#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fkn s ARG 5 N 0.00 4.24 0.96 5.31 3.52 -1.26 -5.01 118.95 126.70 3fkn s ARG 5 Ca 0.00 2.02 -0.12 0.00 -0.13 0.00 0.00 55.73 57.50 3fkn s ARG 5 Cb 0.00 -3.71 0.16 0.00 -1.56 0.00 0.00 34.95 29.84 3fkn s ARG 5 CO 0.00 -0.68 1.09 -1.25 -0.81 0.00 0.00 175.30 173.65 3fkn s PRO 6 N 3.01 0.77 0.05 5.12 0.04 -1.26 -5.02 135.00 137.71 3fkn s PRO 6 Ca 0.66 0.87 -0.27 0.00 0.04 0.00 0.00 61.00 62.31 3fkn s PRO 6 Cb -0.31 -1.75 -0.05 0.00 0.04 0.00 0.00 34.50 32.43 3fkn s PRO 6 CO 0.26 -2.59 0.84 0.99 0.04 0.00 0.00 177.00 176.54 3fkn s THR 7 N -2.82 4.70 0.00 1.26 2.01 -1.26 -5.00 115.64 114.53 3fkn s THR 7 Ca 0.65 1.80 -0.00 0.00 0.31 0.00 0.00 61.69 64.44 3fkn s THR 7 Cb -0.20 -4.19 -0.04 0.00 0.01 0.00 0.00 72.50 68.08 3fkn s THR 7 CO 0.58 0.32 0.10 -0.36 -0.69 0.00 0.00 174.62 174.57 3fkn s PHE 8 N 0.14 3.33 0.15 4.92 0.40 -1.26 -1.45 117.98 124.22 3fkn s PHE 8 Ca 0.42 0.22 0.09 0.00 -0.60 0.00 0.00 56.93 57.06 3fkn s PHE 8 Cb -0.21 -1.74 -0.04 0.00 0.51 0.00 0.00 43.02 41.53 3fkn s PHE 8 CO 0.25 0.57 -0.19 1.52 0.70 0.00 0.00 175.22 178.06 3fkn s TYR 9 N -1.24 1.86 0.03 0.36 -0.85 -0.28 -4.92 117.35 112.30 3fkn s TYR 9 Ca 0.24 -0.45 0.01 0.00 -0.52 0.00 0.00 57.07 56.36 3fkn s TYR 9 Cb -0.12 -0.95 -0.04 0.00 0.38 0.00 0.00 41.96 41.23 3fkn s TYR 9 CO 0.16 0.32 0.06 1.03 -1.52 0.00 0.00 175.55 175.60 3fkn s ARG 10 N -2.59 2.94 -0.28 -3.49 0.52 -1.26 -2.14 118.95 112.65 3fkn s ARG 10 Ca 0.14 -0.58 -0.21 0.00 -0.52 0.00 0.00 55.73 54.56 3fkn s ARG 10 Cb -0.07 -2.77 0.08 0.00 0.52 0.00 0.00 34.95 32.71 3fkn s ARG 10 CO 0.06 0.61 0.74 -1.14 0.02 0.00 0.00 175.30 175.59 3fkn s GLN 11 N -1.93 0.75 -0.12 3.54 0.74 -0.36 -5.00 119.66 117.28 3fkn s GLN 11 Ca 0.24 1.05 -0.20 0.00 0.05 0.00 0.00 55.36 56.51 3fkn s GLN 11 Cb -0.12 0.28 -0.04 0.00 1.10 0.00 0.00 33.01 34.23 3fkn s GLN 11 CO 0.16 -0.12 0.56 -2.00 -0.55 0.00 0.00 175.29 173.34 3fkn s GLU 12 N 0.90 4.35 0.00 1.67 2.12 -1.26 0.28 118.70 126.75 3fkn s GLU 12 Ca -0.04 0.58 0.00 0.00 0.36 0.00 0.00 54.97 55.87 3fkn s GLU 12 Cb -0.05 -3.46 0.00 0.00 0.26 0.00 0.00 34.13 30.88 3fkn s GLU 12 CO -0.08 0.07 0.00 1.28 -0.54 0.00 0.00 175.26 175.99 3fkn n LEU 13 N 3.91 0.00 -3.78 2.70 4.77 -0.85 -4.94 117.00 118.81 3fkn n LEU 13 Ca -0.05 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.51 3fkn n LEU 13 Cb 0.51 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.61 3fkn n LEU 13 CO 0.44 0.00 1.93 0.59 -1.33 0.00 0.00 177.39 179.02 3fkn n ASN 14 N -0.74 6.07 -2.27 -1.43 5.03 -1.26 -4.67 115.26 115.99 3fkn n ASN 14 Ca 0.00 -3.18 -0.05 0.00 0.87 0.00 0.00 54.58 52.21 3fkn n ASN 14 Cb 0.00 -1.41 -0.01 0.00 -1.02 0.00 0.00 39.78 37.34 3fkn n ASN 14 CO 0.00 0.00 0.00 2.29 -1.83 0.00 0.00 177.26 177.72 3fkn n LYS 15 N 2.83 -2.18 -4.13 3.52 2.85 -1.26 -4.91 118.16 114.89 3fkn n LYS 15 Ca 0.43 0.02 -0.09 0.00 -1.05 0.00 0.00 58.31 57.63 3fkn n LYS 15 Cb 0.33 -3.32 -0.10 0.00 -0.65 0.00 0.00 35.03 31.29 3fkn n LYS 15 CO 0.00 0.00 0.00 -0.08 -0.05 0.00 0.00 177.40 177.27 3fkn s THR 16 N -1.67 0.22 -0.41 0.58 -1.32 -1.26 -5.13 115.64 106.66 3fkn s THR 16 Ca 0.11 -1.87 -0.21 0.00 -1.21 0.00 0.00 61.69 58.51 3fkn s THR 16 Cb -0.06 -1.78 0.02 0.00 -1.51 0.00 0.00 72.50 69.16 3fkn s THR 16 CO 0.13 -0.74 0.65 -0.63 -2.21 0.00 0.00 174.62 171.82 3fkn s ILE 17 N -3.94 4.84 -0.09 5.08 1.01 -1.26 -2.00 121.20 124.84 3fkn s ILE 17 Ca 0.15 0.31 -0.26 0.00 0.00 0.00 0.00 60.65 60.86 3fkn s ILE 17 Cb 0.08 -4.16 -0.03 0.00 0.01 0.00 0.00 42.46 38.35 3fkn s ILE 17 CO -0.04 -0.50 0.81 0.26 0.00 0.00 0.00 174.94 175.47 3fkn s TRP 18 N 2.81 3.54 -0.28 3.97 0.52 0.14 -4.90 118.94 124.74 3fkn s TRP 18 Ca 0.24 1.36 0.03 0.00 0.02 0.00 0.00 56.10 57.74 3fkn s TRP 18 Cb -0.14 -2.95 0.07 0.00 -1.15 0.00 0.00 33.47 29.30 3fkn s TRP 18 CO 0.18 -0.05 -0.05 -2.00 0.02 0.00 0.00 176.95 175.05 3fkn s GLU 19 N 1.31 1.90 0.12 4.98 2.12 -1.26 -1.22 118.70 126.64 3fkn s GLU 19 Ca 0.41 -1.47 0.05 0.00 0.36 0.00 0.00 54.97 54.32 3fkn s GLU 19 Cb -0.18 -2.94 -0.04 0.00 0.26 0.00 0.00 34.13 31.24 3fkn s GLU 19 CO 0.18 -0.70 -0.13 0.14 -0.54 0.00 0.00 175.26 174.21 3fkn s VAL 20 N 1.08 1.25 0.52 3.70 -7.23 -0.91 -4.59 120.40 114.23 3fkn s VAL 20 Ca -0.02 -1.71 -0.21 0.00 -1.81 0.00 0.00 61.98 58.22 3fkn s VAL 20 Cb -0.19 -1.51 -0.07 0.00 0.56 0.00 0.00 36.38 35.17 3fkn s VAL 20 CO -0.07 -0.45 1.12 -2.65 -0.31 0.00 0.00 175.10 172.75 3fkn n PRO 21 N 0.52 1.35 -0.13 4.82 -0.02 -1.26 -1.13 135.00 139.15 3fkn n PRO 21 Ca -0.15 0.50 0.21 0.00 -2.02 0.00 0.00 63.50 62.03 3fkn n PRO 21 Cb 0.57 -2.28 0.62 0.00 -0.02 0.00 0.00 33.50 32.39 3fkn n PRO 21 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3fkn h GLU 22 N 1.18 0.17 -0.67 -0.52 5.08 -1.61 -1.93 114.58 116.28 3fkn h GLU 22 Ca -0.48 -0.01 0.19 0.00 -1.00 0.00 0.00 59.36 58.06 3fkn h GLU 22 Cb 1.33 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 30.52 3fkn h GLU 22 CO 0.55 0.11 0.48 0.07 -1.00 0.00 0.00 179.01 179.22 3fkn h ARG 23 N 0.17 0.04 -5.43 2.33 0.11 -1.91 -3.38 114.38 106.31 3fkn h ARG 23 Ca 0.36 -0.00 -0.63 0.00 0.10 0.00 0.00 59.98 59.81 3fkn h ARG 23 Cb 1.18 -0.01 -0.14 0.00 1.11 0.00 0.00 29.97 32.12 3fkn h ARG 23 CO -0.06 0.03 0.10 0.71 0.10 0.00 0.00 179.97 180.85 3fkn s TYR 24 N -5.04 3.16 0.26 4.08 1.51 -0.73 -0.68 117.35 119.91 3fkn s TYR 24 Ca -0.05 0.33 0.11 0.00 -1.01 0.00 0.00 57.07 56.45 3fkn s TYR 24 Cb 0.20 -3.08 -0.05 0.00 -0.11 0.00 0.00 41.96 38.93 3fkn s TYR 24 CO 0.75 -0.59 -0.18 -0.65 -1.11 0.00 0.00 175.55 173.76 3fkn s GLN 25 N 2.63 1.58 -1.28 -0.62 -1.52 -0.29 -4.84 119.66 115.33 3fkn s GLN 25 Ca 0.23 -1.72 -0.04 0.00 -1.95 0.00 0.00 55.36 51.88 3fkn s GLN 25 Cb -0.15 -1.59 0.01 0.00 -0.22 0.00 0.00 33.01 31.06 3fkn s GLN 25 CO 0.14 0.29 1.04 0.09 -0.25 0.00 0.00 175.29 176.59 3fkn n ASN 26 N -0.55 -3.59 -4.69 5.90 3.02 -1.26 -0.54 115.26 113.55 3fkn n ASN 26 Ca -0.06 -0.62 -0.42 0.00 -0.03 0.00 0.00 54.58 53.45 3fkn n ASN 26 Cb 0.60 -4.93 -0.03 0.00 -0.61 0.00 0.00 39.78 34.81 3fkn n ASN 26 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3fkn s LEU 27 N -6.76 4.36 -0.04 3.41 1.02 -1.25 -4.34 118.68 115.07 3fkn s LEU 27 Ca 0.24 2.47 -0.02 0.00 0.02 0.00 0.00 54.13 56.83 3fkn s LEU 27 Cb -0.11 -3.57 0.03 0.00 0.02 0.00 0.00 46.19 42.57 3fkn s LEU 27 CO 0.74 -0.86 0.07 -0.55 0.02 0.00 0.00 176.35 175.77 3fkn s SER 28 N 2.19 0.92 0.34 2.29 0.15 -0.14 -4.96 113.70 114.49 3fkn s SER 28 Ca 0.72 0.11 -0.28 0.00 0.70 0.00 0.00 55.95 57.21 3fkn s SER 28 Cb -0.39 -0.07 -0.12 0.00 -1.71 0.00 0.00 66.02 63.72 3fkn s SER 28 CO 0.32 -0.23 1.23 -2.65 1.20 0.00 0.00 173.24 173.11 3fkn n PRO 29 N 5.14 1.96 -4.18 5.44 -0.02 -1.26 -0.35 135.00 141.72 3fkn n PRO 29 Ca -0.07 0.69 -0.14 0.00 -2.02 0.00 0.00 63.50 61.96 3fkn n PRO 29 Cb 0.50 -2.23 -0.11 0.00 -0.02 0.00 0.00 33.50 31.64 3fkn n PRO 29 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 3fkn s VAL 30 N -1.10 0.95 0.00 -1.45 -7.23 -0.61 -4.79 120.40 106.17 3fkn s VAL 30 Ca 0.56 -1.71 0.00 0.00 -1.81 0.00 0.00 61.98 59.02 3fkn s VAL 30 Cb -0.59 -1.44 0.00 0.00 0.56 0.00 0.00 36.38 34.91 3fkn s VAL 30 CO 0.62 -0.61 0.00 0.61 -0.31 0.00 0.00 175.10 175.41 3fkn n GLY 31 N 0.42 1.91 4.06 2.32 0.00 -1.26 -4.30 105.19 108.35 3fkn n GLY 31 Ca -0.15 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.42 3fkn n GLY 31 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3fkn n SER 32 N 0.00 -3.89 0.00 1.61 3.41 -1.26 -2.01 113.62 111.48 3fkn n SER 32 Ca 0.00 -1.28 0.00 0.00 -0.26 0.00 0.00 58.87 57.33 3fkn n SER 32 Cb 0.00 -1.82 0.00 0.00 -0.26 0.00 0.00 64.21 62.13 3fkn n SER 32 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3fkn n GLY 33 N -2.09 3.08 0.31 5.00 0.00 -1.26 -4.89 105.19 105.33 3fkn n GLY 33 Ca -0.12 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.88 3fkn n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fkn h ALA 34 N 0.00 1.30 -0.02 4.61 0.00 -1.70 -2.52 119.26 120.93 3fkn h ALA 34 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.74 3fkn h ALA 34 Cb 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.56 3fkn h ALA 34 CO 0.00 0.51 -0.05 0.66 0.00 0.00 0.00 179.25 180.37 3fkn n TYR 35 N -4.31 0.00 0.00 0.00 4.01 -1.26 -5.06 117.16 110.54 3fkn n TYR 35 Ca 0.04 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.78 3fkn n TYR 35 Cb 0.18 -0.02 0.00 0.00 -0.31 0.00 0.00 39.34 39.20 3fkn n TYR 35 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3fkn n GLY 36 N 1.23 -0.77 3.48 2.72 0.00 -0.95 -4.72 105.19 106.18 3fkn n GLY 36 Ca 0.17 -1.94 -0.44 0.00 0.00 0.00 0.00 46.02 43.82 3fkn n GLY 36 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3fkn s SER 37 N -4.00 6.90 -0.07 1.61 0.15 -1.26 -4.36 113.70 112.67 3fkn s SER 37 Ca 0.00 -2.60 0.04 0.00 0.70 0.00 0.00 55.95 54.09 3fkn s SER 37 Cb 0.00 -2.44 -0.00 0.00 -1.71 0.00 0.00 66.02 61.87 3fkn s SER 37 CO 0.00 -0.93 -0.20 -0.69 1.20 0.00 0.00 173.24 172.62 3fkn s VAL 38 N 2.44 1.73 0.00 4.45 1.01 -1.26 -1.00 120.40 127.78 3fkn s VAL 38 Ca 0.42 -0.86 0.08 0.00 0.00 0.00 0.00 61.98 61.63 3fkn s VAL 38 Cb -0.02 -1.50 -0.02 0.00 0.00 0.00 0.00 36.38 34.84 3fkn s VAL 38 CO -0.02 0.49 -0.26 0.00 0.00 0.00 0.00 175.10 175.31 3fkn s ALA 40 N -0.67 2.94 0.18 0.00 0.00 0.53 0.33 121.76 125.06 3fkn s ALA 40 Ca 0.10 0.49 -0.22 0.00 0.00 0.00 0.00 51.96 52.34 3fkn s ALA 40 Cb -0.10 -3.21 0.05 0.00 0.00 0.00 0.00 23.12 19.87 3fkn s ALA 40 CO 0.00 -0.17 0.60 0.00 0.00 0.00 0.00 175.76 176.19 3fkn s ALA 41 N -2.12 -1.43 -0.23 0.00 0.00 -0.36 -0.97 121.76 116.66 3fkn s ALA 41 Ca 0.65 0.25 -0.07 0.00 0.00 0.00 0.00 51.96 52.79 3fkn s ALA 41 Cb -0.13 0.87 -0.03 0.00 0.00 0.00 0.00 23.12 23.83 3fkn s ALA 41 CO 0.19 -0.81 0.05 0.12 0.00 0.00 0.00 175.76 175.30 3fkn s PHE 42 N -3.80 3.09 -0.60 0.00 5.36 0.30 -0.98 117.98 121.35 3fkn s PHE 42 Ca 0.04 -0.39 -0.22 0.00 -0.96 0.00 0.00 56.93 55.39 3fkn s PHE 42 Cb -0.02 -2.17 0.06 0.00 -0.34 0.00 0.00 43.02 40.55 3fkn s PHE 42 CO -0.08 -0.27 0.89 0.34 -1.46 0.00 0.00 175.22 174.63 3fkn s ASP 43 N 1.29 6.23 0.57 6.13 2.15 -0.01 -1.13 116.67 131.90 3fkn s ASP 43 Ca 0.05 -0.83 0.35 0.00 0.43 0.00 0.00 52.55 52.54 3fkn s ASP 43 Cb -0.15 -2.40 1.54 0.00 -0.30 0.00 0.00 42.92 41.62 3fkn s ASP 43 CO 0.03 -1.27 2.05 0.71 -0.17 0.00 0.00 175.17 176.51 3fkn h THR 44 N 5.97 0.05 -0.02 1.71 1.35 -1.20 0.27 112.91 121.04 3fkn h THR 44 Ca -0.28 -0.45 -0.24 0.00 -0.55 0.00 0.00 66.41 64.89 3fkn h THR 44 Cb 1.08 1.43 0.01 0.00 -1.73 0.00 0.00 68.15 68.93 3fkn h THR 44 CO 1.12 0.02 -0.95 0.50 -0.25 0.00 0.00 175.52 175.96 3fkn h LYS 45 N 0.00 0.55 0.00 4.72 3.64 -1.91 -3.37 116.57 120.20 3fkn h LYS 45 Ca -0.00 -0.56 0.00 0.00 -1.27 0.00 0.00 60.65 58.82 3fkn h LYS 45 Cb 0.43 0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.40 3fkn h LYS 45 CO 0.00 1.19 -1.48 0.25 -2.27 0.00 0.00 179.45 177.14 3fkn n THR 46 N -3.81 0.00 -1.00 1.00 -2.24 -1.06 -4.99 114.28 102.18 3fkn n THR 46 Ca -0.08 -0.30 -0.00 0.00 -2.27 0.00 0.00 64.05 61.40 3fkn n THR 46 Cb 0.83 0.32 -0.00 0.00 -2.10 0.00 0.00 70.33 69.38 3fkn n THR 46 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3fkn n GLY 47 N 1.63 0.48 3.83 3.38 0.00 0.93 -5.03 105.19 110.41 3fkn n GLY 47 Ca -0.02 -0.13 -0.38 0.00 0.00 0.00 0.00 46.02 45.49 3fkn n GLY 47 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3fkn s LEU 48 N -0.02 4.50 -0.10 0.99 1.43 -1.18 -4.89 118.68 119.41 3fkn s LEU 48 Ca 0.00 1.08 -0.30 0.00 -1.03 0.00 0.00 54.13 53.88 3fkn s LEU 48 Cb 0.00 -2.71 -0.02 0.00 0.03 0.00 0.00 46.19 43.49 3fkn s LEU 48 CO 0.00 0.31 1.12 -0.13 0.23 0.00 0.00 176.35 177.87 3fkn s ARG 49 N -1.10 4.36 0.21 1.70 0.52 -1.26 -0.83 118.95 122.56 3fkn s ARG 49 Ca 0.26 1.54 0.09 0.00 -0.52 0.00 0.00 55.73 57.09 3fkn s ARG 49 Cb -0.18 -3.58 -0.05 0.00 0.52 0.00 0.00 34.95 31.67 3fkn s ARG 49 CO 0.16 -0.44 -0.16 0.14 0.02 0.00 0.00 175.30 175.02 3fkn s VAL 50 N 2.34 1.89 -0.18 3.52 -7.23 -0.15 -1.63 120.40 118.95 3fkn s VAL 50 Ca 0.52 -2.22 -0.04 0.00 -1.81 0.00 0.00 61.98 58.43 3fkn s VAL 50 Cb -0.21 -2.07 -0.02 0.00 0.56 0.00 0.00 36.38 34.63 3fkn s VAL 50 CO 0.18 -0.53 -0.02 0.00 -0.31 0.00 0.00 175.10 174.42 3fkn s ALA 51 N -2.79 2.99 -0.24 1.32 0.00 0.65 -1.22 121.76 122.47 3fkn s ALA 51 Ca 0.23 -0.92 -0.04 0.00 0.00 0.00 0.00 51.96 51.23 3fkn s ALA 51 Cb -0.02 -1.65 0.00 0.00 0.00 0.00 0.00 23.12 21.45 3fkn s ALA 51 CO 0.08 0.00 -0.03 0.08 0.00 0.00 0.00 175.76 175.90 3fkn s VAL 52 N 0.73 3.38 -0.24 0.00 1.01 0.15 -1.19 120.40 124.25 3fkn s VAL 52 Ca -0.01 -0.62 -0.07 0.00 0.00 0.00 0.00 61.98 61.28 3fkn s VAL 52 Cb -0.14 -2.61 -0.03 0.00 0.00 0.00 0.00 36.38 33.60 3fkn s VAL 52 CO 0.02 0.33 0.05 -0.75 0.00 0.00 0.00 175.10 174.74 3fkn s LYS 53 N 1.46 3.63 -0.22 2.72 2.20 1.00 -0.23 119.74 130.30 3fkn s LYS 53 Ca 0.04 -0.49 -0.12 0.00 -0.36 0.00 0.00 55.97 55.04 3fkn s LYS 53 Cb -0.15 -3.25 -0.05 0.00 -1.51 0.00 0.00 37.83 32.87 3fkn s LYS 53 CO -0.03 -0.14 0.23 0.21 -0.36 0.00 0.00 175.35 175.27 3fkn s LYS 54 N 1.45 4.14 0.05 4.03 2.20 -0.17 -0.23 119.74 131.21 3fkn s LYS 54 Ca 0.05 -0.10 -0.30 0.00 -0.36 0.00 0.00 55.97 55.26 3fkn s LYS 54 Cb -0.15 -3.51 -0.05 0.00 -1.51 0.00 0.00 37.83 32.62 3fkn s LYS 54 CO 0.02 0.09 1.09 -0.51 -0.36 0.00 0.00 175.35 175.68 3fkn s LEU 55 N 0.96 4.39 -0.18 5.43 1.43 -0.48 -4.40 118.68 125.84 3fkn s LEU 55 Ca 0.12 1.87 -0.25 0.00 -1.03 0.00 0.00 54.13 54.84 3fkn s LEU 55 Cb -0.13 -3.58 -0.01 0.00 0.03 0.00 0.00 46.19 42.49 3fkn s LEU 55 CO 0.04 -0.34 0.81 -0.94 0.23 0.00 0.00 176.35 176.16 3fkn s SER 56 N 0.85 6.92 -0.59 2.29 1.04 -1.26 -4.43 113.70 118.53 3fkn s SER 56 Ca 0.54 1.14 -0.01 0.00 0.48 0.00 0.00 55.95 58.10 3fkn s SER 56 Cb -0.26 -2.44 0.00 0.00 0.10 0.00 0.00 66.02 63.42 3fkn s SER 56 CO 0.29 -0.40 0.42 0.54 0.98 0.00 0.00 173.24 175.08 3fkn n ARG 57 N 5.27 -1.06 0.10 4.02 3.00 -1.26 -4.81 116.66 121.92 3fkn n ARG 57 Ca 0.04 0.50 0.12 0.00 -0.01 0.00 0.00 57.85 58.50 3fkn n ARG 57 Cb 0.49 -1.54 0.45 0.00 0.00 0.00 0.00 32.46 31.86 3fkn n ARG 57 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.63 177.28 3fkn n PRO 58 N -2.06 0.19 -1.22 5.56 -0.04 -1.26 -3.28 135.00 132.90 3fkn n PRO 58 Ca -0.23 0.30 0.02 0.00 -0.04 0.00 0.00 63.50 63.55 3fkn n PRO 58 Cb 0.48 -1.79 0.12 0.00 -0.04 0.00 0.00 33.50 32.27 3fkn n PRO 58 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3fkn n PHE 59 N -2.13 0.41 0.21 0.54 3.01 -1.26 -2.67 117.46 115.55 3fkn n PHE 59 Ca 0.04 -1.31 0.09 0.00 1.01 0.00 0.00 57.45 57.28 3fkn n PHE 59 Cb 0.31 -0.23 0.36 0.00 -0.01 0.00 0.00 39.48 39.91 3fkn n PHE 59 CO 0.00 0.00 0.00 -0.56 1.01 0.00 0.00 176.76 177.21 3fkn h GLN 60 N 1.25 0.00 -4.06 -1.08 3.07 -1.91 -3.45 115.11 108.94 3fkn h GLN 60 Ca -0.04 0.00 -0.16 0.00 0.09 0.00 0.00 58.65 58.54 3fkn h GLN 60 Cb 1.37 0.00 -0.11 0.00 0.08 0.00 0.00 27.48 28.82 3fkn h GLN 60 CO 0.13 0.27 -0.30 -1.54 0.09 0.00 0.00 178.83 177.48 3fkn s SER 61 N -6.25 0.18 0.10 0.06 1.04 -1.26 -5.02 113.70 102.55 3fkn s SER 61 Ca 0.02 -1.18 -0.22 0.00 0.48 0.00 0.00 55.95 55.04 3fkn s SER 61 Cb 0.09 0.53 -0.12 0.00 0.10 0.00 0.00 66.02 66.62 3fkn s SER 61 CO 0.66 -1.07 1.74 0.40 0.98 0.00 0.00 173.24 175.95 3fkn h ILE 62 N 2.35 0.98 -0.52 -1.02 2.04 -1.94 -0.05 117.51 119.35 3fkn h ILE 62 Ca -0.30 -0.01 0.04 0.00 1.00 0.00 0.00 64.86 65.59 3fkn h ILE 62 Cb 1.25 0.94 -0.04 0.00 -0.74 0.00 0.00 36.82 38.23 3fkn h ILE 62 CO 0.42 0.01 0.28 0.40 0.00 0.00 0.00 178.15 179.25 3fkn h ILE 63 N 0.04 0.99 -0.37 -0.67 1.08 -1.97 -0.77 117.51 115.84 3fkn h ILE 63 Ca 0.02 -0.19 -0.10 0.00 -0.39 0.00 0.00 64.86 64.21 3fkn h ILE 63 Cb 0.01 0.39 -0.01 0.00 -3.07 0.00 0.00 36.82 34.15 3fkn h ILE 63 CO -0.03 0.10 -0.14 0.45 -0.69 0.00 0.00 178.15 177.84 3fkn h HIS 64 N 0.55 0.85 -0.77 1.37 3.86 -1.84 -1.70 115.15 117.47 3fkn h HIS 64 Ca 0.22 -0.20 0.02 0.00 -1.16 0.00 0.00 60.37 59.25 3fkn h HIS 64 Cb 0.10 -0.20 -0.04 0.00 1.06 0.00 0.00 27.41 28.33 3fkn h HIS 64 CO -0.09 0.92 0.50 0.00 0.86 0.00 0.00 177.93 180.12 3fkn h ALA 65 N 0.81 0.99 -0.33 2.45 0.00 -0.67 0.24 119.26 122.76 3fkn h ALA 65 Ca 0.09 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.81 3fkn h ALA 65 Cb 0.68 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 3fkn h ALA 65 CO 0.05 0.36 -0.36 -0.22 0.00 0.00 0.00 179.25 179.07 3fkn h LYS 66 N 1.01 0.75 -0.68 0.00 3.64 -1.12 -2.07 116.57 118.09 3fkn h LYS 66 Ca 0.29 -0.37 -0.06 0.00 -1.27 0.00 0.00 60.65 59.24 3fkn h LYS 66 Cb -0.07 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.72 3fkn h LYS 66 CO -0.08 0.99 0.19 -0.09 -2.27 0.00 0.00 179.45 178.18 3fkn h ARG 67 N 0.62 1.08 -0.19 1.90 2.43 -0.88 0.11 114.38 119.46 3fkn h ARG 67 Ca 0.06 -0.25 -0.00 0.00 -0.81 0.00 0.00 59.98 58.98 3fkn h ARG 67 Cb 0.90 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 30.29 3fkn h ARG 67 CO 0.08 0.95 0.11 1.15 -1.51 0.00 0.00 179.97 180.75 3fkn h THR 68 N 1.02 1.09 -0.71 0.20 2.02 -0.86 -1.39 112.91 114.27 3fkn h THR 68 Ca 0.22 -0.23 0.01 0.00 0.77 0.00 0.00 66.41 67.17 3fkn h THR 68 Cb 0.34 0.91 -0.03 0.00 -1.74 0.00 0.00 68.15 67.63 3fkn h THR 68 CO -0.00 0.09 0.47 0.22 0.37 0.00 0.00 175.52 176.66 3fkn h TYR 69 N 0.21 0.89 0.11 3.16 3.20 -1.13 -2.10 116.97 121.31 3fkn h TYR 69 Ca 0.07 0.02 0.01 0.00 3.14 0.00 0.00 58.73 61.96 3fkn h TYR 69 Cb 0.04 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.00 3fkn h TYR 69 CO -0.05 0.57 -0.12 -0.09 -1.64 0.00 0.00 178.16 176.83 3fkn h ARG 70 N 0.96 -0.25 -0.62 1.82 2.43 -0.57 0.56 114.38 118.70 3fkn h ARG 70 Ca 0.26 0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.44 3fkn h ARG 70 Cb -0.11 0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.47 3fkn h ARG 70 CO -0.06 -0.17 0.37 1.49 -1.51 0.00 0.00 179.97 180.10 3fkn h GLU 71 N -0.26 0.85 -0.18 0.20 4.81 -1.17 0.37 114.58 119.19 3fkn h GLU 71 Ca 0.01 -0.08 -0.01 0.00 -0.13 0.00 0.00 59.36 59.15 3fkn h GLU 71 Cb 0.26 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.46 3fkn h GLU 71 CO -0.05 0.61 0.06 1.25 -0.73 0.00 0.00 179.01 180.15 3fkn h LEU 72 N 0.84 0.27 -0.30 1.64 5.85 -1.20 -0.53 115.31 121.88 3fkn h LEU 72 Ca 0.22 -0.20 0.06 0.00 0.84 0.00 0.00 57.88 58.80 3fkn h LEU 72 Cb -0.02 -0.07 -0.06 0.00 0.37 0.00 0.00 40.66 40.88 3fkn h LEU 72 CO -0.04 0.40 -0.08 0.03 -0.34 0.00 0.00 178.44 178.40 3fkn h ARG 73 N 0.12 -0.01 0.23 1.25 2.47 -0.67 0.75 114.38 118.53 3fkn h ARG 73 Ca 0.06 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.77 3fkn h ARG 73 Cb 0.23 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.55 3fkn h ARG 73 CO -0.00 -0.01 -0.11 -0.07 0.56 0.00 0.00 179.97 180.34 3fkn h LEU 74 N -0.01 -0.27 -1.00 3.04 3.38 -0.76 -1.84 115.31 117.84 3fkn h LEU 74 Ca 0.15 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.08 3fkn h LEU 74 Cb 0.24 0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.03 3fkn h LEU 74 CO -0.32 -0.19 0.21 -0.07 0.09 0.00 0.00 178.44 178.16 3fkn h LEU 75 N -0.32 0.85 -1.59 1.67 3.38 -0.94 -1.76 115.31 116.60 3fkn h LEU 75 Ca -0.03 -0.13 -0.05 0.00 0.09 0.00 0.00 57.88 57.76 3fkn h LEU 75 Cb 0.24 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 3fkn h LEU 75 CO 0.05 0.79 -0.22 0.11 0.09 0.00 0.00 178.44 179.27 3fkn h LYS 76 N 0.90 0.00 0.13 1.13 1.57 -0.72 -3.13 116.57 116.45 3fkn h LYS 76 Ca 0.21 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.71 3fkn h LYS 76 Cb 0.24 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.55 3fkn h LYS 76 CO -0.01 0.22 -1.23 1.25 -0.57 0.00 0.00 179.45 179.11 3fkn h HIS 77 N 0.00 0.53 -3.14 -1.35 2.76 -0.46 -3.46 115.15 110.03 3fkn h HIS 77 Ca -0.00 -0.38 -0.57 0.00 -2.20 0.00 0.00 60.37 57.22 3fkn h HIS 77 Cb 0.46 -0.02 -0.05 0.00 1.55 0.00 0.00 27.41 29.34 3fkn h HIS 77 CO 0.00 1.29 1.01 -1.64 -1.30 0.00 0.00 177.93 177.29 3fkn s MET 78 N -2.70 3.81 -0.52 5.26 -1.94 -0.94 -4.94 119.30 117.33 3fkn s MET 78 Ca -0.04 1.21 0.05 0.00 -1.71 0.00 0.00 55.69 55.20 3fkn s MET 78 Cb 0.07 -3.93 0.19 0.00 2.01 0.00 0.00 34.83 33.17 3fkn s MET 78 CO 0.89 -1.26 0.46 1.63 -0.01 0.00 0.00 175.02 176.73 3fkn n LYS 79 N 7.55 1.00 -3.73 2.03 5.02 -1.26 -4.37 118.16 124.40 3fkn n LYS 79 Ca 0.16 -3.72 -0.13 0.00 -2.02 0.00 0.00 58.31 52.59 3fkn n LYS 79 Cb 0.47 -1.84 -0.09 0.00 -0.02 0.00 0.00 35.03 33.55 3fkn n LYS 79 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 3fkn s HIS 80 N -0.86 -0.40 0.40 2.13 2.46 -1.26 -5.06 115.29 112.69 3fkn s HIS 80 Ca 0.32 0.92 0.11 0.00 0.47 0.00 0.00 55.06 56.88 3fkn s HIS 80 Cb 0.05 0.15 0.91 0.00 -0.13 0.00 0.00 32.58 33.56 3fkn s HIS 80 CO -0.16 -0.28 1.94 0.93 -2.47 0.00 0.00 174.74 174.71 3fkn h GLU 81 N 5.01 0.55 -0.67 2.88 5.08 -1.98 -2.51 114.58 122.93 3fkn h GLU 81 Ca -0.27 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.05 3fkn h GLU 81 Cb 1.18 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.30 3fkn h GLU 81 CO 0.29 0.36 0.00 0.09 -1.00 0.00 0.00 179.01 178.75 3fkn n ASN 82 N -4.49 4.59 -3.94 1.42 5.03 -1.26 -4.66 115.26 111.95 3fkn n ASN 82 Ca 0.12 -2.37 -0.21 0.00 0.87 0.00 0.00 54.58 52.99 3fkn n ASN 82 Cb 0.38 -0.57 -0.16 0.00 -1.02 0.00 0.00 39.78 38.41 3fkn n ASN 82 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 3fkn s VAL 83 N -1.71 0.74 -0.01 2.41 1.01 -0.95 -0.55 120.40 121.33 3fkn s VAL 83 Ca 0.50 -0.25 -0.33 0.00 0.00 0.00 0.00 61.98 61.90 3fkn s VAL 83 Cb 0.31 -0.71 -0.11 0.00 0.00 0.00 0.00 36.38 35.87 3fkn s VAL 83 CO 0.26 0.26 1.87 -0.38 0.00 0.00 0.00 175.10 177.11 3fkn n ILE 84 N 3.88 0.54 -4.11 2.22 2.08 -0.56 -4.45 119.36 118.96 3fkn n ILE 84 Ca -0.24 -0.10 -0.13 0.00 0.56 0.00 0.00 62.75 62.85 3fkn n ILE 84 Cb 0.51 -1.96 -0.02 0.00 -0.75 0.00 0.00 39.64 37.42 3fkn n ILE 84 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 3fkn n GLY 85 N 4.32 3.63 3.45 7.39 0.00 -1.26 -4.83 105.19 117.89 3fkn n GLY 85 Ca 0.21 -2.26 -0.38 0.00 0.00 0.00 0.00 46.02 43.59 3fkn n GLY 85 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3fkn s LEU 86 N 0.00 3.96 0.10 0.99 2.96 -1.24 -4.52 118.68 120.94 3fkn s LEU 86 Ca 0.04 -0.44 -0.02 0.00 -0.22 0.00 0.00 54.13 53.49 3fkn s LEU 86 Cb -0.00 -1.99 -0.22 0.00 0.50 0.00 0.00 46.19 44.48 3fkn s LEU 86 CO 0.02 -0.15 1.21 -0.07 -1.32 0.00 0.00 176.35 176.04 3fkn h LEU 87 N 8.32 0.35 -7.00 -0.68 3.38 -0.94 -3.41 115.31 115.32 3fkn h LEU 87 Ca -0.33 -0.35 0.01 0.00 0.09 0.00 0.00 57.88 57.30 3fkn h LEU 87 Cb 1.15 -0.11 -0.19 0.00 0.09 0.00 0.00 40.66 41.61 3fkn h LEU 87 CO 0.60 1.25 0.34 -0.62 0.09 0.00 0.00 178.44 180.10 3fkn s ASP 88 N -7.05 -0.52 -0.05 -0.43 3.68 -1.12 -4.53 116.67 106.65 3fkn s ASP 88 Ca -0.03 0.42 -0.04 0.00 2.13 0.00 0.00 52.55 55.03 3fkn s ASP 88 Cb 0.08 0.46 0.02 0.00 -1.45 0.00 0.00 42.92 42.03 3fkn s ASP 88 CO 0.87 -0.59 0.13 0.54 0.13 0.00 0.00 175.17 176.25 3fkn s VAL 89 N -1.83 -0.02 0.12 1.11 0.11 -1.26 -0.87 120.40 117.75 3fkn s VAL 89 Ca -0.04 0.08 -0.11 0.00 -2.93 0.00 0.00 61.98 58.98 3fkn s VAL 89 Cb -0.00 -0.20 0.01 0.00 -1.53 0.00 0.00 36.38 34.65 3fkn s VAL 89 CO 0.01 0.03 0.28 0.72 -3.33 0.00 0.00 175.10 172.82 3fkn s PHE 90 N 0.54 0.10 -0.00 1.54 -0.12 -0.82 -4.98 117.98 114.24 3fkn s PHE 90 Ca -0.04 -0.48 0.00 0.00 -0.05 0.00 0.00 56.93 56.36 3fkn s PHE 90 Cb -0.05 0.05 -0.00 0.00 -0.63 0.00 0.00 43.02 42.38 3fkn s PHE 90 CO -0.02 -0.64 -0.01 -0.08 -0.05 0.00 0.00 175.22 174.41 3fkn s THR 91 N -3.87 0.10 -0.78 -4.49 -1.32 -1.26 -1.82 115.64 102.19 3fkn s THR 91 Ca 0.07 -0.08 0.17 0.00 -1.21 0.00 0.00 61.69 60.64 3fkn s THR 91 Cb 0.03 -0.09 0.16 0.00 -1.51 0.00 0.00 72.50 71.09 3fkn s THR 91 CO -0.09 0.01 1.52 -0.81 -2.21 0.00 0.00 174.62 173.04 3fkn n PRO 92 N 3.00 0.07 -2.24 7.08 -0.04 -1.26 -4.84 135.00 136.77 3fkn n PRO 92 Ca -0.13 0.35 -0.39 0.00 -0.04 0.00 0.00 63.50 63.30 3fkn n PRO 92 Cb 0.59 -1.65 -0.02 0.00 -0.04 0.00 0.00 33.50 32.39 3fkn n PRO 92 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3fkn s ALA 93 N -3.13 3.24 -1.24 0.55 0.00 -1.26 -4.95 121.76 114.97 3fkn s ALA 93 Ca 0.05 1.05 0.22 0.00 0.00 0.00 0.00 51.96 53.28 3fkn s ALA 93 Cb 0.08 -3.41 -0.08 0.00 0.00 0.00 0.00 23.12 19.71 3fkn s ALA 93 CO 0.28 -0.57 1.01 0.54 0.00 0.00 0.00 175.76 177.02 3fkn n ARG 94 N 0.28 0.27 -3.93 0.00 1.74 -1.26 -4.95 116.66 108.81 3fkn n ARG 94 Ca 0.03 -0.22 -0.08 0.00 -0.77 0.00 0.00 57.85 56.81 3fkn n ARG 94 Cb 0.45 -1.50 -0.04 0.00 -1.02 0.00 0.00 32.46 30.36 3fkn n ARG 94 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 3fkn s SER 95 N -2.88 -0.17 0.35 0.55 1.04 -1.26 -5.05 113.70 106.29 3fkn s SER 95 Ca 0.11 -0.78 0.03 0.00 0.48 0.00 0.00 55.95 55.79 3fkn s SER 95 Cb 0.17 0.64 0.65 0.00 0.10 0.00 0.00 66.02 67.58 3fkn s SER 95 CO 0.78 -1.22 2.00 0.25 0.98 0.00 0.00 173.24 176.04 3fkn h LEU 96 N 2.15 0.72 -1.04 2.42 5.85 -1.95 -2.07 115.31 121.39 3fkn h LEU 96 Ca -0.23 -0.02 -0.10 0.00 0.84 0.00 0.00 57.88 58.37 3fkn h LEU 96 Cb 1.25 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 42.09 3fkn h LEU 96 CO 0.31 0.51 -0.37 1.05 -0.34 0.00 0.00 178.44 179.60 3fkn h GLU 97 N 0.85 0.21 -0.02 1.25 9.09 -2.01 -2.73 114.58 121.22 3fkn h GLU 97 Ca 0.24 -0.09 0.00 0.00 0.05 0.00 0.00 59.36 59.56 3fkn h GLU 97 Cb -0.05 -0.01 0.00 0.00 -1.65 0.00 0.00 28.75 27.04 3fkn h GLU 97 CO -0.06 0.56 -0.09 -0.85 0.05 0.00 0.00 179.01 178.62 3fkn n GLU 98 N -4.07 1.85 -2.03 1.06 0.28 -1.10 -4.93 120.64 111.71 3fkn n GLU 98 Ca -0.01 -1.38 -0.42 0.00 -0.16 0.00 0.00 57.16 55.18 3fkn n GLU 98 Cb 0.44 -1.47 -0.03 0.00 1.43 0.00 0.00 31.44 31.81 3fkn n GLU 98 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 177.13 177.09 3fkn s PHE 99 N -2.11 2.03 0.00 -1.84 5.36 -0.80 -4.71 117.98 115.91 3fkn s PHE 99 Ca 0.29 0.25 0.00 0.00 -0.96 0.00 0.00 56.93 56.52 3fkn s PHE 99 Cb 0.20 -3.89 0.00 0.00 -0.34 0.00 0.00 43.02 38.99 3fkn s PHE 99 CO 0.37 -3.70 0.00 -1.71 -1.46 0.00 0.00 175.22 168.72 3fkn n ASN 100 N 7.17 0.00 -4.14 6.13 5.15 -1.26 -5.02 115.26 123.28 3fkn n ASN 100 Ca 0.17 -0.11 -0.22 0.00 -0.60 0.00 0.00 54.58 53.82 3fkn n ASN 100 Cb 0.43 0.00 -0.15 0.00 -0.53 0.00 0.00 39.78 39.53 3fkn n ASN 100 CO 0.00 0.00 0.00 -1.81 1.40 0.00 0.00 177.26 176.85 3fkn s ASP 101 N 0.00 1.82 -0.08 1.20 -0.00 -1.26 -4.52 116.67 113.83 3fkn s ASP 101 Ca 0.00 -0.35 0.03 0.00 -0.00 0.00 0.00 52.55 52.23 3fkn s ASP 101 Cb 0.00 -0.17 0.01 0.00 -0.00 0.00 0.00 42.92 42.75 3fkn s ASP 101 CO 0.00 0.14 -0.17 -0.69 -0.00 0.00 0.00 175.17 174.45 3fkn s VAL 102 N -0.54 1.51 -0.11 -1.27 1.01 -1.26 -4.60 120.40 115.14 3fkn s VAL 102 Ca 0.05 -0.70 0.03 0.00 0.00 0.00 0.00 61.98 61.36 3fkn s VAL 102 Cb -0.07 -1.34 -0.00 0.00 0.00 0.00 0.00 36.38 34.97 3fkn s VAL 102 CO 0.00 0.44 -0.21 -0.31 0.00 0.00 0.00 175.10 175.02 3fkn s TYR 103 N 0.54 2.62 -0.09 5.22 1.51 -0.76 -1.38 117.35 125.01 3fkn s TYR 103 Ca -0.16 -0.94 0.03 0.00 -1.01 0.00 0.00 57.07 54.98 3fkn s TYR 103 Cb -0.17 -1.74 -0.01 0.00 -0.11 0.00 0.00 41.96 39.93 3fkn s TYR 103 CO 0.06 -0.36 -0.18 -0.51 -1.11 0.00 0.00 175.55 173.44 3fkn s LEU 104 N 0.33 2.46 -0.13 -1.29 1.43 0.68 -1.95 118.68 120.21 3fkn s LEU 104 Ca -0.17 -0.38 0.03 0.00 -1.03 0.00 0.00 54.13 52.58 3fkn s LEU 104 Cb -0.17 -1.50 0.00 0.00 0.03 0.00 0.00 46.19 44.55 3fkn s LEU 104 CO 0.08 0.23 -0.22 -0.69 0.23 0.00 0.00 176.35 175.98 3fkn s VAL 105 N -0.05 2.13 0.37 -1.59 1.01 -0.05 -0.00 120.40 122.22 3fkn s VAL 105 Ca -0.05 -0.97 0.06 0.00 0.00 0.00 0.00 61.98 61.02 3fkn s VAL 105 Cb -0.14 -1.84 -0.02 0.00 0.00 0.00 0.00 36.38 34.37 3fkn s VAL 105 CO 0.04 0.55 0.22 0.28 0.00 0.00 0.00 175.10 176.20 3fkn s THR 106 N 0.62 0.22 0.38 3.92 -1.32 -0.33 -0.20 115.64 118.92 3fkn s THR 106 Ca -0.12 -2.00 -0.28 0.00 -1.21 0.00 0.00 61.69 58.08 3fkn s THR 106 Cb -0.16 -2.40 -0.11 0.00 -1.51 0.00 0.00 72.50 68.31 3fkn s THR 106 CO 0.03 0.00 1.47 -1.00 -2.21 0.00 0.00 174.62 172.91 3fkn s HIS 107 N -3.31 2.61 -0.20 9.09 3.76 -1.26 -0.25 115.29 125.72 3fkn s HIS 107 Ca 0.33 1.19 -0.27 0.00 -0.15 0.00 0.00 55.06 56.15 3fkn s HIS 107 Cb 0.02 -4.00 -0.00 0.00 1.11 0.00 0.00 32.58 29.71 3fkn s HIS 107 CO 0.23 -2.93 0.95 -1.17 -0.85 0.00 0.00 174.74 170.97 3fkn s LEU 108 N -2.10 4.13 0.27 0.89 2.96 -0.65 -4.18 118.68 119.99 3fkn s LEU 108 Ca 0.53 1.28 0.03 0.00 -0.22 0.00 0.00 54.13 55.75 3fkn s LEU 108 Cb -0.46 -3.40 -0.03 0.00 0.50 0.00 0.00 46.19 42.79 3fkn s LEU 108 CO 0.62 -0.55 0.42 -0.04 -1.32 0.00 0.00 176.35 175.48 3fkn s MET 109 N 2.75 3.46 0.03 1.98 -1.94 -1.26 -4.88 119.30 119.44 3fkn s MET 109 Ca 0.41 -0.60 -0.19 0.00 -1.71 0.00 0.00 55.69 53.61 3fkn s MET 109 Cb -0.16 -2.82 -0.18 0.00 2.01 0.00 0.00 34.83 33.68 3fkn s MET 109 CO 0.09 0.34 1.22 0.78 -0.01 0.00 0.00 175.02 177.44 3fkn h GLY 110 N 1.13 0.50 -1.82 -0.03 0.00 -1.85 -3.49 103.07 97.51 3fkn h GLY 110 Ca -0.51 -0.69 0.03 0.00 0.00 0.00 0.00 47.33 46.16 3fkn h GLY 110 CO 0.62 0.62 0.20 0.00 0.00 0.00 0.00 176.54 177.97 3fkn s ALA 111 N -3.68 -0.97 0.24 3.60 0.00 -0.53 -5.01 121.76 115.41 3fkn s ALA 111 Ca -0.13 -0.49 0.04 0.00 0.00 0.00 0.00 51.96 51.37 3fkn s ALA 111 Cb 0.05 0.84 -0.03 0.00 0.00 0.00 0.00 23.12 23.98 3fkn s ALA 111 CO 0.81 -1.00 0.37 0.16 0.00 0.00 0.00 175.76 176.09 3fkn s ASP 112 N -2.97 6.32 0.42 0.00 3.84 -1.26 -0.54 116.67 122.49 3fkn s ASP 112 Ca 0.14 0.14 0.11 0.00 -0.00 0.00 0.00 52.55 52.94 3fkn s ASP 112 Cb -0.05 -1.89 0.95 0.00 -1.38 0.00 0.00 42.92 40.55 3fkn s ASP 112 CO 0.09 -0.08 2.01 0.25 -0.00 0.00 0.00 175.17 177.44 3fkn h LEU 113 N 1.31 0.41 -0.41 2.11 5.85 -0.03 -2.27 115.31 122.28 3fkn h LEU 113 Ca -0.51 0.00 0.08 0.00 0.84 0.00 0.00 57.88 58.29 3fkn h LEU 113 Cb 1.22 -0.09 -0.07 0.00 0.37 0.00 0.00 40.66 42.09 3fkn h LEU 113 CO 0.62 0.27 -0.07 0.78 -0.34 0.00 0.00 178.44 179.71 3fkn h ASN 114 N 0.47 -0.32 0.50 1.25 -0.26 -1.84 -0.06 115.58 115.33 3fkn h ASN 114 Ca 0.22 0.12 0.00 0.00 -0.56 0.00 0.00 56.30 56.08 3fkn h ASN 114 Cb 0.28 0.23 0.00 0.00 -1.06 0.00 0.00 38.32 37.77 3fkn h ASN 114 CO -0.06 -0.11 0.00 0.59 -1.06 0.00 0.00 177.43 176.79 3fkn n ASN 115 N -5.28 0.07 -0.09 5.81 3.02 -0.86 -2.60 115.26 115.33 3fkn n ASN 115 Ca 0.03 0.52 -0.23 0.00 -0.03 0.00 0.00 54.58 54.87 3fkn n ASN 115 Cb 0.22 -0.53 -0.12 0.00 -0.61 0.00 0.00 39.78 38.74 3fkn n ASN 115 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 3fkn n ILE 116 N -1.57 1.60 -0.17 2.41 2.08 -0.33 -4.49 119.36 118.89 3fkn n ILE 116 Ca 0.03 -0.42 -0.08 0.00 0.56 0.00 0.00 62.75 62.84 3fkn n ILE 116 Cb 0.17 -1.77 0.01 0.00 -0.75 0.00 0.00 39.64 37.30 3fkn n ILE 116 CO 0.00 0.00 0.00 0.58 0.56 0.00 0.00 176.55 177.69 3fkn h VAL 117 N -0.45 1.20 -6.86 1.39 2.07 -1.02 -3.47 116.25 109.11 3fkn h VAL 117 Ca -0.51 -0.60 -0.44 0.00 0.82 0.00 0.00 66.70 65.97 3fkn h VAL 117 Cb 1.73 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 32.18 3fkn h VAL 117 CO -0.14 0.23 -0.81 2.29 0.02 0.00 0.00 177.57 179.15 3fkn n LYS 118 N -4.59 -0.64 -1.70 1.57 2.85 -1.07 0.26 118.16 114.83 3fkn n LYS 118 Ca 0.02 0.12 -0.16 0.00 -1.05 0.00 0.00 58.31 57.24 3fkn n LYS 118 Cb 0.14 -1.68 -0.05 0.00 -0.65 0.00 0.00 35.03 32.78 3fkn n LYS 118 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 3fkn s GLN 120 N -3.78 1.85 0.23 0.00 -0.21 0.14 -4.86 119.66 113.03 3fkn s GLN 120 Ca 0.00 -0.68 -0.32 0.00 0.02 0.00 0.00 55.36 54.38 3fkn s GLN 120 Cb 0.00 -1.64 -0.12 0.00 1.00 0.00 0.00 33.01 32.25 3fkn s GLN 120 CO 0.00 0.31 1.65 1.63 -2.12 0.00 0.00 175.29 176.76 3fkn n LYS 121 N 2.97 2.63 -3.54 2.91 5.02 -1.26 -4.02 118.16 122.87 3fkn n LYS 121 Ca -0.17 0.95 -0.26 0.00 -2.02 0.00 0.00 58.31 56.80 3fkn n LYS 121 Cb 0.53 -2.76 -0.02 0.00 -0.02 0.00 0.00 35.03 32.76 3fkn n LYS 121 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3fkn s LEU 122 N 0.65 4.13 0.58 -0.35 1.02 -0.43 -4.96 118.68 119.32 3fkn s LEU 122 Ca 0.72 0.45 -0.19 0.00 0.02 0.00 0.00 54.13 55.14 3fkn s LEU 122 Cb -0.53 -3.26 -0.04 0.00 0.02 0.00 0.00 46.19 42.37 3fkn s LEU 122 CO 0.38 -0.16 1.16 0.42 0.02 0.00 0.00 176.35 178.17 3fkn s THR 123 N -2.07 2.94 0.34 5.49 -4.23 -1.26 -4.77 115.64 112.09 3fkn s THR 123 Ca 0.40 0.56 0.05 0.00 -1.18 0.00 0.00 61.69 61.52 3fkn s THR 123 Cb -0.10 -3.20 0.29 0.00 1.34 0.00 0.00 72.50 70.83 3fkn s THR 123 CO 0.31 -0.15 1.93 -0.78 -0.54 0.00 0.00 174.62 175.40 3fkn h ASP 124 N 0.90 0.73 -0.66 3.99 3.58 -1.98 -0.71 116.42 122.28 3fkn h ASP 124 Ca -0.50 0.01 -0.02 0.00 0.42 0.00 0.00 57.03 56.94 3fkn h ASP 124 Cb 1.28 -0.14 -0.03 0.00 1.72 0.00 0.00 39.33 42.15 3fkn h ASP 124 CO 0.56 0.45 0.32 0.44 -2.88 0.00 0.00 179.24 178.13 3fkn h ASP 125 N 0.82 0.87 -0.58 2.28 3.45 -1.99 0.14 116.42 121.40 3fkn h ASP 125 Ca 0.36 -0.13 -0.03 0.00 0.43 0.00 0.00 57.03 57.65 3fkn h ASP 125 Cb 0.32 -0.22 -0.03 0.00 -0.56 0.00 0.00 39.33 38.85 3fkn h ASP 125 CO -0.13 0.76 0.23 0.45 -1.57 0.00 0.00 179.24 178.97 3fkn h HIS 126 N 0.92 0.89 -0.19 4.55 3.86 -1.55 -2.40 115.15 121.23 3fkn h HIS 126 Ca 0.23 -0.07 -0.01 0.00 -1.16 0.00 0.00 60.37 59.36 3fkn h HIS 126 Cb 0.12 -0.27 -0.01 0.00 1.06 0.00 0.00 27.41 28.32 3fkn h HIS 126 CO 0.00 0.72 0.10 0.28 0.86 0.00 0.00 177.93 179.89 3fkn h VAL 127 N 0.81 1.12 -0.49 2.45 2.07 -0.88 -1.26 116.25 120.06 3fkn h VAL 127 Ca 0.19 -0.33 0.10 0.00 0.82 0.00 0.00 66.70 67.49 3fkn h VAL 127 Cb 0.21 0.99 -0.09 0.00 -1.52 0.00 0.00 31.29 30.87 3fkn h VAL 127 CO -0.02 0.11 -0.10 1.56 0.02 0.00 0.00 177.57 179.15 3fkn h GLN 128 N 0.19 0.02 -0.03 1.57 4.20 -0.64 -0.62 115.11 119.80 3fkn h GLN 128 Ca 0.07 -0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.77 3fkn h GLN 128 Cb 0.09 -0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.87 3fkn h GLN 128 CO -0.01 0.01 -0.01 0.35 -0.67 0.00 0.00 178.83 178.51 3fkn h PHE 129 N 0.02 0.07 -0.14 2.96 3.57 -1.21 -0.62 116.94 121.59 3fkn h PHE 129 Ca 0.24 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.72 3fkn h PHE 129 Cb 0.37 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.08 3fkn h PHE 129 CO -0.40 0.41 0.07 -0.07 -2.23 0.00 0.00 178.31 176.09 3fkn h LEU 130 N -0.29 0.18 -0.67 0.59 3.38 -1.11 -2.34 115.31 115.05 3fkn h LEU 130 Ca 0.01 -0.12 -0.08 0.00 0.09 0.00 0.00 57.88 57.78 3fkn h LEU 130 Cb 0.39 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 3fkn h LEU 130 CO 0.00 0.24 0.09 0.40 0.09 0.00 0.00 178.44 179.27 3fkn h ILE 131 N 0.10 1.27 -0.48 1.22 1.08 -1.15 -2.19 117.51 117.36 3fkn h ILE 131 Ca 0.05 -1.07 0.09 0.00 -0.39 0.00 0.00 64.86 63.54 3fkn h ILE 131 Cb 0.11 0.65 -0.08 0.00 -3.07 0.00 0.00 36.82 34.44 3fkn h ILE 131 CO -0.01 0.40 0.03 0.22 -0.69 0.00 0.00 178.15 178.10 3fkn h TYR 132 N 1.04 0.02 -0.63 1.37 3.20 -0.98 -0.27 116.97 120.72 3fkn h TYR 132 Ca 0.20 0.03 -0.08 0.00 3.14 0.00 0.00 58.73 62.03 3fkn h TYR 132 Cb 0.47 0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.77 3fkn h TYR 132 CO 0.03 -0.08 0.09 1.96 -1.64 0.00 0.00 178.16 178.53 3fkn h GLN 133 N 0.15 1.05 -0.01 1.82 4.20 -1.20 0.95 115.11 122.07 3fkn h GLN 133 Ca 0.24 -0.29 0.01 0.00 0.06 0.00 0.00 58.65 58.67 3fkn h GLN 133 Cb 0.35 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.00 3fkn h GLN 133 CO -0.37 0.98 -0.04 0.82 -0.67 0.00 0.00 178.83 179.55 3fkn h ILE 134 N 0.96 0.90 -0.52 2.54 2.04 -1.03 -0.42 117.51 121.98 3fkn h ILE 134 Ca 0.19 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 66.02 3fkn h ILE 134 Cb 0.45 0.90 -0.03 0.00 -0.74 0.00 0.00 36.82 37.41 3fkn h ILE 134 CO 0.01 0.00 0.21 -0.07 0.00 0.00 0.00 178.15 178.31 3fkn h LEU 135 N -0.06 0.67 -0.31 1.44 3.38 -0.86 0.40 115.31 119.97 3fkn h LEU 135 Ca 0.02 -0.08 -0.05 0.00 0.09 0.00 0.00 57.88 57.86 3fkn h LEU 135 Cb 0.08 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 3fkn h LEU 135 CO -0.04 0.60 0.01 -0.09 0.09 0.00 0.00 178.44 179.01 3fkn h ARG 136 N 0.73 0.54 -0.61 1.13 2.43 -0.53 -0.44 114.38 117.65 3fkn h ARG 136 Ca 0.18 -0.17 -0.02 0.00 -0.81 0.00 0.00 59.98 59.16 3fkn h ARG 136 Cb 0.13 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.61 3fkn h ARG 136 CO -0.02 0.67 0.30 0.78 -1.51 0.00 0.00 179.97 180.20 3fkn h GLY 137 N 0.34 0.92 1.05 2.80 0.00 -0.79 -2.91 103.07 104.48 3fkn h GLY 137 Ca 0.09 -0.45 -0.09 0.00 0.00 0.00 0.00 47.33 46.89 3fkn h GLY 137 CO 0.01 0.42 0.03 1.41 0.00 0.00 0.00 176.54 178.42 3fkn h LEU 138 N 0.83 0.97 -0.71 3.11 3.38 -0.82 -1.01 115.31 121.05 3fkn h LEU 138 Ca 0.21 -0.29 0.12 0.00 0.09 0.00 0.00 57.88 58.00 3fkn h LEU 138 Cb 0.09 -0.26 -0.08 0.00 0.09 0.00 0.00 40.66 40.50 3fkn h LEU 138 CO -0.03 1.03 0.30 0.50 0.09 0.00 0.00 178.44 180.33 3fkn h LYS 139 N 0.89 0.47 -0.07 1.13 3.64 -1.02 0.36 116.57 121.96 3fkn h LYS 139 Ca 0.17 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.51 3fkn h LYS 139 Cb 0.51 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 32.22 3fkn h LYS 139 CO 0.02 0.31 0.03 -0.92 -2.27 0.00 0.00 179.45 176.62 3fkn h TYR 140 N 0.48 0.12 0.02 1.91 3.20 -1.30 -1.70 116.97 119.70 3fkn h TYR 140 Ca 0.38 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.23 3fkn h TYR 140 Cb 0.51 -0.03 0.00 0.00 1.54 0.00 0.00 36.73 38.74 3fkn h TYR 140 CO -0.15 0.26 -0.01 0.82 -1.64 0.00 0.00 178.16 177.44 3fkn h ILE 141 N -0.06 1.04 -0.42 1.81 2.04 -0.66 -3.06 117.51 118.20 3fkn h ILE 141 Ca 0.02 -0.19 -0.03 0.00 1.00 0.00 0.00 64.86 65.66 3fkn h ILE 141 Cb 0.20 1.17 -0.02 0.00 -0.74 0.00 0.00 36.82 37.43 3fkn h ILE 141 CO -0.00 0.05 0.11 0.45 0.00 0.00 0.00 178.15 178.76 3fkn h HIS 142 N -0.11 0.62 0.00 1.37 3.86 -0.33 -2.29 115.15 118.27 3fkn h HIS 142 Ca -0.00 -0.04 -0.00 0.00 -1.16 0.00 0.00 60.37 59.17 3fkn h HIS 142 Cb 0.10 -0.19 -0.00 0.00 1.06 0.00 0.00 27.41 28.38 3fkn h HIS 142 CO -0.05 0.53 -0.00 0.66 0.86 0.00 0.00 177.93 179.93 3fkn h SER 143 N 0.60 0.00 -0.51 2.45 4.64 -1.20 0.61 113.55 120.14 3fkn h SER 143 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 3fkn h SER 143 Cb 0.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 3fkn h SER 143 CO -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 3fkn n ALA 144 N -2.09 2.98 -3.63 5.18 0.00 -0.89 -4.71 120.51 117.34 3fkn n ALA 144 Ca -0.02 -1.23 -0.27 0.00 0.00 0.00 0.00 53.44 51.91 3fkn n ALA 144 Cb 0.13 -1.02 0.02 0.00 0.00 0.00 0.00 19.45 18.58 3fkn n ALA 144 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3fkn n ASP 145 N 0.84 -4.87 -4.62 0.00 10.43 0.21 -4.36 116.55 114.17 3fkn n ASP 145 Ca 0.20 -0.60 -0.34 0.00 2.57 0.00 0.00 54.79 56.62 3fkn n ASP 145 Cb 0.73 -3.92 -0.10 0.00 1.84 0.00 0.00 41.12 39.67 3fkn n ASP 145 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 3fkn s ILE 146 N -3.19 4.12 -0.09 0.53 1.01 -1.04 -5.04 121.20 117.50 3fkn s ILE 146 Ca 0.55 -0.31 0.01 0.00 0.00 0.00 0.00 60.65 60.90 3fkn s ILE 146 Cb -0.27 -2.74 -0.02 0.00 0.01 0.00 0.00 42.46 39.43 3fkn s ILE 146 CO 0.67 0.58 -0.10 -0.63 0.00 0.00 0.00 174.94 175.46 3fkn s ILE 147 N -0.57 3.35 -0.01 2.92 1.01 -1.26 -3.59 121.20 123.05 3fkn s ILE 147 Ca 0.09 -0.59 -0.25 0.00 0.00 0.00 0.00 60.65 59.91 3fkn s ILE 147 Cb -0.12 -2.37 -0.18 0.00 0.01 0.00 0.00 42.46 39.80 3fkn s ILE 147 CO 0.02 0.57 1.22 -0.74 0.00 0.00 0.00 174.94 176.01 3fkn h HIS 148 N 5.79 -0.19 0.00 3.97 -0.00 -1.94 -3.05 115.15 119.72 3fkn h HIS 148 Ca -0.40 -0.00 0.00 0.00 -0.00 0.00 0.00 60.37 59.96 3fkn h HIS 148 Cb 1.18 0.06 0.00 0.00 -0.00 0.00 0.00 27.41 28.65 3fkn h HIS 148 CO 0.52 0.19 0.00 0.54 -0.00 0.00 0.00 177.93 179.19 3fkn n ARG 149 N -5.00 0.00 -2.49 5.26 1.74 -1.26 -3.13 116.66 111.79 3fkn n ARG 149 Ca -0.09 0.00 -0.00 0.00 -0.77 0.00 0.00 57.85 56.99 3fkn n ARG 149 Cb 0.24 -1.06 0.06 0.00 -1.02 0.00 0.00 32.46 30.68 3fkn n ARG 149 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3fkn n ASP 150 N 0.00 0.60 -4.72 0.55 2.03 -1.26 -5.01 116.55 108.74 3fkn n ASP 150 Ca 0.00 -2.06 -0.42 0.00 0.52 0.00 0.00 54.79 52.83 3fkn n ASP 150 Cb 0.00 -0.13 -0.03 0.00 -0.72 0.00 0.00 41.12 40.24 3fkn n ASP 150 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3fkn s LEU 151 N -3.09 4.37 0.14 -2.67 1.43 -1.26 -4.90 118.68 112.70 3fkn s LEU 151 Ca 0.22 2.54 -0.24 0.00 -1.03 0.00 0.00 54.13 55.62 3fkn s LEU 151 Cb 0.34 -3.59 0.07 0.00 0.03 0.00 0.00 46.19 43.04 3fkn s LEU 151 CO -0.08 -0.76 0.67 -1.59 0.23 0.00 0.00 176.35 174.82 3fkn s LYS 152 N 1.01 1.25 0.41 1.70 -2.85 -1.26 -4.83 119.74 115.16 3fkn s LYS 152 Ca 0.68 -0.50 0.18 0.00 -1.00 0.00 0.00 55.97 55.33 3fkn s LYS 152 Cb -0.42 0.55 1.09 0.00 -2.06 0.00 0.00 37.83 36.99 3fkn s LYS 152 CO 0.32 -0.55 1.81 -1.35 0.10 0.00 0.00 175.35 175.68 3fkn h PRO 153 N 2.00 0.40 0.00 1.78 0.11 -1.94 -1.73 132.00 132.62 3fkn h PRO 153 Ca -0.30 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 65.76 3fkn h PRO 153 Cb 1.29 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 3fkn h PRO 153 CO 0.35 0.26 -0.11 0.66 -0.21 0.00 0.00 178.00 178.95 3fkn h SER 154 N 0.41 0.00 -0.61 -2.05 4.64 -1.93 -2.06 113.55 111.95 3fkn h SER 154 Ca 0.54 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.64 3fkn h SER 154 Cb 1.35 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 63.31 3fkn h SER 154 CO -0.23 0.11 0.21 -0.46 -0.87 0.00 0.00 176.83 175.58 3fkn n ASN 155 N -3.37 3.97 -4.16 4.97 0.23 -0.65 -4.80 115.26 111.45 3fkn n ASN 155 Ca -0.01 -3.38 -0.34 0.00 -0.53 0.00 0.00 54.58 50.32 3fkn n ASN 155 Cb 0.30 -0.70 -0.14 0.00 -2.08 0.00 0.00 39.78 37.16 3fkn n ASN 155 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 3fkn s LEU 156 N -3.08 3.83 -0.11 -4.53 1.43 -0.82 -0.82 118.68 114.58 3fkn s LEU 156 Ca 0.51 -1.29 -0.08 0.00 -1.03 0.00 0.00 54.13 52.24 3fkn s LEU 156 Cb 0.42 -1.69 -0.04 0.00 0.03 0.00 0.00 46.19 44.91 3fkn s LEU 156 CO 0.09 -0.25 0.16 0.00 0.23 0.00 0.00 176.35 176.58 3fkn s ALA 157 N 1.23 3.86 0.01 4.21 0.00 -0.19 -0.12 121.76 130.75 3fkn s ALA 157 Ca -0.06 -0.61 0.01 0.00 0.00 0.00 0.00 51.96 51.30 3fkn s ALA 157 Cb -0.20 -2.01 -0.01 0.00 0.00 0.00 0.00 23.12 20.90 3fkn s ALA 157 CO -0.02 0.59 -0.04 0.08 0.00 0.00 0.00 175.76 176.38 3fkn s VAL 158 N -0.98 0.27 0.68 0.00 1.01 0.30 -0.77 120.40 120.92 3fkn s VAL 158 Ca 0.15 -0.35 0.04 0.00 0.00 0.00 0.00 61.98 61.82 3fkn s VAL 158 Cb -0.12 -0.28 0.12 0.00 0.00 0.00 0.00 36.38 36.11 3fkn s VAL 158 CO 0.05 -0.06 0.94 0.54 0.00 0.00 0.00 175.10 176.56 3fkn s ASN 159 N -0.44 4.55 0.37 3.32 2.20 -0.82 -1.45 114.94 122.68 3fkn s ASN 159 Ca -0.02 -0.65 0.27 0.00 -0.94 0.00 0.00 52.86 51.52 3fkn s ASN 159 Cb -0.03 0.27 1.19 0.00 -2.00 0.00 0.00 41.25 40.68 3fkn s ASN 159 CO -0.00 -1.74 1.81 -0.33 -2.94 0.00 0.00 177.10 173.91 3fkn h GLU 160 N -0.30 0.00 -0.05 3.55 5.08 -1.97 -0.63 114.58 120.27 3fkn h GLU 160 Ca -0.32 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.04 3fkn h GLU 160 Cb 1.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.52 3fkn h GLU 160 CO 0.39 0.00 0.00 -0.25 -1.00 0.00 0.00 179.01 178.15 3fkn n ASP 161 N -2.51 0.68 -0.30 1.42 10.43 -1.26 -4.91 116.55 120.11 3fkn n ASP 161 Ca 0.01 -1.43 -0.04 0.00 2.57 0.00 0.00 54.79 55.90 3fkn n ASP 161 Cb 0.21 -0.03 -0.02 0.00 1.84 0.00 0.00 41.12 43.13 3fkn n ASP 161 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3fkn s GLU 163 N -1.78 4.40 0.03 0.00 2.02 -1.26 -4.80 118.70 117.30 3fkn s GLU 163 Ca 0.00 2.02 0.08 0.00 0.02 0.00 0.00 54.97 57.09 3fkn s GLU 163 Cb 0.00 -3.22 -0.03 0.00 0.10 0.00 0.00 34.13 30.99 3fkn s GLU 163 CO 0.00 -0.25 -0.23 -1.17 0.02 0.00 0.00 175.26 173.63 3fkn s LEU 164 N 0.07 2.31 -0.00 1.80 0.20 -1.26 -1.94 118.68 119.86 3fkn s LEU 164 Ca 0.57 -0.50 0.03 0.00 0.69 0.00 0.00 54.13 54.92 3fkn s LEU 164 Cb -0.36 -1.38 -0.01 0.00 -0.43 0.00 0.00 46.19 44.02 3fkn s LEU 164 CO 0.37 0.27 -0.10 -0.54 -0.29 0.00 0.00 176.35 176.06 3fkn s LYS 165 N -1.16 0.75 -0.09 1.98 1.02 0.05 -4.17 119.74 118.12 3fkn s LYS 165 Ca 0.12 -0.38 -0.23 0.00 0.02 0.00 0.00 55.97 55.50 3fkn s LYS 165 Cb -0.10 -0.72 -0.03 0.00 -0.52 0.00 0.00 37.83 36.46 3fkn s LYS 165 CO 0.02 0.19 0.69 0.42 -0.92 0.00 0.00 175.35 175.75 3fkn s ILE 166 N -0.32 5.05 0.27 2.17 1.01 0.29 -1.02 121.20 128.63 3fkn s ILE 166 Ca 0.03 1.40 0.07 0.00 0.00 0.00 0.00 60.65 62.14 3fkn s ILE 166 Cb -0.04 -4.02 -0.03 0.00 0.01 0.00 0.00 42.46 38.38 3fkn s ILE 166 CO -0.00 0.23 0.28 -0.76 0.00 0.00 0.00 174.94 174.69 3fkn s LEU 167 N 0.96 3.92 -0.66 2.97 1.43 -0.00 -1.50 118.68 125.80 3fkn s LEU 167 Ca 0.36 -0.20 0.00 0.00 -1.03 0.00 0.00 54.13 53.26 3fkn s LEU 167 Cb -0.17 -2.49 0.00 0.00 0.03 0.00 0.00 46.19 43.56 3fkn s LEU 167 CO 0.17 -0.13 0.00 0.47 0.23 0.00 0.00 176.35 177.09 3fkn n ASP 168 N -1.31 -4.52 -4.76 2.29 10.43 -1.26 -4.85 116.55 112.58 3fkn n ASP 168 Ca -0.07 0.15 -0.39 0.00 2.57 0.00 0.00 54.79 57.06 3fkn n ASP 168 Cb 0.58 -2.57 0.03 0.00 1.84 0.00 0.00 41.12 41.01 3fkn n ASP 168 CO 0.00 0.00 0.00 0.72 -1.07 0.00 0.00 177.20 176.85 3fkn s PHE 169 N -1.97 2.31 0.00 1.24 -0.12 -1.26 -4.92 117.98 113.26 3fkn s PHE 169 Ca 0.00 1.31 0.00 0.00 -0.05 0.00 0.00 56.93 58.19 3fkn s PHE 169 Cb 0.00 -3.88 0.00 0.00 -0.63 0.00 0.00 43.02 38.51 3fkn s PHE 169 CO 0.00 -3.02 0.00 0.41 -0.05 0.00 0.00 175.22 172.56 3fkn n GLY 170 N 0.67 0.89 0.00 1.99 0.00 -1.16 -4.99 105.19 102.59 3fkn n GLY 170 Ca 0.08 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.10 3fkn n GLY 170 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3fkn n HIS 174 N -2.22 0.00 -1.82 1.61 8.25 -1.26 -5.03 115.22 114.75 3fkn n HIS 174 Ca 0.00 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.16 3fkn n HIS 174 Cb 0.00 0.00 0.07 0.00 1.12 0.00 0.00 29.99 31.18 3fkn n HIS 174 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 3fkn s THR 175 N -0.78 2.80 0.23 1.59 -4.23 -1.26 -4.97 115.64 109.02 3fkn s THR 175 Ca 0.00 0.26 -0.07 0.00 -1.18 0.00 0.00 61.69 60.70 3fkn s THR 175 Cb 0.00 -3.21 0.20 0.00 1.34 0.00 0.00 72.50 70.83 3fkn s THR 175 CO 0.00 -0.34 1.85 0.44 -0.54 0.00 0.00 174.62 176.03 3fkn h ASP 176 N -0.91 1.11 -0.35 3.99 3.45 -2.04 -3.02 116.42 118.65 3fkn h ASP 176 Ca -0.46 -0.11 -0.04 0.00 0.43 0.00 0.00 57.03 56.85 3fkn h ASP 176 Cb 1.29 -0.28 -0.02 0.00 -0.56 0.00 0.00 39.33 39.75 3fkn h ASP 176 CO 0.64 0.90 0.08 -0.78 -1.57 0.00 0.00 179.24 178.50 3fkn h ASP 177 N 1.24 0.60 0.28 6.45 1.82 -1.96 -2.40 116.42 122.46 3fkn h ASP 177 Ca 0.31 -0.10 0.00 0.00 -0.39 0.00 0.00 57.03 56.85 3fkn h ASP 177 Cb 0.04 -0.16 0.00 0.00 0.68 0.00 0.00 39.33 39.89 3fkn h ASP 177 CO -0.05 0.62 -0.15 -1.84 -1.61 0.00 0.00 179.24 176.21 3fkn n GLU 178 N -4.30 0.82 -0.14 0.28 0.28 -1.15 -2.79 120.64 113.64 3fkn n GLU 178 Ca 0.03 -0.37 0.12 0.00 -0.16 0.00 0.00 57.16 56.77 3fkn n GLU 178 Cb 0.22 -1.49 0.19 0.00 1.43 0.00 0.00 31.44 31.78 3fkn n GLU 178 CO 0.00 0.00 0.00 -1.33 -0.16 0.00 0.00 177.13 175.64 3fkn n MET 179 N -0.77 2.46 -3.35 3.44 2.81 -0.93 -4.69 117.12 116.10 3fkn n MET 179 Ca 0.14 -2.18 -0.38 0.00 -1.81 0.00 0.00 57.70 53.47 3fkn n MET 179 Cb 0.30 -1.50 -0.06 0.00 -0.71 0.00 0.00 33.22 31.25 3fkn n MET 179 CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 3fkn s THR 180 N -1.64 5.07 0.00 2.03 2.01 -1.07 -4.82 115.64 117.21 3fkn s THR 180 Ca 0.36 0.98 0.00 0.00 0.31 0.00 0.00 61.69 63.34 3fkn s THR 180 Cb 0.22 -3.81 0.00 0.00 0.01 0.00 0.00 72.50 68.92 3fkn s THR 180 CO 0.31 0.43 0.00 0.61 -0.69 0.00 0.00 174.62 175.29 3fkn n GLY 181 N 2.61 -0.72 3.44 4.40 0.00 -1.26 -4.56 105.19 109.11 3fkn n GLY 181 Ca -0.09 -1.38 -0.43 0.00 0.00 0.00 0.00 46.02 44.12 3fkn n GLY 181 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3fkn n TYR 182 N 0.00 4.59 -4.20 1.61 9.36 -1.06 -3.84 117.16 123.62 3fkn n TYR 182 Ca 0.00 -3.02 -0.18 0.00 3.32 0.00 0.00 57.90 58.02 3fkn n TYR 182 Cb 0.00 -2.46 -0.16 0.00 -0.63 0.00 0.00 39.34 36.10 3fkn n TYR 182 CO 0.00 0.00 0.00 0.14 0.22 0.00 0.00 176.86 177.22 3fkn s VAL 183 N 3.10 0.53 -0.01 2.97 -7.23 -1.26 -5.01 120.40 113.49 3fkn s VAL 183 Ca 0.49 -0.19 0.29 0.00 -1.81 0.00 0.00 61.98 60.76 3fkn s VAL 183 Cb 0.03 -0.50 0.30 0.00 0.56 0.00 0.00 36.38 36.76 3fkn s VAL 183 CO 0.04 0.19 1.88 0.00 -0.31 0.00 0.00 175.10 176.90 3fkn h ALA 184 N 6.63 1.00 0.00 1.32 0.00 -1.93 -2.04 119.26 124.24 3fkn h ALA 184 Ca -0.35 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.56 3fkn h ALA 184 Cb 1.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.96 3fkn h ALA 184 CO 0.49 0.00 0.00 1.79 0.00 0.00 0.00 179.25 181.53 3fkn h THR 185 N 0.00 0.00 0.00 0.00 1.35 -1.95 -3.20 112.91 109.11 3fkn h THR 185 Ca 0.00 -0.26 0.00 0.00 -0.55 0.00 0.00 66.41 65.60 3fkn h THR 185 Cb 0.12 1.07 0.00 0.00 -1.73 0.00 0.00 68.15 67.60 3fkn h THR 185 CO 0.00 0.00 -1.13 -1.14 -0.25 0.00 0.00 175.52 173.00 3fkn n ARG 186 N -2.58 0.28 0.30 4.72 0.63 -0.77 -4.79 116.66 114.44 3fkn n ARG 186 Ca 0.01 -0.03 0.16 0.00 -0.92 0.00 0.00 57.85 57.07 3fkn n ARG 186 Cb 0.21 -1.07 0.92 0.00 0.45 0.00 0.00 32.46 32.97 3fkn n ARG 186 CO 0.00 0.00 0.00 -1.49 -2.51 0.00 0.00 177.63 173.63 3fkn h TRP 187 N 0.00 0.00 -0.26 -0.14 6.55 -1.53 -2.28 115.95 118.29 3fkn h TRP 187 Ca 0.00 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.84 3fkn h TRP 187 Cb 0.16 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.46 3fkn h TRP 187 CO 0.00 0.03 0.00 0.66 -1.05 0.00 0.00 178.44 178.08 3fkn n TYR 188 N -3.65 0.34 -2.81 0.49 4.02 -1.26 -4.54 117.16 109.74 3fkn n TYR 188 Ca -0.03 -0.22 -0.41 0.00 -0.01 0.00 0.00 57.90 57.23 3fkn n TYR 188 Cb 0.12 -0.01 -0.05 0.00 -0.02 0.00 0.00 39.34 39.39 3fkn n TYR 188 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 3fkn s ARG 189 N -1.27 4.66 0.43 -0.72 1.81 -0.86 -3.73 118.95 119.27 3fkn s ARG 189 Ca 0.28 1.34 -0.26 0.00 -1.72 0.00 0.00 55.73 55.37 3fkn s ARG 189 Cb 0.17 -3.35 -0.09 0.00 -0.45 0.00 0.00 34.95 31.23 3fkn s ARG 189 CO 0.24 0.30 1.40 0.00 -0.68 0.00 0.00 175.30 176.56 3fkn n ALA 190 N 2.53 1.91 0.01 2.13 0.00 -1.26 -4.80 120.51 121.02 3fkn n ALA 190 Ca -0.00 0.27 0.11 0.00 0.00 0.00 0.00 53.44 53.82 3fkn n ALA 190 Cb 0.49 -2.37 0.54 0.00 0.00 0.00 0.00 19.45 18.12 3fkn n ALA 190 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3fkn h PRO 191 N 2.36 0.29 0.00 0.00 0.13 -1.95 -1.16 132.00 131.66 3fkn h PRO 191 Ca -0.50 -0.02 -0.08 0.00 -0.87 0.00 0.00 66.00 64.53 3fkn h PRO 191 Cb 1.27 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 3fkn h PRO 191 CO 0.61 0.19 -0.40 1.05 -0.23 0.00 0.00 178.00 179.22 3fkn h GLU 192 N 0.30 0.00 0.16 0.86 9.09 -1.91 -1.66 114.58 121.42 3fkn h GLU 192 Ca 0.20 0.00 -0.35 0.00 0.05 0.00 0.00 59.36 59.26 3fkn h GLU 192 Cb 0.42 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.52 3fkn h GLU 192 CO -0.04 0.40 -1.81 0.97 0.05 0.00 0.00 179.01 178.58 3fkn h ILE 193 N 0.00 0.84 -0.60 -1.06 2.10 -1.73 0.20 117.51 117.26 3fkn h ILE 193 Ca -0.00 -2.45 0.04 0.00 1.08 0.00 0.00 64.86 63.53 3fkn h ILE 193 Cb 0.76 2.68 -0.03 0.00 -1.09 0.00 0.00 36.82 39.13 3fkn h ILE 193 CO 0.05 0.86 0.40 -0.03 -1.08 0.00 0.00 178.15 178.35 3fkn h MET 194 N 0.07 0.66 -0.01 2.19 4.05 -1.13 -3.03 114.93 117.73 3fkn h MET 194 Ca -0.37 -0.04 0.00 0.00 -0.28 0.00 0.00 59.70 59.01 3fkn h MET 194 Cb 2.06 -0.15 0.00 0.00 -0.80 0.00 0.00 31.60 32.71 3fkn h MET 194 CO 0.14 0.44 0.00 1.28 0.23 0.00 0.00 176.91 179.00 3fkn n LEU 195 N -4.47 2.37 -4.05 3.39 4.77 -0.63 -5.02 117.00 113.36 3fkn n LEU 195 Ca 0.07 -2.98 -0.36 0.00 -0.03 0.00 0.00 56.01 52.71 3fkn n LEU 195 Cb 0.16 -0.39 -0.01 0.00 -2.33 0.00 0.00 43.42 40.84 3fkn n LEU 195 CO 0.35 0.69 -0.25 0.59 -1.33 0.00 0.00 177.39 177.44 3fkn n ASN 196 N -1.31 -2.29 0.02 -1.43 4.13 -0.91 -4.87 115.26 108.60 3fkn n ASN 196 Ca 0.15 -1.20 -0.08 0.00 1.68 0.00 0.00 54.58 55.13 3fkn n ASN 196 Cb 0.61 -2.18 0.09 0.00 -1.54 0.00 0.00 39.78 36.76 3fkn n ASN 196 CO 0.00 0.00 0.00 -0.50 0.28 0.00 0.00 177.26 177.04 3fkn h TRP 197 N -2.15 0.62 -2.08 3.10 6.55 -1.24 -3.43 115.95 117.32 3fkn h TRP 197 Ca -0.68 -0.20 0.21 0.00 0.95 0.00 0.00 58.89 59.17 3fkn h TRP 197 Cb 1.39 -0.12 -0.10 0.00 -0.86 0.00 0.00 29.16 29.47 3fkn h TRP 197 CO 0.42 0.90 0.58 0.00 -1.05 0.00 0.00 178.44 179.30 3fkn s MET 198 N -4.06 0.92 -0.04 0.49 0.23 -1.26 -1.86 119.30 113.72 3fkn s MET 198 Ca -0.07 -0.49 -0.30 0.00 -1.03 0.00 0.00 55.69 53.80 3fkn s MET 198 Cb 0.12 0.33 -0.07 0.00 -1.53 0.00 0.00 34.83 33.68 3fkn s MET 198 CO 0.83 -0.42 1.83 -1.01 -2.03 0.00 0.00 175.02 174.21 3fkn s HIS 199 N -3.02 1.63 0.41 3.16 3.76 -1.26 -4.88 115.29 115.09 3fkn s HIS 199 Ca 0.12 -0.04 0.00 0.00 -0.15 0.00 0.00 55.06 55.00 3fkn s HIS 199 Cb 0.00 -4.07 -0.02 0.00 1.11 0.00 0.00 32.58 29.61 3fkn s HIS 199 CO -0.01 -4.54 0.62 1.52 -0.85 0.00 0.00 174.74 171.49 3fkn s TYR 200 N 4.63 3.33 0.00 1.40 -0.85 -1.26 -5.12 117.35 119.48 3fkn s TYR 200 Ca 0.82 0.27 0.00 0.00 -0.52 0.00 0.00 57.07 57.64 3fkn s TYR 200 Cb -0.37 -2.15 0.00 0.00 0.38 0.00 0.00 41.96 39.82 3fkn s TYR 200 CO 0.35 -0.17 0.00 0.27 -1.52 0.00 0.00 175.55 174.48 3fkn n ASN 201 N -1.96 1.09 0.04 -0.18 0.23 -1.26 -5.05 115.26 108.17 3fkn n ASN 201 Ca -0.01 -0.79 0.16 0.00 -0.53 0.00 0.00 54.58 53.41 3fkn n ASN 201 Cb 0.57 0.00 0.64 0.00 -2.08 0.00 0.00 39.78 38.91 3fkn n ASN 201 CO 0.00 0.00 0.00 1.56 -0.93 0.00 0.00 177.26 177.89 3fkn h GLN 202 N 0.00 0.08 0.00 -3.83 4.20 -1.98 -2.37 115.11 111.20 3fkn h GLN 202 Ca 0.00 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3fkn h GLN 202 Cb 0.00 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.76 3fkn h GLN 202 CO 0.00 0.05 0.00 0.25 -0.67 0.00 0.00 178.83 178.46 3fkn n THR 203 N -4.43 1.34 -0.24 -0.54 -2.24 -1.26 -1.60 114.28 105.30 3fkn n THR 203 Ca 0.07 0.34 0.05 0.00 -2.27 0.00 0.00 64.05 62.24 3fkn n THR 203 Cb 0.45 -1.18 0.29 0.00 -2.10 0.00 0.00 70.33 67.79 3fkn n THR 203 CO 0.00 0.00 0.00 -0.37 -0.57 0.00 0.00 175.07 174.13 3fkn h VAL 204 N 0.00 1.06 -0.12 2.28 -1.51 -1.80 -1.78 116.25 114.37 3fkn h VAL 204 Ca 0.00 -0.31 -0.08 0.00 -1.23 0.00 0.00 66.70 65.08 3fkn h VAL 204 Cb 0.16 0.07 -0.01 0.00 -2.13 0.00 0.00 31.29 29.38 3fkn h VAL 204 CO 0.00 0.17 -0.30 0.44 -1.23 0.00 0.00 177.57 176.65 3fkn h ASP 205 N 0.91 0.23 -0.43 4.19 3.32 -1.55 -2.75 116.42 120.34 3fkn h ASP 205 Ca 0.35 -0.08 -0.12 0.00 0.02 0.00 0.00 57.03 57.20 3fkn h ASP 205 Cb 0.20 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 39.67 3fkn h ASP 205 CO -0.12 0.53 -0.17 0.40 -1.72 0.00 0.00 179.24 178.16 3fkn h ILE 206 N 0.20 1.27 -0.36 0.35 1.08 -1.47 -1.56 117.51 117.02 3fkn h ILE 206 Ca 0.03 -1.31 0.06 0.00 -0.39 0.00 0.00 64.86 63.25 3fkn h ILE 206 Cb 0.64 1.09 -0.05 0.00 -3.07 0.00 0.00 36.82 35.43 3fkn h ILE 206 CO 0.05 0.45 0.04 -0.25 -0.69 0.00 0.00 178.15 177.75 3fkn h TRP 207 N 0.81 0.06 -0.49 1.37 2.91 -1.16 -1.21 115.95 118.23 3fkn h TRP 207 Ca 0.12 0.02 0.04 0.00 1.13 0.00 0.00 58.89 60.20 3fkn h TRP 207 Cb 0.72 0.03 -0.04 0.00 -0.51 0.00 0.00 29.16 29.35 3fkn h TRP 207 CO 0.04 -0.02 0.25 0.77 -1.03 0.00 0.00 178.44 178.45 3fkn h SER 208 N 0.15 0.36 -0.50 2.65 0.02 -1.27 -1.52 113.55 113.44 3fkn h SER 208 Ca 0.17 0.03 0.05 0.00 -0.84 0.00 0.00 61.79 61.20 3fkn h SER 208 Cb 0.22 -0.04 -0.05 0.00 0.14 0.00 0.00 62.40 62.67 3fkn h SER 208 CO -0.25 0.25 0.22 0.58 -1.14 0.00 0.00 176.83 176.49 3fkn h VAL 209 N 0.49 0.90 -0.58 2.27 2.07 -0.91 -0.25 116.25 120.25 3fkn h VAL 209 Ca 0.22 -0.15 0.09 0.00 0.82 0.00 0.00 66.70 67.68 3fkn h VAL 209 Cb 0.12 0.43 -0.07 0.00 -1.52 0.00 0.00 31.29 30.25 3fkn h VAL 209 CO -0.15 0.08 0.19 1.23 0.02 0.00 0.00 177.57 178.94 3fkn h GLY 210 N 0.43 0.78 0.98 2.17 0.00 -0.64 0.53 103.07 107.33 3fkn h GLY 210 Ca 0.23 -0.09 -0.02 0.00 0.00 0.00 0.00 47.33 47.45 3fkn h GLY 210 CO -0.19 -0.03 0.26 0.00 0.00 0.00 0.00 176.54 176.57 3fkn h ILE 212 N 0.74 1.27 -0.50 0.00 2.04 -0.52 -2.44 117.51 118.10 3fkn h ILE 212 Ca 0.19 -0.86 0.07 0.00 1.00 0.00 0.00 64.86 65.25 3fkn h ILE 212 Cb 0.13 1.65 -0.06 0.00 -0.74 0.00 0.00 36.82 37.80 3fkn h ILE 212 CO -0.02 0.24 0.19 -0.03 0.00 0.00 0.00 178.15 178.53 3fkn h MET 213 N -0.12 0.37 -0.62 2.37 4.05 0.18 -0.53 114.93 120.64 3fkn h MET 213 Ca 0.03 -0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.43 3fkn h MET 213 Cb 0.38 -0.08 -0.03 0.00 -0.80 0.00 0.00 31.60 31.07 3fkn h MET 213 CO 0.01 0.24 0.39 0.00 0.23 0.00 0.00 176.91 177.78 3fkn h ALA 214 N 1.33 0.78 -0.51 0.39 0.00 -1.26 -1.84 119.26 118.15 3fkn h ALA 214 Ca 0.24 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.04 3fkn h ALA 214 Cb 0.24 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 3fkn h ALA 214 CO -0.23 0.24 0.12 1.49 0.00 0.00 0.00 179.25 180.86 3fkn h GLU 215 N 0.84 0.77 -0.30 0.00 4.81 -0.88 -0.79 114.58 119.03 3fkn h GLU 215 Ca 0.22 -0.15 -0.09 0.00 -0.13 0.00 0.00 59.36 59.21 3fkn h GLU 215 Cb -0.06 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.18 3fkn h GLU 215 CO -0.05 0.70 -0.18 -0.07 -0.73 0.00 0.00 179.01 178.69 3fkn h LEU 216 N 0.75 0.53 -0.31 1.64 3.38 -0.74 0.27 115.31 120.83 3fkn h LEU 216 Ca 0.17 -0.16 -0.19 0.00 0.09 0.00 0.00 57.88 57.79 3fkn h LEU 216 Cb 0.28 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 3fkn h LEU 216 CO -0.00 0.72 -0.86 -0.07 0.09 0.00 0.00 178.44 178.32 3fkn h LEU 217 N 0.48 0.12 0.00 1.67 3.38 -0.66 -1.14 115.31 119.17 3fkn h LEU 217 Ca 0.08 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.95 3fkn h LEU 217 Cb 0.59 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.30 3fkn h LEU 217 CO 0.04 0.92 -1.43 0.35 0.09 0.00 0.00 178.44 178.40 3fkn n THR 218 N -3.60 0.00 -0.93 0.22 -2.24 -0.37 -4.62 114.28 102.75 3fkn n THR 218 Ca -0.02 -0.23 0.00 0.00 -2.27 0.00 0.00 64.05 61.53 3fkn n THR 218 Cb 0.80 0.29 0.00 0.00 -2.10 0.00 0.00 70.33 69.33 3fkn n THR 218 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3fkn n GLY 219 N 1.90 0.79 3.19 3.38 0.00 0.94 -4.36 105.19 111.03 3fkn n GLY 219 Ca -0.02 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.76 3fkn n GLY 219 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3fkn s ARG 220 N -0.07 1.33 0.16 1.61 1.81 -1.21 -4.00 118.95 118.58 3fkn s ARG 220 Ca 0.00 -0.76 -0.34 0.00 -1.72 0.00 0.00 55.73 52.91 3fkn s ARG 220 Cb 0.00 -1.36 -0.14 0.00 -0.45 0.00 0.00 34.95 33.00 3fkn s ARG 220 CO 0.00 0.36 1.48 2.41 -0.68 0.00 0.00 175.30 178.87 3fkn n THR 221 N 2.23 0.18 0.05 0.02 -1.04 -1.26 -3.96 114.28 110.50 3fkn n THR 221 Ca -0.16 -0.04 -0.13 0.00 -2.04 0.00 0.00 64.05 61.68 3fkn n THR 221 Cb 0.54 -1.35 -0.09 0.00 -1.82 0.00 0.00 70.33 67.61 3fkn n THR 221 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 3fkn h LEU 222 N 5.27 -0.11 -6.31 -4.42 5.85 -1.92 -3.38 115.31 110.28 3fkn h LEU 222 Ca -0.45 -0.31 -0.60 0.00 0.84 0.00 0.00 57.88 57.36 3fkn h LEU 222 Cb 1.28 0.03 -0.41 0.00 0.37 0.00 0.00 40.66 41.92 3fkn h LEU 222 CO 0.84 0.26 -0.67 0.49 -0.34 0.00 0.00 178.44 179.02 3fkn n PHE 223 N -4.98 2.92 -1.61 1.25 3.01 -1.26 -5.01 117.46 111.78 3fkn n PHE 223 Ca -0.09 -4.08 -0.41 0.00 1.01 0.00 0.00 57.45 53.88 3fkn n PHE 223 Cb 0.22 -0.52 -0.01 0.00 -0.01 0.00 0.00 39.48 39.16 3fkn n PHE 223 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 3fkn n PRO 224 N 1.15 3.01 -2.05 -1.08 -0.04 -1.26 -4.69 135.00 130.05 3fkn n PRO 224 Ca 0.27 -2.48 -0.41 0.00 -0.04 0.00 0.00 63.50 60.84 3fkn n PRO 224 Cb 0.42 -3.16 -0.02 0.00 -0.04 0.00 0.00 33.50 30.70 3fkn n PRO 224 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 3fkn s GLY 225 N 3.01 2.98 0.14 0.55 0.00 -1.26 -4.91 107.32 107.83 3fkn s GLY 225 Ca 0.52 1.32 0.27 0.00 0.00 0.00 0.00 44.72 46.84 3fkn s GLY 225 CO -0.08 1.98 1.82 -1.30 0.00 0.00 0.00 173.10 175.52 3fkn n THR 226 N 0.67 0.42 -3.87 0.90 -2.24 -1.26 -4.22 114.28 104.68 3fkn n THR 226 Ca 0.00 -0.17 -0.04 0.00 -2.27 0.00 0.00 64.05 61.58 3fkn n THR 226 Cb 0.41 -0.59 0.02 0.00 -2.10 0.00 0.00 70.33 68.08 3fkn n THR 226 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 3fkn s ASP 227 N -4.00 0.00 0.21 3.42 1.47 -1.25 -2.55 116.67 113.97 3fkn s ASP 227 Ca 0.11 -0.76 -0.10 0.00 1.18 0.00 0.00 52.55 52.98 3fkn s ASP 227 Cb 0.14 0.57 0.27 0.00 -0.34 0.00 0.00 42.92 43.56 3fkn s ASP 227 CO 0.56 -1.13 1.73 0.45 0.68 0.00 0.00 175.17 177.46 3fkn h HIS 228 N 2.00 0.31 -0.14 2.11 3.86 -1.87 -0.87 115.15 120.54 3fkn h HIS 228 Ca -0.28 0.03 -0.07 0.00 -1.16 0.00 0.00 60.37 58.89 3fkn h HIS 228 Cb 1.22 -0.05 -0.00 0.00 1.06 0.00 0.00 27.41 29.64 3fkn h HIS 228 CO 1.35 0.05 -0.18 0.82 0.86 0.00 0.00 177.93 180.82 3fkn h ILE 229 N 0.34 1.36 -0.47 2.45 1.08 -1.99 -1.78 117.51 118.50 3fkn h ILE 229 Ca 0.30 -1.39 0.05 0.00 -0.39 0.00 0.00 64.86 63.44 3fkn h ILE 229 Cb 0.40 1.94 -0.05 0.00 -3.07 0.00 0.00 36.82 36.04 3fkn h ILE 229 CO -0.33 0.41 0.19 -0.78 -0.69 0.00 0.00 178.15 176.94 3fkn h ASP 230 N -0.01 0.23 -0.55 1.72 -0.00 -1.92 -1.70 116.42 114.18 3fkn h ASP 230 Ca 0.02 0.04 -0.01 0.00 -0.00 0.00 0.00 57.03 57.08 3fkn h ASP 230 Cb 0.74 0.01 -0.03 0.00 -0.00 0.00 0.00 39.33 40.05 3fkn h ASP 230 CO 0.04 0.17 0.30 -0.61 -0.00 0.00 0.00 179.24 179.14 3fkn h GLN 231 N 0.38 0.77 -0.53 0.28 4.15 -1.13 -1.11 115.11 117.91 3fkn h GLN 231 Ca 0.22 -0.09 0.05 0.00 0.77 0.00 0.00 58.65 59.59 3fkn h GLN 231 Cb 0.19 -0.15 -0.05 0.00 0.21 0.00 0.00 27.48 27.68 3fkn h GLN 231 CO -0.20 0.59 0.27 1.25 -1.93 0.00 0.00 178.83 178.81 3fkn h LEU 232 N 0.74 0.38 -0.96 -2.39 5.85 -1.02 0.67 115.31 118.59 3fkn h LEU 232 Ca 0.19 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.94 3fkn h LEU 232 Cb 0.05 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 40.99 3fkn h LEU 232 CO -0.03 0.26 0.60 0.11 -0.34 0.00 0.00 178.44 179.04 3fkn h LYS 233 N 0.52 1.29 -0.59 1.25 1.57 -0.90 0.70 116.57 120.40 3fkn h LYS 233 Ca 0.24 -0.10 -0.04 0.00 -1.87 0.00 0.00 60.65 58.88 3fkn h LYS 233 Cb 0.15 -0.28 -0.03 0.00 0.08 0.00 0.00 32.23 32.16 3fkn h LYS 233 CO -0.17 0.88 0.23 -0.07 -0.57 0.00 0.00 179.45 179.76 3fkn h LEU 234 N 1.31 0.82 0.19 2.94 3.38 -0.45 -1.25 115.31 122.25 3fkn h LEU 234 Ca 0.35 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 58.13 3fkn h LEU 234 Cb -0.09 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.45 3fkn h LEU 234 CO -0.07 0.77 -0.09 0.40 0.09 0.00 0.00 178.44 179.54 3fkn h ILE 235 N 0.82 0.84 0.00 1.22 2.04 -0.24 -3.05 117.51 119.14 3fkn h ILE 235 Ca 0.20 -0.13 -0.08 0.00 1.00 0.00 0.00 64.86 65.85 3fkn h ILE 235 Cb 0.21 0.92 -0.01 0.00 -0.74 0.00 0.00 36.82 37.20 3fkn h ILE 235 CO -0.02 0.03 -0.36 -0.07 0.00 0.00 0.00 178.15 177.73 3fkn h LEU 236 N -0.32 0.00 -1.04 1.44 3.38 -0.76 -1.03 115.31 116.97 3fkn h LEU 236 Ca -0.03 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 3fkn h LEU 236 Cb 0.25 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 3fkn h LEU 236 CO 0.04 0.36 0.35 -0.09 0.09 0.00 0.00 178.44 179.20 3fkn h ARG 237 N 0.00 1.03 0.07 1.13 2.43 -1.20 0.18 114.38 118.01 3fkn h ARG 237 Ca -0.00 -0.14 -0.00 0.00 -0.81 0.00 0.00 59.98 59.02 3fkn h ARG 237 Cb 0.69 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 30.05 3fkn h ARG 237 CO 0.05 0.79 -0.03 1.25 -1.51 0.00 0.00 179.97 180.51 3fkn h LEU 238 N 1.02 -0.08 -0.94 3.80 5.85 -1.21 -3.37 115.31 120.38 3fkn h LEU 238 Ca 0.25 -0.52 0.00 0.00 0.84 0.00 0.00 57.88 58.45 3fkn h LEU 238 Cb 0.10 0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.15 3fkn h LEU 238 CO -0.03 0.62 -0.40 1.33 -0.34 0.00 0.00 178.44 179.61 3fkn n VAL 239 N -4.79 0.00 0.00 1.05 0.24 -0.48 -0.66 118.33 113.69 3fkn n VAL 239 Ca -0.07 -0.24 0.00 0.00 -2.04 0.00 0.00 64.34 61.99 3fkn n VAL 239 Cb 0.29 1.07 0.00 0.00 -1.47 0.00 0.00 33.84 33.73 3fkn n VAL 239 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3fkn n GLY 240 N 1.40 -0.20 3.78 7.63 0.00 0.64 -4.22 105.19 114.21 3fkn n GLY 240 Ca 0.10 -1.62 -0.34 0.00 0.00 0.00 0.00 46.02 44.16 3fkn n GLY 240 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3fkn s THR 241 N -2.99 3.29 0.56 2.61 -4.23 -0.58 -4.66 115.64 109.63 3fkn s THR 241 Ca 0.00 0.74 -0.21 0.00 -1.18 0.00 0.00 61.69 61.04 3fkn s THR 241 Cb 0.00 -3.26 -0.04 0.00 1.34 0.00 0.00 72.50 70.53 3fkn s THR 241 CO 0.00 -0.24 1.31 -2.16 -0.54 0.00 0.00 174.62 172.99 3fkn s PRO 242 N -3.54 3.09 0.83 3.99 0.04 -1.26 -4.87 135.00 133.28 3fkn s PRO 242 Ca 0.70 2.10 -0.09 0.00 0.04 0.00 0.00 61.00 63.75 3fkn s PRO 242 Cb -0.22 -2.16 0.15 0.00 0.04 0.00 0.00 34.50 32.31 3fkn s PRO 242 CO 0.31 -1.19 1.16 0.20 0.04 0.00 0.00 177.00 177.51 3fkn s GLY 243 N -1.15 1.75 0.30 0.56 0.00 -1.26 -4.86 107.32 102.66 3fkn s GLY 243 Ca 0.73 -1.32 -0.00 0.00 0.00 0.00 0.00 44.72 44.13 3fkn s GLY 243 CO 0.43 -0.68 1.94 0.00 0.00 0.00 0.00 173.10 174.79 3fkn h ALA 244 N -1.08 1.48 0.33 3.20 0.00 -1.99 -1.32 119.26 119.89 3fkn h ALA 244 Ca -0.42 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 3fkn h ALA 244 Cb 1.26 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 3fkn h ALA 244 CO 0.43 0.44 -0.22 1.49 0.00 0.00 0.00 179.25 181.39 3fkn h GLU 245 N 1.06 -0.52 -0.66 0.00 4.81 -2.01 -1.55 114.58 115.71 3fkn h GLU 245 Ca 0.34 0.04 -0.08 0.00 -0.13 0.00 0.00 59.36 59.53 3fkn h GLU 245 Cb 0.05 0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.52 3fkn h GLU 245 CO -0.11 -0.35 0.09 1.25 -0.73 0.00 0.00 179.01 179.17 3fkn h LEU 246 N -0.54 1.06 -0.51 1.64 5.85 -1.88 -3.01 115.31 117.93 3fkn h LEU 246 Ca -0.03 -0.26 0.10 0.00 0.84 0.00 0.00 57.88 58.53 3fkn h LEU 246 Cb 0.45 -0.28 -0.09 0.00 0.37 0.00 0.00 40.66 41.11 3fkn h LEU 246 CO 0.02 1.06 -0.06 -0.07 -0.34 0.00 0.00 178.44 179.05 3fkn h LEU 247 N 1.03 -0.35 -1.05 2.25 3.38 -0.99 0.03 115.31 119.61 3fkn h LEU 247 Ca 0.20 0.14 0.19 0.00 0.09 0.00 0.00 57.88 58.49 3fkn h LEU 247 Cb 0.46 0.27 -0.10 0.00 0.09 0.00 0.00 40.66 41.38 3fkn h LEU 247 CO 0.02 -0.13 0.61 0.11 0.09 0.00 0.00 178.44 179.14 3fkn h LYS 248 N 0.05 0.73 0.00 1.13 1.57 -1.15 -1.62 116.57 117.29 3fkn h LYS 248 Ca 0.25 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.97 3fkn h LYS 248 Cb 0.39 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 32.53 3fkn h LYS 248 CO -0.48 0.48 -0.07 0.87 -0.57 0.00 0.00 179.45 179.69 3fkn h LYS 249 N 0.75 0.00 -5.91 3.15 1.57 -0.98 -3.40 116.57 111.76 3fkn h LYS 249 Ca 0.57 0.00 -0.43 0.00 -1.87 0.00 0.00 60.65 58.92 3fkn h LYS 249 Cb 0.89 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 33.16 3fkn h LYS 249 CO -0.36 0.07 1.11 0.42 -0.57 0.00 0.00 179.45 180.13 3fkn s ILE 250 N -3.48 3.43 -0.06 1.86 1.01 -0.61 -4.78 121.20 118.57 3fkn s ILE 250 Ca 0.03 -0.04 0.29 0.00 0.00 0.00 0.00 60.65 60.93 3fkn s ILE 250 Cb 0.08 -4.07 0.36 0.00 0.01 0.00 0.00 42.46 38.84 3fkn s ILE 250 CO 0.61 -1.02 1.85 0.77 0.00 0.00 0.00 174.94 177.15 3fkn h SER 251 N 13.09 0.00 -3.07 3.58 4.64 -1.59 -3.41 113.55 126.79 3fkn h SER 251 Ca -0.11 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.65 3fkn h SER 251 Cb 1.09 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.13 3fkn h SER 251 CO 1.23 0.03 1.11 -0.55 -0.87 0.00 0.00 176.83 177.78 3fkn s SER 252 N -5.90 6.20 0.27 4.97 0.15 -1.00 -4.89 113.70 113.49 3fkn s SER 252 Ca 0.03 0.73 -0.04 0.00 0.70 0.00 0.00 55.95 57.37 3fkn s SER 252 Cb 0.08 -2.54 0.35 0.00 -1.71 0.00 0.00 66.02 62.20 3fkn s SER 252 CO 0.59 -1.56 1.94 -0.08 1.20 0.00 0.00 173.24 175.33 3fkn h GLU 253 N 11.17 1.19 -0.18 5.44 4.81 -1.93 -0.46 114.58 134.63 3fkn h GLU 253 Ca -0.28 -0.08 -0.01 0.00 -0.13 0.00 0.00 59.36 58.86 3fkn h GLU 253 Cb 1.11 -0.26 -0.01 0.00 0.63 0.00 0.00 28.75 30.22 3fkn h GLU 253 CO 1.11 0.80 0.07 1.03 -0.73 0.00 0.00 179.01 181.29 3fkn h SER 254 N 1.22 0.24 -0.49 1.04 0.87 -1.95 0.18 113.55 114.66 3fkn h SER 254 Ca 0.33 -0.16 -0.03 0.00 -1.23 0.00 0.00 61.79 60.69 3fkn h SER 254 Cb -0.11 -0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 61.76 3fkn h SER 254 CO -0.07 0.34 0.17 0.00 -0.53 0.00 0.00 176.83 176.74 3fkn h ALA 255 N 0.91 0.64 -0.42 6.23 0.00 -1.86 -1.96 119.26 122.80 3fkn h ALA 255 Ca 0.06 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 3fkn h ALA 255 Cb 0.17 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 3fkn h ALA 255 CO -0.00 0.28 0.24 -0.09 0.00 0.00 0.00 179.25 179.67 3fkn h ARG 256 N 0.65 0.57 -0.78 0.00 2.43 -0.98 -0.64 114.38 115.64 3fkn h ARG 256 Ca 0.16 -0.06 0.02 0.00 -0.81 0.00 0.00 59.98 59.29 3fkn h ARG 256 Cb 0.24 -0.12 -0.04 0.00 -0.42 0.00 0.00 29.97 29.64 3fkn h ARG 256 CO -0.01 0.44 0.51 -0.97 -1.51 0.00 0.00 179.97 178.44 3fkn h ASN 257 N 0.55 0.87 -0.36 -3.80 -0.73 -0.88 -2.33 115.58 108.90 3fkn h ASN 257 Ca 0.15 -0.02 -0.05 0.00 1.87 0.00 0.00 56.30 58.25 3fkn h ASN 257 Cb 0.03 -0.21 -0.01 0.00 0.27 0.00 0.00 38.32 38.39 3fkn h ASN 257 CO -0.03 0.62 0.03 0.22 -0.37 0.00 0.00 177.43 177.91 3fkn h TYR 258 N 1.03 0.65 -0.80 0.67 3.20 -1.01 -3.09 116.97 117.63 3fkn h TYR 258 Ca 0.30 -0.10 0.14 0.00 3.14 0.00 0.00 58.73 62.20 3fkn h TYR 258 Cb -0.08 -0.17 -0.09 0.00 1.54 0.00 0.00 36.73 37.92 3fkn h TYR 258 CO -0.02 0.69 0.38 0.82 -1.64 0.00 0.00 178.16 178.38 3fkn h ILE 259 N 0.43 0.71 0.00 1.81 1.08 -0.86 -1.73 117.51 118.96 3fkn h ILE 259 Ca 0.10 -0.19 0.00 0.00 -0.39 0.00 0.00 64.86 64.38 3fkn h ILE 259 Cb 0.41 0.11 0.00 0.00 -3.07 0.00 0.00 36.82 34.27 3fkn h ILE 259 CO 0.01 0.10 0.00 0.00 -0.69 0.00 0.00 178.15 177.57 3fkn n GLN 260 N -4.92 0.19 0.07 2.37 6.02 -0.90 -2.53 117.38 117.67 3fkn n GLN 260 Ca 0.15 0.35 0.12 0.00 -0.01 0.00 0.00 57.00 57.61 3fkn n GLN 260 Cb 0.41 -1.81 0.47 0.00 1.02 0.00 0.00 30.24 30.33 3fkn n GLN 260 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 3fkn n SER 261 N -2.16 0.46 -4.79 1.08 3.41 -0.65 -4.83 113.62 106.14 3fkn n SER 261 Ca 0.03 0.56 -0.39 0.00 -0.26 0.00 0.00 58.87 58.81 3fkn n SER 261 Cb 0.28 -0.68 -0.06 0.00 -0.26 0.00 0.00 64.21 63.49 3fkn n SER 261 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3fkn s LEU 262 N -3.90 4.56 0.22 1.04 1.43 -1.05 -5.02 118.68 115.95 3fkn s LEU 262 Ca 0.10 1.54 -0.31 0.00 -1.03 0.00 0.00 54.13 54.43 3fkn s LEU 262 Cb 0.13 -3.24 -0.11 0.00 0.03 0.00 0.00 46.19 43.01 3fkn s LEU 262 CO 0.50 0.21 1.61 -0.89 0.23 0.00 0.00 176.35 178.01 3fkn s THR 263 N -1.18 2.30 0.36 5.49 2.01 -1.26 -4.93 115.64 118.43 3fkn s THR 263 Ca 0.35 0.22 -0.28 0.00 0.31 0.00 0.00 61.69 62.29 3fkn s THR 263 Cb -0.22 -3.14 -0.10 0.00 0.01 0.00 0.00 72.50 69.05 3fkn s THR 263 CO 0.24 0.02 1.35 -1.10 -0.69 0.00 0.00 174.62 174.44 3fkn s GLN 264 N 0.59 4.21 -0.01 4.92 -0.21 -1.26 -4.94 119.66 122.95 3fkn s GLN 264 Ca 0.69 2.29 0.03 0.00 0.02 0.00 0.00 55.36 58.38 3fkn s GLN 264 Cb -0.46 -2.97 -0.00 0.00 1.00 0.00 0.00 33.01 30.57 3fkn s GLN 264 CO 0.37 -0.34 -0.08 -1.64 -2.12 0.00 0.00 175.29 171.47 3fkn s MET 265 N -1.97 0.74 0.52 2.91 -1.94 -1.26 -4.98 119.30 113.31 3fkn s MET 265 Ca 0.52 -0.29 -0.15 0.00 -1.71 0.00 0.00 55.69 54.05 3fkn s MET 265 Cb -0.41 -0.71 -0.07 0.00 2.01 0.00 0.00 34.83 35.65 3fkn s MET 265 CO 0.54 0.16 0.97 -1.25 -0.01 0.00 0.00 175.02 175.43 3fkn s PRO 266 N -0.09 3.87 0.28 2.03 0.04 -1.26 -1.52 135.00 138.35 3fkn s PRO 266 Ca 0.02 0.86 -0.30 0.00 0.04 0.00 0.00 61.00 61.61 3fkn s PRO 266 Cb -0.05 -2.16 -0.12 0.00 0.04 0.00 0.00 34.50 32.22 3fkn s PRO 266 CO -0.00 -0.29 1.57 1.17 0.04 0.00 0.00 177.00 179.49 3fkn n LYS 267 N -1.75 2.58 -1.70 4.56 4.81 -1.26 -4.14 118.16 121.27 3fkn n LYS 267 Ca 0.06 0.92 -0.30 0.00 -0.87 0.00 0.00 58.31 58.12 3fkn n LYS 267 Cb 0.54 -2.68 0.06 0.00 0.02 0.00 0.00 35.03 32.97 3fkn n LYS 267 CO 0.00 0.00 0.00 -1.64 1.17 0.00 0.00 177.40 176.93 3fkn s MET 268 N -0.39 2.61 -0.41 1.64 -1.94 0.16 -4.91 119.30 116.06 3fkn s MET 268 Ca 0.65 0.64 -0.27 0.00 -1.71 0.00 0.00 55.69 55.00 3fkn s MET 268 Cb -0.53 -1.98 0.02 0.00 2.01 0.00 0.00 34.83 34.36 3fkn s MET 268 CO 0.48 -1.25 1.02 1.21 -0.01 0.00 0.00 175.02 176.47 3fkn s ASN 269 N -4.07 6.68 0.44 3.03 3.84 -1.26 -4.93 114.94 118.67 3fkn s ASN 269 Ca 0.59 0.56 0.13 0.00 0.21 0.00 0.00 52.86 54.35 3fkn s ASN 269 Cb -0.13 -2.50 0.96 0.00 -0.55 0.00 0.00 41.25 39.03 3fkn s ASN 269 CO 0.53 -1.02 1.99 -0.26 -2.79 0.00 0.00 177.10 175.55 3fkn h PHE 270 N 8.73 0.07 0.00 0.43 -1.00 -1.95 -1.45 116.94 121.77 3fkn h PHE 270 Ca -0.23 -0.01 -0.05 0.00 2.81 0.00 0.00 57.97 60.49 3fkn h PHE 270 Cb 1.07 -0.02 -0.01 0.00 3.61 0.00 0.00 35.95 40.60 3fkn h PHE 270 CO 0.88 0.22 -0.25 0.00 -1.61 0.00 0.00 178.31 177.55 3fkn h ALA 271 N 1.79 1.52 0.00 2.45 0.00 -1.92 0.42 119.26 123.52 3fkn h ALA 271 Ca 0.01 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 3fkn h ALA 271 Cb 0.30 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 3fkn h ALA 271 CO 0.02 0.32 -0.34 -0.91 0.00 0.00 0.00 179.25 178.34 3fkn h ASN 272 N 0.00 0.00 0.13 0.00 -0.26 -1.70 -3.30 115.58 110.44 3fkn h ASN 272 Ca -0.00 0.00 -0.23 0.00 -0.56 0.00 0.00 56.30 55.51 3fkn h ASN 272 Cb 0.47 0.00 0.01 0.00 -1.06 0.00 0.00 38.32 37.74 3fkn h ASN 272 CO 0.03 0.03 -1.08 0.58 -1.06 0.00 0.00 177.43 175.93 3fkn h VAL 273 N 0.00 1.31 -2.52 2.81 2.07 -0.61 -3.39 116.25 115.92 3fkn h VAL 273 Ca -0.00 -2.49 -0.72 0.00 0.82 0.00 0.00 66.70 64.31 3fkn h VAL 273 Cb 1.02 3.00 -0.34 0.00 -1.52 0.00 0.00 31.29 33.45 3fkn h VAL 273 CO 0.00 0.71 0.26 0.49 0.02 0.00 0.00 177.57 179.06 3fkn n PHE 274 N -4.04 2.94 -1.68 1.57 3.01 0.14 -5.04 117.46 114.36 3fkn n PHE 274 Ca -0.19 -3.19 -0.45 0.00 1.01 0.00 0.00 57.45 54.63 3fkn n PHE 274 Cb 0.86 -0.95 -0.04 0.00 -0.01 0.00 0.00 39.48 39.34 3fkn n PHE 274 CO 0.00 0.00 0.00 -0.89 1.01 0.00 0.00 176.76 176.88 3fkn n ILE 275 N 0.77 0.22 -0.03 4.37 5.41 -1.24 -2.17 119.36 126.69 3fkn n ILE 275 Ca 0.31 -0.04 0.00 0.00 1.00 0.00 0.00 62.75 64.02 3fkn n ILE 275 Cb 0.35 -1.78 0.00 0.00 -0.71 0.00 0.00 39.64 37.50 3fkn n ILE 275 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3fkn n GLY 276 N 3.87 1.61 3.78 7.39 0.00 -1.26 -5.03 105.19 115.54 3fkn n GLY 276 Ca 0.18 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.84 3fkn n GLY 276 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fkn s ALA 277 N -2.58 3.06 -0.23 4.61 0.00 -0.92 -4.95 121.76 120.75 3fkn s ALA 277 Ca 0.00 0.72 -0.40 0.00 0.00 0.00 0.00 51.96 52.27 3fkn s ALA 277 Cb 0.00 -3.28 -0.17 0.00 0.00 0.00 0.00 23.12 19.67 3fkn s ALA 277 CO 0.00 -0.26 1.62 -1.71 0.00 0.00 0.00 175.76 175.41 3fkn n ASN 278 N -0.18 1.97 0.15 0.00 2.85 -1.26 -4.84 115.26 113.96 3fkn n ASN 278 Ca 0.06 1.10 0.17 0.00 -0.11 0.00 0.00 54.58 55.80 3fkn n ASN 278 Cb 0.50 -1.10 0.77 0.00 1.24 0.00 0.00 39.78 41.18 3fkn n ASN 278 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 3fkn h PRO 279 N 6.22 0.00 -0.11 1.20 0.11 -1.97 0.15 132.00 137.60 3fkn h PRO 279 Ca -0.47 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 65.51 3fkn h PRO 279 Cb 1.33 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.43 3fkn h PRO 279 CO 0.91 0.00 -0.54 -0.07 -0.21 0.00 0.00 178.00 178.09 3fkn h LEU 280 N 0.00 0.35 -0.39 2.35 3.38 -1.99 -1.74 115.31 117.27 3fkn h LEU 280 Ca 0.13 -0.18 -0.11 0.00 0.09 0.00 0.00 57.88 57.81 3fkn h LEU 280 Cb 0.62 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 3fkn h LEU 280 CO -0.00 0.82 -0.18 0.00 0.09 0.00 0.00 178.44 179.17 3fkn h ALA 281 N 1.18 0.55 -0.26 1.53 0.00 -1.09 -2.09 119.26 119.08 3fkn h ALA 281 Ca 0.00 -0.36 0.01 0.00 0.00 0.00 0.00 54.91 54.56 3fkn h ALA 281 Cb 1.03 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.67 3fkn h ALA 281 CO 0.09 0.50 0.15 0.28 0.00 0.00 0.00 179.25 180.26 3fkn h VAL 282 N 0.62 1.03 -0.16 0.00 2.07 -1.27 -1.07 116.25 117.48 3fkn h VAL 282 Ca 0.09 -0.11 0.02 0.00 0.82 0.00 0.00 66.70 67.52 3fkn h VAL 282 Cb 0.74 0.69 -0.02 0.00 -1.52 0.00 0.00 31.29 31.18 3fkn h VAL 282 CO 0.06 0.06 0.03 -0.78 0.02 0.00 0.00 177.57 176.96 3fkn h ASP 283 N 0.31 0.01 -0.24 0.57 3.58 -1.25 -0.82 116.42 118.58 3fkn h ASP 283 Ca 0.10 0.02 -0.00 0.00 0.42 0.00 0.00 57.03 57.57 3fkn h ASP 283 Cb -0.01 0.03 -0.01 0.00 1.72 0.00 0.00 39.33 41.06 3fkn h ASP 283 CO -0.04 0.03 0.14 0.25 -2.88 0.00 0.00 179.24 176.74 3fkn h LEU 284 N 0.10 0.30 -0.71 2.28 5.85 -1.24 -2.06 115.31 119.83 3fkn h LEU 284 Ca 0.07 -0.06 0.12 0.00 0.84 0.00 0.00 57.88 58.85 3fkn h LEU 284 Cb 0.06 -0.08 -0.09 0.00 0.37 0.00 0.00 40.66 40.93 3fkn h LEU 284 CO -0.09 0.28 0.28 -0.07 -0.34 0.00 0.00 178.44 178.50 3fkn h LEU 285 N 0.30 0.28 -1.57 2.25 3.38 -0.95 0.10 115.31 119.10 3fkn h LEU 285 Ca 0.09 0.10 0.05 0.00 0.09 0.00 0.00 57.88 58.20 3fkn h LEU 285 Cb 0.04 0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.82 3fkn h LEU 285 CO -0.02 0.13 0.36 -0.33 0.09 0.00 0.00 178.44 178.68 3fkn h GLU 286 N 0.45 0.53 0.00 1.13 5.08 -0.70 0.43 114.58 121.50 3fkn h GLU 286 Ca 0.38 -0.03 -0.08 0.00 -1.00 0.00 0.00 59.36 58.62 3fkn h GLU 286 Cb 0.53 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 3fkn h GLU 286 CO -0.36 0.35 -0.78 0.87 -1.00 0.00 0.00 179.01 178.08 3fkn h LYS 287 N 0.54 0.00 0.19 2.33 1.57 -0.29 -3.33 116.57 117.58 3fkn h LYS 287 Ca 0.23 0.00 -0.34 0.00 -1.87 0.00 0.00 60.65 58.67 3fkn h LYS 287 Cb 0.22 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.55 3fkn h LYS 287 CO -0.06 0.26 -1.64 0.52 -0.57 0.00 0.00 179.45 177.96 3fkn h MET 288 N 0.00 0.40 -2.24 3.15 2.86 -0.47 -2.11 114.93 116.53 3fkn h MET 288 Ca -0.05 -0.69 -0.71 0.00 -2.06 0.00 0.00 59.70 56.20 3fkn h MET 288 Cb 1.30 0.26 -0.21 0.00 0.06 0.00 0.00 31.60 33.01 3fkn h MET 288 CO 0.04 1.31 1.27 1.28 1.06 0.00 0.00 176.91 181.87 3fkn n LEU 289 N -3.59 7.38 -4.76 1.22 4.77 0.11 -4.31 117.00 117.81 3fkn n LEU 289 Ca -0.21 -4.81 -0.37 0.00 -0.03 0.00 0.00 56.01 50.60 3fkn n LEU 289 Cb 1.08 -1.22 -0.07 0.00 -2.33 0.00 0.00 43.42 40.88 3fkn n LEU 289 CO 0.54 1.91 -0.03 -0.69 -1.33 0.00 0.00 177.39 177.79 3fkn s VAL 290 N -3.10 5.30 0.11 4.08 1.01 -1.26 -4.90 120.40 121.65 3fkn s VAL 290 Ca 0.51 0.53 -0.17 0.00 0.00 0.00 0.00 61.98 62.84 3fkn s VAL 290 Cb 0.29 -3.61 -0.04 0.00 0.00 0.00 0.00 36.38 33.02 3fkn s VAL 290 CO -0.21 0.44 1.65 0.25 0.00 0.00 0.00 175.10 177.23 3fkn h LEU 291 N 6.27 0.45 -8.76 3.92 5.85 -1.91 -3.39 115.31 117.74 3fkn h LEU 291 Ca -0.44 -0.18 -0.56 0.00 0.84 0.00 0.00 57.88 57.54 3fkn h LEU 291 Cb 1.18 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 42.04 3fkn h LEU 291 CO 0.72 0.51 1.11 -0.62 -0.34 0.00 0.00 178.44 179.83 3fkn s ASP 292 N -5.78 6.21 0.52 1.25 3.68 -1.26 -4.89 116.67 116.39 3fkn s ASP 292 Ca -0.13 0.79 0.17 0.00 2.13 0.00 0.00 52.55 55.51 3fkn s ASP 292 Cb 0.09 -2.54 1.27 0.00 -1.45 0.00 0.00 42.92 40.29 3fkn s ASP 292 CO 0.74 -1.54 2.12 0.77 0.13 0.00 0.00 175.17 177.39 3fkn h SER 293 N 11.20 0.02 -0.09 -0.34 4.64 -1.97 -0.61 113.55 126.39 3fkn h SER 293 Ca -0.28 -0.00 0.03 0.00 -0.47 0.00 0.00 61.79 61.06 3fkn h SER 293 Cb 1.11 -0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 63.19 3fkn h SER 293 CO 1.10 0.02 0.14 0.44 -0.87 0.00 0.00 176.83 177.65 3fkn h ASP 294 N 0.03 0.00 -0.01 4.97 3.45 -1.94 -2.98 116.42 119.94 3fkn h ASP 294 Ca 0.04 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.50 3fkn h ASP 294 Cb 0.14 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.91 3fkn h ASP 294 CO -0.00 0.00 -0.30 0.29 -1.57 0.00 0.00 179.24 177.65 3fkn n LYS 295 N -3.55 2.02 -2.02 3.56 5.02 -0.24 -4.98 118.16 117.96 3fkn n LYS 295 Ca -0.01 -0.62 -0.37 0.00 -2.02 0.00 0.00 58.31 55.30 3fkn n LYS 295 Cb 0.24 -1.16 0.02 0.00 -0.02 0.00 0.00 35.03 34.11 3fkn n LYS 295 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 3fkn s ARG 296 N -1.68 3.33 0.47 1.97 0.52 -1.13 -4.98 118.95 117.46 3fkn s ARG 296 Ca 0.10 1.96 -0.24 0.00 -0.52 0.00 0.00 55.73 57.03 3fkn s ARG 296 Cb 0.10 -2.23 -0.07 0.00 0.52 0.00 0.00 34.95 33.27 3fkn s ARG 296 CO 0.35 -0.96 1.31 -1.50 0.02 0.00 0.00 175.30 174.52 3fkn s ILE 297 N -1.46 2.46 0.56 1.52 2.07 -0.79 -5.04 121.20 120.52 3fkn s ILE 297 Ca 0.70 0.38 -0.03 0.00 -1.41 0.00 0.00 60.65 60.29 3fkn s ILE 297 Cb -0.34 -3.21 0.02 0.00 0.13 0.00 0.00 42.46 39.07 3fkn s ILE 297 CO 0.39 0.02 0.83 0.42 -1.91 0.00 0.00 174.94 174.70 3fkn s THR 298 N -1.33 3.32 0.13 4.00 -4.23 -1.26 -4.91 115.64 111.37 3fkn s THR 298 Ca 0.64 -0.31 -0.18 0.00 -1.18 0.00 0.00 61.69 60.65 3fkn s THR 298 Cb -0.38 -3.29 -0.04 0.00 1.34 0.00 0.00 72.50 70.14 3fkn s THR 298 CO 0.47 -0.26 1.78 0.00 -0.54 0.00 0.00 174.62 176.07 3fkn h ALA 299 N -0.04 0.34 -0.82 3.99 0.00 -1.93 0.77 119.26 121.56 3fkn h ALA 299 Ca -0.45 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3fkn h ALA 299 Cb 1.27 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.94 3fkn h ALA 299 CO 0.58 -0.22 0.53 0.00 0.00 0.00 0.00 179.25 180.14 3fkn h ALA 300 N 1.12 1.04 -0.39 0.00 0.00 -1.93 -1.61 119.26 117.49 3fkn h ALA 300 Ca 0.10 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 3fkn h ALA 300 Cb -0.01 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.44 3fkn h ALA 300 CO -0.05 0.47 -0.04 1.96 0.00 0.00 0.00 179.25 181.59 3fkn h GLN 301 N 1.12 0.71 -0.68 0.00 4.20 -1.88 -3.21 115.11 115.35 3fkn h GLN 301 Ca 0.30 -0.25 -0.02 0.00 0.06 0.00 0.00 58.65 58.74 3fkn h GLN 301 Cb -0.11 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 27.59 3fkn h GLN 301 CO -0.06 0.83 0.35 0.00 -0.67 0.00 0.00 178.83 179.27 3fkn h ALA 302 N 0.86 1.32 -0.21 3.87 0.00 -0.47 -2.17 119.26 122.46 3fkn h ALA 302 Ca 0.10 -0.12 0.04 0.00 0.00 0.00 0.00 54.91 54.94 3fkn h ALA 302 Cb 0.53 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 3fkn h ALA 302 CO 0.03 0.54 0.15 -0.07 0.00 0.00 0.00 179.25 179.89 3fkn h LEU 303 N 0.96 0.07 -0.71 0.00 3.38 -1.31 -1.34 115.31 116.36 3fkn h LEU 303 Ca 0.24 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.21 3fkn h LEU 303 Cb 0.07 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.80 3fkn h LEU 303 CO -0.03 0.05 -0.02 0.00 0.09 0.00 0.00 178.44 178.52 3fkn n ALA 304 N -2.56 2.64 -1.81 1.53 0.00 -0.82 -4.71 120.51 114.78 3fkn n ALA 304 Ca 0.02 -0.39 -0.41 0.00 0.00 0.00 0.00 53.44 52.66 3fkn n ALA 304 Cb 0.23 -1.24 -0.03 0.00 0.00 0.00 0.00 19.45 18.41 3fkn n ALA 304 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 3fkn s HIS 305 N -2.06 3.32 0.59 0.00 5.04 -0.51 -4.91 115.29 116.76 3fkn s HIS 305 Ca 0.39 1.51 0.29 0.00 -1.54 0.00 0.00 55.06 55.70 3fkn s HIS 305 Cb 0.21 -3.49 1.39 0.00 0.04 0.00 0.00 32.58 30.73 3fkn s HIS 305 CO 0.36 -1.28 1.79 0.00 -2.34 0.00 0.00 174.74 173.27 3fkn h ALA 306 N 3.93 2.34 -0.06 1.58 0.00 -1.90 -0.68 119.26 124.46 3fkn h ALA 306 Ca -0.47 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.44 3fkn h ALA 306 Cb 1.22 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.05 3fkn h ALA 306 CO 0.68 -0.92 0.06 -0.92 0.00 0.00 0.00 179.25 178.16 3fkn h TYR 307 N 0.00 0.00 -0.41 0.00 3.20 -1.91 -2.00 116.97 115.85 3fkn h TYR 307 Ca 0.27 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 62.14 3fkn h TYR 307 Cb 1.51 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 39.78 3fkn h TYR 307 CO 0.00 0.00 0.00 1.19 -1.64 0.00 0.00 178.16 177.71 3fkn n PHE 308 N -3.98 1.50 -0.31 -3.82 3.01 -0.26 -4.75 117.46 108.85 3fkn n PHE 308 Ca -0.01 -0.82 0.13 0.00 1.01 0.00 0.00 57.45 57.75 3fkn n PHE 308 Cb 0.16 -0.41 0.30 0.00 -0.01 0.00 0.00 39.48 39.52 3fkn n PHE 308 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3fkn h ALA 309 N 2.84 1.48 0.00 4.37 0.00 -1.49 0.23 119.26 126.69 3fkn h ALA 309 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3fkn h ALA 309 Cb 1.71 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.57 3fkn h ALA 309 CO 0.36 -0.25 0.00 0.00 0.00 0.00 0.00 179.25 179.36 3fkn n GLN 310 N -4.96 0.10 -0.02 0.00 10.64 -1.26 -3.82 117.38 118.07 3fkn n GLN 310 Ca 0.22 0.08 -0.02 0.00 -1.83 0.00 0.00 57.00 55.45 3fkn n GLN 310 Cb 0.61 -1.50 -0.03 0.00 -0.86 0.00 0.00 30.24 28.47 3fkn n GLN 310 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 3fkn n TYR 311 N -1.44 0.00 -1.71 2.61 4.02 -0.20 -5.05 117.16 115.39 3fkn n TYR 311 Ca 0.07 0.00 -0.43 0.00 -0.01 0.00 0.00 57.90 57.53 3fkn n TYR 311 Cb 0.26 -0.18 -0.03 0.00 -0.02 0.00 0.00 39.34 39.37 3fkn n TYR 311 CO 0.00 0.00 0.00 1.58 -1.01 0.00 0.00 176.86 177.43 3fkn n HIS 312 N -2.23 2.64 -3.45 -0.72 -0.00 0.64 -4.99 115.22 107.12 3fkn n HIS 312 Ca -0.06 0.09 -0.18 0.00 0.46 0.00 0.00 57.72 58.03 3fkn n HIS 312 Cb 0.61 -2.64 -0.11 0.00 -0.12 0.00 0.00 29.99 27.73 3fkn n HIS 312 CO 0.00 0.00 0.00 0.34 0.46 0.00 0.00 176.34 177.14 3fkn s ASP 313 N 1.11 1.49 0.59 0.26 3.68 -1.26 -4.98 116.67 117.55 3fkn s ASP 313 Ca 0.76 -0.43 0.32 0.00 2.13 0.00 0.00 52.55 55.33 3fkn s ASP 313 Cb -0.55 0.46 1.84 0.00 -1.45 0.00 0.00 42.92 43.22 3fkn s ASP 313 CO 0.34 -0.35 2.24 -0.65 0.13 0.00 0.00 175.17 176.87 3fkn h PRO 314 N 8.29 0.00 -0.01 4.34 0.11 -1.96 -0.07 132.00 142.69 3fkn h PRO 314 Ca -0.16 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.95 3fkn h PRO 314 Cb 1.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.23 3fkn h PRO 314 CO 0.31 0.02 -0.15 -0.25 -0.21 0.00 0.00 178.00 177.73 3fkn n ASP 315 N -3.68 1.17 -2.02 -2.05 10.43 -1.26 -4.04 116.55 115.09 3fkn n ASP 315 Ca -0.03 -1.11 -0.11 0.00 2.57 0.00 0.00 54.79 56.12 3fkn n ASP 315 Cb 0.11 0.07 0.05 0.00 1.84 0.00 0.00 41.12 43.20 3fkn n ASP 315 CO 0.00 0.00 0.00 -0.67 -1.07 0.00 0.00 177.20 175.46 3fkn n ASP 316 N -0.35 3.18 -3.25 -2.24 2.03 -0.05 -4.85 116.55 111.01 3fkn n ASP 316 Ca 0.15 -3.12 -0.25 0.00 0.52 0.00 0.00 54.79 52.09 3fkn n ASP 316 Cb 0.34 -0.40 -0.08 0.00 -0.72 0.00 0.00 41.12 40.27 3fkn n ASP 316 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 3fkn n GLU 317 N -0.63 0.90 -1.63 -0.67 1.02 -1.19 -4.86 120.64 113.59 3fkn n GLU 317 Ca 0.27 -3.42 -0.33 0.00 -0.02 0.00 0.00 57.16 53.66 3fkn n GLU 317 Cb 0.90 -1.41 0.06 0.00 -0.02 0.00 0.00 31.44 30.97 3fkn n GLU 317 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 3fkn s PRO 318 N -1.22 2.61 0.45 3.49 0.04 -1.26 -4.96 135.00 134.14 3fkn s PRO 318 Ca 0.35 1.40 0.08 0.00 0.04 0.00 0.00 61.00 62.87 3fkn s PRO 318 Cb 0.15 -1.92 0.02 0.00 0.04 0.00 0.00 34.50 32.79 3fkn s PRO 318 CO -0.11 -1.40 0.61 0.14 0.04 0.00 0.00 177.00 176.28 3fkn s VAL 319 N -2.39 2.88 0.21 -0.36 -7.23 -1.26 -4.19 120.40 108.06 3fkn s VAL 319 Ca 0.67 -0.97 -0.03 0.00 -1.81 0.00 0.00 61.98 59.84 3fkn s VAL 319 Cb -0.21 -2.91 -0.05 0.00 0.56 0.00 0.00 36.38 33.77 3fkn s VAL 319 CO 0.44 0.00 0.43 0.00 -0.31 0.00 0.00 175.10 175.66 3fkn s ALA 320 N -2.42 3.77 0.82 1.32 0.00 -1.25 -5.01 121.76 118.99 3fkn s ALA 320 Ca 0.56 -0.70 -0.13 0.00 0.00 0.00 0.00 51.96 51.68 3fkn s ALA 320 Cb -0.10 -2.10 0.08 0.00 0.00 0.00 0.00 23.12 21.00 3fkn s ALA 320 CO 0.34 0.44 1.08 -0.25 0.00 0.00 0.00 175.76 177.37 3fkn n ASP 321 N -0.58 0.54 -4.73 0.00 10.43 -1.26 -4.73 116.55 116.22 3fkn n ASP 321 Ca -0.03 0.55 -0.41 0.00 2.57 0.00 0.00 54.79 57.47 3fkn n ASP 321 Cb 0.53 -1.46 0.00 0.00 1.84 0.00 0.00 41.12 42.04 3fkn n ASP 321 CO 0.00 0.00 0.00 -2.65 -1.07 0.00 0.00 177.20 173.48 3fkn n PRO 322 N -3.04 2.27 -3.94 -0.24 -0.02 -1.26 -4.73 135.00 124.05 3fkn n PRO 322 Ca 0.13 0.80 -0.34 0.00 -2.02 0.00 0.00 63.50 62.06 3fkn n PRO 322 Cb 0.51 -2.51 -0.14 0.00 -0.02 0.00 0.00 33.50 31.34 3fkn n PRO 322 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 3fkn s TYR 323 N -1.15 3.25 -0.52 6.00 5.04 -1.26 -5.07 117.35 123.65 3fkn s TYR 323 Ca 0.57 -1.93 -0.28 0.00 -2.44 0.00 0.00 57.07 52.99 3fkn s TYR 323 Cb -0.50 -2.07 0.02 0.00 0.35 0.00 0.00 41.96 39.75 3fkn s TYR 323 CO 0.61 -0.81 1.33 0.34 -1.34 0.00 0.00 175.55 175.68 3fkn s ASP 324 N 1.23 6.31 -0.26 4.32 -1.08 -1.26 -4.86 116.67 121.07 3fkn s ASP 324 Ca -0.06 0.41 0.09 0.00 -0.52 0.00 0.00 52.55 52.48 3fkn s ASP 324 Cb -0.20 -2.55 0.47 0.00 -1.46 0.00 0.00 42.92 39.19 3fkn s ASP 324 CO -0.02 -1.53 1.37 0.00 0.52 0.00 0.00 175.17 175.51 3fkn n GLN 325 N 8.36 1.75 0.30 4.34 10.64 -1.26 -4.67 117.38 136.84 3fkn n GLN 325 Ca 0.13 -3.26 0.16 0.00 -1.83 0.00 0.00 57.00 52.20 3fkn n GLN 325 Cb 0.49 -1.75 0.95 0.00 -0.86 0.00 0.00 30.24 29.07 3fkn n GLN 325 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 3fkn h SER 326 N 1.02 0.00 -0.12 2.61 4.64 -2.03 -2.04 113.55 117.63 3fkn h SER 326 Ca 0.14 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 61.50 3fkn h SER 326 Cb 1.40 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.49 3fkn h SER 326 CO 0.25 0.01 0.12 2.19 -0.87 0.00 0.00 176.83 178.52 3fkn h PHE 327 N 0.00 0.00 -0.27 4.77 -5.15 -1.96 -2.69 116.94 111.64 3fkn h PHE 327 Ca -0.00 0.00 -0.03 0.00 -0.20 0.00 0.00 57.97 57.74 3fkn h PHE 327 Cb 0.02 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 36.17 3fkn h PHE 327 CO 0.00 0.00 0.05 0.93 -2.00 0.00 0.00 178.31 177.29 3fkn h GLU 328 N 0.00 0.39 -0.29 6.09 4.39 -1.75 -1.66 114.58 121.75 3fkn h GLU 328 Ca 0.06 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3fkn h GLU 328 Cb 0.29 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 28.87 3fkn h GLU 328 CO -0.00 0.38 0.00 -1.13 -1.16 0.00 0.00 179.01 177.10 3fkn n SER 329 N -4.37 2.38 -4.79 1.42 3.41 -1.02 -4.92 113.62 105.74 3fkn n SER 329 Ca 0.01 -1.85 -0.38 0.00 -0.26 0.00 0.00 58.87 56.39 3fkn n SER 329 Cb 0.18 -0.19 -0.06 0.00 -0.26 0.00 0.00 64.21 63.88 3fkn n SER 329 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 3fkn s ARG 330 N -1.63 4.10 -0.30 4.33 3.52 -0.62 -5.07 118.95 123.29 3fkn s ARG 330 Ca 0.34 0.42 -0.10 0.00 -0.13 0.00 0.00 55.73 56.26 3fkn s ARG 330 Cb 0.19 -3.31 -0.03 0.00 -1.56 0.00 0.00 34.95 30.24 3fkn s ARG 330 CO 0.27 0.48 0.17 -0.51 -0.81 0.00 0.00 175.30 174.90 3fkn s ASP 331 N -0.41 5.75 0.21 -2.12 1.01 -1.26 -5.03 116.67 114.82 3fkn s ASP 331 Ca 0.24 -0.28 0.03 0.00 0.71 0.00 0.00 52.55 53.24 3fkn s ASP 331 Cb -0.16 -2.06 -0.05 0.00 1.01 0.00 0.00 42.92 41.66 3fkn s ASP 331 CO 0.12 -0.13 0.00 -0.76 0.21 0.00 0.00 175.17 174.61 3fkn s LEU 332 N 1.69 2.11 0.64 1.23 1.43 -1.26 -5.16 118.68 119.36 3fkn s LEU 332 Ca 0.06 -1.21 -0.09 0.00 -1.03 0.00 0.00 54.13 51.86 3fkn s LEU 332 Cb -0.16 -0.15 0.00 0.00 0.03 0.00 0.00 46.19 45.91 3fkn s LEU 332 CO 0.08 -0.55 1.00 -0.76 0.23 0.00 0.00 176.35 176.35 3fkn s LEU 333 N -3.24 3.11 0.14 1.79 1.43 -1.26 -4.89 118.68 115.76 3fkn s LEU 333 Ca 0.27 1.00 -0.22 0.00 -1.03 0.00 0.00 54.13 54.14 3fkn s LEU 333 Cb 0.06 -3.84 0.02 0.00 0.03 0.00 0.00 46.19 42.45 3fkn s LEU 333 CO 0.07 -1.13 1.64 0.40 0.23 0.00 0.00 176.35 177.56 3fkn h ILE 334 N -0.38 0.46 0.00 -0.59 2.04 -1.92 -1.64 117.51 115.47 3fkn h ILE 334 Ca -0.45 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.39 3fkn h ILE 334 Cb 1.24 0.46 -0.00 0.00 -0.74 0.00 0.00 36.82 37.78 3fkn h ILE 334 CO 0.62 0.00 -0.08 0.44 0.00 0.00 0.00 178.15 179.13 3fkn h ASP 335 N -0.23 0.00 -0.07 1.72 3.45 -1.95 0.22 116.42 119.56 3fkn h ASP 335 Ca 0.12 0.00 -0.12 0.00 0.43 0.00 0.00 57.03 57.46 3fkn h ASP 335 Cb 0.42 0.00 0.01 0.00 -0.56 0.00 0.00 39.33 39.20 3fkn h ASP 335 CO -0.34 0.08 -0.44 -0.33 -1.57 0.00 0.00 179.24 176.64 3fkn h GLU 336 N 0.00 0.43 -0.87 3.56 5.08 -1.76 -0.78 114.58 120.23 3fkn h GLU 336 Ca -0.00 -0.36 -0.01 0.00 -1.00 0.00 0.00 59.36 57.98 3fkn h GLU 336 Cb 0.16 0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.45 3fkn h GLU 336 CO 0.01 1.00 0.50 -1.49 -1.00 0.00 0.00 179.01 178.03 3fkn h TRP 337 N -0.04 1.17 -0.52 4.33 -0.00 -0.90 -1.84 115.95 118.16 3fkn h TRP 337 Ca -0.04 -0.02 -0.03 0.00 -0.00 0.00 0.00 58.89 58.81 3fkn h TRP 337 Cb 1.10 -0.38 -0.02 0.00 -0.00 0.00 0.00 29.16 29.86 3fkn h TRP 337 CO 0.13 0.80 0.19 -0.22 -0.00 0.00 0.00 178.44 179.34 3fkn h LYS 338 N 1.21 0.78 -0.45 0.49 3.64 -0.91 -0.59 116.57 120.74 3fkn h LYS 338 Ca 0.31 -0.15 -0.07 0.00 -1.27 0.00 0.00 60.65 59.47 3fkn h LYS 338 Cb -0.01 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.67 3fkn h LYS 338 CO -0.05 0.70 0.01 1.03 -2.27 0.00 0.00 179.45 178.86 3fkn h SER 339 N 0.70 0.77 -0.58 4.20 0.87 -1.01 -0.32 113.55 118.18 3fkn h SER 339 Ca 0.17 -0.30 0.03 0.00 -1.23 0.00 0.00 61.79 60.46 3fkn h SER 339 Cb 0.22 -0.21 -0.04 0.00 -0.44 0.00 0.00 62.40 61.93 3fkn h SER 339 CO -0.01 0.89 0.34 -0.07 -0.53 0.00 0.00 176.83 177.45 3fkn h LEU 340 N 0.64 0.55 -0.14 2.23 3.38 -1.17 -1.09 115.31 119.70 3fkn h LEU 340 Ca 0.13 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 3fkn h LEU 340 Cb 0.49 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 3fkn h LEU 340 CO 0.02 0.38 0.07 0.74 0.09 0.00 0.00 178.44 179.74 3fkn h THR 341 N 0.67 1.12 -0.40 0.22 2.02 -0.94 -2.50 112.91 113.11 3fkn h THR 341 Ca 0.24 -0.35 0.07 0.00 0.77 0.00 0.00 66.41 67.14 3fkn h THR 341 Cb 0.05 1.10 -0.06 0.00 -1.74 0.00 0.00 68.15 67.49 3fkn h THR 341 CO -0.11 0.11 0.01 0.22 0.37 0.00 0.00 175.52 176.12 3fkn h TYR 342 N 0.10 -0.00 -0.82 3.16 3.20 -0.86 -0.49 116.97 121.26 3fkn h TYR 342 Ca 0.05 0.03 0.14 0.00 3.14 0.00 0.00 58.73 62.08 3fkn h TYR 342 Cb 0.12 0.06 -0.09 0.00 1.54 0.00 0.00 36.73 38.36 3fkn h TYR 342 CO -0.03 -0.07 0.42 -0.44 -1.64 0.00 0.00 178.16 176.40 3fkn h ASP 343 N 0.12 0.50 -0.27 -2.11 3.32 -1.11 -0.69 116.42 116.18 3fkn h ASP 343 Ca 0.19 0.09 -0.12 0.00 0.02 0.00 0.00 57.03 57.21 3fkn h ASP 343 Cb 0.27 0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.82 3fkn h ASP 343 CO -0.32 0.22 -0.26 -0.33 -1.72 0.00 0.00 179.24 176.84 3fkn h GLU 344 N 0.61 0.76 0.19 3.56 4.39 -0.72 -2.18 114.58 121.19 3fkn h GLU 344 Ca 0.44 -0.33 -0.01 0.00 0.34 0.00 0.00 59.36 59.81 3fkn h GLU 344 Cb 0.60 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.23 3fkn h GLU 344 CO -0.35 0.94 -0.09 0.28 -1.16 0.00 0.00 179.01 178.63 3fkn h VAL 345 N 0.66 0.88 -0.51 3.13 2.07 -0.54 -3.04 116.25 118.90 3fkn h VAL 345 Ca 0.08 -0.38 0.03 0.00 0.82 0.00 0.00 66.70 67.26 3fkn h VAL 345 Cb 0.78 1.11 -0.03 0.00 -1.52 0.00 0.00 31.29 31.63 3fkn h VAL 345 CO 0.06 0.09 0.34 0.40 0.02 0.00 0.00 177.57 178.48 3fkn h ILE 346 N -0.44 1.06 -0.06 4.57 1.08 -1.11 -2.65 117.51 119.96 3fkn h ILE 346 Ca -0.03 -0.20 0.00 0.00 -0.39 0.00 0.00 64.86 64.24 3fkn h ILE 346 Cb 0.34 0.42 0.00 0.00 -3.07 0.00 0.00 36.82 34.51 3fkn h ILE 346 CO 0.04 0.11 0.00 -1.54 -0.69 0.00 0.00 178.15 176.07 3fkn n SER 347 N -4.47 1.95 -4.73 1.72 3.41 -0.83 -4.95 113.62 105.73 3fkn n SER 347 Ca 0.06 -1.67 -0.42 0.00 -0.26 0.00 0.00 58.87 56.58 3fkn n SER 347 Cb 0.14 -0.03 -0.02 0.00 -0.26 0.00 0.00 64.21 64.03 3fkn n SER 347 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 3fkn n PHE 348 N 0.52 2.81 -4.15 7.33 7.35 -1.00 -5.00 117.46 125.32 3fkn n PHE 348 Ca 0.18 0.15 -0.33 0.00 -0.76 0.00 0.00 57.45 56.68 3fkn n PHE 348 Cb 0.42 -2.63 -0.15 0.00 0.35 0.00 0.00 39.48 37.46 3fkn n PHE 348 CO 0.00 0.00 0.00 0.08 -0.76 0.00 0.00 176.76 176.08 3fkn s VAL 349 N 0.55 2.43 0.63 -2.13 1.01 -1.26 -5.07 120.40 116.56 3fkn s VAL 349 Ca 0.69 -0.82 -0.18 0.00 0.00 0.00 0.00 61.98 61.67 3fkn s VAL 349 Cb -0.50 -2.04 -0.02 0.00 0.00 0.00 0.00 36.38 33.82 3fkn s VAL 349 CO 0.41 0.51 1.27 -2.16 0.00 0.00 0.00 175.10 175.13 3fkn s PRO 350 N 1.26 2.67 0.53 2.72 0.04 -1.26 -4.98 135.00 135.97 3fkn s PRO 350 Ca 0.03 1.99 -0.21 0.00 0.04 0.00 0.00 61.00 62.86 3fkn s PRO 350 Cb -0.14 -1.87 -0.06 0.00 0.04 0.00 0.00 34.50 32.48 3fkn s PRO 350 CO -0.09 -1.49 1.18 -1.25 0.04 0.00 0.00 177.00 175.39 3fkn s PRO 351 N -3.37 3.37 0.00 0.56 0.04 -1.26 -5.15 135.00 129.19 3fkn s PRO 351 Ca 0.81 1.76 0.00 0.00 0.04 0.00 0.00 61.00 63.61 3fkn s PRO 351 Cb -0.35 -2.13 0.00 0.00 0.04 0.00 0.00 34.50 32.06 3fkn s PRO 351 CO 0.38 -0.87 0.41 -2.30 0.04 0.00 0.00 177.00 174.66