 -2.02 0.00 0.00 63.50 60.36 3ffz n PRO 1067Cb 0.65 -1.58 -0.02 0.00 -0.02 0.00 0.00 33.50 32.54 3ffz n PRO 1067CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3ffz n ASN 1068N 0.25 -5.01 0.33 2.55 3.02 -1.15 -4.71 115.26 110.53 3ffz n ASN 1068Ca 0.10 1.40 0.15 0.00 -0.03 0.00 0.00 54.58 56.19 3ffz n ASN 1068Cb 0.46 -5.28 0.78 0.00 -0.61 0.00 0.00 39.78 35.13 3ffz n ASN 1068CO 0.00 0.00 0.00 0.71 -2.62 0.00 0.00 177.26 175.35 3ffz h THR 1069N 3.50 0.00 0.00 3.41 1.35 -1.80 -2.62 112.91 116.74 3ffz h THR 1069Ca -0.23 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.63 3ffz h THR 1069Cb 0.52 0.63 0.00 0.00 -1.73 0.00 0.00 68.15 67.58 3ffz h THR 1069CO 0.06 0.00 -0.96 0.59 -0.25 0.00 0.00 175.52 174.96 3ffz n ASN 1070N -2.83 0.72 -4.65 5.36 3.02 -1.26 -4.86 115.26 110.75 3ffz n ASN 1070Ca -0.02 -0.55 -0.38 0.00 -0.03 0.00 0.00 54.58 53.59 3ffz n ASN 1070Cb 0.38 0.85 -0.08 0.00 -0.61 0.00 0.00 39.78 40.32 3ffz n ASN 1070CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3ffz s ILE 1071N -3.09 5.21 0.80 2.41 1.01 -0.99 -0.94 121.20 125.62 3ffz s ILE 1071Ca 0.06 0.62 -0.11 0.00 0.00 0.00 0.00 60.65 61.22 3ffz s ILE 1071Cb 0.16 -3.70 0.08 0.00 0.01 0.00 0.00 42.46 39.01 3ffz s ILE 1071CO 0.82 0.24 1.13 -0.76 0.00 0.00 0.00 174.94 176.36 3ffz s LEU 1072N 1.47 3.04 0.43 2.97 1.02 0.20 -4.89 118.68 122.92 3ffz s LEU 1072Ca 0.17 2.04 0.06 0.00 0.02 0.00 0.00 54.13 56.42 3ffz s LEU 1072Cb -0.15 -4.55 -0.05 0.00 0.02 0.00 0.00 46.19 41.46 3ffz s LEU 1072CO 0.08 -2.39 0.11 -0.54 0.02 0.00 0.00 176.35 173.62 3ffz s LYS 1073N -4.60 2.12 0.16 1.70 -0.14 -1.26 -1.10 119.74 116.62 3ffz s LYS 1073Ca 0.65 -2.03 -0.03 0.00 -1.36 0.00 0.00 55.97 53.21 3ffz s LYS 1073Cb -0.21 -1.80 0.04 0.00 -1.68 0.00 0.00 37.83 34.17 3ffz s LYS 1073CO 0.54 -0.15 0.21 -0.25 -0.76 0.00 0.00 175.35 174.94 3ffz n ASP 1074N -1.17 -0.02 0.04 2.83 9.92 0.29 -4.41 116.55 124.02 3ffz n ASP 1074Ca -0.05 -1.06 -0.09 0.00 -0.53 0.00 0.00 54.79 53.06 3ffz n ASP 1074Cb 0.66 -0.16 -0.13 0.00 -0.64 0.00 0.00 41.12 40.84 3ffz n ASP 1074CO 0.00 0.00 0.00 0.15 0.13 0.00 0.00 177.20 177.48 3ffz h PHE 1075N -1.14 0.06 0.00 1.24 3.57 -1.68 -3.23 116.94 115.77 3ffz h PHE 1075Ca -0.07 -0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.38 3ffz h PHE 1075Cb 0.19 -0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.93 3ffz h PHE 1075CO 0.00 1.05 -0.45 0.91 -2.23 0.00 0.00 178.31 177.59 3ffz n TRP 1076N -3.28 0.10 -0.22 0.41 8.01 -1.26 -4.91 117.44 116.29 3ffz n TRP 1076Ca -0.07 0.03 0.00 0.00 -1.31 0.00 0.00 57.50 56.15 3ffz n TRP 1076Cb 0.99 -0.36 0.00 0.00 -2.01 0.00 0.00 31.31 29.93 3ffz n TRP 1076CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3ffz n GLY 1077N 1.47 1.38 3.80 6.99 0.00 -1.22 -1.20 105.19 116.42 3ffz n GLY 1077Ca 0.05 -0.14 -0.22 0.00 0.00 0.00 0.00 46.02 45.71 3ffz n GLY 1077CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3ffz s ASN 1078N -2.14 5.07 0.02 1.61 0.01 -1.26 -4.76 114.94 113.47 3ffz s ASN 1078Ca 0.00 -0.59 -0.30 0.00 -0.71 0.00 0.00 52.86 51.27 3ffz s ASN 1078Cb 0.00 -0.90 -0.08 0.00 0.41 0.00 0.00 41.25 40.68 3ffz s ASN 1078CO 0.00 -0.31 1.85 -0.31 -1.51 0.00 0.00 177.10 176.82 3ffz s TYR 1079N -2.34 1.57 0.33 2.20 2.02 -1.26 0.10 117.35 119.97 3ffz s TYR 1079Ca 0.39 -0.22 -0.29 0.00 -0.37 0.00 0.00 57.07 56.59 3ffz s TYR 1079Cb -0.05 -4.13 -0.12 0.00 -0.40 0.00 0.00 41.96 37.26 3ffz s TYR 1079CO 0.25 -4.96 1.38 -0.11 -1.57 0.00 0.00 175.55 170.54 3ffz n LEU 1080N 7.25 3.84 -4.27 -1.29 7.94 -0.26 -4.74 117.00 125.47 3ffz n LEU 1080Ca 0.19 1.20 -0.26 0.00 -1.11 0.00 0.00 56.01 56.03 3ffz n LEU 1080Cb 0.41 -1.52 -0.14 0.00 0.53 0.00 0.00 43.42 42.71 3ffz n LEU 1080CO 0.66 -0.28 -0.53 -0.76 -1.11 0.00 0.00 177.39 175.38 3ffz s LEU 1081N -1.02 2.19 0.71 -1.96 1.43 -1.26 -2.19 118.68 116.58 3ffz s LEU 1081Ca 0.58 -0.56 -0.11 0.00 -1.03 0.00 0.00 54.13 53.01 3ffz s LEU 1081Cb -0.55 -0.99 0.02 0.00 0.03 0.00 0.00 46.19 44.70 3ffz s LEU 1081CO 0.59 0.15 1.07 -0.31 0.23 0.00 0.00 176.35 178.08 3ffz s TYR 1082N -0.87 3.04 -1.55 0.29 2.02 -0.85 -3.79 117.35 115.65 3ffz s TYR 1082Ca 0.08 1.40 -0.07 0.00 -0.37 0.00 0.00 57.07 58.10 3ffz s TYR 1082Cb -0.09 -2.92 0.06 0.00 -0.40 0.00 0.00 41.96 38.61 3ffz s TYR 1082CO 0.02 -1.34 0.50 -3.47 -1.57 0.00 0.00 175.55 169.70 3ffz n ASP 1083N -3.19 -1.29 -4.07 2.29 4.64 -0.26 -4.95 116.55 109.72 3ffz n ASP 1083Ca 0.08 -1.05 -0.22 0.00 -1.38 0.00 0.00 54.79 52.21 3ffz n ASP 1083Cb 0.54 -2.73 -0.15 0.00 -1.04 0.00 0.00 41.12 37.74 3ffz n ASP 1083CO 0.00 0.00 0.00 -0.75 -0.82 0.00 0.00 177.20 175.63 3ffz s LYS 1084N -6.82 1.22 0.10 -0.67 2.47 -1.25 -5.02 119.74 109.77 3ffz s LYS 1084Ca 0.29 -0.44 -0.30 0.00 -1.56 0.00 0.00 55.97 53.96 3ffz s LYS 1084Cb -0.16 -1.12 -0.06 0.00 -1.46 0.00 0.00 37.83 35.03 3ffz s LYS 1084CO 0.92 0.20 1.12 -1.21 0.16 0.00 0.00 175.35 176.54 3ffz s GLU 1085N -0.00 4.53 -0.01 4.03 2.02 -1.26 -4.30 118.70 123.71 3ffz s GLU 1085Ca -0.01 1.68 0.01 0.00 0.02 0.00 0.00 54.97 56.67 3ffz s GLU 1085Cb -0.08 -3.34 0.00 0.00 0.10 0.00 0.00 34.13 30.81 3ffz s GLU 1085CO 0.01 -0.07 -0.02 0.71 0.02 0.00 0.00 175.26 175.90 3ffz s TYR 1086N 0.49 0.26 0.23 1.61 2.02 0.64 -4.63 117.35 117.98 3ffz s TYR 1086Ca 0.53 -0.04 -0.08 0.00 -0.37 0.00 0.00 57.07 57.12 3ffz s TYR 1086Cb -0.28 -0.20 -0.06 0.00 -0.40 0.00 0.00 41.96 41.01 3ffz s TYR 1086CO 0.31 -0.03 0.52 0.71 -1.57 0.00 0.00 175.55 175.50 3ffz s TYR 1087N 0.12 3.45 -0.08 2.71 2.02 0.22 -0.13 117.35 125.65 3ffz s TYR 1087Ca -0.01 0.76 -0.02 0.00 -0.37 0.00 0.00 57.07 57.43 3ffz s TYR 1087Cb -0.03 -2.18 -0.03 0.00 -0.40 0.00 0.00 41.96 39.32 3ffz s TYR 1087CO -0.00 0.26 0.01 -0.51 -1.57 0.00 0.00 175.55 173.74 3ffz s LEU 1088N -3.01 3.62 -0.13 -1.29 1.43 -1.26 -0.37 118.68 117.67 3ffz s LEU 1088Ca 0.45 0.15 -0.01 0.00 -1.03 0.00 0.00 54.13 53.70 3ffz s LEU 1088Cb -0.11 -1.84 0.04 0.00 0.03 0.00 0.00 46.19 44.30 3ffz s LEU 1088CO 0.24 0.38 -0.03 -0.22 0.23 0.00 0.00 176.35 176.95 3ffz s LEU 1089N -0.93 1.16 0.07 1.79 2.96 -1.05 -4.67 118.68 118.01 3ffz s LEU 1089Ca 0.14 -0.43 -0.22 0.00 -0.22 0.00 0.00 54.13 53.40 3ffz s LEU 1089Cb -0.11 -0.72 -0.06 0.00 0.50 0.00 0.00 46.19 45.79 3ffz s LEU 1089CO 0.03 -0.19 0.65 0.21 -1.32 0.00 0.00 176.35 175.73 3ffz s ASN 1090N 1.78 7.13 0.07 3.68 3.84 -1.26 -1.18 114.94 128.99 3ffz s ASN 1090Ca 0.03 1.34 -0.20 0.00 0.21 0.00 0.00 52.86 54.24 3ffz s ASN 1090Cb -0.14 -2.40 -0.10 0.00 -0.55 0.00 0.00 41.25 38.05 3ffz s ASN 1090CO -0.07 0.18 1.50 0.58 -2.79 0.00 0.00 177.10 176.50 3ffz h VAL 1091N 3.75 1.25 -0.32 -5.21 2.07 -1.27 -2.84 116.25 113.68 3ffz h VAL 1091Ca -0.47 -0.87 -0.03 0.00 0.82 0.00 0.00 66.70 66.15 3ffz h VAL 1091Cb 1.21 1.44 -0.02 0.00 -1.52 0.00 0.00 31.29 32.40 3ffz h VAL 1091CO 0.67 0.26 0.06 0.25 0.02 0.00 0.00 177.57 178.83 3ffz h LEU 1092N 0.11 0.42 -5.77 2.57 5.85 -1.82 -3.27 115.31 113.41 3ffz h LEU 1092Ca 0.06 -0.06 -0.57 0.00 0.84 0.00 0.00 57.88 58.15 3ffz h LEU 1092Cb 0.39 -0.11 -0.41 0.00 0.37 0.00 0.00 40.66 40.90 3ffz h LEU 1092CO 0.01 0.44 -0.77 0.29 -0.34 0.00 0.00 178.44 178.07 3ffz n LYS 1093N -4.35 2.37 0.00 1.25 5.02 -1.22 -4.94 118.16 116.28 3ffz n LYS 1093Ca 0.01 -4.38 0.02 0.00 -2.02 0.00 0.00 58.31 51.94 3ffz n LYS 1093Cb 0.18 -2.04 0.10 0.00 -0.02 0.00 0.00 35.03 33.25 3ffz n LYS 1093CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 3ffz n PRO 1094N 0.37 0.12 -0.10 1.97 -0.04 -1.07 -1.71 135.00 134.53 3ffz n PRO 1094Ca 0.29 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.82 3ffz n PRO 1094Cb 0.46 -1.43 0.12 0.00 -0.04 0.00 0.00 33.50 32.60 3ffz n PRO 1094CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3ffz n ASN 1095N -0.93 2.61 -4.75 3.54 3.02 -1.26 -4.72 115.26 112.76 3ffz n ASN 1095Ca 0.02 -1.77 -0.23 0.00 -0.03 0.00 0.00 54.58 52.58 3ffz n ASN 1095Cb 0.01 -0.13 -0.06 0.00 -0.61 0.00 0.00 39.78 38.99 3ffz n ASN 1095CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 3ffz s ASN 1096N -1.09 4.70 0.06 6.41 0.02 -0.70 0.17 114.94 124.51 3ffz s ASN 1096Ca 0.22 -0.82 -0.04 0.00 -1.02 0.00 0.00 52.86 51.20 3ffz s ASN 1096Cb 0.13 -0.68 -0.02 0.00 0.02 0.00 0.00 41.25 40.70 3ffz s ASN 1096CO 0.18 -0.38 0.06 0.72 0.02 0.00 0.00 177.10 177.71 3ffz s PHE 1097N -2.46 0.34 0.06 2.20 -0.12 -0.71 -4.72 117.98 112.58 3ffz s PHE 1097Ca 0.39 -0.81 -0.12 0.00 -0.05 0.00 0.00 56.93 56.34 3ffz s PHE 1097Cb -0.02 -0.24 -0.06 0.00 -0.63 0.00 0.00 43.02 42.08 3ffz s PHE 1097CO 0.23 -0.43 0.43 0.42 -0.05 0.00 0.00 175.22 175.82 3ffz s ILE 1098N -3.67 5.02 0.07 -4.49 1.09 -1.25 -4.09 121.20 113.89 3ffz s ILE 1098Ca 0.04 0.67 0.02 0.00 -1.10 0.00 0.00 60.65 60.28 3ffz s ILE 1098Cb 0.05 -3.69 -0.03 0.00 -1.06 0.00 0.00 42.46 37.73 3ffz s ILE 1098CO -0.09 0.39 -0.07 -0.62 -0.10 0.00 0.00 174.94 174.44 3ffz s ASP 1099N -1.50 1.01 0.39 3.58 -1.08 -0.22 -1.56 116.67 117.29 3ffz s ASP 1099Ca 0.31 -0.82 -0.24 0.00 -0.52 0.00 0.00 52.55 51.28 3ffz s ASP 1099Cb -0.15 0.07 -0.10 0.00 -1.46 0.00 0.00 42.92 41.29 3ffz s ASP 1099CO 0.17 -0.36 1.00 -0.60 0.52 0.00 0.00 175.17 175.90 3ffz s ARG 1100N -2.90 4.26 0.31 4.34 3.52 -1.26 -0.77 118.95 126.45 3ffz s ARG 1100Ca 0.03 1.37 0.09 0.00 -0.13 0.00 0.00 55.73 57.09 3ffz s ARG 1100Cb -0.01 -2.50 -0.05 0.00 -1.56 0.00 0.00 34.95 30.83 3ffz s ARG 1100CO -0.03 -0.03 -0.01 1.03 -0.81 0.00 0.00 175.30 175.46 3ffz s ARG 1101N -2.58 2.11 0.16 5.12 0.52 -0.25 -4.85 118.95 119.19 3ffz s ARG 1101Ca 0.57 -1.65 -0.15 0.00 -0.52 0.00 0.00 55.73 53.99 3ffz s ARG 1101Cb -0.18 -1.99 0.04 0.00 0.52 0.00 0.00 34.95 33.34 3ffz s ARG 1101CO 0.23 0.22 1.82 0.87 0.02 0.00 0.00 175.30 178.45 3ffz h LYS 1102N 1.87 0.56 0.00 3.54 1.57 -1.98 -1.14 116.57 120.99 3ffz h LYS 1102Ca -0.43 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 3ffz h LYS 1102Cb 1.25 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 33.44 3ffz h LYS 1102CO 0.64 0.37 0.00 -0.40 -0.57 0.00 0.00 179.45 179.49 3ffz n ASP 1103N -4.80 0.00 -0.03 0.86 5.75 -1.26 -4.82 116.55 112.24 3ffz n ASP 1103Ca 0.02 -1.28 -0.00 0.00 -0.01 0.00 0.00 54.79 53.51 3ffz n ASP 1103Cb 0.04 0.00 -0.00 0.00 -1.03 0.00 0.00 41.12 40.13 3ffz n ASP 1103CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 3ffz n SER 1104N -0.53 -3.44 -4.33 -1.12 3.41 -0.43 -4.97 113.62 102.22 3ffz n SER 1104Ca 0.01 0.01 -0.22 0.00 -0.26 0.00 0.00 58.87 58.41 3ffz n SER 1104Cb 0.00 -0.98 0.12 0.00 -0.26 0.00 0.00 64.21 63.09 3ffz n SER 1104CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3ffz n THR 1105N -2.86 0.00 -4.88 6.66 -2.24 -1.26 -1.86 114.28 107.85 3ffz n THR 1105Ca -0.00 -1.42 -0.32 0.00 -2.27 0.00 0.00 64.05 60.03 3ffz n THR 1105Cb 0.08 -0.98 -0.13 0.00 -2.10 0.00 0.00 70.33 67.20 3ffz n THR 1105CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3ffz s LEU 1106N 0.00 2.67 0.14 3.22 1.43 -1.25 -1.09 118.68 123.80 3ffz s LEU 1106Ca 0.63 -0.25 0.08 0.00 -1.03 0.00 0.00 54.13 53.55 3ffz s LEU 1106Cb -0.03 -1.54 -0.04 0.00 0.03 0.00 0.00 46.19 44.61 3ffz s LEU 1106CO 0.42 0.33 -0.11 -0.94 0.23 0.00 0.00 176.35 176.28 3ffz s SER 1107N -0.85 4.27 0.00 2.29 1.04 0.05 -2.50 113.70 117.99 3ffz s SER 1107Ca 0.12 -0.50 0.00 0.00 0.48 0.00 0.00 55.95 56.05 3ffz s SER 1107Cb -0.11 -0.75 0.00 0.00 0.10 0.00 0.00 66.02 65.27 3ffz s SER 1107CO 0.01 0.14 0.51 0.00 0.98 0.00 0.00 173.24 174.89 3ffz n ILE 1108N 0.40 0.26 -0.48 -1.02 0.13 0.23 -1.06 119.36 117.83 3ffz n ILE 1108Ca -0.12 -0.37 -0.15 0.00 -1.10 0.00 0.00 62.75 61.01 3ffz n ILE 1108Cb 0.54 1.10 0.07 0.00 -0.84 0.00 0.00 39.64 40.51 3ffz n ILE 1108CO 0.00 0.00 0.00 -0.46 2.80 0.00 0.00 176.55 178.89 3ffz n ASN 1109N -0.13 4.73 -4.22 9.51 6.94 -1.25 -4.40 115.26 126.44 3ffz n ASN 1109Ca 0.00 -2.96 -0.33 0.00 -0.02 0.00 0.00 54.58 51.27 3ffz n ASN 1109Cb 0.27 -0.83 -0.15 0.00 -2.36 0.00 0.00 39.78 36.70 3ffz n ASN 1109CO 0.00 0.00 0.00 0.20 -1.03 0.00 0.00 177.26 176.43 3ffz s ASN 1110N -0.11 3.52 -0.04 0.53 0.01 -1.26 -5.05 114.94 112.54 3ffz s ASN 1110Ca 0.31 -0.52 -0.12 0.00 -0.71 0.00 0.00 52.86 51.82 3ffz s ASN 1110Cb 0.26 -1.54 -0.05 0.00 0.41 0.00 0.00 41.25 40.32 3ffz s ASN 1110CO 0.03 0.05 0.33 0.27 -1.51 0.00 0.00 177.10 176.27 3ffz s ILE 1111N 0.99 5.18 0.06 0.60 -5.25 -1.26 -1.74 121.20 119.78 3ffz s ILE 1111Ca -0.02 0.65 -0.30 0.00 -0.99 0.00 0.00 60.65 59.98 3ffz s ILE 1111Cb -0.15 -3.62 -0.08 0.00 2.95 0.00 0.00 42.46 41.56 3ffz s ILE 1111CO -0.03 0.59 1.75 -0.13 -1.79 0.00 0.00 174.94 175.32 3ffz s ARG 1112N -1.03 4.17 1.18 0.37 0.52 0.45 -4.93 118.95 119.69 3ffz s ARG 1112Ca 0.21 2.42 -0.14 0.00 -0.52 0.00 0.00 55.73 57.70 3ffz s ARG 1112Cb -0.15 -3.74 0.29 0.00 0.52 0.00 0.00 34.95 31.86 3ffz s ARG 1112CO 0.10 -0.81 1.03 0.45 0.02 0.00 0.00 175.30 176.09 3ffz s SER 1113N 2.94 0.89 0.18 0.23 0.15 -1.26 -4.73 113.70 112.10 3ffz s SER 1113Ca 0.78 1.33 0.03 0.00 0.70 0.00 0.00 55.95 58.78 3ffz s SER 1113Cb -0.41 -2.05 -0.05 0.00 -1.71 0.00 0.00 66.02 61.80 3ffz s SER 1113CO 0.34 -4.23 -0.02 -0.89 1.20 0.00 0.00 173.24 169.64 3ffz s THR 1114N -2.53 0.88 -0.36 6.45 2.01 -1.26 -2.09 115.64 118.73 3ffz s THR 1114Ca 0.68 -2.01 0.00 0.00 0.31 0.00 0.00 61.69 60.67 3ffz s THR 1114Cb -0.22 -2.12 0.14 0.00 0.01 0.00 0.00 72.50 70.31 3ffz s THR 1114CO 0.63 -0.50 0.21 -0.51 -0.69 0.00 0.00 174.62 173.75 3ffz s ILE 1115N -3.52 0.39 -0.88 1.82 2.07 -0.82 -4.88 121.20 115.38 3ffz s ILE 1115Ca 0.23 -1.80 -0.05 0.00 -1.41 0.00 0.00 60.65 57.62 3ffz s ILE 1115Cb 0.05 -1.29 -0.01 0.00 0.13 0.00 0.00 42.46 41.34 3ffz s ILE 1115CO 0.04 -0.94 0.73 0.00 -1.91 0.00 0.00 174.94 172.86 3ffz n LEU 1116N 4.05 -4.87 0.00 8.50 -0.00 -1.26 -3.05 117.00 120.38 3ffz n LEU 1116Ca 0.10 -0.53 0.00 0.00 -0.00 0.00 0.00 56.01 55.57 3ffz n LEU 1116Cb 0.37 -2.78 0.00 0.00 -0.00 0.00 0.00 43.42 41.01 3ffz n LEU 1116CO 0.15 -0.33 0.00 0.18 -0.00 0.00 0.00 177.39 177.40 3ffz n LEU 1117N -2.64 0.00 -4.60 1.47 4.32 -1.26 -4.94 117.00 109.35 3ffz n LEU 1117Ca -0.09 0.00 -0.42 0.00 -0.02 0.00 0.00 56.01 55.48 3ffz n LEU 1117Cb 0.57 0.00 -0.05 0.00 -1.62 0.00 0.00 43.42 42.32 3ffz n LEU 1117CO 0.59 0.00 0.53 0.00 -1.22 0.00 0.00 177.39 177.29 3ffz s ALA 1118N -0.74 3.51 0.84 -1.18 0.00 -1.17 0.33 121.76 123.35 3ffz s ALA 1118Ca 0.00 -0.53 -0.15 0.00 0.00 0.00 0.00 51.96 51.28 3ffz s ALA 1118Cb 0.00 -3.25 -0.02 0.00 0.00 0.00 0.00 23.12 19.85 3ffz s ALA 1118CO 0.00 -1.21 0.36 0.09 0.00 0.00 0.00 175.76 175.00 3ffz n ASN 1119N 6.15 -2.01 -4.67 0.00 3.02 0.11 -1.95 115.26 115.91 3ffz n ASN 1119Ca 0.02 0.44 -0.40 0.00 -0.03 0.00 0.00 54.58 54.62 3ffz n ASN 1119Cb 0.48 -1.17 -0.06 0.00 -0.61 0.00 0.00 39.78 38.43 3ffz n ASN 1119CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 3ffz s ARG 1120N -3.07 4.25 -0.06 3.52 0.52 -0.89 -4.78 118.95 118.44 3ffz s ARG 1120Ca 0.59 0.66 -0.07 0.00 -0.52 0.00 0.00 55.73 56.39 3ffz s ARG 1120Cb -0.28 -3.55 -0.28 0.00 0.52 0.00 0.00 34.95 31.36 3ffz s ARG 1120CO 0.64 -0.18 0.61 -0.07 0.02 0.00 0.00 175.30 176.33 3ffz h LEU 1121N 7.91 0.47 -5.11 2.53 3.38 -1.92 -3.40 115.31 119.18 3ffz h LEU 1121Ca -0.33 -0.81 -0.59 0.00 0.09 0.00 0.00 57.88 56.24 3ffz h LEU 1121Cb 1.15 -0.15 0.03 0.00 0.09 0.00 0.00 40.66 41.77 3ffz h LEU 1121CO 0.77 1.70 3.54 -1.22 0.09 0.00 0.00 178.44 183.32 3ffz n TYR 1122N -3.50 2.14 -4.17 1.13 4.01 -1.26 -4.87 117.16 110.65 3ffz n TYR 1122Ca -0.25 -2.81 -0.18 0.00 -0.16 0.00 0.00 57.90 54.51 3ffz n TYR 1122Cb 1.06 -2.29 -0.12 0.00 -0.31 0.00 0.00 39.34 37.69 3ffz n TYR 1122CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 3ffz s SER 1123N 2.48 1.64 0.00 7.72 0.01 -1.26 -5.09 113.70 119.20 3ffz s SER 1123Ca 0.62 -0.64 0.00 0.00 1.31 0.00 0.00 55.95 57.24 3ffz s SER 1123Cb 0.16 -0.04 0.00 0.00 0.21 0.00 0.00 66.02 66.35 3ffz s SER 1123CO -0.05 -0.10 0.00 0.61 0.41 0.00 0.00 173.24 174.10 3ffz n GLY 1124N 1.17 -2.07 3.72 3.44 0.00 -1.26 -4.66 105.19 105.53 3ffz n GLY 1124Ca -0.20 -1.72 -0.31 0.00 0.00 0.00 0.00 46.02 43.78 3ffz n GLY 1124CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3ffz s ILE 1125N -0.12 2.67 -0.03 -0.61 -4.36 -0.60 -4.99 121.20 113.16 3ffz s ILE 1125Ca 0.00 0.23 0.05 0.00 -0.26 0.00 0.00 60.65 60.67 3ffz s ILE 1125Cb 0.00 -2.50 -0.03 0.00 1.25 0.00 0.00 42.46 41.18 3ffz s ILE 1125CO 0.00 -0.27 -0.17 -0.54 0.24 0.00 0.00 174.94 174.20 3ffz s LYS 1126N -4.69 2.38 0.18 0.37 1.02 -1.26 -4.14 119.74 113.59 3ffz s LYS 1126Ca 0.65 -0.77 0.06 0.00 0.02 0.00 0.00 55.97 55.92 3ffz s LYS 1126Cb -0.21 -2.29 -0.05 0.00 -0.52 0.00 0.00 37.83 34.77 3ffz s LYS 1126CO 0.56 0.60 -0.12 0.14 -0.92 0.00 0.00 175.35 175.61 3ffz s VAL 1127N -0.73 1.43 -0.00 3.17 -7.23 0.82 -1.83 120.40 116.02 3ffz s VAL 1127Ca 0.12 -2.13 0.03 0.00 -1.81 0.00 0.00 61.98 58.18 3ffz s VAL 1127Cb -0.10 -1.95 -0.01 0.00 0.56 0.00 0.00 36.38 34.87 3ffz s VAL 1127CO 0.01 -0.67 -0.09 -0.54 -0.31 0.00 0.00 175.10 173.50 3ffz s LYS 1128N -3.70 0.75 -0.16 4.82 1.02 -0.59 -0.26 119.74 121.61 3ffz s LYS 1128Ca 0.20 -0.35 -0.05 0.00 0.02 0.00 0.00 55.97 55.79 3ffz s LYS 1128Cb 0.01 -0.72 -0.03 0.00 -0.52 0.00 0.00 37.83 36.57 3ffz s LYS 1128CO 0.04 0.20 0.00 0.42 -0.92 0.00 0.00 175.35 175.09 3ffz s ILE 1129N -0.25 4.26 0.06 2.17 1.01 -1.26 -0.39 121.20 126.80 3ffz s ILE 1129Ca 0.03 -0.23 0.07 0.00 0.00 0.00 0.00 60.65 60.53 3ffz s ILE 1129Cb -0.04 -2.88 -0.03 0.00 0.01 0.00 0.00 42.46 39.52 3ffz s ILE 1129CO -0.00 0.49 -0.20 0.00 0.00 0.00 0.00 174.94 175.23 3ffz s GLN 1130N 0.29 1.22 -0.17 2.79 -2.07 -0.75 -1.11 119.66 119.87 3ffz s GLN 1130Ca -0.01 -0.99 -0.29 0.00 -1.82 0.00 0.00 55.36 52.25 3ffz s GLN 1130Cb -0.13 -1.37 -0.02 0.00 -1.09 0.00 0.00 33.01 30.40 3ffz s GLN 1130CO 0.02 0.34 1.40 0.50 -1.32 0.00 0.00 175.29 176.22 3ffz s ARG 1131N -1.43 4.11 0.29 9.60 3.52 -1.26 -1.30 118.95 132.48 3ffz s ARG 1131Ca 0.06 1.70 -0.00 0.00 -0.13 0.00 0.00 55.73 57.35 3ffz s ARG 1131Cb -0.09 -3.87 0.49 0.00 -1.56 0.00 0.00 34.95 29.92 3ffz s ARG 1131CO 0.03 -0.89 1.91 0.28 -0.81 0.00 0.00 175.30 175.82 3ffz h VAL 1132N 5.68 1.09 -1.72 7.11 2.07 -1.82 -3.43 116.25 125.23 3ffz h VAL 1132Ca -0.30 -0.37 0.00 0.00 0.82 0.00 0.00 66.70 66.85 3ffz h VAL 1132Cb 1.12 -0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.82 3ffz h VAL 1132CO 0.98 0.20 0.00 -0.46 0.02 0.00 0.00 177.57 178.31 3ffz n ASN 1133N -4.48 0.00 0.00 0.57 6.94 -1.26 -5.10 115.26 111.93 3ffz n ASN 1133Ca 0.13 -0.34 0.00 0.00 -0.02 0.00 0.00 54.58 54.35 3ffz n ASN 1133Cb 0.17 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.59 3ffz n ASN 1133CO 0.00 0.00 0.00 -3.20 -1.03 0.00 0.00 177.26 173.03 3ffz n ASN 1134N -1.02 0.00 -3.60 0.53 5.15 -1.26 -5.18 115.26 109.87 3ffz n ASN 1134Ca 0.00 0.00 -0.03 0.00 -0.60 0.00 0.00 54.58 53.95 3ffz n ASN 1134Cb 0.00 0.00 -0.02 0.00 -0.53 0.00 0.00 39.78 39.23 3ffz n ASN 1134CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 3ffz s SER 1135N 0.00 -0.11 0.34 1.20 0.15 -1.26 -5.08 113.70 108.94 3ffz s SER 1135Ca 0.00 -0.03 -0.27 0.00 0.70 0.00 0.00 55.95 56.35 3ffz s SER 1135Cb 0.00 0.14 -0.09 0.00 -1.71 0.00 0.00 66.02 64.36 3ffz s SER 1135CO 0.00 -0.23 1.14 -0.55 1.20 0.00 0.00 173.24 174.80 3ffz s SER 1136N -2.36 6.89 -1.58 5.45 0.15 -1.26 -1.41 113.70 119.58 3ffz s SER 1136Ca 0.11 2.31 -0.01 0.00 0.70 0.00 0.00 55.95 59.06 3ffz s SER 1136Cb 0.00 -2.62 0.00 0.00 -1.71 0.00 0.00 66.02 61.70 3ffz s SER 1136CO -0.04 -0.41 0.12 0.41 1.20 0.00 0.00 173.24 174.51 3ffz n THR 1137N 0.60 -1.10 -2.03 6.45 -1.04 -1.26 -4.92 114.28 110.99 3ffz n THR 1137Ca 0.02 0.00 -0.43 0.00 -2.04 0.00 0.00 64.05 61.60 3ffz n THR 1137Cb 0.46 -2.86 -0.03 0.00 -1.82 0.00 0.00 70.33 66.08 3ffz n THR 1137CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 3ffz s ASN 1138N -2.27 6.30 0.33 8.00 3.04 -0.50 -4.98 114.94 124.87 3ffz s ASN 1138Ca 0.06 1.75 -0.28 0.00 0.04 0.00 0.00 52.86 54.43 3ffz s ASN 1138Cb -0.03 -2.53 -0.09 0.00 -1.54 0.00 0.00 41.25 37.06 3ffz s ASN 1138CO 0.07 -1.30 1.13 -0.62 -3.04 0.00 0.00 177.10 173.34 3ffz s ASP 1139N 4.61 6.98 -0.01 -4.21 2.15 -1.26 -5.00 116.67 119.94 3ffz s ASP 1139Ca 0.76 2.30 0.02 0.00 0.43 0.00 0.00 52.55 56.05 3ffz s ASP 1139Cb -0.27 -2.62 0.07 0.00 -0.30 0.00 0.00 42.92 39.79 3ffz s ASP 1139CO 0.31 -0.35 0.92 -0.46 -0.17 0.00 0.00 175.17 175.42 3ffz n ASN 1140N 0.72 0.69 -4.88 -0.34 6.94 -1.26 -4.90 115.26 112.23 3ffz n ASN 1140Ca 0.01 -2.03 -0.35 0.00 -0.02 0.00 0.00 54.58 52.19 3ffz n ASN 1140Cb 0.46 -0.19 -0.05 0.00 -2.36 0.00 0.00 39.78 37.63 3ffz n ASN 1140CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 3ffz s LEU 1141N -0.78 4.39 -0.17 -4.53 1.43 -1.26 -2.00 118.68 115.76 3ffz s LEU 1141Ca 0.05 0.53 -0.15 0.00 -1.03 0.00 0.00 54.13 53.53 3ffz s LEU 1141Cb 0.03 -2.45 -0.04 0.00 0.03 0.00 0.00 46.19 43.76 3ffz s LEU 1141CO 0.03 0.32 0.35 -0.69 0.23 0.00 0.00 176.35 176.58 3ffz s VAL 1142N -1.19 5.26 0.35 -1.59 1.01 -0.93 -4.88 120.40 118.43 3ffz s VAL 1142Ca 0.23 0.64 0.09 0.00 0.00 0.00 0.00 61.98 62.94 3ffz s VAL 1142Cb -0.13 -3.68 -0.06 0.00 0.00 0.00 0.00 36.38 32.51 3ffz s VAL 1142CO 0.12 0.34 0.03 -0.13 0.00 0.00 0.00 175.10 175.46 3ffz s ARG 1143N 0.75 2.09 0.00 2.72 0.52 -1.26 -0.63 118.95 123.13 3ffz s ARG 1143Ca 0.18 -1.79 0.00 0.00 -0.52 0.00 0.00 55.73 53.60 3ffz s ARG 1143Cb -0.14 -1.91 0.00 0.00 0.52 0.00 0.00 34.95 33.42 3ffz s ARG 1143CO 0.06 0.09 0.10 1.17 0.02 0.00 0.00 175.30 176.73 3ffz n LYS 1144N -0.99 0.00 0.00 3.54 4.81 -0.11 -2.16 118.16 123.25 3ffz n LYS 1144Ca -0.04 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.40 3ffz n LYS 1144Cb 0.63 -1.20 0.00 0.00 0.02 0.00 0.00 35.03 34.48 3ffz n LYS 1144CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 3ffz n ASN 1145N -0.44 0.00 -4.74 3.14 3.02 -1.18 -4.50 115.26 110.56 3ffz n ASN 1145Ca 0.00 -0.87 -0.42 0.00 -0.03 0.00 0.00 54.58 53.26 3ffz n ASN 1145Cb 0.00 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.16 3ffz n ASN 1145CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3ffz n ASP 1146N 0.00 3.51 -4.64 6.41 8.00 -0.92 -4.70 116.55 124.21 3ffz n ASP 1146Ca 0.00 1.19 -0.36 0.00 0.71 0.00 0.00 54.79 56.32 3ffz n ASP 1146Cb 0.43 -1.56 -0.10 0.00 -0.02 0.00 0.00 41.12 39.87 3ffz n ASP 1146CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3ffz s GLN 1147N -1.29 4.04 0.00 -1.24 -2.07 -1.26 -2.27 119.66 115.56 3ffz s GLN 1147Ca 0.59 -0.29 0.00 0.00 -1.82 0.00 0.00 55.36 53.84 3ffz s GLN 1147Cb -0.52 -3.52 0.00 0.00 -1.09 0.00 0.00 33.01 27.88 3ffz s GLN 1147CO 0.56 0.04 0.00 1.33 -1.32 0.00 0.00 175.29 175.91 3ffz n VAL 1148N 4.33 0.00 -4.20 3.63 0.24 0.18 -3.01 118.33 119.50 3ffz n VAL 1148Ca -0.15 0.00 -0.22 0.00 -2.04 0.00 0.00 64.34 61.93 3ffz n VAL 1148Cb 0.52 0.00 -0.17 0.00 -1.47 0.00 0.00 33.84 32.72 3ffz n VAL 1148CO 0.00 0.00 0.00 -0.31 -2.14 0.00 0.00 176.83 174.38 3ffz s TYR 1149N -0.74 1.02 -0.43 6.34 2.02 -0.42 -2.61 117.35 122.55 3ffz s TYR 1149Ca 0.00 -0.36 -0.17 0.00 -0.37 0.00 0.00 57.07 56.18 3ffz s TYR 1149Cb 0.00 -0.86 0.03 0.00 -0.40 0.00 0.00 41.96 40.73 3ffz s TYR 1149CO 0.00 -0.27 0.40 0.42 -1.57 0.00 0.00 175.55 174.53 3ffz s ILE 1150N 1.07 5.14 0.02 2.71 -1.09 -1.26 -1.80 121.20 125.99 3ffz s ILE 1150Ca -0.08 -0.51 -0.03 0.00 -2.23 0.00 0.00 60.65 57.80 3ffz s ILE 1150Cb -0.14 -4.03 -0.04 0.00 -1.58 0.00 0.00 42.46 36.67 3ffz s ILE 1150CO -0.01 -0.42 0.23 0.20 -1.23 0.00 0.00 174.94 173.71 3ffz s ASN 1151N 1.87 6.41 -0.08 3.58 0.01 0.48 -2.29 114.94 124.92 3ffz s ASN 1151Ca 0.09 0.41 -0.20 0.00 -0.71 0.00 0.00 52.86 52.45 3ffz s ASN 1151Cb -0.18 -2.02 -0.04 0.00 0.41 0.00 0.00 41.25 39.41 3ffz s ASN 1151CO 0.12 0.22 0.57 0.12 -1.51 0.00 0.00 177.10 176.62 3ffz s PHE 1152N -1.39 3.56 -0.16 2.20 5.36 0.96 -1.55 117.98 126.96 3ffz s PHE 1152Ca 0.30 1.06 -0.15 0.00 -0.96 0.00 0.00 56.93 57.18 3ffz s PHE 1152Cb -0.13 -2.64 -0.04 0.00 -0.34 0.00 0.00 43.02 39.87 3ffz s PHE 1152CO 0.21 0.18 0.34 0.14 -1.46 0.00 0.00 175.22 174.62 3ffz s VAL 1153N 0.53 5.27 -0.08 3.12 -7.23 -0.76 -0.86 120.40 120.40 3ffz s VAL 1153Ca 0.30 0.64 0.18 0.00 -1.81 0.00 0.00 61.98 61.29 3ffz s VAL 1153Cb -0.16 -3.68 -0.26 0.00 0.56 0.00 0.00 36.38 32.83 3ffz s VAL 1153CO 0.14 0.35 0.29 0.00 -0.31 0.00 0.00 175.10 175.57 3ffz n ALA 1154N 3.78 2.30 -3.72 1.32 0.00 -0.93 -4.69 120.51 118.56 3ffz n ALA 1154Ca -0.10 -0.68 -0.01 0.00 0.00 0.00 0.00 53.44 52.65 3ffz n ALA 1154Cb 0.52 -0.46 -0.00 0.00 0.00 0.00 0.00 19.45 19.50 3ffz n ALA 1154CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3ffz s SER 1155N -4.48 -0.09 0.55 0.00 1.04 -1.20 -5.00 113.70 104.52 3ffz s SER 1155Ca -0.07 -0.29 0.45 0.00 0.48 0.00 0.00 55.95 56.51 3ffz s SER 1155Cb 0.10 0.31 1.66 0.00 0.10 0.00 0.00 66.02 68.19 3ffz s SER 1155CO 0.75 -0.58 1.67 0.50 0.98 0.00 0.00 173.24 176.56 3ffz h LYS 1156N 2.00 0.00 0.00 4.02 3.64 -2.03 -3.33 116.57 120.87 3ffz h LYS 1156Ca -0.27 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.11 3ffz h LYS 1156Cb 1.21 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.03 3ffz h LYS 1156CO 0.28 0.00 0.00 2.41 -2.27 0.00 0.00 179.45 179.87 3ffz n THR 1157N -4.04 0.00 -0.86 1.00 -1.04 -1.26 -5.02 114.28 103.05 3ffz n THR 1157Ca 0.36 0.00 -0.34 0.00 -2.04 0.00 0.00 64.05 62.04 3ffz n THR 1157Cb 1.69 0.00 -0.05 0.00 -1.82 0.00 0.00 70.33 70.15 3ffz n THR 1157CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 3ffz n HIS 1158N 0.00 0.38 -4.24 -1.42 8.25 -1.25 -4.82 115.22 112.11 3ffz n HIS 1158Ca 0.00 0.61 -0.17 0.00 -0.26 0.00 0.00 57.72 57.89 3ffz n HIS 1158Cb 0.00 -1.19 -0.11 0.00 1.12 0.00 0.00 29.99 29.81 3ffz n HIS 1158CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3ffz s LEU 1159N 0.03 2.43 -0.01 2.41 1.43 -1.26 -2.20 118.68 121.51 3ffz s LEU 1159Ca 0.52 -0.85 0.01 0.00 -1.03 0.00 0.00 54.13 52.78 3ffz s LEU 1159Cb -0.73 -0.51 0.00 0.00 0.03 0.00 0.00 46.19 44.98 3ffz s LEU 1159CO 0.33 -0.18 -0.04 -0.36 0.23 0.00 0.00 176.35 176.33 3ffz s PHE 1160N -2.37 0.36 0.58 0.29 0.40 -0.04 -4.93 117.98 112.28 3ffz s PHE 1160Ca 0.10 -0.07 -0.19 0.00 -0.60 0.00 0.00 56.93 56.18 3ffz s PHE 1160Cb -0.03 -0.26 -0.04 0.00 0.51 0.00 0.00 43.02 43.20 3ffz s PHE 1160CO 0.03 -0.02 1.21 -1.25 0.70 0.00 0.00 175.22 175.89 3ffz s PRO 1161N 0.03 3.05 -0.23 0.24 0.04 -1.26 -0.03 135.00 136.85 3ffz s PRO 1161Ca 0.00 1.84 -0.06 0.00 0.04 0.00 0.00 61.00 62.82 3ffz s PRO 1161Cb -0.03 -1.98 -0.03 0.00 0.04 0.00 0.00 34.50 32.50 3ffz s PRO 1161CO -0.00 -1.14 0.04 -0.51 0.04 0.00 0.00 177.00 175.42 3ffz s LEU 1162N -3.95 3.34 0.27 -3.56 1.43 -0.97 -0.63 118.68 114.61 3ffz s LEU 1162Ca 0.76 -0.22 0.02 0.00 -1.03 0.00 0.00 54.13 53.66 3ffz s LEU 1162Cb -0.31 -1.88 -0.05 0.00 0.03 0.00 0.00 46.19 43.98 3ffz s LEU 1162CO 0.34 0.00 0.09 -0.72 0.23 0.00 0.00 176.35 176.28 3ffz s TYR 1163N 1.39 1.62 -0.19 0.29 -0.85 -0.72 -4.74 117.35 114.14 3ffz s TYR 1163Ca 0.05 -1.13 -0.08 0.00 -0.52 0.00 0.00 57.07 55.39 3ffz s TYR 1163Cb -0.15 -0.97 -0.04 0.00 0.38 0.00 0.00 41.96 41.18 3ffz s TYR 1163CO 0.02 -0.26 0.08 0.00 -1.52 0.00 0.00 175.55 173.87 3ffz s ALA 1164N -3.66 3.45 -1.06 9.51 0.00 -1.26 -0.94 121.76 127.81 3ffz s ALA 1164Ca 0.37 -0.77 -0.22 0.00 0.00 0.00 0.00 51.96 51.34 3ffz s ALA 1164Cb 0.08 -2.00 0.05 0.00 0.00 0.00 0.00 23.12 21.26 3ffz s ALA 1164CO 0.14 0.11 1.49 0.34 0.00 0.00 0.00 175.76 177.84 3ffz s ASP 1165N 0.49 6.54 0.56 0.00 -1.08 -0.53 -4.79 116.67 117.86 3ffz s ASP 1165Ca 0.04 -1.57 0.36 0.00 -0.52 0.00 0.00 52.55 50.86 3ffz s ASP 1165Cb -0.12 -2.57 1.62 0.00 -1.46 0.00 0.00 42.92 40.39 3ffz s ASP 1165CO 0.00 -1.47 2.07 0.71 0.52 0.00 0.00 175.17 177.00 3ffz h THR 1166N 6.64 0.00 -0.63 1.71 1.35 -1.95 -3.39 112.91 116.65 3ffz h THR 1166Ca 0.23 -0.36 -0.36 0.00 -0.55 0.00 0.00 66.41 65.37 3ffz h THR 1166Cb 0.99 1.34 -0.05 0.00 -1.73 0.00 0.00 68.15 68.70 3ffz h THR 1166CO 1.43 0.00 1.06 0.00 -0.25 0.00 0.00 175.52 177.76 3ffz s ALA 1167N -3.77 1.92 0.03 6.62 0.00 -1.26 -4.81 121.76 120.49 3ffz s ALA 1167Ca -0.00 -1.97 -0.28 0.00 0.00 0.00 0.00 51.96 49.70 3ffz s ALA 1167Cb 0.10 -4.62 0.10 0.00 0.00 0.00 0.00 23.12 18.70 3ffz s ALA 1167CO 0.50 -4.82 1.23 0.95 0.00 0.00 0.00 175.76 173.61 3ffz s THR 1168N 9.76 0.00 -0.59 0.00 -4.23 -1.26 -5.09 115.64 114.23 3ffz s THR 1168Ca 0.66 -0.28 0.05 0.00 -1.18 0.00 0.00 61.69 60.95 3ffz s THR 1168Cb -0.03 -2.54 0.20 0.00 1.34 0.00 0.00 72.50 71.47 3ffz s THR 1168CO 0.06 0.00 0.52 0.41 -0.54 0.00 0.00 174.62 175.07 3ffz n THR 1169N -0.70 0.89 -1.85 3.99 -1.04 -1.26 -4.84 114.28 109.47 3ffz n THR 1169Ca -0.02 -4.52 0.00 0.00 -2.04 0.00 0.00 64.05 57.46 3ffz n THR 1169Cb 0.60 -2.02 0.00 0.00 -1.82 0.00 0.00 70.33 67.09 3ffz n THR 1169CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 3ffz n ASN 1170N 1.86 0.00 0.00 8.00 4.05 -1.26 -5.02 115.26 122.89 3ffz n ASN 1170Ca 0.25 -1.00 0.00 0.00 0.45 0.00 0.00 54.58 54.28 3ffz n ASN 1170Cb 0.41 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.42 3ffz n ASN 1170CO 0.00 0.00 0.00 1.17 -3.05 0.00 0.00 177.26 175.38 3ffz n LYS 1171N 0.00 0.00 -3.24 1.20 4.81 -1.26 -4.84 118.16 114.83 3ffz n LYS 1171Ca 0.00 0.00 -0.39 0.00 -0.87 0.00 0.00 58.31 57.05 3ffz n LYS 1171Cb 0.31 -0.24 -0.07 0.00 0.02 0.00 0.00 35.03 35.05 3ffz n LYS 1171CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 3ffz s GLU 1172N 0.00 4.17 -0.30 1.64 8.01 -1.26 -3.88 118.70 127.07 3ffz s GLU 1172Ca 0.00 0.40 -0.10 0.00 0.01 0.00 0.00 54.97 55.29 3ffz s GLU 1172Cb 0.00 -3.58 -0.02 0.00 -4.31 0.00 0.00 34.13 26.23 3ffz s GLU 1172CO 0.00 -0.18 0.15 0.15 0.01 0.00 0.00 175.26 175.39 3ffz s LYS 1173N 1.75 3.48 0.09 1.61 -0.14 -0.48 -4.93 119.74 121.13 3ffz s LYS 1173Ca 0.24 -0.62 -0.31 0.00 -1.36 0.00 0.00 55.97 53.92 3ffz s LYS 1173Cb -0.15 -3.56 -0.08 0.00 -1.68 0.00 0.00 37.83 32.35 3ffz s LYS 1173CO 0.09 -0.35 1.60 0.99 -0.76 0.00 0.00 175.35 176.93 3ffz s THR 1174N 1.64 3.00 0.32 2.17 2.01 -1.26 -1.27 115.64 122.26 3ffz s THR 1174Ca 0.05 0.54 -0.28 0.00 0.31 0.00 0.00 61.69 62.31 3ffz s THR 1174Cb -0.17 -3.35 -0.09 0.00 0.01 0.00 0.00 72.50 68.90 3ffz s THR 1174CO 0.07 0.01 1.13 -0.63 -0.69 0.00 0.00 174.62 174.51 3ffz s ILE 1175N 2.21 3.36 0.11 1.82 -1.09 -1.04 -1.46 121.20 125.11 3ffz s ILE 1175Ca 0.72 1.29 -0.04 0.00 -2.23 0.00 0.00 60.65 60.39 3ffz s ILE 1175Cb -0.40 -3.79 -0.03 0.00 -1.58 0.00 0.00 42.46 36.66 3ffz s ILE 1175CO 0.31 0.25 0.10 -0.54 -1.23 0.00 0.00 174.94 173.84 3ffz s LYS 1176N -1.75 0.87 -0.25 2.79 1.02 -0.11 -3.91 119.74 118.39 3ffz s LYS 1176Ca 0.49 -1.24 -0.11 0.00 0.02 0.00 0.00 55.97 55.12 3ffz s LYS 1176Cb -0.32 0.28 -0.05 0.00 -0.52 0.00 0.00 37.83 37.22 3ffz s LYS 1176CO 0.41 -0.25 0.20 0.42 -0.92 0.00 0.00 175.35 175.21 3ffz s ILE 1177N -3.96 5.32 -0.20 2.17 1.01 -0.77 -1.75 121.20 123.01 3ffz s ILE 1177Ca 0.14 0.24 -0.29 0.00 0.00 0.00 0.00 60.65 60.75 3ffz s ILE 1177Cb 0.06 -3.54 0.00 0.00 0.01 0.00 0.00 42.46 39.00 3ffz s ILE 1177CO -0.04 0.30 1.00 -0.55 0.00 0.00 0.00 174.94 175.65 3ffz s SER 1178N 1.29 7.10 0.43 3.58 0.15 0.20 -4.93 113.70 121.52 3ffz s SER 1178Ca 0.09 1.37 0.23 0.00 0.70 0.00 0.00 55.95 58.34 3ffz s SER 1178Cb -0.14 -2.53 0.38 0.00 -1.71 0.00 0.00 66.02 62.02 3ffz s SER 1178CO 0.07 -0.59 1.62 0.77 1.20 0.00 0.00 173.24 176.30 3ffz h SER 1179N 7.39 0.00 0.21 5.45 4.64 -1.94 -3.30 113.55 126.00 3ffz h SER 1179Ca -0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.10 3ffz h SER 1179Cb 1.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 3ffz h SER 1179CO 0.94 0.06 -0.27 -1.54 -0.87 0.00 0.00 176.83 175.15 3ffz n SER 1180N -3.12 1.12 0.00 4.97 3.41 -1.26 -4.91 113.62 113.83 3ffz n SER 1180Ca 0.03 -0.96 0.00 0.00 -0.26 0.00 0.00 58.87 57.69 3ffz n SER 1180Cb 0.54 0.16 0.00 0.00 -0.26 0.00 0.00 64.21 64.65 3ffz n SER 1180CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3ffz n GLY 1181N 1.34 1.28 3.64 5.00 0.00 -1.24 -4.99 105.19 110.21 3ffz n GLY 1181Ca 0.12 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.71 3ffz n GLY 1181CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3ffz s ASN 1182N -3.14 6.55 0.45 1.61 2.47 -1.26 -4.72 114.94 116.90 3ffz s ASN 1182Ca 0.00 1.79 0.31 0.00 0.42 0.00 0.00 52.86 55.38 3ffz s ASN 1182Cb 0.00 -2.53 1.36 0.00 -1.45 0.00 0.00 41.25 38.63 3ffz s ASN 1182CO 0.00 -1.09 1.92 0.03 -3.72 0.00 0.00 177.10 174.24 3ffz h ARG 1183N 9.98 0.00 -5.72 0.43 2.47 -1.94 -3.46 114.38 116.13 3ffz h ARG 1183Ca -0.34 0.00 -0.35 0.00 -1.26 0.00 0.00 59.98 58.03 3ffz h ARG 1183Cb 1.15 0.00 0.16 0.00 -1.65 0.00 0.00 29.97 29.63 3ffz h ARG 1183CO 0.98 0.00 -0.75 1.19 0.56 0.00 0.00 179.97 181.96 3ffz n PHE 1184N -2.75 -2.37 -4.06 3.04 3.72 -1.26 -3.30 117.46 110.47 3ffz n PHE 1184Ca 0.00 0.96 -0.40 0.00 -0.05 0.00 0.00 57.45 57.96 3ffz n PHE 1184Cb 0.23 -5.05 0.00 0.00 -0.94 0.00 0.00 39.48 33.73 3ffz n PHE 1184CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 3ffz n ASN 1185N -3.10 -2.94 -3.98 4.37 3.02 -1.26 -4.94 115.26 106.42 3ffz n ASN 1185Ca -0.21 -1.16 -0.08 0.00 -0.03 0.00 0.00 54.58 53.10 3ffz n ASN 1185Cb 0.64 -1.40 -0.09 0.00 -0.61 0.00 0.00 39.78 38.33 3ffz n ASN 1185CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 3ffz s GLN 1186N -7.18 0.75 0.29 3.52 -0.21 -1.21 -2.38 119.66 113.25 3ffz s GLN 1186Ca 0.38 -1.11 -0.13 0.00 0.02 0.00 0.00 55.36 54.52 3ffz s GLN 1186Cb -0.21 0.28 0.01 0.00 1.00 0.00 0.00 33.01 34.09 3ffz s GLN 1186CO 0.87 -0.20 0.57 0.14 -2.12 0.00 0.00 175.29 174.54 3ffz s VAL 1187N -3.90 0.00 0.01 1.09 -7.23 -0.67 -4.88 120.40 104.82 3ffz s VAL 1187Ca 0.07 -1.31 0.02 0.00 -1.81 0.00 0.00 61.98 58.95 3ffz s VAL 1187Cb 0.06 -2.37 -0.01 0.00 0.56 0.00 0.00 36.38 34.62 3ffz s VAL 1187CO -0.10 0.00 -0.07 0.54 -0.31 0.00 0.00 175.10 175.17 3ffz s VAL 1188N -3.54 0.49 -0.19 1.32 0.11 -1.07 -1.26 120.40 116.26 3ffz s VAL 1188Ca 0.21 -0.56 -0.07 0.00 -2.93 0.00 0.00 61.98 58.63 3ffz s VAL 1188Cb -0.02 -0.47 -0.04 0.00 -1.53 0.00 0.00 36.38 34.32 3ffz s VAL 1188CO 0.11 -0.07 0.05 0.68 -3.33 0.00 0.00 175.10 172.54 3ffz s VAL 1189N -0.61 4.55 -0.67 2.04 -7.23 -0.84 -0.65 120.40 116.99 3ffz s VAL 1189Ca -0.02 -0.11 -0.23 0.00 -1.81 0.00 0.00 61.98 59.80 3ffz s VAL 1189Cb -0.05 -3.05 0.07 0.00 0.56 0.00 0.00 36.38 33.90 3ffz s VAL 1189CO 0.00 0.44 1.01 -0.04 -0.31 0.00 0.00 175.10 176.20 3ffz s MET 1190N 0.59 3.13 0.43 4.82 -1.94 -0.96 -2.17 119.30 123.19 3ffz s MET 1190Ca 0.02 -0.78 0.07 0.00 -1.71 0.00 0.00 55.69 53.29 3ffz s MET 1190Cb -0.13 -4.24 -0.04 0.00 2.01 0.00 0.00 34.83 32.43 3ffz s MET 1190CO 0.02 -1.86 0.23 1.21 -0.01 0.00 0.00 175.02 174.60 3ffz s ASN 1191N 3.70 4.53 0.08 3.03 3.84 -0.89 -3.09 114.94 126.13 3ffz s ASN 1191Ca 0.24 -1.06 0.02 0.00 0.21 0.00 0.00 52.86 52.26 3ffz s ASN 1191Cb -0.16 -0.37 -0.04 0.00 -0.55 0.00 0.00 41.25 40.14 3ffz s ASN 1191CO 0.10 -0.63 -0.07 -0.55 -2.79 0.00 0.00 177.10 173.16 3ffz s SER 1192N -3.98 1.06 0.00 -4.21 0.15 -1.26 -1.08 113.70 104.38 3ffz s SER 1192Ca 0.40 -0.85 0.00 0.00 0.70 0.00 0.00 55.95 56.20 3ffz s SER 1192Cb 0.02 0.07 0.00 0.00 -1.71 0.00 0.00 66.02 64.40 3ffz s SER 1192CO 0.23 -0.37 0.00 1.33 1.20 0.00 0.00 173.24 175.62 3ffz n VAL 1193N 0.47 0.00 -0.01 4.45 0.24 -0.95 -4.98 118.33 117.55 3ffz n VAL 1193Ca -0.16 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.14 3ffz n VAL 1193Cb 0.59 -0.43 0.00 0.00 -1.47 0.00 0.00 33.84 32.53 3ffz n VAL 1193CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3ffz n GLY 1194N 3.09 0.03 0.00 7.63 0.00 -1.26 -4.91 105.19 109.77 3ffz n GLY 1194Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3ffz n GLY 1194CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3ffz n ASN 1195N 0.00 0.00 -4.68 1.61 2.85 -1.26 -5.07 115.26 108.70 3ffz n ASN 1195Ca 0.00 0.00 -0.38 0.00 -0.11 0.00 0.00 54.58 54.09 3ffz n ASN 1195Cb 0.00 0.00 -0.07 0.00 1.24 0.00 0.00 39.78 40.95 3ffz n ASN 1195CO 0.00 0.00 0.00 0.20 -2.11 0.00 0.00 177.26 175.35 3ffz s ASN 1196N 0.00 6.47 0.36 1.20 0.02 -1.26 -4.67 114.94 117.06 3ffz s ASN 1196Ca 0.00 0.56 0.02 0.00 -1.02 0.00 0.00 52.86 52.42 3ffz s ASN 1196Cb 0.00 -2.23 -0.02 0.00 0.02 0.00 0.00 41.25 39.01 3ffz s ASN 1196CO 0.00 -0.05 0.55 0.00 0.02 0.00 0.00 177.10 177.62 3ffz s THR 1198N -2.32 0.48 -0.20 0.00 -4.23 -0.24 -0.78 115.64 108.35 3ffz s THR 1198Ca 0.42 -1.02 -0.03 0.00 -1.18 0.00 0.00 61.69 59.88 3ffz s THR 1198Cb -0.10 -0.55 0.06 0.00 1.34 0.00 0.00 72.50 73.25 3ffz s THR 1198CO 0.35 -0.38 0.03 -0.04 -0.54 0.00 0.00 174.62 174.05 3ffz s MET 1199N -1.51 0.68 -0.43 3.99 -1.94 -1.26 -2.10 119.30 116.73 3ffz s MET 1199Ca -0.10 -0.45 -0.15 0.00 -1.71 0.00 0.00 55.69 53.28 3ffz s MET 1199Cb -0.10 -2.13 0.04 0.00 2.01 0.00 0.00 34.83 34.65 3ffz s MET 1199CO 0.00 -0.65 0.34 1.21 -0.01 0.00 0.00 175.02 175.92 3ffz s ASN 1200N 1.84 6.13 0.30 3.03 2.47 -0.92 -0.24 114.94 127.55 3ffz s ASN 1200Ca -0.01 -1.02 -0.29 0.00 0.42 0.00 0.00 52.86 51.96 3ffz s ASN 1200Cb -0.17 -2.17 -0.09 0.00 -1.45 0.00 0.00 41.25 37.36 3ffz s ASN 1200CO -0.08 -0.52 1.11 -0.36 -3.72 0.00 0.00 177.10 173.53 3ffz s PHE 1201N 1.70 3.48 0.10 0.43 0.08 0.11 -1.99 117.98 121.89 3ffz s PHE 1201Ca 0.05 1.67 -0.22 0.00 0.12 0.00 0.00 56.93 58.55 3ffz s PHE 1201Cb -0.21 -3.30 0.06 0.00 -0.57 0.00 0.00 43.02 39.00 3ffz s PHE 1201CO 0.09 -0.68 0.55 -1.59 -0.10 0.00 0.00 175.22 173.49 3ffz s LYS 1202N -1.63 1.14 0.34 0.44 -2.85 -0.39 -0.20 119.74 116.59 3ffz s LYS 1202Ca 0.47 -0.36 -0.26 0.00 -1.00 0.00 0.00 55.97 54.82 3ffz s LYS 1202Cb -0.31 0.52 -0.10 0.00 -2.06 0.00 0.00 37.83 35.88 3ffz s LYS 1202CO 0.40 -0.45 0.99 1.21 0.10 0.00 0.00 175.35 177.60 3ffz s ASN 1203N -2.35 7.17 0.32 0.03 3.84 0.12 -1.67 114.94 122.40 3ffz s ASN 1203Ca -0.02 1.94 0.09 0.00 0.21 0.00 0.00 52.86 55.08 3ffz s ASN 1203Cb -0.00 -2.59 0.89 0.00 -0.55 0.00 0.00 41.25 39.00 3ffz s ASN 1203CO -0.07 -0.19 1.69 0.78 -2.79 0.00 0.00 177.10 176.53 3ffz h ASN 1204N 3.07 0.48 0.00 -4.21 2.35 -1.77 0.38 115.58 115.89 3ffz h ASN 1204Ca -0.47 0.16 0.00 0.00 -0.55 0.00 0.00 56.30 55.44 3ffz h ASN 1204Cb 1.20 0.11 0.00 0.00 0.05 0.00 0.00 38.32 39.68 3ffz h ASN 1204CO 0.64 -0.01 0.00 -0.46 -1.65 0.00 0.00 177.43 175.95 3ffz n ASN 1205N -5.00 0.24 0.00 5.81 0.23 -1.26 -4.79 115.26 110.49 3ffz n ASN 1205Ca 0.27 -0.82 0.00 0.00 -0.53 0.00 0.00 54.58 53.50 3ffz n ASN 1205Cb 0.78 -0.12 0.00 0.00 -2.08 0.00 0.00 39.78 38.36 3ffz n ASN 1205CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3ffz n GLY 1206N 0.14 2.83 3.66 4.83 0.00 0.12 -5.04 105.19 111.73 3ffz n GLY 1206Ca 0.00 -0.05 -0.42 0.00 0.00 0.00 0.00 46.02 45.55 3ffz n GLY 1206CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3ffz n ASN 1207N 0.37 2.10 -4.89 1.61 4.13 -1.24 -4.73 115.26 112.60 3ffz n ASN 1207Ca 0.00 1.14 -0.34 0.00 1.68 0.00 0.00 54.58 57.07 3ffz n ASN 1207Cb 0.00 -1.42 -0.05 0.00 -1.54 0.00 0.00 39.78 36.77 3ffz n ASN 1207CO 0.00 0.00 0.00 0.20 0.28 0.00 0.00 177.26 177.74 3ffz s ASN 1208N -0.50 6.45 -0.25 6.41 0.01 -1.26 0.13 114.94 125.93 3ffz s ASN 1208Ca 0.59 0.49 -0.13 0.00 -0.71 0.00 0.00 52.86 53.10 3ffz s ASN 1208Cb -0.58 -2.06 -0.10 0.00 0.41 0.00 0.00 41.25 38.92 3ffz s ASN 1208CO 0.60 0.22 -0.33 -0.38 -1.51 0.00 0.00 177.10 175.70 3ffz n ILE 1209N 0.87 1.39 0.00 0.60 2.08 0.72 -4.85 119.36 120.17 3ffz n ILE 1209Ca -0.09 -0.31 0.00 0.00 0.56 0.00 0.00 62.75 62.90 3ffz n ILE 1209Cb 0.52 -1.88 0.00 0.00 -0.75 0.00 0.00 39.64 37.54 3ffz n ILE 1209CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 3ffz n GLY 1210N 1.43 2.90 3.82 7.39 0.00 -0.80 -3.75 105.19 116.18 3ffz n GLY 1210Ca -0.47 -1.17 -0.33 0.00 0.00 0.00 0.00 46.02 44.05 3ffz n GLY 1210CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ffz s LEU 1211N 0.00 3.93 -0.27 0.99 1.02 -0.83 0.05 118.68 123.57 3ffz s LEU 1211Ca 0.00 1.66 -0.29 0.00 0.02 0.00 0.00 54.13 55.52 3ffz s LEU 1211Cb 0.00 -4.51 -0.01 0.00 0.02 0.00 0.00 46.19 41.69 3ffz s LEU 1211CO 0.00 -0.36 1.41 -0.22 0.02 0.00 0.00 176.35 177.19 3ffz s LEU 1212N -3.22 3.90 0.00 1.79 2.96 0.66 -2.59 118.68 122.19 3ffz s LEU 1212Ca 0.61 1.37 0.00 0.00 -0.22 0.00 0.00 54.13 55.89 3ffz s LEU 1212Cb -0.09 -3.54 0.00 0.00 0.50 0.00 0.00 46.19 43.06 3ffz s LEU 1212CO 0.14 -1.13 0.00 0.61 -1.32 0.00 0.00 176.35 174.65 3ffz n GLY 1213N 4.40 4.94 2.82 7.98 0.00 0.12 -4.39 105.19 121.06 3ffz n GLY 1213Ca 0.16 -0.82 -0.15 0.00 0.00 0.00 0.00 46.02 45.22 3ffz n GLY 1213CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 3ffz n PHE 1214N 0.00 -0.96 -3.12 1.61 1.16 -1.25 -0.45 117.46 114.46 3ffz n PHE 1214Ca 0.00 -2.24 -0.00 0.00 -1.87 0.00 0.00 57.45 53.34 3ffz n PHE 1214Cb 0.00 0.35 -0.01 0.00 -1.61 0.00 0.00 39.48 38.21 3ffz n PHE 1214CO 0.00 0.00 0.00 0.21 -1.87 0.00 0.00 176.76 175.10 3ffz s LYS 1215N -2.95 0.87 6.20 3.97 2.36 -0.33 -4.68 119.74 125.19 3ffz s LYS 1215Ca 0.30 -0.43 0.00 0.00 -2.55 0.00 0.00 55.97 53.29 3ffz s LYS 1215Cb 0.01 0.07 0.00 0.00 -1.05 0.00 0.00 37.83 36.85 3ffz s LYS 1215CO 0.21 -1.22 0.00 0.00 1.55 0.00 0.00 175.35 175.89 3ffz n ALA 1216N 4.11 0.00 0.18 3.13 0.00 -1.26 -3.33 120.51 123.33 3ffz n ALA 1216Ca 0.12 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.68 3ffz n ALA 1216Cb 0.57 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.93 3ffz n ALA 1216CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3ffz n ASP 1217N 10.11 0.41 -4.65 0.00 10.43 -1.26 -4.77 116.55 126.82 3ffz n ASP 1217Ca 0.00 0.01 -0.34 0.00 2.57 0.00 0.00 54.79 57.03 3ffz n ASP 1217Cb 0.00 1.28 -0.10 0.00 1.84 0.00 0.00 41.12 44.14 3ffz n ASP 1217CO 0.00 0.00 0.00 0.28 -1.07 0.00 0.00 177.20 176.41 3ffz s THR 1218N -3.39 4.05 0.13 -3.53 -1.32 -1.21 -0.60 115.64 109.77 3ffz s THR 1218Ca -0.03 -0.41 -0.30 0.00 -1.21 0.00 0.00 61.69 59.74 3ffz s THR 1218Cb 0.13 -2.71 -0.07 0.00 -1.51 0.00 0.00 72.50 68.34 3ffz s THR 1218CO 0.85 0.55 1.14 -0.69 -2.21 0.00 0.00 174.62 174.26 3ffz s VAL 1219N -0.90 3.92 0.25 5.08 1.01 -1.04 -1.18 120.40 127.54 3ffz s VAL 1219Ca 0.14 1.54 0.04 0.00 0.00 0.00 0.00 61.98 63.71 3ffz s VAL 1219Cb -0.11 -3.99 -0.02 0.00 0.00 0.00 0.00 36.38 32.27 3ffz s VAL 1219CO 0.04 0.21 0.15 1.33 0.00 0.00 0.00 175.10 176.83 3ffz n VAL 1220N 2.94 0.00 -3.71 2.92 0.24 0.41 -2.49 118.33 118.63 3ffz n VAL 1220Ca 0.05 -1.65 -0.29 0.00 -2.04 0.00 0.00 64.34 60.41 3ffz n VAL 1220Cb 0.46 0.72 -0.16 0.00 -1.47 0.00 0.00 33.84 33.39 3ffz n VAL 1220CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3ffz s ALA 1221N -2.85 1.21 0.25 2.33 0.00 -0.40 0.13 121.76 122.43 3ffz s ALA 1221Ca 0.21 -1.21 0.11 0.00 0.00 0.00 0.00 51.96 51.07 3ffz s ALA 1221Cb 0.01 -1.42 -0.05 0.00 0.00 0.00 0.00 23.12 21.67 3ffz s ALA 1221CO 0.15 -1.47 -0.17 -1.54 0.00 0.00 0.00 175.76 172.73 3ffz s SER 1222N 1.78 3.75 0.04 0.00 1.04 -1.07 -1.38 113.70 117.87 3ffz s SER 1222Ca 0.05 -0.89 -0.19 0.00 0.48 0.00 0.00 55.95 55.40 3ffz s SER 1222Cb -0.17 -0.41 -0.15 0.00 0.10 0.00 0.00 66.02 65.39 3ffz s SER 1222CO -0.20 0.06 1.29 0.74 0.98 0.00 0.00 173.24 176.11 3ffz h THR 1223N 2.50 1.36 -0.30 2.02 2.02 -1.67 -2.20 112.91 116.64 3ffz h THR 1223Ca -0.43 -1.56 0.04 0.00 0.77 0.00 0.00 66.41 65.22 3ffz h THR 1223Cb 1.24 2.01 -0.04 0.00 -1.74 0.00 0.00 68.15 69.61 3ffz h THR 1223CO 0.56 0.47 -0.15 1.87 0.37 0.00 0.00 175.52 178.64 3ffz n TRP 1224N -4.39 -0.07 0.00 3.16 -0.00 -1.26 -0.45 117.44 114.44 3ffz n TRP 1224Ca -0.07 0.37 0.23 0.00 -0.00 0.00 0.00 57.50 58.03 3ffz n TRP 1224Cb 0.47 -0.56 0.69 0.00 -0.00 0.00 0.00 31.31 31.91 3ffz n TRP 1224CO 0.00 0.00 0.00 1.88 -0.00 0.00 0.00 177.69 179.57 3ffz h TYR 1225N 0.00 0.00 -0.50 5.87 0.05 -1.93 -0.41 116.97 120.05 3ffz h TYR 1225Ca 0.07 0.00 0.15 0.00 0.05 0.00 0.00 58.73 59.00 3ffz h TYR 1225Cb 0.15 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 37.87 3ffz h TYR 1225CO -0.28 0.00 0.41 1.88 -1.05 0.00 0.00 178.16 179.12 3ffz h TYR 1226N 0.00 0.00 0.00 4.88 0.99 -1.04 -2.50 116.97 119.30 3ffz h TYR 1226Ca 0.28 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.01 3ffz h TYR 1226Cb 1.51 0.00 0.00 0.00 1.00 0.00 0.00 36.73 39.24 3ffz h TYR 1226CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 178.16 178.41 3ffz n THR 1227N -4.12 0.00 -0.70 -2.88 -2.24 -0.19 -4.74 114.28 99.42 3ffz n THR 1227Ca 0.09 -0.37 0.04 0.00 -2.27 0.00 0.00 64.05 61.54 3ffz n THR 1227Cb 0.62 1.17 0.05 0.00 -2.10 0.00 0.00 70.33 70.08 3ffz n THR 1227CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 3ffz n HIS 1228N -0.26 0.00 0.88 4.78 8.25 -1.06 -4.39 115.22 123.42 3ffz n HIS 1228Ca 0.00 -0.60 0.10 0.00 -0.26 0.00 0.00 57.72 56.96 3ffz n HIS 1228Cb 0.04 -0.08 0.01 0.00 1.12 0.00 0.00 29.99 31.08 3ffz n HIS 1228CO 0.00 0.00 0.00 -0.12 0.64 0.00 0.00 176.34 176.86 3ffz n MET 1229N -0.77 1.51 0.25 -0.41 0.00 -0.95 -4.12 117.12 112.62 3ffz n MET 1229Ca 0.06 -1.08 0.13 0.00 0.00 0.00 0.00 57.70 56.81 3ffz n MET 1229Cb 0.47 -1.40 0.64 0.00 0.00 0.00 0.00 33.22 32.93 3ffz n MET 1229CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 175.97 176.04 3ffz h ARG 1230N 2.56 0.00 0.00 2.12 0.11 -1.79 -3.46 114.38 113.91 3ffz h ARG 1230Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3ffz h ARG 1230Cb 0.71 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.79 3ffz h ARG 1230CO 0.00 0.14 0.00 -3.47 0.10 0.00 0.00 179.97 176.74 3ffz n ASP 1231N -3.41 0.00 0.00 0.08 2.03 -1.26 -5.11 116.55 108.88 3ffz n ASP 1231Ca -0.01 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.30 3ffz n ASP 1231Cb 0.32 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.72 3ffz n ASP 1231CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3ffz n HIS 1232N 0.00 0.00 0.79 -0.67 1.44 -1.26 -4.85 115.22 110.67 3ffz n HIS 1232Ca 0.00 -0.15 -0.02 0.00 -2.01 0.00 0.00 57.72 55.54 3ffz n HIS 1232Cb 0.00 -0.01 0.01 0.00 0.12 0.00 0.00 29.99 30.11 3ffz n HIS 1232CO 0.00 0.00 0.00 2.41 -2.81 0.00 0.00 176.34 175.94 3ffz n THR 1233N -0.15 1.20 -1.85 0.61 -1.04 -1.26 -4.77 114.28 107.02 3ffz n THR 1233Ca 0.00 -0.16 0.00 0.00 -2.04 0.00 0.00 64.05 61.85 3ffz n THR 1233Cb 0.28 -0.97 0.00 0.00 -1.82 0.00 0.00 70.33 67.82 3ffz n THR 1233CO 0.00 0.00 0.00 -0.46 -0.64 0.00 0.00 175.07 173.97 3ffz n ASN 1234N 0.39 -0.64 -3.19 8.00 6.94 -1.26 -4.68 115.26 120.82 3ffz n ASN 1234Ca 0.05 0.32 -0.22 0.00 -0.02 0.00 0.00 54.58 54.70 3ffz n ASN 1234Cb 0.59 -0.73 -0.06 0.00 -2.36 0.00 0.00 39.78 37.22 3ffz n ASN 1234CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 3ffz n SER 1235N -0.77 0.38 -2.07 0.53 7.64 -1.26 -4.92 113.62 113.15 3ffz n SER 1235Ca 0.00 -2.78 -0.23 0.00 1.01 0.00 0.00 58.87 56.87 3ffz n SER 1235Cb 0.32 -0.63 0.04 0.00 -1.01 0.00 0.00 64.21 62.93 3ffz n SER 1235CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 3ffz n ASN 1236N 1.10 6.83 -1.79 6.43 5.15 -1.26 -4.73 115.26 127.00 3ffz n ASN 1236Ca 0.22 -3.29 -0.15 0.00 -0.60 0.00 0.00 54.58 50.76 3ffz n ASN 1236Cb 0.56 -1.05 0.06 0.00 -0.53 0.00 0.00 39.78 38.83 3ffz n ASN 1236CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3ffz n GLY 1237N 0.02 3.79 0.11 8.20 0.00 -1.26 -3.84 105.19 112.21 3ffz n GLY 1237Ca 0.41 -0.90 0.06 0.00 0.00 0.00 0.00 46.02 45.59 3ffz n GLY 1237CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ffz s PHE 1239N -2.06 2.95 0.30 0.00 0.40 -1.25 -4.42 117.98 113.90 3ffz s PHE 1239Ca 0.20 -0.81 0.10 0.00 -0.60 0.00 0.00 56.93 55.82 3ffz s PHE 1239Cb 0.17 -2.06 -0.06 0.00 0.51 0.00 0.00 43.02 41.58 3ffz s PHE 1239CO 0.03 -0.44 -0.14 -1.58 0.70 0.00 0.00 175.22 173.79 3ffz s TRP 1240N 1.20 2.27 0.11 0.36 0.52 0.04 -0.79 118.94 122.66 3ffz s TRP 1240Ca 0.02 -0.44 0.06 0.00 0.02 0.00 0.00 56.10 55.76 3ffz s TRP 1240Cb -0.14 -1.15 -0.04 0.00 -1.15 0.00 0.00 33.47 30.99 3ffz s TRP 1240CO -0.01 0.61 -0.14 -0.80 0.02 0.00 0.00 176.95 176.62 3ffz s ASN 1241N -3.53 1.94 -0.27 2.95 -0.87 -0.32 -0.26 114.94 114.57 3ffz s ASN 1241Ca 0.30 -0.76 -0.01 0.00 -1.57 0.00 0.00 52.86 50.83 3ffz s ASN 1241Cb -0.01 -0.07 0.04 0.00 -0.02 0.00 0.00 41.25 41.19 3ffz s ASN 1241CO 0.15 -0.12 -0.05 -0.36 -2.57 0.00 0.00 177.10 174.14 3ffz s PHE 1242N -1.90 3.16 -0.12 2.20 0.08 -1.26 -2.53 117.98 117.61 3ffz s PHE 1242Ca 0.06 -1.79 -0.10 0.00 0.12 0.00 0.00 56.93 55.21 3ffz s PHE 1242Cb -0.06 -2.05 -0.05 0.00 -0.57 0.00 0.00 43.02 40.29 3ffz s PHE 1242CO 0.03 -0.78 0.22 0.42 -0.10 0.00 0.00 175.22 175.01 3ffz s ILE 1243N 1.26 5.36 -0.06 0.64 1.01 0.51 -1.83 121.20 128.08 3ffz s ILE 1243Ca -0.03 0.40 0.04 0.00 0.00 0.00 0.00 60.65 61.06 3ffz s ILE 1243Cb -0.18 -3.52 0.00 0.00 0.01 0.00 0.00 42.46 38.77 3ffz s ILE 1243CO -0.04 0.53 -0.18 -0.94 0.00 0.00 0.00 174.94 174.32 3ffz s SER 1244N -0.49 2.31 -0.35 3.58 1.04 -1.26 0.70 113.70 119.23 3ffz s SER 1244Ca 0.16 -0.39 -0.36 0.00 0.48 0.00 0.00 55.95 55.83 3ffz s SER 1244Cb -0.13 -0.83 -0.12 0.00 0.10 0.00 0.00 66.02 65.03 3ffz s SER 1244CO 0.05 0.13 2.14 1.21 0.98 0.00 0.00 173.24 177.75 3ffz n GLU 1245N 3.37 1.00 -4.10 4.02 4.07 -1.26 -4.94 120.64 122.80 3ffz n GLU 1245Ca -0.19 0.29 -0.14 0.00 -0.06 0.00 0.00 57.16 57.05 3ffz n GLU 1245Cb 0.53 -2.34 -0.12 0.00 -0.06 0.00 0.00 31.44 29.45 3ffz n GLU 1245CO 0.00 0.00 0.00 -1.21 -0.06 0.00 0.00 177.13 175.86 3ffz s GLU 1246N 5.92 0.58 0.52 5.31 2.02 -1.26 -5.04 118.70 126.74 3ffz s GLU 1246Ca 1.09 -0.74 0.20 0.00 0.02 0.00 0.00 54.97 55.54 3ffz s GLU 1246Cb -0.94 -0.42 1.35 0.00 0.10 0.00 0.00 34.13 34.23 3ffz s GLU 1246CO 0.52 0.08 2.12 1.25 0.02 0.00 0.00 175.26 179.25 3ffz h HIS 1247N 4.60 0.00 0.00 1.61 -0.00 -1.98 -2.68 115.15 116.70 3ffz h HIS 1247Ca -0.36 0.00 -0.00 0.00 -0.00 0.00 0.00 60.37 60.01 3ffz h HIS 1247Cb 1.20 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 28.61 3ffz h HIS 1247CO 0.62 0.07 -0.00 0.78 -0.00 0.00 0.00 177.93 179.40 3ffz h GLY 1248N 0.29 0.00 -7.09 5.26 0.00 -1.98 -3.32 103.07 96.23 3ffz h GLY 1248Ca -0.00 0.00 -0.62 0.00 0.00 0.00 0.00 47.33 46.71 3ffz h GLY 1248CO 0.01 0.00 -0.64 0.86 0.00 0.00 0.00 176.54 176.77 3ffz s TRP 1249N -3.73 3.08 0.14 5.60 -0.11 -1.01 0.08 118.94 122.99 3ffz s TRP 1249Ca 0.00 -3.11 -0.19 0.00 1.22 0.00 0.00 56.10 54.02 3ffz s TRP 1249Cb 0.09 -2.49 0.01 0.00 -1.50 0.00 0.00 33.47 29.58 3ffz s TRP 1249CO 0.53 -0.65 1.69 1.96 -4.62 0.00 0.00 176.95 175.86 3ffz h GLN 1250N 5.84 -0.01 0.00 5.86 4.20 -1.66 -3.43 115.11 125.92 3ffz h GLN 1250Ca 0.08 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.79 3ffz h GLN 1250Cb 0.82 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.60 3ffz h GLN 1250CO 0.65 -0.01 0.00 -1.91 -0.67 0.00 0.00 178.83 176.90 3ffz n GLU 1251N -5.23 0.00 0.00 1.46 2.13 -1.26 -5.07 120.64 112.66 3ffz n GLU 1251Ca -0.01 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.81 3ffz n GLU 1251Cb 0.16 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.87 3ffz n GLU 1251CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89