#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 1.70 -4.79 3.23 1.02 0.35 -4.67 120.64 117.49 1xxe n GLU 4 Ca 0.00 0.61 -0.33 0.00 -0.02 0.00 0.00 57.16 57.42 1xxe n GLU 4 Cb 0.00 -2.30 -0.14 0.00 -0.02 0.00 0.00 31.44 28.98 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 0.47 3.21 0.31 3.49 2.47 -1.26 -0.50 119.74 127.94 1xxe s LYS 5 Ca 0.79 -0.68 0.04 0.00 -1.56 0.00 0.00 55.97 54.56 1xxe s LYS 5 Cb -0.79 -2.59 -0.04 0.00 -1.46 0.00 0.00 37.83 32.96 1xxe s LYS 5 CO 0.44 0.31 0.18 -0.08 0.16 0.00 0.00 175.35 176.35 1xxe s THR 6 N 0.11 0.26 0.14 3.43 -1.32 -0.68 -2.29 115.64 115.29 1xxe s THR 6 Ca -0.06 -2.00 -0.26 0.00 -1.21 0.00 0.00 61.69 58.16 1xxe s THR 6 Cb -0.15 -2.49 -0.07 0.00 -1.51 0.00 0.00 72.50 68.28 1xxe s THR 6 CO 0.05 0.00 0.82 0.68 -2.21 0.00 0.00 174.62 173.95 1xxe s VAL 7 N -3.59 4.43 0.00 5.08 -7.23 -1.26 0.13 120.40 117.96 1xxe s VAL 7 Ca 0.36 1.78 -0.22 0.00 -1.81 0.00 0.00 61.98 62.09 1xxe s VAL 7 Cb 0.04 -4.18 -0.18 0.00 0.56 0.00 0.00 36.38 32.62 1xxe s VAL 7 CO 0.19 0.46 1.22 0.50 -0.31 0.00 0.00 175.10 177.16 1xxe h LYS 8 N 4.75 0.26 -5.69 4.82 3.64 0.02 -3.42 116.57 120.95 1xxe h LYS 8 Ca -0.46 -0.18 -0.47 0.00 -1.27 0.00 0.00 60.65 58.28 1xxe h LYS 8 Cb 1.21 0.03 -0.17 0.00 -0.41 0.00 0.00 32.23 32.88 1xxe h LYS 8 CO 0.68 0.78 -0.76 -2.00 -2.27 0.00 0.00 179.45 175.88 1xxe s GLU 9 N -3.88 1.22 0.25 1.90 2.12 -1.26 -4.97 118.70 114.09 1xxe s GLU 9 Ca -0.15 -1.41 -0.30 0.00 0.36 0.00 0.00 54.97 53.47 1xxe s GLU 9 Cb 0.03 -1.15 -0.10 0.00 0.26 0.00 0.00 34.13 33.17 1xxe s GLU 9 CO 0.74 0.22 1.44 0.21 -0.54 0.00 0.00 175.26 177.34 1xxe s LYS 10 N -3.01 4.26 0.32 4.30 2.36 -1.26 -4.84 119.74 121.87 1xxe s LYS 10 Ca 0.16 2.31 0.10 0.00 -2.55 0.00 0.00 55.97 55.99 1xxe s LYS 10 Cb -0.04 -3.10 -0.05 0.00 -1.05 0.00 0.00 37.83 33.58 1xxe s LYS 10 CO 0.06 -0.43 -0.06 -0.51 1.55 0.00 0.00 175.35 175.96 1xxe s LEU 11 N -0.42 2.86 -0.07 5.43 1.43 -0.80 -4.95 118.68 122.16 1xxe s LEU 11 Ca 0.59 -1.02 -0.20 0.00 -1.03 0.00 0.00 54.13 52.47 1xxe s LEU 11 Cb -0.42 -1.25 0.04 0.00 0.03 0.00 0.00 46.19 44.60 1xxe s LEU 11 CO 0.44 -0.15 0.47 -0.94 0.23 0.00 0.00 176.35 176.40 1xxe s SER 12 N -3.64 -0.42 0.17 2.29 1.04 -1.26 -0.73 113.70 111.15 1xxe s SER 12 Ca 0.33 0.53 0.04 0.00 0.48 0.00 0.00 55.95 57.33 1xxe s SER 12 Cb -0.01 0.57 -0.05 0.00 0.10 0.00 0.00 66.02 66.64 1xxe s SER 12 CO 0.18 -0.42 -0.07 -0.36 0.98 0.00 0.00 173.24 173.54 1xxe s PHE 13 N -0.86 1.37 -0.13 5.02 0.08 -0.43 -4.96 117.98 118.06 1xxe s PHE 13 Ca -0.09 -0.80 -0.11 0.00 0.12 0.00 0.00 56.93 56.05 1xxe s PHE 13 Cb -0.03 -0.72 0.04 0.00 -0.57 0.00 0.00 43.02 41.74 1xxe s PHE 13 CO 0.05 0.06 0.35 -1.83 -0.10 0.00 0.00 175.22 173.74 1xxe s GLU 14 N -3.78 0.37 0.00 0.44 -1.05 -1.26 -1.51 118.70 111.92 1xxe s GLU 14 Ca 0.20 0.55 0.00 0.00 -0.15 0.00 0.00 54.97 55.57 1xxe s GLU 14 Cb 0.03 0.11 0.00 0.00 -0.44 0.00 0.00 34.13 33.83 1xxe s GLU 14 CO 0.03 -0.09 0.00 0.41 0.95 0.00 0.00 175.26 176.57 1xxe n GLY 15 N 3.35 1.79 3.80 -3.83 0.00 -0.75 -4.97 105.19 104.58 1xxe n GLY 15 Ca -0.17 -0.79 -0.31 0.00 0.00 0.00 0.00 46.02 44.76 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 3.63 0.02 1.61 0.11 -1.26 -2.10 120.40 120.41 1xxe s VAL 16 Ca 0.00 0.53 -0.16 0.00 -2.93 0.00 0.00 61.98 59.43 1xxe s VAL 16 Cb 0.00 -3.21 -0.06 0.00 -1.53 0.00 0.00 36.38 31.58 1xxe s VAL 16 CO 0.00 -0.69 0.44 -0.83 -3.33 0.00 0.00 175.10 170.69 1xxe s GLY 17 N -3.72 2.52 0.12 6.54 0.00 -0.67 -1.57 107.32 110.53 1xxe s GLY 17 Ca 0.59 -0.17 -0.24 0.00 0.00 0.00 0.00 44.72 44.90 1xxe s GLY 17 CO 0.55 0.20 1.67 1.19 0.00 0.00 0.00 173.10 176.72 1xxe h ILE 18 N 3.66 0.62 0.15 0.90 2.10 -1.83 0.35 117.51 123.46 1xxe h ILE 18 Ca -0.51 0.00 -0.34 0.00 1.08 0.00 0.00 64.86 65.08 1xxe h ILE 18 Cb 1.22 0.62 -0.00 0.00 -1.09 0.00 0.00 36.82 37.57 1xxe h ILE 18 CO 0.62 0.00 -1.79 0.45 -1.08 0.00 0.00 178.15 176.35 1xxe h HIS 19 N -0.25 0.56 -0.30 2.19 -0.00 -1.89 3.11 115.15 118.57 1xxe h HIS 19 Ca 0.05 -0.41 -0.12 0.00 -0.00 0.00 0.00 60.37 59.89 1xxe h HIS 19 Cb 0.32 -0.02 -0.01 0.00 -0.00 0.00 0.00 27.41 27.69 1xxe h HIS 19 CO -0.21 1.62 -0.32 1.15 -0.00 0.00 0.00 177.93 180.17 1xxe h THR 20 N 0.08 1.28 -1.33 2.45 2.02 -1.92 -2.38 112.91 113.13 1xxe h THR 20 Ca -0.35 -1.46 -0.35 0.00 0.77 0.00 0.00 66.41 65.03 1xxe h THR 20 Cb 2.06 1.40 -0.10 0.00 -1.74 0.00 0.00 68.15 69.77 1xxe h THR 20 CO 0.14 0.47 -0.36 0.61 0.37 0.00 0.00 175.52 176.76 1xxe n GLY 21 N -0.12 1.07 3.48 2.16 0.00 0.12 -4.66 105.19 107.25 1xxe n GLY 21 Ca -0.01 -0.19 -0.26 0.00 0.00 0.00 0.00 46.02 45.56 1xxe n GLY 21 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1xxe s GLU 22 N -3.89 1.73 0.22 1.61 2.12 -1.26 -4.80 118.70 114.43 1xxe s GLU 22 Ca 0.00 -1.46 -0.30 0.00 0.36 0.00 0.00 54.97 53.57 1xxe s GLU 22 Cb 0.00 -1.95 -0.09 0.00 0.26 0.00 0.00 34.13 32.35 1xxe s GLU 22 CO 0.00 0.40 1.22 -0.47 -0.54 0.00 0.00 175.26 175.87 1xxe s TYR 23 N -1.78 3.38 0.06 5.30 5.04 -1.26 -1.67 117.35 126.41 1xxe s TYR 23 Ca 0.23 1.43 -0.06 0.00 -2.44 0.00 0.00 57.07 56.23 1xxe s TYR 23 Cb -0.08 -3.47 -0.01 0.00 0.35 0.00 0.00 41.96 38.75 1xxe s TYR 23 CO 0.12 -1.30 0.10 0.45 -1.34 0.00 0.00 175.55 173.58 1xxe s SER 24 N -0.07 0.22 0.02 4.32 0.15 -0.89 -4.86 113.70 112.60 1xxe s SER 24 Ca 0.52 -0.67 0.01 0.00 0.70 0.00 0.00 55.95 56.52 1xxe s SER 24 Cb -0.34 0.26 -0.02 0.00 -1.71 0.00 0.00 66.02 64.21 1xxe s SER 24 CO 0.39 -0.60 -0.06 -0.75 1.20 0.00 0.00 173.24 173.43 1xxe s LYS 25 N -3.28 0.41 0.13 5.44 2.20 -0.92 -1.82 119.74 121.91 1xxe s LYS 25 Ca 0.01 -0.55 0.09 0.00 -0.36 0.00 0.00 55.97 55.16 1xxe s LYS 25 Cb 0.03 -0.20 -0.04 0.00 -1.51 0.00 0.00 37.83 36.11 1xxe s LYS 25 CO -0.08 0.04 -0.22 -0.51 -0.36 0.00 0.00 175.35 174.22 1xxe s LEU 26 N -1.13 2.34 -0.04 5.43 1.43 -0.57 -1.12 118.68 125.02 1xxe s LEU 26 Ca -0.08 -0.74 0.01 0.00 -1.03 0.00 0.00 54.13 52.29 1xxe s LEU 26 Cb -0.08 -0.98 0.02 0.00 0.03 0.00 0.00 46.19 45.18 1xxe s LEU 26 CO -0.00 0.08 -0.04 -0.63 0.23 0.00 0.00 176.35 175.99 1xxe s ILE 27 N -1.31 0.48 -0.30 -0.59 1.01 -0.59 -1.31 121.20 118.59 1xxe s ILE 27 Ca 0.11 -0.09 -0.03 0.00 0.00 0.00 0.00 60.65 60.64 1xxe s ILE 27 Cb -0.09 -0.52 0.04 0.00 0.01 0.00 0.00 42.46 41.90 1xxe s ILE 27 CO 0.05 0.21 0.01 -0.63 0.00 0.00 0.00 174.94 174.59 1xxe s ILE 28 N 0.95 3.16 0.09 2.92 1.01 0.10 -0.04 121.20 129.38 1xxe s ILE 28 Ca -0.11 -1.27 0.04 0.00 0.00 0.00 0.00 60.65 59.31 1xxe s ILE 28 Cb -0.14 -2.78 -0.04 0.00 0.01 0.00 0.00 42.46 39.51 1xxe s ILE 28 CO -0.00 -0.08 0.05 -1.00 0.00 0.00 0.00 174.94 173.91 1xxe s HIS 29 N 1.30 3.11 0.95 3.97 3.76 -0.99 -1.90 115.29 125.49 1xxe s HIS 29 Ca -0.04 0.03 -0.11 0.00 -0.15 0.00 0.00 55.06 54.80 1xxe s HIS 29 Cb -0.19 -1.58 0.16 0.00 1.11 0.00 0.00 32.58 32.08 1xxe s HIS 29 CO -0.01 0.51 1.12 -1.25 -0.85 0.00 0.00 174.74 174.26 1xxe s PRO 30 N -2.39 0.75 0.05 8.40 0.04 -1.26 -1.76 135.00 138.83 1xxe s PRO 30 Ca 0.28 1.37 -0.02 0.00 0.04 0.00 0.00 61.00 62.67 1xxe s PRO 30 Cb -0.12 -1.71 -0.04 0.00 0.04 0.00 0.00 34.50 32.68 1xxe s PRO 30 CO 0.21 -2.75 -0.01 -1.21 0.04 0.00 0.00 177.00 173.27 1xxe s GLU 31 N -4.64 0.61 0.63 4.56 0.41 -1.25 -4.57 118.70 114.44 1xxe s GLU 31 Ca 0.67 -1.16 -0.19 0.00 -0.41 0.00 0.00 54.97 53.88 1xxe s GLU 31 Cb -0.23 0.21 -0.02 0.00 -1.78 0.00 0.00 34.13 32.32 1xxe s GLU 31 CO 0.59 -0.12 1.29 1.17 -0.49 0.00 0.00 175.26 177.70 1xxe n LYS 32 N 0.19 1.21 -1.48 1.61 4.81 -1.26 -4.85 118.16 118.40 1xxe n LYS 32 Ca -0.15 0.47 -0.39 0.00 -0.87 0.00 0.00 58.31 57.37 1xxe n LYS 32 Cb 0.61 -2.53 0.03 0.00 0.02 0.00 0.00 35.03 33.16 1xxe n LYS 32 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 1xxe n GLU 33 N -1.71 0.60 -2.06 1.64 4.71 -1.26 -1.66 120.64 120.90 1xxe n GLU 33 Ca 0.15 0.23 -0.20 0.00 -0.01 0.00 0.00 57.16 57.33 1xxe n GLU 33 Cb 0.47 -1.69 -0.04 0.00 -1.01 0.00 0.00 31.44 29.18 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 1.73 0.49 0.13 0.62 0.00 -1.26 -4.85 105.19 102.04 1xxe n GLY 34 Ca 0.11 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.93 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 1.35 0.00 2.61 2.02 -1.51 -3.51 112.91 113.88 1xxe h THR 35 Ca -0.44 -2.86 0.00 0.00 0.77 0.00 0.00 66.41 63.88 1xxe h THR 35 Cb 1.32 2.98 0.00 0.00 -1.74 0.00 0.00 68.15 70.71 1xxe h THR 35 CO 0.57 0.85 0.00 0.61 0.37 0.00 0.00 175.52 177.92 1xxe n GLY 36 N 1.64 -3.35 3.67 2.16 0.00 0.72 -4.89 105.19 105.14 1xxe n GLY 36 Ca -0.14 -1.99 -0.37 0.00 0.00 0.00 0.00 46.02 43.53 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 -0.70 5.33 -0.03 -0.61 -1.09 -1.23 -2.31 121.20 120.57 1xxe s ILE 37 Ca 0.00 0.29 -0.02 0.00 -2.23 0.00 0.00 60.65 58.69 1xxe s ILE 37 Cb 0.00 -3.55 0.01 0.00 -1.58 0.00 0.00 42.46 37.34 1xxe s ILE 37 CO 0.00 0.33 0.07 0.00 -1.23 0.00 0.00 174.94 174.11 1xxe s ARG 38 N 1.06 0.08 0.15 2.79 1.70 -1.02 -1.83 118.95 121.89 1xxe s ARG 38 Ca 0.10 0.09 -0.01 0.00 -0.47 0.00 0.00 55.73 55.43 1xxe s ARG 38 Cb -0.14 0.04 -0.04 0.00 -0.57 0.00 0.00 34.95 34.24 1xxe s ARG 38 CO 0.05 -0.01 0.33 -0.06 -1.08 0.00 0.00 175.30 174.53 1xxe s PHE 39 N 0.02 3.49 -0.01 5.89 0.08 -0.68 -1.38 117.98 125.39 1xxe s PHE 39 Ca -0.00 0.36 0.03 0.00 0.12 0.00 0.00 56.93 57.43 1xxe s PHE 39 Cb -0.01 -1.86 -0.01 0.00 -0.57 0.00 0.00 43.02 40.58 1xxe s PHE 39 CO 0.00 0.46 -0.08 0.12 -0.10 0.00 0.00 175.22 175.61 1xxe s PHE 40 N -1.71 0.75 -0.25 0.36 2.19 0.56 0.27 117.98 120.15 1xxe s PHE 40 Ca 0.38 -0.15 -0.27 0.00 0.33 0.00 0.00 56.93 57.23 1xxe s PHE 40 Cb -0.12 -0.49 0.14 0.00 -1.31 0.00 0.00 43.02 41.25 1xxe s PHE 40 CO 0.27 -0.01 1.11 0.21 1.83 0.00 0.00 175.22 178.63 1xxe s LYS 41 N -0.22 0.43 -1.37 10.12 2.20 -0.57 -1.23 119.74 129.10 1xxe s LYS 41 Ca 0.03 0.34 0.00 0.00 -0.36 0.00 0.00 55.97 55.98 1xxe s LYS 41 Cb -0.03 0.21 0.00 0.00 -1.51 0.00 0.00 37.83 36.49 1xxe s LYS 41 CO -0.00 -0.09 0.00 0.09 -0.36 0.00 0.00 175.35 174.99 1xxe n ASN 42 N 1.54 -4.64 -0.78 1.43 5.03 -1.26 -0.22 115.26 116.37 1xxe n ASN 42 Ca -0.11 0.14 -0.10 0.00 0.87 0.00 0.00 54.58 55.39 1xxe n ASN 42 Cb 0.57 -3.93 -0.04 0.00 -1.02 0.00 0.00 39.78 35.36 1xxe n ASN 42 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1xxe n GLY 43 N -0.83 0.99 3.17 7.41 0.00 -1.26 -5.01 105.19 109.66 1xxe n GLY 43 Ca -0.18 -0.58 -0.27 0.00 0.00 0.00 0.00 46.02 44.98 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 -2.37 1.59 0.01 1.61 1.01 0.69 -5.13 120.40 117.82 1xxe s VAL 44 Ca 0.00 -0.81 -0.12 0.00 0.00 0.00 0.00 61.98 61.05 1xxe s VAL 44 Cb 0.00 -1.36 -0.05 0.00 0.00 0.00 0.00 36.38 34.96 1xxe s VAL 44 CO 0.00 0.45 0.37 -0.31 0.00 0.00 0.00 175.10 175.61 1xxe s TYR 45 N -0.05 3.66 -0.35 5.22 1.51 -1.26 -1.52 117.35 124.56 1xxe s TYR 45 Ca -0.03 0.85 -0.00 0.00 -1.01 0.00 0.00 57.07 56.87 1xxe s TYR 45 Cb -0.12 -2.19 0.12 0.00 -0.11 0.00 0.00 41.96 39.67 1xxe s TYR 45 CO 0.02 0.61 0.17 0.42 -1.11 0.00 0.00 175.55 175.67 1xxe s ILE 46 N -1.20 0.64 0.37 2.71 1.01 0.14 -4.93 121.20 119.95 1xxe s ILE 46 Ca 0.26 -1.69 -0.25 0.00 0.00 0.00 0.00 60.65 58.98 1xxe s ILE 46 Cb -0.15 -1.48 -0.13 0.00 0.01 0.00 0.00 42.46 40.72 1xxe s ILE 46 CO 0.14 -0.83 0.80 -2.65 0.00 0.00 0.00 174.94 172.40 1xxe n PRO 47 N 4.34 0.95 -2.98 2.79 -0.02 -1.26 -1.69 135.00 137.12 1xxe n PRO 47 Ca 0.04 0.34 -0.44 0.00 -2.02 0.00 0.00 63.50 61.42 1xxe n PRO 47 Cb 0.39 -1.71 0.00 0.00 -0.02 0.00 0.00 33.50 32.15 1xxe n PRO 47 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1xxe n ALA 48 N -0.43 3.97 -2.41 3.55 0.00 -0.76 -4.82 120.51 119.61 1xxe n ALA 48 Ca 0.11 -4.30 -0.09 0.00 0.00 0.00 0.00 53.44 49.16 1xxe n ALA 48 Cb 0.36 -2.98 -0.10 0.00 0.00 0.00 0.00 19.45 16.73 1xxe n ALA 48 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1xxe s ARG 49 N 1.16 0.57 0.16 0.00 0.52 -1.26 -4.56 118.95 115.53 1xxe s ARG 49 Ca 0.41 -1.04 -0.18 0.00 -0.52 0.00 0.00 55.73 54.40 1xxe s ARG 49 Cb -0.03 0.04 0.07 0.00 0.52 0.00 0.00 34.95 35.55 1xxe s ARG 49 CO -0.01 -0.06 1.67 1.12 0.02 0.00 0.00 175.30 178.05 1xxe h HIS 50 N 3.64 -0.20 0.00 -0.53 2.07 -1.93 0.12 115.15 118.31 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 1.17 0.14 0.00 0.00 2.57 0.00 0.00 27.41 31.29 1xxe h HIS 50 CO 0.59 -0.16 0.58 0.93 -3.07 0.00 0.00 177.93 176.79 1xxe h GLU 51 N -0.01 0.00 -0.22 5.12 5.08 -1.97 2.80 114.58 125.39 1xxe h GLU 51 Ca 0.17 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 1xxe h GLU 51 Cb 0.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.52 1xxe h GLU 51 CO -0.37 0.00 0.00 1.19 -1.00 0.00 0.00 179.01 178.83 1xxe n PHE 52 N -1.99 0.26 -1.71 4.33 3.01 0.42 -4.95 117.46 116.83 1xxe n PHE 52 Ca -0.00 -0.13 -0.43 0.00 1.01 0.00 0.00 57.45 57.89 1xxe n PHE 52 Cb 0.59 -0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 40.03 1xxe n PHE 52 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 1xxe n VAL 53 N 1.42 0.67 0.00 -4.37 0.31 0.94 -2.51 118.33 114.80 1xxe n VAL 53 Ca 0.17 -0.17 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1xxe n VAL 53 Cb 0.60 -1.77 0.00 0.00 -0.91 0.00 0.00 33.84 31.76 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 2.59 0.00 -3.67 2.52 0.24 -0.99 -4.85 118.33 114.18 1xxe n VAL 54 Ca 0.12 0.00 -0.10 0.00 -2.04 0.00 0.00 64.34 62.32 1xxe n VAL 54 Cb 0.34 -0.66 -0.10 0.00 -1.47 0.00 0.00 33.84 31.94 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 -1.97 -0.70 -0.13 6.34 5.65 -1.19 -5.05 115.29 118.25 1xxe s HIS 55 Ca 0.00 1.39 -0.02 0.00 0.25 0.00 0.00 55.06 56.68 1xxe s HIS 55 Cb 0.00 0.24 -0.02 0.00 -1.18 0.00 0.00 32.58 31.62 1xxe s HIS 55 CO 0.00 -0.43 -0.07 0.95 -0.65 0.00 0.00 174.74 174.54 1xxe s THR 56 N 2.33 3.62 0.00 0.89 -4.23 -1.26 -1.88 115.64 115.10 1xxe s THR 56 Ca -0.03 -0.47 0.00 0.00 -1.18 0.00 0.00 61.69 60.01 1xxe s THR 56 Cb -0.11 -2.54 0.00 0.00 1.34 0.00 0.00 72.50 71.19 1xxe s THR 56 CO -0.12 0.53 0.00 -3.20 -0.54 0.00 0.00 174.62 171.29 1xxe n ASN 57 N 3.18 0.00 0.07 3.99 2.85 -1.26 -4.85 115.26 119.23 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 41.64 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 0.12 -4.23 1.20 8.25 -1.26 -4.40 115.22 114.89 1xxe n HIS 58 Ca 0.00 0.06 -0.13 0.00 -0.26 0.00 0.00 57.72 57.39 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 -2.68 1.01 -0.28 0.41 0.15 -1.26 -5.06 113.70 105.99 1xxe s SER 59 Ca -0.00 -1.22 -0.10 0.00 0.70 0.00 0.00 55.95 55.33 1xxe s SER 59 Cb 0.01 0.17 -0.04 0.00 -1.71 0.00 0.00 66.02 64.44 1xxe s SER 59 CO 0.03 -0.63 0.16 -0.89 1.20 0.00 0.00 173.24 173.11 1xxe s THR 60 N -3.76 5.04 -0.07 6.45 2.01 -1.26 -4.61 115.64 119.43 1xxe s THR 60 Ca 0.27 0.06 0.04 0.00 0.31 0.00 0.00 61.69 62.36 1xxe s THR 60 Cb 0.07 -3.40 -0.02 0.00 0.01 0.00 0.00 72.50 69.16 1xxe s THR 60 CO 0.05 0.26 -0.19 -1.81 -0.69 0.00 0.00 174.62 172.24 1xxe s ASP 61 N 1.72 3.56 0.22 3.53 1.11 -0.79 -1.52 116.67 124.50 1xxe s ASP 61 Ca 0.07 -0.38 0.09 0.00 0.18 0.00 0.00 52.55 52.51 1xxe s ASP 61 Cb -0.16 -1.01 -0.05 0.00 1.07 0.00 0.00 42.92 42.77 1xxe s ASP 61 CO 0.09 0.26 -0.17 -0.76 1.18 0.00 0.00 175.17 175.77 1xxe s LEU 62 N -0.22 2.54 -0.28 1.23 1.43 -0.75 -2.34 118.68 120.29 1xxe s LEU 62 Ca -0.01 -0.99 -0.27 0.00 -1.03 0.00 0.00 54.13 51.83 1xxe s LEU 62 Cb -0.13 -0.84 0.19 0.00 0.03 0.00 0.00 46.19 45.43 1xxe s LEU 62 CO 0.03 -0.08 1.36 -0.83 0.23 0.00 0.00 176.35 177.07 1xxe s GLY 63 N -3.23 0.17 0.01 -3.19 0.00 -1.04 0.04 107.32 100.08 1xxe s GLY 63 Ca 0.23 3.07 -0.07 0.00 0.00 0.00 0.00 44.72 47.95 1xxe s GLY 63 CO 0.09 1.47 0.13 -0.12 0.00 0.00 0.00 173.10 174.67 1xxe s PHE 64 N -0.56 0.07 -1.79 1.90 5.36 0.42 -4.77 117.98 118.61 1xxe s PHE 64 Ca 0.07 -0.21 0.00 0.00 -0.96 0.00 0.00 56.93 55.84 1xxe s PHE 64 Cb -0.03 -0.06 0.00 0.00 -0.34 0.00 0.00 43.02 42.59 1xxe s PHE 64 CO -0.10 -0.31 0.00 1.63 -1.46 0.00 0.00 175.22 174.97 1xxe n LYS 65 N 1.27 -1.57 -0.44 10.12 5.02 -1.26 -0.56 118.16 130.73 1xxe n LYS 65 Ca -0.22 1.00 0.00 0.00 -2.02 0.00 0.00 58.31 57.08 1xxe n LYS 65 Cb 0.56 -5.46 0.00 0.00 -0.02 0.00 0.00 35.03 30.11 1xxe n LYS 65 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1xxe n GLY 66 N -0.57 0.73 3.87 0.72 0.00 -1.26 -5.05 105.19 103.63 1xxe n GLY 66 Ca -0.20 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.45 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 -0.56 3.51 0.04 1.61 -1.52 0.28 -5.09 119.66 117.92 1xxe s GLN 67 Ca 0.00 -0.07 0.02 0.00 -1.95 0.00 0.00 55.36 53.36 1xxe s GLN 67 Cb 0.00 -3.20 -0.02 0.00 -0.22 0.00 0.00 33.01 29.57 1xxe s GLN 67 CO 0.00 0.76 -0.07 -0.98 -0.25 0.00 0.00 175.29 174.75 1xxe s ARG 68 N -1.01 0.51 0.00 2.91 1.70 -1.26 -0.43 118.95 121.37 1xxe s ARG 68 Ca 0.16 -0.73 0.03 0.00 -0.47 0.00 0.00 55.73 54.72 1xxe s ARG 68 Cb -0.13 -0.27 -0.01 0.00 -0.57 0.00 0.00 34.95 33.98 1xxe s ARG 68 CO 0.05 0.04 -0.11 0.42 -1.08 0.00 0.00 175.30 174.62 1xxe s ILE 69 N -1.35 0.86 0.13 4.99 1.01 0.11 -4.86 121.20 122.08 1xxe s ILE 69 Ca -0.10 -0.59 0.08 0.00 0.00 0.00 0.00 60.65 60.04 1xxe s ILE 69 Cb -0.10 -0.74 -0.04 0.00 0.01 0.00 0.00 42.46 41.59 1xxe s ILE 69 CO 0.00 0.15 -0.13 -0.54 0.00 0.00 0.00 174.94 174.43 1xxe s LYS 70 N -0.49 1.98 -0.89 2.79 1.02 -0.79 -1.81 119.74 121.55 1xxe s LYS 70 Ca 0.03 -1.14 -0.05 0.00 0.02 0.00 0.00 55.97 54.83 1xxe s LYS 70 Cb -0.05 -2.20 -0.02 0.00 -0.52 0.00 0.00 37.83 35.04 1xxe s LYS 70 CO -0.00 0.48 0.76 2.41 -0.92 0.00 0.00 175.35 178.08 1xxe n THR 71 N 0.58 -8.58 0.30 2.17 -1.04 -0.57 -2.20 114.28 104.93 1xxe n THR 71 Ca -0.14 -0.63 0.03 0.00 -2.04 0.00 0.00 64.05 61.28 1xxe n THR 71 Cb 0.53 -6.03 0.01 0.00 -1.82 0.00 0.00 70.33 63.01 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 -2.61 0.00 0.17 12.58 0.24 -1.22 -4.19 118.33 123.31 1xxe n VAL 72 Ca -0.07 -0.45 0.03 0.00 -2.04 0.00 0.00 64.34 61.82 1xxe n VAL 72 Cb 0.57 1.09 0.30 0.00 -1.47 0.00 0.00 33.84 34.34 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 0.89 0.00 0.76 7.34 4.11 -1.88 -2.41 114.58 123.38 1xxe h GLU 73 Ca 0.00 0.00 -0.04 0.00 0.07 0.00 0.00 59.36 59.39 1xxe h GLU 73 Cb 0.24 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.50 1xxe h GLU 73 CO 0.00 0.45 -0.36 0.45 0.07 0.00 0.00 179.01 179.61 1xxe h HIS 74 N 0.00 -0.94 -0.58 2.06 3.86 -1.92 0.57 115.15 118.20 1xxe h HIS 74 Ca -0.00 -0.02 0.03 0.00 -1.16 0.00 0.00 60.37 59.21 1xxe h HIS 74 Cb 0.88 0.31 -0.04 0.00 1.06 0.00 0.00 27.41 29.62 1xxe h HIS 74 CO 0.00 -0.59 0.36 0.97 0.86 0.00 0.00 177.93 179.53 1xxe h ILE 75 N -1.22 1.07 -0.89 2.45 6.09 -1.87 -1.56 117.51 121.58 1xxe h ILE 75 Ca -0.10 -0.24 0.09 0.00 -1.37 0.00 0.00 64.86 63.23 1xxe h ILE 75 Cb 0.78 0.30 -0.07 0.00 0.47 0.00 0.00 36.82 38.30 1xxe h ILE 75 CO 0.17 0.13 0.54 -0.07 -3.07 0.00 0.00 178.15 175.85 1xxe h LEU 76 N 0.70 0.81 -0.47 2.19 3.38 -1.40 -1.12 115.31 119.40 1xxe h LEU 76 Ca 0.23 0.04 0.05 0.00 0.09 0.00 0.00 57.88 58.29 1xxe h LEU 76 Cb 0.02 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 40.59 1xxe h LEU 76 CO -0.10 0.48 0.21 -1.28 0.09 0.00 0.00 178.44 177.84 1xxe h SER 77 N 0.92 0.28 0.23 -0.43 0.87 0.14 0.50 113.55 116.07 1xxe h SER 77 Ca 0.42 0.04 0.00 0.00 -1.23 0.00 0.00 61.79 61.01 1xxe h SER 77 Cb 0.32 -0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.25 1xxe h SER 77 CO -0.22 0.20 -0.20 0.58 -0.53 0.00 0.00 176.83 176.66 1xxe h VAL 78 N 0.42 0.56 -0.74 2.23 2.07 -0.89 -1.80 116.25 118.11 1xxe h VAL 78 Ca 0.21 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.87 1xxe h VAL 78 Cb 0.16 0.56 -0.09 0.00 -1.52 0.00 0.00 31.29 30.40 1xxe h VAL 78 CO -0.17 0.00 0.29 -0.07 0.02 0.00 0.00 177.57 177.63 1xxe h LEU 79 N -0.45 0.26 0.08 2.57 3.38 -0.79 0.14 115.31 120.50 1xxe h LEU 79 Ca -0.01 0.11 0.02 0.00 0.09 0.00 0.00 57.88 58.09 1xxe h LEU 79 Cb 0.41 0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.21 1xxe h LEU 79 CO -0.03 0.10 -0.31 -0.74 0.09 0.00 0.00 178.44 177.54 1xxe h HIS 80 N 0.43 -0.86 -0.62 1.13 2.76 -0.18 0.63 115.15 118.44 1xxe h HIS 80 Ca 0.40 0.02 -0.03 0.00 -2.20 0.00 0.00 60.37 58.57 1xxe h HIS 80 Cb 0.61 0.37 -0.03 0.00 1.55 0.00 0.00 27.41 29.91 1xxe h HIS 80 CO -0.17 -0.42 0.27 -0.07 -1.30 0.00 0.00 177.93 176.24 1xxe h LEU 81 N -0.51 0.81 0.00 0.26 3.38 -0.50 -1.35 115.31 117.41 1xxe h LEU 81 Ca 0.04 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1xxe h LEU 81 Cb 0.56 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1xxe h LEU 81 CO -0.21 0.72 0.00 0.18 0.09 0.00 0.00 178.44 179.21 1xxe n LEU 82 N -4.33 0.00 -2.94 1.67 4.77 0.41 -4.94 117.00 111.64 1xxe n LEU 82 Ca 0.05 0.49 -0.12 0.00 -0.03 0.00 0.00 56.01 56.41 1xxe n LEU 82 Cb 0.15 -0.49 0.05 0.00 -2.33 0.00 0.00 43.42 40.81 1xxe n LEU 82 CO 0.39 -0.03 0.04 -0.62 -1.33 0.00 0.00 177.39 175.84 1xxe n GLU 83 N -1.49 -1.81 -4.10 3.23 1.02 0.21 -4.98 120.64 112.73 1xxe n GLU 83 Ca 0.07 0.77 -0.35 0.00 -0.02 0.00 0.00 57.16 57.63 1xxe n GLU 83 Cb 0.32 -5.09 -0.09 0.00 -0.02 0.00 0.00 31.44 26.55 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 -3.30 4.74 -0.00 -3.67 -1.09 -0.93 -3.98 121.20 112.97 1xxe s ILE 84 Ca 0.35 -0.06 0.00 0.00 -2.23 0.00 0.00 60.65 58.71 1xxe s ILE 84 Cb -0.05 -3.09 -0.00 0.00 -1.58 0.00 0.00 42.46 37.74 1xxe s ILE 84 CO 0.61 0.52 0.00 0.35 -1.23 0.00 0.00 174.94 175.20 1xxe n THR 85 N 2.94 0.00 -3.85 2.92 -2.24 -0.97 -4.86 114.28 108.22 1xxe n THR 85 Ca -0.18 -0.15 -0.29 0.00 -2.27 0.00 0.00 64.05 61.17 1xxe n THR 85 Cb 0.53 0.64 -0.16 0.00 -2.10 0.00 0.00 70.33 69.24 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 -1.73 3.15 -0.28 3.42 0.01 -1.24 -0.20 114.94 118.08 1xxe s ASN 86 Ca -0.00 -0.87 -0.22 0.00 -0.71 0.00 0.00 52.86 51.06 1xxe s ASN 86 Cb 0.00 -0.87 0.11 0.00 0.41 0.00 0.00 41.25 40.90 1xxe s ASN 86 CO 0.01 -0.24 0.90 0.68 -1.51 0.00 0.00 177.10 176.93 1xxe s VAL 87 N 1.65 0.00 -0.48 1.60 -7.23 -0.98 -3.96 120.40 111.00 1xxe s VAL 87 Ca -0.02 0.00 -0.09 0.00 -1.81 0.00 0.00 61.98 60.06 1xxe s VAL 87 Cb -0.17 -1.00 0.12 0.00 0.56 0.00 0.00 36.38 35.89 1xxe s VAL 87 CO -0.07 0.00 0.35 -0.89 -0.31 0.00 0.00 175.10 174.18 1xxe s THR 88 N 0.68 4.17 -0.29 5.32 2.01 -0.72 -2.42 115.64 124.38 1xxe s THR 88 Ca -0.02 -1.85 -0.22 0.00 0.31 0.00 0.00 61.69 59.91 1xxe s THR 88 Cb -0.05 -3.75 -0.01 0.00 0.01 0.00 0.00 72.50 68.71 1xxe s THR 88 CO -0.08 -0.78 0.72 -0.63 -0.69 0.00 0.00 174.62 173.16 1xxe s ILE 89 N 1.28 4.86 -0.28 1.82 1.01 -0.48 -2.34 121.20 127.08 1xxe s ILE 89 Ca 0.06 1.11 -0.15 0.00 0.00 0.00 0.00 60.65 61.68 1xxe s ILE 89 Cb -0.26 -4.07 -0.04 0.00 0.01 0.00 0.00 42.46 38.11 1xxe s ILE 89 CO -0.01 -0.17 0.37 -1.61 0.00 0.00 0.00 174.94 173.52 1xxe s GLU 90 N 2.79 3.98 -0.44 2.79 2.02 0.95 -0.32 118.70 130.46 1xxe s GLU 90 Ca 0.30 -0.00 -0.11 0.00 0.02 0.00 0.00 54.97 55.17 1xxe s GLU 90 Cb -0.15 -3.67 0.08 0.00 0.10 0.00 0.00 34.13 30.50 1xxe s GLU 90 CO 0.11 -0.29 0.31 0.08 0.02 0.00 0.00 175.26 175.48 1xxe s VAL 91 N 2.06 4.54 -0.50 2.63 1.01 -0.37 -1.55 120.40 128.23 1xxe s VAL 91 Ca 0.15 -1.31 -0.24 0.00 0.00 0.00 0.00 61.98 60.58 1xxe s VAL 91 Cb -0.16 -3.77 0.04 0.00 0.00 0.00 0.00 36.38 32.49 1xxe s VAL 91 CO 0.10 -0.54 0.86 -0.63 0.00 0.00 0.00 175.10 174.89 1xxe s ILE 92 N 1.49 4.53 -3.18 2.22 1.01 -0.27 -4.72 121.20 122.27 1xxe s ILE 92 Ca 0.03 0.33 0.00 0.00 0.00 0.00 0.00 60.65 61.02 1xxe s ILE 92 Cb -0.24 -4.43 0.00 0.00 0.01 0.00 0.00 42.46 37.80 1xxe s ILE 92 CO 0.03 -0.92 0.00 0.61 0.00 0.00 0.00 174.94 174.67 1xxe n GLY 93 N 5.05 0.81 0.00 6.18 0.00 -1.26 -2.16 105.19 113.81 1xxe n GLY 93 Ca 0.02 -2.03 0.02 0.00 0.00 0.00 0.00 46.02 44.02 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 0.25 1.99 -3.90 1.61 0.23 -1.26 -5.01 115.26 109.17 1xxe n ASN 94 Ca 0.00 -0.32 -0.11 0.00 -0.53 0.00 0.00 54.58 53.62 1xxe n ASN 94 Cb 0.00 1.07 -0.11 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 -1.73 0.28 0.01 -3.83 2.12 -1.26 -1.88 118.70 112.41 1xxe s GLU 95 Ca 0.00 -0.29 -0.30 0.00 0.36 0.00 0.00 54.97 54.74 1xxe s GLU 95 Cb 0.02 0.11 -0.06 0.00 0.26 0.00 0.00 34.13 34.47 1xxe s GLU 95 CO 0.14 -0.06 1.47 0.42 -0.54 0.00 0.00 175.26 176.69 1xxe s ILE 96 N -0.89 3.56 0.04 -3.70 -1.09 -0.93 -4.69 121.20 113.49 1xxe s ILE 96 Ca -0.10 0.94 -0.38 0.00 -2.23 0.00 0.00 60.65 58.89 1xxe s ILE 96 Cb -0.06 -3.61 -0.17 0.00 -1.58 0.00 0.00 42.46 37.04 1xxe s ILE 96 CO 0.00 -0.01 1.31 -2.65 -1.23 0.00 0.00 174.94 172.36 1xxe n PRO 97 N 5.51 0.89 0.10 2.79 -0.02 -1.26 -4.54 135.00 138.46 1xxe n PRO 97 Ca 0.14 0.32 -0.04 0.00 -2.02 0.00 0.00 63.50 61.91 1xxe n PRO 97 Cb 0.43 -1.94 -0.00 0.00 -0.02 0.00 0.00 33.50 31.97 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 3.37 1.50 0.00 4.25 6.09 -1.57 -3.48 117.51 127.67 1xxe h ILE 98 Ca -0.48 -2.84 0.00 0.00 -1.37 0.00 0.00 64.86 60.17 1xxe h ILE 98 Cb 1.36 2.57 0.00 0.00 0.47 0.00 0.00 36.82 41.21 1xxe h ILE 98 CO 0.76 0.79 0.00 0.18 -3.07 0.00 0.00 178.15 176.81 1xxe n LEU 99 N -3.46 0.00 0.00 2.19 4.77 -1.26 -1.13 117.00 118.12 1xxe n LEU 99 Ca -0.00 0.00 -0.06 0.00 -0.03 0.00 0.00 56.01 55.92 1xxe n LEU 99 Cb 0.81 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.78 1xxe n LEU 99 CO 0.44 0.00 -0.39 -0.78 -1.33 0.00 0.00 177.39 175.34 1xxe h ASP 100 N 0.00 0.00 0.00 -1.43 1.82 -1.89 -3.41 116.42 111.51 1xxe h ASP 100 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 1xxe h ASP 100 Cb 0.00 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.01 1xxe h ASP 100 CO 0.00 0.86 0.00 0.61 -1.61 0.00 0.00 179.24 179.10 1xxe n GLY 101 N 1.48 1.85 0.00 -0.78 0.00 -0.28 -4.23 105.19 103.23 1xxe n GLY 101 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.89 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 0.99 -0.16 1.61 3.41 -1.26 -1.92 113.62 116.30 1xxe n SER 102 Ca 0.00 -0.68 0.03 0.00 -0.26 0.00 0.00 58.87 57.96 1xxe n SER 102 Cb 0.00 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 63.96 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 -0.52 0.32 5.00 0.00 -0.84 -4.68 105.19 109.47 1xxe n GLY 103 Ca 0.00 -0.15 0.15 0.00 0.00 0.00 0.00 46.02 46.01 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 0.79 0.68 0.17 1.61 2.91 -1.84 0.30 115.95 120.58 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 0.20 -0.16 0.00 0.00 -0.51 0.00 0.00 29.16 28.70 1xxe h TRP 104 CO 0.00 -0.07 -0.08 0.93 -1.03 0.00 0.00 178.44 178.19 1xxe h GLU 105 N 0.39 -0.22 -0.41 2.65 5.08 -1.90 0.70 114.58 120.86 1xxe h GLU 105 Ca 0.58 0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.93 1xxe h GLU 105 Cb 1.14 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.42 1xxe h GLU 105 CO -0.54 -0.03 0.15 0.74 -1.00 0.00 0.00 179.01 178.33 1xxe h PHE 106 N -0.38 0.64 -0.71 4.33 0.04 -1.60 -0.57 116.94 118.69 1xxe h PHE 106 Ca -0.02 -0.05 -0.03 0.00 2.80 0.00 0.00 57.97 60.66 1xxe h PHE 106 Cb 0.29 -0.19 -0.03 0.00 2.20 0.00 0.00 35.95 38.22 1xxe h PHE 106 CO -0.02 0.57 0.32 -0.92 -0.60 0.00 0.00 178.31 177.66 1xxe h TYR 107 N 0.52 1.02 -0.11 -0.55 5.03 -0.31 0.30 116.97 122.86 1xxe h TYR 107 Ca 0.13 -0.05 -0.07 0.00 2.58 0.00 0.00 58.73 61.33 1xxe h TYR 107 Cb 0.21 -0.31 0.00 0.00 1.55 0.00 0.00 36.73 38.18 1xxe h TYR 107 CO 0.00 0.75 -0.20 0.93 -1.32 0.00 0.00 178.16 178.32 1xxe h GLU 108 N 1.01 0.33 0.04 1.82 4.39 0.78 -2.06 114.58 120.88 1xxe h GLU 108 Ca 0.24 -0.21 -0.00 0.00 0.34 0.00 0.00 59.36 59.73 1xxe h GLU 108 Cb 0.13 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 28.81 1xxe h GLU 108 CO -0.03 0.80 -0.02 0.00 -1.16 0.00 0.00 179.01 178.61 1xxe h ALA 109 N 0.53 -0.05 -0.57 3.43 0.00 -0.99 -3.19 119.26 118.42 1xxe h ALA 109 Ca 0.01 -0.34 0.07 0.00 0.00 0.00 0.00 54.91 54.65 1xxe h ALA 109 Cb 0.79 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.54 1xxe h ALA 109 CO 0.05 -0.14 0.26 0.82 0.00 0.00 0.00 179.25 180.23 1xxe h ILE 110 N -0.82 0.88 -0.42 0.00 2.04 -0.53 0.38 117.51 119.04 1xxe h ILE 110 Ca -0.01 -0.17 0.12 0.00 1.00 0.00 0.00 64.86 65.81 1xxe h ILE 110 Cb 0.69 0.35 -0.02 0.00 -0.74 0.00 0.00 36.82 37.10 1xxe h ILE 110 CO 0.01 0.09 0.32 -0.09 0.00 0.00 0.00 178.15 178.47 1xxe h ARG 111 N 0.48 0.00 0.00 2.37 9.65 -1.46 0.49 114.38 125.91 1xxe h ARG 111 Ca 0.27 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.15 1xxe h ARG 111 Cb 0.25 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.83 1xxe h ARG 111 CO -0.23 0.00 -0.08 1.17 2.80 0.00 0.00 179.97 183.63 1xxe n LYS 112 N -4.31 0.16 -1.04 0.20 4.81 0.09 -3.72 118.16 114.36 1xxe n LYS 112 Ca 0.07 0.12 -0.03 0.00 -0.87 0.00 0.00 58.31 57.60 1xxe n LYS 112 Cb 0.51 -1.68 0.15 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 -1.96 2.70 -4.86 3.14 5.03 0.17 -5.01 115.26 114.46 1xxe n ASN 113 Ca 0.06 -3.85 -0.33 0.00 0.87 0.00 0.00 54.58 51.32 1xxe n ASN 113 Cb 0.40 -0.47 -0.06 0.00 -1.02 0.00 0.00 39.78 38.63 1xxe n ASN 113 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1xxe s ILE 114 N -3.65 4.90 0.14 2.41 1.01 -0.97 0.66 121.20 125.69 1xxe s ILE 114 Ca 0.42 0.61 0.05 0.00 0.00 0.00 0.00 60.65 61.73 1xxe s ILE 114 Cb 0.38 -3.66 -0.04 0.00 0.01 0.00 0.00 42.46 39.15 1xxe s ILE 114 CO -0.04 0.04 -0.11 -0.22 0.00 0.00 0.00 174.94 174.62 1xxe s LEU 115 N -2.50 2.49 -0.07 2.97 2.96 0.34 -4.41 118.68 120.44 1xxe s LEU 115 Ca 0.44 -0.94 -0.01 0.00 -0.22 0.00 0.00 54.13 53.40 1xxe s LEU 115 Cb -0.13 -0.39 -0.03 0.00 0.50 0.00 0.00 46.19 46.14 1xxe s LEU 115 CO 0.20 -0.28 -0.02 0.20 -1.32 0.00 0.00 176.35 175.13 1xxe s ASN 116 N -2.92 5.01 0.00 3.68 0.01 -1.26 -1.69 114.94 117.77 1xxe s ASN 116 Ca 0.14 0.08 0.00 0.00 -0.71 0.00 0.00 52.86 52.36 1xxe s ASN 116 Cb 0.00 -1.35 0.00 0.00 0.41 0.00 0.00 41.25 40.31 1xxe s ASN 116 CO 0.01 0.37 0.00 0.00 -1.51 0.00 0.00 177.10 175.97 1xxe n GLN 117 N 2.13 2.59 0.00 -0.60 6.02 0.35 -4.93 117.38 122.94 1xxe n GLN 117 Ca -0.18 0.00 0.02 0.00 -0.01 0.00 0.00 57.00 56.83 1xxe n GLN 117 Cb 0.53 0.00 0.01 0.00 1.02 0.00 0.00 30.24 31.81 1xxe n GLN 117 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 1xxe n ASN 118 N -0.79 1.19 -4.89 1.08 2.04 -1.26 -4.66 115.26 107.97 1xxe n ASN 118 Ca 0.00 -1.10 -0.32 0.00 -0.44 0.00 0.00 54.58 52.72 1xxe n ASN 118 Cb 0.00 0.14 -0.05 0.00 -2.53 0.00 0.00 39.78 37.34 1xxe n ASN 118 CO 0.00 0.00 0.00 -0.60 -0.44 0.00 0.00 177.26 176.22 1xxe s ARG 119 N -0.49 3.69 0.03 -3.83 3.52 -1.26 -4.91 118.95 115.70 1xxe s ARG 119 Ca 0.04 0.04 -0.21 0.00 -0.13 0.00 0.00 55.73 55.48 1xxe s ARG 119 Cb 0.03 -2.82 -0.06 0.00 -1.56 0.00 0.00 34.95 30.54 1xxe s ARG 119 CO 0.07 0.44 0.60 -2.00 -0.81 0.00 0.00 175.30 173.61 1xxe s GLU 120 N -2.58 4.30 0.34 5.12 2.56 -1.26 0.13 118.70 127.32 1xxe s GLU 120 Ca 0.41 0.77 -0.26 0.00 0.00 0.00 0.00 54.97 55.90 1xxe s GLU 120 Cb -0.12 -3.31 -0.09 0.00 2.00 0.00 0.00 34.13 32.61 1xxe s GLU 120 CO 0.23 0.46 1.00 0.42 -0.56 0.00 0.00 175.26 176.81 1xxe s ILE 121 N -0.53 3.93 -0.96 -3.70 1.01 -1.26 -4.74 121.20 114.95 1xxe s ILE 121 Ca 0.31 1.60 -0.20 0.00 0.00 0.00 0.00 60.65 62.36 1xxe s ILE 121 Cb -0.19 -3.89 0.11 0.00 0.01 0.00 0.00 42.46 38.50 1xxe s ILE 121 CO 0.19 0.13 1.23 -0.62 0.00 0.00 0.00 174.94 175.86 1xxe s ASP 122 N -1.49 6.59 0.51 3.58 2.15 -1.26 -5.00 116.67 121.74 1xxe s ASP 122 Ca 0.52 -1.86 -0.23 0.00 0.43 0.00 0.00 52.55 51.41 1xxe s ASP 122 Cb -0.22 -2.45 -0.06 0.00 -0.30 0.00 0.00 42.92 39.89 1xxe s ASP 122 CO 0.27 -1.20 1.32 -0.31 -0.17 0.00 0.00 175.17 175.08 1xxe s TYR 123 N 3.41 2.47 -0.24 -5.34 1.51 -1.26 -4.68 117.35 113.21 1xxe s TYR 123 Ca 0.37 1.40 -0.09 0.00 -1.01 0.00 0.00 57.07 57.73 1xxe s TYR 123 Cb -0.03 -3.72 -0.04 0.00 -0.11 0.00 0.00 41.96 38.05 1xxe s TYR 123 CO -0.10 -2.56 0.13 0.12 -1.11 0.00 0.00 175.55 172.03 1xxe s PHE 124 N -1.34 3.22 -0.00 2.71 2.19 0.44 -4.98 117.98 120.22 1xxe s PHE 124 Ca 0.67 0.01 0.06 0.00 0.33 0.00 0.00 56.93 58.00 1xxe s PHE 124 Cb -0.38 -2.25 -0.02 0.00 -1.31 0.00 0.00 43.02 39.06 1xxe s PHE 124 CO 0.46 -0.08 -0.18 0.08 1.83 0.00 0.00 175.22 177.33 1xxe s VAL 125 N 1.25 1.44 0.13 3.12 1.01 -1.26 0.08 120.40 126.16 1xxe s VAL 125 Ca 0.06 -0.85 -0.25 0.00 0.00 0.00 0.00 61.98 60.94 1xxe s VAL 125 Cb -0.14 -1.21 -0.07 0.00 0.00 0.00 0.00 36.38 34.96 1xxe s VAL 125 CO 0.05 0.35 0.77 -0.69 0.00 0.00 0.00 175.10 175.58 1xxe s VAL 126 N -0.51 4.49 -0.04 2.92 1.01 -0.74 -4.93 120.40 122.61 1xxe s VAL 126 Ca 0.07 1.67 0.01 0.00 0.00 0.00 0.00 61.98 63.73 1xxe s VAL 126 Cb -0.07 -4.13 -0.01 0.00 0.00 0.00 0.00 36.38 32.17 1xxe s VAL 126 CO -0.00 0.48 0.04 -0.62 0.00 0.00 0.00 175.10 174.99 1xxe n GLU 127 N 1.97 5.92 -3.91 2.72 1.02 -1.26 -4.29 120.64 122.80 1xxe n GLU 127 Ca -0.05 -0.00 -0.11 0.00 -0.02 0.00 0.00 57.16 56.98 1xxe n GLU 127 Cb 0.49 -0.60 -0.13 0.00 -0.02 0.00 0.00 31.44 31.19 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 -1.20 0.14 1.05 3.49 -1.05 -1.26 -4.82 118.70 115.04 1xxe s GLU 128 Ca 0.00 -0.25 -0.15 0.00 -0.15 0.00 0.00 54.97 54.43 1xxe s GLU 128 Cb 0.01 0.05 0.22 0.00 -0.44 0.00 0.00 34.13 33.96 1xxe s GLU 128 CO 0.04 -0.02 1.13 -1.25 0.95 0.00 0.00 175.26 176.11 1xxe s PRO 129 N -0.61 -0.03 -0.24 -4.83 0.04 -1.26 -4.60 135.00 123.47 1xxe s PRO 129 Ca -0.07 0.16 -0.26 0.00 0.04 0.00 0.00 61.00 60.87 1xxe s PRO 129 Cb -0.04 -1.72 0.10 0.00 0.04 0.00 0.00 34.50 32.89 1xxe s PRO 129 CO -0.00 -2.96 0.91 -1.50 0.04 0.00 0.00 177.00 173.49 1xxe s ILE 130 N -3.13 0.00 -0.09 0.56 2.07 -0.78 -4.95 121.20 114.88 1xxe s ILE 130 Ca 0.68 0.00 0.01 0.00 -1.41 0.00 0.00 60.65 59.93 1xxe s ILE 130 Cb -0.13 -1.00 0.02 0.00 0.13 0.00 0.00 42.46 41.48 1xxe s ILE 130 CO 0.56 0.00 -0.09 -0.63 -1.91 0.00 0.00 174.94 172.86 1xxe s ILE 131 N -0.03 1.02 -0.22 2.00 1.09 -1.26 -1.01 121.20 122.79 1xxe s ILE 131 Ca 0.00 -0.35 0.02 0.00 -1.10 0.00 0.00 60.65 59.22 1xxe s ILE 131 Cb -0.04 -0.99 0.04 0.00 -1.06 0.00 0.00 42.46 40.41 1xxe s ILE 131 CO -0.02 0.35 -0.13 0.68 -0.10 0.00 0.00 174.94 175.72 1xxe s VAL 132 N 1.18 1.96 -0.02 2.92 -7.23 -0.68 -4.99 120.40 113.53 1xxe s VAL 132 Ca -0.05 -1.25 0.04 0.00 -1.81 0.00 0.00 61.98 58.91 1xxe s VAL 132 Cb -0.14 -1.98 -0.03 0.00 0.56 0.00 0.00 36.38 34.79 1xxe s VAL 132 CO -0.02 0.18 -0.13 -0.70 -0.31 0.00 0.00 175.10 174.12 1xxe s GLU 133 N 1.25 2.46 -0.29 4.82 2.12 -1.26 -1.70 118.70 126.10 1xxe s GLU 133 Ca -0.03 -0.74 -0.23 0.00 0.36 0.00 0.00 54.97 54.33 1xxe s GLU 133 Cb -0.17 -2.39 0.17 0.00 0.26 0.00 0.00 34.13 32.00 1xxe s GLU 133 CO -0.08 0.61 1.28 0.34 -0.54 0.00 0.00 175.26 176.87 1xxe s ASP 134 N -1.01 -0.19 -1.59 -1.70 -1.08 0.16 -4.97 116.67 106.29 1xxe s ASP 134 Ca 0.13 0.35 0.00 0.00 -0.52 0.00 0.00 52.55 52.51 1xxe s ASP 134 Cb -0.11 0.50 0.00 0.00 -1.46 0.00 0.00 42.92 41.86 1xxe s ASP 134 CO 0.03 -0.06 0.00 -0.62 0.52 0.00 0.00 175.17 175.04 1xxe n GLU 135 N 2.10 -1.82 -0.99 4.34 1.02 -1.26 -0.25 120.64 123.78 1xxe n GLU 135 Ca -0.12 0.90 0.00 0.00 -0.02 0.00 0.00 57.16 57.92 1xxe n GLU 135 Cb 0.57 -5.53 0.00 0.00 -0.02 0.00 0.00 31.44 26.45 1xxe n GLU 135 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1xxe n GLY 136 N -0.92 0.45 3.70 0.62 0.00 -1.26 -5.00 105.19 102.77 1xxe n GLY 136 Ca -0.22 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.56 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 -0.34 2.49 0.08 1.61 0.52 0.66 -4.91 118.95 119.06 1xxe s ARG 137 Ca 0.00 -1.20 -0.24 0.00 -0.52 0.00 0.00 55.73 53.77 1xxe s ARG 137 Cb 0.00 -2.34 0.06 0.00 0.52 0.00 0.00 34.95 33.19 1xxe s ARG 137 CO 0.00 0.41 0.59 -1.17 0.02 0.00 0.00 175.30 175.15 1xxe s LEU 138 N -3.40 -0.41 -0.13 2.53 0.20 -0.99 -0.66 118.68 115.81 1xxe s LEU 138 Ca 0.30 0.21 -0.08 0.00 0.69 0.00 0.00 54.13 55.24 1xxe s LEU 138 Cb -0.08 2.42 0.05 0.00 -0.43 0.00 0.00 46.19 48.15 1xxe s LEU 138 CO 0.21 -0.81 0.33 -0.63 -0.29 0.00 0.00 176.35 175.15 1xxe s ILE 139 N -2.77 -0.02 0.02 6.68 1.01 -0.69 -1.26 121.20 124.18 1xxe s ILE 139 Ca -0.04 0.08 0.08 0.00 0.00 0.00 0.00 60.65 60.78 1xxe s ILE 139 Cb -0.01 -0.48 -0.03 0.00 0.01 0.00 0.00 42.46 41.96 1xxe s ILE 139 CO -0.04 0.03 -0.25 -0.75 0.00 0.00 0.00 174.94 173.93 1xxe s LYS 140 N 0.98 1.81 0.03 2.79 2.20 -0.45 -1.69 119.74 125.42 1xxe s LYS 140 Ca -0.07 -1.02 0.08 0.00 -0.36 0.00 0.00 55.97 54.60 1xxe s LYS 140 Cb -0.07 -1.91 -0.02 0.00 -1.51 0.00 0.00 37.83 34.32 1xxe s LYS 140 CO -0.07 0.50 -0.22 0.00 -0.36 0.00 0.00 175.35 175.20 1xxe s ALA 141 N -0.73 1.89 -0.03 3.13 0.00 -0.18 -0.47 121.76 125.37 1xxe s ALA 141 Ca 0.10 -1.09 -0.02 0.00 0.00 0.00 0.00 51.96 50.95 1xxe s ALA 141 Cb -0.10 -0.39 0.01 0.00 0.00 0.00 0.00 23.12 22.64 1xxe s ALA 141 CO 0.01 0.44 0.08 -2.00 0.00 0.00 0.00 175.76 174.28 1xxe s GLU 142 N -1.09 0.08 0.45 0.00 2.12 0.56 -1.87 118.70 118.95 1xxe s GLU 142 Ca 0.09 0.13 -0.23 0.00 0.36 0.00 0.00 54.97 55.32 1xxe s GLU 142 Cb -0.09 0.00 -0.10 0.00 0.26 0.00 0.00 34.13 34.21 1xxe s GLU 142 CO 0.01 -0.03 0.98 -0.35 -0.54 0.00 0.00 175.26 175.33 1xxe n PRO 143 N 3.22 1.25 -3.55 4.30 -0.04 -1.26 0.32 135.00 139.23 1xxe n PRO 143 Ca -0.14 0.45 -0.14 0.00 -0.04 0.00 0.00 63.50 63.63 1xxe n PRO 143 Cb 0.58 -2.04 -0.06 0.00 -0.04 0.00 0.00 33.50 31.94 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 -0.83 -0.49 0.00 3.54 0.15 -1.26 -4.37 113.70 110.43 1xxe s SER 144 Ca 0.65 0.55 0.30 0.00 0.70 0.00 0.00 55.95 58.15 1xxe s SER 144 Cb -0.53 0.42 1.55 0.00 -1.71 0.00 0.00 66.02 65.74 1xxe s SER 144 CO 0.55 -0.45 2.04 0.47 1.20 0.00 0.00 173.24 177.05 1xxe n ASP 145 N 0.83 0.37 -4.01 5.45 9.92 -1.26 -3.45 116.55 124.40 1xxe n ASP 145 Ca -0.14 -0.87 -0.16 0.00 -0.53 0.00 0.00 54.79 53.09 1xxe n ASP 145 Cb 0.57 -0.05 -0.14 0.00 -0.64 0.00 0.00 41.12 40.86 1xxe n ASP 145 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 1xxe s THR 146 N -2.19 0.57 -0.23 -3.53 -4.23 -1.26 -4.91 115.64 99.87 1xxe s THR 146 Ca 0.39 -0.49 -0.29 0.00 -1.18 0.00 0.00 61.69 60.12 1xxe s THR 146 Cb 0.21 -0.52 -0.00 0.00 1.34 0.00 0.00 72.50 73.54 1xxe s THR 146 CO 0.40 0.03 1.17 -0.22 -0.54 0.00 0.00 174.62 175.47 1xxe s LEU 147 N -0.51 4.08 -0.01 4.79 2.96 -1.26 -3.26 118.68 125.47 1xxe s LEU 147 Ca 0.00 1.44 0.01 0.00 -0.22 0.00 0.00 54.13 55.35 1xxe s LEU 147 Cb -0.04 -3.54 0.01 0.00 0.50 0.00 0.00 46.19 43.11 1xxe s LEU 147 CO 0.00 -0.80 -0.02 -0.70 -1.32 0.00 0.00 176.35 173.51 1xxe s GLU 148 N 3.53 0.26 -0.07 1.98 2.12 -0.70 -2.97 118.70 122.85 1xxe s GLU 148 Ca 0.50 -0.05 -0.01 0.00 0.36 0.00 0.00 54.97 55.78 1xxe s GLU 148 Cb -0.18 -0.31 0.03 0.00 0.26 0.00 0.00 34.13 33.93 1xxe s GLU 148 CO 0.13 0.00 -0.03 0.08 -0.54 0.00 0.00 175.26 174.91 1xxe s VAL 149 N 0.27 0.55 -0.11 3.70 1.01 -0.77 -0.52 120.40 124.53 1xxe s VAL 149 Ca -0.02 -0.03 -0.02 0.00 0.00 0.00 0.00 61.98 61.91 1xxe s VAL 149 Cb -0.05 -0.65 -0.03 0.00 0.00 0.00 0.00 36.38 35.65 1xxe s VAL 149 CO -0.01 0.27 -0.02 -0.89 0.00 0.00 0.00 175.10 174.46 1xxe s THR 150 N 1.64 4.13 -0.07 3.92 2.01 0.25 -1.03 115.64 126.50 1xxe s THR 150 Ca 0.01 -0.30 0.02 0.00 0.31 0.00 0.00 61.69 61.73 1xxe s THR 150 Cb -0.13 -2.76 0.01 0.00 0.01 0.00 0.00 72.50 69.64 1xxe s THR 150 CO -0.04 0.57 -0.14 -0.47 -0.69 0.00 0.00 174.62 173.84 1xxe s TYR 151 N -0.47 1.63 -0.35 4.92 5.04 -0.93 0.12 117.35 127.31 1xxe s TYR 151 Ca 0.08 -0.63 -0.01 0.00 -2.44 0.00 0.00 57.07 54.08 1xxe s TYR 151 Cb -0.12 -1.17 0.09 0.00 0.35 0.00 0.00 41.96 41.10 1xxe s TYR 151 CO 0.02 -0.31 0.09 -2.00 -1.34 0.00 0.00 175.55 172.01 1xxe s GLU 152 N 0.66 2.02 -0.09 4.97 2.12 0.12 -1.71 118.70 126.78 1xxe s GLU 152 Ca -0.14 -1.64 -0.13 0.00 0.36 0.00 0.00 54.97 53.41 1xxe s GLU 152 Cb -0.16 -3.34 -0.05 0.00 0.26 0.00 0.00 34.13 30.84 1xxe s GLU 152 CO 0.04 -0.88 0.31 0.20 -0.54 0.00 0.00 175.26 174.39 1xxe s GLY 153 N 1.41 2.30 -0.58 -1.50 0.00 0.16 -1.25 107.32 107.86 1xxe s GLY 153 Ca 0.04 -0.40 -0.04 0.00 0.00 0.00 0.00 44.72 44.32 1xxe s GLY 153 CO -0.04 0.19 0.41 1.85 0.00 0.00 0.00 173.10 175.51 1xxe s GLU 154 N -0.35 2.52 0.13 2.90 2.12 -1.26 -0.93 118.70 123.82 1xxe s GLU 154 Ca 0.19 -2.32 -0.06 0.00 0.36 0.00 0.00 54.97 53.14 1xxe s GLU 154 Cb -0.14 -3.77 -0.06 0.00 0.26 0.00 0.00 34.13 30.42 1xxe s GLU 154 CO 0.07 -1.16 0.38 -0.06 -0.54 0.00 0.00 175.26 173.95 1xxe s PHE 155 N 0.32 3.50 -2.16 5.30 0.08 0.87 -4.93 117.98 120.96 1xxe s PHE 155 Ca 0.14 0.62 0.24 0.00 0.12 0.00 0.00 56.93 58.05 1xxe s PHE 155 Cb -0.21 -2.05 0.27 0.00 -0.57 0.00 0.00 43.02 40.47 1xxe s PHE 155 CO -0.04 0.45 1.27 1.63 -0.10 0.00 0.00 175.22 178.44 1xxe n LYS 156 N 0.31 1.34 0.00 0.44 5.02 -1.26 -3.53 118.16 120.47 1xxe n LYS 156 Ca -0.04 -1.03 0.00 0.00 -2.02 0.00 0.00 58.31 55.22 1xxe n LYS 156 Cb 0.52 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 34.05 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 0.07 -0.59 0.33 4.39 2.04 -1.26 -4.71 115.26 115.52 1xxe n ASN 157 Ca 0.11 -0.65 0.21 0.00 -0.44 0.00 0.00 54.58 53.82 1xxe n ASN 157 Cb 0.45 0.00 1.15 0.00 -2.53 0.00 0.00 39.78 38.85 1xxe n ASN 157 CO 0.00 0.00 0.00 2.19 -0.44 0.00 0.00 177.26 179.01 1xxe h PHE 158 N -1.25 0.00 0.00 -2.53 -0.00 -1.52 -0.25 116.94 111.39 1xxe h PHE 158 Ca 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 57.97 57.88 1xxe h PHE 158 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 35.94 1xxe h PHE 158 CO 0.00 0.00 -0.44 -0.07 -0.00 0.00 0.00 178.31 177.81 1xxe h LEU 159 N 0.00 0.00 0.00 2.10 3.38 -1.88 -3.48 115.31 115.43 1xxe h LEU 159 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1xxe h LEU 159 Cb 0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1xxe h LEU 159 CO 0.00 0.44 0.00 0.61 0.09 0.00 0.00 178.44 179.58 1xxe n GLY 160 N -0.01 2.42 3.79 0.83 0.00 -0.11 -4.66 105.19 107.45 1xxe n GLY 160 Ca -0.01 -0.35 -0.33 0.00 0.00 0.00 0.00 46.02 45.32 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 3.09 0.05 1.61 3.00 -1.25 -0.09 118.95 125.35 1xxe s ARG 161 Ca 0.00 -0.47 -0.09 0.00 0.00 0.00 0.00 55.73 55.18 1xxe s ARG 161 Cb 0.00 -2.87 0.00 0.00 0.00 0.00 0.00 34.95 32.08 1xxe s ARG 161 CO 0.00 0.65 0.18 -0.65 0.00 0.00 0.00 175.30 175.48 1xxe s GLN 162 N -1.69 0.71 0.01 3.54 -0.21 -0.11 -4.93 119.66 116.98 1xxe s GLN 162 Ca 0.22 -0.73 0.00 0.00 0.02 0.00 0.00 55.36 54.88 1xxe s GLN 162 Cb -0.12 0.29 -0.01 0.00 1.00 0.00 0.00 33.01 34.17 1xxe s GLN 162 CO 0.13 -0.21 -0.02 -1.59 -2.12 0.00 0.00 175.29 171.48 1xxe s LYS 163 N -2.88 0.22 -0.05 2.91 -2.85 -1.26 -0.66 119.74 115.17 1xxe s LYS 163 Ca -0.03 -0.34 -0.00 0.00 -1.00 0.00 0.00 55.97 54.61 1xxe s LYS 163 Cb 0.00 -0.02 0.03 0.00 -2.06 0.00 0.00 37.83 35.78 1xxe s LYS 163 CO -0.06 -0.00 -0.01 0.12 0.10 0.00 0.00 175.35 175.50 1xxe s PHE 164 N -0.73 0.52 -0.23 1.78 5.36 -0.70 -4.99 117.98 118.99 1xxe s PHE 164 Ca -0.07 -0.09 -0.08 0.00 -0.96 0.00 0.00 56.93 55.72 1xxe s PHE 164 Cb -0.05 -0.59 -0.04 0.00 -0.34 0.00 0.00 43.02 42.00 1xxe s PHE 164 CO -0.00 -0.20 0.09 -0.08 -1.46 0.00 0.00 175.22 173.57 1xxe s THR 165 N 1.31 4.73 -0.15 0.12 -1.32 -1.26 -2.18 115.64 116.88 1xxe s THR 165 Ca -0.05 -0.04 -0.08 0.00 -1.21 0.00 0.00 61.69 60.31 1xxe s THR 165 Cb -0.13 -3.19 -0.04 0.00 -1.51 0.00 0.00 72.50 67.62 1xxe s THR 165 CO -0.02 0.37 0.13 0.12 -2.21 0.00 0.00 174.62 173.01 1xxe s PHE 166 N 1.16 3.51 0.09 9.09 5.36 -0.20 -4.97 117.98 132.03 1xxe s PHE 166 Ca 0.05 0.44 0.04 0.00 -0.96 0.00 0.00 56.93 56.50 1xxe s PHE 166 Cb -0.14 -2.02 -0.03 0.00 -0.34 0.00 0.00 43.02 40.48 1xxe s PHE 166 CO 0.04 0.55 -0.12 0.08 -1.46 0.00 0.00 175.22 174.32 1xxe s VAL 167 N -0.48 1.04 -0.06 3.12 1.01 -1.26 -1.86 120.40 121.92 1xxe s VAL 167 Ca 0.12 -1.54 -0.32 0.00 0.00 0.00 0.00 61.98 60.24 1xxe s VAL 167 Cb -0.12 -1.28 -0.10 0.00 0.00 0.00 0.00 36.38 34.89 1xxe s VAL 167 CO 0.02 -0.43 1.96 -0.62 0.00 0.00 0.00 175.10 176.02 1xxe n GLU 168 N 0.79 2.38 0.00 2.72 1.02 -1.16 -1.58 120.64 124.82 1xxe n GLU 168 Ca -0.18 0.86 0.00 0.00 -0.02 0.00 0.00 57.16 57.82 1xxe n GLU 168 Cb 0.56 -2.82 0.00 0.00 -0.02 0.00 0.00 31.44 29.16 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 4.65 0.99 1.02 0.62 0.00 -1.26 -4.95 105.19 106.25 1xxe n GLY 169 Ca 0.23 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.28 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 1.82 0.08 1.61 4.13 -0.61 -4.79 115.26 117.49 1xxe n ASN 170 Ca 0.00 -3.37 0.01 0.00 1.68 0.00 0.00 54.58 52.91 1xxe n ASN 170 Cb 0.00 -0.46 0.36 0.00 -1.54 0.00 0.00 39.78 38.14 1xxe n ASN 170 CO 0.00 0.00 0.00 -0.33 0.28 0.00 0.00 177.26 177.21 1xxe h GLU 171 N 1.16 0.33 0.00 3.52 3.07 -1.93 -2.49 114.58 118.24 1xxe h GLU 171 Ca -0.03 -0.08 0.00 0.00 -0.50 0.00 0.00 59.36 58.76 1xxe h GLU 171 Cb 1.28 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 29.14 1xxe h GLU 171 CO 0.10 0.44 0.07 0.93 -1.40 0.00 0.00 179.01 179.15 1xxe h GLU 172 N 0.32 0.00 -0.01 2.33 5.08 -1.97 0.21 114.58 120.53 1xxe h GLU 172 Ca 0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1xxe h GLU 172 Cb 0.37 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.62 1xxe h GLU 172 CO 0.02 0.00 -0.26 0.39 -1.00 0.00 0.00 179.01 178.16 1xxe n GLU 173 N -2.34 1.08 0.00 2.33 1.02 -0.94 -4.14 120.64 117.66 1xxe n GLU 173 Ca -0.02 -0.72 0.00 0.00 -0.02 0.00 0.00 57.16 56.41 1xxe n GLU 173 Cb 0.11 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.04 1xxe n GLU 173 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 1xxe n ILE 174 N -0.33 0.00 -0.01 -3.67 -5.35 0.03 -4.64 119.36 105.39 1xxe n ILE 174 Ca 0.12 -0.47 -0.07 0.00 -0.27 0.00 0.00 62.75 62.07 1xxe n ILE 174 Cb 0.39 1.02 -0.13 0.00 -1.74 0.00 0.00 39.64 39.18 1xxe n ILE 174 CO 0.00 0.00 0.00 -0.37 -1.76 0.00 0.00 176.55 174.42 1xxe h VAL 175 N 0.02 0.80 -0.06 7.28 -1.51 -1.62 -3.33 116.25 117.83 1xxe h VAL 175 Ca 0.00 -2.58 0.00 0.00 -1.23 0.00 0.00 66.70 62.89 1xxe h VAL 175 Cb 0.01 2.35 0.00 0.00 -2.13 0.00 0.00 31.29 31.52 1xxe h VAL 175 CO 0.00 0.45 0.00 0.18 -1.23 0.00 0.00 177.57 176.97 1xxe n LEU 176 N -3.02 1.12 -4.63 4.19 4.77 -1.26 -1.99 117.00 116.18 1xxe n LEU 176 Ca -0.15 -0.42 -0.43 0.00 -0.03 0.00 0.00 56.01 54.98 1xxe n LEU 176 Cb 1.01 -0.03 -0.02 0.00 -2.33 0.00 0.00 43.42 42.04 1xxe n LEU 176 CO 0.45 0.21 1.00 0.00 -1.33 0.00 0.00 177.39 177.72 1xxe s ALA 177 N -1.93 3.44 0.39 -1.18 0.00 -1.25 -4.87 121.76 116.37 1xxe s ALA 177 Ca 0.36 -0.05 -0.10 0.00 0.00 0.00 0.00 51.96 52.17 1xxe s ALA 177 Cb 0.19 -3.71 -0.06 0.00 0.00 0.00 0.00 23.12 19.53 1xxe s ALA 177 CO 0.30 -1.61 0.75 -0.98 0.00 0.00 0.00 175.76 174.23 1xxe s ARG 178 N 3.83 3.77 0.93 0.00 1.70 -1.26 -4.47 118.95 123.45 1xxe s ARG 178 Ca 0.48 0.44 -0.13 0.00 -0.47 0.00 0.00 55.73 56.06 1xxe s ARG 178 Cb -0.13 -2.41 0.04 0.00 -0.57 0.00 0.00 34.95 31.89 1xxe s ARG 178 CO 0.18 -0.01 0.52 -2.37 -1.08 0.00 0.00 175.30 172.54 1xxe n THR 179 N -1.25 0.18 -4.09 4.99 5.66 -0.81 -4.80 114.28 114.18 1xxe n THR 179 Ca 0.02 -0.18 -0.10 0.00 -3.05 0.00 0.00 64.05 60.73 1xxe n THR 179 Cb 0.54 -0.68 -0.08 0.00 -1.55 0.00 0.00 70.33 68.56 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 -2.38 0.73 0.11 1.09 -0.71 -1.26 -2.29 117.98 113.27 1xxe s PHE 180 Ca 0.59 -1.03 -0.25 0.00 -1.04 0.00 0.00 56.93 55.20 1xxe s PHE 180 Cb -0.22 -0.18 0.07 0.00 -1.21 0.00 0.00 43.02 41.48 1xxe s PHE 180 CO 0.65 -0.80 0.82 0.00 -1.34 0.00 0.00 175.22 174.55 1xxe s PHE 182 N -3.42 3.32 0.56 0.00 0.08 -1.26 -0.02 117.98 117.23 1xxe s PHE 182 Ca 0.07 0.22 0.41 0.00 0.12 0.00 0.00 56.93 57.74 1xxe s PHE 182 Cb -0.02 -1.74 2.17 0.00 -0.57 0.00 0.00 43.02 42.86 1xxe s PHE 182 CO -0.05 0.56 2.29 0.38 -0.10 0.00 0.00 175.22 178.30 1xxe h ASP 183 N 3.95 0.00 1.25 1.36 3.04 -1.84 -0.89 116.42 123.30 1xxe h ASP 183 Ca -0.49 0.00 -0.15 0.00 -3.24 0.00 0.00 57.03 53.15 1xxe h ASP 183 Cb 1.18 0.00 -0.02 0.00 -1.04 0.00 0.00 39.33 39.45 1xxe h ASP 183 CO 0.64 0.01 -0.76 4.11 -2.04 0.00 0.00 179.24 181.19 1xxe h TRP 184 N 0.00 0.00 0.00 4.15 0.09 -1.94 -3.29 115.95 114.96 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 0.10 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.34 1xxe h TRP 184 CO 0.00 0.69 -1.41 -0.85 0.09 0.00 0.00 178.44 176.96 1xxe n GLU 185 N -3.24 0.38 0.08 0.12 0.28 -0.79 -4.38 120.64 113.10 1xxe n GLU 185 Ca 0.00 -0.07 -0.12 0.00 -0.16 0.00 0.00 57.16 56.81 1xxe n GLU 185 Cb 0.82 -1.55 -0.05 0.00 1.43 0.00 0.00 31.44 32.08 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 0.69 -0.49 3.84 2.04 -1.26 -1.51 117.51 120.83 1xxe h ILE 186 Ca 0.00 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.96 1xxe h ILE 186 Cb 0.79 0.69 -0.09 0.00 -0.74 0.00 0.00 36.82 37.47 1xxe h ILE 186 CO 0.00 0.00 -0.05 -0.33 0.00 0.00 0.00 178.15 177.77 1xxe h GLU 187 N -0.25 0.06 -0.10 2.37 5.08 -1.76 0.28 114.58 120.25 1xxe h GLU 187 Ca 0.03 -0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.42 1xxe h GLU 187 Cb 0.28 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.47 1xxe h GLU 187 CO -0.09 0.04 -0.18 0.45 -1.00 0.00 0.00 179.01 178.23 1xxe h HIS 188 N 0.06 -0.45 -0.53 4.33 3.86 -1.68 0.78 115.15 121.51 1xxe h HIS 188 Ca 0.24 0.02 0.06 0.00 -1.16 0.00 0.00 60.37 59.54 1xxe h HIS 188 Cb 0.37 0.22 -0.03 0.00 1.06 0.00 0.00 27.41 29.03 1xxe h HIS 188 CO -0.36 -0.25 0.35 0.82 0.86 0.00 0.00 177.93 179.36 1xxe h ILE 189 N -0.23 0.97 0.00 2.45 2.04 -0.15 -0.59 117.51 122.00 1xxe h ILE 189 Ca 0.09 -0.16 -0.17 0.00 1.00 0.00 0.00 64.86 65.62 1xxe h ILE 189 Cb 0.36 0.47 -0.02 0.00 -0.74 0.00 0.00 36.82 36.88 1xxe h ILE 189 CO -0.24 0.09 -0.80 0.11 0.00 0.00 0.00 178.15 177.30 1xxe h LYS 190 N 0.47 0.00 0.00 2.37 1.57 0.17 -1.86 116.57 119.29 1xxe h LYS 190 Ca 0.23 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.92 1xxe h LYS 190 Cb 0.31 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.61 1xxe h LYS 190 CO -0.06 0.80 -0.43 0.87 -0.57 0.00 0.00 179.45 180.06 1xxe h LYS 191 N 0.00 0.00 -0.46 3.15 1.79 0.20 -2.65 116.57 118.60 1xxe h LYS 191 Ca -0.01 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.46 1xxe h LYS 191 Cb 1.51 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.16 1xxe h LYS 191 CO 0.10 0.43 0.00 1.33 -1.08 0.00 0.00 179.45 180.24 1xxe n VAL 192 N -3.56 0.40 -1.73 0.50 0.24 -0.80 -4.84 118.33 108.54 1xxe n VAL 192 Ca -0.00 -0.28 -0.07 0.00 -2.04 0.00 0.00 64.34 61.95 1xxe n VAL 192 Cb 0.54 -0.10 -0.02 0.00 -1.47 0.00 0.00 33.84 32.80 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 0.54 0.44 3.49 7.63 0.00 -1.00 -5.03 105.19 111.27 1xxe n GLY 193 Ca 0.06 -0.65 -0.26 0.00 0.00 0.00 0.00 46.02 45.18 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 -1.86 2.68 -0.13 0.99 1.43 -0.70 -4.71 118.68 116.38 1xxe s LEU 194 Ca 0.00 -0.83 0.00 0.00 -1.03 0.00 0.00 54.13 52.27 1xxe s LEU 194 Cb 0.00 -1.31 0.00 0.00 0.03 0.00 0.00 46.19 44.91 1xxe s LEU 194 CO 0.00 0.08 0.00 0.61 0.23 0.00 0.00 176.35 177.27 1xxe n GLY 195 N -0.17 0.39 0.28 -3.19 0.00 -1.25 -3.59 105.19 97.65 1xxe n GLY 195 Ca -0.09 -0.92 0.17 0.00 0.00 0.00 0.00 46.02 45.17 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 -0.01 1.61 1.57 -1.24 -2.22 116.57 116.28 1xxe h LYS 196 Ca -0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1xxe h LYS 196 Cb 0.61 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.92 1xxe h LYS 196 CO 0.04 0.04 -0.62 0.41 -0.57 0.00 0.00 179.45 178.75 1xxe n GLY 197 N -0.11 -0.34 3.71 3.86 0.00 1.00 -4.65 105.19 108.66 1xxe n GLY 197 Ca 0.00 -0.53 -0.42 0.00 0.00 0.00 0.00 46.02 45.07 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 -2.44 1.36 0.21 -0.02 0.00 0.12 -4.66 107.32 101.90 1xxe s GLY 198 Ca 0.11 1.48 -0.05 0.00 0.00 0.00 0.00 44.72 46.27 1xxe s GLY 198 CO 0.61 2.82 0.24 -1.35 0.00 0.00 0.00 173.10 175.42 1xxe s SER 199 N 1.37 0.08 0.35 1.64 1.04 -1.26 -5.01 113.70 111.91 1xxe s SER 199 Ca 0.74 -1.24 0.27 0.00 0.48 0.00 0.00 55.95 56.19 1xxe s SER 199 Cb -0.47 0.44 1.06 0.00 0.10 0.00 0.00 66.02 67.16 1xxe s SER 199 CO 0.32 -0.93 1.80 -0.07 0.98 0.00 0.00 173.24 175.33 1xxe h LEU 200 N 2.51 0.00 -0.02 2.42 3.38 -1.95 0.41 115.31 122.06 1xxe h LEU 200 Ca -0.33 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.64 1xxe h LEU 200 Cb 1.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.00 1xxe h LEU 200 CO 0.48 0.00 -0.29 1.17 0.09 0.00 0.00 178.44 179.88 1xxe n LYS 201 N -2.53 0.05 -0.10 1.13 4.81 -1.26 -3.98 118.16 116.29 1xxe n LYS 201 Ca 0.02 -0.02 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1xxe n LYS 201 Cb 0.28 -1.50 0.00 0.00 0.02 0.00 0.00 35.03 33.83 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 -1.46 0.18 -3.69 3.14 5.03 -0.84 -4.68 115.26 112.94 1xxe n ASN 202 Ca 0.07 -1.30 -0.10 0.00 0.87 0.00 0.00 54.58 54.12 1xxe n ASN 202 Cb 0.33 -0.05 -0.10 0.00 -1.02 0.00 0.00 39.78 38.95 1xxe n ASN 202 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 1xxe s THR 203 N -0.12 -0.02 -0.35 3.41 2.01 0.14 -4.21 115.64 116.50 1xxe s THR 203 Ca 0.01 0.06 -0.21 0.00 0.31 0.00 0.00 61.69 61.86 1xxe s THR 203 Cb 0.01 -0.67 0.00 0.00 0.01 0.00 0.00 72.50 71.85 1xxe s THR 203 CO 0.00 0.03 0.67 -0.22 -0.69 0.00 0.00 174.62 174.41 1xxe s LEU 204 N 1.24 4.22 -0.24 4.42 2.96 -0.97 -4.24 118.68 126.07 1xxe s LEU 204 Ca -0.08 0.22 -0.10 0.00 -0.22 0.00 0.00 54.13 53.95 1xxe s LEU 204 Cb -0.07 -2.84 -0.05 0.00 0.50 0.00 0.00 46.19 43.73 1xxe s LEU 204 CO -0.12 -0.62 0.15 -0.69 -1.32 0.00 0.00 176.35 173.76 1xxe s VAL 205 N 2.79 5.25 -0.01 1.68 1.01 -1.26 -0.62 120.40 129.25 1xxe s VAL 205 Ca 0.26 0.14 -0.02 0.00 0.00 0.00 0.00 61.98 62.36 1xxe s VAL 205 Cb -0.14 -3.44 -0.04 0.00 0.00 0.00 0.00 36.38 32.75 1xxe s VAL 205 CO 0.15 0.35 0.17 -0.76 0.00 0.00 0.00 175.10 175.01 1xxe s LEU 206 N 1.04 4.29 0.09 3.92 1.43 0.96 -3.03 118.68 127.38 1xxe s LEU 206 Ca 0.07 0.31 0.04 0.00 -1.03 0.00 0.00 54.13 53.52 1xxe s LEU 206 Cb -0.14 -2.57 -0.04 0.00 0.03 0.00 0.00 46.19 43.48 1xxe s LEU 206 CO 0.04 0.26 0.06 -0.83 0.23 0.00 0.00 176.35 176.11 1xxe s GLY 207 N -1.92 1.98 0.60 -3.19 0.00 0.16 -2.37 107.32 102.57 1xxe s GLY 207 Ca 0.27 -1.05 0.29 0.00 0.00 0.00 0.00 44.72 44.23 1xxe s GLY 207 CO 0.18 -1.04 1.62 1.70 0.00 0.00 0.00 173.10 175.57 1xxe h LYS 208 N 3.28 0.00 0.00 2.90 3.64 -1.98 -2.92 116.57 121.49 1xxe h LYS 208 Ca -0.47 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 1xxe h LYS 208 Cb 1.17 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.99 1xxe h LYS 208 CO 0.64 0.00 -0.03 -3.47 -2.27 0.00 0.00 179.45 174.32 1xxe n ASP 209 N -3.53 0.00 -3.84 4.20 2.03 -1.26 -1.51 116.55 112.64 1xxe n ASP 209 Ca 0.17 -1.05 -0.10 0.00 0.52 0.00 0.00 54.79 54.32 1xxe n ASP 209 Cb 1.13 -0.01 -0.08 0.00 -0.72 0.00 0.00 41.12 41.44 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 0.72 -0.24 -0.67 2.20 -1.10 -5.00 119.74 115.64 1xxe s LYS 210 Ca 0.00 -0.65 -0.13 0.00 -0.36 0.00 0.00 55.97 54.83 1xxe s LYS 210 Cb 0.00 0.30 -0.04 0.00 -1.51 0.00 0.00 37.83 36.57 1xxe s LYS 210 CO 0.00 -0.21 0.26 0.08 -0.36 0.00 0.00 175.35 175.12 1xxe s VAL 211 N -2.70 5.28 -0.03 4.02 1.01 -1.26 0.36 120.40 127.07 1xxe s VAL 211 Ca -0.04 0.38 -0.22 0.00 0.00 0.00 0.00 61.98 62.10 1xxe s VAL 211 Cb -0.00 -3.60 -0.16 0.00 0.00 0.00 0.00 36.38 32.62 1xxe s VAL 211 CO -0.05 0.27 1.00 1.88 0.00 0.00 0.00 175.10 178.20 1xxe h TYR 212 N 7.74 -0.25 -2.24 5.22 -1.99 -1.88 -3.44 116.97 120.12 1xxe h TYR 212 Ca -0.36 -0.01 -0.60 0.00 2.00 0.00 0.00 58.73 59.76 1xxe h TYR 212 Cb 1.17 0.08 0.06 0.00 2.00 0.00 0.00 36.73 40.05 1xxe h TYR 212 CO 0.70 0.15 0.66 0.09 -0.00 0.00 0.00 178.16 179.76 1xxe n ASN 213 N -4.99 2.64 0.20 3.88 3.02 -1.26 -4.86 115.26 113.91 1xxe n ASN 213 Ca -0.08 1.11 0.08 0.00 -0.03 0.00 0.00 54.58 55.65 1xxe n ASN 213 Cb 0.26 -1.37 0.39 0.00 -0.61 0.00 0.00 39.78 38.45 1xxe n ASN 213 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1xxe h PRO 214 N 5.12 0.00 0.00 3.52 0.13 -1.97 -2.80 132.00 136.00 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 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 1xxe h PRO 214 CO 0.83 0.30 0.00 -1.91 -0.23 0.00 0.00 178.00 176.98 1xxe n GLU 215 N -3.45 0.42 0.00 0.86 4.07 -1.26 -4.99 120.64 116.28 1xxe n GLU 215 Ca 0.00 0.05 0.00 0.00 -0.06 0.00 0.00 57.16 57.15 1xxe n GLU 215 Cb 0.47 -1.50 0.00 0.00 -0.06 0.00 0.00 31.44 30.35 1xxe n GLU 215 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1xxe n GLY 216 N 0.65 -1.66 3.86 8.31 0.00 -1.06 -4.83 105.19 110.45 1xxe n GLY 216 Ca 0.12 -1.28 -0.32 0.00 0.00 0.00 0.00 46.02 44.54 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 4.12 -0.06 0.99 1.43 -1.26 -4.93 118.68 118.97 1xxe s LEU 217 Ca 0.00 1.12 -0.09 0.00 -1.03 0.00 0.00 54.13 54.13 1xxe s LEU 217 Cb 0.00 -3.89 -0.05 0.00 0.03 0.00 0.00 46.19 42.28 1xxe s LEU 217 CO 0.00 -0.14 0.38 -0.09 0.23 0.00 0.00 176.35 176.73 1xxe h ARG 218 N 2.42 -0.31 -6.62 1.70 9.65 -1.98 -3.46 114.38 115.78 1xxe h ARG 218 Ca -0.47 0.02 -0.66 0.00 -1.10 0.00 0.00 59.98 57.77 1xxe h ARG 218 Cb 1.17 0.07 -0.17 0.00 -1.39 0.00 0.00 29.97 29.65 1xxe h ARG 218 CO 0.67 -0.20 -0.79 0.71 2.80 0.00 0.00 179.97 183.16 1xxe s TYR 219 N -2.58 2.49 -1.61 2.20 2.02 -1.26 -4.97 117.35 113.64 1xxe s TYR 219 Ca -0.05 -0.28 0.01 0.00 -0.37 0.00 0.00 57.07 56.38 1xxe s TYR 219 Cb 0.00 -1.27 0.05 0.00 -0.40 0.00 0.00 41.96 40.35 1xxe s TYR 219 CO 0.14 0.45 0.74 0.39 -1.57 0.00 0.00 175.55 175.71 1xxe n GLU 220 N 0.42 0.02 -1.36 -0.62 4.71 -1.26 -1.07 120.64 121.48 1xxe n GLU 220 Ca -0.13 0.19 0.04 0.00 -0.01 0.00 0.00 57.16 57.25 1xxe n GLU 220 Cb 0.54 -1.50 0.04 0.00 -1.01 0.00 0.00 31.44 29.52 1xxe n GLU 220 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 1xxe n ASN 221 N -1.20 1.07 -0.30 1.62 3.02 -1.26 -4.89 115.26 113.32 1xxe n ASN 221 Ca 0.01 -2.24 0.05 0.00 -0.03 0.00 0.00 54.58 52.36 1xxe n ASN 221 Cb 0.01 -0.33 0.19 0.00 -0.61 0.00 0.00 39.78 39.04 1xxe n ASN 221 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 1xxe h GLU 222 N 0.98 0.77 -0.27 3.52 4.81 -1.48 0.28 114.58 123.18 1xxe h GLU 222 Ca -0.20 -0.05 -0.17 0.00 -0.13 0.00 0.00 59.36 58.82 1xxe h GLU 222 Cb 1.78 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 30.98 1xxe h GLU 222 CO 0.09 0.51 -0.51 -1.35 -0.73 0.00 0.00 179.01 177.02 1xxe h PRO 223 N 0.79 0.77 0.00 0.92 0.11 -1.87 -2.19 132.00 130.54 1xxe h PRO 223 Ca 0.43 -0.46 -0.15 0.00 0.11 0.00 0.00 66.00 65.92 1xxe h PRO 223 Cb 0.45 0.04 -0.02 0.00 0.11 0.00 0.00 31.00 31.58 1xxe h PRO 223 CO -0.27 1.09 -0.82 -0.39 -0.21 0.00 0.00 178.00 177.40 1xxe h VAL 224 N 0.60 1.08 -0.53 3.15 -1.51 -1.84 -2.68 116.25 114.52 1xxe h VAL 224 Ca 0.02 -2.59 -0.12 0.00 -1.23 0.00 0.00 66.70 62.79 1xxe h VAL 224 Cb 1.08 2.51 -0.02 0.00 -2.13 0.00 0.00 31.29 32.74 1xxe h VAL 224 CO 0.11 0.62 -0.13 0.03 -1.23 0.00 0.00 177.57 176.97 1xxe h ARG 225 N 0.00 1.02 -0.53 5.19 3.08 -0.41 -2.25 114.38 120.48 1xxe h ARG 225 Ca -0.04 -0.39 -0.09 0.00 0.07 0.00 0.00 59.98 59.53 1xxe h ARG 225 Cb 1.56 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 31.53 1xxe h ARG 225 CO 0.08 1.08 -0.04 1.25 -1.07 0.00 0.00 179.97 181.27 1xxe h HIS 226 N 0.90 1.06 -0.84 3.04 2.76 -1.38 -0.97 115.15 119.72 1xxe h HIS 226 Ca 0.14 -0.20 0.08 0.00 -2.20 0.00 0.00 60.37 58.19 1xxe h HIS 226 Cb 0.70 -0.27 -0.07 0.00 1.55 0.00 0.00 27.41 29.32 1xxe h HIS 226 CO 0.05 0.98 0.50 -0.22 -1.30 0.00 0.00 177.93 177.94 1xxe h LYS 227 N 0.83 0.86 -0.27 5.26 3.11 -1.16 0.15 116.57 125.35 1xxe h LYS 227 Ca 0.15 -0.05 -0.07 0.00 -2.81 0.00 0.00 60.65 57.86 1xxe h LYS 227 Cb 0.58 -0.19 -0.01 0.00 -1.00 0.00 0.00 32.23 31.61 1xxe h LYS 227 CO 0.03 0.57 -0.11 0.28 -2.81 0.00 0.00 179.45 177.41 1xxe h VAL 228 N 0.88 1.29 -0.94 2.00 2.07 -1.10 -0.64 116.25 119.81 1xxe h VAL 228 Ca 0.39 -1.17 0.10 0.00 0.82 0.00 0.00 66.70 66.83 1xxe h VAL 228 Cb 0.27 1.49 -0.08 0.00 -1.52 0.00 0.00 31.29 31.45 1xxe h VAL 228 CO -0.21 0.37 0.58 0.15 0.02 0.00 0.00 177.57 178.48 1xxe h PHE 229 N 0.29 1.06 -0.26 1.57 3.57 -0.10 -1.29 116.94 121.77 1xxe h PHE 229 Ca 0.06 0.03 -0.20 0.00 3.53 0.00 0.00 57.97 61.40 1xxe h PHE 229 Cb 0.61 -0.33 0.00 0.00 2.79 0.00 0.00 35.95 39.02 1xxe h PHE 229 CO 0.06 0.45 -0.60 -0.44 -2.23 0.00 0.00 178.31 175.55 1xxe h ASP 230 N 0.96 0.98 -0.68 0.41 5.19 -0.50 -2.61 116.42 120.17 1xxe h ASP 230 Ca 0.45 -0.55 0.09 0.00 -0.62 0.00 0.00 57.03 56.40 1xxe h ASP 230 Cb 0.39 -0.28 -0.04 0.00 0.18 0.00 0.00 39.33 39.57 1xxe h ASP 230 CO -0.24 1.36 0.45 0.25 -3.12 0.00 0.00 179.24 177.93 1xxe h LEU 231 N 0.65 0.52 -0.02 1.55 5.85 0.01 -1.21 115.31 122.66 1xxe h LEU 231 Ca 0.00 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.71 1xxe h LEU 231 Cb 1.21 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.15 1xxe h LEU 231 CO 0.13 0.32 -0.06 0.40 -0.34 0.00 0.00 178.44 178.89 1xxe h ILE 232 N 0.58 1.47 -1.06 4.05 2.04 -1.26 -1.95 117.51 121.37 1xxe h ILE 232 Ca 0.31 -1.46 0.30 0.00 1.00 0.00 0.00 64.86 65.01 1xxe h ILE 232 Cb 0.45 2.39 -0.05 0.00 -0.74 0.00 0.00 36.82 38.88 1xxe h ILE 232 CO -0.10 0.39 0.75 1.23 0.00 0.00 0.00 178.15 180.42 1xxe h GLY 233 N -0.49 0.18 1.73 5.37 0.00 -0.91 0.74 103.07 109.68 1xxe h GLY 233 Ca -0.00 -0.03 -0.19 0.00 0.00 0.00 0.00 47.33 47.10 1xxe h GLY 233 CO 0.01 -0.02 -1.04 -0.55 0.00 0.00 0.00 176.54 174.95 1xxe h ASP 234 N 0.06 0.00 1.64 0.19 5.19 -1.02 -3.27 116.42 119.21 1xxe h ASP 234 Ca 0.52 0.00 -0.06 0.00 -0.62 0.00 0.00 57.03 56.87 1xxe h ASP 234 Cb 1.95 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 41.45 1xxe h ASP 234 CO -0.05 0.83 -0.27 -0.07 -3.12 0.00 0.00 179.24 176.56 1xxe h LEU 235 N 0.00 0.00 0.00 1.55 3.38 0.12 -3.00 115.31 117.35 1xxe h LEU 235 Ca -0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1xxe h LEU 235 Cb 1.70 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.45 1xxe h LEU 235 CO 0.10 0.27 0.00 0.00 0.09 0.00 0.00 178.44 178.90 1xxe n TYR 236 N -3.18 0.00 -0.16 1.13 9.36 0.21 -2.80 117.16 121.72 1xxe n TYR 236 Ca 0.03 0.00 0.29 0.00 3.32 0.00 0.00 57.90 61.53 1xxe n TYR 236 Cb 0.62 -0.40 0.72 0.00 -0.63 0.00 0.00 39.34 39.65 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 0.00 -2.55 2.98 3.38 -1.67 1.79 115.31 119.24 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 0.20 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 1xxe h LEU 237 CO 0.00 0.00 -0.01 -0.07 0.09 0.00 0.00 178.44 178.45 1xxe h LEU 238 N 0.00 0.00 0.06 1.67 3.38 -1.80 -3.30 115.31 115.32 1xxe h LEU 238 Ca 0.42 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.36 1xxe h LEU 238 Cb 1.82 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.56 1xxe h LEU 238 CO -0.00 0.01 -0.02 0.61 0.09 0.00 0.00 178.44 179.12 1xxe n GLY 239 N -0.81 0.50 3.40 0.83 0.00 0.61 -5.02 105.19 104.70 1xxe n GLY 239 Ca -0.02 -0.80 -0.13 0.00 0.00 0.00 0.00 46.02 45.07 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 -2.78 -0.54 0.10 1.61 1.04 -1.26 -4.91 113.70 106.96 1xxe s SER 240 Ca 0.00 1.02 -0.35 0.00 0.48 0.00 0.00 55.95 57.11 1xxe s SER 240 Cb 0.00 1.02 -0.18 0.00 0.10 0.00 0.00 66.02 66.96 1xxe s SER 240 CO 0.00 -0.18 0.92 -2.65 0.98 0.00 0.00 173.24 172.31 1xxe n PRO 241 N 2.98 0.25 -4.10 4.02 -0.02 -1.26 -4.52 135.00 132.35 1xxe n PRO 241 Ca -0.14 0.09 -0.35 0.00 -2.02 0.00 0.00 63.50 61.07 1xxe n PRO 241 Cb 0.56 -1.43 -0.09 0.00 -0.02 0.00 0.00 33.50 32.53 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 -0.35 4.82 -0.12 -1.45 1.01 -1.26 -0.42 120.40 122.63 1xxe s VAL 242 Ca 0.79 -0.04 0.02 0.00 0.00 0.00 0.00 61.98 62.75 1xxe s VAL 242 Cb -1.07 -3.10 0.01 0.00 0.00 0.00 0.00 36.38 32.22 1xxe s VAL 242 CO 0.56 0.55 -0.19 -0.54 0.00 0.00 0.00 175.10 175.48 1xxe s LYS 243 N -0.45 2.67 0.00 2.72 -0.14 0.11 -4.60 119.74 120.06 1xxe s LYS 243 Ca 0.10 -0.73 0.00 0.00 -1.36 0.00 0.00 55.97 53.98 1xxe s LYS 243 Cb -0.12 -2.18 0.00 0.00 -1.68 0.00 0.00 37.83 33.85 1xxe s LYS 243 CO 0.02 -0.02 0.00 0.41 -0.76 0.00 0.00 175.35 175.00 1xxe n GLY 244 N 4.07 1.40 3.44 -3.33 0.00 -1.20 -1.79 105.19 107.78 1xxe n GLY 244 Ca -0.20 -1.19 -0.41 0.00 0.00 0.00 0.00 46.02 44.23 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 -1.99 3.12 0.05 1.61 2.20 0.15 -1.72 119.74 123.17 1xxe s LYS 245 Ca 0.00 -0.89 0.06 0.00 -0.36 0.00 0.00 55.97 54.78 1xxe s LYS 245 Cb 0.00 -3.76 -0.04 0.00 -1.51 0.00 0.00 37.83 32.52 1xxe s LYS 245 CO 0.00 -0.59 -0.10 -0.06 -0.36 0.00 0.00 175.35 174.24 1xxe s PHE 246 N 1.63 2.77 0.03 4.03 0.40 0.32 -0.33 117.98 126.84 1xxe s PHE 246 Ca 0.04 -0.13 0.06 0.00 -0.60 0.00 0.00 56.93 56.31 1xxe s PHE 246 Cb -0.18 -1.51 -0.02 0.00 0.51 0.00 0.00 43.02 41.82 1xxe s PHE 246 CO 0.08 0.38 -0.18 -0.47 0.70 0.00 0.00 175.22 175.73 1xxe s TYR 247 N -1.08 1.55 -0.03 0.36 6.14 0.38 -0.58 117.35 124.08 1xxe s TYR 247 Ca 0.19 -0.35 -0.00 0.00 0.64 0.00 0.00 57.07 57.54 1xxe s TYR 247 Cb -0.11 -0.93 0.03 0.00 0.42 0.00 0.00 41.96 41.36 1xxe s TYR 247 CO 0.10 0.05 0.02 0.45 0.64 0.00 0.00 175.55 176.82 1xxe s SER 248 N -1.02 0.57 -0.28 4.32 0.15 0.32 -1.34 113.70 116.41 1xxe s SER 248 Ca 0.05 0.02 -0.03 0.00 0.70 0.00 0.00 55.95 56.69 1xxe s SER 248 Cb -0.08 -0.17 0.03 0.00 -1.71 0.00 0.00 66.02 64.09 1xxe s SER 248 CO 0.01 -0.15 0.00 0.12 1.20 0.00 0.00 173.24 174.42 1xxe s PHE 249 N 1.39 3.16 -1.24 3.44 5.36 -0.39 0.13 117.98 129.83 1xxe s PHE 249 Ca -0.05 -1.52 -0.16 0.00 -0.96 0.00 0.00 56.93 54.24 1xxe s PHE 249 Cb -0.13 -2.13 0.00 0.00 -0.34 0.00 0.00 43.02 40.42 1xxe s PHE 249 CO -0.03 -0.72 0.64 0.54 -1.46 0.00 0.00 175.22 174.20 1xxe n ARG 250 N 4.71 -1.68 -3.11 10.12 1.74 -0.38 -2.35 116.66 125.71 1xxe n ARG 250 Ca -0.15 0.37 -0.35 0.00 -0.77 0.00 0.00 57.85 56.95 1xxe n ARG 250 Cb 0.46 -3.97 -0.06 0.00 -1.02 0.00 0.00 32.46 27.86 1xxe n ARG 250 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1xxe s GLY 251 N -3.77 2.55 0.50 -0.13 0.00 -1.26 -4.27 107.32 100.93 1xxe s GLY 251 Ca 0.33 0.13 0.05 0.00 0.00 0.00 0.00 44.72 45.23 1xxe s GLY 251 CO 0.89 0.45 0.24 -0.32 0.00 0.00 0.00 173.10 174.36 1xxe s GLY 252 N -1.80 2.53 0.05 0.20 0.00 -1.26 -5.01 107.32 102.02 1xxe s GLY 252 Ca 0.46 -1.28 -0.22 0.00 0.00 0.00 0.00 44.72 43.68 1xxe s GLY 252 CO 0.20 -1.99 1.45 0.45 0.00 0.00 0.00 173.10 173.20 1xxe h HIS 253 N 1.10 0.26 0.51 1.90 3.86 -1.97 -2.22 115.15 118.60 1xxe h HIS 253 Ca -0.40 -0.05 -0.03 0.00 -1.16 0.00 0.00 60.37 58.73 1xxe h HIS 253 Cb 1.29 -0.07 0.01 0.00 1.06 0.00 0.00 27.41 29.70 1xxe h HIS 253 CO 1.01 0.51 -0.25 0.77 0.86 0.00 0.00 177.93 180.83 1xxe h SER 254 N -0.06 -0.59 -0.97 2.45 0.02 -1.89 -2.32 113.55 110.20 1xxe h SER 254 Ca 0.03 0.01 0.19 0.00 -0.84 0.00 0.00 61.79 61.19 1xxe h SER 254 Cb 0.42 0.15 -0.09 0.00 0.14 0.00 0.00 62.40 63.02 1xxe h SER 254 CO 0.01 -0.41 0.61 0.25 -1.14 0.00 0.00 176.83 176.16 1xxe h LEU 255 N -0.71 0.64 0.45 5.07 5.85 -1.97 -0.83 115.31 123.81 1xxe h LEU 255 Ca -0.07 0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 1xxe h LEU 255 Cb 0.54 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.52 1xxe h LEU 255 CO 0.12 0.24 -0.27 0.78 -0.34 0.00 0.00 178.44 178.96 1xxe h ASN 256 N 0.63 -0.69 -0.95 1.25 -0.26 -0.88 -1.89 115.58 112.79 1xxe h ASN 256 Ca 0.53 0.04 0.22 0.00 -0.56 0.00 0.00 56.30 56.53 1xxe h ASN 256 Cb 1.00 0.20 -0.12 0.00 -1.06 0.00 0.00 38.32 38.35 1xxe h ASN 256 CO -0.29 -0.43 0.51 0.58 -1.06 0.00 0.00 177.43 176.74 1xxe h VAL 257 N -0.69 0.56 -0.44 2.81 2.07 -0.66 0.20 116.25 120.11 1xxe h VAL 257 Ca -0.05 -0.19 0.06 0.00 0.82 0.00 0.00 66.70 67.34 1xxe h VAL 257 Cb 0.56 -0.04 -0.05 0.00 -1.52 0.00 0.00 31.29 30.24 1xxe h VAL 257 CO 0.05 0.10 0.12 0.50 0.02 0.00 0.00 177.57 178.37 1xxe h LYS 258 N 0.55 0.27 -0.32 1.57 3.64 -0.72 0.47 116.57 122.04 1xxe h LYS 258 Ca 0.59 -0.02 0.07 0.00 -1.27 0.00 0.00 60.65 60.02 1xxe h LYS 258 Cb 1.06 -0.06 -0.07 0.00 -0.41 0.00 0.00 32.23 32.76 1xxe h LYS 258 CO -0.47 0.18 -0.11 1.25 -2.27 0.00 0.00 179.45 178.03 1xxe h LEU 259 N 0.27 -0.40 -0.69 5.20 5.85 -0.18 -0.23 115.31 125.13 1xxe h LEU 259 Ca 0.21 0.11 -0.05 0.00 0.84 0.00 0.00 57.88 58.99 1xxe h LEU 259 Cb 0.24 0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.48 1xxe h LEU 259 CO -0.25 -0.15 0.24 0.58 -0.34 0.00 0.00 178.44 178.53 1xxe h VAL 260 N -0.05 1.25 0.06 1.05 2.07 -0.84 -1.64 116.25 118.15 1xxe h VAL 260 Ca 0.16 -0.82 0.01 0.00 0.82 0.00 0.00 66.70 66.87 1xxe h VAL 260 Cb 0.29 0.49 -0.02 0.00 -1.52 0.00 0.00 31.29 30.54 1xxe h VAL 260 CO -0.36 0.32 -0.12 0.11 0.02 0.00 0.00 177.57 177.55 1xxe h LYS 261 N 0.99 -0.23 -0.33 1.57 1.79 0.12 0.38 116.57 120.86 1xxe h LYS 261 Ca 0.23 0.02 -0.03 0.00 -2.18 0.00 0.00 60.65 58.68 1xxe h LYS 261 Cb 0.25 0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 30.94 1xxe h LYS 261 CO -0.01 -0.15 0.08 0.93 -1.08 0.00 0.00 179.45 179.21 1xxe h GLU 262 N -0.23 0.53 -0.47 3.15 5.08 -1.00 -0.52 114.58 121.12 1xxe h GLU 262 Ca 0.02 -0.13 0.02 0.00 -1.00 0.00 0.00 59.36 58.28 1xxe h GLU 262 Cb 0.26 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.41 1xxe h GLU 262 CO -0.08 0.59 0.28 -0.07 -1.00 0.00 0.00 179.01 178.73 1xxe h LEU 263 N 0.37 0.44 -1.29 1.33 3.38 -1.04 0.24 115.31 118.75 1xxe h LEU 263 Ca 0.10 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.01 1xxe h LEU 263 Cb 0.30 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 1xxe h LEU 263 CO 0.00 0.32 -0.19 0.00 0.09 0.00 0.00 178.44 178.65 1xxe h ALA 264 N 1.21 1.41 0.00 1.53 0.00 -0.02 -1.84 119.26 121.55 1xxe h ALA 264 Ca 0.19 -0.25 -0.17 0.00 0.00 0.00 0.00 54.91 54.67 1xxe h ALA 264 Cb 0.02 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1xxe h ALA 264 CO -0.09 0.41 -0.83 0.87 0.00 0.00 0.00 179.25 179.61 1xxe h LYS 265 N 0.23 0.00 -0.04 0.00 1.57 -0.15 -2.75 116.57 115.43 1xxe h LYS 265 Ca 0.04 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.80 1xxe h LYS 265 Cb 0.48 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.79 1xxe h LYS 265 CO 0.03 0.83 -0.07 0.87 -0.57 0.00 0.00 179.45 180.54 1xxe h LYS 266 N 0.00 0.11 -0.01 3.15 1.57 0.02 -3.04 116.57 118.37 1xxe h LYS 266 Ca -0.01 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 1xxe h LYS 266 Cb 1.53 0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.85 1xxe h LYS 266 CO 0.11 0.64 0.00 0.94 -0.57 0.00 0.00 179.45 180.57 1xxe n GLN 267 N -4.72 1.05 0.27 3.15 7.27 -0.75 -3.99 117.38 119.67 1xxe n GLN 267 Ca -0.08 -0.08 -0.12 0.00 0.07 0.00 0.00 57.00 56.79 1xxe n GLN 267 Cb 0.33 -1.28 -0.06 0.00 2.41 0.00 0.00 30.24 31.64 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 0.15 -0.72 0.00 3.69 3.64 -1.36 -3.38 116.57 118.58 1xxe h LYS 268 Ca 0.00 0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 1xxe h LYS 268 Cb 0.03 0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.02 1xxe h LYS 268 CO 0.00 -0.46 0.00 1.28 -2.27 0.00 0.00 179.45 178.00 1xxe n LEU 269 N -5.28 0.00 -0.49 5.20 4.77 -1.26 -5.12 117.00 114.83 1xxe n LEU 269 Ca -0.10 0.28 0.14 0.00 -0.03 0.00 0.00 56.01 56.30 1xxe n LEU 269 Cb 0.31 0.00 0.52 0.00 -2.33 0.00 0.00 43.42 41.91 1xxe n LEU 269 CO 0.24 0.00 0.87 0.35 -1.33 0.00 0.00 177.39 177.52