#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xa6 s PRO 22 N 0.00 4.03 0.32 0.54 0.04 -1.26 -4.97 135.00 133.70 1xa6 s PRO 22 Ca 0.00 0.54 0.10 0.00 0.04 0.00 0.00 61.00 61.68 1xa6 s PRO 22 Cb 0.00 -3.10 0.91 0.00 0.04 0.00 0.00 34.50 32.35 1xa6 s PRO 22 CO 0.00 0.58 1.72 -0.84 0.04 0.00 0.00 177.00 178.50 1xa6 h ILE 23 N 3.24 0.50 -2.86 0.56 3.07 -1.96 -3.31 117.51 116.75 1xa6 h ILE 23 Ca -0.50 -0.19 -0.63 0.00 1.55 0.00 0.00 64.86 65.10 1xa6 h ILE 23 Cb 1.21 -0.09 -0.14 0.00 -0.27 0.00 0.00 36.82 37.52 1xa6 h ILE 23 CO 0.64 0.10 0.50 0.26 -1.05 0.00 0.00 178.15 178.60 1xa6 s TRP 24 N -5.76 2.74 0.52 0.16 0.23 -1.26 -4.84 118.94 110.73 1xa6 s TRP 24 Ca -0.11 -0.41 -0.21 0.00 -2.03 0.00 0.00 56.10 53.35 1xa6 s TRP 24 Cb 0.28 -4.16 -0.06 0.00 0.03 0.00 0.00 33.47 29.55 1xa6 s TRP 24 CO 0.80 -1.51 1.20 0.15 0.96 0.00 0.00 176.95 178.55 1xa6 s LYS 25 N 3.89 3.39 0.00 4.98 1.02 -1.12 -4.97 119.74 126.93 1xa6 s LYS 25 Ca 0.24 1.84 0.07 0.00 0.02 0.00 0.00 55.97 58.14 1xa6 s LYS 25 Cb -0.16 -2.20 0.14 0.00 -0.52 0.00 0.00 37.83 35.09 1xa6 s LYS 25 CO 0.13 -0.87 0.99 -1.13 -0.92 0.00 0.00 175.35 173.55 1xa6 n SER 26 N -0.98 2.20 0.19 2.83 3.41 -1.26 -4.28 113.62 115.72 1xa6 n SER 26 Ca 0.10 -1.72 -0.17 0.00 -0.26 0.00 0.00 58.87 56.82 1xa6 n SER 26 Cb 0.48 -0.09 -0.09 0.00 -0.26 0.00 0.00 64.21 64.25 1xa6 n SER 26 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 1xa6 h TYR 27 N 1.35 -1.40 0.35 7.33 3.20 -1.93 0.17 116.97 126.03 1xa6 h TYR 27 Ca 0.00 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.89 1xa6 h TYR 27 Cb 0.51 0.57 -0.02 0.00 1.54 0.00 0.00 36.73 39.33 1xa6 h TYR 27 CO 0.09 -0.61 -0.35 -0.07 -1.64 0.00 0.00 178.16 175.57 1xa6 h LEU 28 N -0.84 -0.96 -0.64 2.82 3.38 -1.92 0.08 115.31 117.23 1xa6 h LEU 28 Ca -0.02 0.08 0.13 0.00 0.09 0.00 0.00 57.88 58.16 1xa6 h LEU 28 Cb 0.79 0.32 -0.12 0.00 0.09 0.00 0.00 40.66 41.74 1xa6 h LEU 28 CO -0.19 -0.49 -0.17 0.22 0.09 0.00 0.00 178.44 177.91 1xa6 h TYR 29 N -0.73 -0.36 -0.71 1.13 3.20 -1.86 0.64 116.97 118.28 1xa6 h TYR 29 Ca -0.02 0.06 0.14 0.00 3.14 0.00 0.00 58.73 62.05 1xa6 h TYR 29 Cb 0.66 0.26 -0.10 0.00 1.54 0.00 0.00 36.73 39.09 1xa6 h TYR 29 CO -0.21 -0.28 0.21 1.96 -1.64 0.00 0.00 178.16 178.21 1xa6 h GLN 30 N -0.01 0.32 0.43 1.82 1.08 0.14 -2.95 115.11 115.93 1xa6 h GLN 30 Ca 0.31 -0.02 -0.02 0.00 -1.45 0.00 0.00 58.65 57.47 1xa6 h GLN 30 Cb 0.47 -0.07 0.00 0.00 -0.05 0.00 0.00 27.48 27.83 1xa6 h GLN 30 CO -0.66 0.21 -0.20 -0.07 -0.95 0.00 0.00 178.83 177.16 1xa6 h LEU 31 N 0.33 -0.48 -0.96 1.46 3.38 0.22 -3.11 115.31 116.14 1xa6 h LEU 31 Ca 0.39 0.02 0.36 0.00 0.09 0.00 0.00 57.88 58.74 1xa6 h LEU 31 Cb 0.63 0.13 -0.13 0.00 0.09 0.00 0.00 40.66 41.37 1xa6 h LEU 31 CO -0.45 -0.32 0.57 1.67 0.09 0.00 0.00 178.44 180.00 1xa6 n GLN 32 N -3.68 -0.04 0.20 1.13 7.27 -0.24 0.33 117.38 122.35 1xa6 n GLN 32 Ca -0.07 1.07 0.05 0.00 0.07 0.00 0.00 57.00 58.12 1xa6 n GLN 32 Cb 0.23 -2.00 0.42 0.00 2.41 0.00 0.00 30.24 31.30 1xa6 n GLN 32 CO 0.00 0.00 0.00 1.96 0.07 0.00 0.00 177.06 179.09 1xa6 h GLN 33 N 0.00 0.00 0.00 3.69 1.08 -1.45 -2.43 115.11 115.99 1xa6 h GLN 33 Ca 0.70 0.00 -0.14 0.00 -1.45 0.00 0.00 58.65 57.76 1xa6 h GLN 33 Cb 2.05 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 29.46 1xa6 h GLN 33 CO -0.50 0.32 -0.78 0.93 -0.95 0.00 0.00 178.83 177.85 1xa6 h GLU 34 N 0.00 0.00 -6.35 1.46 5.08 0.54 -3.47 114.58 111.85 1xa6 h GLU 34 Ca -0.00 0.00 -0.63 0.00 -1.00 0.00 0.00 59.36 57.73 1xa6 h GLU 34 Cb 0.64 0.00 0.10 0.00 0.50 0.00 0.00 28.75 29.99 1xa6 h GLU 34 CO 0.04 0.58 0.02 0.00 -1.00 0.00 0.00 179.01 178.65 1xa6 n ALA 35 N -2.29 -0.90 -1.77 3.43 0.00 -0.68 -4.94 120.51 113.37 1xa6 n ALA 35 Ca -0.01 0.42 -0.38 0.00 0.00 0.00 0.00 53.44 53.47 1xa6 n ALA 35 Cb 0.80 -1.93 -0.02 0.00 0.00 0.00 0.00 19.45 18.30 1xa6 n ALA 35 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1xa6 s PRO 36 N -1.22 4.11 0.20 0.00 0.04 -1.26 -5.02 135.00 131.85 1xa6 s PRO 36 Ca 0.63 1.81 0.05 0.00 0.04 0.00 0.00 61.00 63.53 1xa6 s PRO 36 Cb -0.78 -2.70 -0.04 0.00 0.04 0.00 0.00 34.50 31.02 1xa6 s PRO 36 CO 0.58 -0.26 0.18 1.03 0.04 0.00 0.00 177.00 178.57 1xa6 s ARG 37 N -2.25 2.98 -0.65 4.56 0.52 -1.26 -4.57 118.95 118.27 1xa6 s ARG 37 Ca 0.56 -0.90 -0.12 0.00 -0.52 0.00 0.00 55.73 54.75 1xa6 s ARG 37 Cb -0.30 -2.66 -0.18 0.00 0.52 0.00 0.00 34.95 32.33 1xa6 s ARG 37 CO 0.38 0.46 1.82 -2.30 0.02 0.00 0.00 175.30 175.67 1xa6 n PRO 38 N -0.69 0.11 0.00 3.54 -0.02 -1.26 -4.69 135.00 131.99 1xa6 n PRO 38 Ca -0.08 -0.45 0.00 0.00 -2.02 0.00 0.00 63.50 60.95 1xa6 n PRO 38 Cb 0.56 -1.99 0.00 0.00 -0.02 0.00 0.00 33.50 32.05 1xa6 n PRO 38 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1xa6 n LYS 39 N 6.21 0.40 0.00 -0.52 4.76 0.35 -4.66 118.16 124.71 1xa6 n LYS 39 Ca 0.37 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.81 1xa6 n LYS 39 Cb 0.37 -1.03 0.00 0.00 -1.84 0.00 0.00 35.03 32.53 1xa6 n LYS 39 CO 0.00 0.00 0.00 -2.13 -1.37 0.00 0.00 177.40 173.90 1xa6 n ARG 40 N -0.39 0.00 0.06 1.97 3.00 -1.26 -4.50 116.66 115.55 1xa6 n ARG 40 Ca 0.00 0.00 0.12 0.00 -0.00 0.00 0.00 57.85 57.97 1xa6 n ARG 40 Cb 0.01 0.00 0.47 0.00 0.00 0.00 0.00 32.46 32.94 1xa6 n ARG 40 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.63 176.74 1xa6 n ILE 41 N 0.00 0.54 -2.30 5.15 5.41 -1.26 -2.60 119.36 124.31 1xa6 n ILE 41 Ca 0.00 -0.01 -0.01 0.00 1.00 0.00 0.00 62.75 63.73 1xa6 n ILE 41 Cb 0.00 -0.75 0.00 0.00 -0.71 0.00 0.00 39.64 38.18 1xa6 n ILE 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1xa6 n ILE 42 N -1.91 -0.16 -1.36 1.39 3.06 -1.26 -4.50 119.36 114.62 1xa6 n ILE 42 Ca 0.05 0.00 -0.31 0.00 -2.50 0.00 0.00 62.75 59.99 1xa6 n ILE 42 Cb 0.32 -0.14 0.09 0.00 0.54 0.00 0.00 39.64 40.45 1xa6 n ILE 42 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1xa6 s PRO 44 N -4.98 1.54 0.00 0.00 0.04 -1.25 -4.91 135.00 125.45 1xa6 s PRO 44 Ca 0.61 -0.45 0.00 0.00 0.04 0.00 0.00 61.00 61.20 1xa6 s PRO 44 Cb -0.16 -2.07 0.00 0.00 0.04 0.00 0.00 34.50 32.30 1xa6 s PRO 44 CO 0.56 -1.71 0.58 0.54 0.04 0.00 0.00 177.00 177.00 1xa6 n ARG 45 N -3.23 0.52 -3.31 4.56 3.00 -1.26 -4.63 116.66 112.32 1xa6 n ARG 45 Ca 0.12 0.00 -0.16 0.00 -0.01 0.00 0.00 57.85 57.80 1xa6 n ARG 45 Cb 0.60 -1.24 0.08 0.00 0.00 0.00 0.00 32.46 31.90 1xa6 n ARG 45 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 1xa6 n GLU 46 N 0.84 -6.08 0.22 5.56 -0.58 -1.26 -4.91 120.64 114.43 1xa6 n GLU 46 Ca 0.00 0.76 0.09 0.00 -0.42 0.00 0.00 57.16 57.59 1xa6 n GLU 46 Cb 0.26 -5.53 0.47 0.00 -0.57 0.00 0.00 31.44 26.07 1xa6 n GLU 46 CO 0.00 0.00 0.00 -0.39 -0.48 0.00 0.00 177.13 176.26 1xa6 h VAL 47 N -1.78 0.66 -5.79 2.62 -1.51 -1.96 -3.47 116.25 105.02 1xa6 h VAL 47 Ca -0.53 -1.13 -0.44 0.00 -1.23 0.00 0.00 66.70 63.37 1xa6 h VAL 47 Cb 1.31 1.74 0.00 0.00 -2.13 0.00 0.00 31.29 32.21 1xa6 h VAL 47 CO 0.45 0.25 -0.69 -0.62 -1.23 0.00 0.00 177.57 175.73 1xa6 n GLU 48 N -3.49 -5.53 -1.53 5.19 1.02 -1.26 -4.86 120.64 110.18 1xa6 n GLU 48 Ca -0.00 0.67 -0.45 0.00 -0.02 0.00 0.00 57.16 57.36 1xa6 n GLU 48 Cb 0.42 -5.56 -0.02 0.00 -0.02 0.00 0.00 31.44 26.26 1xa6 n GLU 48 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1xa6 n ASN 49 N -2.73 0.40 0.00 1.62 2.85 -1.26 -4.94 115.26 111.20 1xa6 n ASN 49 Ca 0.00 1.13 0.00 0.00 -0.11 0.00 0.00 54.58 55.61 1xa6 n ASN 49 Cb 0.55 -1.18 0.00 0.00 1.24 0.00 0.00 39.78 40.38 1xa6 n ASN 49 CO 0.00 0.00 0.00 -2.11 -2.11 0.00 0.00 177.26 173.04 1xa6 n ARG 50 N 0.76 0.00 -1.54 1.20 1.85 -1.26 -4.46 116.66 113.21 1xa6 n ARG 50 Ca 0.12 0.32 -0.36 0.00 -1.00 0.00 0.00 57.85 56.93 1xa6 n ARG 50 Cb 0.31 -1.27 -0.04 0.00 -1.05 0.00 0.00 32.46 30.40 1xa6 n ARG 50 CO 0.00 0.00 0.00 -2.30 -0.01 0.00 0.00 177.63 175.32 1xa6 n PRO 51 N -1.47 0.92 0.00 2.89 -0.02 -1.26 -4.72 135.00 131.34 1xa6 n PRO 51 Ca 0.00 -0.02 0.00 0.00 -2.02 0.00 0.00 63.50 61.46 1xa6 n PRO 51 Cb 0.00 -3.24 0.00 0.00 -0.02 0.00 0.00 33.50 30.24 1xa6 n PRO 51 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1xa6 n LYS 52 N 8.95 0.00 0.00 -0.52 0.00 -1.26 -4.97 118.16 120.36 1xa6 n LYS 52 Ca 0.40 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.71 1xa6 n LYS 52 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.52 1xa6 n LYS 52 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.40 178.38 1xa6 n TYR 53 N -0.01 0.00 -3.41 5.64 9.36 -1.26 -4.98 117.16 122.49 1xa6 n TYR 53 Ca 0.00 0.00 -0.40 0.00 3.32 0.00 0.00 57.90 60.82 1xa6 n TYR 53 Cb 0.00 -0.02 -0.09 0.00 -0.63 0.00 0.00 39.34 38.60 1xa6 n TYR 53 CO 0.00 0.00 0.00 1.52 0.22 0.00 0.00 176.86 178.60 1xa6 s TYR 54 N -0.59 3.23 0.00 2.98 -0.85 -1.26 -5.01 117.35 115.85 1xa6 s TYR 54 Ca 0.00 0.23 0.00 0.00 -0.52 0.00 0.00 57.07 56.78 1xa6 s TYR 54 Cb 0.00 -2.59 0.00 0.00 0.38 0.00 0.00 41.96 39.75 1xa6 s TYR 54 CO 0.00 -0.29 0.00 0.41 -1.52 0.00 0.00 175.55 174.15 1xa6 n GLY 55 N 4.82 4.52 0.00 5.49 0.00 -1.26 -4.94 105.19 113.83 1xa6 n GLY 55 Ca -0.09 -1.33 0.00 0.00 0.00 0.00 0.00 46.02 44.60 1xa6 n GLY 55 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xa6 n ARG 56 N -1.91 0.00 -0.28 1.61 5.12 -1.26 -4.56 116.66 115.39 1xa6 n ARG 56 Ca 0.00 -0.22 0.11 0.00 -1.93 0.00 0.00 57.85 55.80 1xa6 n ARG 56 Cb 0.00 -0.58 0.26 0.00 -1.16 0.00 0.00 32.46 30.98 1xa6 n ARG 56 CO 0.00 0.00 0.00 -0.85 -1.93 0.00 0.00 177.63 174.85 1xa6 n GLU 57 N -0.02 2.62 -3.38 5.56 0.00 -1.26 -3.89 120.64 120.27 1xa6 n GLU 57 Ca 0.00 -2.42 -0.43 0.00 0.00 0.00 0.00 57.16 54.31 1xa6 n GLU 57 Cb 0.28 -1.50 -0.09 0.00 0.00 0.00 0.00 31.44 30.13 1xa6 n GLU 57 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.13 177.25 1xa6 s PHE 58 N -1.14 3.20 -0.51 -1.84 5.36 -1.26 -1.19 117.98 120.60 1xa6 s PHE 58 Ca 0.41 -0.40 -0.02 0.00 -0.96 0.00 0.00 56.93 55.96 1xa6 s PHE 58 Cb 0.22 -2.76 0.29 0.00 -0.34 0.00 0.00 43.02 40.43 1xa6 s PHE 58 CO 0.30 -0.63 2.13 0.72 -1.46 0.00 0.00 175.22 176.28 1xa6 n HIS 59 N 5.43 2.27 -0.24 10.12 8.25 -0.25 -4.85 115.22 135.95 1xa6 n HIS 59 Ca -0.09 -2.37 0.00 0.00 -0.26 0.00 0.00 57.72 55.00 1xa6 n HIS 59 Cb 0.48 -1.21 0.00 0.00 1.12 0.00 0.00 29.99 30.37 1xa6 n HIS 59 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1xa6 n GLY 60 N -0.10 2.38 3.68 -1.41 0.00 -1.26 -4.36 105.19 104.12 1xa6 n GLY 60 Ca 0.46 -0.09 -0.36 0.00 0.00 0.00 0.00 46.02 46.03 1xa6 n GLY 60 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xa6 s ILE 61 N 0.00 5.34 0.29 -0.61 1.09 -1.26 -0.27 121.20 125.78 1xa6 s ILE 61 Ca 0.00 0.27 -0.18 0.00 -1.10 0.00 0.00 60.65 59.65 1xa6 s ILE 61 Cb 0.00 -3.53 0.02 0.00 -1.06 0.00 0.00 42.46 37.89 1xa6 s ILE 61 CO 0.00 0.35 0.66 -0.51 -0.10 0.00 0.00 174.94 175.35 1xa6 s ILE 62 N 0.93 0.00 0.35 2.92 1.10 -1.26 -4.96 121.20 120.28 1xa6 s ILE 62 Ca 0.10 -1.11 -0.10 0.00 -0.51 0.00 0.00 60.65 59.03 1xa6 s ILE 62 Cb -0.13 -2.18 -0.06 0.00 0.15 0.00 0.00 42.46 40.23 1xa6 s ILE 62 CO 0.04 0.00 0.69 -0.94 -2.11 0.00 0.00 174.94 172.62 1xa6 s SER 63 N -2.97 6.54 0.20 4.50 1.04 -1.26 -4.76 113.70 116.98 1xa6 s SER 63 Ca 0.15 1.03 -0.11 0.00 0.48 0.00 0.00 55.95 57.50 1xa6 s SER 63 Cb -0.04 -2.28 0.20 0.00 0.10 0.00 0.00 66.02 64.00 1xa6 s SER 63 CO 0.08 -0.30 1.79 0.03 0.98 0.00 0.00 173.24 175.83 1xa6 h ARG 64 N 1.58 0.58 -0.64 4.02 3.08 -2.00 0.41 114.38 121.41 1xa6 h ARG 64 Ca -0.47 -0.03 0.07 0.00 0.07 0.00 0.00 59.98 59.61 1xa6 h ARG 64 Cb 1.18 -0.13 -0.04 0.00 0.08 0.00 0.00 29.97 31.07 1xa6 h ARG 64 CO 0.65 0.38 0.42 0.93 -1.07 0.00 0.00 179.97 181.29 1xa6 h GLU 65 N 0.60 0.60 0.20 0.04 3.07 -2.00 -0.69 114.58 116.39 1xa6 h GLU 65 Ca 0.27 -0.04 -0.32 0.00 -0.50 0.00 0.00 59.36 58.77 1xa6 h GLU 65 Cb 0.18 -0.14 0.02 0.00 -0.84 0.00 0.00 28.75 27.97 1xa6 h GLU 65 CO -0.18 0.40 -1.50 1.96 -1.40 0.00 0.00 179.01 178.29 1xa6 h GLN 66 N 0.62 0.42 0.92 2.33 1.08 -1.42 -3.26 115.11 115.80 1xa6 h GLN 66 Ca 0.28 -0.71 -0.04 0.00 -1.45 0.00 0.00 58.65 56.72 1xa6 h GLN 66 Cb 0.30 0.27 0.01 0.00 -0.05 0.00 0.00 27.48 28.00 1xa6 h GLN 66 CO -0.09 1.33 -0.47 0.00 -0.95 0.00 0.00 178.83 178.65 1xa6 h ALA 67 N 0.28 -1.29 -1.03 3.87 0.00 0.29 -2.69 119.26 118.70 1xa6 h ALA 67 Ca -0.25 -0.28 0.36 0.00 0.00 0.00 0.00 54.91 54.74 1xa6 h ALA 67 Cb 2.10 0.54 -0.15 0.00 0.00 0.00 0.00 17.79 20.27 1xa6 h ALA 67 CO 0.23 -1.23 0.59 -0.44 0.00 0.00 0.00 179.25 178.39 1xa6 h ASP 68 N -1.28 0.44 -0.26 0.00 5.19 -1.29 0.68 116.42 119.90 1xa6 h ASP 68 Ca -0.13 0.20 0.01 0.00 -0.62 0.00 0.00 57.03 56.50 1xa6 h ASP 68 Cb 0.99 0.17 -0.02 0.00 0.18 0.00 0.00 39.33 40.66 1xa6 h ASP 68 CO 0.19 -0.22 0.16 -0.08 -3.12 0.00 0.00 179.24 176.17 1xa6 h GLU 69 N 0.22 0.33 -0.28 3.56 4.22 -1.52 0.59 114.58 121.70 1xa6 h GLU 69 Ca 0.77 -0.02 0.06 0.00 0.08 0.00 0.00 59.36 60.25 1xa6 h GLU 69 Cb 1.90 -0.07 -0.07 0.00 0.50 0.00 0.00 28.75 31.01 1xa6 h GLU 69 CO -0.63 0.22 -0.16 -0.07 -2.18 0.00 0.00 179.01 176.19 1xa6 h LEU 70 N 0.34 -0.52 0.00 1.64 3.38 0.59 -3.24 115.31 117.49 1xa6 h LEU 70 Ca 0.10 0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.19 1xa6 h LEU 70 Cb -0.02 0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.01 1xa6 h LEU 70 CO -0.04 -0.19 0.00 0.18 0.09 0.00 0.00 178.44 178.48 1xa6 n LEU 71 N -5.32 0.69 -2.22 1.67 4.77 -0.96 -5.04 117.00 110.57 1xa6 n LEU 71 Ca -0.00 0.52 0.00 0.00 -0.03 0.00 0.00 56.01 56.50 1xa6 n LEU 71 Cb 0.24 -0.27 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 1xa6 n LEU 71 CO 0.17 -0.27 -0.43 0.61 -1.33 0.00 0.00 177.39 176.14 1xa6 n GLY 72 N 0.74 -4.92 5.10 -0.72 0.00 0.20 -4.36 105.19 101.23 1xa6 n GLY 72 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1xa6 n GLY 72 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xa6 n GLY 73 N 1.90 0.29 0.00 -0.02 0.00 -1.26 -4.80 105.19 101.30 1xa6 n GLY 73 Ca 0.00 0.73 0.00 0.00 0.00 0.00 0.00 46.02 46.75 1xa6 n GLY 73 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1xa6 n VAL 74 N 0.00 0.00 -1.64 1.61 0.31 -1.26 -4.67 118.33 112.68 1xa6 n VAL 74 Ca 0.00 0.00 -0.45 0.00 -0.01 0.00 0.00 64.34 63.88 1xa6 n VAL 74 Cb 0.00 0.00 -0.04 0.00 -0.91 0.00 0.00 33.84 32.89 1xa6 n VAL 74 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 1xa6 n GLU 75 N 0.00 2.36 0.00 5.55 2.13 -1.26 -1.51 120.64 127.91 1xa6 n GLU 75 Ca 0.00 0.81 0.00 0.00 0.66 0.00 0.00 57.16 58.63 1xa6 n GLU 75 Cb 0.00 -2.93 0.00 0.00 0.27 0.00 0.00 31.44 28.78 1xa6 n GLU 75 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1xa6 n GLY 76 N 4.93 2.11 3.76 8.31 0.00 -0.48 -4.77 105.19 119.06 1xa6 n GLY 76 Ca 0.24 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.87 1xa6 n GLY 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xa6 s ALA 77 N -1.99 3.31 0.07 4.61 0.00 -0.57 -0.49 121.76 126.70 1xa6 s ALA 77 Ca 0.00 0.82 0.03 0.00 0.00 0.00 0.00 51.96 52.81 1xa6 s ALA 77 Cb 0.00 -3.30 -0.03 0.00 0.00 0.00 0.00 23.12 19.79 1xa6 s ALA 77 CO 0.00 -0.14 -0.09 1.52 0.00 0.00 0.00 175.76 177.05 1xa6 s TYR 78 N -1.30 0.87 0.08 0.00 1.13 -1.07 -0.59 117.35 116.47 1xa6 s TYR 78 Ca 0.48 -0.62 -0.07 0.00 -1.41 0.00 0.00 57.07 55.45 1xa6 s TYR 78 Cb -0.29 -0.50 -0.01 0.00 -1.10 0.00 0.00 41.96 40.06 1xa6 s TYR 78 CO 0.36 -0.06 0.14 -1.50 -2.51 0.00 0.00 175.55 171.99 1xa6 s ILE 79 N -2.11 0.16 0.12 -3.49 1.10 -0.17 -4.35 121.20 112.45 1xa6 s ILE 79 Ca -0.01 -1.32 0.10 0.00 -0.51 0.00 0.00 60.65 58.91 1xa6 s ILE 79 Cb -0.05 -1.40 -0.04 0.00 0.15 0.00 0.00 42.46 41.12 1xa6 s ILE 79 CO -0.01 -0.71 -0.21 -0.76 -2.11 0.00 0.00 174.94 171.14 1xa6 s LEU 80 N -2.88 2.57 0.20 8.50 1.43 -0.33 -1.49 118.68 126.68 1xa6 s LEU 80 Ca 0.06 -0.63 -0.19 0.00 -1.03 0.00 0.00 54.13 52.34 1xa6 s LEU 80 Cb 0.06 -1.43 0.03 0.00 0.03 0.00 0.00 46.19 44.88 1xa6 s LEU 80 CO -0.10 0.18 0.57 0.00 0.23 0.00 0.00 176.35 177.22 1xa6 s ARG 81 N -2.11 1.42 0.21 1.70 1.70 -1.02 -1.09 118.95 119.76 1xa6 s ARG 81 Ca 0.17 -0.81 0.07 0.00 -0.47 0.00 0.00 55.73 54.69 1xa6 s ARG 81 Cb -0.10 0.55 -0.04 0.00 -0.57 0.00 0.00 34.95 34.79 1xa6 s ARG 81 CO 0.09 -0.62 0.11 -2.00 -1.08 0.00 0.00 175.30 171.80 1xa6 s GLU 82 N -3.86 2.74 -0.10 3.89 2.12 0.63 -0.62 118.70 123.49 1xa6 s GLU 82 Ca 0.08 -1.05 -0.30 0.00 0.36 0.00 0.00 54.97 54.06 1xa6 s GLU 82 Cb -0.02 -2.50 -0.02 0.00 0.26 0.00 0.00 34.13 31.85 1xa6 s GLU 82 CO -0.03 0.43 1.15 0.45 -0.54 0.00 0.00 175.26 176.72 1xa6 s SER 83 N -3.40 7.08 0.63 -1.70 0.15 -0.54 -4.11 113.70 111.82 1xa6 s SER 83 Ca 0.31 1.69 0.39 0.00 0.70 0.00 0.00 55.95 59.04 1xa6 s SER 83 Cb -0.09 -2.55 2.16 0.00 -1.71 0.00 0.00 66.02 63.83 1xa6 s SER 83 CO 0.23 -0.59 2.31 0.06 1.20 0.00 0.00 173.24 176.44 1xa6 h GLN 84 N 7.49 0.00 0.00 5.44 3.07 -1.92 -3.37 115.11 125.82 1xa6 h GLN 84 Ca -0.31 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.43 1xa6 h GLN 84 Cb 1.14 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.70 1xa6 h GLN 84 CO 0.90 0.01 0.00 0.54 0.09 0.00 0.00 178.83 180.37 1xa6 n ARG 85 N -3.33 0.00 -2.18 0.06 5.12 -1.26 -4.94 116.66 110.13 1xa6 n ARG 85 Ca -0.03 0.00 -0.43 0.00 -1.93 0.00 0.00 57.85 55.47 1xa6 n ARG 85 Cb 0.10 0.00 -0.02 0.00 -1.16 0.00 0.00 32.46 31.37 1xa6 n ARG 85 CO 0.00 0.00 0.00 -1.14 -1.93 0.00 0.00 177.63 174.56 1xa6 s GLN 86 N 0.05 3.93 0.55 5.56 -0.44 -1.26 -5.00 119.66 123.05 1xa6 s GLN 86 Ca 0.00 1.69 -0.18 0.00 -2.50 0.00 0.00 55.36 54.37 1xa6 s GLN 86 Cb 0.00 -3.97 -0.06 0.00 -1.64 0.00 0.00 33.01 27.34 1xa6 s GLN 86 CO 0.00 -1.12 1.07 -2.14 0.50 0.00 0.00 175.29 173.60 1xa6 s PRO 87 N 4.34 3.46 0.00 1.67 0.02 -1.26 -3.70 135.00 139.53 1xa6 s PRO 87 Ca 0.67 1.37 0.00 0.00 0.02 0.00 0.00 61.00 63.06 1xa6 s PRO 87 Cb -0.25 -2.04 0.00 0.00 0.02 0.00 0.00 34.50 32.23 1xa6 s PRO 87 CO 0.26 -0.72 0.00 0.41 -0.33 0.00 0.00 177.00 176.63 1xa6 n GLY 88 N -0.42 0.54 3.11 0.52 0.00 -1.26 -4.99 105.19 102.68 1xa6 n GLY 88 Ca 0.10 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.76 1xa6 n GLY 88 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xa6 s TYR 90 N 0.76 3.49 -0.09 0.00 1.51 -1.26 -1.46 117.35 120.29 1xa6 s TYR 90 Ca 0.11 0.41 -0.09 0.00 -1.01 0.00 0.00 57.07 56.49 1xa6 s TYR 90 Cb -0.22 -1.93 0.02 0.00 -0.11 0.00 0.00 41.96 39.73 1xa6 s TYR 90 CO -0.04 0.22 0.25 -0.08 -1.11 0.00 0.00 175.55 174.79 1xa6 s THR 91 N -2.12 0.00 -0.02 -0.71 -1.32 0.21 -3.68 115.64 108.00 1xa6 s THR 91 Ca 0.40 -0.03 -0.16 0.00 -1.21 0.00 0.00 61.69 60.70 1xa6 s THR 91 Cb -0.10 -0.37 -0.06 0.00 -1.51 0.00 0.00 72.50 70.47 1xa6 s THR 91 CO 0.32 -0.01 0.43 -0.22 -2.21 0.00 0.00 174.62 172.93 1xa6 s LEU 92 N 0.07 4.44 -0.24 9.08 0.20 0.11 -2.44 118.68 129.90 1xa6 s LEU 92 Ca -0.01 0.95 -0.02 0.00 0.69 0.00 0.00 54.13 55.74 1xa6 s LEU 92 Cb -0.02 -2.62 0.07 0.00 -0.43 0.00 0.00 46.19 43.19 1xa6 s LEU 92 CO 0.00 0.26 0.05 0.00 -0.29 0.00 0.00 176.35 176.38 1xa6 s ALA 93 N -0.76 1.20 0.13 5.97 0.00 -0.55 0.70 121.76 128.45 1xa6 s ALA 93 Ca 0.24 -1.06 0.11 0.00 0.00 0.00 0.00 51.96 51.25 1xa6 s ALA 93 Cb -0.17 -1.34 -0.04 0.00 0.00 0.00 0.00 23.12 21.57 1xa6 s ALA 93 CO 0.13 -1.36 -0.27 -0.48 0.00 0.00 0.00 175.76 173.79 1xa6 s LEU 94 N 1.77 2.32 0.12 0.00 2.34 -0.63 -1.00 118.68 123.60 1xa6 s LEU 94 Ca 0.03 -0.75 -0.20 0.00 0.06 0.00 0.00 54.13 53.26 1xa6 s LEU 94 Cb -0.17 -1.21 -0.07 0.00 -0.56 0.00 0.00 46.19 44.17 1xa6 s LEU 94 CO -0.15 0.18 0.63 -0.13 -1.06 0.00 0.00 176.35 175.82 1xa6 s ARG 95 N -2.08 4.27 -0.44 1.48 0.52 0.24 -1.61 118.95 121.33 1xa6 s ARG 95 Ca 0.14 0.82 0.10 0.00 -0.52 0.00 0.00 55.73 56.27 1xa6 s ARG 95 Cb -0.10 -3.17 0.35 0.00 0.52 0.00 0.00 34.95 32.55 1xa6 s ARG 95 CO 0.06 0.58 0.80 0.34 0.02 0.00 0.00 175.30 177.10 1xa6 n PHE 96 N 1.49 1.40 0.00 -0.53 7.35 -0.50 -1.38 117.46 125.28 1xa6 n PHE 96 Ca -0.08 -3.87 0.00 0.00 -0.76 0.00 0.00 57.45 52.74 1xa6 n PHE 96 Cb 0.50 -0.44 0.00 0.00 0.35 0.00 0.00 39.48 39.89 1xa6 n PHE 96 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1xa6 n GLY 97 N 0.11 0.01 0.49 7.13 0.00 -1.26 -2.88 105.19 108.79 1xa6 n GLY 97 Ca 0.27 0.17 0.38 0.00 0.00 0.00 0.00 46.02 46.84 1xa6 n GLY 97 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1xa6 h ASN 98 N 0.00 0.21 0.00 1.61 -0.00 -1.96 -3.45 115.58 111.99 1xa6 h ASN 98 Ca 0.00 0.12 0.00 0.00 -0.00 0.00 0.00 56.30 56.42 1xa6 h ASN 98 Cb 0.00 0.10 0.00 0.00 -0.00 0.00 0.00 38.32 38.42 1xa6 h ASN 98 CO 0.00 -0.15 0.00 0.00 -0.00 0.00 0.00 177.43 177.28 1xa6 n GLN 99 N -4.59 0.00 -4.85 6.67 10.64 -1.14 -5.16 117.38 118.95 1xa6 n GLN 99 Ca 0.37 0.00 -0.27 0.00 -1.83 0.00 0.00 57.00 55.27 1xa6 n GLN 99 Cb 1.47 0.00 -0.16 0.00 -0.86 0.00 0.00 30.24 30.68 1xa6 n GLN 99 CO 0.00 0.00 0.00 0.99 -1.83 0.00 0.00 177.06 176.22 1xa6 s THR 100 N -1.26 1.47 -0.08 -0.39 2.01 -1.26 -1.41 115.64 114.72 1xa6 s THR 100 Ca 0.00 -0.72 0.03 0.00 0.31 0.00 0.00 61.69 61.31 1xa6 s THR 100 Cb 0.00 -1.28 -0.02 0.00 0.01 0.00 0.00 72.50 71.21 1xa6 s THR 100 CO 0.00 0.43 -0.16 -0.76 -0.69 0.00 0.00 174.62 173.43 1xa6 s LEU 101 N 0.21 2.57 -0.13 4.42 1.02 -0.63 -4.98 118.68 121.17 1xa6 s LEU 101 Ca -0.08 -0.31 -0.03 0.00 0.02 0.00 0.00 54.13 53.73 1xa6 s LEU 101 Cb -0.13 -1.53 -0.03 0.00 0.02 0.00 0.00 46.19 44.52 1xa6 s LEU 101 CO 0.04 0.27 -0.02 0.20 0.02 0.00 0.00 176.35 176.85 1xa6 s ASN 102 N -0.26 4.96 -0.01 2.29 0.01 -1.25 -1.61 114.94 119.08 1xa6 s ASN 102 Ca 0.01 -0.03 0.03 0.00 -0.71 0.00 0.00 52.86 52.16 1xa6 s ASN 102 Cb -0.13 -1.65 -0.05 0.00 0.41 0.00 0.00 41.25 39.84 1xa6 s ASN 102 CO 0.03 0.25 0.06 -1.22 -1.51 0.00 0.00 177.10 174.70 1xa6 n TYR 103 N 3.02 0.00 -0.47 2.20 4.01 0.22 -4.96 117.16 121.18 1xa6 n TYR 103 Ca -0.18 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.56 1xa6 n TYR 103 Cb 0.53 -0.08 0.00 0.00 -0.31 0.00 0.00 39.34 39.48 1xa6 n TYR 103 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1xa6 n ARG 104 N -1.67 0.00 0.00 -0.72 1.74 -1.26 -4.73 116.66 110.02 1xa6 n ARG 104 Ca -0.01 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.07 1xa6 n ARG 104 Cb 0.15 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.59 1xa6 n ARG 104 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 1xa6 n LEU 105 N 0.00 0.00 0.00 0.55 0.00 -1.24 0.09 117.00 116.39 1xa6 n LEU 105 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.01 1xa6 n LEU 105 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.42 1xa6 n LEU 105 CO 0.00 0.00 0.00 0.49 0.00 0.00 0.00 177.39 177.88 1xa6 n PHE 106 N 0.00 0.00 -2.94 1.96 3.01 -0.81 -4.59 117.46 114.09 1xa6 n PHE 106 Ca 0.00 0.00 0.04 0.00 1.01 0.00 0.00 57.45 58.50 1xa6 n PHE 106 Cb 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.47 1xa6 n PHE 106 CO 0.00 0.00 0.00 -1.58 1.01 0.00 0.00 176.76 176.19 1xa6 s HIS 107 N 1.44 -0.35 -0.96 1.38 2.46 -1.26 -3.62 115.29 114.38 1xa6 s HIS 107 Ca 0.00 0.13 -0.03 0.00 0.47 0.00 0.00 55.06 55.63 1xa6 s HIS 107 Cb 0.00 0.06 0.25 0.00 -0.13 0.00 0.00 32.58 32.77 1xa6 s HIS 107 CO 0.00 -0.22 2.12 -3.47 -2.47 0.00 0.00 174.74 170.70 1xa6 n ASP 108 N 4.34 7.43 0.00 9.88 -0.08 -1.26 -4.51 116.55 132.35 1xa6 n ASP 108 Ca 0.07 -3.56 0.00 0.00 -1.51 0.00 0.00 54.79 49.80 1xa6 n ASP 108 Cb 0.61 -1.19 0.00 0.00 2.34 0.00 0.00 41.12 42.88 1xa6 n ASP 108 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1xa6 n GLY 109 N 0.29 0.49 3.59 0.27 0.00 -1.26 -4.93 105.19 103.63 1xa6 n GLY 109 Ca 0.52 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.56 1xa6 n GLY 109 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xa6 s LYS 110 N -0.25 0.08 0.52 1.61 -2.85 -1.26 -5.10 119.74 112.49 1xa6 s LYS 110 Ca 0.00 0.14 -0.18 0.00 -1.00 0.00 0.00 55.97 54.93 1xa6 s LYS 110 Cb 0.00 0.03 -0.14 0.00 -2.06 0.00 0.00 37.83 35.66 1xa6 s LYS 110 CO 0.00 -0.02 -0.01 0.72 0.10 0.00 0.00 175.35 176.14 1xa6 n HIS 111 N 3.35 -2.50 0.00 1.78 8.25 -1.26 -4.42 115.22 120.41 1xa6 n HIS 111 Ca -0.16 0.45 0.00 0.00 -0.26 0.00 0.00 57.72 57.75 1xa6 n HIS 111 Cb 0.56 -1.74 0.00 0.00 1.12 0.00 0.00 29.99 29.94 1xa6 n HIS 111 CO 0.00 0.00 0.00 1.97 0.64 0.00 0.00 176.34 178.95 1xa6 n PHE 112 N -1.56 0.00 -2.65 4.41 1.16 -1.24 -1.02 117.46 116.57 1xa6 n PHE 112 Ca 0.08 0.00 -0.16 0.00 -1.87 0.00 0.00 57.45 55.50 1xa6 n PHE 112 Cb 0.47 0.00 0.08 0.00 -1.61 0.00 0.00 39.48 38.42 1xa6 n PHE 112 CO 0.00 0.00 0.00 0.28 -1.87 0.00 0.00 176.76 175.17 1xa6 n VAL 113 N 0.00 0.00 0.00 1.97 0.31 -1.26 -1.93 118.33 117.42 1xa6 n VAL 113 Ca 0.00 -1.21 0.00 0.00 -0.01 0.00 0.00 64.34 63.12 1xa6 n VAL 113 Cb 0.00 -0.93 0.00 0.00 -0.91 0.00 0.00 33.84 32.00 1xa6 n VAL 113 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1xa6 n GLY 114 N -0.44 0.00 0.00 2.92 0.00 -1.26 -4.50 105.19 101.90 1xa6 n GLY 114 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1xa6 n GLY 114 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1xa6 n GLU 115 N 0.00 0.00 0.00 1.61 4.71 -1.26 -4.25 120.64 121.45 1xa6 n GLU 115 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.15 1xa6 n GLU 115 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 30.43 1xa6 n GLU 115 CO 0.00 0.00 0.00 0.36 0.09 0.00 0.00 177.13 177.58 1xa6 n LYS 116 N 0.00 0.00 0.00 3.49 2.85 -1.26 -4.38 118.16 118.86 1xa6 n LYS 116 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1xa6 n LYS 116 Cb 0.00 -1.47 0.00 0.00 -0.65 0.00 0.00 35.03 32.91 1xa6 n LYS 116 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 1xa6 n ARG 117 N 2.10 0.00 -1.64 -1.58 5.12 -1.26 -5.04 116.66 114.36 1xa6 n ARG 117 Ca 0.00 0.00 -0.01 0.00 -1.93 0.00 0.00 57.85 55.91 1xa6 n ARG 117 Cb 0.00 -0.43 -0.01 0.00 -1.16 0.00 0.00 32.46 30.86 1xa6 n ARG 117 CO 0.00 0.00 0.00 1.19 -1.93 0.00 0.00 177.63 176.89 1xa6 n PHE 118 N 0.00 -0.99 0.00 -1.55 3.72 -1.26 -5.05 117.46 112.33 1xa6 n PHE 118 Ca 0.00 0.58 0.00 0.00 -0.05 0.00 0.00 57.45 57.98 1xa6 n PHE 118 Cb 0.00 -2.11 0.00 0.00 -0.94 0.00 0.00 39.48 36.43 1xa6 n PHE 118 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 1xa6 n GLU 119 N 0.37 0.00 -2.64 -1.08 1.02 -0.19 -5.00 120.64 113.13 1xa6 n GLU 119 Ca -0.07 0.00 -0.05 0.00 -0.02 0.00 0.00 57.16 57.01 1xa6 n GLU 119 Cb 0.11 0.00 0.08 0.00 -0.02 0.00 0.00 31.44 31.61 1xa6 n GLU 119 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1xa6 n SER 120 N 0.00 -1.58 -1.26 1.62 7.64 -1.26 -4.25 113.62 114.53 1xa6 n SER 120 Ca 0.00 -2.15 0.04 0.00 1.01 0.00 0.00 58.87 57.76 1xa6 n SER 120 Cb 0.00 0.94 -0.02 0.00 -1.01 0.00 0.00 64.21 64.12 1xa6 n SER 120 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1xa6 n ILE 121 N -0.66 -1.32 0.00 0.44 0.13 -1.26 -4.38 119.36 112.31 1xa6 n ILE 121 Ca -0.11 0.76 0.00 0.00 -1.10 0.00 0.00 62.75 62.30 1xa6 n ILE 121 Cb 0.78 -1.24 0.00 0.00 -0.84 0.00 0.00 39.64 38.35 1xa6 n ILE 121 CO 0.00 0.00 0.00 1.57 2.80 0.00 0.00 176.55 180.92 1xa6 n HIS 122 N -2.89 0.00 -0.29 9.51 -0.00 -1.26 -3.91 115.22 116.37 1xa6 n HIS 122 Ca -0.02 0.00 0.11 0.00 0.46 0.00 0.00 57.72 58.27 1xa6 n HIS 122 Cb 0.33 0.00 0.27 0.00 -0.12 0.00 0.00 29.99 30.47 1xa6 n HIS 122 CO 0.00 0.00 0.00 -0.44 0.46 0.00 0.00 176.34 176.36 1xa6 h ASP 123 N 0.00 0.10 0.00 0.26 5.19 -1.99 1.45 116.42 121.44 1xa6 h ASP 123 Ca 0.00 0.17 0.00 0.00 -0.62 0.00 0.00 57.03 56.58 1xa6 h ASP 123 Cb 0.00 0.21 0.00 0.00 0.18 0.00 0.00 39.33 39.72 1xa6 h ASP 123 CO 0.00 -0.08 0.00 -0.11 -3.12 0.00 0.00 179.24 175.93 1xa6 n LEU 124 N -5.15 0.00 -0.33 1.55 0.00 -1.25 -0.32 117.00 111.50 1xa6 n LEU 124 Ca 0.20 0.75 0.05 0.00 0.00 0.00 0.00 56.01 57.00 1xa6 n LEU 124 Cb 0.61 -0.25 0.12 0.00 0.00 0.00 0.00 43.42 43.91 1xa6 n LEU 124 CO 0.10 -0.25 0.67 0.58 0.00 0.00 0.00 177.39 178.50 1xa6 h VAL 125 N 0.00 0.07 0.00 1.96 2.07 -1.53 1.06 116.25 119.88 1xa6 h VAL 125 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1xa6 h VAL 125 Cb 0.00 0.07 0.00 0.00 -1.52 0.00 0.00 31.29 29.84 1xa6 h VAL 125 CO 0.00 0.00 0.00 0.41 0.02 0.00 0.00 177.57 178.00 1xa6 n THR 126 N -5.59 0.00 -0.34 2.57 -1.04 0.49 0.12 114.28 110.49 1xa6 n THR 126 Ca 0.14 1.42 0.09 0.00 -2.04 0.00 0.00 64.05 63.66 1xa6 n THR 126 Cb 0.46 -2.12 0.28 0.00 -1.82 0.00 0.00 70.33 67.13 1xa6 n THR 126 CO 0.00 0.00 0.00 -0.78 -0.64 0.00 0.00 175.07 173.65 1xa6 h ASP 127 N 0.00 0.85 -0.06 8.00 3.58 0.45 -0.17 116.42 129.07 1xa6 h ASP 127 Ca 0.00 0.05 0.00 0.00 0.42 0.00 0.00 57.03 57.50 1xa6 h ASP 127 Cb 0.00 -0.12 -0.00 0.00 1.72 0.00 0.00 39.33 40.93 1xa6 h ASP 127 CO 0.00 0.44 0.04 1.23 -2.88 0.00 0.00 179.24 178.07 1xa6 h GLY 128 N 0.91 0.09 0.78 -0.78 0.00 0.18 0.96 103.07 105.21 1xa6 h GLY 128 Ca 0.49 -0.03 0.04 0.00 0.00 0.00 0.00 47.33 47.83 1xa6 h GLY 128 CO -0.26 0.03 0.30 1.41 0.00 0.00 0.00 176.54 178.02 1xa6 h LEU 129 N 0.06 0.45 0.30 3.11 3.38 0.21 -0.10 115.31 122.72 1xa6 h LEU 129 Ca 0.02 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1xa6 h LEU 129 Cb 0.01 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 1xa6 h LEU 129 CO -0.00 0.31 -0.42 0.40 0.09 0.00 0.00 178.44 178.82 1xa6 h ILE 130 N 0.58 0.15 -0.48 1.22 2.04 -0.52 0.24 117.51 120.75 1xa6 h ILE 130 Ca 0.23 0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.23 1xa6 h ILE 130 Cb 0.09 0.15 -0.02 0.00 -0.74 0.00 0.00 36.82 36.31 1xa6 h ILE 130 CO -0.13 0.00 0.50 0.74 0.00 0.00 0.00 178.15 179.25 1xa6 h THR 131 N -0.78 0.37 0.07 -0.27 2.02 -0.28 -0.77 112.91 113.27 1xa6 h THR 131 Ca -0.02 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.16 1xa6 h THR 131 Cb 0.73 0.61 0.00 0.00 -1.74 0.00 0.00 68.15 67.75 1xa6 h THR 131 CO -0.13 0.00 -0.03 -0.07 0.37 0.00 0.00 175.52 175.65 1xa6 h LEU 132 N 0.00 -0.08 -0.78 2.58 3.38 0.10 -2.80 115.31 117.72 1xa6 h LEU 132 Ca 0.23 0.00 0.18 0.00 0.09 0.00 0.00 57.88 58.38 1xa6 h LEU 132 Cb 1.22 0.02 -0.13 0.00 0.09 0.00 0.00 40.66 41.86 1xa6 h LEU 132 CO -0.00 0.26 0.06 0.22 0.09 0.00 0.00 178.44 179.07 1xa6 h TYR 133 N -0.73 0.05 0.09 1.13 3.20 0.04 -0.04 116.97 120.72 1xa6 h TYR 133 Ca -0.01 0.05 -0.00 0.00 3.14 0.00 0.00 58.73 61.91 1xa6 h TYR 133 Cb 0.07 0.10 0.00 0.00 1.54 0.00 0.00 36.73 38.44 1xa6 h TYR 133 CO 0.01 -0.22 -0.05 0.82 -1.64 0.00 0.00 178.16 177.08 1xa6 h ILE 134 N 0.14 0.00 -1.15 1.81 2.04 -1.32 -2.78 117.51 116.25 1xa6 h ILE 134 Ca 0.44 -0.05 0.42 0.00 1.00 0.00 0.00 64.86 66.67 1xa6 h ILE 134 Cb 0.79 0.00 -0.16 0.00 -0.74 0.00 0.00 36.82 36.72 1xa6 h ILE 134 CO -0.65 0.00 0.68 -0.33 0.00 0.00 0.00 178.15 177.85 1xa6 h GLU 135 N -0.18 0.06 0.65 2.37 5.08 -1.28 0.79 114.58 122.07 1xa6 h GLU 135 Ca -0.01 -0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.31 1xa6 h GLU 135 Cb 0.10 -0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.34 1xa6 h GLU 135 CO 0.02 0.04 -0.31 1.15 -1.00 0.00 0.00 179.01 178.91 1xa6 h THR 136 N 0.07 0.00 -2.93 1.13 2.02 -1.03 -3.27 112.91 108.90 1xa6 h THR 136 Ca 0.83 -0.06 -0.55 0.00 0.77 0.00 0.00 66.41 67.40 1xa6 h THR 136 Cb 2.35 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 68.75 1xa6 h THR 136 CO -0.61 0.00 0.84 -0.54 0.37 0.00 0.00 175.52 175.57 1xa6 s LYS 137 N -4.75 4.28 -0.58 6.66 1.02 0.27 -4.12 119.74 122.52 1xa6 s LYS 137 Ca -0.13 1.86 -0.21 0.00 0.02 0.00 0.00 55.97 57.51 1xa6 s LYS 137 Cb 0.01 -3.64 0.03 0.00 -0.52 0.00 0.00 37.83 33.71 1xa6 s LYS 137 CO 0.38 -0.59 0.64 0.00 -0.92 0.00 0.00 175.35 174.86 1xa6 n ALA 138 N 5.73 -2.58 0.03 5.17 0.00 -1.26 -4.79 120.51 122.81 1xa6 n ALA 138 Ca 0.13 0.29 0.04 0.00 0.00 0.00 0.00 53.44 53.90 1xa6 n ALA 138 Cb 0.44 -2.03 -0.08 0.00 0.00 0.00 0.00 19.45 17.78 1xa6 n ALA 138 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xa6 n ALA 139 N -1.03 2.22 -0.03 0.00 0.00 -1.23 -3.46 120.51 116.97 1xa6 n ALA 139 Ca -0.11 -0.52 -0.11 0.00 0.00 0.00 0.00 53.44 52.70 1xa6 n ALA 139 Cb 0.63 -0.90 -0.05 0.00 0.00 0.00 0.00 19.45 19.13 1xa6 n ALA 139 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1xa6 h GLU 140 N 0.00 0.22 -0.28 0.00 3.07 -1.89 -2.21 114.58 113.48 1xa6 h GLU 140 Ca -0.12 -0.04 0.04 0.00 -0.50 0.00 0.00 59.36 58.74 1xa6 h GLU 140 Cb 1.37 -0.04 -0.04 0.00 -0.84 0.00 0.00 28.75 29.21 1xa6 h GLU 140 CO 0.02 0.30 0.05 -0.92 -1.40 0.00 0.00 179.01 177.06 1xa6 h TYR 141 N 0.09 0.08 0.00 4.33 3.20 -1.94 -0.40 116.97 122.33 1xa6 h TYR 141 Ca 0.05 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.94 1xa6 h TYR 141 Cb 0.16 0.01 0.00 0.00 1.54 0.00 0.00 36.73 38.43 1xa6 h TYR 141 CO -0.02 0.01 0.10 0.82 -1.64 0.00 0.00 178.16 177.43 1xa6 h ILE 142 N 0.15 0.00 0.17 1.81 2.04 -1.49 -1.67 117.51 118.52 1xa6 h ILE 142 Ca 0.13 0.00 -0.34 0.00 1.00 0.00 0.00 64.86 65.65 1xa6 h ILE 142 Cb 0.14 0.83 0.00 0.00 -0.74 0.00 0.00 36.82 37.05 1xa6 h ILE 142 CO -0.18 0.00 -1.74 0.77 0.00 0.00 0.00 178.15 177.00 1xa6 h SER 143 N 0.00 0.55 0.37 1.72 4.64 -0.49 -3.34 113.55 117.01 1xa6 h SER 143 Ca 0.00 -0.93 0.00 0.00 -0.47 0.00 0.00 61.79 60.39 1xa6 h SER 143 Cb 0.20 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 62.11 1xa6 h SER 143 CO 0.00 1.78 0.00 0.29 -0.87 0.00 0.00 176.83 178.03 1xa6 n LYS 144 N -3.63 0.42 -0.07 4.77 5.02 -0.66 -3.58 118.16 120.43 1xa6 n LYS 144 Ca -0.26 0.05 0.22 0.00 -2.02 0.00 0.00 58.31 56.29 1xa6 n LYS 144 Cb 1.04 -1.50 0.67 0.00 -0.02 0.00 0.00 35.03 35.22 1xa6 n LYS 144 CO 0.00 0.00 0.00 0.52 -0.52 0.00 0.00 177.40 177.40 1xa6 h MET 145 N 0.00 0.06 -0.25 1.97 2.86 -1.59 0.96 114.93 118.94 1xa6 h MET 145 Ca 0.00 -0.00 -0.16 0.00 -2.06 0.00 0.00 59.70 57.48 1xa6 h MET 145 Cb 0.19 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.83 1xa6 h MET 145 CO 0.00 0.04 -0.49 1.15 1.06 0.00 0.00 176.91 178.67 1xa6 h THR 146 N 0.06 1.30 -4.29 2.22 2.02 -1.85 -3.42 112.91 108.95 1xa6 h THR 146 Ca 0.31 -1.69 -0.52 0.00 0.77 0.00 0.00 66.41 65.28 1xa6 h THR 146 Cb 1.16 1.63 0.16 0.00 -1.74 0.00 0.00 68.15 69.36 1xa6 h THR 146 CO -0.02 0.54 0.27 -0.89 0.37 0.00 0.00 175.52 175.79 1xa6 s THR 147 N -4.14 2.73 -0.88 3.16 2.01 0.33 -3.55 115.64 115.31 1xa6 s THR 147 Ca -0.08 0.24 -0.23 0.00 0.31 0.00 0.00 61.69 61.93 1xa6 s THR 147 Cb 0.11 -2.51 0.03 0.00 0.01 0.00 0.00 72.50 70.15 1xa6 s THR 147 CO 0.85 -0.31 0.51 -0.46 -0.69 0.00 0.00 174.62 174.52 1xa6 n ASN 148 N -3.86 -3.21 -3.21 3.53 6.94 -1.26 -4.90 115.26 109.30 1xa6 n ASN 148 Ca 0.10 -0.96 0.00 0.00 -0.02 0.00 0.00 54.58 53.70 1xa6 n ASN 148 Cb 0.53 -1.20 0.00 0.00 -2.36 0.00 0.00 39.78 36.74 1xa6 n ASN 148 CO 0.00 0.00 0.00 -0.81 -1.03 0.00 0.00 177.26 175.42 1xa6 n PRO 149 N -3.76 -0.86 0.00 -0.53 -0.04 -1.23 -5.01 135.00 123.57 1xa6 n PRO 149 Ca -0.11 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.35 1xa6 n PRO 149 Cb 0.45 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.91 1xa6 n PRO 149 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1xa6 n ILE 150 N -2.23 0.00 -0.34 0.52 5.41 -1.11 -4.91 119.36 116.71 1xa6 n ILE 150 Ca 0.00 0.00 0.21 0.00 1.00 0.00 0.00 62.75 63.96 1xa6 n ILE 150 Cb 0.00 0.47 0.45 0.00 -0.71 0.00 0.00 39.64 39.85 1xa6 n ILE 150 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 176.55 176.77 1xa6 h TYR 151 N 0.00 0.84 -0.97 1.39 3.20 -1.65 -2.41 116.97 117.37 1xa6 h TYR 151 Ca 0.00 0.03 0.14 0.00 3.14 0.00 0.00 58.73 62.04 1xa6 h TYR 151 Cb 0.03 -0.24 -0.15 0.00 1.54 0.00 0.00 36.73 37.91 1xa6 h TYR 151 CO 0.00 0.04 -0.41 0.39 -1.64 0.00 0.00 178.16 176.54 1xa6 n GLU 152 N -4.77 -0.26 -3.84 1.82 -0.58 -1.26 -3.45 120.64 108.29 1xa6 n GLU 152 Ca 0.27 1.48 -0.28 0.00 -0.42 0.00 0.00 57.16 58.21 1xa6 n GLU 152 Cb 0.84 -2.20 -0.12 0.00 -0.57 0.00 0.00 31.44 29.39 1xa6 n GLU 152 CO 0.00 0.00 0.00 -3.38 -0.48 0.00 0.00 177.13 173.27 1xa6 s HIS 153 N -5.83 3.13 0.00 -0.32 -3.43 -0.91 -4.63 115.29 103.30 1xa6 s HIS 153 Ca -0.13 -3.14 0.00 0.00 -0.80 0.00 0.00 55.06 50.99 1xa6 s HIS 153 Cb 0.18 -2.49 0.00 0.00 -1.43 0.00 0.00 32.58 28.84 1xa6 s HIS 153 CO 0.67 -0.63 0.00 0.44 -2.00 0.00 0.00 174.74 173.22 1xa6 n ILE 154 N 2.39 0.00 0.00 -5.38 -5.35 -1.22 -5.05 119.36 104.74 1xa6 n ILE 154 Ca 0.17 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.65 1xa6 n ILE 154 Cb 0.36 -0.48 0.00 0.00 -1.74 0.00 0.00 39.64 37.77 1xa6 n ILE 154 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1xa6 n GLY 155 N 2.82 3.71 4.75 3.28 0.00 -1.26 -4.97 105.19 113.52 1xa6 n GLY 155 Ca 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.80 1xa6 n GLY 155 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1xa6 n TYR 156 N -0.37 0.00 -0.55 1.61 4.02 -1.26 -4.37 117.16 116.23 1xa6 n TYR 156 Ca 0.00 0.00 0.08 0.00 -0.01 0.00 0.00 57.90 57.97 1xa6 n TYR 156 Cb 0.00 -0.81 0.28 0.00 -0.02 0.00 0.00 39.34 38.78 1xa6 n TYR 156 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1xa6 n ALA 157 N 0.87 2.75 0.00 -0.72 0.00 -1.26 -4.17 120.51 117.97 1xa6 n ALA 157 Ca 0.00 -1.60 0.00 0.00 0.00 0.00 0.00 53.44 51.84 1xa6 n ALA 157 Cb 0.00 -0.77 0.00 0.00 0.00 0.00 0.00 19.45 18.68 1xa6 n ALA 157 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1xa6 n THR 158 N 0.64 0.00 0.00 0.00 -1.04 -1.26 -4.86 114.28 107.76 1xa6 n THR 158 Ca 0.21 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.22 1xa6 n THR 158 Cb 0.74 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.25 1xa6 n THR 158 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1xa6 n LEU 159 N -1.20 0.00 -1.12 -4.42 7.99 -1.26 -5.08 117.00 111.91 1xa6 n LEU 159 Ca 0.00 0.00 0.07 0.00 -0.01 0.00 0.00 56.01 56.07 1xa6 n LEU 159 Cb 0.00 0.00 -0.04 0.00 -0.11 0.00 0.00 43.42 43.27 1xa6 n LEU 159 CO 0.00 0.00 -0.34 -0.11 -1.51 0.00 0.00 177.39 175.43 1xa6 n LEU 160 N 0.00 -0.69 0.00 2.23 -0.00 -1.26 -4.66 117.00 112.62 1xa6 n LEU 160 Ca 0.00 1.45 0.00 0.00 -0.00 0.00 0.00 56.01 57.46 1xa6 n LEU 160 Cb 0.00 -2.42 0.00 0.00 -0.00 0.00 0.00 43.42 41.00 1xa6 n LEU 160 CO 0.00 -1.01 0.00 -1.14 -0.00 0.00 0.00 177.39 175.24 1xa6 n ARG 161 N -3.40 0.00 0.00 1.96 0.00 -1.26 -5.06 116.66 108.90 1xa6 n ARG 161 Ca -0.04 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.81 1xa6 n ARG 161 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.82 1xa6 n ARG 161 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.63 178.61 1xa6 n TYR 209 N -0.96 0.00 -1.34 -0.14 9.36 -1.26 -5.24 117.16 117.58 1xa6 n TYR 209 Ca 0.00 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.22 1xa6 n TYR 209 Cb 0.00 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 38.71 1xa6 n TYR 209 CO 0.00 0.00 0.00 -1.91 0.22 0.00 0.00 176.86 175.17 1xa6 n GLU 210 N 0.00 -3.80 -3.65 2.98 2.13 -1.26 -5.06 120.64 111.98 1xa6 n GLU 210 Ca 0.00 2.77 -0.03 0.00 0.66 0.00 0.00 57.16 60.57 1xa6 n GLU 210 Cb 0.00 -3.08 -0.07 0.00 0.27 0.00 0.00 31.44 28.56 1xa6 n GLU 210 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 1xa6 s LYS 211 N -3.25 0.08 0.33 5.31 2.36 -1.23 -4.90 119.74 118.43 1xa6 s LYS 211 Ca 0.00 0.10 -0.11 0.00 -2.55 0.00 0.00 55.97 53.41 1xa6 s LYS 211 Cb 0.00 0.04 -0.07 0.00 -1.05 0.00 0.00 37.83 36.75 1xa6 s LYS 211 CO 0.00 -0.01 0.69 0.95 1.55 0.00 0.00 175.35 178.53 1xa6 s THR 212 N 0.11 4.81 -0.23 3.43 -4.23 -1.26 -3.40 115.64 114.87 1xa6 s THR 212 Ca 0.06 0.64 -0.18 0.00 -1.18 0.00 0.00 61.69 61.03 1xa6 s THR 212 Cb -0.05 -3.67 -0.03 0.00 1.34 0.00 0.00 72.50 70.10 1xa6 s THR 212 CO -0.15 -0.29 0.52 -1.00 -0.54 0.00 0.00 174.62 173.16 1xa6 s HIS 213 N -2.10 3.32 -1.38 3.99 3.76 -1.26 -4.97 115.29 116.66 1xa6 s HIS 213 Ca 0.51 0.71 -0.08 0.00 -0.15 0.00 0.00 55.06 56.05 1xa6 s HIS 213 Cb -0.10 -2.70 0.09 0.00 1.11 0.00 0.00 32.58 30.98 1xa6 s HIS 213 CO 0.24 -0.19 2.32 -1.71 -0.85 0.00 0.00 174.74 174.56 1xa6 n ASN 214 N 5.16 6.93 -4.64 1.40 4.05 -1.26 -4.97 115.26 121.92 1xa6 n ASN 214 Ca -0.04 -3.01 -0.35 0.00 0.45 0.00 0.00 54.58 51.63 1xa6 n ASN 214 Cb 0.50 -1.46 0.11 0.00 1.23 0.00 0.00 39.78 40.16 1xa6 n ASN 214 CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 177.26 174.70 1xa6 n PHE 215 N 3.06 0.82 -3.70 1.20 3.72 -1.26 -1.85 117.46 119.45 1xa6 n PHE 215 Ca 0.58 0.39 -0.13 0.00 -0.05 0.00 0.00 57.45 58.23 1xa6 n PHE 215 Cb 0.29 -2.08 -0.09 0.00 -0.94 0.00 0.00 39.48 36.66 1xa6 n PHE 215 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1xa6 s LYS 216 N -3.68 0.58 0.60 -1.08 1.02 -1.25 -4.82 119.74 111.11 1xa6 s LYS 216 Ca 0.73 0.70 -0.19 0.00 0.02 0.00 0.00 55.97 57.22 1xa6 s LYS 216 Cb -0.31 0.28 -0.03 0.00 -0.52 0.00 0.00 37.83 37.24 1xa6 s LYS 216 CO 0.51 -0.07 1.21 1.55 -0.92 0.00 0.00 175.35 177.64 1xa6 n VAL 217 N 2.84 4.22 -3.72 3.17 3.14 -1.26 -0.44 118.33 126.28 1xa6 n VAL 217 Ca -0.14 -0.50 -0.13 0.00 -2.96 0.00 0.00 64.34 60.61 1xa6 n VAL 217 Cb 0.57 -1.44 -0.10 0.00 -1.06 0.00 0.00 33.84 31.81 1xa6 n VAL 217 CO 0.00 0.00 0.00 -2.28 -6.46 0.00 0.00 176.83 168.09 1xa6 s HIS 218 N -1.39 -0.47 -0.36 1.45 2.46 0.20 -4.66 115.29 112.53 1xa6 s HIS 218 Ca 0.77 1.12 -0.13 0.00 0.47 0.00 0.00 55.06 57.29 1xa6 s HIS 218 Cb -0.41 0.16 -0.00 0.00 -0.13 0.00 0.00 32.58 32.21 1xa6 s HIS 218 CO 0.45 -0.25 0.25 0.99 -2.47 0.00 0.00 174.74 173.72 1xa6 s THR 219 N 0.12 5.19 -0.01 0.89 2.01 -1.26 -3.58 115.64 119.00 1xa6 s THR 219 Ca -0.01 -0.41 -0.27 0.00 0.31 0.00 0.00 61.69 61.31 1xa6 s THR 219 Cb -0.03 -3.75 -0.04 0.00 0.01 0.00 0.00 72.50 68.69 1xa6 s THR 219 CO 0.01 -0.11 0.86 -0.36 -0.69 0.00 0.00 174.62 174.32 1xa6 s PHE 220 N 1.69 3.66 -0.74 4.92 0.40 -1.26 -5.00 117.98 121.64 1xa6 s PHE 220 Ca 0.05 1.53 -0.10 0.00 -0.60 0.00 0.00 56.93 57.81 1xa6 s PHE 220 Cb -0.18 -2.97 0.19 0.00 0.51 0.00 0.00 43.02 40.57 1xa6 s PHE 220 CO 0.10 0.08 0.64 1.03 0.70 0.00 0.00 175.22 177.77 1xa6 s ARG 221 N 0.71 3.22 0.00 0.44 0.52 -1.26 -4.88 118.95 117.70 1xa6 s ARG 221 Ca 0.45 -2.44 0.00 0.00 -0.52 0.00 0.00 55.73 53.22 1xa6 s ARG 221 Cb -0.20 -4.19 0.00 0.00 0.52 0.00 0.00 34.95 31.08 1xa6 s ARG 221 CO 0.24 -1.25 0.00 0.41 0.02 0.00 0.00 175.30 174.72 1xa6 n GLY 222 N 3.88 4.06 3.67 -3.53 0.00 -1.26 -5.04 105.19 106.97 1xa6 n GLY 222 Ca 0.10 -1.36 -0.47 0.00 0.00 0.00 0.00 46.02 44.29 1xa6 n GLY 222 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1xa6 n PRO 223 N -0.95 2.14 -4.26 1.61 -0.02 -1.26 -4.96 135.00 127.30 1xa6 n PRO 223 Ca 0.00 0.78 -0.20 0.00 -2.02 0.00 0.00 63.50 62.06 1xa6 n PRO 223 Cb 0.00 -2.57 -0.11 0.00 -0.02 0.00 0.00 33.50 30.80 1xa6 n PRO 223 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 1xa6 s HIS 224 N 1.88 1.53 0.05 6.00 3.76 -1.26 -4.46 115.29 122.79 1xa6 s HIS 224 Ca 0.83 -0.51 0.07 0.00 -0.15 0.00 0.00 55.06 55.31 1xa6 s HIS 224 Cb -0.69 -0.80 -0.03 0.00 1.11 0.00 0.00 32.58 32.18 1xa6 s HIS 224 CO 0.42 0.19 -0.21 -1.58 -0.85 0.00 0.00 174.74 172.71 1xa6 s TRP 225 N -1.91 1.81 -0.19 1.40 0.52 -1.26 -2.04 118.94 117.27 1xa6 s TRP 225 Ca 0.09 -0.38 -0.29 0.00 0.02 0.00 0.00 56.10 55.54 1xa6 s TRP 225 Cb -0.06 -1.06 -0.04 0.00 -1.15 0.00 0.00 33.47 31.15 1xa6 s TRP 225 CO 0.04 0.11 1.92 0.00 0.02 0.00 0.00 176.95 179.04 1xa6 n GLU 227 N 8.15 0.11 0.00 0.00 4.71 -0.58 0.51 120.64 133.54 1xa6 n GLU 227 Ca 0.24 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.39 1xa6 n GLU 227 Cb 0.45 -1.03 0.00 0.00 -1.01 0.00 0.00 31.44 29.85 1xa6 n GLU 227 CO 0.00 0.00 0.00 0.98 0.09 0.00 0.00 177.13 178.20 1xa6 n TYR 228 N -0.07 0.00 1.43 -0.32 9.36 -1.26 -4.38 117.16 121.92 1xa6 n TYR 228 Ca 0.00 0.00 0.04 0.00 3.32 0.00 0.00 57.90 61.26 1xa6 n TYR 228 Cb 0.01 0.00 0.13 0.00 -0.63 0.00 0.00 39.34 38.85 1xa6 n TYR 228 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1xa6 n ALA 230 N 0.01 -1.20 -2.56 0.00 0.00 0.18 -4.90 120.51 112.04 1xa6 n ALA 230 Ca 0.07 -0.21 -0.26 0.00 0.00 0.00 0.00 53.44 53.04 1xa6 n ALA 230 Cb 0.16 -2.47 -0.11 0.00 0.00 0.00 0.00 19.45 17.03 1xa6 n ALA 230 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1xa6 s ASN 231 N -3.23 3.79 0.23 0.00 3.84 -1.24 -2.80 114.94 115.53 1xa6 s ASN 231 Ca 0.82 -1.24 -0.31 0.00 0.21 0.00 0.00 52.86 52.35 1xa6 s ASN 231 Cb -0.48 -0.37 -0.10 0.00 -0.55 0.00 0.00 41.25 39.75 1xa6 s ASN 231 CO 1.02 -0.27 1.52 0.12 -2.79 0.00 0.00 177.10 176.70 1xa6 s PHE 232 N -2.63 2.97 -0.80 0.43 5.36 -1.26 -0.40 117.98 121.65 1xa6 s PHE 232 Ca 0.33 0.83 -0.17 0.00 -0.96 0.00 0.00 56.93 56.96 1xa6 s PHE 232 Cb 0.04 -3.91 0.15 0.00 -0.34 0.00 0.00 43.02 38.96 1xa6 s PHE 232 CO 0.17 -3.14 0.89 -1.64 -1.46 0.00 0.00 175.22 170.05 1xa6 s MET 233 N 0.11 3.44 0.84 10.12 -1.94 -0.86 -4.85 119.30 126.15 1xa6 s MET 233 Ca 0.64 -1.84 -0.12 0.00 -1.71 0.00 0.00 55.69 52.65 1xa6 s MET 233 Cb -0.44 -4.57 0.09 0.00 2.01 0.00 0.00 34.83 31.93 1xa6 s MET 233 CO 0.40 -1.56 1.14 1.67 -0.01 0.00 0.00 175.02 176.67 1xa6 s TRP 234 N 1.91 2.80 0.00 -0.03 -2.14 -1.26 -4.67 118.94 115.56 1xa6 s TRP 234 Ca 0.22 0.88 0.00 0.00 2.66 0.00 0.00 56.10 59.86 1xa6 s TRP 234 Cb -0.12 -3.36 0.00 0.00 -3.10 0.00 0.00 33.47 26.89 1xa6 s TRP 234 CO -0.05 -1.94 0.00 0.41 -2.66 0.00 0.00 176.95 172.71 1xa6 n GLY 235 N -2.68 2.97 0.09 3.67 0.00 -1.26 -3.74 105.19 104.24 1xa6 n GLY 235 Ca 0.07 -1.80 -0.13 0.00 0.00 0.00 0.00 46.02 44.16 1xa6 n GLY 235 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1xa6 h LEU 236 N 0.00 0.27 0.00 0.99 6.46 -1.93 -3.43 115.31 117.67 1xa6 h LEU 236 Ca 0.00 -0.30 0.00 0.00 -0.12 0.00 0.00 57.88 57.46 1xa6 h LEU 236 Cb 0.00 -0.09 0.00 0.00 -0.73 0.00 0.00 40.66 39.84 1xa6 h LEU 236 CO 0.00 1.23 0.00 0.00 -0.62 0.00 0.00 178.44 179.05 1xa6 n ILE 237 N -3.46 0.00 0.00 4.05 3.06 -1.26 -4.92 119.36 116.83 1xa6 n ILE 237 Ca -0.06 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.19 1xa6 n ILE 237 Cb 1.00 0.24 0.00 0.00 0.54 0.00 0.00 39.64 41.42 1xa6 n ILE 237 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1xa6 n ALA 238 N 0.00 -0.28 -0.42 1.51 0.00 -1.26 -4.36 120.51 115.69 1xa6 n ALA 238 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1xa6 n ALA 238 Cb 0.00 0.09 0.00 0.00 0.00 0.00 0.00 19.45 19.54 1xa6 n ALA 238 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1xa6 n GLN 239 N -1.75 0.00 0.00 0.00 1.13 -1.25 -4.55 117.38 110.96 1xa6 n GLN 239 Ca 0.00 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 1xa6 n GLN 239 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.35 1xa6 n GLN 239 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1xa6 n GLY 240 N 0.00 1.27 3.33 1.08 0.00 -1.23 -4.60 105.19 105.04 1xa6 n GLY 240 Ca 0.00 -0.35 -0.27 0.00 0.00 0.00 0.00 46.02 45.40 1xa6 n GLY 240 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1xa6 s VAL 241 N -1.24 1.98 -0.33 1.61 -7.23 0.94 -0.62 120.40 115.51 1xa6 s VAL 241 Ca 0.00 -1.61 0.02 0.00 -1.81 0.00 0.00 61.98 58.59 1xa6 s VAL 241 Cb 0.00 -1.77 0.10 0.00 0.56 0.00 0.00 36.38 35.27 1xa6 s VAL 241 CO 0.00 0.05 0.07 -0.60 -0.31 0.00 0.00 175.10 174.31 1xa6 s ARG 242 N -1.88 1.22 0.28 4.82 3.52 0.41 -1.00 118.95 126.32 1xa6 s ARG 242 Ca 0.10 -1.61 -0.24 0.00 -0.13 0.00 0.00 55.73 53.85 1xa6 s ARG 242 Cb -0.10 -2.79 -0.16 0.00 -1.56 0.00 0.00 34.95 30.34 1xa6 s ARG 242 CO 0.05 -0.96 0.33 0.00 -0.81 0.00 0.00 175.30 173.90 1xa6 h SER 244 N 0.69 0.00 0.00 0.00 0.02 -1.68 -3.16 113.55 109.41 1xa6 h SER 244 Ca -0.31 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.63 1xa6 h SER 244 Cb 1.40 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.94 1xa6 h SER 244 CO 0.51 0.81 -0.35 0.44 -1.14 0.00 0.00 176.83 177.10 1xa6 h ASP 245 N 0.00 0.00 0.25 3.07 5.19 -1.89 -3.39 116.42 119.65 1xa6 h ASP 245 Ca -0.15 -0.04 0.00 0.00 -0.62 0.00 0.00 57.03 56.22 1xa6 h ASP 245 Cb 1.75 0.00 0.00 0.00 0.18 0.00 0.00 39.33 41.26 1xa6 h ASP 245 CO 0.08 0.70 -0.05 0.00 -3.12 0.00 0.00 179.24 176.84 1xa6 n GLY 247 N 1.20 1.52 3.32 0.00 0.00 -1.19 -4.16 105.19 105.88 1xa6 n GLY 247 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 1xa6 n GLY 247 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1xa6 n LEU 248 N 0.00 -1.51 -3.57 0.99 7.94 -1.26 -4.68 117.00 114.92 1xa6 n LEU 248 Ca 0.00 0.15 -0.12 0.00 -1.11 0.00 0.00 56.01 54.94 1xa6 n LEU 248 Cb 0.00 -1.06 -0.11 0.00 0.53 0.00 0.00 43.42 42.78 1xa6 n LEU 248 CO 0.00 -3.61 -0.08 0.20 -1.11 0.00 0.00 177.39 172.79 1xa6 s ASN 249 N -1.84 0.29 0.36 1.96 0.01 -1.26 -2.13 114.94 112.33 1xa6 s ASN 249 Ca 0.54 0.52 -0.05 0.00 -0.71 0.00 0.00 52.86 53.16 1xa6 s ASN 249 Cb -0.17 0.93 0.01 0.00 0.41 0.00 0.00 41.25 42.44 1xa6 s ASN 249 CO 0.68 -0.26 0.55 0.68 -1.51 0.00 0.00 177.10 177.24 1xa6 s VAL 250 N 2.49 0.00 0.80 1.60 -7.23 -0.17 -1.53 120.40 116.36 1xa6 s VAL 250 Ca 0.04 -1.48 -0.12 0.00 -1.81 0.00 0.00 61.98 58.61 1xa6 s VAL 250 Cb -0.13 -2.72 0.08 0.00 0.56 0.00 0.00 36.38 34.17 1xa6 s VAL 250 CO -0.12 0.00 1.14 -1.00 -0.31 0.00 0.00 175.10 174.81 1xa6 s HIS 251 N -2.82 2.11 0.07 2.82 3.76 -1.26 -0.04 115.29 119.93 1xa6 s HIS 251 Ca 0.28 1.65 -0.34 0.00 -0.15 0.00 0.00 55.06 56.49 1xa6 s HIS 251 Cb -0.02 -3.27 -0.18 0.00 1.11 0.00 0.00 32.58 30.22 1xa6 s HIS 251 CO 0.19 -2.35 1.60 -0.22 -0.85 0.00 0.00 174.74 173.11 1xa6 h LYS 252 N -1.05 -0.99 0.00 1.40 3.64 -1.88 -2.88 116.57 114.81 1xa6 h LYS 252 Ca -0.45 0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.00 1xa6 h LYS 252 Cb 1.26 0.23 0.00 0.00 -0.41 0.00 0.00 32.23 33.31 1xa6 h LYS 252 CO 0.48 -0.66 0.00 1.04 -2.27 0.00 0.00 179.45 178.04 1xa6 n GLN 253 N -5.55 0.00 -0.39 1.90 3.00 -1.26 -1.91 117.38 113.17 1xa6 n GLN 253 Ca -0.14 0.65 0.31 0.00 -0.01 0.00 0.00 57.00 57.81 1xa6 n GLN 253 Cb 0.43 -1.39 0.49 0.00 0.00 0.00 0.00 30.24 29.77 1xa6 n GLN 253 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1xa6 h SER 255 N 0.00 0.40 -0.37 0.00 0.02 -1.15 0.14 113.55 112.59 1xa6 h SER 255 Ca 0.59 0.04 -0.07 0.00 -0.84 0.00 0.00 61.79 61.52 1xa6 h SER 255 Cb 2.18 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 64.67 1xa6 h SER 255 CO -0.14 0.16 -0.04 0.11 -1.14 0.00 0.00 176.83 175.78 1xa6 h LYS 256 N 0.40 0.68 0.00 3.45 1.79 0.10 -3.21 116.57 119.79 1xa6 h LYS 256 Ca 0.46 -0.24 0.00 0.00 -2.18 0.00 0.00 60.65 58.70 1xa6 h LYS 256 Cb 1.16 -0.05 0.00 0.00 -1.58 0.00 0.00 32.23 31.76 1xa6 h LYS 256 CO -0.17 0.81 -0.07 0.45 -1.08 0.00 0.00 179.45 179.39 1xa6 h HIS 257 N 0.49 0.00 -2.89 -1.35 3.86 -0.96 -3.45 115.15 110.85 1xa6 h HIS 257 Ca 0.10 0.00 -0.57 0.00 -1.16 0.00 0.00 60.37 58.74 1xa6 h HIS 257 Cb 0.53 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 28.96 1xa6 h HIS 257 CO 0.04 0.00 0.92 0.54 0.86 0.00 0.00 177.93 180.30 1xa6 s VAL 258 N -3.15 4.21 1.01 2.45 0.11 0.14 -5.00 120.40 120.18 1xa6 s VAL 258 Ca 0.09 1.46 -0.15 0.00 -2.93 0.00 0.00 61.98 60.45 1xa6 s VAL 258 Cb 0.10 -3.95 0.05 0.00 -1.53 0.00 0.00 36.38 31.05 1xa6 s VAL 258 CO 0.63 -0.14 0.21 -2.65 -3.33 0.00 0.00 175.10 169.82 1xa6 n PRO 259 N 6.69 -0.72 0.00 1.54 -0.02 -1.26 -4.98 135.00 136.25 1xa6 n PRO 259 Ca 0.14 -0.18 0.00 0.00 -2.02 0.00 0.00 63.50 61.44 1xa6 n PRO 259 Cb 0.45 -1.77 0.00 0.00 -0.02 0.00 0.00 33.50 32.16 1xa6 n PRO 259 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1xa6 n ASN 260 N -1.25 0.00 0.00 2.55 3.02 -1.26 -4.74 115.26 113.57 1xa6 n ASN 260 Ca 0.04 0.65 0.00 0.00 -0.03 0.00 0.00 54.58 55.24 1xa6 n ASN 260 Cb 0.57 -0.26 0.00 0.00 -0.61 0.00 0.00 39.78 39.48 1xa6 n ASN 260 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 1xa6 n ASP 261 N -1.27 0.00 -1.32 6.41 5.75 -1.22 -4.69 116.55 120.22 1xa6 n ASP 261 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.78 1xa6 n ASP 261 Cb 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.09 1xa6 n ASP 261 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1xa6 s GLN 263 N -2.80 1.27 0.00 0.00 -0.21 -1.26 -4.82 119.66 111.84 1xa6 s GLN 263 Ca 0.00 -2.16 0.00 0.00 0.02 0.00 0.00 55.36 53.22 1xa6 s GLN 263 Cb 0.00 -2.11 0.00 0.00 1.00 0.00 0.00 33.01 31.90 1xa6 s GLN 263 CO 0.00 -1.25 0.58 -0.35 -2.12 0.00 0.00 175.29 172.15 1xa6 n PRO 264 N 3.17 0.00 -0.00 2.91 -0.04 -1.26 0.13 135.00 139.90 1xa6 n PRO 264 Ca 0.17 0.09 0.09 0.00 -0.04 0.00 0.00 63.50 63.81 1xa6 n PRO 264 Cb 0.39 -1.90 -0.11 0.00 -0.04 0.00 0.00 33.50 31.83 1xa6 n PRO 264 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1xa6 n ASP 265 N -1.08 0.93 -0.24 3.54 5.75 -1.26 -4.01 116.55 120.18 1xa6 n ASP 265 Ca 0.00 -0.95 0.00 0.00 -0.01 0.00 0.00 54.79 53.83 1xa6 n ASP 265 Cb 0.40 1.02 0.01 0.00 -1.03 0.00 0.00 41.12 41.52 1xa6 n ASP 265 CO 0.00 0.00 0.00 -0.11 -0.11 0.00 0.00 177.20 176.98 1xa6 n LEU 266 N -1.49 0.52 -0.08 -2.12 7.94 0.35 -2.78 117.00 119.34 1xa6 n LEU 266 Ca 0.04 -0.26 -0.10 0.00 -1.11 0.00 0.00 56.01 54.58 1xa6 n LEU 266 Cb 0.32 -0.21 -0.15 0.00 0.53 0.00 0.00 43.42 43.90 1xa6 n LEU 266 CO 0.41 0.12 -0.99 1.17 -1.11 0.00 0.00 177.39 176.99 1xa6 n LYS 267 N -0.26 0.67 0.00 1.96 4.81 -1.26 -4.10 118.16 119.99 1xa6 n LYS 267 Ca 0.01 0.09 0.00 0.00 -0.87 0.00 0.00 58.31 57.53 1xa6 n LYS 267 Cb 0.12 -1.60 0.00 0.00 0.02 0.00 0.00 35.03 33.57 1xa6 n LYS 267 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 1xa6 n ARG 268 N -2.87 0.00 0.00 1.64 1.74 -1.12 -3.62 116.66 112.43 1xa6 n ARG 268 Ca -0.29 0.10 0.00 0.00 -0.77 0.00 0.00 57.85 56.88 1xa6 n ARG 268 Cb 1.12 -1.51 0.00 0.00 -1.02 0.00 0.00 32.46 31.05 1xa6 n ARG 268 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 1xa6 n ILE 269 N -1.05 0.00 -1.85 0.55 5.41 -1.26 -4.90 119.36 116.27 1xa6 n ILE 269 Ca 0.00 0.87 -0.02 0.00 1.00 0.00 0.00 62.75 64.60 1xa6 n ILE 269 Cb 0.01 -1.75 0.00 0.00 -0.71 0.00 0.00 39.64 37.20 1xa6 n ILE 269 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 1xa6 n LYS 270 N -1.65 -0.73 -2.18 0.38 5.02 -1.24 -3.64 118.16 114.13 1xa6 n LYS 270 Ca 0.00 0.99 -0.41 0.00 -2.02 0.00 0.00 58.31 56.87 1xa6 n LYS 270 Cb 0.00 -2.50 -0.03 0.00 -0.02 0.00 0.00 35.03 32.49 1xa6 n LYS 270 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1xa6 s LYS 271 N -1.15 4.39 -0.11 1.97 1.02 -1.26 -3.61 119.74 121.00 1xa6 s LYS 271 Ca 0.05 2.13 0.06 0.00 0.02 0.00 0.00 55.97 58.23 1xa6 s LYS 271 Cb -0.01 -3.13 -0.11 0.00 -0.52 0.00 0.00 37.83 34.06 1xa6 s LYS 271 CO 0.21 -0.20 -0.02 1.33 -0.92 0.00 0.00 175.35 175.75 1xa6 n VAL 272 N 1.67 0.68 -2.68 3.17 0.24 -1.26 -4.80 118.33 115.34 1xa6 n VAL 272 Ca 0.03 -0.36 -0.43 0.00 -2.04 0.00 0.00 64.34 61.54 1xa6 n VAL 272 Cb 0.42 -0.81 -0.02 0.00 -1.47 0.00 0.00 33.84 31.96 1xa6 n VAL 272 CO 0.00 0.00 0.00 -0.31 -2.14 0.00 0.00 176.83 174.38 1xa6 s TYR 273 N -2.24 3.39 0.00 6.34 1.51 -1.26 -3.84 117.35 121.26 1xa6 s TYR 273 Ca -0.09 1.49 0.00 0.00 -1.01 0.00 0.00 57.07 57.46 1xa6 s TYR 273 Cb 0.03 -3.23 0.00 0.00 -0.11 0.00 0.00 41.96 38.65 1xa6 s TYR 273 CO 0.36 -0.39 0.00 0.00 -1.11 0.00 0.00 175.55 174.41 1xa6 n ASP 276 N 0.73 -0.83 0.35 0.00 4.64 -1.26 -4.66 116.55 115.52 1xa6 n ASP 276 Ca -0.09 0.67 -0.16 0.00 -1.38 0.00 0.00 54.79 53.83 1xa6 n ASP 276 Cb 0.52 -0.57 -0.08 0.00 -1.04 0.00 0.00 41.12 39.95 1xa6 n ASP 276 CO 0.00 0.00 0.00 0.25 -0.82 0.00 0.00 177.20 176.63 1xa6 h LEU 277 N 0.57 -0.96 -0.83 -2.67 5.85 -1.96 -1.84 115.31 113.48 1xa6 h LEU 277 Ca -0.17 0.05 0.15 0.00 0.84 0.00 0.00 57.88 58.75 1xa6 h LEU 277 Cb 0.87 0.27 -0.10 0.00 0.37 0.00 0.00 40.66 42.08 1xa6 h LEU 277 CO 0.34 -0.60 0.40 0.74 -0.34 0.00 0.00 178.44 178.98 1xa6 h THR 278 N -0.97 0.70 0.11 1.05 2.02 -1.93 -1.01 112.91 112.88 1xa6 h THR 278 Ca -0.09 -0.19 -0.01 0.00 0.77 0.00 0.00 66.41 66.89 1xa6 h THR 278 Cb 0.77 0.08 0.00 0.00 -1.74 0.00 0.00 68.15 67.26 1xa6 h THR 278 CO 0.10 0.10 -0.05 0.74 0.37 0.00 0.00 175.52 176.78 1xa6 h THR 279 N 0.56 0.94 -0.18 3.16 2.02 -1.90 -0.28 112.91 117.23 1xa6 h THR 279 Ca 0.46 -0.16 0.04 0.00 0.77 0.00 0.00 66.41 67.51 1xa6 h THR 279 Cb 0.67 1.05 -0.04 0.00 -1.74 0.00 0.00 68.15 68.09 1xa6 h THR 279 CO -0.38 0.04 -0.06 0.25 0.37 0.00 0.00 175.52 175.74 1xa6 h LEU 280 N -0.22 -0.22 0.58 2.58 7.12 -0.48 -0.13 115.31 124.54 1xa6 h LEU 280 Ca -0.01 0.06 -0.02 0.00 0.13 0.00 0.00 57.88 58.04 1xa6 h LEU 280 Cb 0.18 0.13 -0.01 0.00 -0.53 0.00 0.00 40.66 40.43 1xa6 h LEU 280 CO 0.02 -0.08 -0.43 0.58 -0.13 0.00 0.00 178.44 178.40 1xa6 h VAL 281 N -0.03 0.14 -0.77 1.05 2.07 -1.13 -0.94 116.25 116.64 1xa6 h VAL 281 Ca 0.09 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.75 1xa6 h VAL 281 Cb 0.17 0.14 -0.09 0.00 -1.52 0.00 0.00 31.29 29.99 1xa6 h VAL 281 CO -0.20 0.00 0.34 0.11 0.02 0.00 0.00 177.57 177.84 1xa6 h LYS 282 N -0.98 0.50 -0.29 1.57 1.57 -0.79 0.11 116.57 118.26 1xa6 h LYS 282 Ca -0.07 -0.03 -0.11 0.00 -1.87 0.00 0.00 60.65 58.58 1xa6 h LYS 282 Cb 0.82 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 33.00 1xa6 h LYS 282 CO 0.02 0.33 -0.27 0.00 -0.57 0.00 0.00 179.45 178.97 1xa6 h ALA 283 N 1.53 1.01 -0.01 3.86 0.00 -0.83 -2.86 119.26 121.96 1xa6 h ALA 283 Ca 0.42 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1xa6 h ALA 283 Cb 0.60 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1xa6 h ALA 283 CO -0.37 0.59 -0.18 0.72 0.00 0.00 0.00 179.25 180.01 1xa6 n HIS 284 N -4.10 0.00 -2.95 0.00 8.25 -0.37 -4.99 115.22 111.06 1xa6 n HIS 284 Ca -0.00 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.42 1xa6 n HIS 284 Cb 0.43 -0.07 0.02 0.00 1.12 0.00 0.00 29.99 31.49 1xa6 n HIS 284 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1xa6 n ASN 285 N -0.26 -6.95 -0.41 0.41 4.05 0.28 -5.01 115.26 107.36 1xa6 n ASN 285 Ca 0.14 -0.22 0.00 0.00 0.45 0.00 0.00 54.58 54.95 1xa6 n ASN 285 Cb 0.37 -4.85 0.00 0.00 1.23 0.00 0.00 39.78 36.53 1xa6 n ASN 285 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 177.26 174.56 1xa6 n THR 286 N -2.06 0.00 0.00 -0.44 -2.24 -1.06 -5.04 114.28 103.44 1xa6 n THR 286 Ca -0.02 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 1xa6 n THR 286 Cb 0.53 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.76 1xa6 n THR 286 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 1xa6 n GLN 287 N 0.00 0.00 -4.69 -0.78 -0.06 -1.26 -4.66 117.38 105.93 1xa6 n GLN 287 Ca 0.00 0.00 -0.25 0.00 -2.00 0.00 0.00 57.00 54.75 1xa6 n GLN 287 Cb 0.47 0.00 -0.16 0.00 -4.06 0.00 0.00 30.24 26.49 1xa6 n GLN 287 CO 0.00 0.00 0.00 1.03 -0.20 0.00 0.00 177.06 177.89 1xa6 s ARG 288 N 0.00 1.59 -0.26 3.69 0.52 -1.26 -4.59 118.95 118.64 1xa6 s ARG 288 Ca 0.00 -0.50 -0.39 0.00 -0.52 0.00 0.00 55.73 54.31 1xa6 s ARG 288 Cb 0.00 -1.38 -0.15 0.00 0.52 0.00 0.00 34.95 33.94 1xa6 s ARG 288 CO 0.00 0.17 1.78 -2.30 0.02 0.00 0.00 175.30 174.97 1xa6 n PRO 289 N 3.30 1.31 0.29 3.54 -0.02 -1.26 -4.80 135.00 137.36 1xa6 n PRO 289 Ca -0.19 0.48 0.15 0.00 -2.02 0.00 0.00 63.50 61.92 1xa6 n PRO 289 Cb 0.53 -2.19 0.71 0.00 -0.02 0.00 0.00 33.50 32.53 1xa6 n PRO 289 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1xa6 h MET 290 N 7.61 0.00 0.04 -0.52 -0.00 -1.96 -1.45 114.93 118.65 1xa6 h MET 290 Ca -0.47 0.00 -0.00 0.00 -0.00 0.00 0.00 59.70 59.23 1xa6 h MET 290 Cb 1.31 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.91 1xa6 h MET 290 CO 0.96 0.00 -0.02 0.28 -0.00 0.00 0.00 176.91 178.13 1xa6 h VAL 291 N 0.00 0.00 -1.43 -0.10 2.07 -1.92 -2.48 116.25 112.39 1xa6 h VAL 291 Ca 0.04 -0.07 0.43 0.00 0.82 0.00 0.00 66.70 67.92 1xa6 h VAL 291 Cb 0.92 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 30.62 1xa6 h VAL 291 CO -0.00 0.00 1.01 0.52 0.02 0.00 0.00 177.57 179.12 1xa6 n VAL 292 N -2.33 -0.04 0.03 2.57 0.31 -0.59 -0.37 118.33 117.90 1xa6 n VAL 292 Ca -0.01 1.19 -0.02 0.00 -0.01 0.00 0.00 64.34 65.49 1xa6 n VAL 292 Cb 0.02 -1.97 -0.01 0.00 -0.91 0.00 0.00 33.84 30.97 1xa6 n VAL 292 CO 0.00 0.00 0.00 -0.78 -1.32 0.00 0.00 176.83 174.73 1xa6 h ASP 293 N 0.00 -0.10 -0.39 4.52 3.58 -1.43 -3.18 116.42 119.42 1xa6 h ASP 293 Ca 0.71 0.00 0.08 0.00 0.42 0.00 0.00 57.03 58.25 1xa6 h ASP 293 Cb 2.76 0.03 -0.09 0.00 1.72 0.00 0.00 39.33 43.75 1xa6 h ASP 293 CO -0.08 0.09 -0.30 0.40 -2.88 0.00 0.00 179.24 176.47 1xa6 h ILE 294 N -0.44 0.27 0.00 2.25 1.08 -0.22 -1.26 117.51 119.18 1xa6 h ILE 294 Ca -0.01 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.46 1xa6 h ILE 294 Cb 0.09 0.27 0.00 0.00 -3.07 0.00 0.00 36.82 34.11 1xa6 h ILE 294 CO 0.02 0.00 0.00 0.00 -0.69 0.00 0.00 178.15 177.48 1xa6 h ILE 296 N 0.00 0.17 -0.58 0.00 2.04 -1.47 -0.47 117.51 117.21 1xa6 h ILE 296 Ca 0.00 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.91 1xa6 h ILE 296 Cb 0.00 0.17 -0.07 0.00 -0.74 0.00 0.00 36.82 36.18 1xa6 h ILE 296 CO 0.00 0.00 -0.34 -1.14 0.00 0.00 0.00 178.15 176.67 1xa6 n ARG 297 N -5.46 -0.25 0.33 2.37 0.63 -0.42 -0.45 116.66 113.41 1xa6 n ARG 297 Ca 0.07 1.13 -0.18 0.00 -0.92 0.00 0.00 57.85 57.95 1xa6 n ARG 297 Cb 0.37 -1.67 -0.09 0.00 0.45 0.00 0.00 32.46 31.52 1xa6 n ARG 297 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 1xa6 h GLU 298 N 0.00 -0.97 -1.07 -0.14 4.39 -0.34 0.44 114.58 116.89 1xa6 h GLU 298 Ca 0.09 0.07 0.36 0.00 0.34 0.00 0.00 59.36 60.22 1xa6 h GLU 298 Cb 0.24 0.22 -0.15 0.00 -0.10 0.00 0.00 28.75 28.96 1xa6 h GLU 298 CO -0.54 -0.65 0.63 0.82 -1.16 0.00 0.00 179.01 178.11 1xa6 h ILE 299 N -1.01 0.22 0.00 3.13 2.04 -0.04 0.54 117.51 122.40 1xa6 h ILE 299 Ca -0.07 -0.07 -0.20 0.00 1.00 0.00 0.00 64.86 65.52 1xa6 h ILE 299 Cb 0.85 -0.02 0.02 0.00 -0.74 0.00 0.00 36.82 36.93 1xa6 h ILE 299 CO -0.00 0.04 -0.77 -0.33 0.00 0.00 0.00 178.15 177.08 1xa6 h GLU 300 N 0.22 0.52 0.19 2.37 5.08 -0.26 -3.24 114.58 119.46 1xa6 h GLU 300 Ca 0.77 -0.56 0.01 0.00 -1.00 0.00 0.00 59.36 58.58 1xa6 h GLU 300 Cb 1.97 0.16 -0.04 0.00 0.50 0.00 0.00 28.75 31.34 1xa6 h GLU 300 CO -0.58 1.19 -0.42 0.00 -1.00 0.00 0.00 179.01 178.20 1xa6 h ALA 301 N 0.34 -0.79 -3.00 3.43 0.00 0.21 -3.40 119.26 116.05 1xa6 h ALA 301 Ca -0.10 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1xa6 h ALA 301 Cb 1.47 0.68 0.00 0.00 0.00 0.00 0.00 17.79 19.94 1xa6 h ALA 301 CO 0.15 -1.01 0.00 0.54 0.00 0.00 0.00 179.25 178.94 1xa6 n ARG 302 N -5.48 3.62 -0.89 0.00 1.74 0.84 -4.82 116.66 111.67 1xa6 n ARG 302 Ca -0.08 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.00 1xa6 n ARG 302 Cb 0.39 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.83 1xa6 n ARG 302 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1xa6 n GLY 303 N 5.00 0.00 0.11 -0.13 0.00 -1.25 -4.50 105.19 104.42 1xa6 n GLY 303 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.10 1xa6 n GLY 303 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1xa6 h LEU 304 N 6.33 0.00 -3.20 0.99 6.46 -1.78 -3.28 115.31 120.83 1xa6 h LEU 304 Ca 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.76 1xa6 h LEU 304 Cb 0.47 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.40 1xa6 h LEU 304 CO 0.47 0.17 0.00 2.29 -0.62 0.00 0.00 178.44 180.75 1xa6 n LYS 305 N -2.77 3.23 -1.73 1.25 2.85 -1.26 -4.82 118.16 114.91 1xa6 n LYS 305 Ca -0.02 -2.72 -0.33 0.00 -1.05 0.00 0.00 58.31 54.19 1xa6 n LYS 305 Cb 0.63 -1.78 0.05 0.00 -0.65 0.00 0.00 35.03 33.28 1xa6 n LYS 305 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 1xa6 s SER 306 N -1.50 5.17 0.23 -5.58 0.15 -1.24 -4.41 113.70 106.51 1xa6 s SER 306 Ca 0.41 1.91 -0.23 0.00 0.70 0.00 0.00 55.95 58.74 1xa6 s SER 306 Cb 0.30 -2.54 -0.09 0.00 -1.71 0.00 0.00 66.02 61.99 1xa6 s SER 306 CO 0.13 -1.59 0.79 -1.61 1.20 0.00 0.00 173.24 172.16 1xa6 s GLU 307 N -4.27 4.44 -1.61 5.44 2.02 -1.26 -4.10 118.70 119.37 1xa6 s GLU 307 Ca 0.65 1.08 -0.02 0.00 0.02 0.00 0.00 54.97 56.70 1xa6 s GLU 307 Cb -0.19 -3.00 0.00 0.00 0.10 0.00 0.00 34.13 31.04 1xa6 s GLU 307 CO 0.44 0.43 0.21 0.41 0.02 0.00 0.00 175.26 176.76 1xa6 n GLY 308 N 1.00 -0.45 3.58 -1.39 0.00 0.17 -4.84 105.19 103.27 1xa6 n GLY 308 Ca -0.03 -0.01 -0.54 0.00 0.00 0.00 0.00 46.02 45.44 1xa6 n GLY 308 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1xa6 n LEU 309 N -3.18 1.30 0.00 0.99 4.77 -1.26 -0.36 117.00 119.26 1xa6 n LEU 309 Ca -0.19 1.13 0.00 0.00 -0.03 0.00 0.00 56.01 56.92 1xa6 n LEU 309 Cb 0.66 -1.12 0.00 0.00 -2.33 0.00 0.00 43.42 40.63 1xa6 n LEU 309 CO 0.33 -1.20 0.00 -1.22 -1.33 0.00 0.00 177.39 173.97 1xa6 n TYR 310 N 2.52 0.00 -0.12 -1.77 0.53 -1.26 -4.71 117.16 112.34 1xa6 n TYR 310 Ca 0.20 0.00 -0.26 0.00 -1.02 0.00 0.00 57.90 56.82 1xa6 n TYR 310 Cb 0.15 -0.65 -0.09 0.00 -1.03 0.00 0.00 39.34 37.72 1xa6 n TYR 310 CO 0.00 0.00 0.00 -2.13 -1.02 0.00 0.00 176.86 173.71 1xa6 n ARG 311 N -2.00 0.53 -2.13 -0.72 0.63 0.51 -4.86 116.66 108.63 1xa6 n ARG 311 Ca 0.00 0.22 -0.39 0.00 -0.92 0.00 0.00 57.85 56.76 1xa6 n ARG 311 Cb 0.00 -1.39 -0.01 0.00 0.45 0.00 0.00 32.46 31.51 1xa6 n ARG 311 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 1xa6 s VAL 312 N -2.46 2.80 0.09 5.15 1.01 -0.51 -5.03 120.40 121.46 1xa6 s VAL 312 Ca -0.34 0.69 0.02 0.00 0.00 0.00 0.00 61.98 62.35 1xa6 s VAL 312 Cb 0.13 -3.40 -0.04 0.00 0.00 0.00 0.00 36.38 33.07 1xa6 s VAL 312 CO 0.45 0.09 0.17 -0.94 0.00 0.00 0.00 175.10 174.87 1xa6 s SER 313 N -0.89 5.98 0.46 3.32 1.04 -1.26 -4.91 113.70 117.45 1xa6 s SER 313 Ca 0.57 0.11 0.07 0.00 0.48 0.00 0.00 55.95 57.18 1xa6 s SER 313 Cb -0.35 -1.73 0.07 0.00 0.10 0.00 0.00 66.02 64.10 1xa6 s SER 313 CO 0.45 0.14 0.55 0.61 0.98 0.00 0.00 173.24 175.97 1xa6 n GLY 314 N 0.12 2.21 3.58 7.32 0.00 -1.23 -4.92 105.19 112.27 1xa6 n GLY 314 Ca -0.07 -2.23 -0.40 0.00 0.00 0.00 0.00 46.02 43.33 1xa6 n GLY 314 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1xa6 s PHE 315 N -2.00 1.13 0.17 1.61 5.36 -1.26 -4.82 117.98 118.17 1xa6 s PHE 315 Ca 0.42 1.05 -0.27 0.00 -0.96 0.00 0.00 56.93 57.17 1xa6 s PHE 315 Cb -0.03 -3.76 0.02 0.00 -0.34 0.00 0.00 43.02 38.91 1xa6 s PHE 315 CO 0.27 -3.30 1.55 0.00 -1.46 0.00 0.00 175.22 172.28 1xa6 h THR 316 N 7.42 0.03 0.00 0.12 1.03 -1.99 1.56 112.91 121.08 1xa6 h THR 316 Ca -0.33 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.07 1xa6 h THR 316 Cb 1.25 0.03 0.00 0.00 -1.07 0.00 0.00 68.15 68.36 1xa6 h THR 316 CO 1.06 0.00 0.00 1.21 -0.01 0.00 0.00 175.52 177.78 1xa6 n GLU 317 N -5.36 0.00 -0.03 0.00 2.13 -1.26 -0.12 120.64 116.00 1xa6 n GLU 317 Ca 0.03 0.11 0.02 0.00 0.66 0.00 0.00 57.16 57.98 1xa6 n GLU 317 Cb 0.33 -1.50 -0.11 0.00 0.27 0.00 0.00 31.44 30.42 1xa6 n GLU 317 CO 0.00 0.00 0.00 0.72 -0.41 0.00 0.00 177.13 177.44 1xa6 n HIS 318 N -1.11 0.00 -0.05 4.31 8.25 0.52 -3.98 115.22 123.15 1xa6 n HIS 318 Ca 0.00 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.33 1xa6 n HIS 318 Cb 0.00 -0.49 -0.07 0.00 1.12 0.00 0.00 29.99 30.55 1xa6 n HIS 318 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 1xa6 h ILE 319 N 0.00 1.33 -0.88 1.59 2.04 0.94 -2.67 117.51 119.87 1xa6 h ILE 319 Ca -0.16 -1.20 0.20 0.00 1.00 0.00 0.00 64.86 64.71 1xa6 h ILE 319 Cb 1.18 1.81 -0.12 0.00 -0.74 0.00 0.00 36.82 38.95 1xa6 h ILE 319 CO 0.01 0.35 0.39 -0.33 0.00 0.00 0.00 178.15 178.57 1xa6 h GLU 320 N -0.03 0.42 -0.80 2.37 4.39 -1.58 0.43 114.58 119.78 1xa6 h GLU 320 Ca 0.03 -0.03 0.04 0.00 0.34 0.00 0.00 59.36 59.74 1xa6 h GLU 320 Cb 0.60 -0.10 -0.05 0.00 -0.10 0.00 0.00 28.75 29.11 1xa6 h GLU 320 CO 0.03 0.28 0.53 -0.44 -1.16 0.00 0.00 179.01 178.24 1xa6 h ASP 321 N 0.43 0.84 0.59 1.42 3.32 -1.61 0.19 116.42 121.60 1xa6 h ASP 321 Ca 0.53 -0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.55 1xa6 h ASP 321 Cb 0.96 -0.19 0.01 0.00 0.22 0.00 0.00 39.33 40.32 1xa6 h ASP 321 CO -0.50 0.57 -0.28 0.58 -1.72 0.00 0.00 179.24 177.89 1xa6 h VAL 322 N 0.97 0.00 -0.67 -1.35 2.07 0.07 -2.25 116.25 115.09 1xa6 h VAL 322 Ca 0.32 -0.38 0.07 0.00 0.82 0.00 0.00 66.70 67.53 1xa6 h VAL 322 Cb 0.07 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 29.75 1xa6 h VAL 322 CO -0.10 0.00 -0.52 0.50 0.02 0.00 0.00 177.57 177.47 1xa6 h LYS 323 N -1.17 -0.15 -0.07 1.57 3.64 -1.13 1.97 116.57 121.24 1xa6 h LYS 323 Ca -0.08 0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.33 1xa6 h LYS 323 Cb 0.60 0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.46 1xa6 h LYS 323 CO 0.13 -0.10 0.54 1.98 -2.27 0.00 0.00 179.45 179.73 1xa6 h MET 324 N -0.16 0.00 0.23 1.90 4.05 -1.00 0.69 114.93 120.65 1xa6 h MET 324 Ca 0.11 0.00 -0.34 0.00 -0.28 0.00 0.00 59.70 59.19 1xa6 h MET 324 Cb 0.44 0.00 0.03 0.00 -0.80 0.00 0.00 31.60 31.27 1xa6 h MET 324 CO -0.71 0.00 -1.59 0.00 0.23 0.00 0.00 176.91 174.84 1xa6 h ALA 325 N 0.99 -0.03 -0.37 0.39 0.00 0.37 -3.29 119.26 117.32 1xa6 h ALA 325 Ca 0.03 -0.98 -0.08 0.00 0.00 0.00 0.00 54.91 53.88 1xa6 h ALA 325 Cb 1.10 0.30 -0.02 0.00 0.00 0.00 0.00 17.79 19.18 1xa6 h ALA 325 CO -0.00 0.82 -0.12 0.74 0.00 0.00 0.00 179.25 180.70 1xa6 h PHE 326 N 0.12 0.70 -2.24 0.00 -1.00 0.17 -3.06 116.94 111.63 1xa6 h PHE 326 Ca -0.29 -0.12 -0.52 0.00 2.81 0.00 0.00 57.97 59.85 1xa6 h PHE 326 Cb 2.13 -0.18 -0.05 0.00 3.61 0.00 0.00 35.95 41.46 1xa6 h PHE 326 CO 0.12 0.73 1.24 -0.51 -1.61 0.00 0.00 178.31 178.28 1xa6 s ASP 327 N -6.73 5.65 0.49 2.17 1.01 -0.45 -2.78 116.67 116.02 1xa6 s ASP 327 Ca -0.08 0.19 0.00 0.00 0.71 0.00 0.00 52.55 53.36 1xa6 s ASP 327 Cb 0.14 -2.54 0.00 0.00 1.01 0.00 0.00 42.92 41.53 1xa6 s ASP 327 CO 0.80 -2.11 0.00 -1.14 0.21 0.00 0.00 175.17 172.93 1xa6 n ARG 328 N 9.12 0.00 -0.17 8.23 3.00 -1.24 -4.63 116.66 130.96 1xa6 n ARG 328 Ca 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 58.00 1xa6 n ARG 328 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.97 1xa6 n ARG 328 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.63 174.16 1xa6 n ASP 329 N -2.35 0.00 0.00 6.15 4.64 -1.26 0.82 116.55 124.55 1xa6 n ASP 329 Ca 0.00 0.00 0.00 0.00 -1.38 0.00 0.00 54.79 53.41 1xa6 n ASP 329 Cb 0.00 -1.17 0.00 0.00 -1.04 0.00 0.00 41.12 38.91 1xa6 n ASP 329 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1xa6 n GLY 330 N -0.84 0.97 5.66 0.27 0.00 -1.24 -4.94 105.19 105.08 1xa6 n GLY 330 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1xa6 n GLY 330 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1xa6 n GLU 331 N 0.00 0.00 0.07 1.61 2.13 0.24 0.28 120.64 124.96 1xa6 n GLU 331 Ca 0.00 0.00 0.12 0.00 0.66 0.00 0.00 57.16 57.94 1xa6 n GLU 331 Cb 0.00 0.00 0.25 0.00 0.27 0.00 0.00 31.44 31.96 1xa6 n GLU 331 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 1xa6 n LYS 332 N 0.00 0.25 -3.40 5.31 4.81 -1.26 -4.27 118.16 119.61 1xa6 n LYS 332 Ca 0.00 0.11 -0.31 0.00 -0.87 0.00 0.00 58.31 57.24 1xa6 n LYS 332 Cb 0.00 -1.70 -0.07 0.00 0.02 0.00 0.00 35.03 33.29 1xa6 n LYS 332 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1xa6 n ALA 333 N -1.78 4.21 -1.37 3.14 0.00 0.79 -5.01 120.51 120.48 1xa6 n ALA 333 Ca 0.04 -4.75 0.00 0.00 0.00 0.00 0.00 53.44 48.73 1xa6 n ALA 333 Cb 0.43 -1.23 0.00 0.00 0.00 0.00 0.00 19.45 18.64 1xa6 n ALA 333 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1xa6 n ASP 334 N 1.12 0.00 -3.59 0.00 9.92 -1.26 -4.36 116.55 118.38 1xa6 n ASP 334 Ca 0.28 0.00 -0.10 0.00 -0.53 0.00 0.00 54.79 54.44 1xa6 n ASP 334 Cb 0.39 0.00 -0.05 0.00 -0.64 0.00 0.00 41.12 40.81 1xa6 n ASP 334 CO 0.00 0.00 0.00 -0.51 0.13 0.00 0.00 177.20 176.82 1xa6 s ILE 335 N 0.86 0.00 0.00 0.53 1.10 -1.26 -5.02 121.20 117.40 1xa6 s ILE 335 Ca 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 60.65 60.14 1xa6 s ILE 335 Cb 0.00 -1.00 0.00 0.00 0.15 0.00 0.00 42.46 41.61 1xa6 s ILE 335 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 174.94 171.29 1xa6 n SER 336 N 1.03 0.00 -0.06 4.50 3.41 -1.26 -4.96 113.62 116.27 1xa6 n SER 336 Ca -0.10 0.00 -0.05 0.00 -0.26 0.00 0.00 58.87 58.46 1xa6 n SER 336 Cb 0.58 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.49 1xa6 n SER 336 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xa6 h ALA 337 N -2.73 0.02 -3.00 7.33 0.00 -1.97 -3.41 119.26 115.50 1xa6 h ALA 337 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1xa6 h ALA 337 Cb 0.00 0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1xa6 h ALA 337 CO 0.00 0.17 0.00 0.27 0.00 0.00 0.00 179.25 179.69 1xa6 n ASN 338 N -4.69 -0.05 0.00 0.00 0.23 -1.26 -1.87 115.26 107.63 1xa6 n ASN 338 Ca -0.06 -0.66 0.00 0.00 -0.53 0.00 0.00 54.58 53.33 1xa6 n ASN 338 Cb 0.20 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.90 1xa6 n ASN 338 CO 0.00 0.00 0.00 0.52 -0.93 0.00 0.00 177.26 176.85 1xa6 n VAL 339 N -1.40 0.00 -3.38 3.53 0.31 -1.26 -4.16 118.33 111.98 1xa6 n VAL 339 Ca 0.00 0.00 -0.26 0.00 -0.01 0.00 0.00 64.34 64.07 1xa6 n VAL 339 Cb 0.00 0.00 -0.09 0.00 -0.91 0.00 0.00 33.84 32.84 1xa6 n VAL 339 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 1xa6 n TYR 340 N 0.00 0.83 -0.16 3.52 4.02 -1.24 -5.01 117.16 119.13 1xa6 n TYR 340 Ca 0.00 -3.72 -0.08 0.00 -0.01 0.00 0.00 57.90 54.09 1xa6 n TYR 340 Cb 0.00 -0.28 0.01 0.00 -0.02 0.00 0.00 39.34 39.05 1xa6 n TYR 340 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 176.86 174.50 1xa6 h PRO 341 N 4.62 0.63 -6.02 -0.72 0.11 -1.53 -3.40 132.00 125.69 1xa6 h PRO 341 Ca 0.16 -0.05 -0.50 0.00 0.11 0.00 0.00 66.00 65.71 1xa6 h PRO 341 Cb 0.82 -0.14 -0.04 0.00 0.11 0.00 0.00 31.00 31.76 1xa6 h PRO 341 CO 0.55 0.45 1.31 0.34 -0.21 0.00 0.00 178.00 180.44 1xa6 s ASP 342 N -5.68 5.38 0.66 -2.05 -1.08 -1.26 -4.81 116.67 107.83 1xa6 s ASP 342 Ca -0.13 0.22 0.36 0.00 -0.52 0.00 0.00 52.55 52.47 1xa6 s ASP 342 Cb 0.11 -2.53 1.96 0.00 -1.46 0.00 0.00 42.92 41.01 1xa6 s ASP 342 CO 0.74 -2.32 2.13 0.16 0.52 0.00 0.00 175.17 176.40 1xa6 h ILE 343 N 6.79 0.05 0.00 4.11 3.07 -1.92 0.18 117.51 129.80 1xa6 h ILE 343 Ca -0.25 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.16 1xa6 h ILE 343 Cb 1.15 0.82 0.00 0.00 -0.27 0.00 0.00 36.82 38.51 1xa6 h ILE 343 CO 1.23 0.00 0.06 0.78 -1.05 0.00 0.00 178.15 179.16 1xa6 h ASN 344 N 0.00 0.00 0.06 2.16 2.35 -1.91 0.90 115.58 119.14 1xa6 h ASN 344 Ca 0.01 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.76 1xa6 h ASN 344 Cb 0.38 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.75 1xa6 h ASN 344 CO -0.00 0.00 -0.03 0.40 -1.65 0.00 0.00 177.43 176.15 1xa6 h ILE 345 N 0.00 0.00 -0.59 2.81 2.04 -0.98 -0.59 117.51 120.19 1xa6 h ILE 345 Ca 0.00 -0.02 0.08 0.00 1.00 0.00 0.00 64.86 65.92 1xa6 h ILE 345 Cb 0.11 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 36.09 1xa6 h ILE 345 CO 0.00 0.00 -0.47 0.40 0.00 0.00 0.00 178.15 178.08 1xa6 h ILE 346 N -0.11 0.06 -0.92 -0.67 5.03 -1.30 2.01 117.51 121.62 1xa6 h ILE 346 Ca -0.01 0.00 0.26 0.00 -0.12 0.00 0.00 64.86 64.99 1xa6 h ILE 346 Cb 0.07 0.06 -0.04 0.00 -3.03 0.00 0.00 36.82 33.87 1xa6 h ILE 346 CO 0.01 0.00 0.65 0.71 -0.68 0.00 0.00 178.15 178.84 1xa6 h THR 347 N -0.24 0.56 0.23 -0.27 1.35 -0.97 0.29 112.91 113.86 1xa6 h THR 347 Ca 0.16 -0.03 -0.01 0.00 -0.55 0.00 0.00 66.41 65.98 1xa6 h THR 347 Cb 0.56 0.47 0.00 0.00 -1.73 0.00 0.00 68.15 67.46 1xa6 h THR 347 CO -0.70 0.01 -0.11 1.23 -0.25 0.00 0.00 175.52 175.71 1xa6 h GLY 348 N 0.08 -0.32 -0.33 5.82 0.00 0.44 -2.22 103.07 106.54 1xa6 h GLY 348 Ca 0.45 0.12 0.10 0.00 0.00 0.00 0.00 47.33 48.00 1xa6 h GLY 348 CO -0.05 -0.12 -0.31 0.00 0.00 0.00 0.00 176.54 176.06 1xa6 h ALA 349 N -0.57 -0.03 -0.66 3.60 0.00 0.27 0.76 119.26 122.63 1xa6 h ALA 349 Ca -0.03 0.16 0.09 0.00 0.00 0.00 0.00 54.91 55.12 1xa6 h ALA 349 Cb 0.48 0.73 -0.07 0.00 0.00 0.00 0.00 17.79 18.93 1xa6 h ALA 349 CO 0.05 -0.66 0.31 1.25 0.00 0.00 0.00 179.25 180.20 1xa6 h LEU 350 N -0.17 0.39 -0.80 0.00 5.85 -0.58 0.40 115.31 120.40 1xa6 h LEU 350 Ca 0.22 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.99 1xa6 h LEU 350 Cb 0.54 -0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.53 1xa6 h LEU 350 CO -0.64 0.23 0.45 0.11 -0.34 0.00 0.00 178.44 178.25 1xa6 h LYS 351 N 0.55 1.10 0.12 1.25 1.57 0.01 -2.63 116.57 118.54 1xa6 h LYS 351 Ca 0.33 -0.12 0.02 0.00 -1.87 0.00 0.00 60.65 59.00 1xa6 h LYS 351 Cb 0.34 -0.22 -0.04 0.00 0.08 0.00 0.00 32.23 32.39 1xa6 h LYS 351 CO -0.27 0.80 -0.39 1.25 -0.57 0.00 0.00 179.45 180.28 1xa6 h LEU 352 N 1.10 -1.15 -0.79 2.94 5.85 0.35 -1.62 115.31 121.98 1xa6 h LEU 352 Ca 0.28 0.13 0.17 0.00 0.84 0.00 0.00 57.88 59.30 1xa6 h LEU 352 Cb 0.01 0.43 -0.15 0.00 0.37 0.00 0.00 40.66 41.33 1xa6 h LEU 352 CO -0.05 -0.47 -0.11 0.22 -0.34 0.00 0.00 178.44 177.69 1xa6 h TYR 353 N -0.63 -0.27 0.00 1.25 3.20 -0.04 0.86 116.97 121.35 1xa6 h TYR 353 Ca 0.02 0.07 -0.06 0.00 3.14 0.00 0.00 58.73 61.90 1xa6 h TYR 353 Cb 0.66 0.24 -0.01 0.00 1.54 0.00 0.00 36.73 39.16 1xa6 h TYR 353 CO -0.35 -0.32 -0.27 0.74 -1.64 0.00 0.00 178.16 176.33 1xa6 h PHE 354 N 0.03 0.00 -0.08 -3.82 -1.00 -1.09 -2.51 116.94 108.47 1xa6 h PHE 354 Ca 0.41 0.00 -0.17 0.00 2.81 0.00 0.00 57.97 61.02 1xa6 h PHE 354 Cb 0.68 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.23 1xa6 h PHE 354 CO -0.55 0.27 -0.68 -0.09 -1.61 0.00 0.00 178.31 175.66 1xa6 h ARG 355 N 0.00 0.36 -0.00 1.51 2.43 0.15 -3.17 114.38 115.65 1xa6 h ARG 355 Ca -0.00 -0.27 0.00 0.00 -0.81 0.00 0.00 59.98 58.89 1xa6 h ARG 355 Cb 0.50 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.10 1xa6 h ARG 355 CO 0.04 0.91 -0.03 -0.25 -1.51 0.00 0.00 179.97 179.12 1xa6 n ASP 356 N -3.85 0.08 -4.77 -3.80 8.00 0.63 -4.88 116.55 107.96 1xa6 n ASP 356 Ca -0.03 -0.21 -0.39 0.00 0.71 0.00 0.00 54.79 54.86 1xa6 n ASP 356 Cb 0.67 -0.24 -0.01 0.00 -0.02 0.00 0.00 41.12 41.52 1xa6 n ASP 356 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1xa6 s LEU 357 N -2.57 4.23 0.19 0.64 1.43 -1.14 -4.00 118.68 117.47 1xa6 s LEU 357 Ca 0.28 2.63 0.01 0.00 -1.03 0.00 0.00 54.13 56.02 1xa6 s LEU 357 Cb 0.20 -3.89 0.11 0.00 0.03 0.00 0.00 46.19 42.64 1xa6 s LEU 357 CO 0.47 -0.80 1.47 -0.65 0.23 0.00 0.00 176.35 177.06 1xa6 h PRO 358 N 2.74 0.30 -5.72 1.29 0.11 -1.85 -3.41 132.00 125.47 1xa6 h PRO 358 Ca -0.49 -0.25 -0.68 0.00 0.11 0.00 0.00 66.00 64.68 1xa6 h PRO 358 Cb 1.24 0.05 -0.31 0.00 0.11 0.00 0.00 31.00 32.09 1xa6 h PRO 358 CO 0.63 0.90 -0.87 0.42 -0.21 0.00 0.00 178.00 178.87 1xa6 s ILE 359 N -3.58 2.19 0.67 4.15 1.09 -1.26 -4.93 121.20 119.52 1xa6 s ILE 359 Ca -0.04 -1.00 -0.17 0.00 -1.10 0.00 0.00 60.65 58.33 1xa6 s ILE 359 Cb 0.11 -1.82 0.00 0.00 -1.06 0.00 0.00 42.46 39.69 1xa6 s ILE 359 CO 0.82 0.56 1.26 -2.84 -0.10 0.00 0.00 174.94 174.65 1xa6 s PRO 360 N 0.04 2.46 0.27 2.79 0.02 -1.26 -4.73 135.00 134.58 1xa6 s PRO 360 Ca -0.09 1.97 -0.01 0.00 0.02 0.00 0.00 61.00 62.89 1xa6 s PRO 360 Cb -0.15 -1.85 0.49 0.00 0.02 0.00 0.00 34.50 33.01 1xa6 s PRO 360 CO 0.06 -1.64 1.82 0.28 -0.33 0.00 0.00 177.00 177.19 1xa6 h VAL 361 N 0.34 0.91 -0.00 3.83 2.07 -1.84 0.18 116.25 121.74 1xa6 h VAL 361 Ca -0.50 -0.31 0.00 0.00 0.82 0.00 0.00 66.70 66.71 1xa6 h VAL 361 Cb 1.32 -0.08 0.00 0.00 -1.52 0.00 0.00 31.29 31.02 1xa6 h VAL 361 CO 0.52 0.17 -0.01 0.00 0.02 0.00 0.00 177.57 178.27 1xa6 n ILE 362 N -4.67 0.00 -1.46 4.57 0.13 -0.93 -4.72 119.36 112.28 1xa6 n ILE 362 Ca 0.17 -0.02 0.19 0.00 -1.10 0.00 0.00 62.75 61.99 1xa6 n ILE 362 Cb 0.32 -0.43 -0.06 0.00 -0.84 0.00 0.00 39.64 38.63 1xa6 n ILE 362 CO 0.00 0.00 0.00 0.35 2.80 0.00 0.00 176.55 179.70 1xa6 n THR 363 N -1.01 0.00 -0.13 9.51 -2.24 0.62 -3.97 114.28 117.06 1xa6 n THR 363 Ca 0.21 0.36 -0.27 0.00 -2.27 0.00 0.00 64.05 62.08 1xa6 n THR 363 Cb 0.16 -0.86 -0.10 0.00 -2.10 0.00 0.00 70.33 67.44 1xa6 n THR 363 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1xa6 n TYR 364 N -4.32 0.17 0.00 4.78 4.02 -1.26 -3.30 117.16 117.25 1xa6 n TYR 364 Ca -0.03 0.07 0.00 0.00 -0.01 0.00 0.00 57.90 57.94 1xa6 n TYR 364 Cb 0.68 -0.98 0.00 0.00 -0.02 0.00 0.00 39.34 39.01 1xa6 n TYR 364 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 176.86 175.45 1xa6 n ASP 365 N -4.30 0.00 -0.03 7.72 5.75 -1.26 -0.33 116.55 124.10 1xa6 n ASP 365 Ca -0.48 0.24 -0.02 0.00 -0.01 0.00 0.00 54.79 54.51 1xa6 n ASP 365 Cb 0.83 -0.24 -0.05 0.00 -1.03 0.00 0.00 41.12 40.63 1xa6 n ASP 365 CO 0.00 0.00 0.00 0.41 -0.11 0.00 0.00 177.20 177.50 1xa6 n THR 366 N -1.20 0.39 -0.37 2.12 -1.04 -1.26 -4.74 114.28 108.17 1xa6 n THR 366 Ca 0.00 -0.26 -0.09 0.00 -2.04 0.00 0.00 64.05 61.66 1xa6 n THR 366 Cb 0.17 -0.67 -0.07 0.00 -1.82 0.00 0.00 70.33 67.94 1xa6 n THR 366 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1xa6 n TYR 367 N -2.17 -0.33 0.02 -1.42 9.36 0.55 -0.48 117.16 122.69 1xa6 n TYR 367 Ca -0.09 1.13 -0.13 0.00 3.32 0.00 0.00 57.90 62.12 1xa6 n TYR 367 Cb 0.64 -0.61 -0.08 0.00 -0.63 0.00 0.00 39.34 38.66 1xa6 n TYR 367 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 1xa6 h SER 368 N 0.00 -1.43 -0.27 2.98 4.64 -1.86 -2.07 113.55 115.55 1xa6 h SER 368 Ca 0.17 0.16 0.08 0.00 -0.47 0.00 0.00 61.79 61.73 1xa6 h SER 368 Cb 0.40 0.55 -0.01 0.00 -0.31 0.00 0.00 62.40 63.02 1xa6 h SER 368 CO -0.86 -0.43 0.20 0.11 -0.87 0.00 0.00 176.83 174.98 1xa6 h LYS 369 N -0.53 0.02 0.00 4.77 1.57 -1.46 -0.25 116.57 120.68 1xa6 h LYS 369 Ca 0.02 -0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.78 1xa6 h LYS 369 Cb 0.59 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.90 1xa6 h LYS 369 CO -0.33 0.01 -0.07 0.74 -0.57 0.00 0.00 179.45 179.22 1xa6 h PHE 370 N 0.02 0.00 0.00 -1.35 0.04 -0.08 -3.10 116.94 112.46 1xa6 h PHE 370 Ca 0.13 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.88 1xa6 h PHE 370 Cb 0.50 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.64 1xa6 h PHE 370 CO -0.00 0.07 -0.12 0.82 -0.60 0.00 0.00 178.31 178.48 1xa6 h ILE 371 N 0.00 1.24 0.00 -0.55 1.08 -0.66 -3.27 117.51 115.34 1xa6 h ILE 371 Ca -0.00 -1.97 0.00 0.00 -0.39 0.00 0.00 64.86 62.50 1xa6 h ILE 371 Cb 0.61 2.38 0.00 0.00 -3.07 0.00 0.00 36.82 36.74 1xa6 h ILE 371 CO 0.01 0.42 0.00 0.47 -0.69 0.00 0.00 178.15 178.36 1xa6 n ASP 372 N -4.64 0.00 -0.02 1.72 10.43 -0.93 -0.08 116.55 123.03 1xa6 n ASP 372 Ca -0.09 0.00 -0.04 0.00 2.57 0.00 0.00 54.79 57.23 1xa6 n ASP 372 Cb 0.38 0.00 -0.02 0.00 1.84 0.00 0.00 41.12 43.32 1xa6 n ASP 372 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1xa6 n ALA 373 N -0.09 2.22 0.66 2.24 0.00 -1.23 -4.56 120.51 119.75 1xa6 n ALA 373 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.25 1xa6 n ALA 373 Cb 0.00 0.42 0.00 0.00 0.00 0.00 0.00 19.45 19.87 1xa6 n ALA 373 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xa6 n ALA 374 N -2.86 2.01 0.04 0.00 0.00 0.89 -2.30 120.51 118.28 1xa6 n ALA 374 Ca -0.08 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.37 1xa6 n ALA 374 Cb 0.58 -1.00 0.01 0.00 0.00 0.00 0.00 19.45 19.04 1xa6 n ALA 374 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1xa6 n LYS 375 N 0.21 0.60 0.13 0.00 5.02 -1.20 -4.72 118.16 118.19 1xa6 n LYS 375 Ca 0.00 -0.96 -0.02 0.00 -2.02 0.00 0.00 58.31 55.31 1xa6 n LYS 375 Cb 0.18 -1.04 0.17 0.00 -0.02 0.00 0.00 35.03 34.32 1xa6 n LYS 375 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 1xa6 h ILE 376 N 0.33 1.42 0.00 -0.18 2.04 -1.76 -3.46 117.51 115.90 1xa6 h ILE 376 Ca 0.00 -2.04 0.00 0.00 1.00 0.00 0.00 64.86 63.82 1xa6 h ILE 376 Cb 0.24 2.08 0.00 0.00 -0.74 0.00 0.00 36.82 38.40 1xa6 h ILE 376 CO 0.00 0.59 0.00 -1.20 0.00 0.00 0.00 178.15 177.54 1xa6 n SER 377 N -3.84 0.00 -4.43 1.72 7.64 -1.26 -4.83 113.62 108.62 1xa6 n SER 377 Ca -0.01 0.00 -0.44 0.00 1.01 0.00 0.00 58.87 59.42 1xa6 n SER 377 Cb 0.60 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.79 1xa6 n SER 377 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 1xa6 s ASN 378 N 0.00 6.92 0.36 6.43 2.47 -1.26 -4.90 114.94 124.96 1xa6 s ASN 378 Ca 0.00 -2.70 0.00 0.00 0.42 0.00 0.00 52.86 50.58 1xa6 s ASN 378 Cb 0.00 -2.36 0.00 0.00 -1.45 0.00 0.00 41.25 37.44 1xa6 s ASN 378 CO 0.00 -0.79 0.65 0.00 -3.72 0.00 0.00 177.10 173.24 1xa6 n ALA 379 N 5.49 0.00 0.02 1.71 0.00 -1.26 0.25 120.51 126.71 1xa6 n ALA 379 Ca 0.29 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.54 1xa6 n ALA 379 Cb 0.45 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.80 1xa6 n ALA 379 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1xa6 h ASP 380 N 0.00 0.87 0.55 0.00 5.19 -1.99 -3.30 116.42 117.74 1xa6 h ASP 380 Ca 0.00 -0.71 -0.29 0.00 -0.62 0.00 0.00 57.03 55.41 1xa6 h ASP 380 Cb 1.30 -0.26 -0.02 0.00 0.18 0.00 0.00 39.33 40.53 1xa6 h ASP 380 CO 0.00 1.46 -1.48 -0.33 -3.12 0.00 0.00 179.24 175.77 1xa6 h GLU 381 N 0.36 0.16 0.00 3.56 5.08 -0.62 -3.33 114.58 119.79 1xa6 h GLU 381 Ca -0.10 -0.28 0.00 0.00 -1.00 0.00 0.00 59.36 57.98 1xa6 h GLU 381 Cb 1.57 0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.92 1xa6 h GLU 381 CO 0.18 0.99 0.00 0.54 -1.00 0.00 0.00 179.01 179.72 1xa6 n ARG 382 N -3.36 0.00 -0.38 2.33 1.74 -1.11 0.78 116.66 116.66 1xa6 n ARG 382 Ca -0.14 0.77 0.01 0.00 -0.77 0.00 0.00 57.85 57.72 1xa6 n ARG 382 Cb 1.03 -1.35 0.06 0.00 -1.02 0.00 0.00 32.46 31.19 1xa6 n ARG 382 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 1xa6 n LEU 383 N -2.26 -0.58 0.12 0.55 7.94 -1.24 0.85 117.00 122.38 1xa6 n LEU 383 Ca 0.00 1.73 0.02 0.00 -1.11 0.00 0.00 56.01 56.65 1xa6 n LEU 383 Cb 0.00 -0.43 0.37 0.00 0.53 0.00 0.00 43.42 43.90 1xa6 n LEU 383 CO 0.00 -1.58 0.86 -0.08 -1.11 0.00 0.00 177.39 175.48 1xa6 h GLU 384 N 0.00 0.22 0.70 1.96 4.81 -1.47 -0.16 114.58 120.64 1xa6 h GLU 384 Ca 0.38 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 59.52 1xa6 h GLU 384 Cb 0.63 -0.03 0.01 0.00 0.63 0.00 0.00 28.75 29.99 1xa6 h GLU 384 CO -1.00 0.40 -0.34 0.00 -0.73 0.00 0.00 179.01 177.34 1xa6 h ALA 385 N 1.62 -0.94 -0.74 2.92 0.00 0.67 -1.83 119.26 120.96 1xa6 h ALA 385 Ca 0.04 -0.21 0.12 0.00 0.00 0.00 0.00 54.91 54.86 1xa6 h ALA 385 Cb 0.43 0.36 -0.13 0.00 0.00 0.00 0.00 17.79 18.45 1xa6 h ALA 385 CO 0.03 -0.88 -0.35 0.28 0.00 0.00 0.00 179.25 178.32 1xa6 h VAL 386 N -1.24 0.11 -0.16 0.00 2.07 -0.17 0.63 116.25 117.49 1xa6 h VAL 386 Ca -0.10 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.47 1xa6 h VAL 386 Cb 0.73 0.11 -0.07 0.00 -1.52 0.00 0.00 31.29 30.54 1xa6 h VAL 386 CO 0.16 0.00 -0.38 -0.74 0.02 0.00 0.00 177.57 176.63 1xa6 h HIS 387 N -0.10 -1.08 -0.92 1.57 6.17 -1.01 0.72 115.15 120.50 1xa6 h HIS 387 Ca 0.28 0.05 0.14 0.00 0.71 0.00 0.00 60.37 61.54 1xa6 h HIS 387 Cb 0.57 0.49 -0.15 0.00 2.52 0.00 0.00 27.41 30.85 1xa6 h HIS 387 CO -0.72 -0.44 -0.37 -1.91 0.71 0.00 0.00 177.93 175.20 1xa6 n GLU 388 N -5.43 -0.22 0.09 5.26 2.13 0.17 -0.40 120.64 122.25 1xa6 n GLU 388 Ca -0.03 1.42 -0.12 0.00 0.66 0.00 0.00 57.16 59.09 1xa6 n GLU 388 Cb 0.35 -2.11 -0.11 0.00 0.27 0.00 0.00 31.44 29.84 1xa6 n GLU 388 CO 0.00 0.00 0.00 -0.24 -0.41 0.00 0.00 177.13 176.48 1xa6 h VAL 389 N 0.00 1.56 -0.08 6.31 3.04 -0.97 -3.08 116.25 123.04 1xa6 h VAL 389 Ca 0.32 -3.08 0.02 0.00 -1.01 0.00 0.00 66.70 62.95 1xa6 h VAL 389 Cb 0.55 2.82 -0.00 0.00 -2.01 0.00 0.00 31.29 32.65 1xa6 h VAL 389 CO -0.92 0.89 0.33 0.25 -1.01 0.00 0.00 177.57 177.11 1xa6 h LEU 390 N 0.06 0.00 0.00 3.16 6.46 0.33 0.91 115.31 126.23 1xa6 h LEU 390 Ca -0.08 0.00 -0.11 0.00 -0.12 0.00 0.00 57.88 57.57 1xa6 h LEU 390 Cb 1.82 0.00 -0.02 0.00 -0.73 0.00 0.00 40.66 41.73 1xa6 h LEU 390 CO 0.17 0.00 -0.84 -0.03 -0.62 0.00 0.00 178.44 177.12 1xa6 h MET 391 N 0.00 0.00 0.00 1.25 4.05 -1.11 -3.26 114.93 115.86 1xa6 h MET 391 Ca 0.04 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.46 1xa6 h MET 391 Cb 0.69 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.49 1xa6 h MET 391 CO -0.00 0.32 0.00 1.28 0.23 0.00 0.00 176.91 178.74 1xa6 n LEU 392 N -3.03 0.00 -4.80 3.39 4.77 0.31 -4.84 117.00 112.80 1xa6 n LEU 392 Ca -0.02 0.00 -0.36 0.00 -0.03 0.00 0.00 56.01 55.60 1xa6 n LEU 392 Cb 0.73 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.76 1xa6 n LEU 392 CO 0.41 0.00 0.57 -0.76 -1.33 0.00 0.00 177.39 176.28 1xa6 s LEU 393 N -1.39 4.26 0.25 2.23 1.43 -1.21 -4.99 118.68 119.25 1xa6 s LEU 393 Ca 0.18 1.65 -0.30 0.00 -1.03 0.00 0.00 54.13 54.63 1xa6 s LEU 393 Cb 0.08 -3.98 -0.10 0.00 0.03 0.00 0.00 46.19 42.22 1xa6 s LEU 393 CO 0.14 -0.10 1.34 -2.84 0.23 0.00 0.00 176.35 175.12 1xa6 s PRO 394 N -2.28 4.36 0.01 1.29 0.02 -1.26 -4.71 135.00 132.42 1xa6 s PRO 394 Ca 0.50 2.15 -0.02 0.00 0.02 0.00 0.00 61.00 63.66 1xa6 s PRO 394 Cb -0.16 -3.14 -0.00 0.00 0.02 0.00 0.00 34.50 31.22 1xa6 s PRO 394 CO 0.21 -0.27 0.48 -2.30 -0.33 0.00 0.00 177.00 174.78 1xa6 n PRO 395 N 2.08 -0.02 -0.24 5.54 -0.02 -1.26 -0.47 135.00 140.61 1xa6 n PRO 395 Ca 0.05 0.47 -0.05 0.00 -2.02 0.00 0.00 63.50 61.95 1xa6 n PRO 395 Cb 0.42 -0.71 0.01 0.00 -0.02 0.00 0.00 33.50 33.20 1xa6 n PRO 395 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1xa6 h ALA 396 N -0.37 -0.04 0.40 3.55 0.00 -1.91 -0.35 119.26 120.53 1xa6 h ALA 396 Ca 0.01 0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 1xa6 h ALA 396 Cb 0.02 0.85 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 1xa6 h ALA 396 CO -0.05 -0.69 -0.47 0.45 0.00 0.00 0.00 179.25 178.50 1xa6 h HIS 397 N -0.14 -1.30 0.00 0.00 3.86 -1.08 -1.04 115.15 115.46 1xa6 h HIS 397 Ca 0.25 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.47 1xa6 h HIS 397 Cb 0.56 0.51 0.00 0.00 1.06 0.00 0.00 27.41 29.54 1xa6 h HIS 397 CO -0.69 -0.60 0.00 0.98 0.86 0.00 0.00 177.93 178.48 1xa6 n TYR 398 N -5.22 0.00 -0.33 2.45 9.36 -0.37 -0.35 117.16 122.70 1xa6 n TYR 398 Ca -0.10 0.00 0.24 0.00 3.32 0.00 0.00 57.90 61.36 1xa6 n TYR 398 Cb 0.41 -0.39 0.47 0.00 -0.63 0.00 0.00 39.34 39.20 1xa6 n TYR 398 CO 0.00 0.00 0.00 0.93 0.22 0.00 0.00 176.86 178.01 1xa6 h GLU 399 N 0.00 0.10 -0.16 2.98 4.39 -1.05 0.35 114.58 121.20 1xa6 h GLU 399 Ca 0.00 -0.01 -0.03 0.00 0.34 0.00 0.00 59.36 59.66 1xa6 h GLU 399 Cb 0.00 -0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 28.62 1xa6 h GLU 399 CO 0.00 0.07 -0.04 1.15 -1.16 0.00 0.00 179.01 179.03 1xa6 h THR 400 N 0.11 1.29 0.20 1.13 2.02 0.28 -2.52 112.91 115.41 1xa6 h THR 400 Ca 0.74 -0.99 -0.00 0.00 0.77 0.00 0.00 66.41 66.92 1xa6 h THR 400 Cb 1.78 1.63 -0.02 0.00 -1.74 0.00 0.00 68.15 69.80 1xa6 h THR 400 CO -0.75 0.29 -0.27 0.25 0.37 0.00 0.00 175.52 175.41 1xa6 h LEU 401 N 0.00 -0.78 -0.59 2.58 5.85 0.25 -1.52 115.31 121.11 1xa6 h LEU 401 Ca 0.04 0.07 0.05 0.00 0.84 0.00 0.00 57.88 58.88 1xa6 h LEU 401 Cb 0.47 0.27 -0.07 0.00 0.37 0.00 0.00 40.66 41.70 1xa6 h LEU 401 CO 0.02 -0.34 -0.35 -1.14 -0.34 0.00 0.00 178.44 176.29 1xa6 n ARG 402 N -4.01 -0.26 0.27 1.25 0.63 0.26 -0.48 116.66 114.32 1xa6 n ARG 402 Ca -0.06 0.92 -0.18 0.00 -0.92 0.00 0.00 57.85 57.62 1xa6 n ARG 402 Cb 0.24 -1.35 -0.09 0.00 0.45 0.00 0.00 32.46 31.70 1xa6 n ARG 402 CO 0.00 0.00 0.00 -0.92 -2.51 0.00 0.00 177.63 174.20 1xa6 h TYR 403 N 0.00 -1.31 0.00 -0.14 3.20 -1.27 -2.84 116.97 114.61 1xa6 h TYR 403 Ca 0.09 0.01 -0.63 0.00 3.14 0.00 0.00 58.73 61.34 1xa6 h TYR 403 Cb 0.24 0.51 0.01 0.00 1.54 0.00 0.00 36.73 39.03 1xa6 h TYR 403 CO -0.64 -0.63 3.07 -0.11 -1.64 0.00 0.00 178.16 178.21 1xa6 n LEU 404 N -5.54 6.48 -2.07 2.82 7.94 0.37 -2.21 117.00 124.78 1xa6 n LEU 404 Ca -0.11 -3.74 -0.02 0.00 -1.11 0.00 0.00 56.01 51.04 1xa6 n LEU 404 Cb 0.44 -1.43 -0.01 0.00 0.53 0.00 0.00 43.42 42.95 1xa6 n LEU 404 CO 0.26 0.98 0.44 0.80 -1.11 0.00 0.00 177.39 178.77 1xa6 n MET 405 N 5.32 0.07 0.00 1.96 1.56 -1.07 -4.82 117.12 120.14 1xa6 n MET 405 Ca 0.57 -0.31 0.00 0.00 -0.27 0.00 0.00 57.70 57.70 1xa6 n MET 405 Cb 0.31 0.01 0.00 0.00 2.15 0.00 0.00 33.22 35.69 1xa6 n MET 405 CO 0.00 0.00 0.00 -0.89 -0.73 0.00 0.00 175.97 174.35 1xa6 n ILE 406 N -0.28 0.00 0.32 1.12 5.41 -0.94 -4.41 119.36 120.58 1xa6 n ILE 406 Ca -0.15 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.60 1xa6 n ILE 406 Cb 0.57 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.50 1xa6 n ILE 406 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 176.55 177.96 1xa6 n HIS 407 N -1.11 0.00 0.09 1.39 8.25 -1.17 0.28 115.22 122.94 1xa6 n HIS 407 Ca 0.00 -0.10 0.00 0.00 -0.26 0.00 0.00 57.72 57.36 1xa6 n HIS 407 Cb 0.00 -0.10 0.00 0.00 1.12 0.00 0.00 29.99 31.01 1xa6 n HIS 407 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 1xa6 n LEU 408 N 0.65 -0.05 0.00 2.41 -0.00 -1.26 -4.85 117.00 113.89 1xa6 n LEU 408 Ca 0.00 0.30 0.05 0.00 -0.00 0.00 0.00 56.01 56.36 1xa6 n LEU 408 Cb 0.13 0.23 0.21 0.00 -0.00 0.00 0.00 43.42 43.99 1xa6 n LEU 408 CO 0.00 -0.69 0.65 1.17 -0.00 0.00 0.00 177.39 178.52 1xa6 n LYS 409 N -3.13 0.02 0.12 1.96 3.00 0.46 -0.04 118.16 120.55 1xa6 n LYS 409 Ca 0.00 0.32 0.13 0.00 -0.00 0.00 0.00 58.31 58.76 1xa6 n LYS 409 Cb 0.00 -1.50 0.33 0.00 0.00 0.00 0.00 35.03 33.86 1xa6 n LYS 409 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.40 178.27 1xa6 h LYS 410 N 0.00 0.00 -0.01 1.64 1.57 0.37 -2.70 116.57 117.44 1xa6 h LYS 410 Ca 0.00 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.62 1xa6 h LYS 410 Cb 0.16 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.45 1xa6 h LYS 410 CO 0.00 0.00 -0.73 0.28 -0.57 0.00 0.00 179.45 178.43 1xa6 h VAL 411 N 0.00 1.48 -0.77 0.50 2.07 -0.61 -2.66 116.25 116.26 1xa6 h VAL 411 Ca 0.00 -2.40 -0.02 0.00 0.82 0.00 0.00 66.70 65.10 1xa6 h VAL 411 Cb 0.79 2.29 -0.04 0.00 -1.52 0.00 0.00 31.29 32.81 1xa6 h VAL 411 CO 0.00 0.69 0.40 0.74 0.02 0.00 0.00 177.57 179.42 1xa6 h THR 412 N 0.06 1.23 0.00 2.57 2.02 -1.49 -2.67 112.91 114.63 1xa6 h THR 412 Ca -0.02 -0.62 -0.59 0.00 0.77 0.00 0.00 66.41 65.96 1xa6 h THR 412 Cb 1.29 0.22 0.02 0.00 -1.74 0.00 0.00 68.15 67.94 1xa6 h THR 412 CO 0.10 0.27 3.25 0.23 0.37 0.00 0.00 175.52 179.74 1xa6 n MET 413 N -4.34 2.91 0.00 6.66 2.00 -1.00 -3.01 117.12 120.34 1xa6 n MET 413 Ca 0.08 -2.02 0.00 0.00 0.00 0.00 0.00 57.70 55.76 1xa6 n MET 413 Cb 0.12 -2.79 0.00 0.00 0.00 0.00 0.00 33.22 30.55 1xa6 n MET 413 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 1xa6 n ASN 414 N 4.50 0.00 0.00 7.83 3.02 -1.01 -4.98 115.26 124.62 1xa6 n ASN 414 Ca 0.62 0.00 0.02 0.00 -0.03 0.00 0.00 54.58 55.19 1xa6 n ASN 414 Cb 0.24 0.00 0.12 0.00 -0.61 0.00 0.00 39.78 39.54 1xa6 n ASN 414 CO 0.00 0.00 0.00 -1.84 -2.62 0.00 0.00 177.26 172.80 1xa6 n GLU 415 N 0.00 0.13 0.00 3.52 0.28 -1.16 0.49 120.64 123.89 1xa6 n GLU 415 Ca 0.00 0.03 0.15 0.00 -0.16 0.00 0.00 57.16 57.17 1xa6 n GLU 415 Cb 0.00 -1.50 0.67 0.00 1.43 0.00 0.00 31.44 32.04 1xa6 n GLU 415 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1xa6 n LYS 416 N -1.03 1.42 0.00 3.44 4.01 -1.26 -2.61 118.16 122.14 1xa6 n LYS 416 Ca 0.03 -0.63 0.00 0.00 -0.51 0.00 0.00 58.31 57.20 1xa6 n LYS 416 Cb 0.02 -1.49 0.00 0.00 -0.51 0.00 0.00 35.03 33.05 1xa6 n LYS 416 CO 0.00 0.00 0.00 -0.25 -1.11 0.00 0.00 177.40 176.04 1xa6 n ASP 417 N -0.24 0.06 0.00 4.39 9.92 0.18 -4.90 116.55 125.96 1xa6 n ASP 417 Ca 0.21 -0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.46 1xa6 n ASP 417 Cb 0.27 0.02 0.00 0.00 -0.64 0.00 0.00 41.12 40.77 1xa6 n ASP 417 CO 0.00 0.00 0.00 -0.46 0.13 0.00 0.00 177.20 176.87 1xa6 n ASN 418 N -0.02 0.28 0.00 -2.24 0.23 -0.72 -4.05 115.26 108.74 1xa6 n ASN 418 Ca 0.00 -0.62 0.00 0.00 -0.53 0.00 0.00 54.58 53.43 1xa6 n ASN 418 Cb 0.00 0.36 0.00 0.00 -2.08 0.00 0.00 39.78 38.06 1xa6 n ASN 418 CO 0.00 0.00 0.00 0.49 -0.93 0.00 0.00 177.26 176.82 1xa6 n PHE 419 N -0.36 0.00 -3.71 -2.53 3.01 -1.07 0.43 117.46 113.22 1xa6 n PHE 419 Ca 0.00 0.00 -0.37 0.00 1.01 0.00 0.00 57.45 58.09 1xa6 n PHE 419 Cb 0.04 -1.45 -0.07 0.00 -0.01 0.00 0.00 39.48 37.99 1xa6 n PHE 419 CO 0.00 0.00 0.00 -1.64 1.01 0.00 0.00 176.76 176.13 1xa6 s MET 420 N -1.35 3.82 0.23 -1.08 -1.94 -1.26 -4.94 119.30 112.78 1xa6 s MET 420 Ca 0.00 0.01 0.05 0.00 -1.71 0.00 0.00 55.69 54.04 1xa6 s MET 420 Cb 0.00 -3.28 -0.02 0.00 2.01 0.00 0.00 34.83 33.54 1xa6 s MET 420 CO 0.00 0.58 0.18 0.27 -0.01 0.00 0.00 175.02 176.04 1xa6 n ASN 421 N 2.51 -0.25 0.00 3.03 0.23 -1.26 -4.02 115.26 115.49 1xa6 n ASN 421 Ca -0.17 -2.49 0.00 0.00 -0.53 0.00 0.00 54.58 51.40 1xa6 n ASN 421 Cb 0.53 1.07 0.00 0.00 -2.08 0.00 0.00 39.78 39.31 1xa6 n ASN 421 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1xa6 n ALA 422 N -1.48 0.00 -0.23 -2.53 0.00 -1.26 0.77 120.51 115.78 1xa6 n ALA 422 Ca -0.08 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.51 1xa6 n ALA 422 Cb 0.41 0.07 0.29 0.00 0.00 0.00 0.00 19.45 20.23 1xa6 n ALA 422 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1xa6 n GLU 423 N -0.43 -0.05 0.14 0.00 2.13 -1.26 0.57 120.64 121.74 1xa6 n GLU 423 Ca 0.00 0.99 -0.08 0.00 0.66 0.00 0.00 57.16 58.74 1xa6 n GLU 423 Cb 0.00 -1.67 -0.04 0.00 0.27 0.00 0.00 31.44 30.00 1xa6 n GLU 423 CO 0.00 0.00 0.00 -0.97 -0.41 0.00 0.00 177.13 175.75 1xa6 h ASN 424 N 0.00 -0.54 -0.77 4.31 -1.24 -1.79 -3.04 115.58 112.51 1xa6 h ASN 424 Ca 0.49 0.04 -0.04 0.00 0.71 0.00 0.00 56.30 57.50 1xa6 h ASN 424 Cb 1.17 0.17 -0.03 0.00 0.73 0.00 0.00 38.32 40.35 1xa6 h ASN 424 CO -0.59 -0.28 0.31 -0.07 -1.29 0.00 0.00 177.43 175.50 1xa6 h LEU 425 N -0.44 1.06 -0.75 0.34 3.38 0.37 -2.05 115.31 117.23 1xa6 h LEU 425 Ca -0.03 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.77 1xa6 h LEU 425 Cb 0.37 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.84 1xa6 h LEU 425 CO 0.00 0.95 0.62 1.23 0.09 0.00 0.00 178.44 181.32 1xa6 h GLY 426 N 1.12 0.00 0.00 0.83 0.00 0.19 0.13 103.07 105.34 1xa6 h GLY 426 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.59 1xa6 h GLY 426 CO -0.02 0.00 -0.08 -2.22 0.00 0.00 0.00 176.54 174.22 1xa6 h ILE 427 N 0.00 0.00 -0.56 2.60 2.04 -1.25 -2.75 117.51 117.59 1xa6 h ILE 427 Ca 0.00 -0.43 0.16 0.00 1.00 0.00 0.00 64.86 65.59 1xa6 h ILE 427 Cb 1.23 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.29 1xa6 h ILE 427 CO 0.00 0.00 0.68 1.62 0.00 0.00 0.00 178.15 180.45 1xa6 h VAL 428 N -0.43 0.23 0.00 1.67 3.04 -0.86 -3.08 116.25 116.82 1xa6 h VAL 428 Ca 0.00 0.00 -0.35 0.00 -1.01 0.00 0.00 66.70 65.34 1xa6 h VAL 428 Cb 0.08 0.45 -0.06 0.00 -2.01 0.00 0.00 31.29 29.75 1xa6 h VAL 428 CO 0.00 0.00 -2.25 0.49 -1.01 0.00 0.00 177.57 174.80 1xa6 n PHE 429 N -3.49 0.00 -0.19 3.17 3.72 -0.38 -4.61 117.46 115.68 1xa6 n PHE 429 Ca 0.11 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.47 1xa6 n PHE 429 Cb 0.88 -0.83 -0.04 0.00 -0.94 0.00 0.00 39.48 38.55 1xa6 n PHE 429 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1xa6 n GLY 430 N 2.05 -1.18 0.32 1.37 0.00 -1.03 0.52 105.19 107.24 1xa6 n GLY 430 Ca -0.41 0.55 0.12 0.00 0.00 0.00 0.00 46.02 46.27 1xa6 n GLY 430 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1xa6 h PRO 431 N 0.00 0.19 0.04 1.61 0.11 -1.83 -2.65 132.00 129.48 1xa6 h PRO 431 Ca 0.08 -0.01 -0.37 0.00 0.11 0.00 0.00 66.00 65.81 1xa6 h PRO 431 Cb 0.20 -0.04 -0.05 0.00 0.11 0.00 0.00 31.00 31.21 1xa6 h PRO 431 CO -0.44 0.13 -2.26 0.25 -0.21 0.00 0.00 178.00 175.47 1xa6 n THR 432 N -4.47 1.59 1.54 -1.15 -2.24 0.19 -4.13 114.28 105.61 1xa6 n THR 432 Ca 0.05 -0.64 0.08 0.00 -2.27 0.00 0.00 64.05 61.27 1xa6 n THR 432 Cb 0.30 -1.42 0.47 0.00 -2.10 0.00 0.00 70.33 67.58 1xa6 n THR 432 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1xa6 n LEU 433 N -3.28 0.00 -3.81 3.22 4.77 0.03 -4.69 117.00 113.24 1xa6 n LEU 433 Ca -0.38 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.49 1xa6 n LEU 433 Cb 1.03 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 42.04 1xa6 n LEU 433 CO 0.35 0.00 -0.05 -0.04 -1.33 0.00 0.00 177.39 176.31 1xa6 s MET 434 N -2.00 0.70 -0.12 3.23 -1.94 -1.00 -2.19 119.30 115.97 1xa6 s MET 434 Ca 0.24 -0.52 -0.19 0.00 -1.71 0.00 0.00 55.69 53.51 1xa6 s MET 434 Cb 0.11 0.30 0.05 0.00 2.01 0.00 0.00 34.83 37.29 1xa6 s MET 434 CO 0.18 -0.21 0.49 1.03 -0.01 0.00 0.00 175.02 176.51 1xa6 s ARG 435 N -2.29 0.69 0.28 2.03 0.52 -1.26 -4.65 118.95 114.27 1xa6 s ARG 435 Ca -0.07 0.41 -0.24 0.00 -0.52 0.00 0.00 55.73 55.31 1xa6 s ARG 435 Cb -0.02 0.33 -0.09 0.00 0.52 0.00 0.00 34.95 35.68 1xa6 s ARG 435 CO -0.02 -0.14 0.88 -2.14 0.02 0.00 0.00 175.30 173.89 1xa6 s PRO 436 N -0.37 4.51 0.54 3.54 0.02 -1.26 -4.80 135.00 137.18 1xa6 s PRO 436 Ca -0.05 1.20 0.20 0.00 0.02 0.00 0.00 61.00 62.37 1xa6 s PRO 436 Cb -0.03 -2.87 1.41 0.00 0.02 0.00 0.00 34.50 33.02 1xa6 s PRO 436 CO 0.03 0.34 2.15 -1.00 -0.33 0.00 0.00 177.00 178.19 1xa6 h PRO 437 N 3.35 0.00 0.00 5.54 0.13 -1.97 -3.48 132.00 135.57 1xa6 h PRO 437 Ca -0.47 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 64.72 1xa6 h PRO 437 Cb 1.19 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.31 1xa6 h PRO 437 CO 0.65 0.00 -0.08 -1.91 -0.23 0.00 0.00 178.00 176.44 1xa6 n GLU 438 N -4.36 -0.42 -1.23 0.86 2.13 -1.26 -4.87 120.64 111.49 1xa6 n GLU 438 Ca -0.01 0.28 -0.08 0.00 0.66 0.00 0.00 57.16 58.01 1xa6 n GLU 438 Cb 0.15 -0.52 -0.03 0.00 0.27 0.00 0.00 31.44 31.32 1xa6 n GLU 438 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1xa6 n ASP 439 N -1.04 -4.24 -1.03 4.31 8.00 -1.26 -4.76 116.55 116.53 1xa6 n ASP 439 Ca 0.00 0.19 -0.03 0.00 0.71 0.00 0.00 54.79 55.66 1xa6 n ASP 439 Cb 0.10 -2.43 -0.04 0.00 -0.02 0.00 0.00 41.12 38.73 1xa6 n ASP 439 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 1xa6 n SER 440 N 0.21 -0.38 -4.61 -2.24 2.88 -1.26 -5.11 113.62 103.12 1xa6 n SER 440 Ca -0.08 -1.88 -0.43 0.00 -1.33 0.00 0.00 58.87 55.15 1xa6 n SER 440 Cb 0.31 0.10 -0.03 0.00 -0.75 0.00 0.00 64.21 63.84 1xa6 n SER 440 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1xa6 s THR 441 N 0.00 3.23 0.14 2.46 -4.23 -1.26 -4.34 115.64 111.64 1xa6 s THR 441 Ca 0.08 0.25 0.00 0.00 -1.18 0.00 0.00 61.69 60.84 1xa6 s THR 441 Cb 0.09 -3.28 0.00 0.00 1.34 0.00 0.00 72.50 70.65 1xa6 s THR 441 CO -0.04 -0.15 0.00 -0.11 -0.54 0.00 0.00 174.62 173.78 1xa6 n LEU 442 N 10.32 -1.28 0.03 4.79 0.00 -1.26 -4.87 117.00 124.73 1xa6 n LEU 442 Ca 0.25 0.40 0.13 0.00 0.00 0.00 0.00 56.01 56.79 1xa6 n LEU 442 Cb 0.45 1.43 0.33 0.00 0.00 0.00 0.00 43.42 45.63 1xa6 n LEU 442 CO 0.67 -0.02 0.58 0.41 0.00 0.00 0.00 177.39 179.03 1xa6 n THR 443 N -2.70 0.17 -0.25 1.96 -1.04 -1.26 -3.84 114.28 107.32 1xa6 n THR 443 Ca 0.00 -0.11 0.22 0.00 -2.04 0.00 0.00 64.05 62.12 1xa6 n THR 443 Cb 0.00 -0.12 0.55 0.00 -1.82 0.00 0.00 70.33 68.94 1xa6 n THR 443 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1xa6 h THR 444 N 0.00 0.62 0.00 12.58 1.03 -1.90 0.71 112.91 125.96 1xa6 h THR 444 Ca 0.00 -0.11 -0.13 0.00 -0.01 0.00 0.00 66.41 66.16 1xa6 h THR 444 Cb 0.60 0.27 -0.02 0.00 -1.07 0.00 0.00 68.15 67.93 1xa6 h THR 444 CO 0.00 0.06 -0.60 -0.07 -0.01 0.00 0.00 175.52 174.90 1xa6 h LEU 445 N 0.33 0.00 -0.14 0.00 3.38 -1.97 -2.74 115.31 114.17 1xa6 h LEU 445 Ca 0.49 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.46 1xa6 h LEU 445 Cb 1.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.10 1xa6 h LEU 445 CO -0.17 0.60 0.00 1.41 0.09 0.00 0.00 178.44 180.38 1xa6 n HIS 446 N -3.26 0.03 -0.04 1.13 8.25 0.24 -3.45 115.22 118.10 1xa6 n HIS 446 Ca 0.01 -0.01 -0.05 0.00 -0.26 0.00 0.00 57.72 57.41 1xa6 n HIS 446 Cb 0.77 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.83 1xa6 n HIS 446 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 1xa6 n ASP 447 N -0.64 3.22 -0.36 0.41 8.00 -0.68 -4.63 116.55 121.87 1xa6 n ASP 447 Ca 0.14 -0.03 0.31 0.00 0.71 0.00 0.00 54.79 55.92 1xa6 n ASP 447 Cb 0.10 0.18 0.52 0.00 -0.02 0.00 0.00 41.12 41.90 1xa6 n ASP 447 CO 0.00 0.00 0.00 0.80 -0.39 0.00 0.00 177.20 177.61 1xa6 n MET 448 N -2.58 -0.03 0.07 -1.24 0.00 -1.05 0.12 117.12 112.42 1xa6 n MET 448 Ca -0.15 0.94 -0.05 0.00 -0.00 0.00 0.00 57.70 58.44 1xa6 n MET 448 Cb 0.70 -1.86 -0.03 0.00 0.00 0.00 0.00 33.22 32.04 1xa6 n MET 448 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1xa6 h ARG 449 N 0.00 -0.25 -1.31 2.12 2.47 -1.82 -2.77 114.38 112.81 1xa6 h ARG 449 Ca 0.67 0.02 0.38 0.00 -1.26 0.00 0.00 59.98 59.79 1xa6 h ARG 449 Cb 2.17 0.06 -0.08 0.00 -1.65 0.00 0.00 29.97 30.47 1xa6 h ARG 449 CO -0.34 -0.17 0.91 1.88 0.56 0.00 0.00 179.97 182.81 1xa6 h TYR 450 N -0.26 0.25 0.37 3.04 -1.99 -0.63 -0.41 116.97 117.34 1xa6 h TYR 450 Ca -0.01 0.01 -0.01 0.00 2.00 0.00 0.00 58.73 60.72 1xa6 h TYR 450 Cb 0.23 -0.07 -0.02 0.00 2.00 0.00 0.00 36.73 38.87 1xa6 h TYR 450 CO -0.15 -0.03 -0.42 1.96 -0.00 0.00 0.00 178.16 179.52 1xa6 h GLN 451 N 0.10 -0.78 -0.93 4.88 4.20 -1.36 0.36 115.11 121.59 1xa6 h GLN 451 Ca 0.69 0.05 0.20 0.00 0.06 0.00 0.00 58.65 59.65 1xa6 h GLN 451 Cb 2.41 0.18 -0.07 0.00 0.30 0.00 0.00 27.48 30.29 1xa6 h GLN 451 CO -0.16 -0.52 0.61 0.87 -0.67 0.00 0.00 178.83 178.96 1xa6 h LYS 452 N -0.81 0.47 0.41 1.46 1.57 -1.08 -1.82 116.57 116.76 1xa6 h LYS 452 Ca -0.05 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.69 1xa6 h LYS 452 Cb 0.71 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.92 1xa6 h LYS 452 CO -0.08 0.31 -0.20 1.25 -0.57 0.00 0.00 179.45 180.16 1xa6 h LEU 453 N 0.48 -0.46 -0.60 2.94 5.85 -0.78 -1.50 115.31 121.23 1xa6 h LEU 453 Ca 0.49 0.02 0.05 0.00 0.84 0.00 0.00 57.88 59.28 1xa6 h LEU 453 Cb 1.13 0.12 -0.07 0.00 0.37 0.00 0.00 40.66 42.21 1xa6 h LEU 453 CO -0.22 -0.31 -0.35 -0.38 -0.34 0.00 0.00 178.44 176.84 1xa6 n ILE 454 N -3.58 -0.41 -0.04 4.05 2.08 0.11 0.25 119.36 121.82 1xa6 n ILE 454 Ca -0.07 1.62 -0.12 0.00 0.56 0.00 0.00 62.75 64.75 1xa6 n ILE 454 Cb 0.22 -2.02 -0.06 0.00 -0.75 0.00 0.00 39.64 37.03 1xa6 n ILE 454 CO 0.00 0.00 0.00 0.58 0.56 0.00 0.00 176.55 177.69 1xa6 h VAL 455 N 0.00 0.13 -0.58 1.39 2.07 -1.41 0.17 116.25 118.02 1xa6 h VAL 455 Ca 0.10 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.73 1xa6 h VAL 455 Cb 0.25 0.13 -0.10 0.00 -1.52 0.00 0.00 31.29 30.05 1xa6 h VAL 455 CO -0.56 0.00 -0.01 -0.61 0.02 0.00 0.00 177.57 176.40 1xa6 h GLN 456 N -0.45 0.10 -0.67 1.57 4.15 0.84 0.90 115.11 121.55 1xa6 h GLN 456 Ca 0.09 -0.01 0.05 0.00 0.77 0.00 0.00 58.65 59.55 1xa6 h GLN 456 Cb 0.61 -0.02 -0.05 0.00 0.21 0.00 0.00 27.48 28.23 1xa6 h GLN 456 CO -0.45 0.07 0.39 0.82 -1.93 0.00 0.00 178.83 177.73 1xa6 h ILE 457 N 0.10 1.01 -0.51 2.39 2.04 0.12 0.70 117.51 123.36 1xa6 h ILE 457 Ca 0.30 -0.25 -0.06 0.00 1.00 0.00 0.00 64.86 65.84 1xa6 h ILE 457 Cb 0.47 0.21 -0.02 0.00 -0.74 0.00 0.00 36.82 36.73 1xa6 h ILE 457 CO -0.50 0.14 0.08 -0.07 0.00 0.00 0.00 178.15 177.80 1xa6 h LEU 458 N 0.74 0.76 -0.60 1.44 3.38 0.11 -1.35 115.31 119.78 1xa6 h LEU 458 Ca 0.29 -0.15 -0.15 0.00 0.09 0.00 0.00 57.88 57.96 1xa6 h LEU 458 Cb 0.13 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 1xa6 h LEU 458 CO -0.15 0.77 -0.61 0.40 0.09 0.00 0.00 178.44 178.94 1xa6 h ILE 459 N 0.77 1.37 0.13 1.22 2.04 -0.13 -2.62 117.51 120.29 1xa6 h ILE 459 Ca 0.16 -1.96 -0.01 0.00 1.00 0.00 0.00 64.86 64.06 1xa6 h ILE 459 Cb 0.35 1.97 0.00 0.00 -0.74 0.00 0.00 36.82 38.40 1xa6 h ILE 459 CO 0.01 0.59 -0.06 -0.33 0.00 0.00 0.00 178.15 178.35 1xa6 h GLU 460 N 0.23 -0.17 -1.42 2.37 5.08 -0.43 -3.28 114.58 116.96 1xa6 h GLU 460 Ca -0.01 0.01 -0.09 0.00 -1.00 0.00 0.00 59.36 58.27 1xa6 h GLU 460 Cb 1.12 0.04 -0.05 0.00 0.50 0.00 0.00 28.75 30.37 1xa6 h GLU 460 CO 0.10 -0.11 0.12 0.09 -1.00 0.00 0.00 179.01 178.21 1xa6 n ASN 461 N -2.77 4.42 -0.09 1.42 4.13 -0.55 -4.60 115.26 117.22 1xa6 n ASN 461 Ca -0.02 -2.44 -0.07 0.00 1.68 0.00 0.00 54.58 53.72 1xa6 n ASN 461 Cb 0.07 -0.83 -0.05 0.00 -1.54 0.00 0.00 39.78 37.43 1xa6 n ASN 461 CO 0.00 0.00 0.00 -0.08 0.28 0.00 0.00 177.26 177.46 1xa6 h GLU 462 N 0.66 -0.18 -4.19 3.52 4.22 -1.52 -3.05 114.58 114.03 1xa6 h GLU 462 Ca 0.10 0.01 -0.72 0.00 0.08 0.00 0.00 59.36 58.83 1xa6 h GLU 462 Cb 1.13 0.04 -0.09 0.00 0.50 0.00 0.00 28.75 30.34 1xa6 h GLU 462 CO 0.21 -0.12 2.54 -3.47 -2.18 0.00 0.00 179.01 175.99 1xa6 n ASP 463 N -4.13 4.49 0.00 1.04 2.03 -1.26 -2.70 116.55 116.01 1xa6 n ASP 463 Ca -0.02 -2.94 0.00 0.00 0.52 0.00 0.00 54.79 52.35 1xa6 n ASP 463 Cb 0.18 -1.61 0.00 0.00 -0.72 0.00 0.00 41.12 38.96 1xa6 n ASP 463 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 1xa6 n VAL 464 N 4.75 0.00 -0.05 5.18 0.31 -1.15 -4.93 118.33 122.43 1xa6 n VAL 464 Ca 0.47 0.00 -0.09 0.00 -0.01 0.00 0.00 64.34 64.70 1xa6 n VAL 464 Cb 0.40 0.00 -0.15 0.00 -0.91 0.00 0.00 33.84 33.18 1xa6 n VAL 464 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1xa6 n LEU 465 N -0.71 0.57 0.00 7.52 4.77 -1.10 -5.14 117.00 122.90 1xa6 n LEU 465 Ca 0.00 0.23 0.00 0.00 -0.03 0.00 0.00 56.01 56.21 1xa6 n LEU 465 Cb 0.00 0.27 0.00 0.00 -2.33 0.00 0.00 43.42 41.36 1xa6 n LEU 465 CO 0.00 0.45 0.00 2.22 -1.33 0.00 0.00 177.39 178.73