#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xxe n GLU 4 N 0.00 1.99 -5.24 3.23 1.02 0.39 -4.62 120.64 117.40 1xxe n GLU 4 Ca 0.00 0.71 -0.30 0.00 -0.02 0.00 0.00 57.16 57.55 1xxe n GLU 4 Cb 0.00 -2.40 -0.16 0.00 -0.02 0.00 0.00 31.44 28.87 1xxe n GLU 4 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 1xxe s LYS 5 N 0.05 2.05 0.31 3.49 2.47 -1.25 -1.56 119.74 125.31 1xxe s LYS 5 Ca 0.73 -0.89 0.05 0.00 -1.56 0.00 0.00 55.97 54.29 1xxe s LYS 5 Cb -0.68 -1.96 -0.03 0.00 -1.46 0.00 0.00 37.83 33.70 1xxe s LYS 5 CO 0.46 0.52 0.28 -0.08 0.16 0.00 0.00 175.35 176.69 1xxe s THR 6 N -0.55 0.00 0.40 3.43 -1.32 -0.81 -2.27 115.64 114.52 1xxe s THR 6 Ca 0.09 -1.94 -0.20 0.00 -1.21 0.00 0.00 61.69 58.43 1xxe s THR 6 Cb -0.10 -2.51 -0.10 0.00 -1.51 0.00 0.00 72.50 68.27 1xxe s THR 6 CO -0.01 0.00 0.90 0.68 -2.21 0.00 0.00 174.62 173.98 1xxe s VAL 7 N -3.52 4.45 -0.09 5.08 -7.23 -1.26 0.30 120.40 118.13 1xxe s VAL 7 Ca 0.39 1.38 -0.13 0.00 -1.81 0.00 0.00 61.98 61.81 1xxe s VAL 7 Cb 0.03 -3.62 -0.28 0.00 0.56 0.00 0.00 36.38 33.06 1xxe s VAL 7 CO 0.24 -0.26 0.57 0.50 -0.31 0.00 0.00 175.10 175.84 1xxe h LYS 8 N 2.06 0.30 -5.44 4.82 3.64 0.14 -3.41 116.57 118.67 1xxe h LYS 8 Ca -0.49 -0.51 -0.42 0.00 -1.27 0.00 0.00 60.65 57.96 1xxe h LYS 8 Cb 1.18 0.19 -0.19 0.00 -0.41 0.00 0.00 32.23 33.00 1xxe h LYS 8 CO 0.62 1.24 -0.76 -2.00 -2.27 0.00 0.00 179.45 176.28 1xxe s GLU 9 N -2.52 1.01 0.31 1.90 2.12 -1.26 -4.98 118.70 115.28 1xxe s GLU 9 Ca -0.19 -1.21 -0.30 0.00 0.36 0.00 0.00 54.97 53.64 1xxe s GLU 9 Cb 0.05 -0.92 -0.11 0.00 0.26 0.00 0.00 34.13 33.41 1xxe s GLU 9 CO 0.79 0.18 1.60 1.17 -0.54 0.00 0.00 175.26 178.46 1xxe n LYS 10 N 0.63 2.75 -4.47 4.30 0.00 -1.26 -4.87 118.16 115.24 1xxe n LYS 10 Ca -0.16 0.98 -0.23 0.00 0.00 0.00 0.00 58.31 58.90 1xxe n LYS 10 Cb 0.57 -2.76 -0.10 0.00 0.00 0.00 0.00 35.03 32.73 1xxe n LYS 10 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 1xxe s LEU 11 N -0.68 2.50 -0.04 3.14 1.43 -0.86 -4.98 118.68 119.20 1xxe s LEU 11 Ca 0.63 -1.25 -0.28 0.00 -1.03 0.00 0.00 54.13 52.20 1xxe s LEU 11 Cb -0.48 -0.66 0.06 0.00 0.03 0.00 0.00 46.19 45.14 1xxe s LEU 11 CO 0.50 -0.39 0.60 -0.94 0.23 0.00 0.00 176.35 176.35 1xxe s SER 12 N -3.51 -0.56 0.14 2.29 1.04 -1.26 -0.89 113.70 110.94 1xxe s SER 12 Ca 0.32 0.58 0.05 0.00 0.48 0.00 0.00 55.95 57.37 1xxe s SER 12 Cb 0.05 0.50 -0.04 0.00 0.10 0.00 0.00 66.02 66.63 1xxe s SER 12 CO 0.14 -0.59 -0.11 -0.36 0.98 0.00 0.00 173.24 173.30 1xxe s PHE 13 N -1.28 1.28 -0.07 5.02 0.08 -0.33 -4.95 117.98 117.72 1xxe s PHE 13 Ca -0.11 -0.70 -0.05 0.00 0.12 0.00 0.00 56.93 56.19 1xxe s PHE 13 Cb -0.01 -0.65 0.03 0.00 -0.57 0.00 0.00 43.02 41.82 1xxe s PHE 13 CO 0.08 0.09 0.18 -1.83 -0.10 0.00 0.00 175.22 173.65 1xxe s GLU 14 N -3.42 0.17 0.00 0.44 1.03 -1.26 -1.03 118.70 114.63 1xxe s GLU 14 Ca 0.14 0.34 0.00 0.00 0.03 0.00 0.00 54.97 55.48 1xxe s GLU 14 Cb 0.00 -0.03 0.00 0.00 -0.80 0.00 0.00 34.13 33.30 1xxe s GLU 14 CO 0.01 -0.10 0.00 0.41 -1.33 0.00 0.00 175.26 174.25 1xxe n GLY 15 N 3.63 1.39 3.76 -3.83 0.00 -0.77 -4.95 105.19 104.42 1xxe n GLY 15 Ca -0.20 -0.59 -0.39 0.00 0.00 0.00 0.00 46.02 44.84 1xxe n GLY 15 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xxe s VAL 16 N -2.00 4.18 0.31 1.61 0.11 -1.26 -2.11 120.40 121.23 1xxe s VAL 16 Ca 0.00 1.92 -0.29 0.00 -2.93 0.00 0.00 61.98 60.68 1xxe s VAL 16 Cb 0.00 -4.21 -0.10 0.00 -1.53 0.00 0.00 36.38 30.54 1xxe s VAL 16 CO 0.00 0.42 1.38 -0.83 -3.33 0.00 0.00 175.10 172.74 1xxe s GLY 17 N -1.28 2.74 0.14 6.54 0.00 -0.61 -3.38 107.32 111.47 1xxe s GLY 17 Ca 0.42 1.32 -0.18 0.00 0.00 0.00 0.00 44.72 46.28 1xxe s GLY 17 CO 0.29 2.09 1.75 1.19 0.00 0.00 0.00 173.10 178.42 1xxe h ILE 18 N 3.22 0.94 0.13 0.90 2.10 -1.83 0.31 117.51 123.28 1xxe h ILE 18 Ca -0.48 -0.08 -0.33 0.00 1.08 0.00 0.00 64.86 65.05 1xxe h ILE 18 Cb 1.22 0.69 -0.01 0.00 -1.09 0.00 0.00 36.82 37.64 1xxe h ILE 18 CO 0.70 0.04 -1.74 0.45 -1.08 0.00 0.00 178.15 176.52 1xxe h HIS 19 N 0.23 0.50 -0.07 2.19 3.86 -1.89 3.22 115.15 123.20 1xxe h HIS 19 Ca 0.12 -0.37 -0.15 0.00 -1.16 0.00 0.00 60.37 58.81 1xxe h HIS 19 Cb 0.08 -0.02 -0.01 0.00 1.06 0.00 0.00 27.41 28.52 1xxe h HIS 19 CO -0.12 1.54 -0.62 1.15 0.86 0.00 0.00 177.93 180.74 1xxe h THR 20 N 0.08 1.39 -1.20 2.45 2.02 -1.92 -2.20 112.91 113.52 1xxe h THR 20 Ca -0.33 -2.02 -0.35 0.00 0.77 0.00 0.00 66.41 64.48 1xxe h THR 20 Cb 2.05 2.03 -0.11 0.00 -1.74 0.00 0.00 68.15 70.38 1xxe h THR 20 CO 0.14 0.60 -0.35 0.61 0.37 0.00 0.00 175.52 176.89 1xxe n GLY 21 N 0.31 1.23 3.56 2.16 0.00 0.11 -4.66 105.19 107.90 1xxe n GLY 21 Ca -0.02 -0.19 -0.29 0.00 0.00 0.00 0.00 46.02 45.52 1xxe n GLY 21 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xxe s GLU 22 N -3.78 2.05 0.12 1.61 0.41 -1.26 -4.84 118.70 113.01 1xxe s GLU 22 Ca 0.00 -1.12 -0.31 0.00 -0.41 0.00 0.00 54.97 53.13 1xxe s GLU 22 Cb 0.00 -2.23 -0.07 0.00 -1.78 0.00 0.00 34.13 30.04 1xxe s GLU 22 CO 0.00 0.48 1.32 -0.47 -0.49 0.00 0.00 175.26 176.10 1xxe s TYR 23 N -1.34 3.30 0.06 1.61 5.04 -1.26 -1.57 117.35 123.18 1xxe s TYR 23 Ca 0.22 1.10 0.00 0.00 -2.44 0.00 0.00 57.07 55.95 1xxe s TYR 23 Cb -0.10 -3.59 -0.04 0.00 0.35 0.00 0.00 41.96 38.58 1xxe s TYR 23 CO 0.14 -1.97 -0.04 0.45 -1.34 0.00 0.00 175.55 172.78 1xxe s SER 24 N 0.92 0.64 0.05 4.32 0.15 -0.90 -4.88 113.70 114.00 1xxe s SER 24 Ca 0.61 -0.88 0.01 0.00 0.70 0.00 0.00 55.95 56.39 1xxe s SER 24 Cb -0.35 0.14 -0.03 0.00 -1.71 0.00 0.00 66.02 64.08 1xxe s SER 24 CO 0.31 -0.49 -0.06 -0.75 1.20 0.00 0.00 173.24 173.46 1xxe s LYS 25 N -3.31 0.53 0.05 5.44 2.20 -0.93 -1.84 119.74 121.88 1xxe s LYS 25 Ca 0.03 -0.84 0.06 0.00 -0.36 0.00 0.00 55.97 54.86 1xxe s LYS 25 Cb 0.03 -0.16 -0.02 0.00 -1.51 0.00 0.00 37.83 36.16 1xxe s LYS 25 CO -0.06 0.01 -0.17 -0.51 -0.36 0.00 0.00 175.35 174.25 1xxe s LEU 26 N -1.84 2.18 -0.06 5.43 1.43 -0.20 -0.80 118.68 124.83 1xxe s LEU 26 Ca -0.07 -0.51 0.01 0.00 -1.03 0.00 0.00 54.13 52.54 1xxe s LEU 26 Cb -0.07 -0.76 0.02 0.00 0.03 0.00 0.00 46.19 45.41 1xxe s LEU 26 CO -0.01 0.08 -0.08 -0.63 0.23 0.00 0.00 176.35 175.93 1xxe s ILE 27 N -0.87 0.85 -0.08 -0.59 1.01 -0.14 -1.18 121.20 120.19 1xxe s ILE 27 Ca 0.04 -0.30 0.04 0.00 0.00 0.00 0.00 60.65 60.43 1xxe s ILE 27 Cb -0.08 -0.82 -0.01 0.00 0.01 0.00 0.00 42.46 41.55 1xxe s ILE 27 CO 0.02 0.30 -0.21 -0.63 0.00 0.00 0.00 174.94 174.42 1xxe s ILE 28 N 0.86 2.41 0.09 2.92 1.01 -0.07 0.30 121.20 128.72 1xxe s ILE 28 Ca -0.12 -0.92 0.07 0.00 0.00 0.00 0.00 60.65 59.69 1xxe s ILE 28 Cb -0.15 -1.93 -0.03 0.00 0.01 0.00 0.00 42.46 40.36 1xxe s ILE 28 CO 0.01 0.56 -0.19 -1.00 0.00 0.00 0.00 174.94 174.32 1xxe s HIS 29 N 0.01 1.63 0.96 3.97 3.76 -0.93 -2.02 115.29 122.68 1xxe s HIS 29 Ca -0.07 -0.43 -0.11 0.00 -0.15 0.00 0.00 55.06 54.30 1xxe s HIS 29 Cb -0.15 -0.90 0.17 0.00 1.11 0.00 0.00 32.58 32.81 1xxe s HIS 29 CO 0.05 0.17 1.12 -1.25 -0.85 0.00 0.00 174.74 173.98 1xxe s PRO 30 N -1.86 0.66 0.19 8.40 0.04 -1.26 -2.15 135.00 139.00 1xxe s PRO 30 Ca 0.04 1.41 0.03 0.00 0.04 0.00 0.00 61.00 62.52 1xxe s PRO 30 Cb -0.10 -1.70 -0.01 0.00 0.04 0.00 0.00 34.50 32.73 1xxe s PRO 30 CO 0.04 -2.83 0.09 0.39 0.04 0.00 0.00 177.00 174.73 1xxe n GLU 31 N -4.36 0.56 -3.13 4.56 1.02 -1.26 -4.67 120.64 113.37 1xxe n GLU 31 Ca 0.10 -1.66 -0.29 0.00 -0.02 0.00 0.00 57.16 55.29 1xxe n GLU 31 Cb 0.52 1.06 -0.03 0.00 -0.02 0.00 0.00 31.44 32.98 1xxe n GLU 31 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 1xxe s LYS 32 N -2.72 3.69 0.42 3.49 2.20 -1.26 -4.96 119.74 120.60 1xxe s LYS 32 Ca 0.13 0.19 -0.23 0.00 -0.36 0.00 0.00 55.97 55.71 1xxe s LYS 32 Cb 0.01 -2.54 -0.12 0.00 -1.51 0.00 0.00 37.83 33.67 1xxe s LYS 32 CO 0.09 0.10 0.67 0.39 -0.36 0.00 0.00 175.35 176.24 1xxe n GLU 33 N -1.13 0.75 -1.86 4.03 4.71 -1.26 -1.16 120.64 124.72 1xxe n GLU 33 Ca -0.00 0.27 -0.19 0.00 -0.01 0.00 0.00 57.16 57.23 1xxe n GLU 33 Cb 0.54 -1.64 -0.06 0.00 -1.01 0.00 0.00 31.44 29.27 1xxe n GLU 33 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1xxe n GLY 34 N 1.64 1.03 0.11 0.62 0.00 -1.26 -4.86 105.19 102.46 1xxe n GLY 34 Ca 0.11 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.97 1xxe n GLY 34 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1xxe h THR 35 N 0.00 1.49 0.00 2.61 2.02 -1.37 -3.50 112.91 114.16 1xxe h THR 35 Ca -0.42 -1.95 0.00 0.00 0.77 0.00 0.00 66.41 64.80 1xxe h THR 35 Cb 1.30 2.65 0.00 0.00 -1.74 0.00 0.00 68.15 70.36 1xxe h THR 35 CO 0.57 0.55 0.00 0.61 0.37 0.00 0.00 175.52 177.62 1xxe n GLY 36 N 1.00 1.10 3.63 2.16 0.00 -0.54 -4.95 105.19 107.60 1xxe n GLY 36 Ca -0.10 -2.11 -0.39 0.00 0.00 0.00 0.00 46.02 43.42 1xxe n GLY 36 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xxe s ILE 37 N -1.51 5.11 -0.01 -0.61 -1.09 -1.22 -2.34 121.20 119.54 1xxe s ILE 37 Ca 0.00 0.83 -0.00 0.00 -2.23 0.00 0.00 60.65 59.24 1xxe s ILE 37 Cb 0.00 -3.80 0.01 0.00 -1.58 0.00 0.00 42.46 37.09 1xxe s ILE 37 CO 0.00 0.14 0.01 0.00 -1.23 0.00 0.00 174.94 173.87 1xxe s ARG 38 N 1.97 0.00 0.17 2.79 1.70 -1.02 -1.52 118.95 123.04 1xxe s ARG 38 Ca 0.21 0.05 -0.01 0.00 -0.47 0.00 0.00 55.73 55.50 1xxe s ARG 38 Cb -0.15 -0.04 -0.04 0.00 -0.57 0.00 0.00 34.95 34.14 1xxe s ARG 38 CO 0.09 -0.03 0.36 -0.06 -1.08 0.00 0.00 175.30 174.57 1xxe s PHE 39 N 0.20 3.49 -0.01 5.89 0.08 -0.61 -1.74 117.98 125.28 1xxe s PHE 39 Ca -0.02 0.36 0.04 0.00 0.12 0.00 0.00 56.93 57.43 1xxe s PHE 39 Cb -0.02 -1.86 -0.01 0.00 -0.57 0.00 0.00 43.02 40.56 1xxe s PHE 39 CO -0.01 0.43 -0.12 0.12 -0.10 0.00 0.00 175.22 175.55 1xxe s PHE 40 N -1.77 1.05 -0.29 0.36 2.19 -0.84 0.52 117.98 119.21 1xxe s PHE 40 Ca 0.38 -0.20 -0.25 0.00 0.33 0.00 0.00 56.93 57.20 1xxe s PHE 40 Cb -0.11 -0.68 0.14 0.00 -1.31 0.00 0.00 43.02 41.05 1xxe s PHE 40 CO 0.28 -0.02 1.10 0.21 1.83 0.00 0.00 175.22 178.62 1xxe s LYS 41 N -0.27 0.42 -1.74 10.12 2.20 -0.15 -1.59 119.74 128.73 1xxe s LYS 41 Ca 0.04 0.51 0.00 0.00 -0.36 0.00 0.00 55.97 56.16 1xxe s LYS 41 Cb -0.05 0.20 0.00 0.00 -1.51 0.00 0.00 37.83 36.47 1xxe s LYS 41 CO -0.00 -0.05 0.00 0.09 -0.36 0.00 0.00 175.35 175.02 1xxe n ASN 42 N 2.18 -5.65 -0.99 1.43 4.13 -1.26 -1.00 115.26 114.11 1xxe n ASN 42 Ca -0.12 0.06 -0.09 0.00 1.68 0.00 0.00 54.58 56.10 1xxe n ASN 42 Cb 0.56 -4.73 -0.01 0.00 -1.54 0.00 0.00 39.78 34.06 1xxe n ASN 42 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1xxe n GLY 43 N -0.93 0.20 2.99 7.41 0.00 -1.26 -5.02 105.19 108.58 1xxe n GLY 43 Ca -0.23 -0.52 -0.18 0.00 0.00 0.00 0.00 46.02 45.09 1xxe n GLY 43 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xxe s VAL 44 N -2.44 0.58 0.00 1.61 1.01 -0.17 -5.14 120.40 115.85 1xxe s VAL 44 Ca 0.00 -0.30 -0.06 0.00 0.00 0.00 0.00 61.98 61.61 1xxe s VAL 44 Cb 0.00 -0.50 -0.05 0.00 0.00 0.00 0.00 36.38 35.83 1xxe s VAL 44 CO 0.00 0.17 0.26 -0.31 0.00 0.00 0.00 175.10 175.22 1xxe s TYR 45 N -0.09 3.58 -0.32 5.22 2.02 -1.26 -0.97 117.35 125.53 1xxe s TYR 45 Ca 0.02 0.57 -0.02 0.00 -0.37 0.00 0.00 57.07 57.26 1xxe s TYR 45 Cb -0.04 -1.98 0.11 0.00 -0.40 0.00 0.00 41.96 39.65 1xxe s TYR 45 CO -0.00 0.62 0.14 0.42 -1.57 0.00 0.00 175.55 175.16 1xxe s ILE 46 N -1.29 0.34 0.38 2.71 1.01 0.18 -4.91 121.20 119.64 1xxe s ILE 46 Ca 0.27 -1.23 -0.25 0.00 0.00 0.00 0.00 60.65 59.44 1xxe s ILE 46 Cb -0.13 -1.27 -0.12 0.00 0.01 0.00 0.00 42.46 40.95 1xxe s ILE 46 CO 0.16 -0.77 0.91 -2.65 0.00 0.00 0.00 174.94 172.59 1xxe n PRO 47 N 4.81 1.17 -3.01 2.79 -0.02 -1.26 -1.57 135.00 137.91 1xxe n PRO 47 Ca -0.01 0.42 -0.44 0.00 -2.02 0.00 0.00 63.50 61.45 1xxe n PRO 47 Cb 0.41 -1.87 -0.01 0.00 -0.02 0.00 0.00 33.50 32.01 1xxe n PRO 47 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1xxe s ALA 48 N -1.25 3.94 0.05 3.55 0.00 -0.57 -4.83 121.76 122.64 1xxe s ALA 48 Ca 0.62 -3.27 0.00 0.00 0.00 0.00 0.00 51.96 49.31 1xxe s ALA 48 Cb -0.61 -4.01 -0.03 0.00 0.00 0.00 0.00 23.12 18.48 1xxe s ALA 48 CO 0.58 -2.73 -0.05 1.03 0.00 0.00 0.00 175.76 174.60 1xxe s ARG 49 N 1.42 0.54 0.16 0.00 0.52 -1.26 -4.54 118.95 115.79 1xxe s ARG 49 Ca 0.37 -0.96 -0.17 0.00 -0.52 0.00 0.00 55.73 54.46 1xxe s ARG 49 Cb -0.05 0.01 0.08 0.00 0.52 0.00 0.00 34.95 35.52 1xxe s ARG 49 CO -0.04 -0.04 1.69 1.12 0.02 0.00 0.00 175.30 178.05 1xxe h HIS 50 N 3.85 -0.09 0.00 -0.53 2.07 -1.94 0.12 115.15 118.64 1xxe h HIS 50 Ca -0.34 0.03 0.00 0.00 -2.85 0.00 0.00 60.37 57.21 1xxe h HIS 50 Cb 1.18 0.10 0.00 0.00 2.57 0.00 0.00 27.41 31.26 1xxe h HIS 50 CO 0.60 -0.11 0.59 0.93 -3.07 0.00 0.00 177.93 176.88 1xxe h GLU 51 N 0.06 0.00 -0.43 5.12 5.08 -1.96 2.40 114.58 124.85 1xxe h GLU 51 Ca 0.18 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 1xxe h GLU 51 Cb 0.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.51 1xxe h GLU 51 CO -0.33 0.00 0.00 1.19 -1.00 0.00 0.00 179.01 178.87 1xxe n PHE 52 N -2.10 0.56 -1.69 4.33 3.72 0.41 -4.93 117.46 117.76 1xxe n PHE 52 Ca -0.01 -0.28 -0.43 0.00 -0.05 0.00 0.00 57.45 56.68 1xxe n PHE 52 Cb 0.60 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.11 1xxe n PHE 52 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 1xxe n VAL 53 N 1.23 0.28 -0.03 -4.37 0.31 0.81 -2.42 118.33 114.14 1xxe n VAL 53 Ca 0.19 -0.05 -0.03 0.00 -0.01 0.00 0.00 64.34 64.44 1xxe n VAL 53 Cb 0.53 -2.04 -0.04 0.00 -0.91 0.00 0.00 33.84 31.38 1xxe n VAL 53 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 1xxe n VAL 54 N 4.49 0.34 -3.66 2.52 0.24 -1.02 -4.89 118.33 116.36 1xxe n VAL 54 Ca 0.18 -0.19 -0.11 0.00 -2.04 0.00 0.00 64.34 62.18 1xxe n VAL 54 Cb 0.36 -0.84 -0.11 0.00 -1.47 0.00 0.00 33.84 31.78 1xxe n VAL 54 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 1xxe s HIS 55 N -2.12 -0.64 -0.13 6.34 5.65 -1.20 -5.05 115.29 118.14 1xxe s HIS 55 Ca -0.04 1.29 -0.01 0.00 0.25 0.00 0.00 55.06 56.55 1xxe s HIS 55 Cb 0.02 0.16 -0.02 0.00 -1.18 0.00 0.00 32.58 31.55 1xxe s HIS 55 CO 0.19 -0.43 -0.11 0.95 -0.65 0.00 0.00 174.74 174.69 1xxe s THR 56 N 2.53 3.29 0.00 0.89 -4.23 -1.26 -1.89 115.64 114.97 1xxe s THR 56 Ca -0.00 -0.58 0.00 0.00 -1.18 0.00 0.00 61.69 59.92 1xxe s THR 56 Cb -0.12 -2.39 0.00 0.00 1.34 0.00 0.00 72.50 71.33 1xxe s THR 56 CO -0.11 0.53 0.00 -3.20 -0.54 0.00 0.00 174.62 171.30 1xxe n ASN 57 N 3.35 0.00 0.07 3.99 2.85 -1.26 -4.89 115.26 119.37 1xxe n ASN 57 Ca -0.18 0.00 0.02 0.00 -0.11 0.00 0.00 54.58 54.31 1xxe n ASN 57 Cb 0.53 0.00 0.10 0.00 1.24 0.00 0.00 39.78 41.65 1xxe n ASN 57 CO 0.00 0.00 0.00 1.41 -2.11 0.00 0.00 177.26 176.56 1xxe n HIS 58 N 0.00 0.13 -4.23 1.20 8.25 -1.26 -4.38 115.22 114.93 1xxe n HIS 58 Ca 0.00 0.07 -0.13 0.00 -0.26 0.00 0.00 57.72 57.40 1xxe n HIS 58 Cb 0.00 -0.30 -0.10 0.00 1.12 0.00 0.00 29.99 30.71 1xxe n HIS 58 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1xxe s SER 59 N -2.69 0.87 -0.21 0.41 0.15 -1.26 -4.98 113.70 105.98 1xxe s SER 59 Ca -0.00 -1.24 -0.06 0.00 0.70 0.00 0.00 55.95 55.35 1xxe s SER 59 Cb 0.01 0.20 -0.03 0.00 -1.71 0.00 0.00 66.02 64.49 1xxe s SER 59 CO 0.03 -0.66 0.02 -0.89 1.20 0.00 0.00 173.24 172.94 1xxe s THR 60 N -3.82 4.06 0.00 6.45 2.01 -1.26 -4.58 115.64 118.50 1xxe s THR 60 Ca 0.28 -0.27 0.08 0.00 0.31 0.00 0.00 61.69 62.08 1xxe s THR 60 Cb 0.07 -2.85 -0.02 0.00 0.01 0.00 0.00 72.50 69.70 1xxe s THR 60 CO 0.06 0.41 -0.24 -1.81 -0.69 0.00 0.00 174.62 172.35 1xxe s ASP 61 N 1.15 2.79 0.39 3.53 1.01 -0.79 -1.46 116.67 123.29 1xxe s ASP 61 Ca 0.03 -0.47 0.08 0.00 0.71 0.00 0.00 52.55 52.90 1xxe s ASP 61 Cb -0.14 -0.29 -0.07 0.00 1.01 0.00 0.00 42.92 43.43 1xxe s ASP 61 CO 0.02 0.26 0.02 -0.76 0.21 0.00 0.00 175.17 174.92 1xxe s LEU 62 N -0.79 2.90 0.00 1.23 1.43 -0.69 -2.42 118.68 120.33 1xxe s LEU 62 Ca 0.09 -1.26 0.00 0.00 -1.03 0.00 0.00 54.13 51.94 1xxe s LEU 62 Cb -0.09 -1.05 0.00 0.00 0.03 0.00 0.00 46.19 45.08 1xxe s LEU 62 CO 0.00 -0.40 0.00 0.61 0.23 0.00 0.00 176.35 176.79 1xxe n GLY 63 N -0.98 1.61 3.10 -3.19 0.00 -1.02 0.04 105.19 104.75 1xxe n GLY 63 Ca -0.04 -0.15 -0.11 0.00 0.00 0.00 0.00 46.02 45.72 1xxe n GLY 63 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1xxe s PHE 64 N -1.51 0.07 -1.66 1.61 5.36 0.45 -4.75 117.98 117.55 1xxe s PHE 64 Ca 0.00 -0.19 0.00 0.00 -0.96 0.00 0.00 56.93 55.78 1xxe s PHE 64 Cb 0.00 -0.06 0.00 0.00 -0.34 0.00 0.00 43.02 42.62 1xxe s PHE 64 CO 0.00 -0.30 0.00 1.63 -1.46 0.00 0.00 175.22 175.09 1xxe n LYS 65 N 1.36 -1.55 -0.05 10.12 4.76 -1.26 -0.55 118.16 130.99 1xxe n LYS 65 Ca -0.22 0.93 0.00 0.00 -2.87 0.00 0.00 58.31 56.14 1xxe n LYS 65 Cb 0.56 -5.34 0.00 0.00 -1.84 0.00 0.00 35.03 28.41 1xxe n LYS 65 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1xxe n GLY 66 N -0.50 0.63 3.86 0.72 0.00 -1.26 -5.06 105.19 103.58 1xxe n GLY 66 Ca -0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.49 1xxe n GLY 66 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1xxe s GLN 67 N -0.79 3.87 0.03 1.61 -1.52 0.29 -5.08 119.66 118.07 1xxe s GLN 67 Ca 0.00 0.33 -0.03 0.00 -1.95 0.00 0.00 55.36 53.71 1xxe s GLN 67 Cb 0.00 -2.97 -0.02 0.00 -0.22 0.00 0.00 33.01 29.80 1xxe s GLN 67 CO 0.00 0.53 0.02 -0.98 -0.25 0.00 0.00 175.29 174.61 1xxe s ARG 68 N -1.91 0.46 0.04 2.91 3.03 -1.26 -0.41 118.95 121.82 1xxe s ARG 68 Ca 0.35 -0.74 0.03 0.00 2.03 0.00 0.00 55.73 57.40 1xxe s ARG 68 Cb -0.14 0.17 -0.02 0.00 -1.03 0.00 0.00 34.95 33.93 1xxe s ARG 68 CO 0.18 -0.10 -0.11 0.42 -1.13 0.00 0.00 175.30 174.57 1xxe s ILE 69 N -2.24 0.80 0.14 4.99 1.01 0.11 -4.87 121.20 121.14 1xxe s ILE 69 Ca -0.08 -0.98 0.08 0.00 0.00 0.00 0.00 60.65 59.66 1xxe s ILE 69 Cb -0.04 -0.78 -0.04 0.00 0.01 0.00 0.00 42.46 41.61 1xxe s ILE 69 CO -0.03 -0.17 -0.10 -0.54 0.00 0.00 0.00 174.94 174.10 1xxe s LYS 70 N -1.28 2.08 -0.83 2.79 1.02 -0.76 -1.71 119.74 121.06 1xxe s LYS 70 Ca -0.03 -1.13 -0.03 0.00 0.02 0.00 0.00 55.97 54.80 1xxe s LYS 70 Cb -0.08 -2.24 -0.00 0.00 -0.52 0.00 0.00 37.83 34.98 1xxe s LYS 70 CO 0.01 0.48 0.69 2.41 -0.92 0.00 0.00 175.35 178.02 1xxe n THR 71 N 0.43 -7.43 0.34 2.17 -1.04 -0.53 -2.24 114.28 105.98 1xxe n THR 71 Ca -0.13 -0.32 0.03 0.00 -2.04 0.00 0.00 64.05 61.60 1xxe n THR 71 Cb 0.54 -5.33 -0.04 0.00 -1.82 0.00 0.00 70.33 63.68 1xxe n THR 71 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 1xxe n VAL 72 N -2.42 0.00 0.26 12.58 0.24 -1.18 -4.25 118.33 123.56 1xxe n VAL 72 Ca -0.12 -0.32 0.13 0.00 -2.04 0.00 0.00 64.34 61.99 1xxe n VAL 72 Cb 0.58 0.98 0.72 0.00 -1.47 0.00 0.00 33.84 34.65 1xxe n VAL 72 CO 0.00 0.00 0.00 1.05 -2.14 0.00 0.00 176.83 175.74 1xxe h GLU 73 N 0.00 0.00 0.61 7.34 4.11 -1.86 -2.31 114.58 122.47 1xxe h GLU 73 Ca 0.00 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.40 1xxe h GLU 73 Cb 0.18 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.44 1xxe h GLU 73 CO 0.00 0.12 -0.29 0.45 0.07 0.00 0.00 179.01 179.35 1xxe h HIS 74 N 0.00 -0.76 -0.79 2.06 3.86 -1.90 -0.15 115.15 117.46 1xxe h HIS 74 Ca -0.00 -0.02 0.04 0.00 -1.16 0.00 0.00 60.37 59.23 1xxe h HIS 74 Cb 0.37 0.25 -0.05 0.00 1.06 0.00 0.00 27.41 29.04 1xxe h HIS 74 CO 0.00 -0.47 0.50 0.97 0.86 0.00 0.00 177.93 179.79 1xxe h ILE 75 N -1.19 1.10 -0.83 2.45 6.09 -1.85 -1.04 117.51 122.24 1xxe h ILE 75 Ca -0.08 -0.33 0.03 0.00 -1.37 0.00 0.00 64.86 63.11 1xxe h ILE 75 Cb 0.63 0.05 -0.05 0.00 0.47 0.00 0.00 36.82 37.92 1xxe h ILE 75 CO 0.14 0.18 0.55 -0.07 -3.07 0.00 0.00 178.15 175.87 1xxe h LEU 76 N 0.96 0.89 -0.32 2.19 3.38 -1.42 -1.77 115.31 119.23 1xxe h LEU 76 Ca 0.32 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.31 1xxe h LEU 76 Cb 0.05 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.56 1xxe h LEU 76 CO -0.13 0.61 0.15 -1.28 0.09 0.00 0.00 178.44 177.89 1xxe h SER 77 N 1.03 0.22 0.04 -0.43 0.87 0.34 0.47 113.55 116.09 1xxe h SER 77 Ca 0.33 0.02 0.01 0.00 -1.23 0.00 0.00 61.79 60.92 1xxe h SER 77 Cb 0.03 -0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 61.95 1xxe h SER 77 CO -0.10 0.17 -0.10 0.58 -0.53 0.00 0.00 176.83 176.85 1xxe h VAL 78 N 0.32 0.75 -0.77 2.23 2.07 -1.05 -1.65 116.25 118.15 1xxe h VAL 78 Ca 0.13 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.80 1xxe h VAL 78 Cb 0.05 0.75 -0.10 0.00 -1.52 0.00 0.00 31.29 30.48 1xxe h VAL 78 CO -0.10 0.00 0.32 -0.07 0.02 0.00 0.00 177.57 177.74 1xxe h LEU 79 N -0.19 0.30 0.08 2.57 3.38 -0.80 -0.16 115.31 120.48 1xxe h LEU 79 Ca 0.03 0.11 0.02 0.00 0.09 0.00 0.00 57.88 58.13 1xxe h LEU 79 Cb 0.22 0.08 -0.05 0.00 0.09 0.00 0.00 40.66 41.01 1xxe h LEU 79 CO -0.08 0.11 -0.39 -0.74 0.09 0.00 0.00 178.44 177.43 1xxe h HIS 80 N 0.46 -1.10 -0.51 1.13 2.76 0.02 0.27 115.15 118.17 1xxe h HIS 80 Ca 0.43 0.03 -0.02 0.00 -2.20 0.00 0.00 60.37 58.61 1xxe h HIS 80 Cb 0.66 0.47 -0.03 0.00 1.55 0.00 0.00 27.41 30.07 1xxe h HIS 80 CO -0.16 -0.49 0.23 -0.07 -1.30 0.00 0.00 177.93 176.14 1xxe h LEU 81 N -0.60 0.65 0.00 0.26 3.38 -0.83 -1.63 115.31 116.54 1xxe h LEU 81 Ca 0.03 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1xxe h LEU 81 Cb 0.65 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.23 1xxe h LEU 81 CO -0.26 0.56 0.00 0.18 0.09 0.00 0.00 178.44 179.02 1xxe n LEU 82 N -4.37 0.00 -3.09 1.67 4.77 -0.16 -4.93 117.00 110.89 1xxe n LEU 82 Ca 0.04 0.48 -0.15 0.00 -0.03 0.00 0.00 56.01 56.36 1xxe n LEU 82 Cb 0.14 -0.48 0.08 0.00 -2.33 0.00 0.00 43.42 40.82 1xxe n LEU 82 CO 0.37 -0.01 0.09 -0.62 -1.33 0.00 0.00 177.39 175.90 1xxe n GLU 83 N -1.48 -5.59 -3.38 3.23 1.02 0.87 -4.95 120.64 110.35 1xxe n GLU 83 Ca 0.07 0.73 -0.38 0.00 -0.02 0.00 0.00 57.16 57.57 1xxe n GLU 83 Cb 0.33 -5.40 -0.07 0.00 -0.02 0.00 0.00 31.44 26.27 1xxe n GLU 83 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1xxe s ILE 84 N -3.31 5.20 -0.05 -3.67 -1.09 -1.02 -3.77 121.20 113.49 1xxe s ILE 84 Ca 0.01 0.73 0.07 0.00 -2.23 0.00 0.00 60.65 59.23 1xxe s ILE 84 Cb -0.00 -3.74 -0.10 0.00 -1.58 0.00 0.00 42.46 37.04 1xxe s ILE 84 CO 0.63 0.26 0.16 0.35 -1.23 0.00 0.00 174.94 175.11 1xxe n THR 85 N 4.29 0.00 -3.83 2.92 -2.24 -0.96 -4.87 114.28 109.58 1xxe n THR 85 Ca -0.08 -0.18 -0.28 0.00 -2.27 0.00 0.00 64.05 61.24 1xxe n THR 85 Cb 0.51 0.43 -0.16 0.00 -2.10 0.00 0.00 70.33 69.01 1xxe n THR 85 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 1xxe s ASN 86 N -2.63 3.05 -0.13 3.42 0.02 -1.24 -1.47 114.94 115.96 1xxe s ASN 86 Ca -0.02 -0.82 -0.30 0.00 -1.02 0.00 0.00 52.86 50.70 1xxe s ASN 86 Cb 0.04 -0.83 0.10 0.00 0.02 0.00 0.00 41.25 40.59 1xxe s ASN 86 CO 0.28 -0.25 0.85 0.68 0.02 0.00 0.00 177.10 178.69 1xxe s VAL 87 N 1.68 0.00 -0.36 1.60 -7.23 -0.99 -4.07 120.40 111.03 1xxe s VAL 87 Ca -0.01 0.00 -0.00 0.00 -1.81 0.00 0.00 61.98 60.15 1xxe s VAL 87 Cb -0.17 -1.00 0.09 0.00 0.56 0.00 0.00 36.38 35.87 1xxe s VAL 87 CO -0.07 0.00 0.11 -0.89 -0.31 0.00 0.00 175.10 173.94 1xxe s THR 88 N -0.96 2.90 -0.51 5.32 2.01 -0.92 -2.43 115.64 121.05 1xxe s THR 88 Ca -0.05 -2.01 -0.19 0.00 0.31 0.00 0.00 61.69 59.75 1xxe s THR 88 Cb -0.01 -2.96 0.07 0.00 0.01 0.00 0.00 72.50 69.61 1xxe s THR 88 CO 0.05 -0.54 0.60 -0.63 -0.69 0.00 0.00 174.62 173.41 1xxe s ILE 89 N 1.09 4.92 -0.27 1.82 1.01 -0.71 -2.18 121.20 126.88 1xxe s ILE 89 Ca 0.06 -0.63 -0.25 0.00 0.00 0.00 0.00 60.65 59.82 1xxe s ILE 89 Cb -0.21 -4.30 0.00 0.00 0.01 0.00 0.00 42.46 37.96 1xxe s ILE 89 CO -0.05 -0.81 0.87 -1.61 0.00 0.00 0.00 174.94 173.34 1xxe s GLU 90 N 2.49 4.12 -0.34 2.79 2.02 0.15 -1.98 118.70 127.96 1xxe s GLU 90 Ca 0.13 0.92 -0.09 0.00 0.02 0.00 0.00 54.97 55.95 1xxe s GLU 90 Cb -0.21 -3.68 0.02 0.00 0.10 0.00 0.00 34.13 30.37 1xxe s GLU 90 CO 0.10 -0.62 0.15 0.08 0.02 0.00 0.00 175.26 175.00 1xxe s VAL 91 N 3.01 4.29 -0.42 2.63 1.01 -0.62 -0.97 120.40 129.33 1xxe s VAL 91 Ca 0.37 -0.80 -0.20 0.00 0.00 0.00 0.00 61.98 61.34 1xxe s VAL 91 Cb -0.15 -3.33 0.02 0.00 0.00 0.00 0.00 36.38 32.92 1xxe s VAL 91 CO 0.09 -0.11 0.61 -0.63 0.00 0.00 0.00 175.10 175.06 1xxe s ILE 92 N 1.52 4.88 -3.80 2.22 1.09 0.02 -4.68 121.20 122.45 1xxe s ILE 92 Ca 0.02 0.12 0.00 0.00 -1.10 0.00 0.00 60.65 59.69 1xxe s ILE 92 Cb -0.18 -4.15 0.00 0.00 -1.06 0.00 0.00 42.46 37.06 1xxe s ILE 92 CO 0.05 -0.52 0.00 0.61 -0.10 0.00 0.00 174.94 174.98 1xxe n GLY 93 N 4.99 0.86 0.00 6.18 0.00 -1.26 -2.18 105.19 113.77 1xxe n GLY 93 Ca -0.03 -1.99 0.02 0.00 0.00 0.00 0.00 46.02 44.03 1xxe n GLY 93 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1xxe n ASN 94 N 0.72 2.23 -3.95 1.61 0.23 -1.26 -5.01 115.26 109.84 1xxe n ASN 94 Ca 0.00 -0.28 -0.13 0.00 -0.53 0.00 0.00 54.58 53.64 1xxe n ASN 94 Cb 0.00 1.09 -0.13 0.00 -2.08 0.00 0.00 39.78 38.66 1xxe n ASN 94 CO 0.00 0.00 0.00 -0.70 -0.93 0.00 0.00 177.26 175.63 1xxe s GLU 95 N -1.82 0.27 0.01 -3.83 2.12 -1.26 -1.82 118.70 112.37 1xxe s GLU 95 Ca -0.00 -0.27 -0.30 0.00 0.36 0.00 0.00 54.97 54.76 1xxe s GLU 95 Cb 0.03 -0.16 -0.06 0.00 0.26 0.00 0.00 34.13 34.19 1xxe s GLU 95 CO 0.15 0.04 1.46 0.42 -0.54 0.00 0.00 175.26 176.79 1xxe s ILE 96 N -0.47 3.58 -0.07 -3.70 -1.09 -0.95 -4.57 121.20 113.93 1xxe s ILE 96 Ca -0.03 0.96 -0.39 0.00 -2.23 0.00 0.00 60.65 58.96 1xxe s ILE 96 Cb -0.04 -3.62 -0.17 0.00 -1.58 0.00 0.00 42.46 37.06 1xxe s ILE 96 CO -0.00 -0.01 1.45 -2.65 -1.23 0.00 0.00 174.94 172.50 1xxe n PRO 97 N 5.55 0.97 0.20 2.79 -0.02 -1.26 -4.54 135.00 138.68 1xxe n PRO 97 Ca 0.14 0.35 0.10 0.00 -2.02 0.00 0.00 63.50 62.07 1xxe n PRO 97 Cb 0.43 -1.99 0.15 0.00 -0.02 0.00 0.00 33.50 32.08 1xxe n PRO 97 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 1xxe h ILE 98 N 3.96 0.25 0.00 4.25 6.09 -1.84 -3.48 117.51 126.74 1xxe h ILE 98 Ca -0.47 -1.32 0.00 0.00 -1.37 0.00 0.00 64.86 61.70 1xxe h ILE 98 Cb 1.34 2.10 0.00 0.00 0.47 0.00 0.00 36.82 40.73 1xxe h ILE 98 CO 0.83 0.14 0.00 0.18 -3.07 0.00 0.00 178.15 176.23 1xxe n LEU 99 N -3.14 0.00 -0.14 2.19 4.77 -1.26 -1.24 117.00 118.19 1xxe n LEU 99 Ca 0.03 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 56.13 1xxe n LEU 99 Cb 0.58 0.00 0.09 0.00 -2.33 0.00 0.00 43.42 41.76 1xxe n LEU 99 CO 0.36 0.00 0.28 -0.67 -1.33 0.00 0.00 177.39 176.03 1xxe n ASP 100 N 10.58 1.06 0.00 -1.43 -0.08 -1.26 -4.58 116.55 120.83 1xxe n ASP 100 Ca 0.00 -0.87 0.00 0.00 -1.51 0.00 0.00 54.79 52.41 1xxe n ASP 100 Cb 0.00 0.54 0.00 0.00 2.34 0.00 0.00 41.12 44.00 1xxe n ASP 100 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1xxe n GLY 101 N 1.46 0.96 0.00 0.27 0.00 -0.37 -4.23 105.19 103.28 1xxe n GLY 101 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 1xxe n GLY 101 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1xxe n SER 102 N 0.00 1.90 -0.18 1.61 3.41 -1.26 -1.58 113.62 117.52 1xxe n SER 102 Ca 0.00 -0.88 0.04 0.00 -0.26 0.00 0.00 58.87 57.76 1xxe n SER 102 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1xxe n SER 102 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xxe n GLY 103 N 5.00 -0.27 0.32 5.00 0.00 -0.92 -4.65 105.19 109.68 1xxe n GLY 103 Ca 0.00 -0.21 0.15 0.00 0.00 0.00 0.00 46.02 45.96 1xxe n GLY 103 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 1xxe h TRP 104 N 0.90 0.65 0.15 1.61 2.91 -1.82 0.34 115.95 120.68 1xxe h TRP 104 Ca 0.00 0.04 -0.01 0.00 1.13 0.00 0.00 58.89 60.05 1xxe h TRP 104 Cb 0.26 -0.14 0.00 0.00 -0.51 0.00 0.00 29.16 28.77 1xxe h TRP 104 CO 0.00 -0.10 -0.07 0.93 -1.03 0.00 0.00 178.44 178.17 1xxe h GLU 105 N 0.36 -0.19 -0.54 2.65 5.08 -1.90 0.66 114.58 120.70 1xxe h GLU 105 Ca 0.59 0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.95 1xxe h GLU 105 Cb 1.18 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.45 1xxe h GLU 105 CO -0.57 -0.08 0.26 0.74 -1.00 0.00 0.00 179.01 178.37 1xxe h PHE 106 N -0.25 0.77 -0.82 4.33 0.04 -1.41 -1.17 116.94 118.42 1xxe h PHE 106 Ca -0.02 -0.04 -0.02 0.00 2.80 0.00 0.00 57.97 60.69 1xxe h PHE 106 Cb 0.20 -0.24 -0.04 0.00 2.20 0.00 0.00 35.95 38.07 1xxe h PHE 106 CO -0.05 0.59 0.42 -0.92 -0.60 0.00 0.00 178.31 177.75 1xxe h TYR 107 N 0.72 1.16 -0.16 -0.55 3.20 -0.12 0.11 116.97 121.32 1xxe h TYR 107 Ca 0.18 -0.04 -0.05 0.00 3.14 0.00 0.00 58.73 61.96 1xxe h TYR 107 Cb 0.11 -0.36 -0.00 0.00 1.54 0.00 0.00 36.73 38.01 1xxe h TYR 107 CO -0.01 0.82 -0.11 0.93 -1.64 0.00 0.00 178.16 178.16 1xxe h GLU 108 N 1.16 0.35 0.01 1.82 5.08 0.84 -2.19 114.58 121.65 1xxe h GLU 108 Ca 0.29 -0.17 -0.00 0.00 -1.00 0.00 0.00 59.36 58.48 1xxe h GLU 108 Cb 0.08 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.33 1xxe h GLU 108 CO -0.04 0.69 -0.00 0.00 -1.00 0.00 0.00 179.01 178.66 1xxe h ALA 109 N 0.65 -0.01 -0.69 3.43 0.00 -1.12 -3.16 119.26 118.36 1xxe h ALA 109 Ca 0.03 -0.39 0.03 0.00 0.00 0.00 0.00 54.91 54.58 1xxe h ALA 109 Cb 0.60 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.36 1xxe h ALA 109 CO 0.03 -0.03 0.43 0.82 0.00 0.00 0.00 179.25 180.50 1xxe h ILE 110 N -0.96 1.10 -0.07 0.00 2.04 -0.92 -0.77 117.51 117.92 1xxe h ILE 110 Ca -0.00 -0.29 0.01 0.00 1.00 0.00 0.00 64.86 65.58 1xxe h ILE 110 Cb 0.79 0.17 -0.00 0.00 -0.74 0.00 0.00 36.82 37.04 1xxe h ILE 110 CO 0.00 0.16 0.05 -0.09 0.00 0.00 0.00 178.15 178.27 1xxe h ARG 111 N 0.85 0.04 -0.23 2.37 2.43 -1.52 0.22 114.38 118.53 1xxe h ARG 111 Ca 0.28 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.44 1xxe h ARG 111 Cb 0.01 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 1xxe h ARG 111 CO -0.10 0.02 0.00 1.17 -1.51 0.00 0.00 179.97 179.55 1xxe n LYS 112 N -4.52 1.37 -1.70 0.20 4.81 -0.31 -3.65 118.16 114.35 1xxe n LYS 112 Ca -0.02 -0.51 0.01 0.00 -0.87 0.00 0.00 58.31 56.92 1xxe n LYS 112 Cb 0.13 -1.17 0.02 0.00 0.02 0.00 0.00 35.03 34.03 1xxe n LYS 112 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1xxe n ASN 113 N -0.07 0.64 -4.87 3.14 4.13 0.73 -5.04 115.26 113.92 1xxe n ASN 113 Ca 0.05 -2.01 -0.33 0.00 1.68 0.00 0.00 54.58 53.97 1xxe n ASN 113 Cb 0.15 -0.18 -0.05 0.00 -1.54 0.00 0.00 39.78 38.16 1xxe n ASN 113 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1xxe s ILE 114 N -0.64 4.96 0.11 2.41 1.01 -1.07 0.78 121.20 128.76 1xxe s ILE 114 Ca 0.26 0.49 0.06 0.00 0.00 0.00 0.00 60.65 61.45 1xxe s ILE 114 Cb 0.31 -3.64 -0.04 0.00 0.01 0.00 0.00 42.46 39.11 1xxe s ILE 114 CO -0.12 0.02 -0.14 -0.22 0.00 0.00 0.00 174.94 174.49 1xxe s LEU 115 N -2.58 2.38 0.02 2.97 2.96 0.15 -4.49 118.68 120.08 1xxe s LEU 115 Ca 0.44 -0.77 0.01 0.00 -0.22 0.00 0.00 54.13 53.59 1xxe s LEU 115 Cb -0.12 -0.54 -0.04 0.00 0.50 0.00 0.00 46.19 45.99 1xxe s LEU 115 CO 0.21 -0.13 0.06 0.20 -1.32 0.00 0.00 176.35 175.36 1xxe s ASN 116 N -2.31 5.48 0.00 3.68 0.01 -1.26 -1.93 114.94 118.60 1xxe s ASN 116 Ca 0.07 0.06 0.00 0.00 -0.71 0.00 0.00 52.86 52.28 1xxe s ASN 116 Cb -0.06 -1.51 0.00 0.00 0.41 0.00 0.00 41.25 40.09 1xxe s ASN 116 CO 0.03 0.25 0.00 0.00 -1.51 0.00 0.00 177.10 175.87 1xxe n GLN 117 N 1.06 2.80 -0.01 -0.60 6.02 -0.60 -4.93 117.38 121.12 1xxe n GLN 117 Ca -0.12 0.00 0.01 0.00 -0.01 0.00 0.00 57.00 56.88 1xxe n GLN 117 Cb 0.52 0.00 0.02 0.00 1.02 0.00 0.00 30.24 31.80 1xxe n GLN 117 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 1xxe n ASN 118 N -0.58 1.43 -4.92 1.08 4.05 -1.26 -4.79 115.26 110.27 1xxe n ASN 118 Ca 0.00 -1.30 -0.29 0.00 0.45 0.00 0.00 54.58 53.44 1xxe n ASN 118 Cb 0.00 -0.01 -0.04 0.00 1.23 0.00 0.00 39.78 40.96 1xxe n ASN 118 CO 0.00 0.00 0.00 -0.60 -3.05 0.00 0.00 177.26 173.61 1xxe s ARG 119 N -0.39 3.51 0.12 1.20 3.52 -1.26 -4.94 118.95 120.70 1xxe s ARG 119 Ca 0.04 -0.35 -0.08 0.00 -0.13 0.00 0.00 55.73 55.21 1xxe s ARG 119 Cb 0.02 -2.91 -0.06 0.00 -1.56 0.00 0.00 34.95 30.45 1xxe s ARG 119 CO 0.03 0.49 0.40 -2.00 -0.81 0.00 0.00 175.30 173.41 1xxe s GLU 120 N -2.97 3.70 0.33 5.12 2.12 -1.26 0.15 118.70 125.89 1xxe s GLU 120 Ca 0.37 0.08 -0.08 0.00 0.36 0.00 0.00 54.97 55.70 1xxe s GLU 120 Cb -0.12 -2.90 -0.06 0.00 0.26 0.00 0.00 34.13 31.31 1xxe s GLU 120 CO 0.28 0.50 0.65 0.42 -0.54 0.00 0.00 175.26 176.56 1xxe s ILE 121 N -1.54 4.90 -0.54 -3.70 1.01 -1.26 -4.59 121.20 115.47 1xxe s ILE 121 Ca 0.38 0.37 -0.18 0.00 0.00 0.00 0.00 60.65 61.22 1xxe s ILE 121 Cb -0.13 -3.71 0.10 0.00 0.01 0.00 0.00 42.46 38.73 1xxe s ILE 121 CO 0.21 -0.36 0.59 -0.62 0.00 0.00 0.00 174.94 174.75 1xxe s ASP 122 N -3.02 6.19 0.41 3.58 2.15 -1.26 -4.68 116.67 120.03 1xxe s ASP 122 Ca 0.48 -1.42 -0.24 0.00 0.43 0.00 0.00 52.55 51.80 1xxe s ASP 122 Cb -0.11 -2.26 -0.08 0.00 -0.30 0.00 0.00 42.92 40.17 1xxe s ASP 122 CO 0.29 -0.94 1.12 -0.31 -0.17 0.00 0.00 175.17 175.16 1xxe s TYR 123 N 2.23 3.13 -0.24 -5.34 1.51 -1.26 -4.67 117.35 112.71 1xxe s TYR 123 Ca 0.09 1.59 -0.15 0.00 -1.01 0.00 0.00 57.07 57.60 1xxe s TYR 123 Cb -0.25 -3.28 -0.04 0.00 -0.11 0.00 0.00 41.96 38.29 1xxe s TYR 123 CO 0.06 -1.04 0.35 0.12 -1.11 0.00 0.00 175.55 173.93 1xxe s PHE 124 N -1.53 3.31 -0.03 2.71 2.19 -0.32 -4.98 117.98 119.32 1xxe s PHE 124 Ca 0.58 0.46 0.06 0.00 0.33 0.00 0.00 56.93 58.37 1xxe s PHE 124 Cb -0.27 -2.50 -0.01 0.00 -1.31 0.00 0.00 43.02 38.93 1xxe s PHE 124 CO 0.33 -0.09 -0.22 0.08 1.83 0.00 0.00 175.22 177.15 1xxe s VAL 125 N 1.58 1.79 0.10 3.12 1.01 -1.26 0.80 120.40 127.54 1xxe s VAL 125 Ca 0.15 -0.95 -0.25 0.00 0.00 0.00 0.00 61.98 60.93 1xxe s VAL 125 Cb -0.15 -1.50 -0.06 0.00 0.00 0.00 0.00 36.38 34.67 1xxe s VAL 125 CO 0.08 0.51 0.77 -0.69 0.00 0.00 0.00 175.10 175.77 1xxe s VAL 126 N -0.36 4.58 -0.58 2.92 1.01 -0.94 -4.94 120.40 122.10 1xxe s VAL 126 Ca 0.04 1.66 0.08 0.00 0.00 0.00 0.00 61.98 63.76 1xxe s VAL 126 Cb -0.10 -4.12 -0.04 0.00 0.00 0.00 0.00 36.38 32.11 1xxe s VAL 126 CO 0.01 0.43 0.46 -0.62 0.00 0.00 0.00 175.10 175.37 1xxe n GLU 127 N 2.29 3.26 -3.76 2.72 1.02 -1.26 -4.29 120.64 120.62 1xxe n GLU 127 Ca -0.04 -0.28 -0.13 0.00 -0.02 0.00 0.00 57.16 56.69 1xxe n GLU 127 Cb 0.50 -0.95 -0.09 0.00 -0.02 0.00 0.00 31.44 30.87 1xxe n GLU 127 CO 0.00 0.00 0.00 -1.83 1.18 0.00 0.00 177.13 176.48 1xxe s GLU 128 N -1.47 0.60 0.41 3.49 -1.05 -1.26 -4.86 118.70 114.55 1xxe s GLU 128 Ca 0.05 -0.06 -0.24 0.00 -0.15 0.00 0.00 54.97 54.57 1xxe s GLU 128 Cb 0.06 0.27 -0.09 0.00 -0.44 0.00 0.00 34.13 33.94 1xxe s GLU 128 CO 0.27 -0.15 1.09 -1.25 0.95 0.00 0.00 175.26 176.17 1xxe s PRO 129 N -1.01 4.09 0.08 -4.83 0.04 -1.26 -4.54 135.00 127.57 1xxe s PRO 129 Ca -0.11 1.63 0.05 0.00 0.04 0.00 0.00 61.00 62.61 1xxe s PRO 129 Cb -0.05 -2.57 -0.03 0.00 0.04 0.00 0.00 34.50 31.89 1xxe s PRO 129 CO 0.03 -0.23 -0.14 -1.50 0.04 0.00 0.00 177.00 175.20 1xxe s ILE 130 N -1.57 1.12 -0.10 0.56 2.07 -0.81 -4.93 121.20 117.54 1xxe s ILE 130 Ca 0.58 -1.38 -0.02 0.00 -1.41 0.00 0.00 60.65 58.43 1xxe s ILE 130 Cb -0.25 -1.14 0.03 0.00 0.13 0.00 0.00 42.46 41.23 1xxe s ILE 130 CO 0.31 -0.27 0.01 -0.63 -1.91 0.00 0.00 174.94 172.45 1xxe s ILE 131 N -1.46 0.41 -0.28 2.00 1.01 -1.26 -0.57 121.20 121.05 1xxe s ILE 131 Ca -0.00 -0.03 0.01 0.00 0.00 0.00 0.00 60.65 60.63 1xxe s ILE 131 Cb -0.09 -0.64 0.06 0.00 0.01 0.00 0.00 42.46 41.80 1xxe s ILE 131 CO 0.02 0.16 -0.06 0.68 0.00 0.00 0.00 174.94 175.74 1xxe s VAL 132 N 1.95 2.47 -0.13 2.92 -7.23 -0.46 -4.99 120.40 114.93 1xxe s VAL 132 Ca 0.04 -1.58 -0.01 0.00 -1.81 0.00 0.00 61.98 58.62 1xxe s VAL 132 Cb -0.13 -2.45 -0.02 0.00 0.56 0.00 0.00 36.38 34.33 1xxe s VAL 132 CO -0.06 -0.08 -0.09 -0.70 -0.31 0.00 0.00 175.10 173.86 1xxe s GLU 133 N 1.15 3.38 -0.30 4.82 2.12 -1.26 -1.69 118.70 126.92 1xxe s GLU 133 Ca -0.07 -0.60 -0.38 0.00 0.36 0.00 0.00 54.97 54.27 1xxe s GLU 133 Cb -0.20 -2.72 0.16 0.00 0.26 0.00 0.00 34.13 31.63 1xxe s GLU 133 CO -0.04 0.30 1.40 0.34 -0.54 0.00 0.00 175.26 176.72 1xxe s ASP 134 N 0.16 -0.00 -1.80 -1.70 -1.08 -0.87 -4.96 116.67 106.42 1xxe s ASP 134 Ca -0.05 0.00 0.00 0.00 -0.52 0.00 0.00 52.55 51.98 1xxe s ASP 134 Cb -0.14 0.00 0.00 0.00 -1.46 0.00 0.00 42.92 41.32 1xxe s ASP 134 CO 0.04 -0.00 0.00 -0.62 0.52 0.00 0.00 175.17 175.11 1xxe n GLU 135 N 0.03 -1.40 -0.96 4.34 -0.58 -1.26 0.34 120.64 121.16 1xxe n GLU 135 Ca 0.06 1.01 0.00 0.00 -0.42 0.00 0.00 57.16 57.81 1xxe n GLU 135 Cb 0.56 -5.33 0.00 0.00 -0.57 0.00 0.00 31.44 26.10 1xxe n GLU 135 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1xxe n GLY 136 N -0.29 1.07 4.02 0.62 0.00 -1.26 -5.00 105.19 104.34 1xxe n GLY 136 Ca -0.17 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.65 1xxe n GLY 136 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xxe s ARG 137 N -0.01 2.40 -0.14 1.61 0.52 0.15 -4.96 118.95 118.53 1xxe s ARG 137 Ca 0.00 -1.60 -0.29 0.00 -0.52 0.00 0.00 55.73 53.32 1xxe s ARG 137 Cb 0.00 -2.61 0.07 0.00 0.52 0.00 0.00 34.95 32.93 1xxe s ARG 137 CO 0.00 -0.72 0.71 -1.17 0.02 0.00 0.00 175.30 174.14 1xxe s LEU 138 N -4.56 -0.68 -0.08 2.53 0.20 -0.97 -2.05 118.68 113.07 1xxe s LEU 138 Ca 0.58 1.00 -0.04 0.00 0.69 0.00 0.00 54.13 56.35 1xxe s LEU 138 Cb -0.06 2.49 0.04 0.00 -0.43 0.00 0.00 46.19 48.22 1xxe s LEU 138 CO 0.36 -0.46 0.19 -0.63 -0.29 0.00 0.00 176.35 175.53 1xxe s ILE 139 N -0.56 -0.04 -0.04 6.68 1.01 -0.68 -0.92 121.20 126.65 1xxe s ILE 139 Ca -0.06 0.15 0.06 0.00 0.00 0.00 0.00 60.65 60.80 1xxe s ILE 139 Cb -0.02 -0.30 -0.01 0.00 0.01 0.00 0.00 42.46 42.13 1xxe s ILE 139 CO 0.06 0.06 -0.24 -0.75 0.00 0.00 0.00 174.94 174.07 1xxe s LYS 140 N 1.11 2.19 0.10 2.79 2.20 -0.39 -1.35 119.74 126.39 1xxe s LYS 140 Ca -0.08 -0.85 0.07 0.00 -0.36 0.00 0.00 55.97 54.75 1xxe s LYS 140 Cb -0.10 -1.97 -0.04 0.00 -1.51 0.00 0.00 37.83 34.21 1xxe s LYS 140 CO -0.06 0.42 -0.12 0.00 -0.36 0.00 0.00 175.35 175.23 1xxe s ALA 141 N -0.32 2.88 -0.08 3.13 0.00 0.26 -0.23 121.76 127.41 1xxe s ALA 141 Ca 0.02 -1.25 -0.06 0.00 0.00 0.00 0.00 51.96 50.67 1xxe s ALA 141 Cb -0.12 -0.85 0.03 0.00 0.00 0.00 0.00 23.12 22.19 1xxe s ALA 141 CO 0.01 0.63 0.20 -2.00 0.00 0.00 0.00 175.76 174.60 1xxe s GLU 142 N -2.11 0.21 0.51 0.00 2.12 0.69 -1.92 118.70 118.20 1xxe s GLU 142 Ca 0.20 0.34 -0.23 0.00 0.36 0.00 0.00 54.97 55.64 1xxe s GLU 142 Cb -0.11 0.02 -0.06 0.00 0.26 0.00 0.00 34.13 34.24 1xxe s GLU 142 CO 0.12 -0.07 1.37 -0.35 -0.54 0.00 0.00 175.26 175.79 1xxe n PRO 143 N 3.40 1.88 -3.54 4.30 -0.04 -1.26 0.05 135.00 139.78 1xxe n PRO 143 Ca -0.17 0.68 -0.09 0.00 -0.04 0.00 0.00 63.50 63.88 1xxe n PRO 143 Cb 0.57 -2.58 -0.03 0.00 -0.04 0.00 0.00 33.50 31.42 1xxe n PRO 143 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1xxe s SER 144 N -0.75 -0.35 0.00 3.54 0.15 -1.26 -4.45 113.70 110.58 1xxe s SER 144 Ca 0.68 0.16 0.22 0.00 0.70 0.00 0.00 55.95 57.71 1xxe s SER 144 Cb -0.43 0.33 0.87 0.00 -1.71 0.00 0.00 66.02 65.08 1xxe s SER 144 CO 0.52 -0.48 1.62 -0.90 1.20 0.00 0.00 173.24 175.21 1xxe n ASP 145 N 0.15 1.47 -4.04 5.45 5.75 -1.26 -3.69 116.55 120.37 1xxe n ASP 145 Ca -0.08 -1.62 -0.14 0.00 -0.01 0.00 0.00 54.79 52.93 1xxe n ASP 145 Cb 0.60 -0.07 -0.12 0.00 -1.03 0.00 0.00 41.12 40.49 1xxe n ASP 145 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 1xxe s THR 146 N -1.86 0.56 -0.26 2.12 -4.23 -1.26 -4.91 115.64 105.81 1xxe s THR 146 Ca 0.34 -0.86 -0.28 0.00 -1.18 0.00 0.00 61.69 59.71 1xxe s THR 146 Cb 0.18 -0.58 0.01 0.00 1.34 0.00 0.00 72.50 73.45 1xxe s THR 146 CO 0.28 -0.22 1.01 -0.22 -0.54 0.00 0.00 174.62 174.93 1xxe s LEU 147 N -1.17 4.05 -0.01 4.79 2.96 -1.26 -2.86 118.68 125.18 1xxe s LEU 147 Ca -0.06 1.19 0.02 0.00 -0.22 0.00 0.00 54.13 55.06 1xxe s LEU 147 Cb -0.08 -3.47 -0.00 0.00 0.50 0.00 0.00 46.19 43.14 1xxe s LEU 147 CO 0.00 -0.71 -0.05 -0.70 -1.32 0.00 0.00 176.35 173.57 1xxe s GLU 148 N 3.28 0.44 -0.05 1.98 2.12 -0.61 -2.80 118.70 123.07 1xxe s GLU 148 Ca 0.43 -0.17 -0.01 0.00 0.36 0.00 0.00 54.97 55.57 1xxe s GLU 148 Cb -0.14 -0.44 0.03 0.00 0.26 0.00 0.00 34.13 33.84 1xxe s GLU 148 CO 0.09 0.09 0.02 0.08 -0.54 0.00 0.00 175.26 175.01 1xxe s VAL 149 N -0.02 0.15 -0.07 3.70 1.01 -0.74 -0.29 120.40 124.14 1xxe s VAL 149 Ca 0.01 0.22 0.02 0.00 0.00 0.00 0.00 61.98 62.23 1xxe s VAL 149 Cb -0.03 -0.33 -0.03 0.00 0.00 0.00 0.00 36.38 35.99 1xxe s VAL 149 CO -0.00 0.20 -0.11 -0.89 0.00 0.00 0.00 175.10 174.30 1xxe s THR 150 N 1.79 3.37 -0.06 3.92 2.01 0.06 -0.82 115.64 125.91 1xxe s THR 150 Ca 0.01 -0.60 0.03 0.00 0.31 0.00 0.00 61.69 61.44 1xxe s THR 150 Cb -0.12 -2.36 0.01 0.00 0.01 0.00 0.00 72.50 70.03 1xxe s THR 150 CO -0.04 0.58 -0.14 -0.47 -0.69 0.00 0.00 174.62 173.87 1xxe s TYR 151 N -0.62 1.55 -0.20 4.92 6.14 -0.93 0.14 117.35 128.34 1xxe s TYR 151 Ca 0.09 -0.54 -0.01 0.00 0.64 0.00 0.00 57.07 57.26 1xxe s TYR 151 Cb -0.11 -1.10 0.01 0.00 0.42 0.00 0.00 41.96 41.18 1xxe s TYR 151 CO 0.01 -0.25 -0.14 -2.00 0.64 0.00 0.00 175.55 173.82 1xxe s GLU 152 N 0.47 3.05 -0.06 4.97 2.12 0.19 -1.80 118.70 127.63 1xxe s GLU 152 Ca -0.12 -0.81 0.03 0.00 0.36 0.00 0.00 54.97 54.44 1xxe s GLU 152 Cb -0.14 -2.74 -0.02 0.00 0.26 0.00 0.00 34.13 31.48 1xxe s GLU 152 CO 0.04 -0.24 -0.15 0.20 -0.54 0.00 0.00 175.26 174.56 1xxe s GLY 153 N 1.34 1.50 -0.74 -1.50 0.00 -0.19 -0.29 107.32 107.43 1xxe s GLY 153 Ca 0.04 -0.97 -0.02 0.00 0.00 0.00 0.00 44.72 43.77 1xxe s GLY 153 CO -0.09 -0.66 0.59 -1.83 0.00 0.00 0.00 173.10 171.11 1xxe s GLU 154 N -0.48 2.86 0.29 2.90 -1.05 -1.26 -1.47 118.70 120.49 1xxe s GLU 154 Ca 0.06 -2.91 -0.16 0.00 -0.15 0.00 0.00 54.97 51.81 1xxe s GLU 154 Cb -0.12 -3.80 -0.09 0.00 -0.44 0.00 0.00 34.13 29.68 1xxe s GLU 154 CO 0.02 -1.22 0.72 -0.06 0.95 0.00 0.00 175.26 175.66 1xxe s PHE 155 N -0.71 3.45 -2.30 4.83 0.08 0.36 -4.90 117.98 118.78 1xxe s PHE 155 Ca 0.22 1.24 0.24 0.00 0.12 0.00 0.00 56.93 58.75 1xxe s PHE 155 Cb -0.14 -2.53 0.29 0.00 -0.57 0.00 0.00 43.02 40.07 1xxe s PHE 155 CO -0.08 0.17 1.29 1.63 -0.10 0.00 0.00 175.22 178.13 1xxe n LYS 156 N -0.04 1.50 0.00 0.44 5.02 -1.26 -3.17 118.16 120.65 1xxe n LYS 156 Ca 0.02 -1.16 0.00 0.00 -2.02 0.00 0.00 58.31 55.15 1xxe n LYS 156 Cb 0.53 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 34.06 1xxe n LYS 156 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1xxe n ASN 157 N 0.26 -0.36 0.22 4.39 6.94 -1.26 -4.70 115.26 120.74 1xxe n ASN 157 Ca 0.12 -0.81 0.18 0.00 -0.02 0.00 0.00 54.58 54.05 1xxe n ASN 157 Cb 0.47 0.00 0.85 0.00 -2.36 0.00 0.00 39.78 38.74 1xxe n ASN 157 CO 0.00 0.00 0.00 2.19 -1.03 0.00 0.00 177.26 178.42 1xxe h PHE 158 N -1.18 0.00 -0.59 -2.53 -0.00 -1.51 0.25 116.94 111.38 1xxe h PHE 158 Ca 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 57.97 57.87 1xxe h PHE 158 Cb 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 35.95 35.93 1xxe h PHE 158 CO 0.00 0.00 -0.03 -0.07 -0.00 0.00 0.00 178.31 178.21 1xxe h LEU 159 N 0.00 1.04 0.00 2.10 3.38 -1.88 -3.47 115.31 116.47 1xxe h LEU 159 Ca 0.09 -0.32 0.00 0.00 0.09 0.00 0.00 57.88 57.74 1xxe h LEU 159 Cb 0.60 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.06 1xxe h LEU 159 CO -0.00 1.11 0.00 0.61 0.09 0.00 0.00 178.44 180.25 1xxe n GLY 160 N -0.37 1.88 3.51 0.83 0.00 0.07 -4.74 105.19 106.37 1xxe n GLY 160 Ca 0.02 -0.45 -0.31 0.00 0.00 0.00 0.00 46.02 45.29 1xxe n GLY 160 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xxe s ARG 161 N 0.00 2.23 0.14 1.61 0.52 -1.25 0.13 118.95 122.33 1xxe s ARG 161 Ca 0.00 -0.90 -0.24 0.00 -0.52 0.00 0.00 55.73 54.07 1xxe s ARG 161 Cb 0.00 -2.30 0.07 0.00 0.52 0.00 0.00 34.95 33.24 1xxe s ARG 161 CO 0.00 0.56 0.71 -1.14 0.02 0.00 0.00 175.30 175.45 1xxe s GLN 162 N -1.51 1.24 0.09 3.54 0.74 -0.54 -4.95 119.66 118.27 1xxe s GLN 162 Ca 0.16 -0.52 -0.10 0.00 0.05 0.00 0.00 55.36 54.96 1xxe s GLN 162 Cb -0.11 0.53 0.00 0.00 1.10 0.00 0.00 33.01 34.53 1xxe s GLN 162 CO 0.07 -0.55 0.22 -1.59 -0.55 0.00 0.00 175.29 172.89 1xxe s LYS 163 N -3.59 0.87 -0.02 1.67 -2.85 -1.26 -1.02 119.74 113.54 1xxe s LYS 163 Ca 0.04 -0.91 0.00 0.00 -1.00 0.00 0.00 55.97 54.10 1xxe s LYS 163 Cb -0.02 0.36 0.02 0.00 -2.06 0.00 0.00 37.83 36.13 1xxe s LYS 163 CO -0.08 -0.28 0.02 0.12 0.10 0.00 0.00 175.35 175.22 1xxe s PHE 164 N -3.81 0.10 -0.24 1.78 5.36 -0.75 -4.98 117.98 115.45 1xxe s PHE 164 Ca 0.04 0.08 -0.08 0.00 -0.96 0.00 0.00 56.93 56.01 1xxe s PHE 164 Cb 0.04 -0.24 -0.04 0.00 -0.34 0.00 0.00 43.02 42.44 1xxe s PHE 164 CO -0.11 -0.08 0.10 -0.08 -1.46 0.00 0.00 175.22 173.59 1xxe s THR 165 N 0.88 4.73 -0.13 0.12 -1.32 -1.26 -2.19 115.64 116.47 1xxe s THR 165 Ca -0.08 -0.03 -0.07 0.00 -1.21 0.00 0.00 61.69 60.30 1xxe s THR 165 Cb -0.11 -3.20 -0.04 0.00 -1.51 0.00 0.00 72.50 67.64 1xxe s THR 165 CO -0.02 0.35 0.13 0.12 -2.21 0.00 0.00 174.62 172.99 1xxe s PHE 166 N 1.25 3.54 0.03 9.09 5.36 0.00 -4.96 117.98 132.29 1xxe s PHE 166 Ca 0.05 0.47 0.01 0.00 -0.96 0.00 0.00 56.93 56.51 1xxe s PHE 166 Cb -0.14 -1.96 -0.02 0.00 -0.34 0.00 0.00 43.02 40.55 1xxe s PHE 166 CO 0.04 0.65 -0.06 0.08 -1.46 0.00 0.00 175.22 174.48 1xxe s VAL 167 N -0.82 0.38 -0.24 3.12 1.01 -1.26 -1.78 120.40 120.80 1xxe s VAL 167 Ca 0.14 -1.02 -0.38 0.00 0.00 0.00 0.00 61.98 60.72 1xxe s VAL 167 Cb -0.12 -0.48 -0.14 0.00 0.00 0.00 0.00 36.38 35.65 1xxe s VAL 167 CO 0.03 -0.43 1.87 -0.62 0.00 0.00 0.00 175.10 175.95 1xxe n GLU 168 N 1.51 1.42 0.00 2.72 1.02 -1.12 -1.61 120.64 124.58 1xxe n GLU 168 Ca -0.23 0.50 0.00 0.00 -0.02 0.00 0.00 57.16 57.41 1xxe n GLU 168 Cb 0.55 -2.31 0.00 0.00 -0.02 0.00 0.00 31.44 29.65 1xxe n GLU 168 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1xxe n GLY 169 N 4.71 1.19 1.25 0.62 0.00 -1.26 -4.96 105.19 106.74 1xxe n GLY 169 Ca 0.28 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.34 1xxe n GLY 169 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1xxe n ASN 170 N 0.00 0.95 -0.18 1.61 3.02 -0.63 -4.87 115.26 115.15 1xxe n ASN 170 Ca 0.00 -2.19 0.01 0.00 -0.03 0.00 0.00 54.58 52.36 1xxe n ASN 170 Cb 0.00 -0.31 0.26 0.00 -0.61 0.00 0.00 39.78 39.12 1xxe n ASN 170 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 1xxe h GLU 171 N 0.84 0.92 0.00 3.52 5.08 -1.93 -1.58 114.58 121.43 1xxe h GLU 171 Ca -0.17 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.12 1xxe h GLU 171 Cb 1.73 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 30.78 1xxe h GLU 171 CO 0.08 0.63 0.21 0.93 -1.00 0.00 0.00 179.01 179.86 1xxe h GLU 172 N 0.94 0.00 -0.01 2.33 5.08 -1.98 0.23 114.58 121.18 1xxe h GLU 172 Ca 0.25 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.61 1xxe h GLU 172 Cb -0.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.18 1xxe h GLU 172 CO -0.05 0.00 -0.16 0.39 -1.00 0.00 0.00 179.01 178.19 1xxe n GLU 173 N -2.41 0.95 0.00 2.33 -0.58 -0.59 -4.01 120.64 116.34 1xxe n GLU 173 Ca -0.01 -0.49 0.00 0.00 -0.42 0.00 0.00 57.16 56.23 1xxe n GLU 173 Cb 0.25 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.63 1xxe n GLU 173 CO 0.00 0.00 0.00 0.44 -0.48 0.00 0.00 177.13 177.09 1xxe n ILE 174 N -0.59 0.43 -0.09 -3.67 -5.35 0.80 -4.70 119.36 106.18 1xxe n ILE 174 Ca 0.14 -0.60 -0.12 0.00 -0.27 0.00 0.00 62.75 61.91 1xxe n ILE 174 Cb 0.32 0.89 -0.15 0.00 -1.74 0.00 0.00 39.64 38.96 1xxe n ILE 174 CO 0.00 0.00 0.00 1.33 -1.76 0.00 0.00 176.55 176.12 1xxe n VAL 175 N -0.22 1.45 1.49 7.28 0.24 -1.15 -4.27 118.33 123.15 1xxe n VAL 175 Ca 0.00 -0.79 0.12 0.00 -2.04 0.00 0.00 64.34 61.63 1xxe n VAL 175 Cb 0.20 -0.76 0.49 0.00 -1.47 0.00 0.00 33.84 32.30 1xxe n VAL 175 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 1xxe n LEU 176 N -2.91 1.23 -4.64 1.34 4.77 -1.26 -2.16 117.00 113.36 1xxe n LEU 176 Ca -0.34 -0.48 -0.43 0.00 -0.03 0.00 0.00 56.01 54.73 1xxe n LEU 176 Cb 1.11 -0.05 -0.02 0.00 -2.33 0.00 0.00 43.42 42.13 1xxe n LEU 176 CO 0.40 0.24 0.95 0.00 -1.33 0.00 0.00 177.39 177.64 1xxe s ALA 177 N -1.90 3.54 0.27 -1.18 0.00 -1.26 -4.89 121.76 116.34 1xxe s ALA 177 Ca 0.35 -0.00 -0.07 0.00 0.00 0.00 0.00 51.96 52.24 1xxe s ALA 177 Cb 0.18 -3.64 -0.06 0.00 0.00 0.00 0.00 23.12 19.60 1xxe s ALA 177 CO 0.29 -1.38 0.56 -0.98 0.00 0.00 0.00 175.76 174.25 1xxe s ARG 178 N 3.54 3.70 0.21 0.00 1.70 -1.26 -4.50 118.95 122.33 1xxe s ARG 178 Ca 0.45 0.12 -0.32 0.00 -0.47 0.00 0.00 55.73 55.51 1xxe s ARG 178 Cb -0.13 -2.64 -0.13 0.00 -0.57 0.00 0.00 34.95 31.48 1xxe s ARG 178 CO 0.13 0.24 1.62 -2.37 -1.08 0.00 0.00 175.30 173.85 1xxe n THR 179 N -0.64 0.24 -4.03 4.99 5.66 -0.62 -4.79 114.28 115.09 1xxe n THR 179 Ca -0.01 -0.06 -0.22 0.00 -3.05 0.00 0.00 64.05 60.71 1xxe n THR 179 Cb 0.53 -1.78 -0.05 0.00 -1.55 0.00 0.00 70.33 67.48 1xxe n THR 179 CO 0.00 0.00 0.00 0.72 -3.05 0.00 0.00 175.07 172.74 1xxe s PHE 180 N 0.79 2.82 0.11 1.09 -0.71 -1.26 -2.28 117.98 118.53 1xxe s PHE 180 Ca 0.74 -0.31 -0.06 0.00 -1.04 0.00 0.00 56.93 56.26 1xxe s PHE 180 Cb -0.58 -1.61 -0.02 0.00 -1.21 0.00 0.00 43.02 39.60 1xxe s PHE 180 CO 0.38 0.34 0.15 0.00 -1.34 0.00 0.00 175.22 174.76 1xxe s PHE 182 N -3.93 3.23 0.55 0.00 0.08 -1.26 -0.25 117.98 116.39 1xxe s PHE 182 Ca 0.12 0.18 0.26 0.00 0.12 0.00 0.00 56.93 57.61 1xxe s PHE 182 Cb 0.05 -1.73 1.62 0.00 -0.57 0.00 0.00 43.02 42.39 1xxe s PHE 182 CO -0.06 0.53 2.20 0.38 -0.10 0.00 0.00 175.22 178.17 1xxe h ASP 183 N 4.27 0.00 1.29 1.36 2.03 -1.78 -1.18 116.42 122.40 1xxe h ASP 183 Ca -0.49 0.00 -0.14 0.00 -0.73 0.00 0.00 57.03 55.67 1xxe h ASP 183 Cb 1.18 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 39.66 1xxe h ASP 183 CO 0.60 0.03 -0.73 4.11 -1.03 0.00 0.00 179.24 182.22 1xxe h TRP 184 N 0.00 0.00 0.00 4.15 0.09 -1.94 -3.28 115.95 114.97 1xxe h TRP 184 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.89 58.98 1xxe h TRP 184 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.30 1xxe h TRP 184 CO 0.00 0.62 -0.93 -0.85 0.09 0.00 0.00 178.44 177.38 1xxe n GLU 185 N -3.21 0.28 0.10 0.12 0.28 -0.75 -4.28 120.64 113.19 1xxe n GLU 185 Ca -0.00 0.02 -0.12 0.00 -0.16 0.00 0.00 57.16 56.90 1xxe n GLU 185 Cb 0.80 -1.61 -0.05 0.00 1.43 0.00 0.00 31.44 32.00 1xxe n GLU 185 CO 0.00 0.00 0.00 0.82 -0.16 0.00 0.00 177.13 177.79 1xxe h ILE 186 N 0.00 0.54 -0.06 3.84 2.04 -1.30 -0.42 117.51 122.15 1xxe h ILE 186 Ca 0.00 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.90 1xxe h ILE 186 Cb 0.73 0.54 -0.05 0.00 -0.74 0.00 0.00 36.82 37.30 1xxe h ILE 186 CO 0.00 0.00 -0.22 -0.33 0.00 0.00 0.00 178.15 177.60 1xxe h GLU 187 N -0.37 -0.31 -0.91 2.37 3.07 -1.75 0.18 114.58 116.86 1xxe h GLU 187 Ca 0.03 0.02 0.16 0.00 -0.50 0.00 0.00 59.36 59.07 1xxe h GLU 187 Cb 0.41 0.07 -0.10 0.00 -0.84 0.00 0.00 28.75 28.29 1xxe h GLU 187 CO -0.13 -0.20 0.51 1.25 -1.40 0.00 0.00 179.01 179.04 1xxe h HIS 188 N -0.32 0.90 -0.22 4.33 2.76 -1.69 1.01 115.15 121.92 1xxe h HIS 188 Ca 0.08 0.03 -0.09 0.00 -2.20 0.00 0.00 60.37 58.20 1xxe h HIS 188 Cb 0.43 -0.26 -0.01 0.00 1.55 0.00 0.00 27.41 29.12 1xxe h HIS 188 CO -0.29 0.23 -0.24 0.82 -1.30 0.00 0.00 177.93 177.14 1xxe h ILE 189 N 0.71 1.25 0.00 6.26 2.04 0.40 -1.88 117.51 126.29 1xxe h ILE 189 Ca 0.50 -1.20 -0.12 0.00 1.00 0.00 0.00 64.86 65.05 1xxe h ILE 189 Cb 0.72 1.35 -0.02 0.00 -0.74 0.00 0.00 36.82 38.13 1xxe h ILE 189 CO -0.36 0.38 -0.56 0.11 0.00 0.00 0.00 178.15 177.72 1xxe h LYS 190 N 0.37 0.00 0.00 2.37 1.57 0.27 -2.05 116.57 119.10 1xxe h LYS 190 Ca 0.06 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.68 1xxe h LYS 190 Cb 0.62 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.91 1xxe h LYS 190 CO 0.04 0.56 -0.75 0.87 -0.57 0.00 0.00 179.45 179.61 1xxe h LYS 191 N 0.00 0.00 -0.03 3.15 1.57 0.12 -3.08 116.57 118.31 1xxe h LYS 191 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1xxe h LYS 191 Cb 1.41 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.72 1xxe h LYS 191 CO 0.07 0.75 0.00 1.33 -0.57 0.00 0.00 179.45 181.03 1xxe n VAL 192 N -3.32 0.04 -1.41 0.50 0.24 -0.74 -4.83 118.33 108.79 1xxe n VAL 192 Ca 0.01 -0.04 -0.04 0.00 -2.04 0.00 0.00 64.34 62.23 1xxe n VAL 192 Cb 0.82 -0.05 -0.01 0.00 -1.47 0.00 0.00 33.84 33.13 1xxe n VAL 192 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1xxe n GLY 193 N 0.63 0.52 3.44 7.63 0.00 -1.16 -5.03 105.19 111.22 1xxe n GLY 193 Ca 0.05 -0.86 -0.22 0.00 0.00 0.00 0.00 46.02 44.99 1xxe n GLY 193 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xxe s LEU 194 N -0.89 2.56 -0.48 0.99 1.43 -0.77 -4.74 118.68 116.78 1xxe s LEU 194 Ca 0.00 -1.13 0.00 0.00 -1.03 0.00 0.00 54.13 51.97 1xxe s LEU 194 Cb 0.00 -0.79 0.00 0.00 0.03 0.00 0.00 46.19 45.43 1xxe s LEU 194 CO 0.00 -0.22 0.00 0.61 0.23 0.00 0.00 176.35 176.97 1xxe n GLY 195 N -0.59 0.50 0.27 -3.19 0.00 -1.24 -3.52 105.19 97.41 1xxe n GLY 195 Ca -0.06 -0.77 0.16 0.00 0.00 0.00 0.00 46.02 45.35 1xxe n GLY 195 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xxe h LYS 196 N 0.00 0.00 -0.02 1.61 1.57 -1.26 -2.50 116.57 115.97 1xxe h LYS 196 Ca -0.11 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.67 1xxe h LYS 196 Cb 0.66 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.97 1xxe h LYS 196 CO 0.14 0.04 -0.23 0.41 -0.57 0.00 0.00 179.45 179.24 1xxe n GLY 197 N 0.10 0.36 3.71 3.86 0.00 1.05 -4.62 105.19 109.65 1xxe n GLY 197 Ca 0.01 -0.60 -0.42 0.00 0.00 0.00 0.00 46.02 45.01 1xxe n GLY 197 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1xxe s GLY 198 N -2.05 1.58 0.15 -0.02 0.00 0.06 -4.68 107.32 102.36 1xxe s GLY 198 Ca 0.21 1.31 0.02 0.00 0.00 0.00 0.00 44.72 46.26 1xxe s GLY 198 CO 0.40 2.69 0.07 -1.14 0.00 0.00 0.00 173.10 175.12 1xxe n SER 199 N 4.45 0.79 0.02 1.64 3.41 -1.26 -5.04 113.62 117.63 1xxe n SER 199 Ca 0.14 -1.83 0.11 0.00 -0.26 0.00 0.00 58.87 57.03 1xxe n SER 199 Cb 0.39 0.44 0.09 0.00 -0.26 0.00 0.00 64.21 64.87 1xxe n SER 199 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1xxe n LEU 200 N 0.00 0.63 -0.28 1.04 4.77 -1.26 -2.29 117.00 119.61 1xxe n LEU 200 Ca -0.01 -0.04 0.13 0.00 -0.03 0.00 0.00 56.01 56.06 1xxe n LEU 200 Cb 0.23 -0.14 0.33 0.00 -2.33 0.00 0.00 43.42 41.52 1xxe n LEU 200 CO 0.12 0.08 0.62 1.17 -1.33 0.00 0.00 177.39 178.04 1xxe n LYS 201 N -1.80 0.90 -0.10 3.23 4.81 -1.26 -4.06 118.16 119.87 1xxe n LYS 201 Ca 0.03 -0.56 0.00 0.00 -0.87 0.00 0.00 58.31 56.91 1xxe n LYS 201 Cb 0.40 -1.49 0.00 0.00 0.02 0.00 0.00 35.03 33.96 1xxe n LYS 201 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1xxe n ASN 202 N -0.56 0.08 -3.67 3.14 3.02 -1.25 -4.74 115.26 111.28 1xxe n ASN 202 Ca 0.12 -1.25 -0.11 0.00 -0.03 0.00 0.00 54.58 53.31 1xxe n ASN 202 Cb 0.36 -0.04 -0.11 0.00 -0.61 0.00 0.00 39.78 39.38 1xxe n ASN 202 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1xxe s THR 203 N -0.05 -0.44 -0.41 3.41 2.01 -0.97 -3.57 115.64 115.62 1xxe s THR 203 Ca 0.00 0.20 -0.27 0.00 0.31 0.00 0.00 61.69 61.93 1xxe s THR 203 Cb 0.00 -0.56 0.02 0.00 0.01 0.00 0.00 72.50 71.98 1xxe s THR 203 CO 0.00 0.08 1.02 -0.22 -0.69 0.00 0.00 174.62 174.81 1xxe s LEU 204 N 2.28 3.88 -0.20 4.42 2.96 -0.97 -4.42 118.68 126.63 1xxe s LEU 204 Ca -0.02 0.57 -0.08 0.00 -0.22 0.00 0.00 54.13 54.38 1xxe s LEU 204 Cb -0.11 -3.39 -0.04 0.00 0.50 0.00 0.00 46.19 43.15 1xxe s LEU 204 CO -0.11 -1.01 0.07 -0.69 -1.32 0.00 0.00 176.35 173.30 1xxe s VAL 205 N 3.84 4.78 -0.03 1.68 1.01 -1.26 0.34 120.40 130.76 1xxe s VAL 205 Ca 0.42 -0.03 0.02 0.00 0.00 0.00 0.00 61.98 62.39 1xxe s VAL 205 Cb -0.10 -3.17 -0.03 0.00 0.00 0.00 0.00 36.38 33.07 1xxe s VAL 205 CO 0.23 0.43 -0.08 -0.76 0.00 0.00 0.00 175.10 174.92 1xxe s LEU 206 N 0.64 3.11 0.11 3.92 1.43 0.65 -2.78 118.68 125.77 1xxe s LEU 206 Ca 0.04 -0.10 -0.04 0.00 -1.03 0.00 0.00 54.13 52.99 1xxe s LEU 206 Cb -0.13 -1.73 -0.05 0.00 0.03 0.00 0.00 46.19 44.31 1xxe s LEU 206 CO 0.01 0.32 0.34 -0.83 0.23 0.00 0.00 176.35 176.43 1xxe s GLY 207 N -1.08 2.23 0.61 -3.19 0.00 0.45 -2.01 107.32 104.34 1xxe s GLY 207 Ca 0.14 -0.60 0.27 0.00 0.00 0.00 0.00 44.72 44.53 1xxe s GLY 207 CO 0.04 -0.52 1.41 0.50 0.00 0.00 0.00 173.10 174.54 1xxe h LYS 208 N 3.01 0.00 0.00 2.90 1.57 -1.98 -2.39 116.57 119.67 1xxe h LYS 208 Ca -0.46 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 1xxe h LYS 208 Cb 1.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.48 1xxe h LYS 208 CO 0.72 0.00 -0.00 -3.47 -0.57 0.00 0.00 179.45 176.13 1xxe n ASP 209 N -3.31 0.00 -3.92 0.86 2.03 -1.26 -1.47 116.55 109.47 1xxe n ASP 209 Ca 0.20 -1.01 -0.10 0.00 0.52 0.00 0.00 54.79 54.40 1xxe n ASP 209 Cb 1.36 -0.00 -0.10 0.00 -0.72 0.00 0.00 41.12 41.66 1xxe n ASP 209 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 1xxe s LYS 210 N 0.00 0.48 -0.24 -0.67 2.20 -0.90 -4.98 119.74 115.64 1xxe s LYS 210 Ca 0.00 -0.59 -0.14 0.00 -0.36 0.00 0.00 55.97 54.89 1xxe s LYS 210 Cb 0.00 0.19 -0.04 0.00 -1.51 0.00 0.00 37.83 36.47 1xxe s LYS 210 CO 0.00 -0.11 0.32 0.08 -0.36 0.00 0.00 175.35 175.28 1xxe s VAL 211 N -1.87 5.24 -0.05 4.02 1.01 -1.26 0.17 120.40 127.66 1xxe s VAL 211 Ca -0.11 0.50 -0.21 0.00 0.00 0.00 0.00 61.98 62.16 1xxe s VAL 211 Cb -0.06 -3.65 -0.16 0.00 0.00 0.00 0.00 36.38 32.52 1xxe s VAL 211 CO -0.01 0.25 0.87 1.88 0.00 0.00 0.00 175.10 178.09 1xxe h TYR 212 N 7.72 -0.20 -2.70 5.22 -1.99 -1.87 -3.44 116.97 119.71 1xxe h TYR 212 Ca -0.35 -0.00 -0.58 0.00 2.00 0.00 0.00 58.73 59.80 1xxe h TYR 212 Cb 1.17 0.07 0.08 0.00 2.00 0.00 0.00 36.73 40.04 1xxe h TYR 212 CO 0.71 0.24 0.66 0.09 -0.00 0.00 0.00 178.16 179.85 1xxe n ASN 213 N -4.92 2.90 0.23 3.88 5.03 -1.26 -4.87 115.26 116.25 1xxe n ASN 213 Ca -0.08 1.14 0.11 0.00 0.87 0.00 0.00 54.58 56.62 1xxe n ASN 213 Cb 0.26 -1.45 0.44 0.00 -1.02 0.00 0.00 39.78 38.02 1xxe n ASN 213 CO 0.00 0.00 0.00 1.55 -1.83 0.00 0.00 177.26 176.98 1xxe h PRO 214 N 4.43 0.00 0.00 3.52 0.13 -1.96 -2.95 132.00 135.16 1xxe h PRO 214 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1xxe h PRO 214 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1xxe h PRO 214 CO 0.77 0.19 0.00 -1.91 -0.23 0.00 0.00 178.00 176.82 1xxe n GLU 215 N -3.30 0.43 0.00 0.86 2.13 -1.26 -5.00 120.64 114.49 1xxe n GLU 215 Ca 0.01 0.03 0.00 0.00 0.66 0.00 0.00 57.16 57.86 1xxe n GLU 215 Cb 0.44 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.65 1xxe n GLU 215 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1xxe n GLY 216 N 0.96 -0.53 3.85 8.31 0.00 -1.12 -4.79 105.19 111.87 1xxe n GLY 216 Ca 0.14 -1.11 -0.34 0.00 0.00 0.00 0.00 46.02 44.71 1xxe n GLY 216 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xxe s LEU 217 N 0.00 4.26 0.16 0.99 1.43 -1.26 -4.95 118.68 119.31 1xxe s LEU 217 Ca 0.00 1.06 0.22 0.00 -1.03 0.00 0.00 54.13 54.37 1xxe s LEU 217 Cb 0.00 -3.47 -0.05 0.00 0.03 0.00 0.00 46.19 42.70 1xxe s LEU 217 CO 0.00 0.02 0.97 0.54 0.23 0.00 0.00 176.35 178.11 1xxe n ARG 218 N 0.41 0.61 -4.13 1.70 5.12 -1.26 -4.94 116.66 114.17 1xxe n ARG 218 Ca -0.03 0.12 -0.11 0.00 -1.93 0.00 0.00 57.85 55.91 1xxe n ARG 218 Cb 0.52 -1.80 -0.09 0.00 -1.16 0.00 0.00 32.46 29.93 1xxe n ARG 218 CO 0.00 0.00 0.00 0.71 -1.93 0.00 0.00 177.63 176.41 1xxe s TYR 219 N -3.30 0.86 -0.32 -1.55 2.02 -1.26 -5.02 117.35 108.78 1xxe s TYR 219 Ca -0.01 -1.17 0.21 0.00 -0.37 0.00 0.00 57.07 55.73 1xxe s TYR 219 Cb 0.10 -0.37 0.19 0.00 -0.40 0.00 0.00 41.96 41.47 1xxe s TYR 219 CO 0.80 -0.66 1.42 0.93 -1.57 0.00 0.00 175.55 176.47 1xxe h GLU 220 N 2.64 0.00 -0.50 -0.62 4.39 -2.04 -3.30 114.58 115.15 1xxe h GLU 220 Ca -0.34 0.00 -0.37 0.00 0.34 0.00 0.00 59.36 58.99 1xxe h GLU 220 Cb 1.23 0.00 -0.34 0.00 -0.10 0.00 0.00 28.75 29.54 1xxe h GLU 220 CO 0.52 0.13 -0.83 0.09 -1.16 0.00 0.00 179.01 177.75 1xxe n ASN 221 N -3.03 3.44 -0.13 1.42 4.13 -1.26 -4.84 115.26 114.99 1xxe n ASN 221 Ca 0.02 -3.33 0.04 0.00 1.68 0.00 0.00 54.58 52.99 1xxe n ASN 221 Cb 0.60 -0.40 0.35 0.00 -1.54 0.00 0.00 39.78 38.79 1xxe n ASN 221 CO 0.00 0.00 0.00 -0.08 0.28 0.00 0.00 177.26 177.46 1xxe h GLU 222 N 1.98 0.73 -0.06 3.52 4.81 -1.96 0.80 114.58 124.40 1xxe h GLU 222 Ca 0.17 -0.04 -0.10 0.00 -0.13 0.00 0.00 59.36 59.25 1xxe h GLU 222 Cb 1.41 -0.16 0.01 0.00 0.63 0.00 0.00 28.75 30.63 1xxe h GLU 222 CO 0.47 0.48 -0.37 -1.35 -0.73 0.00 0.00 179.01 177.51 1xxe h PRO 223 N 0.75 0.35 0.00 0.92 0.11 -1.88 -2.30 132.00 129.95 1xxe h PRO 223 Ca 0.25 -0.30 -0.09 0.00 0.11 0.00 0.00 66.00 65.97 1xxe h PRO 223 Cb 0.07 0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.23 1xxe h PRO 223 CO -0.07 0.95 -0.43 -0.39 -0.21 0.00 0.00 178.00 177.86 1xxe h VAL 224 N -0.15 0.83 -0.22 3.15 -1.51 -1.92 -2.65 116.25 113.77 1xxe h VAL 224 Ca -0.03 -1.86 -0.05 0.00 -1.23 0.00 0.00 66.70 63.54 1xxe h VAL 224 Cb 1.04 2.18 -0.01 0.00 -2.13 0.00 0.00 31.29 32.37 1xxe h VAL 224 CO 0.08 0.42 -0.04 0.03 -1.23 0.00 0.00 177.57 176.83 1xxe h ARG 225 N 0.00 0.42 -0.71 5.19 3.08 -0.86 -1.70 114.38 119.80 1xxe h ARG 225 Ca -0.00 -0.15 0.04 0.00 0.07 0.00 0.00 59.98 59.93 1xxe h ARG 225 Cb 1.15 -0.03 -0.05 0.00 0.08 0.00 0.00 29.97 31.12 1xxe h ARG 225 CO 0.06 0.64 0.44 1.25 -1.07 0.00 0.00 179.97 181.29 1xxe h HIS 226 N 0.16 0.82 -0.53 3.04 2.76 -1.32 -0.52 115.15 119.56 1xxe h HIS 226 Ca 0.06 0.02 0.05 0.00 -2.20 0.00 0.00 60.37 58.30 1xxe h HIS 226 Cb 0.48 -0.27 -0.05 0.00 1.55 0.00 0.00 27.41 29.12 1xxe h HIS 226 CO 0.05 0.45 0.26 0.87 -1.30 0.00 0.00 177.93 178.27 1xxe h LYS 227 N 0.85 0.49 -0.23 5.26 6.56 -1.17 0.17 116.57 128.50 1xxe h LYS 227 Ca 0.29 -0.03 0.03 0.00 -1.06 0.00 0.00 60.65 59.88 1xxe h LYS 227 Cb 0.05 -0.11 -0.03 0.00 -0.57 0.00 0.00 32.23 31.57 1xxe h LYS 227 CO -0.12 0.33 0.07 0.28 -2.06 0.00 0.00 179.45 177.94 1xxe h VAL 228 N 0.51 0.93 -0.91 0.50 2.07 -0.34 0.30 116.25 119.30 1xxe h VAL 228 Ca 0.24 -0.06 0.12 0.00 0.82 0.00 0.00 66.70 67.82 1xxe h VAL 228 Cb 0.16 0.75 -0.08 0.00 -1.52 0.00 0.00 31.29 30.60 1xxe h VAL 228 CO -0.18 0.03 0.54 0.15 0.02 0.00 0.00 177.57 178.14 1xxe h PHE 229 N 0.17 0.98 -0.43 1.57 3.57 -0.01 -0.45 116.94 122.34 1xxe h PHE 229 Ca 0.10 0.03 -0.15 0.00 3.53 0.00 0.00 57.97 61.49 1xxe h PHE 229 Cb 0.08 -0.30 -0.01 0.00 2.79 0.00 0.00 35.95 38.51 1xxe h PHE 229 CO -0.13 0.36 -0.30 -0.44 -2.23 0.00 0.00 178.31 175.57 1xxe h ASP 230 N 0.85 0.99 -0.68 0.41 5.19 0.61 -2.23 116.42 121.57 1xxe h ASP 230 Ca 0.46 -0.41 0.04 0.00 -0.62 0.00 0.00 57.03 56.49 1xxe h ASP 230 Cb 0.48 -0.28 -0.04 0.00 0.18 0.00 0.00 39.33 39.68 1xxe h ASP 230 CO -0.28 1.21 0.45 0.25 -3.12 0.00 0.00 179.24 177.75 1xxe h LEU 231 N 0.80 0.69 -0.50 1.55 5.85 0.12 0.16 115.31 123.96 1xxe h LEU 231 Ca 0.08 -0.01 -0.17 0.00 0.84 0.00 0.00 57.88 58.63 1xxe h LEU 231 Cb 0.89 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.75 1xxe h LEU 231 CO 0.08 0.47 -0.64 0.40 -0.34 0.00 0.00 178.44 178.41 1xxe h ILE 232 N 0.79 1.36 -0.35 4.05 2.04 -1.12 -0.67 117.51 123.61 1xxe h ILE 232 Ca 0.27 -1.98 -0.04 0.00 1.00 0.00 0.00 64.86 64.12 1xxe h ILE 232 Cb 0.10 1.96 -0.02 0.00 -0.74 0.00 0.00 36.82 38.12 1xxe h ILE 232 CO -0.08 0.60 0.04 1.23 0.00 0.00 0.00 178.15 179.94 1xxe h GLY 233 N 1.24 0.57 1.71 5.37 0.00 -0.43 0.72 103.07 112.25 1xxe h GLY 233 Ca -0.01 -0.31 -0.16 0.00 0.00 0.00 0.00 47.33 46.85 1xxe h GLY 233 CO 0.11 0.30 -0.91 -0.55 0.00 0.00 0.00 176.54 175.49 1xxe h ASP 234 N 0.52 0.00 1.30 0.19 5.19 -0.81 -3.30 116.42 119.51 1xxe h ASP 234 Ca 0.12 0.00 -0.13 0.00 -0.62 0.00 0.00 57.03 56.39 1xxe h ASP 234 Cb 0.27 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.76 1xxe h ASP 234 CO 0.00 0.68 -0.71 -0.07 -3.12 0.00 0.00 179.24 176.02 1xxe h LEU 235 N 0.00 0.00 0.00 1.55 3.38 -0.54 -3.10 115.31 116.60 1xxe h LEU 235 Ca -0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1xxe h LEU 235 Cb 1.57 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.32 1xxe h LEU 235 CO 0.08 0.59 0.00 0.00 0.09 0.00 0.00 178.44 179.20 1xxe n TYR 236 N -3.20 0.00 -0.23 1.13 9.36 0.19 -2.54 117.16 121.87 1xxe n TYR 236 Ca -0.00 0.00 0.31 0.00 3.32 0.00 0.00 57.90 61.53 1xxe n TYR 236 Cb 0.78 -0.44 0.73 0.00 -0.63 0.00 0.00 39.34 39.78 1xxe n TYR 236 CO 0.00 0.00 0.00 -0.07 0.22 0.00 0.00 176.86 177.01 1xxe h LEU 237 N 0.00 0.01 -1.72 2.98 3.38 -1.69 1.61 115.31 119.87 1xxe h LEU 237 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1xxe h LEU 237 Cb 0.15 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.90 1xxe h LEU 237 CO 0.00 0.00 0.00 -0.07 0.09 0.00 0.00 178.44 178.46 1xxe h LEU 238 N 0.01 0.00 0.20 1.67 3.38 -1.77 -3.31 115.31 115.49 1xxe h LEU 238 Ca 0.48 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.36 1xxe h LEU 238 Cb 1.91 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.62 1xxe h LEU 238 CO -0.01 0.00 -0.08 0.61 0.09 0.00 0.00 178.44 179.05 1xxe n GLY 239 N -1.23 0.71 3.48 0.83 0.00 0.55 -5.00 105.19 104.52 1xxe n GLY 239 Ca -0.02 -0.67 -0.12 0.00 0.00 0.00 0.00 46.02 45.21 1xxe n GLY 239 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xxe s SER 240 N -2.77 -0.64 0.04 1.61 1.04 -1.26 -4.93 113.70 106.79 1xxe s SER 240 Ca 0.00 1.18 -0.38 0.00 0.48 0.00 0.00 55.95 57.22 1xxe s SER 240 Cb 0.00 1.16 -0.19 0.00 0.10 0.00 0.00 66.02 67.09 1xxe s SER 240 CO 0.00 -0.20 1.14 -2.65 0.98 0.00 0.00 173.24 172.51 1xxe n PRO 241 N 3.15 0.39 -3.60 4.02 -0.02 -1.26 -4.57 135.00 133.11 1xxe n PRO 241 Ca -0.16 0.14 -0.37 0.00 -2.02 0.00 0.00 63.50 61.09 1xxe n PRO 241 Cb 0.56 -1.67 -0.06 0.00 -0.02 0.00 0.00 33.50 32.31 1xxe n PRO 241 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1xxe s VAL 242 N 0.12 5.25 -0.16 -1.45 1.01 -1.26 -1.18 120.40 122.73 1xxe s VAL 242 Ca 0.88 0.59 0.01 0.00 0.00 0.00 0.00 61.98 63.46 1xxe s VAL 242 Cb -1.15 -3.61 0.01 0.00 0.00 0.00 0.00 36.38 31.63 1xxe s VAL 242 CO 0.54 0.51 -0.19 -0.75 0.00 0.00 0.00 175.10 175.21 1xxe s LYS 243 N -0.44 3.08 0.00 2.72 2.47 0.24 -4.62 119.74 123.19 1xxe s LYS 243 Ca 0.19 -0.81 0.00 0.00 -1.56 0.00 0.00 55.97 53.79 1xxe s LYS 243 Cb -0.14 -2.56 0.00 0.00 -1.46 0.00 0.00 37.83 33.67 1xxe s LYS 243 CO 0.08 -0.08 0.00 0.41 0.16 0.00 0.00 175.35 175.92 1xxe n GLY 244 N 4.27 2.36 3.48 5.54 0.00 -1.13 -2.21 105.19 117.49 1xxe n GLY 244 Ca -0.20 -1.25 -0.40 0.00 0.00 0.00 0.00 46.02 44.17 1xxe n GLY 244 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1xxe s LYS 245 N -2.00 3.34 0.12 1.61 2.20 0.11 -1.57 119.74 123.53 1xxe s LYS 245 Ca 0.00 -0.74 0.07 0.00 -0.36 0.00 0.00 55.97 54.93 1xxe s LYS 245 Cb 0.00 -3.74 -0.04 0.00 -1.51 0.00 0.00 37.83 32.54 1xxe s LYS 245 CO 0.00 -0.49 -0.05 -0.06 -0.36 0.00 0.00 175.35 174.39 1xxe s PHE 246 N 1.67 2.83 0.03 4.03 0.40 0.60 -0.22 117.98 127.31 1xxe s PHE 246 Ca 0.05 -0.12 0.05 0.00 -0.60 0.00 0.00 56.93 56.32 1xxe s PHE 246 Cb -0.18 -1.45 -0.02 0.00 0.51 0.00 0.00 43.02 41.89 1xxe s PHE 246 CO 0.09 0.46 -0.16 -0.47 0.70 0.00 0.00 175.22 175.84 1xxe s TYR 247 N -1.35 1.39 -0.04 0.36 6.14 0.68 -0.76 117.35 123.77 1xxe s TYR 247 Ca 0.24 -0.33 -0.00 0.00 0.64 0.00 0.00 57.07 57.62 1xxe s TYR 247 Cb -0.11 -0.84 0.03 0.00 0.42 0.00 0.00 41.96 41.46 1xxe s TYR 247 CO 0.16 0.03 0.00 -1.54 0.64 0.00 0.00 175.55 174.85 1xxe s SER 248 N -0.96 0.76 -0.28 4.32 1.04 0.37 -1.26 113.70 117.70 1xxe s SER 248 Ca 0.04 -0.04 -0.04 0.00 0.48 0.00 0.00 55.95 56.39 1xxe s SER 248 Cb -0.08 -0.27 0.02 0.00 0.10 0.00 0.00 66.02 65.79 1xxe s SER 248 CO 0.01 -0.13 0.02 0.12 0.98 0.00 0.00 173.24 174.24 1xxe s PHE 249 N 1.30 3.14 -1.29 5.02 2.19 -0.10 0.54 117.98 128.78 1xxe s PHE 249 Ca -0.06 -1.35 -0.18 0.00 0.33 0.00 0.00 56.93 55.67 1xxe s PHE 249 Cb -0.13 -2.16 0.01 0.00 -1.31 0.00 0.00 43.02 39.43 1xxe s PHE 249 CO -0.02 -0.68 0.54 0.54 1.83 0.00 0.00 175.22 177.43 1xxe n ARG 250 N 4.76 -1.25 -2.99 10.12 5.12 0.60 -2.29 116.66 130.73 1xxe n ARG 250 Ca -0.15 0.24 -0.35 0.00 -1.93 0.00 0.00 57.85 55.67 1xxe n ARG 250 Cb 0.47 -3.54 -0.06 0.00 -1.16 0.00 0.00 32.46 28.17 1xxe n ARG 250 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 1xxe s GLY 251 N -3.84 2.54 0.49 -0.13 0.00 -1.26 -4.33 107.32 100.79 1xxe s GLY 251 Ca 0.30 0.25 0.02 0.00 0.00 0.00 0.00 44.72 45.29 1xxe s GLY 251 CO 0.93 0.57 0.01 -0.32 0.00 0.00 0.00 173.10 174.29 1xxe s GLY 252 N -1.91 2.94 0.20 0.20 0.00 -1.26 -4.99 107.32 102.49 1xxe s GLY 252 Ca 0.51 -0.69 -0.06 0.00 0.00 0.00 0.00 44.72 44.48 1xxe s GLY 252 CO 0.19 -2.18 1.62 0.45 0.00 0.00 0.00 173.10 173.18 1xxe h HIS 253 N 1.41 0.96 -0.46 1.90 3.86 -1.94 -0.87 115.15 120.02 1xxe h HIS 253 Ca -0.44 -0.21 -0.12 0.00 -1.16 0.00 0.00 60.37 58.44 1xxe h HIS 253 Cb 1.30 -0.23 -0.02 0.00 1.06 0.00 0.00 27.41 29.53 1xxe h HIS 253 CO 1.39 0.97 -0.19 1.03 0.86 0.00 0.00 177.93 181.99 1xxe h SER 254 N 0.74 0.91 0.02 2.45 0.87 -1.90 -1.68 113.55 114.96 1xxe h SER 254 Ca 0.11 -0.32 -0.19 0.00 -1.23 0.00 0.00 61.79 60.15 1xxe h SER 254 Cb 0.72 -0.25 -0.00 0.00 -0.44 0.00 0.00 62.40 62.43 1xxe h SER 254 CO 0.06 1.07 -0.68 0.25 -0.53 0.00 0.00 176.83 177.00 1xxe h LEU 255 N 0.79 0.71 0.17 2.23 5.85 -1.93 -2.70 115.31 120.43 1xxe h LEU 255 Ca 0.11 -0.43 -0.01 0.00 0.84 0.00 0.00 57.88 58.39 1xxe h LEU 255 Cb 0.73 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.55 1xxe h LEU 255 CO 0.06 1.19 -0.08 0.78 -0.34 0.00 0.00 178.44 180.04 1xxe h ASN 256 N 0.44 -0.20 -0.76 1.25 2.35 -0.98 -1.93 115.58 115.74 1xxe h ASN 256 Ca -0.02 -0.02 0.14 0.00 -0.55 0.00 0.00 56.30 55.85 1xxe h ASN 256 Cb 1.27 0.05 -0.09 0.00 0.05 0.00 0.00 38.32 39.60 1xxe h ASN 256 CO 0.13 -0.12 0.32 0.58 -1.65 0.00 0.00 177.43 176.69 1xxe h VAL 257 N -0.26 0.69 -0.46 2.81 2.07 -1.30 0.37 116.25 120.17 1xxe h VAL 257 Ca -0.02 -0.16 0.07 0.00 0.82 0.00 0.00 66.70 67.40 1xxe h VAL 257 Cb 0.20 0.17 -0.06 0.00 -1.52 0.00 0.00 31.29 30.08 1xxe h VAL 257 CO 0.04 0.09 0.14 0.50 0.02 0.00 0.00 177.57 178.36 1xxe h LYS 258 N 0.48 0.30 -0.39 1.57 3.64 -1.06 0.38 116.57 121.48 1xxe h LYS 258 Ca 0.41 -0.02 0.08 0.00 -1.27 0.00 0.00 60.65 59.85 1xxe h LYS 258 Cb 0.60 -0.07 -0.07 0.00 -0.41 0.00 0.00 32.23 32.28 1xxe h LYS 258 CO -0.38 0.20 -0.07 1.25 -2.27 0.00 0.00 179.45 178.17 1xxe h LEU 259 N 0.30 -0.30 -0.23 5.20 5.85 -0.20 0.13 115.31 126.06 1xxe h LEU 259 Ca 0.22 0.11 -0.01 0.00 0.84 0.00 0.00 57.88 59.04 1xxe h LEU 259 Cb 0.24 0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.48 1xxe h LEU 259 CO -0.25 -0.11 0.09 0.58 -0.34 0.00 0.00 178.44 178.42 1xxe h VAL 260 N 0.03 1.17 -0.24 1.05 2.07 -0.62 -2.41 116.25 117.29 1xxe h VAL 260 Ca 0.19 -0.53 0.06 0.00 0.82 0.00 0.00 66.70 67.24 1xxe h VAL 260 Cb 0.28 1.10 -0.07 0.00 -1.52 0.00 0.00 31.29 31.08 1xxe h VAL 260 CO -0.38 0.17 -0.19 0.11 0.02 0.00 0.00 177.57 177.30 1xxe h LYS 261 N 0.21 -0.18 0.02 1.57 1.79 0.70 0.51 116.57 121.19 1xxe h LYS 261 Ca 0.08 0.01 0.01 0.00 -2.18 0.00 0.00 60.65 58.56 1xxe h LYS 261 Cb 0.19 0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 30.87 1xxe h LYS 261 CO -0.01 -0.12 -0.04 0.93 -1.08 0.00 0.00 179.45 179.13 1xxe h GLU 262 N -0.19 -0.08 -0.88 3.15 4.39 -0.91 0.46 114.58 120.51 1xxe h GLU 262 Ca 0.14 0.01 -0.02 0.00 0.34 0.00 0.00 59.36 59.82 1xxe h GLU 262 Cb 0.40 0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 29.02 1xxe h GLU 262 CO -0.36 -0.05 0.48 -0.07 -1.16 0.00 0.00 179.01 177.85 1xxe h LEU 263 N -0.08 1.10 -0.72 1.33 3.38 -0.96 -0.02 115.31 119.35 1xxe h LEU 263 Ca 0.01 -0.10 -0.13 0.00 0.09 0.00 0.00 57.88 57.75 1xxe h LEU 263 Cb 0.10 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 1xxe h LEU 263 CO -0.03 0.89 -0.48 0.00 0.09 0.00 0.00 178.44 178.91 1xxe h ALA 264 N 1.29 0.89 -0.21 1.53 0.00 0.48 -2.77 119.26 120.47 1xxe h ALA 264 Ca 0.31 -0.47 -0.13 0.00 0.00 0.00 0.00 54.91 54.62 1xxe h ALA 264 Cb 0.03 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1xxe h ALA 264 CO -0.05 0.66 -0.42 0.87 0.00 0.00 0.00 179.25 180.30 1xxe h LYS 265 N 0.32 0.50 -0.44 0.00 1.57 0.63 -2.97 116.57 116.17 1xxe h LYS 265 Ca 0.02 -0.26 0.03 0.00 -1.87 0.00 0.00 60.65 58.57 1xxe h LYS 265 Cb 0.96 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 33.24 1xxe h LYS 265 CO 0.08 0.83 0.25 0.87 -0.57 0.00 0.00 179.45 180.91 1xxe h LYS 266 N 0.41 0.48 -0.02 3.15 1.57 -0.75 0.12 116.57 121.52 1xxe h LYS 266 Ca 0.03 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1xxe h LYS 266 Cb 0.91 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 33.11 1xxe h LYS 266 CO 0.08 0.32 0.00 0.94 -0.57 0.00 0.00 179.45 180.21 1xxe n GLN 267 N -4.87 0.71 0.05 3.15 7.27 -1.12 -3.11 117.38 119.47 1xxe n GLN 267 Ca 0.02 0.00 -0.09 0.00 0.07 0.00 0.00 57.00 57.00 1xxe n GLN 267 Cb 0.09 -1.01 -0.13 0.00 2.41 0.00 0.00 30.24 31.60 1xxe n GLN 267 CO 0.00 0.00 0.00 -0.22 0.07 0.00 0.00 177.06 176.91 1xxe h LYS 268 N 0.01 0.05 -0.06 3.69 1.63 -0.69 -3.20 116.57 118.00 1xxe h LYS 268 Ca 0.00 -0.09 0.00 0.00 -0.85 0.00 0.00 60.65 59.71 1xxe h LYS 268 Cb 0.01 0.03 0.00 0.00 -0.60 0.00 0.00 32.23 31.67 1xxe h LYS 268 CO 0.00 0.95 0.00 1.28 -3.45 0.00 0.00 179.45 178.23 1xxe n LEU 269 N -3.33 1.24 -0.71 5.20 4.77 -1.18 -5.14 117.00 117.85 1xxe n LEU 269 Ca -0.05 -0.46 0.13 0.00 -0.03 0.00 0.00 56.01 55.60 1xxe n LEU 269 Cb 0.98 -0.03 0.32 0.00 -2.33 0.00 0.00 43.42 42.35 1xxe n LEU 269 CO 0.48 0.23 0.75 0.41 -1.33 0.00 0.00 177.39 177.93