#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ng3 n LYS 2 N 0.00 -2.33 -0.02 2.12 5.02 -1.26 -5.01 118.16 116.69 1ng3 n LYS 2 Ca 0.00 -0.59 0.05 0.00 -2.02 0.00 0.00 58.31 55.75 1ng3 n LYS 2 Cb 0.00 -0.63 -0.10 0.00 -0.02 0.00 0.00 35.03 34.27 1ng3 n LYS 2 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 1ng3 n ARG 3 N -3.00 0.66 -3.80 1.97 3.00 -1.26 -4.82 116.66 109.41 1ng3 n ARG 3 Ca 0.05 -0.10 -0.13 0.00 -0.00 0.00 0.00 57.85 57.67 1ng3 n ARG 3 Cb 0.21 -1.32 -0.13 0.00 0.00 0.00 0.00 32.46 31.23 1ng3 n ARG 3 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.63 176.05 1ng3 s HIS 4 N -2.82 -0.21 0.05 -0.14 2.46 -1.26 -0.87 115.29 112.50 1ng3 s HIS 4 Ca -0.05 0.51 0.02 0.00 0.47 0.00 0.00 55.06 56.01 1ng3 s HIS 4 Cb 0.08 0.05 -0.03 0.00 -0.13 0.00 0.00 32.58 32.55 1ng3 s HIS 4 CO 0.55 -0.12 -0.06 0.71 -2.47 0.00 0.00 174.74 173.35 1ng3 s TYR 5 N 0.31 0.62 0.12 3.88 2.02 -0.10 -4.96 117.35 119.25 1ng3 s TYR 5 Ca -0.02 -0.60 -0.14 0.00 -0.37 0.00 0.00 57.07 55.95 1ng3 s TYR 5 Cb -0.03 -0.38 -0.04 0.00 -0.40 0.00 0.00 41.96 41.11 1ng3 s TYR 5 CO -0.01 -0.13 1.51 0.93 -1.57 0.00 0.00 175.55 176.28 1ng3 h GLU 6 N 4.22 0.78 -4.33 -0.62 5.08 -0.92 -3.07 114.58 115.71 1ng3 h GLU 6 Ca -0.35 -0.32 -0.32 0.00 -1.00 0.00 0.00 59.36 57.37 1ng3 h GLU 6 Cb 1.19 -0.03 -0.28 0.00 0.50 0.00 0.00 28.75 30.14 1ng3 h GLU 6 CO 0.46 0.94 -0.75 0.00 -1.00 0.00 0.00 179.01 178.65 1ng3 s ALA 7 N -4.68 0.45 -0.16 3.43 0.00 -0.95 -1.20 121.76 118.64 1ng3 s ALA 7 Ca -0.12 -0.28 0.00 0.00 0.00 0.00 0.00 51.96 51.57 1ng3 s ALA 7 Cb 0.10 -0.10 0.03 0.00 0.00 0.00 0.00 23.12 23.15 1ng3 s ALA 7 CO 0.82 0.09 -0.14 0.08 0.00 0.00 0.00 175.76 176.62 1ng3 s VAL 8 N -0.24 1.61 -0.24 0.00 1.01 0.27 -0.78 120.40 122.02 1ng3 s VAL 8 Ca 0.01 -0.73 -0.10 0.00 0.00 0.00 0.00 61.98 61.16 1ng3 s VAL 8 Cb -0.03 -1.54 -0.05 0.00 0.00 0.00 0.00 36.38 34.76 1ng3 s VAL 8 CO -0.00 0.40 0.16 -0.69 0.00 0.00 0.00 175.10 174.97 1ng3 s VAL 9 N 1.46 5.34 -0.55 2.92 1.01 0.17 -0.86 120.40 129.89 1ng3 s VAL 9 Ca 0.04 0.17 -0.14 0.00 0.00 0.00 0.00 61.98 62.05 1ng3 s VAL 9 Cb -0.14 -3.50 0.14 0.00 0.00 0.00 0.00 36.38 32.89 1ng3 s VAL 9 CO -0.10 0.34 0.49 -0.63 0.00 0.00 0.00 175.10 175.20 1ng3 s ILE 10 N 1.12 5.02 0.00 2.22 1.01 0.44 -0.36 121.20 130.66 1ng3 s ILE 10 Ca 0.07 -1.67 0.00 0.00 0.00 0.00 0.00 60.65 59.06 1ng3 s ILE 10 Cb -0.14 -4.22 0.00 0.00 0.01 0.00 0.00 42.46 38.11 1ng3 s ILE 10 CO 0.05 -0.87 0.00 0.61 0.00 0.00 0.00 174.94 174.73 1ng3 n GLY 11 N 5.04 4.13 2.35 6.18 0.00 -0.62 -0.58 105.19 121.68 1ng3 n GLY 11 Ca -0.10 -1.07 -0.26 0.00 0.00 0.00 0.00 46.02 44.59 1ng3 n GLY 11 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ng3 n GLY 12 N -0.21 6.07 0.42 -0.02 0.00 -1.26 -4.20 105.19 105.98 1ng3 n GLY 12 Ca 0.00 -2.72 -0.02 0.00 0.00 0.00 0.00 46.02 43.28 1ng3 n GLY 12 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ng3 n GLY 13 N -0.55 1.29 0.36 -0.02 0.00 -1.26 0.32 105.19 105.34 1ng3 n GLY 13 Ca 0.40 -2.04 0.11 0.00 0.00 0.00 0.00 46.02 44.49 1ng3 n GLY 13 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1ng3 h ILE 14 N -0.22 0.90 0.68 -0.61 2.10 -1.93 -1.26 117.51 117.17 1ng3 h ILE 14 Ca -0.03 -0.19 -0.03 0.00 1.08 0.00 0.00 64.86 65.69 1ng3 h ILE 14 Cb 0.13 0.31 0.01 0.00 -1.09 0.00 0.00 36.82 36.18 1ng3 h ILE 14 CO 0.04 0.10 -0.33 0.40 -1.08 0.00 0.00 178.15 177.28 1ng3 h ILE 15 N 0.54 0.00 -0.71 2.19 1.08 -1.92 -1.16 117.51 117.54 1ng3 h ILE 15 Ca 0.33 -0.21 0.07 0.00 -0.39 0.00 0.00 64.86 64.66 1ng3 h ILE 15 Cb 0.55 0.00 -0.04 0.00 -3.07 0.00 0.00 36.82 34.25 1ng3 h ILE 15 CO -0.11 0.00 0.47 1.23 -0.69 0.00 0.00 178.15 179.05 1ng3 h GLY 16 N -1.12 0.91 0.92 5.37 0.00 -1.70 -0.78 103.07 106.67 1ng3 h GLY 16 Ca -0.09 -0.28 -0.01 0.00 0.00 0.00 0.00 47.33 46.95 1ng3 h GLY 16 CO 0.15 0.19 0.12 1.76 0.00 0.00 0.00 176.54 178.77 1ng3 h SER 17 N 0.69 0.33 -0.28 0.19 0.02 -1.19 0.10 113.55 113.42 1ng3 h SER 17 Ca 0.31 -0.13 -0.01 0.00 -0.84 0.00 0.00 61.79 61.13 1ng3 h SER 17 Cb 0.33 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 62.77 1ng3 h SER 17 CO -0.11 0.37 0.15 0.00 -1.14 0.00 0.00 176.83 176.11 1ng3 h ALA 18 N 0.97 0.36 -0.36 3.77 0.00 -0.42 -1.81 119.26 121.77 1ng3 h ALA 18 Ca 0.09 -0.07 0.06 0.00 0.00 0.00 0.00 54.91 54.99 1ng3 h ALA 18 Cb 0.13 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 1ng3 h ALA 18 CO -0.01 -0.11 0.03 0.82 0.00 0.00 0.00 179.25 179.98 1ng3 h ILE 19 N 0.34 0.77 -0.71 0.00 2.04 -0.91 -1.24 117.51 117.79 1ng3 h ILE 19 Ca 0.10 -0.05 0.02 0.00 1.00 0.00 0.00 64.86 65.94 1ng3 h ILE 19 Cb 0.06 0.62 -0.04 0.00 -0.74 0.00 0.00 36.82 36.72 1ng3 h ILE 19 CO -0.02 0.03 0.47 0.00 0.00 0.00 0.00 178.15 178.63 1ng3 h ALA 20 N 1.29 1.55 0.16 1.87 0.00 -0.72 -1.97 119.26 121.45 1ng3 h ALA 20 Ca 0.17 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1ng3 h ALA 20 Cb 0.22 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1ng3 h ALA 20 CO -0.26 0.39 -0.08 -0.92 0.00 0.00 0.00 179.25 178.37 1ng3 h TYR 21 N 0.90 -0.20 -0.12 0.00 3.20 -0.39 -1.57 116.97 118.78 1ng3 h TYR 21 Ca 0.28 -0.00 -0.03 0.00 3.14 0.00 0.00 58.73 62.12 1ng3 h TYR 21 Cb -0.00 0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.33 1ng3 h TYR 21 CO -0.00 0.10 -0.05 1.88 -1.64 0.00 0.00 178.16 178.45 1ng3 h TYR 22 N -0.50 0.18 -0.21 -3.82 0.05 -1.09 0.44 116.97 112.02 1ng3 h TYR 22 Ca -0.02 -0.01 -0.18 0.00 0.05 0.00 0.00 58.73 58.57 1ng3 h TYR 22 Cb 0.39 -0.05 0.00 0.00 1.01 0.00 0.00 36.73 38.08 1ng3 h TYR 22 CO 0.02 0.23 -0.56 -0.07 -1.05 0.00 0.00 178.16 176.73 1ng3 h LEU 23 N 0.18 0.85 -1.02 3.88 3.38 -1.32 -1.09 115.31 120.16 1ng3 h LEU 23 Ca 0.04 -0.58 -0.01 0.00 0.09 0.00 0.00 57.88 57.42 1ng3 h LEU 23 Cb 0.21 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.67 1ng3 h LEU 23 CO 0.01 1.27 0.49 0.00 0.09 0.00 0.00 178.44 180.30 1ng3 h ALA 24 N 0.60 1.26 -0.50 1.53 0.00 -0.58 -1.55 119.26 120.02 1ng3 h ALA 24 Ca -0.01 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.71 1ng3 h ALA 24 Cb 1.18 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 1ng3 h ALA 24 CO 0.12 0.62 0.01 -0.22 0.00 0.00 0.00 179.25 179.77 1ng3 h LYS 25 N 1.18 0.84 0.00 0.00 3.64 -0.74 0.14 116.57 121.62 1ng3 h LYS 25 Ca 0.30 -0.23 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 1ng3 h LYS 25 Cb -0.01 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.71 1ng3 h LYS 25 CO -0.05 0.83 0.00 0.39 -2.27 0.00 0.00 179.45 178.35 1ng3 n GLU 26 N -4.21 0.93 -3.29 1.90 -0.58 -0.43 -4.90 120.64 110.07 1ng3 n GLU 26 Ca 0.03 0.00 -0.08 0.00 -0.42 0.00 0.00 57.16 56.69 1ng3 n GLU 26 Cb 0.30 -1.17 0.00 0.00 -0.57 0.00 0.00 31.44 30.00 1ng3 n GLU 26 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1ng3 n ASN 27 N -0.67 -6.89 -3.98 1.62 2.85 0.04 -5.01 115.26 103.22 1ng3 n ASN 27 Ca 0.08 -0.35 -0.28 0.00 -0.11 0.00 0.00 54.58 53.91 1ng3 n ASN 27 Cb 0.03 -4.21 -0.17 0.00 1.24 0.00 0.00 39.78 36.68 1ng3 n ASN 27 CO 0.00 0.00 0.00 -0.75 -2.11 0.00 0.00 177.26 174.40 1ng3 s LYS 28 N -3.62 1.92 -0.76 1.20 2.47 -0.72 -5.01 119.74 115.22 1ng3 s LYS 28 Ca 0.01 -0.42 -0.24 0.00 -1.56 0.00 0.00 55.97 53.76 1ng3 s LYS 28 Cb -0.00 -1.80 -0.16 0.00 -1.46 0.00 0.00 37.83 34.40 1ng3 s LYS 28 CO 0.80 -0.20 2.40 -1.71 0.16 0.00 0.00 175.35 176.79 1ng3 n ASN 29 N 4.69 1.25 -4.42 1.43 5.15 -1.26 -4.48 115.26 117.63 1ng3 n ASN 29 Ca -0.16 -0.91 -0.29 0.00 -0.60 0.00 0.00 54.58 52.62 1ng3 n ASN 29 Cb 0.50 -1.38 -0.13 0.00 -0.53 0.00 0.00 39.78 38.24 1ng3 n ASN 29 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 1ng3 s THR 30 N 11.14 2.46 0.07 -0.44 -4.23 -1.26 -0.25 115.64 123.12 1ng3 s THR 30 Ca 1.05 -1.57 0.05 0.00 -1.18 0.00 0.00 61.69 60.04 1ng3 s THR 30 Cb -0.37 -2.07 -0.03 0.00 1.34 0.00 0.00 72.50 71.37 1ng3 s THR 30 CO 0.25 0.16 -0.14 0.00 -0.54 0.00 0.00 174.62 174.35 1ng3 s ALA 31 N -1.03 1.19 -0.07 3.99 0.00 0.04 -2.05 121.76 123.83 1ng3 s ALA 31 Ca 0.15 -0.97 0.02 0.00 0.00 0.00 0.00 51.96 51.15 1ng3 s ALA 31 Cb -0.10 -0.12 0.01 0.00 0.00 0.00 0.00 23.12 22.91 1ng3 s ALA 31 CO 0.06 0.18 -0.12 -1.17 0.00 0.00 0.00 175.76 174.72 1ng3 s LEU 32 N -1.63 1.59 -0.31 0.00 0.20 -0.67 0.46 118.68 118.32 1ng3 s LEU 32 Ca -0.01 -0.30 -0.07 0.00 0.69 0.00 0.00 54.13 54.45 1ng3 s LEU 32 Cb -0.10 -0.82 0.02 0.00 -0.43 0.00 0.00 46.19 44.87 1ng3 s LEU 32 CO 0.02 0.01 0.09 -0.36 -0.29 0.00 0.00 176.35 175.83 1ng3 s PHE 33 N 0.79 3.18 -0.19 5.38 0.08 0.52 -1.00 117.98 126.74 1ng3 s PHE 33 Ca -0.12 -1.13 -0.04 0.00 0.12 0.00 0.00 56.93 55.76 1ng3 s PHE 33 Cb -0.15 -2.26 -0.02 0.00 -0.57 0.00 0.00 43.02 40.01 1ng3 s PHE 33 CO 0.02 -0.63 -0.03 -2.00 -0.10 0.00 0.00 175.22 172.49 1ng3 s GLU 34 N 1.47 3.56 0.26 0.44 2.56 -0.28 -1.60 118.70 125.12 1ng3 s GLU 34 Ca 0.01 -0.56 -0.01 0.00 0.00 0.00 0.00 54.97 54.42 1ng3 s GLU 34 Cb -0.18 -3.00 0.52 0.00 2.00 0.00 0.00 34.13 33.47 1ng3 s GLU 34 CO 0.03 0.03 1.79 1.03 -0.56 0.00 0.00 175.26 177.58 1ng3 h SER 35 N 7.40 0.66 0.00 -1.70 0.87 -1.84 0.38 113.55 119.32 1ng3 h SER 35 Ca -0.35 0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.28 1ng3 h SER 35 Cb 1.18 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 63.09 1ng3 h SER 35 CO 0.61 0.32 0.00 0.61 -0.53 0.00 0.00 176.83 177.84 1ng3 n GLY 36 N -1.33 1.82 3.54 5.77 0.00 -1.26 -3.36 105.19 110.37 1ng3 n GLY 36 Ca 0.17 -0.09 -0.29 0.00 0.00 0.00 0.00 46.02 45.80 1ng3 n GLY 36 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ng3 s THR 37 N 2.08 3.12 0.04 2.61 -4.23 -1.26 -0.79 115.64 117.21 1ng3 s THR 37 Ca 0.00 -1.42 -0.34 0.00 -1.18 0.00 0.00 61.69 58.75 1ng3 s THR 37 Cb 0.00 -2.46 -0.13 0.00 1.34 0.00 0.00 72.50 71.25 1ng3 s THR 37 CO 0.00 0.08 1.68 0.23 -0.54 0.00 0.00 174.62 176.07 1ng3 n MET 38 N 0.66 2.06 -1.98 3.99 0.00 -1.26 -1.33 117.12 119.27 1ng3 n MET 38 Ca -0.14 0.75 -0.17 0.00 0.00 0.00 0.00 57.70 58.13 1ng3 n MET 38 Cb 0.53 -2.54 -0.04 0.00 0.00 0.00 0.00 33.22 31.17 1ng3 n MET 38 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1ng3 n GLY 39 N 3.76 0.54 0.10 3.03 0.00 0.15 -4.91 105.19 107.87 1ng3 n GLY 39 Ca 0.20 -0.17 0.15 0.00 0.00 0.00 0.00 46.02 46.20 1ng3 n GLY 39 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ng3 n GLY 40 N -0.94 -0.92 0.00 -0.02 0.00 -0.44 -3.37 105.19 99.51 1ng3 n GLY 40 Ca -0.19 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.59 1ng3 n GLY 40 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ng3 n ARG 41 N -0.90 0.00 -0.31 1.61 5.12 -1.26 -4.82 116.66 116.10 1ng3 n ARG 41 Ca 0.18 0.00 0.14 0.00 -1.93 0.00 0.00 57.85 56.24 1ng3 n ARG 41 Cb 0.22 0.00 0.32 0.00 -1.16 0.00 0.00 32.46 31.84 1ng3 n ARG 41 CO 0.00 0.00 0.00 1.15 -1.93 0.00 0.00 177.63 176.85 1ng3 h THR 42 N 0.00 0.52 -0.86 0.55 2.02 -1.89 -0.62 112.91 112.63 1ng3 h THR 42 Ca 0.00 -0.16 0.16 0.00 0.77 0.00 0.00 66.41 67.18 1ng3 h THR 42 Cb 0.00 0.01 -0.10 0.00 -1.74 0.00 0.00 68.15 66.32 1ng3 h THR 42 CO 0.00 0.09 0.44 0.74 0.37 0.00 0.00 175.52 177.15 1ng3 h THR 43 N 0.47 0.68 0.00 3.16 2.02 -1.93 0.89 112.91 118.21 1ng3 h THR 43 Ca 0.57 -0.20 0.00 0.00 0.77 0.00 0.00 66.41 67.55 1ng3 h THR 43 Cb 1.06 0.04 0.00 0.00 -1.74 0.00 0.00 68.15 67.51 1ng3 h THR 43 CO -0.50 0.11 0.00 -1.20 0.37 0.00 0.00 175.52 174.30 1ng3 n SER 44 N -4.90 0.24 0.03 4.18 7.64 -0.24 -2.99 113.62 117.58 1ng3 n SER 44 Ca 0.18 0.55 0.11 0.00 1.01 0.00 0.00 58.87 60.72 1ng3 n SER 44 Cb 0.48 -0.60 -0.11 0.00 -1.01 0.00 0.00 64.21 62.96 1ng3 n SER 44 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ng3 n ALA 45 N -1.59 2.75 -1.54 -0.43 0.00 0.28 -4.89 120.51 115.08 1ng3 n ALA 45 Ca 0.04 -0.43 -0.34 0.00 0.00 0.00 0.00 53.44 52.70 1ng3 n ALA 45 Cb 0.22 -0.86 0.06 0.00 0.00 0.00 0.00 19.45 18.86 1ng3 n ALA 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ng3 s ALA 46 N -3.46 2.38 0.14 0.00 0.00 -1.02 -4.89 121.76 114.91 1ng3 s ALA 46 Ca -0.05 0.81 -0.03 0.00 0.00 0.00 0.00 51.96 52.69 1ng3 s ALA 46 Cb 0.13 -3.41 -0.07 0.00 0.00 0.00 0.00 23.12 19.77 1ng3 s ALA 46 CO 0.87 -1.41 1.33 0.00 0.00 0.00 0.00 175.76 176.54 1ng3 h ALA 47 N 0.25 0.40 0.00 0.00 0.00 -1.92 -3.43 119.26 114.56 1ng3 h ALA 47 Ca -0.48 -0.70 0.00 0.00 0.00 0.00 0.00 54.91 53.73 1ng3 h ALA 47 Cb 1.28 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1ng3 h ALA 47 CO 0.53 0.82 0.00 0.41 0.00 0.00 0.00 179.25 181.01 1ng3 n GLY 48 N 0.89 1.02 3.74 0.00 0.00 -1.26 -4.64 105.19 104.95 1ng3 n GLY 48 Ca -0.06 -0.37 -0.40 0.00 0.00 0.00 0.00 46.02 45.18 1ng3 n GLY 48 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1ng3 s MET 49 N -1.28 4.81 -0.96 1.61 -1.94 -1.26 -1.04 119.30 119.24 1ng3 s MET 49 Ca 0.00 1.47 -0.04 0.00 -1.71 0.00 0.00 55.69 55.41 1ng3 s MET 49 Cb 0.00 -3.31 0.15 0.00 2.01 0.00 0.00 34.83 33.68 1ng3 s MET 49 CO 0.00 0.44 2.40 1.28 -0.01 0.00 0.00 175.02 179.13 1ng3 n LEU 50 N 1.84 7.41 -3.77 -0.03 4.77 -0.16 -4.33 117.00 122.73 1ng3 n LEU 50 Ca -0.01 -4.69 -0.40 0.00 -0.03 0.00 0.00 56.01 50.87 1ng3 n LEU 50 Cb 0.48 -1.27 -0.08 0.00 -2.33 0.00 0.00 43.42 40.22 1ng3 n LEU 50 CO 0.50 1.93 1.81 0.61 -1.33 0.00 0.00 177.39 180.91 1ng3 n GLY 51 N 1.00 1.65 0.16 -0.72 0.00 -1.26 -4.47 105.19 101.54 1ng3 n GLY 51 Ca 0.55 -1.03 0.13 0.00 0.00 0.00 0.00 46.02 45.67 1ng3 n GLY 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ng3 h ALA 52 N 8.91 1.00 -0.97 4.61 0.00 -1.90 -3.15 119.26 127.76 1ng3 h ALA 52 Ca 0.33 0.00 -0.51 0.00 0.00 0.00 0.00 54.91 54.73 1ng3 h ALA 52 Cb 0.73 0.00 -0.30 0.00 0.00 0.00 0.00 17.79 18.22 1ng3 h ALA 52 CO 1.84 0.00 0.63 0.72 0.00 0.00 0.00 179.25 182.44 1ng3 n HIS 53 N -2.56 2.98 0.28 0.00 8.25 -1.26 -3.59 115.22 119.33 1ng3 n HIS 53 Ca 0.04 -1.89 0.03 0.00 -0.26 0.00 0.00 57.72 55.64 1ng3 n HIS 53 Cb 0.40 -0.95 -0.02 0.00 1.12 0.00 0.00 29.99 30.54 1ng3 n HIS 53 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1ng3 n ALA 54 N -1.14 2.73 -1.98 -1.41 0.00 -1.19 -4.49 120.51 113.03 1ng3 n ALA 54 Ca 0.59 -0.25 -0.17 0.00 0.00 0.00 0.00 53.44 53.60 1ng3 n ALA 54 Cb 1.61 -0.22 0.06 0.00 0.00 0.00 0.00 19.45 20.89 1ng3 n ALA 54 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1ng3 n GLU 55 N -0.82 3.13 -0.07 0.00 1.02 -1.24 -4.68 120.64 117.98 1ng3 n GLU 55 Ca 0.02 -3.96 0.06 0.00 -0.02 0.00 0.00 57.16 53.25 1ng3 n GLU 55 Cb 0.11 -2.11 0.08 0.00 -0.02 0.00 0.00 31.44 29.50 1ng3 n GLU 55 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ng3 n GLU 57 N -1.00 0.03 -3.32 0.00 2.13 -1.26 -4.09 120.64 113.13 1ng3 n GLU 57 Ca 0.09 0.29 -0.05 0.00 0.66 0.00 0.00 57.16 58.16 1ng3 n GLU 57 Cb 0.52 -1.50 -0.06 0.00 0.27 0.00 0.00 31.44 30.67 1ng3 n GLU 57 CO 0.00 0.00 0.00 -1.21 -0.41 0.00 0.00 177.13 175.51 1ng3 s GLU 58 N -2.91 0.42 -1.16 5.31 2.02 -1.26 -5.08 118.70 116.04 1ng3 s GLU 58 Ca 0.06 0.75 -0.16 0.00 0.02 0.00 0.00 54.97 55.64 1ng3 s GLU 58 Cb 0.07 -0.05 -0.06 0.00 0.10 0.00 0.00 34.13 34.19 1ng3 s GLU 58 CO 0.19 -0.59 2.18 0.54 0.02 0.00 0.00 175.26 177.60 1ng3 n ARG 59 N 5.39 2.35 -0.10 1.61 3.00 -1.26 -4.62 116.66 123.03 1ng3 n ARG 59 Ca -0.03 -2.15 0.00 0.00 -0.01 0.00 0.00 57.85 55.66 1ng3 n ARG 59 Cb 0.50 -3.01 0.00 0.00 0.00 0.00 0.00 32.46 29.96 1ng3 n ARG 59 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.63 177.23 1ng3 n ASP 60 N 6.14 0.30 -0.32 0.55 5.68 -1.26 -4.91 116.55 122.73 1ng3 n ASP 60 Ca 0.53 -0.08 0.02 0.00 -0.50 0.00 0.00 54.79 54.75 1ng3 n ASP 60 Cb 0.35 0.00 0.16 0.00 -1.14 0.00 0.00 41.12 40.49 1ng3 n ASP 60 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1ng3 h ALA 61 N -0.59 1.23 -0.65 2.12 0.00 -1.94 -2.01 119.26 117.42 1ng3 h ALA 61 Ca 0.00 -0.00 0.05 0.00 0.00 0.00 0.00 54.91 54.96 1ng3 h ALA 61 Cb 0.00 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.51 1ng3 h ALA 61 CO 0.00 0.27 0.38 0.74 0.00 0.00 0.00 179.25 180.64 1ng3 h PHE 62 N 0.97 0.69 -0.44 0.00 0.04 -1.93 0.36 116.94 116.64 1ng3 h PHE 62 Ca 0.39 0.02 -0.10 0.00 2.80 0.00 0.00 57.97 61.08 1ng3 h PHE 62 Cb 0.22 -0.22 -0.02 0.00 2.20 0.00 0.00 35.95 38.14 1ng3 h PHE 62 CO -0.03 0.35 -0.14 0.35 -0.60 0.00 0.00 178.31 178.24 1ng3 h PHE 63 N 0.71 0.91 -0.39 -0.55 3.57 -1.55 -0.32 116.94 119.33 1ng3 h PHE 63 Ca 0.28 -0.18 -0.10 0.00 3.53 0.00 0.00 57.97 61.50 1ng3 h PHE 63 Cb 0.13 -0.23 -0.02 0.00 2.79 0.00 0.00 35.95 38.62 1ng3 h PHE 63 CO -0.07 0.91 -0.16 -0.44 -2.23 0.00 0.00 178.31 176.32 1ng3 h ASP 64 N 0.73 0.72 0.06 0.41 3.32 -0.76 0.37 116.42 121.27 1ng3 h ASP 64 Ca 0.12 -0.23 -0.00 0.00 0.02 0.00 0.00 57.03 56.93 1ng3 h ASP 64 Cb 0.65 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 40.01 1ng3 h ASP 64 CO 0.05 0.89 -0.03 0.15 -1.72 0.00 0.00 179.24 178.57 1ng3 h PHE 65 N 0.64 -0.07 -0.46 4.55 3.57 -0.68 0.14 116.94 124.63 1ng3 h PHE 65 Ca 0.10 -0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.68 1ng3 h PHE 65 Cb 0.64 0.02 -0.06 0.00 2.79 0.00 0.00 35.95 39.34 1ng3 h PHE 65 CO 0.03 0.29 0.09 0.00 -2.23 0.00 0.00 178.31 176.48 1ng3 h ALA 66 N 0.46 0.50 -0.61 2.41 0.00 -0.89 0.20 119.26 121.34 1ng3 h ALA 66 Ca -0.01 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1ng3 h ALA 66 Cb 0.39 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 1ng3 h ALA 66 CO 0.01 -0.32 0.36 0.52 0.00 0.00 0.00 179.25 179.82 1ng3 h MET 67 N 0.22 0.84 -0.68 0.00 2.86 -0.85 0.25 114.93 117.57 1ng3 h MET 67 Ca 0.23 -0.09 -0.04 0.00 -2.06 0.00 0.00 59.70 57.74 1ng3 h MET 67 Cb 0.30 -0.17 -0.03 0.00 0.06 0.00 0.00 31.60 31.75 1ng3 h MET 67 CO -0.30 0.62 0.26 1.25 1.06 0.00 0.00 176.91 179.79 1ng3 h HIS 68 N 0.83 1.05 -0.56 -0.22 6.17 -0.02 -0.65 115.15 121.76 1ng3 h HIS 68 Ca 0.22 -0.09 -0.11 0.00 0.71 0.00 0.00 60.37 61.10 1ng3 h HIS 68 Cb 0.00 -0.31 -0.02 0.00 2.52 0.00 0.00 27.41 29.60 1ng3 h HIS 68 CO -0.02 0.83 -0.08 1.03 0.71 0.00 0.00 177.93 180.40 1ng3 h SER 69 N 0.98 1.04 -0.32 3.26 0.87 -0.30 -1.44 113.55 117.63 1ng3 h SER 69 Ca 0.23 -0.34 -0.02 0.00 -1.23 0.00 0.00 61.79 60.43 1ng3 h SER 69 Cb 0.23 -0.28 -0.02 0.00 -0.44 0.00 0.00 62.40 61.89 1ng3 h SER 69 CO -0.02 1.14 0.15 -0.61 -0.53 0.00 0.00 176.83 176.96 1ng3 h GLN 70 N 0.93 0.53 -0.24 2.24 4.15 -0.62 -1.96 115.11 120.14 1ng3 h GLN 70 Ca 0.15 -0.07 -0.05 0.00 0.77 0.00 0.00 58.65 59.46 1ng3 h GLN 70 Cb 0.65 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 28.23 1ng3 h GLN 70 CO 0.04 0.44 -0.04 -0.09 -1.93 0.00 0.00 178.83 177.26 1ng3 h ARG 71 N 0.53 0.45 0.00 1.69 2.43 -0.55 -2.82 114.38 116.10 1ng3 h ARG 71 Ca 0.13 -0.16 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1ng3 h ARG 71 Cb 0.11 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.63 1ng3 h ARG 71 CO -0.01 0.66 0.16 -0.07 -1.51 0.00 0.00 179.97 179.19 1ng3 h LEU 72 N 0.20 0.00 -0.46 3.80 3.38 -0.48 -0.38 115.31 121.37 1ng3 h LEU 72 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1ng3 h LEU 72 Cb 0.48 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.23 1ng3 h LEU 72 CO 0.02 0.00 0.00 1.88 0.09 0.00 0.00 178.44 180.43 1ng3 h TYR 73 N 0.00 0.00 -2.55 1.13 0.05 -1.36 -3.38 116.97 110.86 1ng3 h TYR 73 Ca 0.00 0.00 -0.57 0.00 0.05 0.00 0.00 58.73 58.21 1ng3 h TYR 73 Cb 0.31 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.03 1ng3 h TYR 73 CO 0.00 0.00 1.27 0.21 -1.05 0.00 0.00 178.16 178.59 1ng3 s LYS 74 N -3.29 3.50 0.00 4.88 2.20 -0.15 -1.98 119.74 124.90 1ng3 s LYS 74 Ca 0.06 1.70 0.00 0.00 -0.36 0.00 0.00 55.97 57.38 1ng3 s LYS 74 Cb 0.09 -4.18 0.00 0.00 -1.51 0.00 0.00 37.83 32.23 1ng3 s LYS 74 CO 0.55 -1.66 0.00 0.41 -0.36 0.00 0.00 175.35 174.28 1ng3 n GLY 75 N 5.19 2.22 0.37 5.54 0.00 -1.26 -4.91 105.19 112.34 1ng3 n GLY 75 Ca 0.23 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.27 1ng3 n GLY 75 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1ng3 h LEU 76 N 0.00 1.03 -0.02 0.99 5.85 -1.57 -2.17 115.31 119.42 1ng3 h LEU 76 Ca 0.00 0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.76 1ng3 h LEU 76 Cb 0.00 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 40.78 1ng3 h LEU 76 CO 0.00 0.66 -0.20 1.23 -0.34 0.00 0.00 178.44 179.79 1ng3 h GLY 77 N 1.17 -0.26 0.99 3.75 0.00 -1.91 -1.27 103.07 105.53 1ng3 h GLY 77 Ca 0.42 0.24 -0.01 0.00 0.00 0.00 0.00 47.33 47.99 1ng3 h GLY 77 CO -0.17 -0.18 0.30 0.83 0.00 0.00 0.00 176.54 177.32 1ng3 h GLU 78 N -0.31 0.76 -0.62 4.80 3.07 -1.90 -0.32 114.58 120.06 1ng3 h GLU 78 Ca 0.07 -0.09 0.05 0.00 -0.50 0.00 0.00 59.36 58.89 1ng3 h GLU 78 Cb 0.40 -0.15 -0.05 0.00 -0.84 0.00 0.00 28.75 28.11 1ng3 h GLU 78 CO -0.21 0.58 0.35 1.49 -1.40 0.00 0.00 179.01 179.82 1ng3 h GLU 79 N 0.73 0.64 0.00 2.33 4.81 -1.11 -1.54 114.58 120.44 1ng3 h GLU 79 Ca 0.19 -0.04 -0.18 0.00 -0.13 0.00 0.00 59.36 59.20 1ng3 h GLU 79 Cb 0.04 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.25 1ng3 h GLU 79 CO -0.03 0.42 -0.86 -0.07 -0.73 0.00 0.00 179.01 177.74 1ng3 h LEU 80 N 0.66 0.00 0.18 1.64 3.38 -1.04 -3.28 115.31 116.85 1ng3 h LEU 80 Ca 0.27 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.23 1ng3 h LEU 80 Cb 0.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.89 1ng3 h LEU 80 CO -0.16 0.86 -0.09 0.22 0.09 0.00 0.00 178.44 179.37 1ng3 h TYR 81 N 0.00 -0.22 -1.04 1.13 3.20 -0.60 0.51 116.97 119.95 1ng3 h TYR 81 Ca -0.01 -0.01 0.33 0.00 3.14 0.00 0.00 58.73 62.19 1ng3 h TYR 81 Cb 1.55 0.07 -0.14 0.00 1.54 0.00 0.00 36.73 39.75 1ng3 h TYR 81 CO 0.00 -0.02 0.61 0.00 -1.64 0.00 0.00 178.16 177.10 1ng3 h ALA 82 N 0.42 2.07 0.00 1.82 0.00 -1.35 0.37 119.26 122.58 1ng3 h ALA 82 Ca -0.02 0.17 -0.17 0.00 0.00 0.00 0.00 54.91 54.89 1ng3 h ALA 82 Cb 0.29 0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 1ng3 h ALA 82 CO 0.04 -0.67 -1.93 1.28 0.00 0.00 0.00 179.25 177.97 1ng3 n LEU 83 N -4.99 0.27 -0.11 0.00 4.77 -1.07 -4.69 117.00 111.18 1ng3 n LEU 83 Ca 0.32 0.12 -0.16 0.00 -0.03 0.00 0.00 56.01 56.26 1ng3 n LEU 83 Cb 1.03 0.19 -0.11 0.00 -2.33 0.00 0.00 43.42 42.20 1ng3 n LEU 83 CO 0.12 0.20 -1.25 -1.20 -1.33 0.00 0.00 177.39 173.93 1ng3 n SER 84 N -2.61 2.22 0.00 -1.43 7.64 0.18 -4.45 113.62 115.17 1ng3 n SER 84 Ca -0.15 -0.12 0.00 0.00 1.01 0.00 0.00 58.87 59.61 1ng3 n SER 84 Cb 0.84 -0.36 0.00 0.00 -1.01 0.00 0.00 64.21 63.68 1ng3 n SER 84 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ng3 n GLY 85 N 2.41 0.66 3.39 0.23 0.00 0.12 -4.93 105.19 107.07 1ng3 n GLY 85 Ca -0.40 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.27 1ng3 n GLY 85 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ng3 s VAL 86 N -2.07 3.55 -0.03 1.61 1.01 -1.26 -5.06 120.40 118.15 1ng3 s VAL 86 Ca 0.00 -0.45 -0.26 0.00 0.00 0.00 0.00 61.98 61.27 1ng3 s VAL 86 Cb 0.00 -2.58 -0.04 0.00 0.00 0.00 0.00 36.38 33.76 1ng3 s VAL 86 CO 0.00 0.46 0.81 -0.62 0.00 0.00 0.00 175.10 175.75 1ng3 s ASP 87 N 0.92 7.15 0.00 3.32 3.68 -1.26 -4.28 116.67 126.20 1ng3 s ASP 87 Ca -0.00 1.38 0.30 0.00 2.13 0.00 0.00 52.55 56.36 1ng3 s ASP 87 Cb -0.15 -2.48 1.44 0.00 -1.45 0.00 0.00 42.92 40.29 1ng3 s ASP 87 CO 0.01 -0.16 1.99 2.30 0.13 0.00 0.00 175.17 179.44 1ng3 n ILE 88 N 3.76 0.00 -3.35 4.11 -5.35 -1.26 -4.78 119.36 112.49 1ng3 n ILE 88 Ca 0.01 -0.02 -0.18 0.00 -0.27 0.00 0.00 62.75 62.29 1ng3 n ILE 88 Cb 0.51 -0.33 0.07 0.00 -1.74 0.00 0.00 39.64 38.14 1ng3 n ILE 88 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1ng3 n ARG 89 N -1.12 -2.33 -2.78 6.28 1.74 -1.26 -1.95 116.66 115.23 1ng3 n ARG 89 Ca 0.15 0.78 -0.41 0.00 -0.77 0.00 0.00 57.85 57.61 1ng3 n ARG 89 Cb 0.24 -5.50 -0.05 0.00 -1.02 0.00 0.00 32.46 26.14 1ng3 n ARG 89 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 1ng3 s GLN 90 N -4.78 4.72 -0.18 5.56 0.74 -1.26 -3.69 119.66 120.78 1ng3 s GLN 90 Ca 0.43 1.41 0.01 0.00 0.05 0.00 0.00 55.36 57.25 1ng3 s GLN 90 Cb -0.08 -3.34 0.03 0.00 1.10 0.00 0.00 33.01 30.73 1ng3 s GLN 90 CO 0.76 0.34 -0.14 -1.58 -0.55 0.00 0.00 175.29 174.12 1ng3 s HIS 91 N -0.45 2.43 -0.39 1.67 5.65 0.94 -5.00 115.29 120.15 1ng3 s HIS 91 Ca 0.44 -1.48 0.09 0.00 0.25 0.00 0.00 55.06 54.35 1ng3 s HIS 91 Cb -0.24 -1.70 0.63 0.00 -1.18 0.00 0.00 32.58 30.09 1ng3 s HIS 91 CO 0.30 -0.73 1.56 0.09 -0.65 0.00 0.00 174.74 175.30 1ng3 n ASN 92 N 4.70 4.49 0.03 9.88 3.02 -1.26 -1.94 115.26 134.17 1ng3 n ASN 92 Ca -0.17 -2.88 0.15 0.00 -0.03 0.00 0.00 54.58 51.65 1ng3 n ASN 92 Cb 0.49 -0.68 0.63 0.00 -0.61 0.00 0.00 39.78 39.60 1ng3 n ASN 92 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 1ng3 h GLY 93 N 3.55 0.17 0.00 7.41 0.00 -1.91 -3.48 103.07 108.81 1ng3 h GLY 93 Ca 0.13 -0.05 0.00 0.00 0.00 0.00 0.00 47.33 47.41 1ng3 h GLY 93 CO 0.52 0.03 0.00 0.61 0.00 0.00 0.00 176.54 177.70 1ng3 n GLY 94 N -1.59 -3.31 3.01 4.60 0.00 -1.26 -4.61 105.19 102.04 1ng3 n GLY 94 Ca 0.07 -2.00 -0.17 0.00 0.00 0.00 0.00 46.02 43.92 1ng3 n GLY 94 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1ng3 s MET 95 N -0.68 0.60 -0.51 1.61 0.00 -0.28 -1.91 119.30 118.14 1ng3 s MET 95 Ca 0.00 -0.36 -0.05 0.00 0.00 0.00 0.00 55.69 55.27 1ng3 s MET 95 Cb 0.00 -0.56 0.13 0.00 0.00 0.00 0.00 34.83 34.41 1ng3 s MET 95 CO 0.00 0.15 0.35 -0.06 0.00 0.00 0.00 175.02 175.45 1ng3 s PHE 96 N -0.38 3.50 -0.71 4.11 0.08 0.68 -0.60 117.98 124.66 1ng3 s PHE 96 Ca 0.01 -2.32 -0.27 0.00 0.12 0.00 0.00 56.93 54.47 1ng3 s PHE 96 Cb -0.04 -3.33 0.01 0.00 -0.57 0.00 0.00 43.02 39.09 1ng3 s PHE 96 CO -0.00 -0.94 1.49 0.15 -0.10 0.00 0.00 175.22 175.82 1ng3 s LYS 97 N 0.80 3.00 0.70 0.44 1.02 -0.34 -1.75 119.74 123.61 1ng3 s LYS 97 Ca 0.11 0.01 -0.15 0.00 0.02 0.00 0.00 55.97 55.96 1ng3 s LYS 97 Cb -0.22 -4.31 0.02 0.00 -0.52 0.00 0.00 37.83 32.80 1ng3 s LYS 97 CO -0.03 -2.37 1.16 -0.51 -0.92 0.00 0.00 175.35 172.67 1ng3 s LEU 98 N 6.90 3.35 -0.06 3.17 1.43 0.91 -1.91 118.68 132.47 1ng3 s LEU 98 Ca 0.47 2.17 0.04 0.00 -1.03 0.00 0.00 54.13 55.78 1ng3 s LEU 98 Cb -0.09 -4.57 -0.00 0.00 0.03 0.00 0.00 46.19 41.56 1ng3 s LEU 98 CO 0.16 -1.95 -0.18 0.00 0.23 0.00 0.00 176.35 174.60 1ng3 s ALA 99 N -2.17 1.63 -0.05 4.21 0.00 -0.55 -4.75 121.76 120.07 1ng3 s ALA 99 Ca 0.70 -0.71 0.07 0.00 0.00 0.00 0.00 51.96 52.02 1ng3 s ALA 99 Cb -0.25 -0.58 0.10 0.00 0.00 0.00 0.00 23.12 22.40 1ng3 s ALA 99 CO 0.43 0.26 1.04 1.19 0.00 0.00 0.00 175.76 178.69 1ng3 n PHE 100 N 3.32 0.00 -3.80 0.00 3.01 -1.26 -0.33 117.46 118.39 1ng3 n PHE 100 Ca -0.19 -0.66 -0.05 0.00 1.01 0.00 0.00 57.45 57.56 1ng3 n PHE 100 Cb 0.53 -0.08 -0.01 0.00 -0.01 0.00 0.00 39.48 39.90 1ng3 n PHE 100 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 1ng3 s SER 101 N -1.65 -0.18 0.13 4.37 1.04 -1.26 -4.86 113.70 111.29 1ng3 s SER 101 Ca 0.12 -0.54 -0.13 0.00 0.48 0.00 0.00 55.95 55.88 1ng3 s SER 101 Cb 0.10 0.59 -0.02 0.00 0.10 0.00 0.00 66.02 66.79 1ng3 s SER 101 CO 0.01 -1.10 1.53 -0.33 0.98 0.00 0.00 173.24 174.33 1ng3 h GLU 102 N 2.00 0.82 -0.97 4.02 4.39 -1.99 -1.91 114.58 120.94 1ng3 h GLU 102 Ca -0.23 -0.33 0.05 0.00 0.34 0.00 0.00 59.36 59.19 1ng3 h GLU 102 Cb 1.24 -0.04 -0.06 0.00 -0.10 0.00 0.00 28.75 29.79 1ng3 h GLU 102 CO 0.26 0.96 0.64 0.93 -1.16 0.00 0.00 179.01 180.64 1ng3 h GLU 103 N 0.64 1.16 -0.37 2.33 3.07 -1.98 0.35 114.58 119.77 1ng3 h GLU 103 Ca 0.10 -0.07 0.01 0.00 -0.50 0.00 0.00 59.36 58.91 1ng3 h GLU 103 Cb 0.67 -0.26 -0.02 0.00 -0.84 0.00 0.00 28.75 28.30 1ng3 h GLU 103 CO 0.05 0.76 0.22 -0.44 -1.40 0.00 0.00 179.01 178.20 1ng3 h ASP 104 N 1.19 0.36 -0.10 1.42 3.45 -1.86 0.11 116.42 120.99 1ng3 h ASP 104 Ca 0.40 0.00 -0.00 0.00 0.43 0.00 0.00 57.03 57.86 1ng3 h ASP 104 Cb 0.08 -0.08 -0.00 0.00 -0.56 0.00 0.00 39.33 38.77 1ng3 h ASP 104 CO -0.14 0.26 0.05 0.58 -1.57 0.00 0.00 179.24 178.42 1ng3 h VAL 105 N 0.45 1.11 -0.05 -1.35 2.07 -0.30 0.27 116.25 118.46 1ng3 h VAL 105 Ca 0.15 -0.31 0.04 0.00 0.82 0.00 0.00 66.70 67.40 1ng3 h VAL 105 Cb -0.00 1.13 -0.05 0.00 -1.52 0.00 0.00 31.29 30.84 1ng3 h VAL 105 CO -0.06 0.09 -0.28 -0.07 0.02 0.00 0.00 177.57 177.27 1ng3 h LEU 106 N 0.05 -0.84 0.09 2.57 4.07 -0.03 0.32 115.31 121.53 1ng3 h LEU 106 Ca 0.04 0.12 0.00 0.00 0.08 0.00 0.00 57.88 58.12 1ng3 h LEU 106 Cb 0.11 0.35 -0.01 0.00 1.08 0.00 0.00 40.66 42.19 1ng3 h LEU 106 CO -0.00 -0.34 -0.08 -0.61 -1.08 0.00 0.00 178.44 176.33 1ng3 h GLN 107 N -0.40 -0.18 -0.03 1.13 4.15 -0.60 -2.95 115.11 116.23 1ng3 h GLN 107 Ca 0.08 0.01 -0.06 0.00 0.77 0.00 0.00 58.65 59.45 1ng3 h GLN 107 Cb 0.51 0.04 -0.01 0.00 0.21 0.00 0.00 27.48 28.23 1ng3 h GLN 107 CO -0.27 -0.12 -0.27 -0.07 -1.93 0.00 0.00 178.83 176.17 1ng3 h LEU 108 N -0.18 0.05 -1.25 -2.39 3.38 -0.15 -2.74 115.31 112.02 1ng3 h LEU 108 Ca 0.00 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.88 1ng3 h LEU 108 Cb 0.17 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1ng3 h LEU 108 CO -0.02 0.33 -0.33 0.03 0.09 0.00 0.00 178.44 178.54 1ng3 h ARG 109 N 0.05 0.07 0.00 1.13 2.47 -0.21 -3.05 114.38 114.84 1ng3 h ARG 109 Ca 0.01 -0.03 0.00 0.00 -1.26 0.00 0.00 59.98 58.70 1ng3 h ARG 109 Cb 0.51 -0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.83 1ng3 h ARG 109 CO 0.04 0.40 0.32 1.04 0.56 0.00 0.00 179.97 182.32 1ng3 n GLN 110 N -4.13 0.07 -0.46 0.04 6.02 -1.03 -0.10 117.38 117.80 1ng3 n GLN 110 Ca -0.02 0.52 0.08 0.00 -0.01 0.00 0.00 57.00 57.57 1ng3 n GLN 110 Cb 0.39 -2.05 0.26 0.00 1.02 0.00 0.00 30.24 29.86 1ng3 n GLN 110 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ng3 n MET 111 N -1.92 3.14 0.08 -1.09 0.00 -1.15 -4.57 117.12 111.60 1ng3 n MET 111 Ca -0.01 -2.76 0.03 0.00 0.00 0.00 0.00 57.70 54.96 1ng3 n MET 111 Cb 0.33 -1.81 0.41 0.00 0.00 0.00 0.00 33.22 32.16 1ng3 n MET 111 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 175.97 175.53 1ng3 h ASP 112 N 2.13 0.32 0.19 3.17 3.32 -0.71 -1.84 116.42 123.01 1ng3 h ASP 112 Ca 0.00 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.01 1ng3 h ASP 112 Cb 1.39 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.86 1ng3 h ASP 112 CO 0.22 0.36 0.00 -0.90 -1.72 0.00 0.00 179.24 177.20 1ng3 n ASP 113 N -4.37 0.00 -4.84 6.45 5.75 -1.26 -4.77 116.55 113.51 1ng3 n ASP 113 Ca 0.01 -0.20 -0.32 0.00 -0.01 0.00 0.00 54.79 54.26 1ng3 n ASP 113 Cb 0.18 -0.17 -0.06 0.00 -1.03 0.00 0.00 41.12 40.04 1ng3 n ASP 113 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1ng3 s LEU 114 N -2.34 3.96 0.25 -2.12 1.43 -0.69 -5.04 118.68 114.13 1ng3 s LEU 114 Ca 0.21 1.41 -0.30 0.00 -1.03 0.00 0.00 54.13 54.42 1ng3 s LEU 114 Cb 0.12 -4.25 -0.09 0.00 0.03 0.00 0.00 46.19 42.00 1ng3 s LEU 114 CO 0.24 -0.31 1.02 -1.81 0.23 0.00 0.00 176.35 175.73 1ng3 s ASP 115 N -2.41 7.45 -0.20 2.29 1.01 -1.26 -3.26 116.67 120.29 1ng3 s ASP 115 Ca 0.57 2.11 0.00 0.00 0.71 0.00 0.00 52.55 55.94 1ng3 s ASP 115 Cb -0.10 -2.62 0.00 0.00 1.01 0.00 0.00 42.92 41.21 1ng3 s ASP 115 CO 0.19 -0.01 0.00 -1.20 0.21 0.00 0.00 175.17 174.36 1ng3 n SER 116 N 1.40 -4.78 -4.09 0.27 7.64 -1.26 -4.97 113.62 107.84 1ng3 n SER 116 Ca -0.01 0.05 -0.29 0.00 1.01 0.00 0.00 58.87 59.63 1ng3 n SER 116 Cb 0.46 -2.44 -0.17 0.00 -1.01 0.00 0.00 64.21 61.05 1ng3 n SER 116 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1ng3 s VAL 117 N -1.55 1.56 0.04 0.44 1.01 -1.20 -2.24 120.40 118.46 1ng3 s VAL 117 Ca 0.00 -0.70 -0.11 0.00 0.00 0.00 0.00 61.98 61.17 1ng3 s VAL 117 Cb 0.00 -1.41 0.01 0.00 0.00 0.00 0.00 36.38 34.98 1ng3 s VAL 117 CO 0.00 0.45 0.22 -0.94 0.00 0.00 0.00 175.10 174.83 1ng3 s SER 118 N 0.79 -0.01 0.19 3.32 1.04 -0.87 -4.61 113.70 113.54 1ng3 s SER 118 Ca -0.11 -0.30 -0.18 0.00 0.48 0.00 0.00 55.95 55.85 1ng3 s SER 118 Cb -0.16 0.30 -0.08 0.00 0.10 0.00 0.00 66.02 66.19 1ng3 s SER 118 CO 0.01 -0.55 0.65 0.86 0.98 0.00 0.00 173.24 175.20 1ng3 s TRP 119 N -2.43 3.64 0.07 5.02 -0.11 -1.26 0.17 118.94 124.04 1ng3 s TRP 119 Ca -0.06 1.27 0.07 0.00 1.22 0.00 0.00 56.10 58.60 1ng3 s TRP 119 Cb -0.02 -2.52 -0.03 0.00 -1.50 0.00 0.00 33.47 29.40 1ng3 s TRP 119 CO -0.03 0.38 -0.20 0.71 -4.62 0.00 0.00 176.95 173.19 1ng3 s TYR 120 N -1.48 1.73 0.40 5.86 1.51 0.12 -4.90 117.35 120.58 1ng3 s TYR 120 Ca 0.40 -0.40 -0.06 0.00 -1.01 0.00 0.00 57.07 56.01 1ng3 s TYR 120 Cb -0.16 -0.98 -0.05 0.00 -0.11 0.00 0.00 41.96 40.66 1ng3 s TYR 120 CO 0.20 0.14 0.70 -1.54 -1.11 0.00 0.00 175.55 173.94 1ng3 s SER 121 N -1.55 6.38 0.55 2.29 1.04 -1.26 -1.85 113.70 119.31 1ng3 s SER 121 Ca 0.06 0.88 0.43 0.00 0.48 0.00 0.00 55.95 57.81 1ng3 s SER 121 Cb -0.09 -2.22 1.64 0.00 0.10 0.00 0.00 66.02 65.44 1ng3 s SER 121 CO 0.03 -0.41 1.68 0.50 0.98 0.00 0.00 173.24 176.02 1ng3 h LYS 122 N 0.92 0.00 0.00 4.02 3.11 -1.86 0.60 116.57 123.36 1ng3 h LYS 122 Ca -0.47 0.00 -0.15 0.00 -2.81 0.00 0.00 60.65 57.21 1ng3 h LYS 122 Cb 1.20 0.00 -0.03 0.00 -1.00 0.00 0.00 32.23 32.40 1ng3 h LYS 122 CO 0.63 0.00 -1.55 -0.85 -2.81 0.00 0.00 179.45 174.88 1ng3 n GLU 123 N -4.03 0.63 0.16 1.90 0.00 -1.26 -3.34 120.64 114.70 1ng3 n GLU 123 Ca 0.35 0.14 0.05 0.00 0.00 0.00 0.00 57.16 57.69 1ng3 n GLU 123 Cb 1.64 -1.75 0.08 0.00 0.00 0.00 0.00 31.44 31.41 1ng3 n GLU 123 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.13 178.06 1ng3 h GLU 124 N 0.00 0.00 0.04 3.44 5.08 -0.26 -2.88 114.58 120.00 1ng3 h GLU 124 Ca -0.17 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.19 1ng3 h GLU 124 Cb 1.53 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.78 1ng3 h GLU 124 CO 0.03 0.40 -0.02 0.28 -1.00 0.00 0.00 179.01 178.70 1ng3 h VAL 125 N 0.00 1.31 0.00 3.13 2.07 -1.15 -3.19 116.25 118.42 1ng3 h VAL 125 Ca -0.00 -1.64 0.00 0.00 0.82 0.00 0.00 66.70 65.88 1ng3 h VAL 125 Cb 1.27 2.32 0.00 0.00 -1.52 0.00 0.00 31.29 33.37 1ng3 h VAL 125 CO 0.05 0.39 0.00 0.18 0.02 0.00 0.00 177.57 178.21 1ng3 n LEU 126 N -4.76 0.55 0.07 2.57 4.77 -1.21 -0.06 117.00 118.92 1ng3 n LEU 126 Ca -0.08 0.74 -0.15 0.00 -0.03 0.00 0.00 56.01 56.49 1ng3 n LEU 126 Cb 0.33 -0.79 -0.07 0.00 -2.33 0.00 0.00 43.42 40.57 1ng3 n LEU 126 CO 0.29 -0.88 0.13 -0.08 -1.33 0.00 0.00 177.39 175.52 1ng3 h GLU 127 N 0.00 0.45 0.08 3.23 4.81 -1.50 -2.49 114.58 119.16 1ng3 h GLU 127 Ca 0.00 -0.51 -0.22 0.00 -0.13 0.00 0.00 59.36 58.50 1ng3 h GLU 127 Cb 0.05 0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.57 1ng3 h GLU 127 CO 0.00 1.16 -1.14 0.87 -0.73 0.00 0.00 179.01 179.17 1ng3 h LYS 128 N 0.24 0.17 -3.07 1.92 1.79 -1.13 -3.41 116.57 113.08 1ng3 h LYS 128 Ca -0.10 -0.28 -0.62 0.00 -2.18 0.00 0.00 60.65 57.47 1ng3 h LYS 128 Cb 1.65 0.11 -0.41 0.00 -1.58 0.00 0.00 32.23 31.99 1ng3 h LYS 128 CO 0.18 1.14 -0.64 -1.21 -1.08 0.00 0.00 179.45 177.83 1ng3 s GLU 129 N -2.42 2.11 0.46 3.15 0.41 0.92 -4.93 118.70 118.40 1ng3 s GLU 129 Ca -0.21 -2.96 0.22 0.00 -0.41 0.00 0.00 54.97 51.61 1ng3 s GLU 129 Cb 0.03 -3.11 1.22 0.00 -1.78 0.00 0.00 34.13 30.49 1ng3 s GLU 129 CO 0.73 -1.25 1.88 -1.35 -0.49 0.00 0.00 175.26 174.77 1ng3 h PRO 130 N 5.77 0.26 -0.24 0.39 0.11 -1.66 -2.30 132.00 134.32 1ng3 h PRO 130 Ca 0.10 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.19 1ng3 h PRO 130 Cb 0.81 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.86 1ng3 h PRO 130 CO 0.66 0.17 0.00 0.66 -0.21 0.00 0.00 178.00 179.28 1ng3 n TYR 131 N -4.44 0.31 -2.08 0.65 4.01 -1.26 -4.92 117.16 109.44 1ng3 n TYR 131 Ca 0.18 -0.15 -0.36 0.00 -0.16 0.00 0.00 57.90 57.41 1ng3 n TYR 131 Cb 0.76 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.81 1ng3 n TYR 131 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1ng3 s ALA 132 N -1.69 2.60 0.22 -0.72 0.00 -0.87 -4.30 121.76 117.01 1ng3 s ALA 132 Ca 0.34 0.97 -0.30 0.00 0.00 0.00 0.00 51.96 52.98 1ng3 s ALA 132 Cb 0.19 -3.43 -0.16 0.00 0.00 0.00 0.00 23.12 19.72 1ng3 s ALA 132 CO 0.28 -1.06 0.90 0.45 0.00 0.00 0.00 175.76 176.33 1ng3 n SER 133 N -1.46 0.46 -0.26 0.00 2.88 -0.57 -4.83 113.62 109.84 1ng3 n SER 133 Ca 0.13 1.15 0.05 0.00 -1.33 0.00 0.00 58.87 58.87 1ng3 n SER 133 Cb 0.50 -1.15 0.20 0.00 -0.75 0.00 0.00 64.21 63.01 1ng3 n SER 133 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1ng3 n GLY 134 N 1.66 -0.37 1.20 0.46 0.00 -1.26 -3.49 105.19 103.39 1ng3 n GLY 134 Ca 0.14 -0.18 0.10 0.00 0.00 0.00 0.00 46.02 46.08 1ng3 n GLY 134 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ng3 n ASP 135 N -0.16 3.79 -4.86 1.61 10.43 -1.26 -4.99 116.55 121.11 1ng3 n ASP 135 Ca 0.08 -2.05 -0.31 0.00 2.57 0.00 0.00 54.79 55.08 1ng3 n ASP 135 Cb 0.14 -0.44 -0.03 0.00 1.84 0.00 0.00 41.12 42.63 1ng3 n ASP 135 CO 0.00 0.00 0.00 0.27 -1.07 0.00 0.00 177.20 176.40 1ng3 s ILE 136 N -1.10 4.69 -0.72 0.53 -4.36 -1.23 -4.73 121.20 114.28 1ng3 s ILE 136 Ca 0.43 0.85 0.16 0.00 -0.26 0.00 0.00 60.65 61.83 1ng3 s ILE 136 Cb 0.23 -3.73 0.71 0.00 1.25 0.00 0.00 42.46 40.92 1ng3 s ILE 136 CO 0.28 -0.60 1.62 0.49 0.24 0.00 0.00 174.94 176.97 1ng3 n PHE 137 N -1.45 1.55 0.00 1.37 3.01 0.55 -4.75 117.46 117.73 1ng3 n PHE 137 Ca 0.04 -0.68 0.00 0.00 1.01 0.00 0.00 57.45 57.82 1ng3 n PHE 137 Cb 0.54 -0.32 0.00 0.00 -0.01 0.00 0.00 39.48 39.69 1ng3 n PHE 137 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1ng3 n GLY 138 N 0.73 -1.50 3.45 1.37 0.00 -1.26 -4.16 105.19 103.82 1ng3 n GLY 138 Ca 0.25 -2.18 -0.11 0.00 0.00 0.00 0.00 46.02 43.97 1ng3 n GLY 138 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ng3 s ALA 139 N -1.55 -1.53 -0.14 4.61 0.00 -0.77 -1.48 121.76 120.91 1ng3 s ALA 139 Ca 0.00 0.39 -0.17 0.00 0.00 0.00 0.00 51.96 52.18 1ng3 s ALA 139 Cb 0.00 0.88 -0.04 0.00 0.00 0.00 0.00 23.12 23.95 1ng3 s ALA 139 CO 0.00 -0.79 0.44 0.45 0.00 0.00 0.00 175.76 175.86 1ng3 s SER 140 N -2.77 6.62 -0.35 0.00 0.15 -0.80 -0.70 113.70 115.84 1ng3 s SER 140 Ca 0.02 0.73 -0.16 0.00 0.70 0.00 0.00 55.95 57.24 1ng3 s SER 140 Cb -0.01 -2.26 -0.01 0.00 -1.71 0.00 0.00 66.02 62.02 1ng3 s SER 140 CO -0.11 0.00 0.40 0.12 1.20 0.00 0.00 173.24 174.85 1ng3 s PHE 141 N 0.70 3.20 -0.49 3.44 5.36 0.13 -1.20 117.98 129.12 1ng3 s PHE 141 Ca 0.24 0.02 -0.09 0.00 -0.96 0.00 0.00 56.93 56.13 1ng3 s PHE 141 Cb -0.15 -2.73 0.12 0.00 -0.34 0.00 0.00 43.02 39.92 1ng3 s PHE 141 CO 0.09 -0.46 0.36 0.42 -1.46 0.00 0.00 175.22 174.16 1ng3 s ILE 142 N 2.11 4.20 0.34 3.12 1.09 0.23 -2.05 121.20 130.23 1ng3 s ILE 142 Ca 0.13 -1.87 0.02 0.00 -1.10 0.00 0.00 60.65 57.84 1ng3 s ILE 142 Cb -0.16 -3.77 0.25 0.00 -1.06 0.00 0.00 42.46 37.72 1ng3 s ILE 142 CO 0.12 -0.79 1.99 -0.61 -0.10 0.00 0.00 174.94 175.55 1ng3 h GLN 143 N 8.36 0.82 -0.00 2.79 4.15 -1.73 -0.70 115.11 128.81 1ng3 h GLN 143 Ca -0.19 -0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.16 1ng3 h GLN 143 Cb 1.07 -0.18 0.00 0.00 0.21 0.00 0.00 27.48 28.58 1ng3 h GLN 143 CO 0.85 0.57 -0.39 -0.25 -1.93 0.00 0.00 178.83 177.68 1ng3 n ASP 144 N -4.42 0.55 -3.52 -0.69 10.43 -1.26 -4.31 116.55 113.33 1ng3 n ASP 144 Ca 0.06 -0.32 -0.40 0.00 2.57 0.00 0.00 54.79 56.69 1ng3 n ASP 144 Cb 0.07 0.15 -0.01 0.00 1.84 0.00 0.00 41.12 43.16 1ng3 n ASP 144 CO 0.00 0.00 0.00 0.47 -1.07 0.00 0.00 177.20 176.60 1ng3 n ASP 145 N -1.31 6.82 -2.04 -2.24 9.92 -1.17 -4.87 116.55 121.65 1ng3 n ASP 145 Ca 0.07 -2.79 0.00 0.00 -0.53 0.00 0.00 54.79 51.55 1ng3 n ASP 145 Cb 0.33 -1.55 0.00 0.00 -0.64 0.00 0.00 41.12 39.26 1ng3 n ASP 145 CO 0.00 0.00 0.00 1.33 0.13 0.00 0.00 177.20 178.66 1ng3 n VAL 146 N 3.75 0.00 -3.94 2.53 0.24 -1.26 -4.15 118.33 115.50 1ng3 n VAL 146 Ca 0.64 0.00 -0.09 0.00 -2.04 0.00 0.00 64.34 62.86 1ng3 n VAL 146 Cb 0.29 -1.98 -0.09 0.00 -1.47 0.00 0.00 33.84 30.60 1ng3 n VAL 146 CO 0.00 0.00 0.00 -1.38 -2.14 0.00 0.00 176.83 173.31 1ng3 s HIS 147 N -0.92 0.26 0.30 6.34 -3.43 -0.82 -0.99 115.29 116.03 1ng3 s HIS 147 Ca 0.00 -0.68 0.03 0.00 -0.80 0.00 0.00 55.06 53.62 1ng3 s HIS 147 Cb 0.00 -0.17 -0.04 0.00 -1.43 0.00 0.00 32.58 30.94 1ng3 s HIS 147 CO 0.00 -0.44 0.16 0.14 -2.00 0.00 0.00 174.74 172.60 1ng3 s VAL 148 N -3.45 0.29 -0.44 -5.38 -7.23 -0.20 -0.04 120.40 103.95 1ng3 s VAL 148 Ca 0.02 -2.00 -0.14 0.00 -1.81 0.00 0.00 61.98 58.05 1ng3 s VAL 148 Cb 0.04 -2.51 0.06 0.00 0.56 0.00 0.00 36.38 34.52 1ng3 s VAL 148 CO -0.09 0.00 0.33 -1.61 -0.31 0.00 0.00 175.10 173.43 1ng3 s GLU 149 N -3.83 2.91 0.27 4.82 2.02 -0.82 -4.17 118.70 119.90 1ng3 s GLU 149 Ca 0.36 -1.26 -0.03 0.00 0.02 0.00 0.00 54.97 54.06 1ng3 s GLU 149 Cb 0.05 -4.01 0.57 0.00 0.10 0.00 0.00 34.13 30.84 1ng3 s GLU 149 CO 0.18 -0.92 1.62 -1.35 0.02 0.00 0.00 175.26 174.80 1ng3 h PRO 150 N 8.64 0.09 -0.19 0.39 0.11 -1.83 -2.40 132.00 136.80 1ng3 h PRO 150 Ca -0.27 -0.01 0.02 0.00 0.11 0.00 0.00 66.00 65.86 1ng3 h PRO 150 Cb 1.11 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 32.17 1ng3 h PRO 150 CO 0.81 0.06 0.04 -0.92 -0.21 0.00 0.00 178.00 177.77 1ng3 h TYR 151 N 0.09 0.07 -0.17 0.65 3.20 -1.91 -1.42 116.97 117.48 1ng3 h TYR 151 Ca 0.49 0.01 -0.14 0.00 3.14 0.00 0.00 58.73 62.23 1ng3 h TYR 151 Cb 0.93 -0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.19 1ng3 h TYR 151 CO -0.43 0.03 -0.49 0.74 -1.64 0.00 0.00 178.16 176.36 1ng3 h PHE 152 N 0.12 0.56 -0.13 -3.82 0.04 -1.78 0.34 116.94 112.26 1ng3 h PHE 152 Ca 0.09 -0.18 -0.08 0.00 2.80 0.00 0.00 57.97 60.60 1ng3 h PHE 152 Cb 0.08 -0.11 -0.01 0.00 2.20 0.00 0.00 35.95 38.10 1ng3 h PHE 152 CO -0.14 0.86 -0.26 -0.24 -0.60 0.00 0.00 178.31 177.94 1ng3 h VAL 153 N 0.36 1.24 0.05 -0.55 3.04 -1.29 0.18 116.25 119.29 1ng3 h VAL 153 Ca 0.02 -1.13 -0.00 0.00 -1.01 0.00 0.00 66.70 64.58 1ng3 h VAL 153 Cb 0.99 1.43 0.00 0.00 -2.01 0.00 0.00 31.29 31.70 1ng3 h VAL 153 CO 0.09 0.34 -0.02 0.00 -1.01 0.00 0.00 177.57 176.97 1ng3 h LYS 155 N -0.48 0.00 -0.22 0.00 1.79 -0.61 -1.15 116.57 115.89 1ng3 h LYS 155 Ca -0.01 0.00 -0.15 0.00 -2.18 0.00 0.00 60.65 58.32 1ng3 h LYS 155 Cb 0.43 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.09 1ng3 h LYS 155 CO 0.01 0.09 -0.44 0.00 -1.08 0.00 0.00 179.45 178.03 1ng3 h ALA 156 N 1.91 0.36 0.11 3.86 0.00 -0.54 -1.16 119.26 123.79 1ng3 h ALA 156 Ca -0.00 -0.47 -0.01 0.00 0.00 0.00 0.00 54.91 54.43 1ng3 h ALA 156 Cb 0.17 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1ng3 h ALA 156 CO 0.01 0.49 -0.05 1.88 0.00 0.00 0.00 179.25 181.58 1ng3 h TYR 157 N 0.40 -0.14 -0.17 0.00 0.05 -0.47 -0.01 116.97 116.64 1ng3 h TYR 157 Ca 0.01 -0.00 0.02 0.00 0.05 0.00 0.00 58.73 58.80 1ng3 h TYR 157 Cb 1.04 0.05 -0.02 0.00 1.01 0.00 0.00 36.73 38.81 1ng3 h TYR 157 CO 0.09 -0.07 0.04 0.28 -1.05 0.00 0.00 178.16 177.45 1ng3 h VAL 158 N -0.17 0.94 -0.35 -2.88 2.07 -1.23 0.63 116.25 115.26 1ng3 h VAL 158 Ca -0.02 -0.04 -0.02 0.00 0.82 0.00 0.00 66.70 67.45 1ng3 h VAL 158 Cb 0.13 0.81 -0.02 0.00 -1.52 0.00 0.00 31.29 30.70 1ng3 h VAL 158 CO 0.03 0.02 0.15 0.50 0.02 0.00 0.00 177.57 178.29 1ng3 h LYS 159 N 0.12 0.51 -0.86 1.57 3.11 -1.15 -0.18 116.57 119.70 1ng3 h LYS 159 Ca 0.07 -0.09 0.02 0.00 -2.81 0.00 0.00 60.65 57.85 1ng3 h LYS 159 Cb 0.06 -0.09 -0.05 0.00 -1.00 0.00 0.00 32.23 31.16 1ng3 h LYS 159 CO -0.09 0.49 0.57 0.00 -2.81 0.00 0.00 179.45 177.61 1ng3 h ALA 160 N 1.00 1.43 -0.62 5.00 0.00 -0.73 -1.64 119.26 123.69 1ng3 h ALA 160 Ca 0.12 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 1ng3 h ALA 160 Cb 0.16 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1ng3 h ALA 160 CO -0.01 0.51 0.04 0.00 0.00 0.00 0.00 179.25 179.79 1ng3 h ALA 161 N 1.48 0.88 -0.46 0.00 0.00 -0.29 -2.52 119.26 118.35 1ng3 h ALA 161 Ca 0.33 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1ng3 h ALA 161 Cb -0.06 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 1ng3 h ALA 161 CO -0.08 0.67 0.25 0.87 0.00 0.00 0.00 179.25 180.95 1ng3 h LYS 162 N 0.99 0.64 0.00 0.00 1.57 -0.18 -0.12 116.57 119.47 1ng3 h LYS 162 Ca 0.18 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 58.87 1ng3 h LYS 162 Cb 0.51 -0.12 -0.00 0.00 0.08 0.00 0.00 32.23 32.70 1ng3 h LYS 162 CO 0.02 0.52 -0.06 0.52 -0.57 0.00 0.00 179.45 179.88 1ng3 h MET 163 N 0.60 0.00 -0.44 3.15 2.86 -1.17 -0.70 114.93 119.24 1ng3 h MET 163 Ca 0.16 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.80 1ng3 h MET 163 Cb 0.07 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.73 1ng3 h MET 163 CO -0.02 0.06 0.00 1.28 1.06 0.00 0.00 176.91 179.28 1ng3 n LEU 164 N -4.42 2.30 0.00 1.22 4.77 -0.76 -4.92 117.00 115.19 1ng3 n LEU 164 Ca -0.03 -1.15 0.00 0.00 -0.03 0.00 0.00 56.01 54.80 1ng3 n LEU 164 Cb 0.14 -0.30 0.00 0.00 -2.33 0.00 0.00 43.42 40.93 1ng3 n LEU 164 CO 0.34 0.55 0.00 0.61 -1.33 0.00 0.00 177.39 177.56 1ng3 n GLY 165 N 1.10 0.45 3.76 -0.72 0.00 -0.27 -4.86 105.19 104.65 1ng3 n GLY 165 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 1ng3 n GLY 165 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ng3 s ALA 166 N -2.00 3.42 -0.39 4.61 0.00 -0.13 -4.74 121.76 122.53 1ng3 s ALA 166 Ca 0.00 0.94 -0.13 0.00 0.00 0.00 0.00 51.96 52.77 1ng3 s ALA 166 Cb 0.00 -3.35 0.02 0.00 0.00 0.00 0.00 23.12 19.78 1ng3 s ALA 166 CO 0.00 -0.24 0.25 -1.21 0.00 0.00 0.00 175.76 174.56 1ng3 s GLU 167 N -1.33 2.98 -0.22 0.00 2.02 -0.87 -4.22 118.70 117.06 1ng3 s GLU 167 Ca 0.46 -1.00 -0.11 0.00 0.02 0.00 0.00 54.97 54.34 1ng3 s GLU 167 Cb -0.33 -3.85 -0.05 0.00 0.10 0.00 0.00 34.13 30.00 1ng3 s GLU 167 CO 0.42 -0.69 0.19 0.42 0.02 0.00 0.00 175.26 175.62 1ng3 s ILE 168 N 1.63 5.35 -0.38 -1.63 1.09 -1.26 -1.66 121.20 124.34 1ng3 s ILE 168 Ca 0.04 0.27 0.01 0.00 -1.10 0.00 0.00 60.65 59.88 1ng3 s ILE 168 Cb -0.19 -3.53 0.11 0.00 -1.06 0.00 0.00 42.46 37.79 1ng3 s ILE 168 CO 0.09 0.36 0.12 -0.36 -0.10 0.00 0.00 174.94 175.04 1ng3 s PHE 169 N 0.91 3.68 0.74 3.97 0.08 -0.17 -4.98 117.98 122.21 1ng3 s PHE 169 Ca 0.10 -2.81 -0.12 0.00 0.12 0.00 0.00 56.93 54.22 1ng3 s PHE 169 Cb -0.13 -3.03 0.04 0.00 -0.57 0.00 0.00 43.02 39.32 1ng3 s PHE 169 CO 0.04 -0.95 1.11 -1.21 -0.10 0.00 0.00 175.22 174.11 1ng3 s GLU 170 N 0.92 2.57 -1.51 0.44 2.02 -1.26 -1.12 118.70 120.76 1ng3 s GLU 170 Ca 0.10 0.42 0.00 0.00 0.02 0.00 0.00 54.97 55.51 1ng3 s GLU 170 Cb -0.21 -1.99 0.00 0.00 0.10 0.00 0.00 34.13 32.03 1ng3 s GLU 170 CO -0.06 -1.23 0.00 0.72 0.02 0.00 0.00 175.26 174.71 1ng3 n HIS 171 N -3.13 -0.73 -3.89 1.61 8.25 0.03 -4.85 115.22 112.51 1ng3 n HIS 171 Ca 0.07 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.25 1ng3 n HIS 171 Cb 0.58 -3.04 -0.12 0.00 1.12 0.00 0.00 29.99 28.52 1ng3 n HIS 171 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1ng3 s THR 172 N -2.55 2.95 0.32 1.59 2.01 -0.10 -4.91 115.64 114.96 1ng3 s THR 172 Ca 0.00 -4.26 -0.29 0.00 0.31 0.00 0.00 61.69 57.45 1ng3 s THR 172 Cb 0.00 -2.93 -0.11 0.00 0.01 0.00 0.00 72.50 69.47 1ng3 s THR 172 CO 0.00 -1.01 1.53 -2.84 -0.69 0.00 0.00 174.62 171.61 1ng3 s PRO 173 N -1.44 4.14 -0.23 4.92 0.02 -1.26 -3.94 135.00 137.20 1ng3 s PRO 173 Ca 0.25 2.54 -0.20 0.00 0.02 0.00 0.00 61.00 63.61 1ng3 s PRO 173 Cb -0.05 -3.01 -0.02 0.00 0.02 0.00 0.00 34.50 31.44 1ng3 s PRO 173 CO -0.16 -0.56 0.61 0.08 -0.33 0.00 0.00 177.00 176.63 1ng3 s VAL 174 N -0.49 5.02 -0.04 3.83 1.01 -1.26 -3.96 120.40 124.50 1ng3 s VAL 174 Ca 0.58 1.11 -0.03 0.00 0.00 0.00 0.00 61.98 63.64 1ng3 s VAL 174 Cb -0.47 -3.92 -0.27 0.00 0.00 0.00 0.00 36.38 31.72 1ng3 s VAL 174 CO 0.54 0.08 0.68 -0.07 0.00 0.00 0.00 175.10 176.32 1ng3 h LEU 175 N 8.55 0.38 -7.00 3.92 3.38 0.94 -3.49 115.31 122.00 1ng3 h LEU 175 Ca -0.29 -0.64 -0.04 0.00 0.09 0.00 0.00 57.88 57.00 1ng3 h LEU 175 Cb 1.13 -0.12 -0.21 0.00 0.09 0.00 0.00 40.66 41.55 1ng3 h LEU 175 CO 0.77 1.55 0.17 -2.28 0.09 0.00 0.00 178.44 178.74 1ng3 s HIS 176 N -2.59 -0.73 -0.23 1.13 5.04 -1.15 -4.99 115.29 111.77 1ng3 s HIS 176 Ca -0.13 1.65 -0.06 0.00 -1.54 0.00 0.00 55.06 54.99 1ng3 s HIS 176 Cb 0.07 0.32 -0.02 0.00 0.04 0.00 0.00 32.58 32.98 1ng3 s HIS 176 CO 0.83 -0.43 0.01 0.08 -2.34 0.00 0.00 174.74 172.89 1ng3 s VAL 177 N -0.07 3.87 -0.09 0.89 1.01 -1.26 -0.67 120.40 124.08 1ng3 s VAL 177 Ca -0.03 -0.33 -0.00 0.00 0.00 0.00 0.00 61.98 61.63 1ng3 s VAL 177 Cb -0.04 -2.78 -0.03 0.00 0.00 0.00 0.00 36.38 33.53 1ng3 s VAL 177 CO 0.03 0.39 -0.06 -1.61 0.00 0.00 0.00 175.10 173.84 1ng3 s GLU 178 N 1.47 2.98 -0.12 2.72 0.41 0.25 -4.88 118.70 121.53 1ng3 s GLU 178 Ca 0.05 -0.54 0.00 0.00 -0.41 0.00 0.00 54.97 54.07 1ng3 s GLU 178 Cb -0.15 -2.66 0.02 0.00 -1.78 0.00 0.00 34.13 29.56 1ng3 s GLU 178 CO 0.00 0.56 -0.10 -0.98 -0.49 0.00 0.00 175.26 174.25 1ng3 s ARG 179 N -0.51 1.81 0.00 1.61 1.70 -1.26 0.86 118.95 123.15 1ng3 s ARG 179 Ca 0.08 -0.37 0.00 0.00 -0.47 0.00 0.00 55.73 54.97 1ng3 s ARG 179 Cb -0.12 -1.75 0.00 0.00 -0.57 0.00 0.00 34.95 32.51 1ng3 s ARG 179 CO 0.02 -0.23 0.00 -3.47 -1.08 0.00 0.00 175.30 170.54 1ng3 n ASP 180 N 4.79 0.00 -3.51 -2.89 2.03 -1.26 -5.05 116.55 110.66 1ng3 n ASP 180 Ca -0.15 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.16 1ng3 n ASP 180 Cb 0.50 0.43 0.00 0.00 -0.72 0.00 0.00 41.12 41.33 1ng3 n ASP 180 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1ng3 n GLY 181 N -1.44 -2.06 0.11 0.27 0.00 -1.26 -4.85 105.19 95.97 1ng3 n GLY 181 Ca 0.00 -1.39 0.14 0.00 0.00 0.00 0.00 46.02 44.78 1ng3 n GLY 181 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1ng3 n GLU 182 N 0.00 0.70 -4.39 1.61 4.07 -1.26 -4.85 120.64 116.52 1ng3 n GLU 182 Ca 0.00 -0.23 -0.21 0.00 -0.06 0.00 0.00 57.16 56.67 1ng3 n GLU 182 Cb 0.00 -1.50 -0.09 0.00 -0.06 0.00 0.00 31.44 29.79 1ng3 n GLU 182 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1ng3 s ALA 183 N -2.46 2.22 0.48 4.31 0.00 -1.26 -5.02 121.76 120.02 1ng3 s ALA 183 Ca 0.29 -1.68 -0.05 0.00 0.00 0.00 0.00 51.96 50.53 1ng3 s ALA 183 Cb 0.20 1.00 -0.03 0.00 0.00 0.00 0.00 23.12 24.29 1ng3 s ALA 183 CO 0.47 -0.45 0.77 -0.51 0.00 0.00 0.00 175.76 176.04 1ng3 s LEU 184 N -3.44 3.63 -0.19 0.00 2.01 -0.12 -4.04 118.68 116.53 1ng3 s LEU 184 Ca 0.33 0.85 -0.03 0.00 0.01 0.00 0.00 54.13 55.29 1ng3 s LEU 184 Cb 0.05 -3.78 0.06 0.00 0.01 0.00 0.00 46.19 42.53 1ng3 s LEU 184 CO 0.17 -0.59 0.03 0.12 1.01 0.00 0.00 176.35 177.08 1ng3 s PHE 185 N -2.72 1.07 -0.07 0.29 5.36 0.25 -1.76 117.98 120.40 1ng3 s PHE 185 Ca 0.47 -0.88 -0.08 0.00 -0.96 0.00 0.00 56.93 55.48 1ng3 s PHE 185 Cb -0.10 -1.04 -0.04 0.00 -0.34 0.00 0.00 43.02 41.49 1ng3 s PHE 185 CO 0.44 -0.61 0.22 0.42 -1.46 0.00 0.00 175.22 174.22 1ng3 s ILE 186 N 1.84 5.38 -0.17 3.12 1.09 0.50 0.87 121.20 133.84 1ng3 s ILE 186 Ca -0.01 0.33 0.01 0.00 -1.10 0.00 0.00 60.65 59.88 1ng3 s ILE 186 Cb -0.17 -3.49 0.02 0.00 -1.06 0.00 0.00 42.46 37.75 1ng3 s ILE 186 CO -0.08 0.57 -0.20 -0.54 -0.10 0.00 0.00 174.94 174.59 1ng3 s LYS 187 N -1.17 3.01 0.25 2.79 1.02 0.16 -1.25 119.74 124.56 1ng3 s LYS 187 Ca 0.19 -0.84 0.10 0.00 0.02 0.00 0.00 55.97 55.44 1ng3 s LYS 187 Cb -0.13 -2.53 -0.05 0.00 -0.52 0.00 0.00 37.83 34.60 1ng3 s LYS 187 CO 0.08 -0.13 -0.16 0.95 -0.92 0.00 0.00 175.35 175.17 1ng3 s THR 188 N 1.11 2.09 0.27 2.17 -4.23 -0.42 0.15 115.64 116.77 1ng3 s THR 188 Ca 0.00 -2.29 0.36 0.00 -1.18 0.00 0.00 61.69 58.58 1ng3 s THR 188 Cb -0.14 -2.23 0.37 0.00 1.34 0.00 0.00 72.50 71.85 1ng3 s THR 188 CO -0.09 -0.46 2.09 -0.65 -0.54 0.00 0.00 174.62 174.98 1ng3 h PRO 189 N 2.38 0.00 -1.01 3.99 0.11 -1.94 -1.76 132.00 133.76 1ng3 h PRO 189 Ca -0.39 0.00 -0.53 0.00 0.11 0.00 0.00 66.00 65.19 1ng3 h PRO 189 Cb 1.24 0.00 -0.29 0.00 0.11 0.00 0.00 31.00 32.06 1ng3 h PRO 189 CO 0.62 0.00 0.68 0.43 -0.21 0.00 0.00 178.00 179.52 1ng3 n SER 190 N -2.85 4.54 0.00 -2.05 7.64 -1.26 -5.03 113.62 114.62 1ng3 n SER 190 Ca -0.01 -3.58 0.00 0.00 1.01 0.00 0.00 58.87 56.28 1ng3 n SER 190 Cb 0.13 -0.86 0.00 0.00 -1.01 0.00 0.00 64.21 62.47 1ng3 n SER 190 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ng3 n GLY 191 N -1.02 0.79 3.50 0.23 0.00 -0.66 -5.03 105.19 102.99 1ng3 n GLY 191 Ca 0.58 -2.19 -0.26 0.00 0.00 0.00 0.00 46.02 44.15 1ng3 n GLY 191 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ng3 s ASP 192 N 0.00 3.82 0.02 1.61 -0.00 -1.26 -1.30 116.67 119.55 1ng3 s ASP 192 Ca 0.00 -0.79 -0.01 0.00 -0.00 0.00 0.00 52.55 51.76 1ng3 s ASP 192 Cb 0.00 -0.46 -0.02 0.00 -0.00 0.00 0.00 42.92 42.44 1ng3 s ASP 192 CO 0.00 0.09 -0.02 -0.69 -0.00 0.00 0.00 175.17 174.56 1ng3 s VAL 193 N -1.88 0.11 0.04 -1.27 1.01 -0.38 -4.79 120.40 113.23 1ng3 s VAL 193 Ca 0.25 -0.88 0.03 0.00 0.00 0.00 0.00 61.98 61.38 1ng3 s VAL 193 Cb -0.08 -0.27 -0.04 0.00 0.00 0.00 0.00 36.38 36.00 1ng3 s VAL 193 CO 0.13 -0.49 -0.01 0.26 0.00 0.00 0.00 175.10 174.99 1ng3 s TRP 194 N -1.44 3.00 0.17 5.22 0.52 -0.05 -0.37 118.94 125.99 1ng3 s TRP 194 Ca -0.16 0.01 -0.10 0.00 0.02 0.00 0.00 56.10 55.87 1ng3 s TRP 194 Cb -0.10 -1.60 -0.00 0.00 -1.15 0.00 0.00 33.47 30.62 1ng3 s TRP 194 CO -0.01 0.45 0.32 0.00 0.02 0.00 0.00 176.95 177.74 1ng3 s ALA 195 N -1.17 -0.12 -0.75 0.98 0.00 -0.72 -0.92 121.76 119.05 1ng3 s ALA 195 Ca 0.22 -0.80 0.20 0.00 0.00 0.00 0.00 51.96 51.57 1ng3 s ALA 195 Cb -0.11 0.87 -0.23 0.00 0.00 0.00 0.00 23.12 23.64 1ng3 s ALA 195 CO 0.13 -0.67 0.76 0.09 0.00 0.00 0.00 175.76 176.07 1ng3 n ASN 196 N -0.24 0.82 -3.69 0.00 3.02 -0.54 -0.95 115.26 113.69 1ng3 n ASN 196 Ca -0.08 -0.78 -0.10 0.00 -0.03 0.00 0.00 54.58 53.60 1ng3 n ASN 196 Cb 0.63 1.18 -0.10 0.00 -0.61 0.00 0.00 39.78 40.87 1ng3 n ASN 196 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 1ng3 s HIS 197 N -2.95 -0.64 -0.06 3.10 3.76 -0.34 -4.74 115.29 113.41 1ng3 s HIS 197 Ca 0.05 1.36 0.06 0.00 -0.15 0.00 0.00 55.06 56.37 1ng3 s HIS 197 Cb 0.14 0.30 -0.01 0.00 1.11 0.00 0.00 32.58 34.12 1ng3 s HIS 197 CO 0.81 -0.36 -0.24 0.08 -0.85 0.00 0.00 174.74 174.18 1ng3 s VAL 198 N 1.45 2.16 -0.18 -0.90 1.01 -0.39 -0.56 120.40 123.00 1ng3 s VAL 198 Ca -0.09 -1.03 0.01 0.00 0.00 0.00 0.00 61.98 60.87 1ng3 s VAL 198 Cb -0.08 -1.79 0.02 0.00 0.00 0.00 0.00 36.38 34.53 1ng3 s VAL 198 CO -0.13 0.57 -0.17 -0.69 0.00 0.00 0.00 175.10 174.67 1ng3 s VAL 199 N -0.19 1.89 -0.36 2.92 1.01 -0.04 -0.71 120.40 124.92 1ng3 s VAL 199 Ca -0.03 -0.89 -0.22 0.00 0.00 0.00 0.00 61.98 60.84 1ng3 s VAL 199 Cb -0.14 -1.76 0.01 0.00 0.00 0.00 0.00 36.38 34.50 1ng3 s VAL 199 CO 0.03 0.46 0.74 -0.69 0.00 0.00 0.00 175.10 175.65 1ng3 s VAL 200 N 1.35 4.78 -0.34 2.92 1.01 0.21 -0.42 120.40 129.90 1ng3 s VAL 200 Ca 0.04 0.79 0.16 0.00 0.00 0.00 0.00 61.98 62.96 1ng3 s VAL 200 Cb -0.13 -4.17 0.44 0.00 0.00 0.00 0.00 36.38 32.51 1ng3 s VAL 200 CO -0.12 -0.40 0.93 0.00 0.00 0.00 0.00 175.10 175.51 1ng3 n ALA 201 N 6.31 3.36 -0.27 5.51 0.00 0.25 -1.09 120.51 134.58 1ng3 n ALA 201 Ca 0.02 -3.32 -0.02 0.00 0.00 0.00 0.00 53.44 50.12 1ng3 n ALA 201 Cb 0.48 -0.90 0.21 0.00 0.00 0.00 0.00 19.45 19.25 1ng3 n ALA 201 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1ng3 n SER 202 N -0.04 3.86 0.00 0.00 7.64 -1.02 -4.15 113.62 119.91 1ng3 n SER 202 Ca 0.15 -2.73 0.00 0.00 1.01 0.00 0.00 58.87 57.30 1ng3 n SER 202 Cb 0.77 -0.65 0.00 0.00 -1.01 0.00 0.00 64.21 63.32 1ng3 n SER 202 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ng3 n GLY 203 N 0.10 2.69 0.10 0.23 0.00 -1.26 -1.40 105.19 105.65 1ng3 n GLY 203 Ca 0.24 -0.22 0.09 0.00 0.00 0.00 0.00 46.02 46.13 1ng3 n GLY 203 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1ng3 n VAL 204 N 0.00 1.12 0.58 1.61 3.14 -1.26 -1.87 118.33 121.65 1ng3 n VAL 204 Ca 0.00 0.44 0.10 0.00 -2.96 0.00 0.00 64.34 61.92 1ng3 n VAL 204 Cb 0.00 -1.38 0.27 0.00 -1.06 0.00 0.00 33.84 31.67 1ng3 n VAL 204 CO 0.00 0.00 0.00 0.79 -6.46 0.00 0.00 176.83 171.16 1ng3 n TRP 205 N -2.00 0.51 0.28 1.45 8.01 -0.49 -4.37 117.44 120.84 1ng3 n TRP 205 Ca 0.01 -0.26 0.15 0.00 -1.31 0.00 0.00 57.50 56.09 1ng3 n TRP 205 Cb 0.12 0.00 0.85 0.00 -2.01 0.00 0.00 31.31 30.27 1ng3 n TRP 205 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 177.69 177.45 1ng3 h SER 206 N 3.19 0.00 -0.79 -0.99 0.02 -1.38 -3.29 113.55 110.30 1ng3 h SER 206 Ca 0.00 0.00 0.16 0.00 -0.84 0.00 0.00 61.79 61.11 1ng3 h SER 206 Cb 0.71 0.00 -0.15 0.00 0.14 0.00 0.00 62.40 63.11 1ng3 h SER 206 CO 0.00 0.06 -0.16 1.23 -1.14 0.00 0.00 176.83 176.82 1ng3 h GLY 207 N 0.57 0.63 1.16 -3.77 0.00 -1.84 -0.66 103.07 99.16 1ng3 h GLY 207 Ca -0.00 0.24 0.10 0.00 0.00 0.00 0.00 47.33 47.67 1ng3 h GLY 207 CO 0.01 -0.31 0.33 0.00 0.00 0.00 0.00 176.54 176.57 1ng3 h MET 208 N 0.01 0.19 0.01 4.80 -0.00 -1.94 -0.53 114.93 117.48 1ng3 h MET 208 Ca 0.39 -0.01 -0.16 0.00 -0.00 0.00 0.00 59.70 59.92 1ng3 h MET 208 Cb 0.62 -0.04 0.01 0.00 -0.00 0.00 0.00 31.60 32.19 1ng3 h MET 208 CO -0.80 0.13 -0.64 0.74 -0.00 0.00 0.00 176.91 176.34 1ng3 h PHE 209 N 0.20 0.62 -0.10 -0.10 0.04 -1.38 -0.65 116.94 115.57 1ng3 h PHE 209 Ca 0.22 -0.35 0.04 0.00 2.80 0.00 0.00 57.97 60.69 1ng3 h PHE 209 Cb 0.62 -0.07 -0.05 0.00 2.20 0.00 0.00 35.95 38.66 1ng3 h PHE 209 CO -0.00 1.17 -0.18 0.74 -0.60 0.00 0.00 178.31 179.44 1ng3 h PHE 210 N -0.10 -0.46 -0.68 -0.55 0.04 -1.13 -0.13 116.94 113.92 1ng3 h PHE 210 Ca -0.08 0.02 0.01 0.00 2.80 0.00 0.00 57.97 60.72 1ng3 h PHE 210 Cb 1.36 0.22 -0.03 0.00 2.20 0.00 0.00 35.95 39.69 1ng3 h PHE 210 CO 0.15 -0.25 0.45 -0.22 -0.60 0.00 0.00 178.31 177.83 1ng3 h LYS 211 N -0.24 0.90 -0.14 1.51 1.63 -0.99 -0.33 116.57 118.92 1ng3 h LYS 211 Ca 0.09 -0.06 -0.07 0.00 -0.85 0.00 0.00 60.65 59.77 1ng3 h LYS 211 Cb 0.37 -0.20 -0.01 0.00 -0.60 0.00 0.00 32.23 31.78 1ng3 h LYS 211 CO -0.24 0.60 -0.21 1.96 -3.45 0.00 0.00 179.45 178.11 1ng3 h GLN 212 N 0.93 0.24 -0.65 1.90 4.20 -0.06 -2.78 115.11 118.89 1ng3 h GLN 212 Ca 0.25 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.89 1ng3 h GLN 212 Cb -0.10 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 27.65 1ng3 h GLN 212 CO -0.05 0.44 0.00 1.28 -0.67 0.00 0.00 178.83 179.83 1ng3 n LEU 213 N -4.20 4.71 0.00 1.46 4.77 -0.16 -4.94 117.00 118.64 1ng3 n LEU 213 Ca -0.01 -2.39 0.00 0.00 -0.03 0.00 0.00 56.01 53.58 1ng3 n LEU 213 Cb 0.33 -0.62 0.00 0.00 -2.33 0.00 0.00 43.42 40.80 1ng3 n LEU 213 CO 0.39 0.61 0.00 0.61 -1.33 0.00 0.00 177.39 177.67 1ng3 n GLY 214 N 0.67 2.02 3.90 -0.72 0.00 -0.98 -5.04 105.19 105.04 1ng3 n GLY 214 Ca 0.23 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.97 1ng3 n GLY 214 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ng3 s LEU 215 N 0.00 3.73 -0.06 0.99 1.43 -0.24 -4.96 118.68 119.58 1ng3 s LEU 215 Ca 0.00 0.96 0.09 0.00 -1.03 0.00 0.00 54.13 54.16 1ng3 s LEU 215 Cb 0.00 -3.88 0.22 0.00 0.03 0.00 0.00 46.19 42.56 1ng3 s LEU 215 CO 0.00 -0.49 1.16 0.59 0.23 0.00 0.00 176.35 177.84 1ng3 n ASN 216 N -1.85 2.60 -4.64 2.29 5.03 -1.26 -2.90 115.26 114.52 1ng3 n ASN 216 Ca 0.01 -2.40 -0.51 0.00 0.87 0.00 0.00 54.58 52.55 1ng3 n ASN 216 Cb 0.55 -0.24 -0.06 0.00 -1.02 0.00 0.00 39.78 39.01 1ng3 n ASN 216 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 1ng3 n ASN 217 N -0.45 2.29 -4.82 6.41 4.13 -1.26 -4.95 115.26 116.61 1ng3 n ASN 217 Ca 0.10 1.09 -0.24 0.00 1.68 0.00 0.00 54.58 57.20 1ng3 n ASN 217 Cb 0.48 -1.25 -0.05 0.00 -1.54 0.00 0.00 39.78 37.42 1ng3 n ASN 217 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1ng3 s ALA 218 N 1.51 3.62 -0.01 5.41 0.00 -1.26 -4.78 121.76 126.26 1ng3 s ALA 218 Ca 0.87 -1.28 0.04 0.00 0.00 0.00 0.00 51.96 51.59 1ng3 s ALA 218 Cb -0.89 -1.38 -0.01 0.00 0.00 0.00 0.00 23.12 20.84 1ng3 s ALA 218 CO 0.49 0.40 -0.14 -0.06 0.00 0.00 0.00 175.76 176.45 1ng3 s PHE 219 N -1.91 1.23 -0.08 0.00 0.08 -1.26 -4.39 117.98 111.65 1ng3 s PHE 219 Ca 0.32 -0.24 0.00 0.00 0.12 0.00 0.00 56.93 57.14 1ng3 s PHE 219 Cb -0.09 -0.79 0.02 0.00 -0.57 0.00 0.00 43.02 41.59 1ng3 s PHE 219 CO 0.24 -0.02 -0.07 -1.17 -0.10 0.00 0.00 175.22 174.10 1ng3 s LEU 220 N -0.35 1.26 0.24 -0.37 1.98 0.11 -4.95 118.68 116.60 1ng3 s LEU 220 Ca 0.05 -0.24 -0.30 0.00 -2.89 0.00 0.00 54.13 50.75 1ng3 s LEU 220 Cb -0.05 -0.72 -0.09 0.00 0.66 0.00 0.00 46.19 45.99 1ng3 s LEU 220 CO -0.00 -0.08 1.04 -2.16 -1.89 0.00 0.00 176.35 173.26 1ng3 s PRO 221 N 1.32 4.70 -0.37 0.98 0.04 -1.26 -0.13 135.00 140.27 1ng3 s PRO 221 Ca -0.03 1.68 0.03 0.00 0.04 0.00 0.00 61.00 62.72 1ng3 s PRO 221 Cb -0.14 -3.24 0.11 0.00 0.04 0.00 0.00 34.50 31.27 1ng3 s PRO 221 CO -0.03 0.28 0.10 0.08 0.04 0.00 0.00 177.00 177.47 1ng3 s VAL 222 N -0.92 2.15 0.39 -0.36 1.01 -0.29 0.55 120.40 122.92 1ng3 s VAL 222 Ca 0.45 -2.44 -0.27 0.00 0.00 0.00 0.00 61.98 59.71 1ng3 s VAL 222 Cb -0.29 -2.57 -0.10 0.00 0.00 0.00 0.00 36.38 33.42 1ng3 s VAL 222 CO 0.37 -0.66 1.44 -0.75 0.00 0.00 0.00 175.10 175.50 1ng3 s LYS 223 N 0.73 4.02 -0.08 2.72 2.20 -0.00 -1.26 119.74 128.07 1ng3 s LYS 223 Ca 0.12 2.47 0.01 0.00 -0.36 0.00 0.00 55.97 58.21 1ng3 s LYS 223 Cb -0.20 -2.88 0.02 0.00 -1.51 0.00 0.00 37.83 33.25 1ng3 s LYS 223 CO -0.08 -0.57 -0.07 0.20 -0.36 0.00 0.00 175.35 174.47 1ng3 s GLY 224 N -0.31 0.66 -0.10 5.54 0.00 0.10 -0.74 107.32 112.47 1ng3 s GLY 224 Ca 0.55 -0.31 -0.02 0.00 0.00 0.00 0.00 44.72 44.94 1ng3 s GLY 224 CO 0.59 0.58 -0.02 -0.54 0.00 0.00 0.00 173.10 173.71 1ng3 s GLU 225 N 1.26 3.15 0.29 2.90 2.02 -1.26 -1.22 118.70 125.84 1ng3 s GLU 225 Ca -0.05 -0.47 0.03 0.00 0.02 0.00 0.00 54.97 54.51 1ng3 s GLU 225 Cb -0.14 -2.80 -0.04 0.00 0.10 0.00 0.00 34.13 31.26 1ng3 s GLU 225 CO -0.02 0.55 0.17 0.00 0.02 0.00 0.00 175.26 175.98 1ng3 s LEU 227 N -3.33 0.30 0.06 0.00 0.05 -1.15 -1.64 118.68 112.98 1ng3 s LEU 227 Ca 0.37 -0.73 0.01 0.00 0.05 0.00 0.00 54.13 53.83 1ng3 s LEU 227 Cb 0.05 1.87 -0.03 0.00 -2.05 0.00 0.00 46.19 46.03 1ng3 s LEU 227 CO 0.18 -1.08 -0.06 -0.94 -0.55 0.00 0.00 176.35 173.91 1ng3 s SER 228 N -2.95 0.81 0.19 1.48 1.04 0.28 -0.79 113.70 113.76 1ng3 s SER 228 Ca 0.16 -0.84 -0.01 0.00 0.48 0.00 0.00 55.95 55.74 1ng3 s SER 228 Cb -0.00 0.11 -0.04 0.00 0.10 0.00 0.00 66.02 66.18 1ng3 s SER 228 CO 0.03 -0.42 0.11 0.68 0.98 0.00 0.00 173.24 174.63 1ng3 s VAL 229 N -2.90 0.05 -0.22 5.02 -7.23 -0.72 -0.16 120.40 114.22 1ng3 s VAL 229 Ca 0.02 -1.98 -0.09 0.00 -1.81 0.00 0.00 61.98 58.12 1ng3 s VAL 229 Cb 0.00 -2.42 -0.04 0.00 0.56 0.00 0.00 36.38 34.48 1ng3 s VAL 229 CO -0.04 -0.09 0.10 0.26 -0.31 0.00 0.00 175.10 175.02 1ng3 s TRP 230 N -4.12 3.23 -0.88 2.82 0.52 -0.74 -0.78 118.94 118.99 1ng3 s TRP 230 Ca 0.36 0.02 -0.08 0.00 0.02 0.00 0.00 56.10 56.42 1ng3 s TRP 230 Cb 0.07 -2.20 0.22 0.00 -1.15 0.00 0.00 33.47 30.42 1ng3 s TRP 230 CO 0.10 -0.01 0.79 1.21 0.02 0.00 0.00 176.95 179.06 1ng3 s ASN 231 N 0.97 6.42 0.00 2.95 2.47 0.47 -4.08 114.94 124.14 1ng3 s ASN 231 Ca 0.05 -3.20 0.24 0.00 0.42 0.00 0.00 52.86 50.37 1ng3 s ASN 231 Cb -0.14 -2.07 0.31 0.00 -1.45 0.00 0.00 41.25 37.90 1ng3 s ASN 231 CO 0.03 -0.37 1.27 0.47 -3.72 0.00 0.00 177.10 174.79 1ng3 n ASP 232 N 3.16 0.93 -0.06 -4.21 8.00 -1.26 -4.68 116.55 118.42 1ng3 n ASP 232 Ca 0.17 -0.74 -0.11 0.00 0.71 0.00 0.00 54.79 54.83 1ng3 n ASP 232 Cb 0.41 0.45 -0.05 0.00 -0.02 0.00 0.00 41.12 41.91 1ng3 n ASP 232 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1ng3 n ASP 233 N -1.14 2.00 -4.83 -2.24 8.00 -1.26 -5.06 116.55 112.01 1ng3 n ASP 233 Ca 0.07 0.04 -0.27 0.00 0.71 0.00 0.00 54.79 55.34 1ng3 n ASP 233 Cb 0.35 -0.27 -0.05 0.00 -0.02 0.00 0.00 41.12 41.13 1ng3 n ASP 233 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 1ng3 s ILE 234 N -2.23 4.71 0.36 0.53 -4.36 -1.26 -5.09 121.20 113.86 1ng3 s ILE 234 Ca -0.17 -0.92 -0.25 0.00 -0.26 0.00 0.00 60.65 59.06 1ng3 s ILE 234 Cb 0.05 -3.38 -0.10 0.00 1.25 0.00 0.00 42.46 40.28 1ng3 s ILE 234 CO 0.24 -0.06 0.99 -2.84 0.24 0.00 0.00 174.94 173.52 1ng3 s PRO 235 N -2.99 4.39 -0.30 0.37 0.02 -1.26 -5.02 135.00 130.21 1ng3 s PRO 235 Ca 0.32 1.39 -0.04 0.00 0.02 0.00 0.00 61.00 62.69 1ng3 s PRO 235 Cb -0.11 -2.64 0.18 0.00 0.02 0.00 0.00 34.50 31.95 1ng3 s PRO 235 CO 0.24 0.08 0.67 -1.17 -0.33 0.00 0.00 177.00 176.50 1ng3 s LEU 236 N -2.39 -1.23 -0.09 -5.54 2.96 -1.26 -4.84 118.68 106.30 1ng3 s LEU 236 Ca 0.54 0.89 0.05 0.00 -0.22 0.00 0.00 54.13 55.39 1ng3 s LEU 236 Cb -0.19 2.08 -0.09 0.00 0.50 0.00 0.00 46.19 48.49 1ng3 s LEU 236 CO 0.24 -0.23 -0.01 0.41 -1.32 0.00 0.00 176.35 175.44 1ng3 n THR 237 N 5.43 0.55 -3.30 3.68 -1.04 -1.26 -4.81 114.28 113.53 1ng3 n THR 237 Ca -0.03 -0.30 -0.31 0.00 -2.04 0.00 0.00 64.05 61.37 1ng3 n THR 237 Cb 0.51 -0.81 -0.05 0.00 -1.82 0.00 0.00 70.33 68.16 1ng3 n THR 237 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1ng3 s LYS 238 N -2.19 3.77 0.06 -2.82 -0.14 -1.26 -4.33 119.74 112.83 1ng3 s LYS 238 Ca -0.07 0.26 -0.26 0.00 -1.36 0.00 0.00 55.97 54.53 1ng3 s LYS 238 Cb 0.03 -2.60 -0.05 0.00 -1.68 0.00 0.00 37.83 33.53 1ng3 s LYS 238 CO 0.29 0.23 0.83 0.99 -0.76 0.00 0.00 175.35 176.93 1ng3 s THR 239 N -1.97 4.67 -0.22 2.17 2.01 -0.80 -4.67 115.64 116.83 1ng3 s THR 239 Ca 0.48 1.76 -0.13 0.00 0.31 0.00 0.00 61.69 64.11 1ng3 s THR 239 Cb -0.11 -4.18 -0.04 0.00 0.01 0.00 0.00 72.50 68.18 1ng3 s THR 239 CO 0.24 0.35 0.29 -0.76 -0.69 0.00 0.00 174.62 174.05 1ng3 s LEU 240 N -0.01 4.14 -0.02 4.42 1.02 -0.64 -0.23 118.68 127.36 1ng3 s LEU 240 Ca 0.41 0.34 0.05 0.00 0.02 0.00 0.00 54.13 54.95 1ng3 s LEU 240 Cb -0.21 -2.33 -0.01 0.00 0.02 0.00 0.00 46.19 43.66 1ng3 s LEU 240 CO 0.25 -0.00 -0.16 -0.47 0.02 0.00 0.00 176.35 175.99 1ng3 s TYR 241 N 1.14 1.49 -0.29 0.29 5.04 -0.72 -1.02 117.35 123.29 1ng3 s TYR 241 Ca 0.14 -0.33 -0.15 0.00 -2.44 0.00 0.00 57.07 54.29 1ng3 s TYR 241 Cb -0.14 -0.98 0.14 0.00 0.35 0.00 0.00 41.96 41.34 1ng3 s TYR 241 CO 0.06 -0.07 0.92 -1.58 -1.34 0.00 0.00 175.55 173.55 1ng3 s HIS 242 N -0.23 -0.71 -1.36 4.97 2.46 -0.28 -0.06 115.29 120.07 1ng3 s HIS 242 Ca 0.03 1.35 -0.05 0.00 0.47 0.00 0.00 55.06 56.86 1ng3 s HIS 242 Cb -0.08 0.43 0.00 0.00 -0.13 0.00 0.00 32.58 32.80 1ng3 s HIS 242 CO 0.00 -0.35 0.47 -3.47 -2.47 0.00 0.00 174.74 168.92 1ng3 n ASP 243 N 4.25 -1.22 0.00 9.88 2.03 -1.26 -0.71 116.55 129.52 1ng3 n ASP 243 Ca -0.16 -1.03 0.00 0.00 0.52 0.00 0.00 54.79 54.12 1ng3 n ASP 243 Cb 0.56 -3.00 0.00 0.00 -0.72 0.00 0.00 41.12 37.96 1ng3 n ASP 243 CO 0.00 0.00 0.00 1.41 -1.92 0.00 0.00 177.20 176.69 1ng3 n HIS 244 N -4.40 0.00 -4.04 -0.67 8.25 -1.26 -4.97 115.22 108.12 1ng3 n HIS 244 Ca -0.27 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 56.96 1ng3 n HIS 244 Cb 0.67 -1.18 -0.04 0.00 1.12 0.00 0.00 29.99 30.56 1ng3 n HIS 244 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1ng3 s TYR 246 N -1.97 -0.04 -0.25 0.00 -0.85 -1.18 -1.13 117.35 111.94 1ng3 s TYR 246 Ca 0.33 -0.38 -0.03 0.00 -0.52 0.00 0.00 57.07 56.46 1ng3 s TYR 246 Cb -0.09 0.54 0.10 0.00 0.38 0.00 0.00 41.96 42.89 1ng3 s TYR 246 CO 0.26 -1.14 0.19 0.42 -1.52 0.00 0.00 175.55 173.76 1ng3 s ILE 247 N -3.94 -0.22 -0.20 -3.49 1.01 -0.19 -1.68 121.20 112.50 1ng3 s ILE 247 Ca 0.14 -0.45 -0.04 0.00 0.00 0.00 0.00 60.65 60.30 1ng3 s ILE 247 Cb -0.04 -0.85 -0.02 0.00 0.01 0.00 0.00 42.46 41.56 1ng3 s ILE 247 CO 0.07 -0.47 -0.02 0.68 0.00 0.00 0.00 174.94 175.19 1ng3 s VAL 248 N 2.23 3.72 -0.23 2.92 -7.23 -0.24 -1.62 120.40 119.94 1ng3 s VAL 248 Ca 0.08 -0.39 -0.28 0.00 -1.81 0.00 0.00 61.98 59.57 1ng3 s VAL 248 Cb -0.15 -2.68 0.01 0.00 0.56 0.00 0.00 36.38 34.12 1ng3 s VAL 248 CO -0.26 0.43 1.02 -2.16 -0.31 0.00 0.00 175.10 173.82 1ng3 s PRO 249 N 1.08 4.25 0.38 4.82 0.04 -1.26 -0.77 135.00 143.54 1ng3 s PRO 249 Ca 0.02 1.31 -0.01 0.00 0.04 0.00 0.00 61.00 62.36 1ng3 s PRO 249 Cb -0.14 -3.64 -0.03 0.00 0.04 0.00 0.00 34.50 30.72 1ng3 s PRO 249 CO 0.01 -0.62 0.61 1.03 0.04 0.00 0.00 177.00 178.07 1ng3 s ARG 250 N 3.15 3.51 0.00 4.56 0.52 0.42 -4.97 118.95 126.14 1ng3 s ARG 250 Ca 0.43 -0.19 0.10 0.00 -0.52 0.00 0.00 55.73 55.56 1ng3 s ARG 250 Cb -0.15 -2.59 0.45 0.00 0.52 0.00 0.00 34.95 33.18 1ng3 s ARG 250 CO 0.06 0.06 1.30 1.63 0.02 0.00 0.00 175.30 178.37 1ng3 n LYS 251 N -1.87 0.04 0.08 3.54 5.02 -1.26 -1.96 118.16 121.74 1ng3 n LYS 251 Ca -0.03 0.29 0.13 0.00 -2.02 0.00 0.00 58.31 56.68 1ng3 n LYS 251 Cb 0.56 -1.50 0.29 0.00 -0.02 0.00 0.00 35.03 34.36 1ng3 n LYS 251 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1ng3 n SER 252 N -1.45 0.73 0.00 4.39 3.41 -1.26 -4.90 113.62 114.54 1ng3 n SER 252 Ca 0.03 0.33 0.00 0.00 -0.26 0.00 0.00 58.87 58.97 1ng3 n SER 252 Cb 0.11 -0.29 0.00 0.00 -0.26 0.00 0.00 64.21 63.77 1ng3 n SER 252 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ng3 n GLY 253 N 1.33 0.69 3.90 5.00 0.00 -0.83 -5.03 105.19 110.25 1ng3 n GLY 253 Ca 0.04 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.78 1ng3 n GLY 253 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ng3 s ARG 254 N -0.81 3.64 -0.15 1.61 0.52 -1.26 -0.39 118.95 122.12 1ng3 s ARG 254 Ca 0.00 0.11 0.01 0.00 -0.52 0.00 0.00 55.73 55.32 1ng3 s ARG 254 Cb 0.00 -2.55 -0.00 0.00 0.52 0.00 0.00 34.95 32.91 1ng3 s ARG 254 CO 0.00 0.10 -0.16 -0.51 0.02 0.00 0.00 175.30 174.75 1ng3 s LEU 255 N -3.85 2.44 -0.24 2.53 1.43 0.04 -0.44 118.68 120.60 1ng3 s LEU 255 Ca 0.46 -0.48 -0.13 0.00 -1.03 0.00 0.00 54.13 52.95 1ng3 s LEU 255 Cb -0.10 -1.55 -0.04 0.00 0.03 0.00 0.00 46.19 44.52 1ng3 s LEU 255 CO 0.33 0.09 0.29 -0.69 0.23 0.00 0.00 176.35 176.60 1ng3 s VAL 256 N 0.76 5.26 0.21 -1.59 1.01 0.05 -1.76 120.40 124.35 1ng3 s VAL 256 Ca -0.06 0.45 0.11 0.00 0.00 0.00 0.00 61.98 62.47 1ng3 s VAL 256 Cb -0.15 -3.63 -0.04 0.00 0.00 0.00 0.00 36.38 32.55 1ng3 s VAL 256 CO 0.01 0.26 -0.18 -0.69 0.00 0.00 0.00 175.10 174.50 1ng3 s VAL 257 N 1.42 2.64 -5.00 2.92 1.01 0.03 -1.08 120.40 122.33 1ng3 s VAL 257 Ca 0.13 -2.03 0.00 0.00 0.00 0.00 0.00 61.98 60.08 1ng3 s VAL 257 Cb -0.15 -2.31 0.00 0.00 0.00 0.00 0.00 36.38 33.92 1ng3 s VAL 257 CO 0.07 -0.20 0.00 0.61 0.00 0.00 0.00 175.10 175.59 1ng3 n GLY 258 N -0.06 0.47 1.55 4.51 0.00 -0.67 -2.92 105.19 108.07 1ng3 n GLY 258 Ca -0.10 -1.56 0.00 0.00 0.00 0.00 0.00 46.02 44.36 1ng3 n GLY 258 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ng3 n ALA 259 N -0.69 -2.39 -2.28 4.61 0.00 -1.00 -3.08 120.51 115.67 1ng3 n ALA 259 Ca 0.00 0.30 -0.21 0.00 0.00 0.00 0.00 53.44 53.53 1ng3 n ALA 259 Cb 0.00 -1.08 0.01 0.00 0.00 0.00 0.00 19.45 18.38 1ng3 n ALA 259 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1ng3 s THR 260 N -0.33 3.75 -0.33 0.00 -4.23 -1.19 -4.80 115.64 108.50 1ng3 s THR 260 Ca 0.00 -0.67 0.00 0.00 -1.18 0.00 0.00 61.69 59.84 1ng3 s THR 260 Cb 0.00 -3.36 0.10 0.00 1.34 0.00 0.00 72.50 70.59 1ng3 s THR 260 CO 0.00 -0.22 0.11 -0.32 -0.54 0.00 0.00 174.62 173.65 1ng3 s MET 261 N -4.49 0.86 -0.50 3.99 1.75 -1.25 -4.10 119.30 115.56 1ng3 s MET 261 Ca 0.49 -1.27 0.03 0.00 -1.25 0.00 0.00 55.69 53.69 1ng3 s MET 261 Cb -0.10 -2.16 0.13 0.00 2.84 0.00 0.00 34.83 35.54 1ng3 s MET 261 CO 0.36 -1.00 0.25 0.15 -0.65 0.00 0.00 175.02 174.13 1ng3 s LYS 262 N 1.39 1.97 0.29 4.11 1.02 0.09 -4.94 119.74 123.67 1ng3 s LYS 262 Ca 0.11 -2.50 -0.29 0.00 0.02 0.00 0.00 55.97 53.31 1ng3 s LYS 262 Cb -0.18 -3.35 -0.10 0.00 -0.52 0.00 0.00 37.83 33.67 1ng3 s LYS 262 CO -0.20 -1.09 1.44 -2.14 -0.92 0.00 0.00 175.35 172.44 1ng3 s PRO 263 N -0.08 4.24 0.00 -1.68 0.02 -1.26 -0.82 135.00 135.42 1ng3 s PRO 263 Ca 0.16 2.37 0.00 0.00 0.02 0.00 0.00 61.00 63.55 1ng3 s PRO 263 Cb -0.24 -3.07 0.00 0.00 0.02 0.00 0.00 34.50 31.21 1ng3 s PRO 263 CO -0.02 -0.42 0.00 0.41 -0.33 0.00 0.00 177.00 176.64 1ng3 n GLY 264 N 1.65 0.56 3.54 0.52 0.00 0.19 -4.93 105.19 106.72 1ng3 n GLY 264 Ca 0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 1ng3 n GLY 264 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ng3 s ASP 265 N -2.27 6.13 0.00 1.61 -1.08 -1.20 -4.93 116.67 114.93 1ng3 s ASP 265 Ca 0.00 -0.30 0.26 0.00 -0.52 0.00 0.00 52.55 51.99 1ng3 s ASP 265 Cb 0.00 -2.17 0.83 0.00 -1.46 0.00 0.00 42.92 40.12 1ng3 s ASP 265 CO 0.00 -0.29 1.62 0.79 0.52 0.00 0.00 175.17 177.81 1ng3 n TRP 266 N 5.26 0.06 -2.48 -5.34 7.02 -1.26 -4.20 117.44 116.50 1ng3 n TRP 266 Ca -0.11 -0.03 -0.39 0.00 -1.02 0.00 0.00 57.50 55.95 1ng3 n TRP 266 Cb 0.50 0.00 -0.04 0.00 -2.42 0.00 0.00 31.31 29.34 1ng3 n TRP 266 CO 0.00 0.00 0.00 -1.54 -2.02 0.00 0.00 177.69 174.13 1ng3 s SER 267 N -1.89 7.12 -0.18 -0.99 1.04 -1.26 -4.97 113.70 112.57 1ng3 s SER 267 Ca 0.35 2.22 0.16 0.00 0.48 0.00 0.00 55.95 59.16 1ng3 s SER 267 Cb 0.20 -2.62 0.60 0.00 0.10 0.00 0.00 66.02 64.30 1ng3 s SER 267 CO 0.31 -0.25 1.50 -0.62 0.98 0.00 0.00 173.24 175.17 1ng3 n GLU 268 N 0.85 3.46 -4.93 4.02 1.02 -1.26 -4.85 120.64 118.95 1ng3 n GLU 268 Ca 0.01 -2.87 -0.26 0.00 -0.02 0.00 0.00 57.16 54.02 1ng3 n GLU 268 Cb 0.46 -1.91 -0.15 0.00 -0.02 0.00 0.00 31.44 29.81 1ng3 n GLU 268 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1ng3 s THR 269 N -2.62 1.51 0.54 2.62 -4.23 -1.26 -3.77 115.64 108.42 1ng3 s THR 269 Ca 0.44 -0.82 -0.22 0.00 -1.18 0.00 0.00 61.69 59.92 1ng3 s THR 269 Cb 0.34 -1.25 -0.05 0.00 1.34 0.00 0.00 72.50 72.88 1ng3 s THR 269 CO 0.12 0.42 1.32 -2.84 -0.54 0.00 0.00 174.62 173.10 1ng3 s PRO 270 N -0.45 3.19 0.31 3.99 0.02 -1.26 -4.92 135.00 135.88 1ng3 s PRO 270 Ca 0.07 2.14 0.08 0.00 0.02 0.00 0.00 61.00 63.31 1ng3 s PRO 270 Cb -0.07 -2.24 -0.03 0.00 0.02 0.00 0.00 34.50 32.17 1ng3 s PRO 270 CO -0.01 -1.12 0.23 0.16 -0.33 0.00 0.00 177.00 175.94 1ng3 s ASP 271 N -1.07 5.26 0.20 2.53 -4.77 -1.26 -5.01 116.67 112.55 1ng3 s ASP 271 Ca 0.71 -0.46 -0.10 0.00 -3.30 0.00 0.00 52.55 49.40 1ng3 s ASP 271 Cb -0.38 -1.07 0.24 0.00 -1.09 0.00 0.00 42.92 40.62 1ng3 s ASP 271 CO 0.45 -0.23 1.78 0.25 0.70 0.00 0.00 175.17 178.12 1ng3 h LEU 272 N 1.39 0.43 -0.76 2.11 6.46 -2.00 -2.47 115.31 120.47 1ng3 h LEU 272 Ca -0.46 0.04 -0.01 0.00 -0.12 0.00 0.00 57.88 57.34 1ng3 h LEU 272 Cb 1.25 -0.03 -0.04 0.00 -0.73 0.00 0.00 40.66 41.11 1ng3 h LEU 272 CO 0.60 0.27 0.43 1.23 -0.62 0.00 0.00 178.44 180.35 1ng3 h GLY 273 N 0.57 1.11 1.05 3.75 0.00 -1.99 -1.88 103.07 105.67 1ng3 h GLY 273 Ca 0.29 -0.49 -0.07 0.00 0.00 0.00 0.00 47.33 47.06 1ng3 h GLY 273 CO -0.21 0.47 0.12 -1.33 0.00 0.00 0.00 176.54 175.59 1ng3 h GLY 274 N 1.04 1.13 1.16 4.60 0.00 -1.89 -1.98 103.07 107.13 1ng3 h GLY 274 Ca 0.27 -0.74 -0.14 0.00 0.00 0.00 0.00 47.33 46.72 1ng3 h GLY 274 CO -0.05 0.68 -0.29 1.41 0.00 0.00 0.00 176.54 178.29 1ng3 h LEU 275 N 0.97 0.98 -0.84 3.11 3.38 -1.27 -1.56 115.31 120.08 1ng3 h LEU 275 Ca 0.20 -0.40 -0.00 0.00 0.09 0.00 0.00 57.88 57.76 1ng3 h LEU 275 Cb 0.41 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.84 1ng3 h LEU 275 CO 0.01 1.19 0.51 -0.08 0.09 0.00 0.00 178.44 180.16 1ng3 h GLU 276 N 0.79 1.13 -0.33 1.13 4.81 -1.26 -0.63 114.58 120.23 1ng3 h GLU 276 Ca 0.09 -0.10 0.01 0.00 -0.13 0.00 0.00 59.36 59.23 1ng3 h GLU 276 Cb 0.87 -0.24 -0.02 0.00 0.63 0.00 0.00 28.75 29.99 1ng3 h GLU 276 CO 0.08 0.79 0.20 1.03 -0.73 0.00 0.00 179.01 180.38 1ng3 h SER 277 N 1.15 0.34 -0.36 1.04 0.87 -1.08 -1.09 113.55 114.42 1ng3 h SER 277 Ca 0.30 -0.00 -0.04 0.00 -1.23 0.00 0.00 61.79 60.82 1ng3 h SER 277 Cb -0.05 -0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 61.81 1ng3 h SER 277 CO -0.06 0.25 0.07 0.58 -0.53 0.00 0.00 176.83 177.15 1ng3 h VAL 278 N 0.42 1.23 -0.27 2.23 2.07 -0.83 -2.02 116.25 119.07 1ng3 h VAL 278 Ca 0.12 -0.79 0.04 0.00 0.82 0.00 0.00 66.70 66.89 1ng3 h VAL 278 Cb -0.02 1.07 -0.04 0.00 -1.52 0.00 0.00 31.29 30.77 1ng3 h VAL 278 CO -0.04 0.27 0.04 0.24 0.02 0.00 0.00 177.57 178.09 1ng3 h MET 279 N 0.42 0.13 -0.55 1.57 2.07 -0.94 -1.36 114.93 116.28 1ng3 h MET 279 Ca 0.11 -0.01 0.07 0.00 -2.07 0.00 0.00 59.70 57.80 1ng3 h MET 279 Cb 0.32 -0.03 -0.06 0.00 -1.87 0.00 0.00 31.60 29.97 1ng3 h MET 279 CO 0.00 0.09 0.23 -0.22 1.07 0.00 0.00 176.91 178.08 1ng3 h LYS 280 N 0.14 0.43 0.47 1.72 3.64 -1.05 -2.05 116.57 119.87 1ng3 h LYS 280 Ca 0.13 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.46 1ng3 h LYS 280 Cb 0.14 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.87 1ng3 h LYS 280 CO -0.18 0.28 -0.23 -0.22 -2.27 0.00 0.00 179.45 176.84 1ng3 h LYS 281 N 0.44 -0.61 -0.92 1.90 1.63 -0.91 -3.00 116.57 115.09 1ng3 h LYS 281 Ca 0.26 0.04 0.22 0.00 -0.85 0.00 0.00 60.65 60.32 1ng3 h LYS 281 Cb 0.25 0.14 -0.12 0.00 -0.60 0.00 0.00 32.23 31.90 1ng3 h LYS 281 CO -0.23 -0.37 0.47 0.00 -3.45 0.00 0.00 179.45 175.87 1ng3 h ALA 282 N -0.23 1.52 -0.43 5.00 0.00 -1.07 0.01 119.26 124.07 1ng3 h ALA 282 Ca -0.07 0.14 0.01 0.00 0.00 0.00 0.00 54.91 54.99 1ng3 h ALA 282 Cb 0.53 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 1ng3 h ALA 282 CO 0.11 -0.27 0.28 0.87 0.00 0.00 0.00 179.25 180.24 1ng3 h LYS 283 N 0.50 0.54 0.00 0.00 1.57 -1.24 0.22 116.57 118.16 1ng3 h LYS 283 Ca 0.57 -0.03 -0.10 0.00 -1.87 0.00 0.00 60.65 59.21 1ng3 h LYS 283 Cb 1.04 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 33.21 1ng3 h LYS 283 CO -0.48 0.36 -0.50 1.79 -0.57 0.00 0.00 179.45 180.04 1ng3 h THR 284 N 0.56 1.23 0.08 -0.16 1.35 -0.92 -2.68 112.91 112.37 1ng3 h THR 284 Ca 0.16 -1.79 -0.32 0.00 -0.55 0.00 0.00 66.41 63.91 1ng3 h THR 284 Cb -0.03 2.00 -0.02 0.00 -1.73 0.00 0.00 68.15 68.37 1ng3 h THR 284 CO -0.04 0.49 -1.72 0.24 -0.25 0.00 0.00 175.52 174.24 1ng3 h MET 285 N 0.00 0.18 -2.17 4.72 2.86 -1.09 -3.42 114.93 116.00 1ng3 h MET 285 Ca -0.00 -0.30 -0.53 0.00 -2.06 0.00 0.00 59.70 56.80 1ng3 h MET 285 Cb 0.96 0.11 -0.35 0.00 0.06 0.00 0.00 31.60 32.38 1ng3 h MET 285 CO 0.06 0.96 -0.91 -1.17 1.06 0.00 0.00 176.91 176.92 1ng3 s LEU 286 N -6.74 0.99 0.26 1.22 2.96 0.68 -1.51 118.68 116.55 1ng3 s LEU 286 Ca -0.12 -2.88 -0.01 0.00 -0.22 0.00 0.00 54.13 50.91 1ng3 s LEU 286 Cb 0.07 -0.11 0.59 0.00 0.50 0.00 0.00 46.19 47.25 1ng3 s LEU 286 CO 0.82 -0.15 1.35 -2.65 -1.32 0.00 0.00 176.35 174.40 1ng3 n PRO 287 N 2.86 -0.07 0.32 0.98 -0.02 -1.01 -0.85 135.00 137.21 1ng3 n PRO 287 Ca 0.28 1.31 0.20 0.00 -2.02 0.00 0.00 63.50 63.27 1ng3 n PRO 287 Cb 0.49 -2.05 1.09 0.00 -0.02 0.00 0.00 33.50 33.02 1ng3 n PRO 287 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1ng3 h PRO 288 N 0.00 0.00 0.00 0.52 0.11 -1.88 -2.44 132.00 128.31 1ng3 h PRO 288 Ca 0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.61 1ng3 h PRO 288 Cb 0.96 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.07 1ng3 h PRO 288 CO -0.83 0.00 0.09 0.97 -0.21 0.00 0.00 178.00 178.02 1ng3 h ILE 289 N 0.00 0.00 0.00 4.15 2.10 -1.35 -0.90 117.51 121.51 1ng3 h ILE 289 Ca 0.00 0.00 -0.03 0.00 1.08 0.00 0.00 64.86 65.92 1ng3 h ILE 289 Cb 0.05 0.74 -0.00 0.00 -1.09 0.00 0.00 36.82 36.52 1ng3 h ILE 289 CO -0.00 0.00 -0.12 -0.61 -1.08 0.00 0.00 178.15 176.34 1ng3 h GLN 290 N 0.00 0.00 -0.45 2.19 4.15 -1.63 -2.49 115.11 116.87 1ng3 h GLN 290 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 1ng3 h GLN 290 Cb 0.19 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.88 1ng3 h GLN 290 CO 0.00 0.12 0.00 0.09 -1.93 0.00 0.00 178.83 177.11 1ng3 n ASN 291 N -3.98 3.54 -4.83 -0.69 3.02 -0.34 -4.96 115.26 107.02 1ng3 n ASN 291 Ca -0.02 -1.99 -0.34 0.00 -0.03 0.00 0.00 54.58 52.20 1ng3 n ASN 291 Cb 0.21 -0.29 -0.06 0.00 -0.61 0.00 0.00 39.78 39.03 1ng3 n ASN 291 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1ng3 s MET 292 N -1.37 4.16 0.06 3.52 -1.94 -0.94 -5.03 119.30 117.77 1ng3 s MET 292 Ca 0.40 0.83 -0.30 0.00 -1.71 0.00 0.00 55.69 54.90 1ng3 s MET 292 Cb 0.23 -2.63 -0.06 0.00 2.01 0.00 0.00 34.83 34.39 1ng3 s MET 292 CO 0.31 0.25 1.17 0.15 -0.01 0.00 0.00 175.02 176.90 1ng3 s LYS 293 N -2.51 4.45 0.22 2.03 -0.14 -1.26 -4.88 119.74 117.65 1ng3 s LYS 293 Ca 0.50 1.74 -0.30 0.00 -1.36 0.00 0.00 55.97 56.55 1ng3 s LYS 293 Cb -0.13 -3.35 -0.09 0.00 -1.68 0.00 0.00 37.83 32.58 1ng3 s LYS 293 CO 0.19 -0.22 1.26 0.08 -0.76 0.00 0.00 175.35 175.90 1ng3 s VAL 294 N 0.96 3.27 0.00 3.17 1.01 -1.26 -1.79 120.40 125.76 1ng3 s VAL 294 Ca 0.57 1.09 0.00 0.00 0.00 0.00 0.00 61.98 63.64 1ng3 s VAL 294 Cb -0.29 -3.70 0.00 0.00 0.00 0.00 0.00 36.38 32.40 1ng3 s VAL 294 CO 0.30 0.18 0.00 -0.67 0.00 0.00 0.00 175.10 174.91 1ng3 n ASP 295 N 2.27 0.00 -4.27 3.32 4.64 0.77 -4.90 116.55 118.38 1ng3 n ASP 295 Ca 0.04 0.00 -0.15 0.00 -1.38 0.00 0.00 54.79 53.31 1ng3 n ASP 295 Cb 0.43 -0.14 -0.10 0.00 -1.04 0.00 0.00 41.12 40.27 1ng3 n ASP 295 CO 0.00 0.00 0.00 -0.13 -0.82 0.00 0.00 177.20 176.25 1ng3 s ARG 296 N -0.27 1.31 0.02 -0.67 0.52 -1.22 -4.96 118.95 113.67 1ng3 s ARG 296 Ca 0.00 -1.69 0.01 0.00 -0.52 0.00 0.00 55.73 53.52 1ng3 s ARG 296 Cb 0.00 -0.07 -0.02 0.00 0.52 0.00 0.00 34.95 35.38 1ng3 s ARG 296 CO 0.00 -0.31 -0.04 -0.59 0.02 0.00 0.00 175.30 174.37 1ng3 s PHE 297 N -3.89 0.38 0.24 -0.53 -0.12 -1.26 -0.55 117.98 112.24 1ng3 s PHE 297 Ca 0.37 -0.43 -0.18 0.00 -0.05 0.00 0.00 56.93 56.63 1ng3 s PHE 297 Cb 0.07 -0.24 0.07 0.00 -0.63 0.00 0.00 43.02 42.29 1ng3 s PHE 297 CO 0.12 -0.12 0.90 -2.67 -0.05 0.00 0.00 175.22 173.39 1ng3 n TRP 298 N 1.81 -1.62 -3.95 3.49 2.14 -0.65 -4.93 117.44 113.73 1ng3 n TRP 298 Ca -0.22 -1.37 -0.09 0.00 2.07 0.00 0.00 57.50 57.90 1ng3 n TRP 298 Cb 0.56 0.67 -0.05 0.00 -0.81 0.00 0.00 31.31 31.68 1ng3 n TRP 298 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1ng3 s ALA 299 N -1.99 -0.41 0.14 -1.67 0.00 -1.25 -0.97 121.76 115.62 1ng3 s ALA 299 Ca 0.19 -0.74 -0.18 0.00 0.00 0.00 0.00 51.96 51.24 1ng3 s ALA 299 Cb -0.03 1.00 0.04 0.00 0.00 0.00 0.00 23.12 24.13 1ng3 s ALA 299 CO 0.07 -0.85 0.46 0.20 0.00 0.00 0.00 175.76 175.64 1ng3 s GLY 300 N -2.99 -0.31 -0.46 0.00 0.00 -0.36 -4.75 107.32 98.46 1ng3 s GLY 300 Ca 0.19 0.03 -0.10 0.00 0.00 0.00 0.00 44.72 44.84 1ng3 s GLY 300 CO 0.07 -0.21 0.33 1.08 0.00 0.00 0.00 173.10 174.37 1ng3 s LEU 301 N -2.80 5.55 0.22 0.66 1.43 -1.26 -0.72 118.68 121.75 1ng3 s LEU 301 Ca 0.04 -1.71 -0.30 0.00 -1.03 0.00 0.00 54.13 51.12 1ng3 s LEU 301 Cb 0.01 -2.03 -0.10 0.00 0.03 0.00 0.00 46.19 44.10 1ng3 s LEU 301 CO -0.11 -0.65 1.46 -0.13 0.23 0.00 0.00 176.35 177.15 1ng3 s ARG 302 N 1.43 4.26 -0.73 1.70 0.52 -0.39 -4.75 118.95 120.99 1ng3 s ARG 302 Ca 0.04 2.29 -0.26 0.00 -0.52 0.00 0.00 55.73 57.29 1ng3 s ARG 302 Cb -0.25 -3.13 0.04 0.00 0.52 0.00 0.00 34.95 32.13 1ng3 s ARG 302 CO 0.01 -0.45 1.21 -1.25 0.02 0.00 0.00 175.30 174.84 1ng3 s PRO 303 N 0.00 3.18 0.01 3.54 0.04 -1.26 -1.14 135.00 139.37 1ng3 s PRO 303 Ca 0.61 -0.41 -0.19 0.00 0.04 0.00 0.00 61.00 61.05 1ng3 s PRO 303 Cb -0.42 -4.22 -0.06 0.00 0.04 0.00 0.00 34.50 29.85 1ng3 s PRO 303 CO 0.40 -2.07 0.55 0.20 0.04 0.00 0.00 177.00 176.12 1ng3 s GLY 304 N 3.75 2.60 0.37 0.56 0.00 0.81 -3.53 107.32 111.88 1ng3 s GLY 304 Ca 0.32 -0.02 0.08 0.00 0.00 0.00 0.00 44.72 45.10 1ng3 s GLY 304 CO 0.13 0.57 0.16 -0.51 0.00 0.00 0.00 173.10 173.46 1ng3 s THR 305 N -0.56 2.73 0.42 0.90 -4.23 -1.26 0.08 115.64 113.73 1ng3 s THR 305 Ca 0.29 -1.69 0.22 0.00 -1.18 0.00 0.00 61.69 59.33 1ng3 s THR 305 Cb -0.18 -2.97 0.42 0.00 1.34 0.00 0.00 72.50 71.11 1ng3 s THR 305 CO 0.17 -0.11 1.75 0.07 -0.54 0.00 0.00 174.62 175.96 1ng3 h LYS 306 N 1.49 0.29 -0.27 3.99 2.10 -1.91 -0.66 116.57 121.60 1ng3 h LYS 306 Ca -0.43 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.20 1ng3 h LYS 306 Cb 1.25 -0.07 0.00 0.00 -0.90 0.00 0.00 32.23 32.52 1ng3 h LYS 306 CO 0.65 0.19 0.00 -0.40 -2.00 0.00 0.00 179.45 177.89 1ng3 n ASP 307 N -4.59 2.80 -1.32 7.07 3.85 -1.26 -4.97 116.55 118.13 1ng3 n ASP 307 Ca 0.27 -2.07 -0.15 0.00 -0.71 0.00 0.00 54.79 52.13 1ng3 n ASP 307 Cb 1.01 -0.21 -0.05 0.00 -1.35 0.00 0.00 41.12 40.52 1ng3 n ASP 307 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1ng3 n GLY 308 N 0.24 0.98 3.29 6.12 0.00 -0.26 -5.00 105.19 110.57 1ng3 n GLY 308 Ca 0.10 -0.30 -0.26 0.00 0.00 0.00 0.00 46.02 45.56 1ng3 n GLY 308 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ng3 s LYS 309 N -3.73 1.40 0.72 1.61 -0.14 -1.26 -4.55 119.74 113.79 1ng3 s LYS 309 Ca 0.00 -1.07 -0.13 0.00 -1.36 0.00 0.00 55.97 53.40 1ng3 s LYS 309 Cb 0.00 -1.61 0.03 0.00 -1.68 0.00 0.00 37.83 34.57 1ng3 s LYS 309 CO 0.00 0.40 1.12 -2.14 -0.76 0.00 0.00 175.35 173.97 1ng3 s PRO 310 N -1.46 2.41 -0.44 -1.68 0.02 -1.11 -4.69 135.00 128.05 1ng3 s PRO 310 Ca 0.09 1.39 -0.07 0.00 0.02 0.00 0.00 61.00 62.43 1ng3 s PRO 310 Cb -0.09 -1.90 0.11 0.00 0.02 0.00 0.00 34.50 32.63 1ng3 s PRO 310 CO 0.03 -1.55 0.28 0.71 -0.33 0.00 0.00 177.00 176.14 1ng3 s TYR 311 N -2.48 3.46 -0.26 6.54 2.02 -0.11 -4.67 117.35 121.85 1ng3 s TYR 311 Ca 0.66 -1.99 0.02 0.00 -0.37 0.00 0.00 57.07 55.39 1ng3 s TYR 311 Cb -0.21 -3.30 0.07 0.00 -0.40 0.00 0.00 41.96 38.12 1ng3 s TYR 311 CO 0.48 -0.96 -0.05 0.42 -1.57 0.00 0.00 175.55 173.86 1ng3 s ILE 312 N 1.30 1.80 -5.00 2.71 1.01 -0.83 -2.39 121.20 119.79 1ng3 s ILE 312 Ca 0.06 -1.51 0.00 0.00 0.00 0.00 0.00 60.65 59.20 1ng3 s ILE 312 Cb -0.25 -2.06 0.00 0.00 0.01 0.00 0.00 42.46 40.16 1ng3 s ILE 312 CO -0.01 -0.17 0.00 0.61 0.00 0.00 0.00 174.94 175.37 1ng3 n GLY 313 N 4.55 -1.39 3.83 6.18 0.00 -0.48 -4.50 105.19 113.38 1ng3 n GLY 313 Ca -0.10 -1.32 -0.31 0.00 0.00 0.00 0.00 46.02 44.28 1ng3 n GLY 313 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ng3 s ARG 314 N -1.98 3.27 0.03 1.61 0.52 -1.26 -0.03 118.95 121.10 1ng3 s ARG 314 Ca 0.00 0.93 -0.30 0.00 -0.52 0.00 0.00 55.73 55.84 1ng3 s ARG 314 Cb 0.00 -2.03 -0.06 0.00 0.52 0.00 0.00 34.95 33.38 1ng3 s ARG 314 CO 0.00 -0.84 1.34 -1.58 0.02 0.00 0.00 175.30 174.24 1ng3 s HIS 315 N -2.96 3.08 0.50 -0.53 5.65 0.13 -4.67 115.29 116.49 1ng3 s HIS 315 Ca 0.58 0.98 0.37 0.00 0.25 0.00 0.00 55.06 57.24 1ng3 s HIS 315 Cb -0.13 -3.59 1.52 0.00 -1.18 0.00 0.00 32.58 29.20 1ng3 s HIS 315 CO 0.50 -2.07 1.68 -1.35 -0.65 0.00 0.00 174.74 172.84 1ng3 h PRO 316 N 7.39 0.07 -0.29 2.88 0.11 -1.94 -0.83 132.00 139.39 1ng3 h PRO 316 Ca -0.39 -0.00 -0.20 0.00 0.11 0.00 0.00 66.00 65.52 1ng3 h PRO 316 Cb 1.19 -0.02 -0.15 0.00 0.11 0.00 0.00 31.00 32.14 1ng3 h PRO 316 CO 0.88 0.05 -0.52 0.39 -0.21 0.00 0.00 178.00 178.58 1ng3 n GLU 317 N -4.32 2.25 0.00 1.05 1.02 -1.26 -4.92 120.64 114.46 1ng3 n GLU 317 Ca 0.35 -3.56 0.00 0.00 -0.02 0.00 0.00 57.16 53.93 1ng3 n GLU 317 Cb 1.49 -1.85 0.00 0.00 -0.02 0.00 0.00 31.44 31.05 1ng3 n GLU 317 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1ng3 n ASP 318 N -0.99 0.00 0.00 1.62 4.64 -0.32 -5.03 116.55 116.47 1ng3 n ASP 318 Ca 0.29 0.00 0.05 0.00 -1.38 0.00 0.00 54.79 53.75 1ng3 n ASP 318 Cb 0.81 0.00 0.32 0.00 -1.04 0.00 0.00 41.12 41.22 1ng3 n ASP 318 CO 0.00 0.00 0.00 -1.54 -0.82 0.00 0.00 177.20 174.84 1ng3 n SER 319 N 0.00 0.00 0.12 1.67 3.41 -1.26 -2.41 113.62 115.16 1ng3 n SER 319 Ca 0.00 -0.89 0.09 0.00 -0.26 0.00 0.00 58.87 57.81 1ng3 n SER 319 Cb 0.00 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 63.98 1ng3 n SER 319 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 1ng3 h ARG 320 N 0.00 0.00 -5.12 4.33 3.08 -1.91 -3.45 114.38 111.31 1ng3 h ARG 320 Ca 0.00 0.00 -0.64 0.00 0.07 0.00 0.00 59.98 59.41 1ng3 h ARG 320 Cb 0.00 0.00 -0.21 0.00 0.08 0.00 0.00 29.97 29.84 1ng3 h ARG 320 CO 0.00 0.11 -0.62 0.42 -1.07 0.00 0.00 179.97 178.81 1ng3 s ILE 321 N -3.20 4.28 0.24 2.04 1.01 -1.01 -1.26 121.20 123.30 1ng3 s ILE 321 Ca 0.01 -0.20 0.10 0.00 0.00 0.00 0.00 60.65 60.57 1ng3 s ILE 321 Cb 0.08 -2.95 -0.05 0.00 0.01 0.00 0.00 42.46 39.55 1ng3 s ILE 321 CO 0.76 0.41 -0.18 -0.76 0.00 0.00 0.00 174.94 175.17 1ng3 s LEU 322 N 0.97 2.57 0.12 2.97 1.02 0.11 0.22 118.68 126.65 1ng3 s LEU 322 Ca 0.03 -1.01 0.07 0.00 0.02 0.00 0.00 54.13 53.24 1ng3 s LEU 322 Cb -0.14 -0.91 -0.04 0.00 0.02 0.00 0.00 46.19 45.12 1ng3 s LEU 322 CO 0.02 -0.05 -0.18 -0.36 0.02 0.00 0.00 176.35 175.80 1ng3 s PHE 323 N -2.66 1.64 -0.47 0.29 0.08 0.96 -0.62 117.98 117.19 1ng3 s PHE 323 Ca 0.26 -0.46 0.06 0.00 0.12 0.00 0.00 56.93 56.91 1ng3 s PHE 323 Cb -0.03 -0.87 0.26 0.00 -0.57 0.00 0.00 43.02 41.81 1ng3 s PHE 323 CO 0.11 0.20 0.88 0.00 -0.10 0.00 0.00 175.22 176.32 1ng3 n ALA 324 N 0.83 -0.67 -2.49 5.36 0.00 -0.25 -1.38 120.51 121.91 1ng3 n ALA 324 Ca -0.18 -1.74 -0.08 0.00 0.00 0.00 0.00 53.44 51.44 1ng3 n ALA 324 Cb 0.55 -1.22 -0.10 0.00 0.00 0.00 0.00 19.45 18.68 1ng3 n ALA 324 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ng3 s ALA 325 N 0.25 0.18 0.00 0.00 0.00 -1.01 -4.59 121.76 116.60 1ng3 s ALA 325 Ca 0.31 -0.83 0.00 0.00 0.00 0.00 0.00 51.96 51.44 1ng3 s ALA 325 Cb 0.24 0.27 0.00 0.00 0.00 0.00 0.00 23.12 23.63 1ng3 s ALA 325 CO -0.18 -0.34 0.00 0.41 0.00 0.00 0.00 175.76 175.65 1ng3 n GLY 326 N 0.53 1.55 3.50 0.00 0.00 -1.26 -0.94 105.19 108.58 1ng3 n GLY 326 Ca -0.17 -0.12 -0.43 0.00 0.00 0.00 0.00 46.02 45.30 1ng3 n GLY 326 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1ng3 s HIS 327 N -2.04 2.89 0.00 1.61 3.76 -1.25 -2.74 115.29 117.53 1ng3 s HIS 327 Ca 0.00 -1.23 0.00 0.00 -0.15 0.00 0.00 55.06 53.68 1ng3 s HIS 327 Cb 0.00 -4.47 0.00 0.00 1.11 0.00 0.00 32.58 29.22 1ng3 s HIS 327 CO 0.00 -1.68 0.71 0.34 -0.85 0.00 0.00 174.74 173.26 1ng3 n PHE 328 N 7.51 0.00 -0.04 1.40 7.35 -1.23 -3.72 117.46 128.73 1ng3 n PHE 328 Ca 0.30 0.00 0.03 0.00 -0.76 0.00 0.00 57.45 57.02 1ng3 n PHE 328 Cb 0.49 -0.21 0.07 0.00 0.35 0.00 0.00 39.48 40.19 1ng3 n PHE 328 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 1ng3 n ARG 329 N -1.72 2.42 -0.49 -4.13 1.74 -1.26 -4.37 116.66 108.86 1ng3 n ARG 329 Ca 0.00 -1.64 0.06 0.00 -0.77 0.00 0.00 57.85 55.50 1ng3 n ARG 329 Cb 0.00 -1.14 0.11 0.00 -1.02 0.00 0.00 32.46 30.41 1ng3 n ARG 329 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 1ng3 n ASN 330 N 0.09 1.51 -0.34 0.55 0.23 -1.25 -4.85 115.26 111.20 1ng3 n ASN 330 Ca 0.06 -2.92 0.06 0.00 -0.53 0.00 0.00 54.58 51.24 1ng3 n ASN 330 Cb 0.31 -0.39 0.22 0.00 -2.08 0.00 0.00 39.78 37.84 1ng3 n ASN 330 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 1ng3 h GLY 331 N 0.39 1.54 0.64 4.83 0.00 -1.85 -0.61 103.07 108.00 1ng3 h GLY 331 Ca -0.03 -0.39 -0.02 0.00 0.00 0.00 0.00 47.33 46.89 1ng3 h GLY 331 CO 0.01 0.15 -0.15 -2.22 0.00 0.00 0.00 176.54 174.33 1ng3 h ILE 332 N 0.93 0.65 -0.34 2.60 1.08 -1.90 -2.45 117.51 118.08 1ng3 h ILE 332 Ca 0.47 -0.62 0.08 0.00 -0.39 0.00 0.00 64.86 64.39 1ng3 h ILE 332 Cb 0.46 0.94 -0.08 0.00 -3.07 0.00 0.00 36.82 35.07 1ng3 h ILE 332 CO -0.26 0.11 -0.22 0.25 -0.69 0.00 0.00 178.15 177.34 1ng3 h LEU 333 N -0.80 -0.74 0.00 1.44 5.85 -1.70 -2.01 115.31 117.34 1ng3 h LEU 333 Ca -0.04 0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.83 1ng3 h LEU 333 Cb 0.52 0.37 0.00 0.00 0.37 0.00 0.00 40.66 41.92 1ng3 h LEU 333 CO 0.07 -0.25 0.00 0.18 -0.34 0.00 0.00 178.44 178.10 1ng3 n LEU 334 N -5.38 0.00 0.07 2.25 4.32 -0.26 -4.24 117.00 113.76 1ng3 n LEU 334 Ca 0.01 0.00 -0.11 0.00 -0.02 0.00 0.00 56.01 55.89 1ng3 n LEU 334 Cb 0.29 0.00 -0.05 0.00 -1.62 0.00 0.00 43.42 42.04 1ng3 n LEU 334 CO 0.12 0.00 0.72 0.00 -1.22 0.00 0.00 177.39 177.01 1ng3 h ALA 335 N 3.47 -0.30 -0.12 -1.18 0.00 -0.85 0.34 119.26 120.62 1ng3 h ALA 335 Ca 0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1ng3 h ALA 335 Cb 0.00 0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1ng3 h ALA 335 CO 0.00 -0.72 0.07 -1.35 0.00 0.00 0.00 179.25 177.25 1ng3 h PRO 336 N -0.36 0.16 -0.54 0.00 0.11 -1.80 -1.29 132.00 128.29 1ng3 h PRO 336 Ca 0.05 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 66.07 1ng3 h PRO 336 Cb 0.42 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 31.48 1ng3 h PRO 336 CO -0.18 0.16 0.02 0.00 -0.21 0.00 0.00 178.00 177.79 1ng3 h ALA 337 N 1.00 1.02 -0.47 -0.75 0.00 -1.82 -1.05 119.26 117.19 1ng3 h ALA 337 Ca 0.04 -0.27 -0.13 0.00 0.00 0.00 0.00 54.91 54.55 1ng3 h ALA 337 Cb 0.04 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1ng3 h ALA 337 CO -0.01 0.61 -0.22 1.15 0.00 0.00 0.00 179.25 180.78 1ng3 h THR 338 N 0.84 1.27 -0.45 0.00 2.02 -0.86 -1.11 112.91 114.62 1ng3 h THR 338 Ca 0.16 -1.38 -0.14 0.00 0.77 0.00 0.00 66.41 65.82 1ng3 h THR 338 Cb 0.47 1.16 -0.01 0.00 -1.74 0.00 0.00 68.15 68.02 1ng3 h THR 338 CO 0.02 0.48 -0.25 1.23 0.37 0.00 0.00 175.52 177.36 1ng3 h GLY 339 N 0.83 1.05 1.12 2.16 0.00 -1.04 -1.77 103.07 105.42 1ng3 h GLY 339 Ca 0.11 -0.97 -0.13 0.00 0.00 0.00 0.00 47.33 46.34 1ng3 h GLY 339 CO 0.07 0.88 -0.18 0.00 0.00 0.00 0.00 176.54 177.30 1ng3 h ALA 340 N 0.84 0.72 0.11 3.60 0.00 -1.16 -1.28 119.26 122.09 1ng3 h ALA 340 Ca 0.10 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 1ng3 h ALA 340 Cb 0.83 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1ng3 h ALA 340 CO 0.07 0.68 -0.05 1.25 0.00 0.00 0.00 179.25 181.19 1ng3 h LEU 341 N 0.88 -0.13 -0.63 0.00 5.85 -1.08 0.59 115.31 120.78 1ng3 h LEU 341 Ca 0.12 -0.12 -0.04 0.00 0.84 0.00 0.00 57.88 58.69 1ng3 h LEU 341 Cb 0.76 0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.79 1ng3 h LEU 341 CO 0.06 0.04 0.26 0.40 -0.34 0.00 0.00 178.44 178.86 1ng3 h ILE 342 N -0.30 1.23 -0.03 4.05 1.08 -1.33 -1.26 117.51 120.96 1ng3 h ILE 342 Ca -0.02 -0.73 -0.00 0.00 -0.39 0.00 0.00 64.86 63.73 1ng3 h ILE 342 Cb 0.24 0.53 -0.00 0.00 -3.07 0.00 0.00 36.82 34.52 1ng3 h ILE 342 CO 0.03 0.29 0.02 -1.28 -0.69 0.00 0.00 178.15 176.51 1ng3 h SER 343 N 0.89 0.04 -0.65 1.72 0.87 -1.12 -1.73 113.55 113.56 1ng3 h SER 343 Ca 0.21 -0.07 -0.01 0.00 -1.23 0.00 0.00 61.79 60.69 1ng3 h SER 343 Cb 0.20 -0.01 -0.03 0.00 -0.44 0.00 0.00 62.40 62.12 1ng3 h SER 343 CO -0.02 0.09 0.36 0.44 -0.53 0.00 0.00 176.83 177.18 1ng3 h ASP 344 N -0.02 0.83 -0.56 6.23 3.32 -0.72 -0.31 116.42 125.19 1ng3 h ASP 344 Ca 0.01 -0.07 -0.04 0.00 0.02 0.00 0.00 57.03 56.95 1ng3 h ASP 344 Cb 0.06 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.38 1ng3 h ASP 344 CO -0.00 0.67 0.19 -0.07 -1.72 0.00 0.00 179.24 178.31 1ng3 h LEU 345 N 0.94 0.81 -1.03 1.55 3.38 -1.01 0.14 115.31 120.08 1ng3 h LEU 345 Ca 0.24 -0.20 -0.08 0.00 0.09 0.00 0.00 57.88 57.93 1ng3 h LEU 345 Cb 0.03 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 1ng3 h LEU 345 CO -0.04 0.79 -0.18 0.40 0.09 0.00 0.00 178.44 179.51 1ng3 h ILE 346 N 0.78 1.24 -0.00 1.22 2.04 -0.75 0.10 117.51 122.15 1ng3 h ILE 346 Ca 0.18 -1.12 0.00 0.00 1.00 0.00 0.00 64.86 64.92 1ng3 h ILE 346 Cb 0.27 1.24 0.00 0.00 -0.74 0.00 0.00 36.82 37.58 1ng3 h ILE 346 CO -0.01 0.36 0.00 0.23 0.00 0.00 0.00 178.15 178.73 1ng3 n MET 347 N -4.17 1.05 -3.83 2.37 2.81 -0.18 -4.90 117.12 110.27 1ng3 n MET 347 Ca 0.00 -0.07 -0.25 0.00 -1.81 0.00 0.00 57.70 55.57 1ng3 n MET 347 Cb 0.36 -1.46 0.02 0.00 -0.71 0.00 0.00 33.22 31.43 1ng3 n MET 347 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 1ng3 n ASN 348 N -0.87 -1.87 -3.09 7.83 4.13 0.36 -4.99 115.26 116.75 1ng3 n ASN 348 Ca 0.22 -0.86 -0.09 0.00 1.68 0.00 0.00 54.58 55.52 1ng3 n ASN 348 Cb 0.12 -3.72 0.05 0.00 -1.54 0.00 0.00 39.78 34.69 1ng3 n ASN 348 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 1ng3 n LYS 349 N -4.40 0.39 -2.76 3.52 5.02 0.26 -5.01 118.16 115.17 1ng3 n LYS 349 Ca -0.21 -1.16 -0.41 0.00 -2.02 0.00 0.00 58.31 54.51 1ng3 n LYS 349 Cb 0.64 -0.25 -0.05 0.00 -0.02 0.00 0.00 35.03 35.34 1ng3 n LYS 349 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 1ng3 s GLU 350 N -3.46 4.74 -0.01 1.97 -1.05 -1.26 -4.82 118.70 114.80 1ng3 s GLU 350 Ca 0.27 1.43 -0.02 0.00 -0.15 0.00 0.00 54.97 56.51 1ng3 s GLU 350 Cb -0.02 -3.34 0.00 0.00 -0.44 0.00 0.00 34.13 30.34 1ng3 s GLU 350 CO 0.18 0.34 0.04 0.14 0.95 0.00 0.00 175.26 176.91 1ng3 s VAL 351 N -0.47 0.02 -0.37 1.83 -7.23 -1.26 -5.01 120.40 107.91 1ng3 s VAL 351 Ca 0.44 -0.14 -0.37 0.00 -1.81 0.00 0.00 61.98 60.10 1ng3 s VAL 351 Cb -0.24 -0.11 -0.12 0.00 0.56 0.00 0.00 36.38 36.46 1ng3 s VAL 351 CO 0.30 -0.08 2.18 -3.20 -0.31 0.00 0.00 175.10 173.99 1ng3 n ASN 352 N 2.80 1.94 0.27 4.85 2.85 -1.26 -4.80 115.26 121.91 1ng3 n ASN 352 Ca -0.14 0.46 0.15 0.00 -0.11 0.00 0.00 54.58 54.93 1ng3 n ASN 352 Cb 0.59 -1.21 0.78 0.00 1.24 0.00 0.00 39.78 41.18 1ng3 n ASN 352 CO 0.00 0.00 0.00 1.56 -2.11 0.00 0.00 177.26 176.71 1ng3 h GLN 353 N 11.86 0.00 -0.21 1.20 1.08 -1.98 -2.22 115.11 124.84 1ng3 h GLN 353 Ca -0.25 0.00 -0.09 0.00 -1.45 0.00 0.00 58.65 56.87 1ng3 h GLN 353 Cb 1.34 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.76 1ng3 h GLN 353 CO 1.03 0.09 -0.21 -0.44 -0.95 0.00 0.00 178.83 178.34 1ng3 h ASP 354 N 0.00 0.54 -0.21 1.46 3.32 -1.99 -1.61 116.42 117.94 1ng3 h ASP 354 Ca -0.00 -0.48 -0.06 0.00 0.02 0.00 0.00 57.03 56.51 1ng3 h ASP 354 Cb 0.32 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 1ng3 h ASP 354 CO 0.01 0.91 -0.11 -0.50 -1.72 0.00 0.00 179.24 177.83 1ng3 h TRP 355 N 0.18 0.51 -0.51 4.55 6.55 -1.87 -0.10 115.95 125.26 1ng3 h TRP 355 Ca 0.03 -0.13 0.13 0.00 0.95 0.00 0.00 58.89 59.87 1ng3 h TRP 355 Cb 0.76 -0.12 -0.02 0.00 -0.86 0.00 0.00 29.16 28.92 1ng3 h TRP 355 CO 0.08 0.74 0.36 1.25 -1.05 0.00 0.00 178.44 179.82 1ng3 h LEU 356 N 0.14 0.09 0.00 -4.49 5.85 -1.40 0.80 115.31 116.31 1ng3 h LEU 356 Ca 0.05 0.00 -0.17 0.00 0.84 0.00 0.00 57.88 58.60 1ng3 h LEU 356 Cb 0.61 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.59 1ng3 h LEU 356 CO 0.03 0.05 -1.26 -0.74 -0.34 0.00 0.00 178.44 176.18 1ng3 h HIS 357 N 0.10 0.00 -0.06 1.25 2.76 -1.02 -3.05 115.15 115.13 1ng3 h HIS 357 Ca 0.24 0.00 -0.11 0.00 -2.20 0.00 0.00 60.37 58.30 1ng3 h HIS 357 Cb 0.83 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.78 1ng3 h HIS 357 CO -0.00 0.63 -0.48 0.00 -1.30 0.00 0.00 177.93 176.78 1ng3 h ALA 358 N 1.37 1.07 -0.47 5.26 0.00 0.10 -3.12 119.26 123.47 1ng3 h ALA 358 Ca -0.14 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.31 1ng3 h ALA 358 Cb 1.61 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.31 1ng3 h ALA 358 CO 0.06 0.63 0.00 1.19 0.00 0.00 0.00 179.25 181.13 1ng3 n PHE 359 N -3.96 0.95 -1.24 0.00 3.72 -0.44 -4.98 117.46 111.51 1ng3 n PHE 359 Ca -0.02 -0.61 -0.40 0.00 -0.05 0.00 0.00 57.45 56.37 1ng3 n PHE 359 Cb 0.52 -0.15 0.00 0.00 -0.94 0.00 0.00 39.48 38.91 1ng3 n PHE 359 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1ng3 n ARG 360 N 0.63 0.00 0.04 -1.08 1.74 -1.15 -1.97 116.66 114.87 1ng3 n ARG 360 Ca 0.20 0.00 -0.13 0.00 -0.77 0.00 0.00 57.85 57.15 1ng3 n ARG 360 Cb 0.69 -0.97 -0.02 0.00 -1.02 0.00 0.00 32.46 31.14 1ng3 n ARG 360 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 1ng3 h ILE 361 N 0.22 1.36 -3.42 0.55 5.03 -1.87 -3.38 117.51 115.99 1ng3 h ILE 361 Ca -0.37 -2.22 -0.74 0.00 -0.12 0.00 0.00 64.86 61.41 1ng3 h ILE 361 Cb 1.40 2.20 -0.32 0.00 -3.03 0.00 0.00 36.82 37.07 1ng3 h ILE 361 CO 0.44 0.67 0.13 1.51 -0.68 0.00 0.00 178.15 180.22 1ng3 s ASP 362 N -7.05 6.55 -0.53 1.72 1.47 -1.26 -4.92 116.67 112.66 1ng3 s ASP 362 Ca -0.07 -3.67 -0.22 0.00 1.18 0.00 0.00 52.55 49.78 1ng3 s ASP 362 Cb 0.09 -2.04 0.05 0.00 -0.34 0.00 0.00 42.92 40.69 1ng3 s ASP 362 CO 0.86 -0.23 0.79 -0.13 0.68 0.00 0.00 175.17 177.15 1ng3 s ARG 363 N -1.31 3.24 0.00 2.11 0.52 -1.26 -5.19 118.95 117.06 1ng3 s ARG 363 Ca 0.29 -0.53 0.00 0.00 -0.52 0.00 0.00 55.73 54.97 1ng3 s ARG 363 Cb -0.08 -4.07 0.00 0.00 0.52 0.00 0.00 34.95 31.32 1ng3 s ARG 363 CO -0.11 -1.35 0.00 0.36 0.02 0.00 0.00 175.30 174.22